NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
621839 | 5lw4 | 19984 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 HIS 1 H1 HIS 1 3.105 0.729 1.492 2 H2 HIS 1 H2 HIS 1 3.046 0.405 -0.091 3 H3 HIS 1 H3 HIS 1 1.682 0.708 0.723 4 HA HIS 1 HA HIS 1 2.351 2.913 1.079 5 HB2 HIS 1 HB2 HIS 1 4.724 2.125 -0.400 6 HB3 HIS 1 HB3 HIS 1 4.364 3.696 -0.135 7 HD1 HIS 1 HD1 HIS 1 6.047 0.841 1.393 8 HD2 HIS 1 HD2 HIS 1 4.552 4.454 2.629 9 HE1 HIS 1 HE1 HIS 1 6.973 1.366 3.647 10 HE2 HIS 1 HE2 HIS 1 6.088 3.531 4.400 11 H GLY 2 H GLY 2 0.988 4.174 -0.076 12 HA2 GLY 2 HA2 GLY 2 0.358 3.353 -2.742 13 HA3 GLY 2 HA3 GLY 2 -0.406 4.514 -1.883 14 H PHE 3 H PHE 3 -0.100 5.486 -4.255 15 HA PHE 3 HA PHE 3 2.004 7.314 -3.963 16 HB2 PHE 3 HB2 PHE 3 3.060 6.817 -6.114 17 HB3 PHE 3 HB3 PHE 3 3.192 5.557 -5.083 18 HD1 PHE 3 HD1 PHE 3 1.658 6.669 -8.116 19 HD2 PHE 3 HD2 PHE 3 2.022 3.469 -5.488 20 HE1 PHE 3 HE1 PHE 3 0.700 5.205 -9.773 21 HE2 PHE 3 HE2 PHE 3 1.075 1.986 -7.137 22 HZ PHE 3 HZ PHE 3 0.426 2.849 -9.291 23 H ILE 4 H ILE 4 2.183 8.980 -5.680 24 HA ILE 4 HA ILE 4 -0.453 9.752 -6.485 25 HB ILE 4 HB ILE 4 2.017 11.291 -6.699 26 HG12 ILE 4 HG12 ILE 4 -0.112 11.612 -4.784 27 HG13 ILE 4 HG13 ILE 4 1.300 10.865 -4.443 28 HG21 ILE 4 HG21 ILE 4 0.631 13.183 -7.225 29 HG22 ILE 4 HG22 ILE 4 -0.684 12.243 -7.197 30 HG23 ILE 4 HG23 ILE 4 0.433 12.037 -8.348 31 HD11 ILE 4 HD11 ILE 4 1.323 13.087 -3.580 32 HD12 ILE 4 HD12 ILE 4 1.060 13.681 -5.060 33 HD13 ILE 4 HD13 ILE 4 2.457 12.941 -4.723 34 H GLU 5 H GLU 5 -1.229 9.288 -8.480 35 HA GLU 5 HA GLU 5 0.566 8.170 -10.374 36 HB2 GLU 5 HB2 GLU 5 -1.654 7.245 -9.928 37 HB3 GLU 5 HB3 GLU 5 -2.305 8.588 -10.591 38 HG2 GLU 5 HG2 GLU 5 -1.174 7.915 -12.662 39 HG3 GLU 5 HG3 GLU 5 -0.962 6.464 -11.943 40 H LYS 6 H LYS 6 -1.465 10.953 -10.128 41 HA LYS 6 HA LYS 6 -0.146 12.213 -12.357 42 HB2 LYS 6 HB2 LYS 6 -3.012 11.782 -12.234 43 HB3 LYS 6 HB3 LYS 6 -2.360 12.891 -13.239 44 HG2 LYS 6 HG2 LYS 6 -1.313 11.244 -14.484 45 HG3 LYS 6 HG3 LYS 6 -1.720 10.096 -13.396 46 HD2 LYS 6 HD2 LYS 6 -4.016 10.399 -13.986 47 HD3 LYS 6 HD3 LYS 6 -3.556 11.468 -15.132 48 HE2 LYS 6 HE2 LYS 6 -2.502 9.838 -16.372 49 HE3 LYS 6 HE3 LYS 6 -2.515 8.783 -15.126 50 HZ1 LYS 6 HZ1 LYS 6 -4.124 8.155 -16.746 51 HZ2 LYS 6 HZ2 LYS 6 -4.853 9.591 -16.597 52 HZ3 LYS 6 HZ3 LYS 6 -4.866 8.546 -15.363 53 HA PRO 7 HA PRO 7 -0.838 14.447 -13.503 54 HB2 PRO 7 HB2 PRO 7 0.109 16.962 -13.450 55 HB3 PRO 7 HB3 PRO 7 -1.481 16.727 -13.160 56 HG2 PRO 7 HG2 PRO 7 0.616 17.014 -11.260 57 HG3 PRO 7 HG3 PRO 7 -0.826 17.780 -11.285 58 HD2 PRO 7 HD2 PRO 7 -0.468 15.697 -9.778 59 HD3 PRO 7 HD3 PRO 7 -1.926 15.988 -10.454 60 H GLY 8 H GLY 8 0.496 13.362 -14.571 61 HA2 GLY 8 HA2 GLY 8 2.523 13.070 -15.568 62 HA3 GLY 8 HA3 GLY 8 3.186 14.239 -14.640 63 H SER 9 H SER 9 4.253 11.606 -15.382 64 HA SER 9 HA SER 9 4.264 10.263 -12.868 65 HB2 SER 9 HB2 SER 9 4.092 8.832 -14.775 66 HB3 SER 9 HB3 SER 9 5.473 9.448 -15.393 67 HG SER 9 HG SER 9 5.192 7.460 -13.727 68 H ARG 10 H ARG 10 5.771 10.694 -11.323 69 HA ARG 10 HA ARG 10 7.917 12.332 -11.940 70 HB2 ARG 10 HB2 ARG 10 6.810 11.454 -9.638 71 HB3 ARG 10 HB3 ARG 10 8.378 11.006 -9.548 72 HG2 ARG 10 HG2 ARG 10 7.566 13.733 -10.040 73 HG3 ARG 10 HG3 ARG 10 7.933 13.177 -8.548 74 HD2 ARG 10 HD2 ARG 10 10.162 12.729 -9.261 75 HD3 ARG 10 HD3 ARG 10 9.796 13.277 -10.755 76 HE ARG 10 HE ARG 10 9.258 15.313 -8.971 77 HH11 ARG 10 HH11 ARG 10 10.658 17.006 -8.683 78 HH12 ARG 10 HH12 ARG 10 12.315 16.876 -9.172 79 HH21 ARG 10 HH21 ARG 10 12.055 13.651 -10.331 80 HH22 ARG 10 HH22 ARG 10 13.091 15.017 -10.085 81 H ALA 11 H ALA 11 7.565 8.992 -12.113 82 HA ALA 11 HA ALA 11 10.164 8.214 -11.770 83 HB1 ALA 11 HB1 ALA 11 8.325 6.617 -11.873 84 HB2 ALA 11 HB2 ALA 11 9.484 6.156 -12.902 85 HB3 ALA 11 HB3 ALA 11 8.162 6.904 -13.456 86 H ALA 12 H ALA 12 8.637 9.544 -14.556 87 HA ALA 12 HA ALA 12 10.610 8.929 -16.388 88 HB1 ALA 12 HB1 ALA 12 8.426 9.761 -17.075 89 HB2 ALA 12 HB2 ALA 12 9.572 10.677 -17.756 90 HB3 ALA 12 HB3 ALA 12 8.776 11.212 -16.454 91 H LEU 13 H LEU 13 10.435 11.326 -14.003 92 HA LEU 13 HA LEU 13 12.679 12.773 -15.012 93 HB2 LEU 13 HB2 LEU 13 11.156 13.324 -12.617 94 HB3 LEU 13 HB3 LEU 13 12.191 14.366 -13.331 95 HG LEU 13 HG LEU 13 9.658 13.584 -14.446 96 HD11 LEU 13 HD11 LEU 13 8.934 15.834 -13.879 97 HD12 LEU 13 HD12 LEU 13 10.367 16.116 -13.185 98 HD13 LEU 13 HD13 LEU 13 9.354 15.035 -12.537 99 HD21 LEU 13 HD21 LEU 13 9.990 15.280 -16.084 100 HD22 LEU 13 HD22 LEU 13 11.144 14.152 -16.191 101 HD23 LEU 13 HD23 LEU 13 11.464 15.573 -15.488 102 H CYS 14 H CYS 14 12.247 10.141 -13.232 103 HA CYS 14 HA CYS 14 14.231 10.647 -11.246 104 HB2 CYS 14 HB2 CYS 14 12.278 9.449 -10.698 105 HB3 CYS 14 HB3 CYS 14 12.678 8.303 -11.791 106 H SER 15 H SER 15 13.739 8.799 -14.101 107 HA SER 15 HA SER 15 15.945 7.201 -13.989 108 HB2 SER 15 HB2 SER 15 14.713 8.250 -16.427 109 HB3 SER 15 HB3 SER 15 15.588 6.872 -16.362 110 HG SER 15 HG SER 15 13.055 7.342 -15.490 111 H GLU 16 H GLU 16 18.087 7.279 -14.709 112 HA GLU 16 HA GLU 16 19.228 9.803 -14.795 113 HB2 GLU 16 HB2 GLU 16 21.285 8.694 -15.212 114 HB3 GLU 16 HB3 GLU 16 20.458 7.911 -14.043 115 HG2 GLU 16 HG2 GLU 16 19.802 6.265 -15.598 116 HG3 GLU 16 HG3 GLU 16 20.605 7.055 -16.780 117 H ALA 17 H ALA 17 17.733 7.989 -17.164 118 HA ALA 17 HA ALA 17 19.007 8.912 -19.403 119 HB1 ALA 17 HB1 ALA 17 17.391 7.091 -19.477 120 HB2 ALA 17 HB2 ALA 17 16.985 8.198 -20.583 121 HB3 ALA 17 HB3 ALA 17 16.193 8.135 -19.175 122 H PHE 18 H PHE 18 17.188 10.656 -17.237 123 HA PHE 18 HA PHE 18 16.298 12.595 -19.083 124 HB2 PHE 18 HB2 PHE 18 15.176 11.999 -16.923 125 HB3 PHE 18 HB3 PHE 18 16.304 12.932 -16.198 126 HD1 PHE 18 HD1 PHE 18 15.958 15.258 -15.949 127 HD2 PHE 18 HD2 PHE 18 13.616 13.089 -18.617 128 HE1 PHE 18 HE1 PHE 18 14.583 17.211 -16.318 129 HE2 PHE 18 HE2 PHE 18 12.249 15.042 -19.012 130 HZ PHE 18 HZ PHE 18 12.738 17.110 -17.877 131 H GLY 19 H GLY 19 19.283 12.048 -17.802 132 HA2 GLY 19 HA2 GLY 19 20.379 14.303 -18.847 133 HA3 GLY 19 HA3 GLY 19 20.068 14.667 -17.286 134 H PHE 20 H PHE 20 20.684 12.024 -16.354 135 HA PHE 20 HA PHE 20 22.324 10.900 -15.514 136 HB2 PHE 20 HB2 PHE 20 22.874 10.297 -17.783 137 HB3 PHE 20 HB3 PHE 20 23.926 11.544 -17.853 138 HD1 PHE 20 HD1 PHE 20 23.396 8.302 -16.387 139 HD2 PHE 20 HD2 PHE 20 26.170 11.340 -17.005 140 HE1 PHE 20 HE1 PHE 20 25.154 6.856 -15.588 141 HE2 PHE 20 HE2 PHE 20 27.938 9.905 -16.187 142 HZ PHE 20 HZ PHE 20 27.425 7.659 -15.476 143 H LEU 21 H LEU 21 24.106 13.586 -16.828 144 HA LEU 21 HA LEU 21 25.814 13.840 -14.623 145 HB2 LEU 21 HB2 LEU 21 25.106 15.826 -16.599 146 HB3 LEU 21 HB3 LEU 21 26.390 15.945 -15.596 147 HG LEU 21 HG LEU 21 26.180 13.927 -17.637 148 HD11 LEU 21 HD11 LEU 21 27.736 15.261 -18.912 149 HD12 LEU 21 HD12 LEU 21 27.674 16.413 -17.779 150 HD13 LEU 21 HD13 LEU 21 26.366 16.086 -18.671 151 HD21 LEU 21 HD21 LEU 21 28.515 13.552 -17.252 152 HD22 LEU 21 HD22 LEU 21 27.676 13.280 -15.897 153 HD23 LEU 21 HD23 LEU 21 28.503 14.659 -16.073 154 H ASN 22 H ASN 22 22.667 14.718 -15.329 155 HA ASN 22 HA ASN 22 22.381 16.102 -12.832 156 HB2 ASN 22 HB2 ASN 22 21.285 16.954 -15.377 157 HB3 ASN 22 HB3 ASN 22 20.706 17.540 -13.967 158 HD21 ASN 22 HD21 ASN 22 23.979 19.073 -15.596 159 HD22 ASN 22 HD22 ASN 22 23.089 17.772 -16.313 160 H LEU 23 H LEU 23 21.065 14.865 -11.566 161 HA LEU 23 HA LEU 23 18.563 14.004 -12.664 162 HB2 LEU 23 HB2 LEU 23 18.633 11.840 -12.113 163 HB3 LEU 23 HB3 LEU 23 20.020 12.125 -12.926 164 HG LEU 23 HG LEU 23 19.975 11.878 -10.070 165 HD11 LEU 23 HD11 LEU 23 20.652 9.578 -10.418 166 HD12 LEU 23 HD12 LEU 23 20.485 9.774 -12.014 167 HD13 LEU 23 HD13 LEU 23 19.185 9.820 -11.054 168 HD21 LEU 23 HD21 LEU 23 22.300 11.456 -10.244 169 HD22 LEU 23 HD22 LEU 23 21.947 12.912 -10.853 170 HD23 LEU 23 HD23 LEU 23 22.229 11.667 -11.846 171 H ASN 24 H ASN 24 16.978 13.539 -10.837 172 HA ASN 24 HA ASN 24 17.825 14.517 -8.303 173 HB2 ASN 24 HB2 ASN 24 17.244 16.520 -9.528 174 HB3 ASN 24 HB3 ASN 24 15.729 15.938 -9.709 175 HD21 ASN 24 HD21 ASN 24 15.420 18.279 -7.007 176 HD22 ASN 24 HD22 ASN 24 15.638 18.283 -8.726 177 H CYS 25 H CYS 25 17.317 12.294 -7.801 178 HA CYS 25 HA CYS 25 14.500 11.940 -7.354 179 HB2 CYS 25 HB2 CYS 25 15.350 10.749 -9.302 180 HB3 CYS 25 HB3 CYS 25 16.198 9.820 -8.261 181 H GLY 26 H GLY 26 17.248 9.834 -6.641 182 HA2 GLY 26 HA2 GLY 26 18.033 9.265 -4.582 183 HA3 GLY 26 HA3 GLY 26 17.119 10.429 -3.892 184 H SER 27 H SER 27 17.231 8.407 -2.283 185 HA SER 27 HA SER 27 15.508 6.331 -3.014 186 HB2 SER 27 HB2 SER 27 17.355 6.017 -1.413 187 HB3 SER 27 HB3 SER 27 16.503 6.876 -0.316 188 HG SER 27 HG SER 27 14.853 5.250 -0.593 189 H VAL 28 H VAL 28 14.907 9.322 -1.708 190 HA VAL 28 HA VAL 28 12.730 8.710 -0.086 191 HB VAL 28 HB VAL 28 14.041 10.853 -0.046 192 HG11 VAL 28 HG11 VAL 28 13.341 12.640 -1.472 193 HG12 VAL 28 HG12 VAL 28 12.337 11.637 -2.246 194 HG13 VAL 28 HG13 VAL 28 13.936 11.421 -2.352 195 HG21 VAL 28 HG21 VAL 28 12.241 12.217 0.738 196 HG22 VAL 28 HG22 VAL 28 12.111 10.718 1.332 197 HG23 VAL 28 HG23 VAL 28 11.174 11.184 0.099 198 H MET 29 H MET 29 12.992 8.611 -3.356 199 HA MET 29 HA MET 29 10.480 9.427 -4.072 200 HB2 MET 29 HB2 MET 29 10.969 8.383 -6.200 201 HB3 MET 29 HB3 MET 29 12.332 9.090 -5.644 202 HG2 MET 29 HG2 MET 29 13.219 7.217 -6.194 203 HG3 MET 29 HG3 MET 29 12.722 6.793 -4.697 204 HE1 MET 29 HE1 MET 29 11.939 3.417 -6.271 205 HE2 MET 29 HE2 MET 29 12.500 4.158 -4.948 206 HE3 MET 29 HE3 MET 29 13.288 4.305 -6.353 207 H TYR 30 H TYR 30 11.185 6.667 -2.396 208 HA TYR 30 HA TYR 30 9.329 5.027 -3.694 209 HB2 TYR 30 HB2 TYR 30 11.280 4.188 -2.476 210 HB3 TYR 30 HB3 TYR 30 10.514 4.560 -1.083 211 HD1 TYR 30 HD1 TYR 30 10.137 2.456 -4.028 212 HD2 TYR 30 HD2 TYR 30 9.133 2.929 -0.014 213 HE1 TYR 30 HE1 TYR 30 9.065 0.293 -4.039 214 HE2 TYR 30 HE2 TYR 30 8.083 0.745 -0.025 215 HH TYR 30 HH TYR 30 6.942 -0.782 -2.067 216 H GLU 31 H GLU 31 9.058 7.104 -0.975 217 HA GLU 31 HA GLU 31 6.309 6.511 -0.927 218 HB2 GLU 31 HB2 GLU 31 6.294 6.116 1.511 219 HB3 GLU 31 HB3 GLU 31 7.191 4.998 0.728 220 HG2 GLU 31 HG2 GLU 31 9.175 6.122 1.392 221 HG3 GLU 31 HG3 GLU 31 8.279 7.244 2.172 222 HA PRO 32 HA PRO 32 6.974 10.768 0.389 223 HB2 PRO 32 HB2 PRO 32 6.461 12.266 -1.754 224 HB3 PRO 32 HB3 PRO 32 7.975 11.689 -1.547 225 HG2 PRO 32 HG2 PRO 32 5.891 10.571 -3.152 226 HG3 PRO 32 HG3 PRO 32 7.439 10.858 -3.587 227 HD2 PRO 32 HD2 PRO 32 6.738 8.475 -2.840 228 HD3 PRO 32 HD3 PRO 32 8.218 9.041 -2.446 229 H GLN 33 H GLN 33 4.511 9.295 -1.436 230 HA GLN 33 HA GLN 33 2.556 11.082 -0.432 231 HB2 GLN 33 HB2 GLN 33 2.273 9.961 -2.564 232 HB3 GLN 33 HB3 GLN 33 2.120 8.545 -1.765 233 HG2 GLN 33 HG2 GLN 33 0.247 10.662 -1.244 234 HG3 GLN 33 HG3 GLN 33 0.018 9.689 -2.535 235 HE21 GLN 33 HE21 GLN 33 -1.584 8.574 0.779 236 HE22 GLN 33 HE22 GLN 33 -1.271 10.185 0.227 237 H SER 34 H SER 34 3.819 7.982 0.361 238 HA SER 34 HA SER 34 1.905 7.799 2.489 239 HB2 SER 34 HB2 SER 34 3.342 5.670 1.103 240 HB3 SER 34 HB3 SER 34 2.454 5.358 2.437 241 HG SER 34 HG SER 34 1.660 5.798 -0.074 242 H LEU 35 H LEU 35 3.481 9.391 3.494 243 HA LEU 35 HA LEU 35 5.677 8.148 4.809 244 HB2 LEU 35 HB2 LEU 35 4.910 10.680 4.443 245 HB3 LEU 35 HB3 LEU 35 4.839 10.436 6.056 246 HG LEU 35 HG LEU 35 7.145 9.824 6.025 247 HD11 LEU 35 HD11 LEU 35 8.484 10.277 4.097 248 HD12 LEU 35 HD12 LEU 35 7.153 10.639 3.253 249 HD13 LEU 35 HD13 LEU 35 7.397 9.126 3.768 250 HD21 LEU 35 HD21 LEU 35 7.950 12.108 5.740 251 HD22 LEU 35 HD22 LEU 35 6.540 12.118 6.533 252 HD23 LEU 35 HD23 LEU 35 6.586 12.486 4.959 253 H GLU 36 H GLU 36 5.457 6.835 6.599 254 HA GLU 36 HA GLU 36 2.815 6.484 7.547 255 HB2 GLU 36 HB2 GLU 36 5.237 5.041 8.232 256 HB3 GLU 36 HB3 GLU 36 3.761 4.598 8.772 257 HG2 GLU 36 HG2 GLU 36 3.086 4.269 6.489 258 HG3 GLU 36 HG3 GLU 36 4.624 4.573 6.031 259 H ALA 37 H ALA 37 1.890 7.155 9.434 260 HA ALA 37 HA ALA 37 3.669 8.333 11.395 261 HB1 ALA 37 HB1 ALA 37 2.354 10.054 10.398 262 HB2 ALA 37 HB2 ALA 37 1.914 9.887 11.945 263 HB3 ALA 37 HB3 ALA 37 0.995 9.261 10.771 264 H LYS 38 H LYS 38 2.901 8.181 13.676 265 HA LYS 38 HA LYS 38 1.210 5.884 14.121 266 HB2 LYS 38 HB2 LYS 38 3.537 5.187 13.939 267 HB3 LYS 38 HB3 LYS 38 3.863 6.118 15.241 268 HG2 LYS 38 HG2 LYS 38 2.448 4.690 16.554 269 HG3 LYS 38 HG3 LYS 38 2.272 3.722 15.251 270 HD2 LYS 38 HD2 LYS 38 4.876 4.262 16.362 271 HD3 LYS 38 HD3 LYS 38 3.973 3.013 16.905 272 HE2 LYS 38 HE2 LYS 38 5.346 2.012 15.379 273 HE3 LYS 38 HE3 LYS 38 3.970 2.233 14.528 274 HZ1 LYS 38 HZ1 LYS 38 5.848 2.818 13.210 275 HZ2 LYS 38 HZ2 LYS 38 6.302 3.911 14.311 276 HZ3 LYS 38 HZ3 LYS 38 4.939 4.130 13.469 277 H LYS 39 H LYS 39 0.047 5.863 16.041 278 HA LYS 39 HA LYS 39 -0.148 8.301 17.387 279 HB2 LYS 39 HB2 LYS 39 -1.135 5.701 18.190 280 HB3 LYS 39 HB3 LYS 39 -1.582 7.094 18.916 281 HG2 LYS 39 HG2 LYS 39 -2.096 6.730 16.139 282 HG3 LYS 39 HG3 LYS 39 -3.115 6.084 17.240 283 HD2 LYS 39 HD2 LYS 39 -3.542 8.263 18.097 284 HD3 LYS 39 HD3 LYS 39 -2.562 8.892 16.952 285 HE2 LYS 39 HE2 LYS 39 -3.991 8.230 15.242 286 HE3 LYS 39 HE3 LYS 39 -4.857 7.284 16.253 287 HZ1 LYS 39 HZ1 LYS 39 -6.083 9.185 15.664 288 HZ2 LYS 39 HZ2 LYS 39 -4.918 10.142 16.250 289 HZ3 LYS 39 HZ3 LYS 39 -5.776 9.205 17.251 290 H GLY 40 H GLY 40 0.745 9.013 19.380 291 HA2 GLY 40 HA2 GLY 40 1.989 8.783 21.256 292 HA3 GLY 40 HA3 GLY 40 1.950 7.158 21.092 293 H PHE 41 H PHE 41 4.046 6.934 21.878 294 HA PHE 41 HA PHE 41 6.122 7.919 20.147 295 HB2 PHE 41 HB2 PHE 41 6.103 7.177 22.901 296 HB3 PHE 41 HB3 PHE 41 7.518 7.056 22.095 297 HD1 PHE 41 HD1 PHE 41 8.862 8.976 21.650 298 HD2 PHE 41 HD2 PHE 41 5.006 9.430 23.138 299 HE1 PHE 41 HE1 PHE 41 9.289 11.324 22.019 300 HE2 PHE 41 HE2 PHE 41 5.421 11.778 23.503 301 HZ PHE 41 HZ PHE 41 7.566 12.729 22.941 302 HA PRO 42 HA PRO 42 8.444 7.315 19.837 303 HB2 PRO 42 HB2 PRO 42 9.999 6.218 17.994 304 HB3 PRO 42 HB3 PRO 42 10.050 5.586 19.500 305 HG2 PRO 42 HG2 PRO 42 8.551 4.651 17.264 306 HG3 PRO 42 HG3 PRO 42 9.499 3.778 18.267 307 HD2 PRO 42 HD2 PRO 42 6.894 3.870 18.636 308 HD3 PRO 42 HD3 PRO 42 7.905 3.720 19.910 309 H HIS 43 H HIS 43 8.810 9.077 18.517 310 HA HIS 43 HA HIS 43 6.848 9.468 16.590 311 HB2 HIS 43 HB2 HIS 43 9.179 10.984 17.286 312 HB3 HIS 43 HB3 HIS 43 8.352 11.405 15.942 313 HD1 HIS 43 HD1 HIS 43 6.012 12.527 16.170 314 HD2 HIS 43 HD2 HIS 43 7.903 11.647 19.702 315 HE1 HIS 43 HE1 HIS 43 4.813 13.679 18.018 316 HE2 HIS 43 HE2 HIS 43 5.929 13.161 20.154 317 H SER 44 H SER 44 10.226 8.812 16.418 318 HA SER 44 HA SER 44 11.521 7.958 14.937 319 HB2 SER 44 HB2 SER 44 9.658 6.203 14.820 320 HB3 SER 44 HB3 SER 44 9.434 6.761 13.302 321 HG SER 44 HG SER 44 10.809 4.938 13.457 322 H GLY 45 H GLY 45 8.929 9.376 13.100 323 HA2 GLY 45 HA2 GLY 45 10.718 10.090 10.987 324 HA3 GLY 45 HA3 GLY 45 9.098 10.302 10.996 325 HA PRO 46 HA PRO 46 10.856 14.389 11.766 326 HB2 PRO 46 HB2 PRO 46 9.183 15.840 10.269 327 HB3 PRO 46 HB3 PRO 46 10.401 15.041 9.529 328 HG2 PRO 46 HG2 PRO 46 7.702 14.168 9.862 329 HG3 PRO 46 HG3 PRO 46 8.568 14.216 8.479 330 HD2 PRO 46 HD2 PRO 46 8.406 11.988 9.770 331 HD3 PRO 46 HD3 PRO 46 9.827 12.392 9.073 332 H ALA 47 H ALA 47 9.931 16.506 12.545 333 HA ALA 47 HA ALA 47 8.480 15.820 14.808 334 HB1 ALA 47 HB1 ALA 47 10.082 17.667 14.827 335 HB2 ALA 47 HB2 ALA 47 8.648 18.218 15.333 336 HB3 ALA 47 HB3 ALA 47 9.137 18.505 13.818 337 H ASP 48 H ASP 48 6.422 15.151 14.690 338 HA ASP 48 HA ASP 48 4.532 17.047 13.674 339 HB2 ASP 48 HB2 ASP 48 4.901 15.437 11.901 340 HB3 ASP 48 HB3 ASP 48 4.281 14.290 12.884 341 H GLY 49 H GLY 49 2.166 16.128 14.258 342 HA2 GLY 49 HA2 GLY 49 0.843 15.420 15.990 343 HA3 GLY 49 HA3 GLY 49 2.137 14.813 16.780 344 H GLN 50 H GLN 50 2.637 17.872 15.613 345 HA GLN 50 HA GLN 50 2.230 19.035 18.215 346 HB2 GLN 50 HB2 GLN 50 4.569 19.372 16.523 347 HB3 GLN 50 HB3 GLN 50 4.354 20.198 17.915 348 HG2 GLN 50 HG2 GLN 50 4.472 18.141 19.114 349 HG3 GLN 50 HG3 GLN 50 4.784 17.368 17.709 350 HE21 GLN 50 HE21 GLN 50 8.176 17.851 17.842 351 HE22 GLN 50 HE22 GLN 50 6.836 16.903 17.288 352 H ILE 51 H ILE 51 0.466 19.271 16.041 353 HA ILE 51 HA ILE 51 0.941 21.629 14.680 354 HB ILE 51 HB ILE 51 -1.655 20.339 15.087 355 HG12 ILE 51 HG12 ILE 51 0.036 20.091 12.749 356 HG13 ILE 51 HG13 ILE 51 0.034 18.983 13.949 357 HG21 ILE 51 HG21 ILE 51 -2.455 21.574 13.154 358 HG22 ILE 51 HG22 ILE 51 -1.034 22.339 13.049 359 HG23 ILE 51 HG23 ILE 51 -2.005 22.608 14.314 360 HD11 ILE 51 HD11 ILE 51 -1.303 18.209 12.122 361 HD12 ILE 51 HD12 ILE 51 -2.241 19.522 12.232 362 HD13 ILE 51 HD13 ILE 51 -2.242 18.425 13.421 363 H ALA 52 H ALA 52 -0.873 20.930 17.571 364 HA ALA 52 HA ALA 52 -1.977 23.443 17.866 365 HB1 ALA 52 HB1 ALA 52 -2.813 21.497 19.072 366 HB2 ALA 52 HB2 ALA 52 -2.539 22.700 20.117 367 HB3 ALA 52 HB3 ALA 52 -1.477 21.488 19.982 368 H SER 53 H SER 53 1.023 22.202 18.960 369 HA SER 53 HA SER 53 1.652 24.587 20.378 370 HB2 SER 53 HB2 SER 53 3.758 23.343 20.857 371 HB3 SER 53 HB3 SER 53 2.422 22.547 21.354 372 HG SER 53 HG SER 53 3.322 21.012 20.263 373 H ALA 54 H ALA 54 1.677 23.697 17.323 374 HA ALA 54 HA ALA 54 2.728 24.202 15.505 375 HB1 ALA 54 HB1 ALA 54 2.132 26.484 16.084 376 HB2 ALA 54 HB2 ALA 54 3.459 26.476 15.160 377 HB3 ALA 54 HB3 ALA 54 3.587 26.687 16.758 378 H GLY 55 H GLY 55 4.396 22.846 17.584 379 HA2 GLY 55 HA2 GLY 55 7.053 23.457 17.020 380 HA3 GLY 55 HA3 GLY 55 6.515 22.025 17.594 381 H GLY 56 H GLY 56 4.720 21.415 15.495 382 HA2 GLY 56 HA2 GLY 56 6.553 20.400 13.595 383 HA3 GLY 56 HA3 GLY 56 4.937 20.167 13.598 384 H LEU 57 H LEU 57 4.182 22.926 13.668 385 HA LEU 57 HA LEU 57 4.171 23.396 10.947 386 HB2 LEU 57 HB2 LEU 57 3.500 25.222 13.087 387 HB3 LEU 57 HB3 LEU 57 3.182 25.551 11.519 388 HG LEU 57 HG LEU 57 1.957 23.401 12.984 389 HD11 LEU 57 HD11 LEU 57 -0.027 24.799 12.981 390 HD12 LEU 57 HD12 LEU 57 0.808 25.978 12.254 391 HD13 LEU 57 HD13 LEU 57 1.171 25.546 13.770 392 HD21 LEU 57 HD21 LEU 57 0.472 23.188 11.119 393 HD22 LEU 57 HD22 LEU 57 1.996 22.921 10.651 394 HD23 LEU 57 HD23 LEU 57 1.289 24.339 10.330 395 H PHE 58 H PHE 58 5.948 25.008 13.499 396 HA PHE 58 HA PHE 58 7.337 26.664 11.712 397 HB2 PHE 58 HB2 PHE 58 8.009 26.067 14.451 398 HB3 PHE 58 HB3 PHE 58 8.653 27.296 13.590 399 HD1 PHE 58 HD1 PHE 58 7.093 27.383 16.244 400 HD2 PHE 58 HD2 PHE 58 6.014 28.213 12.305 401 HE1 PHE 58 HE1 PHE 58 5.347 28.849 17.038 402 HE2 PHE 58 HE2 PHE 58 4.237 29.647 13.087 403 HZ PHE 58 HZ PHE 58 3.900 29.975 15.451 404 H GLY 59 H GLY 59 7.754 23.493 12.854 405 HA2 GLY 59 HA2 GLY 59 10.432 23.155 12.172 406 HA3 GLY 59 HA3 GLY 59 9.332 21.961 12.348 407 H GLY 60 H GLY 60 7.624 23.341 10.242 408 HA2 GLY 60 HA2 GLY 60 8.525 21.911 8.042 409 HA3 GLY 60 HA3 GLY 60 7.368 23.064 8.018 410 H ILE 61 H ILE 61 9.338 25.014 9.161 411 HA ILE 61 HA ILE 61 10.314 26.018 6.756 412 HB ILE 61 HB ILE 61 11.130 26.786 9.457 413 HG12 ILE 61 HG12 ILE 61 8.819 27.130 9.182 414 HG13 ILE 61 HG13 ILE 61 9.580 28.568 9.315 415 HG21 ILE 61 HG21 ILE 61 11.943 28.858 8.526 416 HG22 ILE 61 HG22 ILE 61 11.586 28.333 7.039 417 HG23 ILE 61 HG23 ILE 61 12.751 27.608 7.894 418 HD11 ILE 61 HD11 ILE 61 7.877 28.698 7.629 419 HD12 ILE 61 HD12 ILE 61 8.571 27.488 6.811 420 HD13 ILE 61 HD13 ILE 61 9.325 28.913 6.943 421 H LEU 62 H LEU 62 11.676 24.186 9.349 422 HA LEU 62 HA LEU 62 14.273 24.183 8.297 423 HB2 LEU 62 HB2 LEU 62 13.047 22.796 10.485 424 HB3 LEU 62 HB3 LEU 62 14.543 22.340 10.012 425 HG LEU 62 HG LEU 62 15.287 24.582 10.539 426 HD11 LEU 62 HD11 LEU 62 13.998 25.939 12.016 427 HD12 LEU 62 HD12 LEU 62 12.748 24.924 11.864 428 HD13 LEU 62 HD13 LEU 62 13.252 25.782 10.590 429 HD21 LEU 62 HD21 LEU 62 15.402 24.094 12.935 430 HD22 LEU 62 HD22 LEU 62 15.679 22.748 12.082 431 HD23 LEU 62 HD23 LEU 62 14.230 22.994 12.756 432 H ASP 63 H ASP 63 11.512 22.206 7.959 433 HA ASP 63 HA ASP 63 12.787 19.929 7.020 434 HB2 ASP 63 HB2 ASP 63 10.445 20.045 7.731 435 HB3 ASP 63 HB3 ASP 63 10.109 20.663 6.257 436 H GLN 64 H GLN 64 11.876 22.873 5.552 437 HA GLN 64 HA GLN 64 12.352 22.061 2.925 438 HB2 GLN 64 HB2 GLN 64 12.185 24.702 4.084 439 HB3 GLN 64 HB3 GLN 64 12.416 24.496 2.481 440 HG2 GLN 64 HG2 GLN 64 10.333 23.578 2.207 441 HG3 GLN 64 HG3 GLN 64 10.130 23.396 3.817 442 HE21 GLN 64 HE21 GLN 64 8.489 26.353 4.262 443 HE22 GLN 64 HE22 GLN 64 8.829 24.746 4.813 444 H GLN 65 H GLN 65 14.453 22.195 5.324 445 HA GLN 65 HA GLN 65 16.660 22.579 3.525 446 HB2 GLN 65 HB2 GLN 65 16.753 23.281 6.336 447 HB3 GLN 65 HB3 GLN 65 17.967 23.526 5.272 448 HG2 GLN 65 HG2 GLN 65 15.472 24.960 5.302 449 HG3 GLN 65 HG3 GLN 65 16.918 25.570 5.753 450 HE21 GLN 65 HE21 GLN 65 15.870 26.512 2.250 451 HE22 GLN 65 HE22 GLN 65 14.934 26.361 3.700 452 H SER 66 H SER 66 15.091 20.261 4.519 453 HA SER 66 HA SER 66 16.863 18.912 6.271 454 HB2 SER 66 HB2 SER 66 14.463 18.689 6.599 455 HB3 SER 66 HB3 SER 66 14.332 17.983 5.132 456 HG SER 66 HG SER 66 15.129 16.936 7.473 457 H GLU 67 H GLU 67 17.769 16.803 5.994 458 HA GLU 67 HA GLU 67 18.808 16.290 3.468 459 HB2 GLU 67 HB2 GLU 67 19.750 15.509 5.576 460 HB3 GLU 67 HB3 GLU 67 18.558 14.395 5.642 461 HG2 GLU 67 HG2 GLU 67 19.430 13.305 3.769 462 HG3 GLU 67 HG3 GLU 67 20.577 14.456 3.606 463 H ASN 68 H ASN 68 15.979 15.310 5.106 464 HA ASN 68 HA ASN 68 15.298 13.348 3.185 465 HB2 ASN 68 HB2 ASN 68 13.898 14.258 5.576 466 HB3 ASN 68 HB3 ASN 68 13.303 13.055 4.646 467 HD21 ASN 68 HD21 ASN 68 15.464 11.979 7.603 468 HD22 ASN 68 HD22 ASN 68 14.432 13.364 7.471 469 H ARG 69 H ARG 69 15.101 16.507 3.034 470 HA ARG 69 HA ARG 69 12.512 17.150 2.363 471 HB2 ARG 69 HB2 ARG 69 14.172 18.787 2.663 472 HB3 ARG 69 HB3 ARG 69 14.972 18.249 1.345 473 HG2 ARG 69 HG2 ARG 69 13.127 19.019 -0.013 474 HG3 ARG 69 HG3 ARG 69 12.474 19.684 1.328 475 HD2 ARG 69 HD2 ARG 69 13.704 21.335 0.182 476 HD3 ARG 69 HD3 ARG 69 14.452 21.009 1.597 477 HE ARG 69 HE ARG 69 15.446 19.472 -0.569 478 HH11 ARG 69 HH11 ARG 69 15.881 22.531 1.147 479 HH12 ARG 69 HH12 ARG 69 17.514 22.695 0.592 480 HH21 ARG 69 HH21 ARG 69 17.544 19.762 -1.198 481 HH22 ARG 69 HH22 ARG 69 18.430 21.165 -0.702 482 H TRP 70 H TRP 70 11.206 16.922 0.567 483 HA TRP 70 HA TRP 70 12.155 14.943 -1.247 484 HB2 TRP 70 HB2 TRP 70 10.033 14.343 -1.295 485 HB3 TRP 70 HB3 TRP 70 9.731 15.531 -0.217 486 HD1 TRP 70 HD1 TRP 70 9.306 18.027 -1.598 487 HE1 TRP 70 HE1 TRP 70 7.764 18.511 -3.505 488 HE3 TRP 70 HE3 TRP 70 8.756 13.318 -3.191 489 HZ2 TRP 70 HZ2 TRP 70 6.524 16.968 -5.494 490 HZ3 TRP 70 HZ3 TRP 70 7.305 12.890 -5.088 491 HH2 TRP 70 HH2 TRP 70 6.226 14.713 -6.243 492 H PHE 71 H PHE 71 11.651 15.104 -3.632 493 HA PHE 71 HA PHE 71 12.967 17.437 -4.524 494 HB2 PHE 71 HB2 PHE 71 12.486 16.213 -6.744 495 HB3 PHE 71 HB3 PHE 71 13.672 15.688 -5.752 496 HD1 PHE 71 HD1 PHE 71 13.572 13.517 -4.744 497 HD2 PHE 71 HD2 PHE 71 10.263 15.007 -6.766 498 HE1 PHE 71 HE1 PHE 71 12.498 11.355 -4.602 499 HE2 PHE 71 HE2 PHE 71 9.201 12.859 -6.625 500 HZ PHE 71 HZ PHE 71 10.314 11.036 -5.556 501 H LYS 72 H LYS 72 11.879 19.389 -4.691 502 HA LYS 72 HA LYS 72 9.122 19.329 -4.954 503 HB2 LYS 72 HB2 LYS 72 9.097 21.621 -4.904 504 HB3 LYS 72 HB3 LYS 72 10.371 21.186 -3.979 505 HG2 LYS 72 HG2 LYS 72 11.864 21.820 -5.679 506 HG3 LYS 72 HG3 LYS 72 10.618 22.164 -6.678 507 HD2 LYS 72 HD2 LYS 72 9.889 23.819 -5.024 508 HD3 LYS 72 HD3 LYS 72 11.315 23.581 -4.263 509 HE2 LYS 72 HE2 LYS 72 11.123 24.530 -6.975 510 HE3 LYS 72 HE3 LYS 72 11.313 25.525 -5.694 511 HZ1 LYS 72 HZ1 LYS 72 13.380 25.172 -6.768 512 HZ2 LYS 72 HZ2 LYS 72 13.245 23.577 -6.540 513 HZ3 LYS 72 HZ3 LYS 72 13.434 24.562 -5.272 514 H HIS 73 H HIS 73 7.659 19.930 -6.577 515 HA HIS 73 HA HIS 73 8.794 19.604 -9.209 516 HB2 HIS 73 HB2 HIS 73 7.533 17.669 -8.613 517 HB3 HIS 73 HB3 HIS 73 6.232 18.600 -8.283 518 HD1 HIS 73 HD1 HIS 73 8.392 17.924 -11.313 519 HD2 HIS 73 HD2 HIS 73 4.462 18.565 -10.321 520 HE1 HIS 73 HE1 HIS 73 7.020 17.825 -13.389 521 HE2 HIS 73 HE2 HIS 73 4.649 18.173 -12.807 522 H ILE 74 H ILE 74 8.423 21.061 -10.753 523 HA ILE 74 HA ILE 74 6.865 23.289 -10.009 524 HB ILE 74 HB ILE 74 8.384 22.933 -12.506 525 HG12 ILE 74 HG12 ILE 74 9.312 24.407 -10.209 526 HG13 ILE 74 HG13 ILE 74 9.764 22.867 -10.509 527 HG21 ILE 74 HG21 ILE 74 8.251 25.353 -12.771 528 HG22 ILE 74 HG22 ILE 74 7.361 25.457 -11.425 529 HG23 ILE 74 HG23 ILE 74 6.759 24.731 -12.738 530 HD11 ILE 74 HD11 ILE 74 11.474 24.376 -11.233 531 HD12 ILE 74 HD12 ILE 74 10.425 25.117 -12.215 532 HD13 ILE 74 HD13 ILE 74 10.873 23.592 -12.513 533 H MET 75 H MET 75 4.846 23.881 -10.756 534 HA MET 75 HA MET 75 3.833 22.506 -13.082 535 HB2 MET 75 HB2 MET 75 2.388 22.929 -10.633 536 HB3 MET 75 HB3 MET 75 1.629 22.553 -12.029 537 HG2 MET 75 HG2 MET 75 2.649 20.528 -12.120 538 HG3 MET 75 HG3 MET 75 3.617 20.908 -10.861 539 HE1 MET 75 HE1 MET 75 -0.873 20.366 -10.279 540 HE2 MET 75 HE2 MET 75 -0.189 20.320 -11.744 541 HE3 MET 75 HE3 MET 75 -0.196 21.698 -10.898 542 H THR 76 H THR 76 2.640 23.828 -14.503 543 HA THR 76 HA THR 76 2.880 26.621 -14.031 544 HB THR 76 HB THR 76 1.997 26.720 -16.399 545 HG1 THR 76 HG1 THR 76 0.937 24.890 -16.665 546 HG21 THR 76 HG21 THR 76 4.044 25.957 -17.381 547 HG22 THR 76 HG22 THR 76 4.412 25.149 -16.030 548 HG23 THR 76 HG23 THR 76 4.394 26.765 -16.025 549 H GLY 77 H GLY 77 0.923 28.018 -14.879 550 HA2 GLY 77 HA2 GLY 77 -1.177 27.564 -13.158 551 HA3 GLY 77 HA3 GLY 77 -1.147 28.672 -14.357 552 H GLY 78 H GLY 78 -3.543 28.035 -14.030 553 HA2 GLY 78 HA2 GLY 78 -5.194 27.294 -15.488 554 HA3 GLY 78 HA3 GLY 78 -4.167 26.220 -16.166 555 H GLU 79 H GLU 79 -6.444 25.010 -15.771 556 HA GLU 79 HA GLU 79 -6.650 24.022 -13.130 557 HB2 GLU 79 HB2 GLU 79 -8.581 23.179 -13.713 558 HB3 GLU 79 HB3 GLU 79 -8.409 24.181 -14.991 559 HG2 GLU 79 HG2 GLU 79 -9.107 22.206 -15.944 560 HG3 GLU 79 HG3 GLU 79 -7.495 22.201 -16.209 561 H HIS 80 H HIS 80 -6.051 21.966 -12.292 562 HA HIS 80 HA HIS 80 -4.779 20.187 -14.152 563 HB2 HIS 80 HB2 HIS 80 -3.475 21.051 -11.734 564 HB3 HIS 80 HB3 HIS 80 -2.947 19.797 -12.637 565 HD1 HIS 80 HD1 HIS 80 -1.569 20.272 -14.798 566 HD2 HIS 80 HD2 HIS 80 -3.034 23.599 -12.902 567 HE1 HIS 80 HE1 HIS 80 -0.527 22.296 -15.806 568 HE2 HIS 80 HE2 HIS 80 -1.417 24.300 -14.698 569 H THR 81 H THR 81 -4.722 17.953 -13.460 570 HA THR 81 HA THR 81 -6.692 17.484 -11.419 571 HB THR 81 HB THR 81 -6.240 15.796 -13.759 572 HG1 THR 81 HG1 THR 81 -7.244 17.952 -14.033 573 HG21 THR 81 HG21 THR 81 -8.287 14.700 -13.141 574 HG22 THR 81 HG22 THR 81 -8.437 15.670 -11.857 575 HG23 THR 81 HG23 THR 81 -7.245 14.579 -11.911 576 H PHE 82 H PHE 82 -6.166 16.306 -9.684 577 HA PHE 82 HA PHE 82 -3.654 14.919 -9.748 578 HB2 PHE 82 HB2 PHE 82 -5.207 15.962 -7.539 579 HB3 PHE 82 HB3 PHE 82 -3.937 14.970 -7.272 580 HD1 PHE 82 HD1 PHE 82 -1.717 15.804 -7.201 581 HD2 PHE 82 HD2 PHE 82 -4.802 18.234 -8.586 582 HE1 PHE 82 HE1 PHE 82 -0.220 17.699 -7.194 583 HE2 PHE 82 HE2 PHE 82 -3.318 20.133 -8.572 584 HZ PHE 82 HZ PHE 82 -1.028 19.871 -7.857 585 H THR 83 H THR 83 -3.484 12.728 -9.443 586 HA THR 83 HA THR 83 -5.880 11.327 -8.654 587 HB THR 83 HB THR 83 -4.163 10.416 -10.827 588 HG1 THR 83 HG1 THR 83 -5.377 11.480 -12.114 589 HG21 THR 83 HG21 THR 83 -5.772 8.695 -11.183 590 HG22 THR 83 HG22 THR 83 -6.643 9.223 -9.927 591 HG23 THR 83 HG23 THR 83 -5.188 8.562 -9.681 592 H TRP 84 H TRP 84 -5.547 9.888 -7.008 593 HA TRP 84 HA TRP 84 -2.813 9.131 -6.454 594 HB2 TRP 84 HB2 TRP 84 -4.926 9.658 -4.556 595 HB3 TRP 84 HB3 TRP 84 -3.526 8.939 -4.119 596 HD1 TRP 84 HD1 TRP 84 -3.017 11.804 -6.334 597 HE1 TRP 84 HE1 TRP 84 -2.120 13.824 -5.148 598 HE3 TRP 84 HE3 TRP 84 -3.652 10.119 -1.673 599 HZ2 TRP 84 HZ2 TRP 84 -1.710 14.502 -2.449 600 HZ3 TRP 84 HZ3 TRP 84 -2.986 11.531 0.181 601 HH2 TRP 84 HH2 TRP 84 -1.996 13.691 -0.223 602 H THR 85 H THR 85 -2.527 6.877 -5.726 603 HA THR 85 HA THR 85 -4.925 5.318 -5.610 604 HB THR 85 HB THR 85 -4.196 5.022 -7.902 605 HG1 THR 85 HG1 THR 85 -5.326 3.346 -7.067 606 HG21 THR 85 HG21 THR 85 -2.179 3.841 -8.355 607 HG22 THR 85 HG22 THR 85 -1.824 3.802 -6.778 608 HG23 THR 85 HG23 THR 85 -1.818 5.210 -7.574 609 H TYR 86 H TYR 86 -4.673 3.290 -4.422 610 HA TYR 86 HA TYR 86 -2.347 3.403 -2.747 611 HB2 TYR 86 HB2 TYR 86 -5.006 2.625 -1.885 612 HB3 TYR 86 HB3 TYR 86 -3.709 2.713 -0.897 613 HD1 TYR 86 HD1 TYR 86 -6.563 4.230 -1.153 614 HD2 TYR 86 HD2 TYR 86 -2.552 5.322 -1.467 615 HE1 TYR 86 HE1 TYR 86 -7.138 6.505 -0.587 616 HE2 TYR 86 HE2 TYR 86 -3.150 7.605 -0.927 617 HH TYR 86 HH TYR 86 -4.750 9.050 -0.276 618 H THR 87 H THR 87 -1.231 1.521 -2.249 619 HA THR 87 HA THR 87 -2.072 -0.749 -3.741 620 HB THR 87 HB THR 87 0.142 -1.667 -3.204 621 HG1 THR 87 HG1 THR 87 -0.090 -0.261 -1.124 622 HG21 THR 87 HG21 THR 87 1.498 -0.001 -4.259 623 HG22 THR 87 HG22 THR 87 0.354 1.114 -4.011 624 HG23 THR 87 HG23 THR 87 0.090 -0.097 -5.049 625 H ALA 88 H ALA 88 -2.777 0.364 -0.843 626 HA ALA 88 HA ALA 88 -2.453 -2.043 0.641 627 HB1 ALA 88 HB1 ALA 88 -1.983 0.036 1.793 628 HB2 ALA 88 HB2 ALA 88 -3.217 -0.696 2.539 629 HB3 ALA 88 HB3 ALA 88 -3.498 0.539 1.535 630 HA PRO 89 HA PRO 89 -6.676 -3.001 -0.174 631 HB2 PRO 89 HB2 PRO 89 -6.915 -5.381 0.968 632 HB3 PRO 89 HB3 PRO 89 -5.945 -5.276 -0.342 633 HG2 PRO 89 HG2 PRO 89 -5.188 -5.190 2.400 634 HG3 PRO 89 HG3 PRO 89 -4.544 -6.108 1.213 635 HD2 PRO 89 HD2 PRO 89 -3.414 -3.836 1.909 636 HD3 PRO 89 HD3 PRO 89 -3.330 -4.367 0.366 637 H HIS 90 H HIS 90 -5.428 -2.012 2.578 638 HA HIS 90 HA HIS 90 -7.531 -2.565 4.305 639 HB2 HIS 90 HB2 HIS 90 -5.285 -0.761 4.517 640 HB3 HIS 90 HB3 HIS 90 -6.398 -0.821 5.711 641 HD1 HIS 90 HD1 HIS 90 -3.177 -1.926 5.307 642 HD2 HIS 90 HD2 HIS 90 -6.635 -3.844 6.377 643 HE1 HIS 90 HE1 HIS 90 -2.581 -4.042 6.482 644 HE2 HIS 90 HE2 HIS 90 -4.655 -5.209 7.139 645 H ASN 91 H ASN 91 -9.098 -1.200 5.274 646 HA ASN 91 HA ASN 91 -10.325 0.416 3.388 647 HB2 ASN 91 HB2 ASN 91 -10.909 0.043 6.212 648 HB3 ASN 91 HB3 ASN 91 -11.899 0.909 5.243 649 HD21 ASN 91 HD21 ASN 91 -12.349 -2.974 5.507 650 HD22 ASN 91 HD22 ASN 91 -11.386 -2.009 6.574 651 H THR 92 H THR 92 -10.985 2.652 3.492 652 HA THR 92 HA THR 92 -9.131 4.320 4.966 653 HB THR 92 HB THR 92 -10.168 4.796 2.271 654 HG1 THR 92 HG1 THR 92 -8.432 3.363 2.348 655 HG21 THR 92 HG21 THR 92 -8.906 6.823 2.219 656 HG22 THR 92 HG22 THR 92 -8.438 6.593 3.750 657 HG23 THR 92 HG23 THR 92 -9.988 6.913 3.418 658 H SER 93 H SER 93 -10.079 5.821 6.329 659 HA SER 93 HA SER 93 -12.925 5.906 6.278 660 HB2 SER 93 HB2 SER 93 -12.473 7.279 8.403 661 HB3 SER 93 HB3 SER 93 -12.083 5.694 8.467 662 HG SER 93 HG SER 93 -10.016 6.109 8.307 663 H GLN 94 H GLN 94 -10.272 8.127 5.990 664 HA GLN 94 HA GLN 94 -11.835 10.023 4.595 665 HB2 GLN 94 HB2 GLN 94 -12.421 10.503 6.907 666 HB3 GLN 94 HB3 GLN 94 -10.838 10.732 7.239 667 HG2 GLN 94 HG2 GLN 94 -10.794 12.727 6.161 668 HG3 GLN 94 HG3 GLN 94 -12.205 12.430 5.393 669 HE21 GLN 94 HE21 GLN 94 -12.232 13.812 9.178 670 HE22 GLN 94 HE22 GLN 94 -10.818 13.075 8.502 671 H TRP 95 H TRP 95 -10.575 11.633 3.469 672 HA TRP 95 HA TRP 95 -7.866 11.860 4.339 673 HB2 TRP 95 HB2 TRP 95 -6.849 11.522 2.265 674 HB3 TRP 95 HB3 TRP 95 -7.639 10.171 2.733 675 HD1 TRP 95 HD1 TRP 95 -10.243 10.064 1.497 676 HE1 TRP 95 HE1 TRP 95 -10.798 10.265 -0.938 677 HE3 TRP 95 HE3 TRP 95 -6.058 12.438 0.106 678 HZ2 TRP 95 HZ2 TRP 95 -9.489 11.380 -3.171 679 HZ3 TRP 95 HZ3 TRP 95 -5.771 13.010 -2.222 680 HH2 TRP 95 HH2 TRP 95 -7.483 12.497 -3.837 681 H HIS 96 H HIS 96 -6.852 13.862 3.881 682 HA HIS 96 HA HIS 96 -8.408 15.823 2.530 683 HB2 HIS 96 HB2 HIS 96 -8.579 17.261 4.514 684 HB3 HIS 96 HB3 HIS 96 -9.551 15.950 4.560 685 HD1 HIS 96 HD1 HIS 96 -6.892 17.626 6.395 686 HD2 HIS 96 HD2 HIS 96 -8.648 13.919 6.387 687 HE1 HIS 96 HE1 HIS 96 -6.267 16.444 8.497 688 HE2 HIS 96 HE2 HIS 96 -7.311 14.212 8.510 689 H TYR 97 H TYR 97 -7.356 17.948 2.320 690 HA TYR 97 HA TYR 97 -4.613 17.907 2.955 691 HB2 TYR 97 HB2 TYR 97 -4.097 18.328 0.475 692 HB3 TYR 97 HB3 TYR 97 -4.285 16.785 0.976 693 HD1 TYR 97 HD1 TYR 97 -6.171 15.429 0.204 694 HD2 TYR 97 HD2 TYR 97 -5.870 19.441 -0.837 695 HE1 TYR 97 HE1 TYR 97 -7.984 15.154 -1.389 696 HE2 TYR 97 HE2 TYR 97 -7.687 19.173 -2.411 697 HH TYR 97 HH TYR 97 -8.660 16.969 -3.809 698 H TYR 98 H TYR 98 -3.375 19.796 2.560 699 HA TYR 98 HA TYR 98 -4.964 22.194 2.389 700 HB2 TYR 98 HB2 TYR 98 -2.842 21.850 4.340 701 HB3 TYR 98 HB3 TYR 98 -3.907 23.088 4.297 702 HD1 TYR 98 HD1 TYR 98 -3.572 19.595 5.183 703 HD2 TYR 98 HD2 TYR 98 -6.002 22.964 5.478 704 HE1 TYR 98 HE1 TYR 98 -4.934 18.464 6.813 705 HE2 TYR 98 HE2 TYR 98 -7.354 21.824 7.120 706 HH TYR 98 HH TYR 98 -7.911 19.281 7.660 707 H ILE 99 H ILE 99 -3.497 24.188 1.956 708 HA ILE 99 HA ILE 99 -0.866 23.398 1.173 709 HB ILE 99 HB ILE 99 -0.838 24.997 -0.700 710 HG12 ILE 99 HG12 ILE 99 -3.651 25.335 -0.247 711 HG13 ILE 99 HG13 ILE 99 -2.531 26.449 0.169 712 HG21 ILE 99 HG21 ILE 99 -2.160 23.679 -2.199 713 HG22 ILE 99 HG22 ILE 99 -2.900 22.977 -0.944 714 HG23 ILE 99 HG23 ILE 99 -1.326 22.712 -1.206 715 HD11 ILE 99 HD11 ILE 99 -3.572 27.067 -1.890 716 HD12 ILE 99 HD12 ILE 99 -3.112 25.669 -2.560 717 HD13 ILE 99 HD13 ILE 99 -2.003 26.772 -2.148 718 H THR 100 H THR 100 0.844 25.036 1.474 719 HA THR 100 HA THR 100 0.054 26.833 3.485 720 HB THR 100 HB THR 100 2.521 27.310 3.749 721 HG1 THR 100 HG1 THR 100 3.942 26.107 2.561 722 HG21 THR 100 HG21 THR 100 3.097 25.177 4.609 723 HG22 THR 100 HG22 THR 100 1.861 24.501 3.816 724 HG23 THR 100 HG23 THR 100 1.577 25.518 5.041 725 H LYS 101 H LYS 101 0.226 29.125 3.528 726 HA LYS 101 HA LYS 101 0.969 30.319 1.009 727 HB2 LYS 101 HB2 LYS 101 -0.490 32.175 1.597 728 HB3 LYS 101 HB3 LYS 101 -1.274 30.775 1.291 729 HG2 LYS 101 HG2 LYS 101 -1.534 30.443 3.653 730 HG3 LYS 101 HG3 LYS 101 -0.834 31.895 3.910 731 HD2 LYS 101 HD2 LYS 101 -2.605 32.914 2.654 732 HD3 LYS 101 HD3 LYS 101 -3.330 31.453 2.560 733 HE2 LYS 101 HE2 LYS 101 -3.481 31.390 4.937 734 HE3 LYS 101 HE3 LYS 101 -2.792 32.869 5.010 735 HZ1 LYS 101 HZ1 LYS 101 -5.128 33.044 5.262 736 HZ2 LYS 101 HZ2 LYS 101 -5.349 32.325 3.830 737 HZ3 LYS 101 HZ3 LYS 101 -4.667 33.789 3.903 738 H LYS 102 H LYS 102 2.954 31.209 1.054 739 HA LYS 102 HA LYS 102 4.084 32.174 3.475 740 HB2 LYS 102 HB2 LYS 102 5.348 31.312 1.566 741 HB3 LYS 102 HB3 LYS 102 5.063 32.746 0.837 742 HG2 LYS 102 HG2 LYS 102 6.306 33.864 2.472 743 HG3 LYS 102 HG3 LYS 102 6.519 32.471 3.298 744 HD2 LYS 102 HD2 LYS 102 7.742 31.596 1.411 745 HD3 LYS 102 HD3 LYS 102 7.616 33.057 0.693 746 HE2 LYS 102 HE2 LYS 102 8.865 34.034 2.474 747 HE3 LYS 102 HE3 LYS 102 9.001 32.566 3.178 748 HZ1 LYS 102 HZ1 LYS 102 10.983 33.086 1.980 749 HZ2 LYS 102 HZ2 LYS 102 10.128 33.252 0.618 750 HZ3 LYS 102 HZ3 LYS 102 10.264 31.799 1.315 751 H GLY 103 H GLY 103 4.278 34.431 4.159 752 HA2 GLY 103 HA2 GLY 103 4.078 36.706 3.468 753 HA3 GLY 103 HA3 GLY 103 2.900 36.288 2.416 754 H TRP 104 H TRP 104 2.646 34.886 5.471 755 HA TRP 104 HA TRP 104 0.232 36.016 6.048 756 HB2 TRP 104 HB2 TRP 104 0.662 35.180 8.341 757 HB3 TRP 104 HB3 TRP 104 0.881 34.052 7.180 758 HD1 TRP 104 HD1 TRP 104 2.922 36.203 9.454 759 HE1 TRP 104 HE1 TRP 104 5.273 35.376 9.726 760 HE3 TRP 104 HE3 TRP 104 2.655 32.474 6.133 761 HZ2 TRP 104 HZ2 TRP 104 6.785 33.306 8.554 762 HZ3 TRP 104 HZ3 TRP 104 4.605 31.093 5.760 763 HH2 TRP 104 HH2 TRP 104 6.652 31.514 6.972 764 H ASP 105 H ASP 105 -0.541 37.660 7.464 765 HA ASP 105 HA ASP 105 1.207 39.833 7.799 766 HB2 ASP 105 HB2 ASP 105 -1.432 39.404 8.911 767 HB3 ASP 105 HB3 ASP 105 -0.635 40.823 9.043 768 HA PRO 106 HA PRO 106 2.634 38.462 11.719 769 HB2 PRO 106 HB2 PRO 106 3.582 40.652 12.893 770 HB3 PRO 106 HB3 PRO 106 4.382 40.046 11.604 771 HG2 PRO 106 HG2 PRO 106 2.450 42.174 11.608 772 HG3 PRO 106 HG3 PRO 106 3.926 42.180 10.909 773 HD2 PRO 106 HD2 PRO 106 1.836 41.647 9.469 774 HD3 PRO 106 HD3 PRO 106 3.235 40.859 9.173 775 H ASP 107 H ASP 107 0.286 40.819 11.507 776 HA ASP 107 HA ASP 107 -0.531 40.830 14.175 777 HB2 ASP 107 HB2 ASP 107 -1.103 42.574 12.578 778 HB3 ASP 107 HB3 ASP 107 -2.026 41.504 11.758 779 H LYS 108 H LYS 108 -1.039 38.653 11.660 780 HA LYS 108 HA LYS 108 -3.425 37.590 12.861 781 HB2 LYS 108 HB2 LYS 108 -2.228 37.049 10.295 782 HB3 LYS 108 HB3 LYS 108 -3.547 36.246 10.825 783 HG2 LYS 108 HG2 LYS 108 -4.757 38.291 10.920 784 HG3 LYS 108 HG3 LYS 108 -3.437 39.099 10.398 785 HD2 LYS 108 HD2 LYS 108 -3.565 38.027 8.318 786 HD3 LYS 108 HD3 LYS 108 -4.823 37.123 8.835 787 HE2 LYS 108 HE2 LYS 108 -5.643 38.926 7.520 788 HE3 LYS 108 HE3 LYS 108 -6.141 39.117 9.064 789 HZ1 LYS 108 HZ1 LYS 108 -5.348 41.179 8.201 790 HZ2 LYS 108 HZ2 LYS 108 -3.909 40.511 7.893 791 HZ3 LYS 108 HZ3 LYS 108 -4.402 40.699 9.421 792 HA PRO 109 HA PRO 109 -1.276 34.428 14.769 793 HB2 PRO 109 HB2 PRO 109 -3.059 32.451 15.009 794 HB3 PRO 109 HB3 PRO 109 -3.207 33.791 15.931 795 HG2 PRO 109 HG2 PRO 109 -4.556 33.217 13.464 796 HG3 PRO 109 HG3 PRO 109 -5.215 33.777 14.849 797 HD2 PRO 109 HD2 PRO 109 -4.663 35.428 12.955 798 HD3 PRO 109 HD3 PRO 109 -4.429 35.883 14.506 799 H LEU 110 H LEU 110 0.418 33.665 13.869 800 HA LEU 110 HA LEU 110 0.506 32.719 11.345 801 HB2 LEU 110 HB2 LEU 110 2.308 33.203 13.215 802 HB3 LEU 110 HB3 LEU 110 2.443 31.580 13.093 803 HG LEU 110 HG LEU 110 2.899 33.373 10.900 804 HD11 LEU 110 HD11 LEU 110 5.266 32.940 11.282 805 HD12 LEU 110 HD12 LEU 110 4.887 32.055 12.581 806 HD13 LEU 110 HD13 LEU 110 4.617 33.649 12.583 807 HD21 LEU 110 HD21 LEU 110 3.881 31.512 9.769 808 HD22 LEU 110 HD22 LEU 110 2.328 31.214 10.105 809 HD23 LEU 110 HD23 LEU 110 3.492 30.549 11.009 810 H LYS 111 H LYS 111 0.032 30.863 14.212 811 HA LYS 111 HA LYS 111 0.345 28.379 13.199 812 HB2 LYS 111 HB2 LYS 111 -1.604 29.127 15.218 813 HB3 LYS 111 HB3 LYS 111 -1.060 27.601 15.004 814 HG2 LYS 111 HG2 LYS 111 1.194 28.585 15.490 815 HG3 LYS 111 HG3 LYS 111 0.346 29.820 16.142 816 HD2 LYS 111 HD2 LYS 111 0.065 27.082 17.018 817 HD3 LYS 111 HD3 LYS 111 1.020 28.166 17.780 818 HE2 LYS 111 HE2 LYS 111 -0.946 29.476 18.244 819 HE3 LYS 111 HE3 LYS 111 -1.846 28.263 17.625 820 HZ1 LYS 111 HZ1 LYS 111 -1.714 28.054 19.996 821 HZ2 LYS 111 HZ2 LYS 111 -0.101 27.990 19.908 822 HZ3 LYS 111 HZ3 LYS 111 -0.993 26.788 19.295 823 H ARG 112 H ARG 112 -2.400 30.415 12.886 824 HA ARG 112 HA ARG 112 -3.811 28.429 11.436 825 HB2 ARG 112 HB2 ARG 112 -4.526 31.120 12.226 826 HB3 ARG 112 HB3 ARG 112 -5.505 30.274 11.230 827 HG2 ARG 112 HG2 ARG 112 -5.691 28.601 12.987 828 HG3 ARG 112 HG3 ARG 112 -4.910 29.642 13.974 829 HD2 ARG 112 HD2 ARG 112 -7.199 29.895 14.369 830 HD3 ARG 112 HD3 ARG 112 -6.696 31.237 13.585 831 HE ARG 112 HE ARG 112 -7.560 29.461 11.663 832 HH11 ARG 112 HH11 ARG 112 -9.530 29.651 10.685 833 HH12 ARG 112 HH12 ARG 112 -10.817 30.526 11.447 834 HH21 ARG 112 HH21 ARG 112 -8.984 31.404 14.231 835 HH22 ARG 112 HH22 ARG 112 -10.514 31.503 13.424 836 H ALA 113 H ALA 113 -2.360 31.484 10.874 837 HA ALA 113 HA ALA 113 -3.310 31.800 8.315 838 HB1 ALA 113 HB1 ALA 113 -2.564 33.683 9.711 839 HB2 ALA 113 HB2 ALA 113 -1.847 33.766 8.264 840 HB3 ALA 113 HB3 ALA 113 -1.033 33.193 9.538 841 H ASP 114 H ASP 114 -0.749 29.892 9.288 842 HA ASP 114 HA ASP 114 0.815 30.229 7.061 843 HB2 ASP 114 HB2 ASP 114 1.658 29.151 9.055 844 HB3 ASP 114 HB3 ASP 114 0.642 27.896 8.812 845 H PHE 115 H PHE 115 -1.767 27.950 7.603 846 HA PHE 115 HA PHE 115 -1.572 27.283 4.845 847 HB2 PHE 115 HB2 PHE 115 -1.935 24.930 5.276 848 HB3 PHE 115 HB3 PHE 115 -0.591 25.440 6.050 849 HD1 PHE 115 HD1 PHE 115 -0.591 25.710 8.524 850 HD2 PHE 115 HD2 PHE 115 -3.850 24.118 6.477 851 HE1 PHE 115 HE1 PHE 115 -1.475 24.867 10.602 852 HE2 PHE 115 HE2 PHE 115 -4.726 23.237 8.545 853 HZ PHE 115 HZ PHE 115 -3.539 23.621 10.615 854 H GLU 116 H GLU 116 -3.398 26.396 3.708 855 HA GLU 116 HA GLU 116 -5.882 27.012 5.021 856 HB2 GLU 116 HB2 GLU 116 -5.137 27.719 2.310 857 HB3 GLU 116 HB3 GLU 116 -6.691 27.790 2.808 858 HG2 GLU 116 HG2 GLU 116 -4.698 29.323 4.142 859 HG3 GLU 116 HG3 GLU 116 -5.385 29.887 2.771 860 H LEU 117 H LEU 117 -7.730 25.727 4.508 861 HA LEU 117 HA LEU 117 -7.113 23.178 3.486 862 HB2 LEU 117 HB2 LEU 117 -8.724 23.413 5.223 863 HB3 LEU 117 HB3 LEU 117 -9.676 24.298 4.235 864 HG LEU 117 HG LEU 117 -9.970 22.258 2.910 865 HD11 LEU 117 HD11 LEU 117 -9.575 20.168 4.001 866 HD12 LEU 117 HD12 LEU 117 -8.870 20.939 5.235 867 HD13 LEU 117 HD13 LEU 117 -8.180 20.952 3.772 868 HD21 LEU 117 HD21 LEU 117 -11.705 21.430 4.392 869 HD22 LEU 117 HD22 LEU 117 -11.723 23.046 4.375 870 HD23 LEU 117 HD23 LEU 117 -11.051 22.258 5.617 871 H ILE 118 H ILE 118 -7.278 22.400 1.427 872 HA ILE 118 HA ILE 118 -8.910 23.966 -0.339 873 HB ILE 118 HB ILE 118 -7.427 23.327 -2.189 874 HG12 ILE 118 HG12 ILE 118 -5.423 22.564 -0.318 875 HG13 ILE 118 HG13 ILE 118 -6.528 21.440 -0.746 876 HG21 ILE 118 HG21 ILE 118 -5.685 24.909 -1.625 877 HG22 ILE 118 HG22 ILE 118 -6.135 24.857 -0.073 878 HG23 ILE 118 HG23 ILE 118 -7.124 25.496 -1.181 879 HD11 ILE 118 HD11 ILE 118 -4.574 21.224 -2.104 880 HD12 ILE 118 HD12 ILE 118 -4.739 22.752 -2.607 881 HD13 ILE 118 HD13 ILE 118 -5.832 21.639 -3.031 882 H GLY 119 H GLY 119 -8.890 21.153 1.187 883 HA2 GLY 119 HA2 GLY 119 -11.033 20.164 -0.153 884 HA3 GLY 119 HA3 GLY 119 -9.738 19.419 -0.814 885 H ALA 120 H ALA 120 -12.071 18.541 0.814 886 HA ALA 120 HA ALA 120 -10.581 16.793 2.557 887 HB1 ALA 120 HB1 ALA 120 -11.399 18.440 4.063 888 HB2 ALA 120 HB2 ALA 120 -12.216 17.068 4.318 889 HB3 ALA 120 HB3 ALA 120 -12.899 18.272 3.481 890 H VAL 121 H VAL 121 -11.264 14.689 2.271 891 HA VAL 121 HA VAL 121 -13.722 14.342 0.859 892 HB VAL 121 HB VAL 121 -11.297 12.891 0.125 893 HG11 VAL 121 HG11 VAL 121 -12.535 12.072 -1.786 894 HG12 VAL 121 HG12 VAL 121 -13.852 12.853 -1.270 895 HG13 VAL 121 HG13 VAL 121 -13.262 11.613 -0.417 896 HG21 VAL 121 HG21 VAL 121 -11.215 14.226 -1.893 897 HG22 VAL 121 HG22 VAL 121 -11.073 15.177 -0.593 898 HG23 VAL 121 HG23 VAL 121 -12.485 15.085 -1.377 899 HA PRO 122 HA PRO 122 -13.708 11.302 4.122 900 HB2 PRO 122 HB2 PRO 122 -16.264 11.245 4.729 901 HB3 PRO 122 HB3 PRO 122 -15.378 12.505 5.272 902 HG2 PRO 122 HG2 PRO 122 -17.045 12.416 2.952 903 HG3 PRO 122 HG3 PRO 122 -17.008 13.568 4.109 904 HD2 PRO 122 HD2 PRO 122 -15.704 13.896 1.863 905 HD3 PRO 122 HD3 PRO 122 -15.128 14.528 3.255 906 H HIS 123 H HIS 123 -14.450 9.096 4.256 907 HA HIS 123 HA HIS 123 -15.275 8.173 1.645 908 HB2 HIS 123 HB2 HIS 123 -13.339 7.089 2.398 909 HB3 HIS 123 HB3 HIS 123 -14.073 6.680 3.799 910 HD1 HIS 123 HD1 HIS 123 -16.217 4.960 3.547 911 HD2 HIS 123 HD2 HIS 123 -13.465 5.124 0.511 912 HE1 HIS 123 HE1 HIS 123 -16.515 2.959 2.104 913 HE2 HIS 123 HE2 HIS 123 -14.851 3.020 0.281 914 H ASP 124 H ASP 124 -17.351 7.910 1.370 915 HA ASP 124 HA ASP 124 -18.960 6.911 3.587 916 HB2 ASP 124 HB2 ASP 124 -19.306 9.273 3.238 917 HB3 ASP 124 HB3 ASP 124 -19.835 8.931 1.731 918 H GLY 125 H GLY 125 -20.286 7.686 0.535 919 HA2 GLY 125 HA2 GLY 125 -19.980 5.083 -0.532 920 HA3 GLY 125 HA3 GLY 125 -21.488 5.385 0.019 921 H SER 126 H SER 126 -22.048 4.926 -2.232 922 HA SER 126 HA SER 126 -22.646 5.582 -4.263 923 HB2 SER 126 HB2 SER 126 -23.609 7.664 -4.512 924 HB3 SER 126 HB3 SER 126 -23.546 7.544 -2.885 925 HG SER 126 HG SER 126 -21.281 8.496 -3.652 926 HA PRO 127 HA PRO 127 -19.148 6.376 -6.491 927 HB2 PRO 127 HB2 PRO 127 -19.706 7.431 -8.869 928 HB3 PRO 127 HB3 PRO 127 -20.273 5.934 -8.545 929 HG2 PRO 127 HG2 PRO 127 -21.662 8.419 -8.264 930 HG3 PRO 127 HG3 PRO 127 -22.178 7.074 -9.033 931 HD2 PRO 127 HD2 PRO 127 -22.942 7.538 -6.583 932 HD3 PRO 127 HD3 PRO 127 -22.674 6.003 -7.070 933 H ALA 128 H ALA 128 -20.710 8.954 -5.422 934 HA ALA 128 HA ALA 128 -19.014 10.955 -6.315 935 HB1 ALA 128 HB1 ALA 128 -21.166 11.497 -5.376 936 HB2 ALA 128 HB2 ALA 128 -20.024 12.311 -4.571 937 HB3 ALA 128 HB3 ALA 128 -20.678 10.981 -3.924 938 H SER 129 H SER 129 -19.037 9.050 -3.375 939 HA SER 129 HA SER 129 -16.689 10.227 -2.365 940 HB2 SER 129 HB2 SER 129 -18.338 9.251 -0.884 941 HB3 SER 129 HB3 SER 129 -17.958 7.771 -1.459 942 HG SER 129 HG SER 129 -17.003 8.531 0.571 943 H ARG 130 H ARG 130 -17.359 7.727 -4.498 944 HA ARG 130 HA ARG 130 -15.031 6.240 -4.229 945 HB2 ARG 130 HB2 ARG 130 -17.130 5.657 -5.477 946 HB3 ARG 130 HB3 ARG 130 -16.470 6.470 -6.729 947 HG2 ARG 130 HG2 ARG 130 -14.588 4.713 -6.118 948 HG3 ARG 130 HG3 ARG 130 -15.965 3.861 -5.903 949 HD2 ARG 130 HD2 ARG 130 -15.253 5.220 -8.350 950 HD3 ARG 130 HD3 ARG 130 -15.181 3.603 -8.135 951 HE ARG 130 HE ARG 130 -17.526 5.156 -8.620 952 HH11 ARG 130 HH11 ARG 130 -19.407 4.086 -9.078 953 HH12 ARG 130 HH12 ARG 130 -19.529 2.374 -8.843 954 HH21 ARG 130 HH21 ARG 130 -16.308 1.979 -7.708 955 HH22 ARG 130 HH22 ARG 130 -17.811 1.204 -8.083 956 H ASN 131 H ASN 131 -15.486 9.290 -5.529 957 HA ASN 131 HA ASN 131 -13.528 9.154 -7.481 958 HB2 ASN 131 HB2 ASN 131 -14.810 11.429 -6.226 959 HB3 ASN 131 HB3 ASN 131 -13.684 11.658 -7.387 960 HD21 ASN 131 HD21 ASN 131 -17.360 11.298 -8.490 961 HD22 ASN 131 HD22 ASN 131 -16.780 11.816 -6.942 962 H LEU 132 H LEU 132 -11.484 8.606 -7.009 963 HA LEU 132 HA LEU 132 -10.171 9.764 -4.771 964 HB2 LEU 132 HB2 LEU 132 -9.719 7.609 -6.431 965 HB3 LEU 132 HB3 LEU 132 -8.356 8.506 -6.358 966 HG LEU 132 HG LEU 132 -8.365 6.648 -4.864 967 HD11 LEU 132 HD11 LEU 132 -7.471 7.829 -2.966 968 HD12 LEU 132 HD12 LEU 132 -8.096 9.206 -3.537 969 HD13 LEU 132 HD13 LEU 132 -6.913 8.459 -4.347 970 HD21 LEU 132 HD21 LEU 132 -9.687 6.720 -2.854 971 HD22 LEU 132 HD22 LEU 132 -10.637 6.615 -4.158 972 HD23 LEU 132 HD23 LEU 132 -10.449 8.034 -3.407 973 H SER 133 H SER 133 -10.610 10.453 -8.031 974 HA SER 133 HA SER 133 -8.264 12.085 -8.206 975 HB2 SER 133 HB2 SER 133 -8.807 10.657 -10.093 976 HB3 SER 133 HB3 SER 133 -10.181 11.510 -10.317 977 HG SER 133 HG SER 133 -8.372 12.062 -11.653 978 H HIS 134 H HIS 134 -8.217 14.321 -8.415 979 HA HIS 134 HA HIS 134 -10.724 15.687 -8.266 980 HB2 HIS 134 HB2 HIS 134 -8.698 15.910 -6.193 981 HB3 HIS 134 HB3 HIS 134 -9.944 16.960 -6.300 982 HD1 HIS 134 HD1 HIS 134 -9.110 13.524 -5.222 983 HD2 HIS 134 HD2 HIS 134 -12.418 15.937 -5.432 984 HE1 HIS 134 HE1 HIS 134 -10.972 12.430 -3.994 985 HE2 HIS 134 HE2 HIS 134 -12.977 13.858 -4.117 986 H HIS 135 H HIS 135 -10.765 17.922 -8.722 987 HA HIS 135 HA HIS 135 -8.535 18.685 -10.380 988 HB2 HIS 135 HB2 HIS 135 -11.261 19.682 -10.307 989 HB3 HIS 135 HB3 HIS 135 -10.128 20.314 -11.300 990 HD1 HIS 135 HD1 HIS 135 -9.558 19.133 -13.495 991 HD2 HIS 135 HD2 HIS 135 -12.248 17.150 -11.132 992 HE1 HIS 135 HE1 HIS 135 -10.525 17.263 -14.812 993 HE2 HIS 135 HE2 HIS 135 -12.149 16.046 -13.407 994 H ILE 136 H ILE 136 -7.225 20.411 -9.955 995 HA ILE 136 HA ILE 136 -8.057 22.243 -7.885 996 HB ILE 136 HB ILE 136 -5.363 21.142 -8.103 997 HG12 ILE 136 HG12 ILE 136 -6.842 19.615 -7.055 998 HG13 ILE 136 HG13 ILE 136 -5.667 20.105 -6.032 999 HG21 ILE 136 HG21 ILE 136 -4.765 22.476 -6.166 1000 HG22 ILE 136 HG22 ILE 136 -6.236 23.147 -6.175 1001 HG23 ILE 136 HG23 ILE 136 -5.208 23.437 -7.389 1002 HD11 ILE 136 HD11 ILE 136 -7.775 19.997 -4.863 1003 HD12 ILE 136 HD12 ILE 136 -8.426 21.045 -5.908 1004 HD13 ILE 136 HD13 ILE 136 -7.262 21.530 -4.895 1005 H TYR 137 H TYR 137 -7.840 24.431 -8.533 1006 HA TYR 137 HA TYR 137 -6.629 24.859 -11.070 1007 HB2 TYR 137 HB2 TYR 137 -8.659 26.005 -10.597 1008 HB3 TYR 137 HB3 TYR 137 -7.944 26.774 -9.347 1009 HD1 TYR 137 HD1 TYR 137 -6.776 28.839 -9.688 1010 HD2 TYR 137 HD2 TYR 137 -7.867 26.531 -12.977 1011 HE1 TYR 137 HE1 TYR 137 -6.093 30.621 -11.167 1012 HE2 TYR 137 HE2 TYR 137 -7.156 28.313 -14.454 1013 HH TYR 137 HH TYR 137 -6.039 30.282 -14.643 1014 H ILE 138 H ILE 138 -4.701 25.855 -11.505 1015 HA ILE 138 HA ILE 138 -3.075 26.625 -9.228 1016 HB ILE 138 HB ILE 138 -2.164 25.820 -11.869 1017 HG12 ILE 138 HG12 ILE 138 -3.063 23.942 -10.811 1018 HG13 ILE 138 HG13 ILE 138 -1.438 23.784 -10.867 1019 HG21 ILE 138 HG21 ILE 138 0.048 25.763 -10.949 1020 HG22 ILE 138 HG22 ILE 138 -0.519 26.317 -9.539 1021 HG23 ILE 138 HG23 ILE 138 -0.562 27.257 -10.854 1022 HD11 ILE 138 HD11 ILE 138 -2.260 23.019 -8.751 1023 HD12 ILE 138 HD12 ILE 138 -2.922 24.466 -8.466 1024 HD13 ILE 138 HD13 ILE 138 -1.314 24.310 -8.522 1025 HA PRO 139 HA PRO 139 -3.788 30.599 -10.833 1026 HB2 PRO 139 HB2 PRO 139 -1.860 32.096 -9.702 1027 HB3 PRO 139 HB3 PRO 139 -3.122 31.589 -8.798 1028 HG2 PRO 139 HG2 PRO 139 -0.548 30.352 -9.037 1029 HG3 PRO 139 HG3 PRO 139 -1.350 30.714 -7.662 1030 HD2 PRO 139 HD2 PRO 139 -1.490 28.310 -8.556 1031 HD3 PRO 139 HD3 PRO 139 -2.848 28.990 -7.956 1032 H GLU 140 H GLU 140 -3.447 31.899 -12.478 1033 HA GLU 140 HA GLU 140 -1.263 31.056 -14.148 1034 HB2 GLU 140 HB2 GLU 140 -3.664 31.151 -14.853 1035 HB3 GLU 140 HB3 GLU 140 -3.430 32.762 -14.974 1036 HG2 GLU 140 HG2 GLU 140 -1.794 32.376 -16.661 1037 HG3 GLU 140 HG3 GLU 140 -2.093 30.774 -16.563 1038 H ASP 141 H ASP 141 -1.881 33.378 -11.997 1039 HA ASP 141 HA ASP 141 -0.361 35.365 -13.376 1040 HB2 ASP 141 HB2 ASP 141 -1.596 37.028 -12.091 1041 HB3 ASP 141 HB3 ASP 141 -2.679 35.996 -12.745 1042 H ARG 142 H ARG 142 0.189 33.252 -11.035 1043 HA ARG 142 HA ARG 142 2.046 34.994 -9.704 1044 HB2 ARG 142 HB2 ARG 142 0.091 33.332 -8.334 1045 HB3 ARG 142 HB3 ARG 142 1.368 33.964 -7.536 1046 HG2 ARG 142 HG2 ARG 142 0.593 36.102 -7.823 1047 HG3 ARG 142 HG3 ARG 142 -0.542 35.609 -8.889 1048 HD2 ARG 142 HD2 ARG 142 -1.456 34.336 -6.934 1049 HD3 ARG 142 HD3 ARG 142 -0.600 35.413 -6.054 1050 HE ARG 142 HE ARG 142 -2.297 36.514 -8.084 1051 HH11 ARG 142 HH11 ARG 142 -3.872 37.911 -7.519 1052 HH12 ARG 142 HH12 ARG 142 -4.278 38.176 -5.856 1053 HH21 ARG 142 HH21 ARG 142 -1.951 35.948 -4.626 1054 HH22 ARG 142 HH22 ARG 142 -3.204 37.078 -4.237 1055 H LEU 143 H LEU 143 3.746 34.088 -8.490 1056 HA LEU 143 HA LEU 143 4.339 31.389 -9.273 1057 HB2 LEU 143 HB2 LEU 143 6.222 33.580 -9.213 1058 HB3 LEU 143 HB3 LEU 143 6.680 32.027 -9.425 1059 HG LEU 143 HG LEU 143 5.222 32.204 -11.472 1060 HD11 LEU 143 HD11 LEU 143 5.317 34.376 -12.512 1061 HD12 LEU 143 HD12 LEU 143 5.973 34.991 -11.168 1062 HD13 LEU 143 HD13 LEU 143 4.451 34.445 -11.147 1063 HD21 LEU 143 HD21 LEU 143 7.232 32.777 -12.738 1064 HD22 LEU 143 HD22 LEU 143 7.601 31.744 -11.550 1065 HD23 LEU 143 HD23 LEU 143 7.922 33.320 -11.380 1066 H GLY 144 H GLY 144 5.586 30.110 -7.739 1067 HA2 GLY 144 HA2 GLY 144 7.011 30.737 -5.703 1068 HA3 GLY 144 HA3 GLY 144 5.572 31.209 -5.091 1069 H TYR 145 H TYR 145 7.314 29.295 -3.958 1070 HA TYR 145 HA TYR 145 6.117 26.812 -4.537 1071 HB2 TYR 145 HB2 TYR 145 7.733 25.937 -2.885 1072 HB3 TYR 145 HB3 TYR 145 8.412 26.669 -4.177 1073 HD1 TYR 145 HD1 TYR 145 9.771 28.642 -3.924 1074 HD2 TYR 145 HD2 TYR 145 7.745 27.082 -0.645 1075 HE1 TYR 145 HE1 TYR 145 11.025 30.091 -2.459 1076 HE2 TYR 145 HE2 TYR 145 8.994 28.542 0.818 1077 HH TYR 145 HH TYR 145 11.036 31.072 -0.331 1078 H HIS 146 H HIS 146 5.086 25.387 -3.136 1079 HA HIS 146 HA HIS 146 3.982 26.538 -0.733 1080 HB2 HIS 146 HB2 HIS 146 2.355 25.227 -2.737 1081 HB3 HIS 146 HB3 HIS 146 1.796 25.819 -1.322 1082 HD1 HIS 146 HD1 HIS 146 1.283 28.343 -1.101 1083 HD2 HIS 146 HD2 HIS 146 2.839 27.181 -4.715 1084 HE1 HIS 146 HE1 HIS 146 1.115 30.250 -2.692 1085 HE2 HIS 146 HE2 HIS 146 2.036 29.568 -4.875 1086 H VAL 147 H VAL 147 3.525 24.952 0.885 1087 HA VAL 147 HA VAL 147 4.515 22.321 0.251 1088 HB VAL 147 HB VAL 147 3.961 23.357 2.909 1089 HG11 VAL 147 HG11 VAL 147 5.217 21.471 3.700 1090 HG12 VAL 147 HG12 VAL 147 5.414 20.958 2.179 1091 HG13 VAL 147 HG13 VAL 147 3.941 20.965 2.846 1092 HG21 VAL 147 HG21 VAL 147 6.334 23.665 3.166 1093 HG22 VAL 147 HG22 VAL 147 5.789 24.592 1.959 1094 HG23 VAL 147 HG23 VAL 147 6.565 23.212 1.631 1095 H ILE 148 H ILE 148 3.029 20.631 0.044 1096 HA ILE 148 HA ILE 148 0.303 21.268 0.613 1097 HB ILE 148 HB ILE 148 1.333 18.883 -0.720 1098 HG12 ILE 148 HG12 ILE 148 -0.038 21.102 -1.943 1099 HG13 ILE 148 HG13 ILE 148 1.579 20.887 -2.012 1100 HG21 ILE 148 HG21 ILE 148 -0.986 18.355 -1.259 1101 HG22 ILE 148 HG22 ILE 148 -1.481 19.641 -0.412 1102 HG23 ILE 148 HG23 ILE 148 -0.799 18.387 0.347 1103 HD11 ILE 148 HD11 ILE 148 0.570 20.162 -4.071 1104 HD12 ILE 148 HD12 ILE 148 -0.352 19.107 -3.263 1105 HD13 ILE 148 HD13 ILE 148 1.249 18.894 -3.332 1106 H LEU 149 H LEU 149 -0.539 20.643 2.611 1107 HA LEU 149 HA LEU 149 0.890 18.621 4.121 1108 HB2 LEU 149 HB2 LEU 149 -1.092 20.523 4.895 1109 HB3 LEU 149 HB3 LEU 149 -0.703 19.270 5.868 1110 HG LEU 149 HG LEU 149 1.490 20.185 6.084 1111 HD11 LEU 149 HD11 LEU 149 1.942 22.428 5.462 1112 HD12 LEU 149 HD12 LEU 149 0.520 22.507 4.696 1113 HD13 LEU 149 HD13 LEU 149 1.676 21.514 4.154 1114 HD21 LEU 149 HD21 LEU 149 0.759 21.960 7.612 1115 HD22 LEU 149 HD22 LEU 149 -0.210 20.674 7.764 1116 HD23 LEU 149 HD23 LEU 149 -0.695 21.956 6.905 1117 H ALA 150 H ALA 150 -0.041 16.489 4.138 1118 HA ALA 150 HA ALA 150 -2.831 16.366 3.537 1119 HB1 ALA 150 HB1 ALA 150 -1.743 16.074 1.403 1120 HB2 ALA 150 HB2 ALA 150 -2.524 14.716 1.803 1121 HB3 ALA 150 HB3 ALA 150 -0.921 14.813 1.991 1122 H VAL 151 H VAL 151 -4.019 14.682 4.310 1123 HA VAL 151 HA VAL 151 -2.575 12.784 5.914 1124 HB VAL 151 HB VAL 151 -5.044 14.092 6.742 1125 HG11 VAL 151 HG11 VAL 151 -4.840 12.896 8.838 1126 HG12 VAL 151 HG12 VAL 151 -3.535 12.125 8.274 1127 HG13 VAL 151 HG13 VAL 151 -4.986 11.846 7.616 1128 HG21 VAL 151 HG21 VAL 151 -3.736 15.144 8.477 1129 HG22 VAL 151 HG22 VAL 151 -3.172 15.566 7.021 1130 HG23 VAL 151 HG23 VAL 151 -2.399 14.445 7.894 1131 H TRP 152 H TRP 152 -3.140 10.666 5.634 1132 HA TRP 152 HA TRP 152 -5.644 10.072 4.269 1133 HB2 TRP 152 HB2 TRP 152 -4.082 9.618 2.689 1134 HB3 TRP 152 HB3 TRP 152 -3.039 8.996 3.782 1135 HD1 TRP 152 HD1 TRP 152 -6.516 7.686 3.543 1136 HE1 TRP 152 HE1 TRP 152 -6.588 5.289 2.825 1137 HE3 TRP 152 HE3 TRP 152 -1.661 7.220 2.444 1138 HZ2 TRP 152 HZ2 TRP 152 -4.668 3.434 1.934 1139 HZ3 TRP 152 HZ3 TRP 152 -0.838 5.079 1.661 1140 HH2 TRP 152 HH2 TRP 152 -2.344 3.205 1.417 1141 H ASP 153 H ASP 153 -7.008 9.125 5.672 1142 HA ASP 153 HA ASP 153 -5.873 7.901 8.007 1143 HB2 ASP 153 HB2 ASP 153 -7.564 9.711 8.137 1144 HB3 ASP 153 HB3 ASP 153 -8.655 8.628 7.586 1145 H VAL 154 H VAL 154 -5.772 5.770 8.344 1146 HA VAL 154 HA VAL 154 -7.255 4.079 6.554 1147 HB VAL 154 HB VAL 154 -4.955 3.440 8.210 1148 HG11 VAL 154 HG11 VAL 154 -4.872 1.289 7.115 1149 HG12 VAL 154 HG12 VAL 154 -6.237 1.636 6.321 1150 HG13 VAL 154 HG13 VAL 154 -6.263 1.440 7.925 1151 HG21 VAL 154 HG21 VAL 154 -3.740 3.299 6.140 1152 HG22 VAL 154 HG22 VAL 154 -4.363 4.780 6.322 1153 HG23 VAL 154 HG23 VAL 154 -5.073 3.720 5.329 1154 H ALA 155 H ALA 155 -9.110 3.149 7.202 1155 HA ALA 155 HA ALA 155 -9.865 3.528 9.837 1156 HB1 ALA 155 HB1 ALA 155 -11.473 3.524 7.990 1157 HB2 ALA 155 HB2 ALA 155 -11.969 2.497 9.136 1158 HB3 ALA 155 HB3 ALA 155 -11.244 1.934 7.804 1159 H ASP 156 H ASP 156 -8.176 1.012 8.520 1160 HA ASP 156 HA ASP 156 -9.247 -0.963 10.211 1161 HB2 ASP 156 HB2 ASP 156 -7.055 -1.076 8.310 1162 HB3 ASP 156 HB3 ASP 156 -7.478 -2.392 9.180 1163 H THR 157 H THR 157 -7.217 1.415 10.906 1164 HA THR 157 HA THR 157 -6.156 0.065 13.163 1165 HB THR 157 HB THR 157 -4.394 -0.503 11.639 1166 HG1 THR 157 HG1 THR 157 -3.936 0.675 13.805 1167 HG21 THR 157 HG21 THR 157 -3.197 1.152 10.406 1168 HG22 THR 157 HG22 THR 157 -4.155 2.313 10.998 1169 HG23 THR 157 HG23 THR 157 -4.756 1.209 9.981 1170 H GLU 158 H GLU 158 -4.995 1.604 14.687 1171 HA GLU 158 HA GLU 158 -6.292 4.114 14.670 1172 HB2 GLU 158 HB2 GLU 158 -4.853 2.618 16.528 1173 HB3 GLU 158 HB3 GLU 158 -4.369 4.177 16.580 1174 HG2 GLU 158 HG2 GLU 158 -7.155 3.568 16.788 1175 HG3 GLU 158 HG3 GLU 158 -6.208 3.453 18.114 1176 H ASN 159 H ASN 159 -3.761 3.035 12.965 1177 HA ASN 159 HA ASN 159 -2.202 5.443 13.253 1178 HB2 ASN 159 HB2 ASN 159 -1.474 2.907 12.076 1179 HB3 ASN 159 HB3 ASN 159 -0.478 4.201 12.055 1180 HD21 ASN 159 HD21 ASN 159 -0.127 1.764 14.999 1181 HD22 ASN 159 HD22 ASN 159 -0.677 1.425 13.392 1182 H ALA 160 H ALA 160 -1.392 6.608 11.349 1183 HA ALA 160 HA ALA 160 -2.998 6.219 9.015 1184 HB1 ALA 160 HB1 ALA 160 -4.354 7.695 10.384 1185 HB2 ALA 160 HB2 ALA 160 -3.837 8.514 9.089 1186 HB3 ALA 160 HB3 ALA 160 -3.114 8.724 10.520 1187 H PHE 161 H PHE 161 -2.418 7.901 7.267 1188 HA PHE 161 HA PHE 161 0.435 8.179 7.331 1189 HB2 PHE 161 HB2 PHE 161 -1.389 8.297 5.097 1190 HB3 PHE 161 HB3 PHE 161 0.216 8.553 4.936 1191 HD1 PHE 161 HD1 PHE 161 -2.253 6.018 5.585 1192 HD2 PHE 161 HD2 PHE 161 1.775 6.742 4.894 1193 HE1 PHE 161 HE1 PHE 161 -1.894 3.656 5.213 1194 HE2 PHE 161 HE2 PHE 161 2.140 4.396 4.502 1195 HZ PHE 161 HZ PHE 161 0.311 2.846 4.669 1196 H TYR 162 H TYR 162 1.390 10.153 7.606 1197 HA TYR 162 HA TYR 162 -0.207 12.542 7.078 1198 HB2 TYR 162 HB2 TYR 162 1.495 11.990 9.301 1199 HB3 TYR 162 HB3 TYR 162 1.296 13.535 8.810 1200 HD1 TYR 162 HD1 TYR 162 -0.853 10.699 9.714 1201 HD2 TYR 162 HD2 TYR 162 -0.264 14.810 9.959 1202 HE1 TYR 162 HE1 TYR 162 -2.839 10.910 11.092 1203 HE2 TYR 162 HE2 TYR 162 -2.251 15.016 11.324 1204 HH TYR 162 HH TYR 162 -4.596 13.153 11.534 1205 H GLN 163 H GLN 163 0.825 13.810 5.455 1206 HA GLN 163 HA GLN 163 3.631 13.469 5.193 1207 HB2 GLN 163 HB2 GLN 163 3.558 12.921 2.878 1208 HB3 GLN 163 HB3 GLN 163 2.729 11.803 3.733 1209 HG2 GLN 163 HG2 GLN 163 1.224 13.908 2.524 1210 HG3 GLN 163 HG3 GLN 163 1.782 12.727 1.544 1211 HE21 GLN 163 HE21 GLN 163 -0.466 10.732 4.092 1212 HE22 GLN 163 HE22 GLN 163 1.142 11.289 4.417 1213 H VAL 164 H VAL 164 4.775 15.032 3.931 1214 HA VAL 164 HA VAL 164 3.213 17.356 3.265 1215 HB VAL 164 HB VAL 164 5.137 18.745 3.940 1216 HG11 VAL 164 HG11 VAL 164 4.502 18.778 6.278 1217 HG12 VAL 164 HG12 VAL 164 3.753 17.357 6.093 1218 HG13 VAL 164 HG13 VAL 164 3.183 18.674 5.348 1219 HG21 VAL 164 HG21 VAL 164 6.699 17.838 5.519 1220 HG22 VAL 164 HG22 VAL 164 6.832 17.076 4.099 1221 HG23 VAL 164 HG23 VAL 164 6.049 16.370 5.325 1222 H ILE 165 H ILE 165 3.676 18.288 1.251 1223 HA ILE 165 HA ILE 165 5.886 17.157 -0.162 1224 HB ILE 165 HB ILE 165 3.163 17.154 -1.300 1225 HG12 ILE 165 HG12 ILE 165 4.798 14.893 -0.535 1226 HG13 ILE 165 HG13 ILE 165 3.442 15.370 0.239 1227 HG21 ILE 165 HG21 ILE 165 4.082 16.095 -3.253 1228 HG22 ILE 165 HG22 ILE 165 5.569 16.211 -2.628 1229 HG23 ILE 165 HG23 ILE 165 4.762 17.548 -3.050 1230 HD11 ILE 165 HD11 ILE 165 2.994 13.430 -1.074 1231 HD12 ILE 165 HD12 ILE 165 3.476 14.203 -2.410 1232 HD13 ILE 165 HD13 ILE 165 2.133 14.675 -1.644 1233 H ASP 166 H ASP 166 7.136 18.675 -1.117 1234 HA ASP 166 HA ASP 166 6.141 21.265 -1.303 1235 HB2 ASP 166 HB2 ASP 166 8.669 20.208 -2.303 1236 HB3 ASP 166 HB3 ASP 166 8.345 21.809 -2.270 1237 H VAL 167 H VAL 167 5.195 22.352 -3.008 1238 HA VAL 167 HA VAL 167 5.801 21.338 -5.637 1239 HB VAL 167 HB VAL 167 3.596 22.028 -6.410 1240 HG11 VAL 167 HG11 VAL 167 2.466 20.069 -5.583 1241 HG12 VAL 167 HG12 VAL 167 3.586 19.909 -4.428 1242 HG13 VAL 167 HG13 VAL 167 3.991 19.705 -5.980 1243 HG21 VAL 167 HG21 VAL 167 1.854 22.394 -4.792 1244 HG22 VAL 167 HG22 VAL 167 2.990 23.536 -4.649 1245 HG23 VAL 167 HG23 VAL 167 2.939 22.310 -3.596 1246 H ASP 168 H ASP 168 5.857 22.998 -7.327 1247 HA ASP 168 HA ASP 168 6.257 25.696 -6.276 1248 HB2 ASP 168 HB2 ASP 168 8.275 24.449 -7.007 1249 HB3 ASP 168 HB3 ASP 168 7.727 24.744 -8.517 1250 H LEU 169 H LEU 169 4.617 26.966 -6.978 1251 HA LEU 169 HA LEU 169 3.213 26.042 -9.347 1252 HB2 LEU 169 HB2 LEU 169 2.188 27.637 -7.187 1253 HB3 LEU 169 HB3 LEU 169 1.307 27.102 -8.455 1254 HG LEU 169 HG LEU 169 2.381 25.473 -6.353 1255 HD11 LEU 169 HD11 LEU 169 0.028 25.089 -5.814 1256 HD12 LEU 169 HD12 LEU 169 -0.399 26.078 -7.020 1257 HD13 LEU 169 HD13 LEU 169 0.369 26.667 -5.724 1258 HD21 LEU 169 HD21 LEU 169 1.315 23.571 -7.341 1259 HD22 LEU 169 HD22 LEU 169 2.454 24.162 -8.326 1260 HD23 LEU 169 HD23 LEU 169 0.893 24.469 -8.618 1261 H VAL 170 H VAL 170 3.389 27.243 -11.162 1262 HA VAL 170 HA VAL 170 4.132 29.968 -10.759 1263 HB VAL 170 HB VAL 170 5.728 29.844 -12.633 1264 HG11 VAL 170 HG11 VAL 170 7.459 28.590 -11.464 1265 HG12 VAL 170 HG12 VAL 170 6.334 27.915 -10.518 1266 HG13 VAL 170 HG13 VAL 170 6.641 29.499 -10.406 1267 HG21 VAL 170 HG21 VAL 170 6.342 27.732 -13.553 1268 HG22 VAL 170 HG22 VAL 170 4.784 28.044 -13.853 1269 HG23 VAL 170 HG23 VAL 170 5.190 27.009 -12.678 1270 H ASN 171 H ASN 171 4.045 31.320 -12.822 1271 HA ASN 171 HA ASN 171 1.457 31.199 -13.803 1272 HB2 ASN 171 HB2 ASN 171 2.078 33.153 -15.062 1273 HB3 ASN 171 HB3 ASN 171 2.681 33.278 -13.549 1274 HD21 ASN 171 HD21 ASN 171 5.120 33.790 -16.518 1275 HD22 ASN 171 HD22 ASN 171 3.399 33.977 -16.539 1276 H LYS 172 H LYS 172 1.066 31.578 -16.307 1277 HA LYS 172 HA LYS 172 1.714 29.211 -17.569 1278 HB2 LYS 172 HB2 LYS 172 0.725 30.208 -19.543 1279 HB3 LYS 172 HB3 LYS 172 -0.216 30.428 -18.226 1280 HG2 LYS 172 HG2 LYS 172 0.567 32.667 -18.035 1281 HG3 LYS 172 HG3 LYS 172 1.519 32.449 -19.344 1282 HD2 LYS 172 HD2 LYS 172 -0.265 32.329 -20.751 1283 HD3 LYS 172 HD3 LYS 172 -1.313 32.082 -19.523 1284 HE2 LYS 172 HE2 LYS 172 -0.601 34.390 -18.795 1285 HE3 LYS 172 HE3 LYS 172 -0.134 34.553 -20.351 1286 HZ1 LYS 172 HZ1 LYS 172 -2.361 35.341 -20.080 1287 HZ2 LYS 172 HZ2 LYS 172 -2.813 33.894 -19.519 1288 HZ3 LYS 172 HZ3 LYS 172 -2.350 34.055 -21.060 Start of MODEL 2 1 H1 HIS 1 H1 HIS 1 4.601 3.754 2.240 2 H2 HIS 1 H2 HIS 1 4.137 5.079 1.437 3 H3 HIS 1 H3 HIS 1 4.779 3.830 0.634 4 HA HIS 1 HA HIS 1 2.954 2.506 1.176 5 HB2 HIS 1 HB2 HIS 1 1.875 4.886 2.455 6 HB3 HIS 1 HB3 HIS 1 0.982 3.541 2.205 7 HD1 HIS 1 HD1 HIS 1 2.210 1.235 3.404 8 HD2 HIS 1 HD2 HIS 1 2.756 4.972 5.004 9 HE1 HIS 1 HE1 HIS 1 2.927 0.991 5.775 10 HE2 HIS 1 HE2 HIS 1 3.240 3.224 6.760 11 H GLY 2 H GLY 2 2.687 2.311 -1.068 12 HA2 GLY 2 HA2 GLY 2 1.425 2.776 -2.929 13 HA3 GLY 2 HA3 GLY 2 0.777 4.087 -2.202 14 H PHE 3 H PHE 3 1.142 4.835 -4.577 15 HA PHE 3 HA PHE 3 3.563 6.350 -4.541 16 HB2 PHE 3 HB2 PHE 3 4.231 5.769 -6.727 17 HB3 PHE 3 HB3 PHE 3 4.130 4.410 -5.826 18 HD1 PHE 3 HD1 PHE 3 2.972 6.023 -8.726 19 HD2 PHE 3 HD2 PHE 3 2.148 2.864 -6.144 20 HE1 PHE 3 HE1 PHE 3 1.576 5.017 -10.417 21 HE2 PHE 3 HE2 PHE 3 0.738 1.852 -7.823 22 HZ PHE 3 HZ PHE 3 0.451 2.931 -9.967 23 H ILE 4 H ILE 4 3.598 8.130 -6.246 24 HA ILE 4 HA ILE 4 0.944 9.147 -6.581 25 HB ILE 4 HB ILE 4 3.427 10.503 -7.268 26 HG12 ILE 4 HG12 ILE 4 3.389 10.202 -4.962 27 HG13 ILE 4 HG13 ILE 4 3.177 11.786 -5.301 28 HG21 ILE 4 HG21 ILE 4 2.091 12.525 -7.432 29 HG22 ILE 4 HG22 ILE 4 0.754 11.668 -7.129 30 HG23 ILE 4 HG23 ILE 4 1.571 11.433 -8.504 31 HD11 ILE 4 HD11 ILE 4 1.731 11.134 -3.507 32 HD12 ILE 4 HD12 ILE 4 1.048 10.008 -4.445 33 HD13 ILE 4 HD13 ILE 4 0.838 11.576 -4.780 34 H GLU 5 H GLU 5 -0.175 8.732 -8.498 35 HA GLU 5 HA GLU 5 1.333 7.601 -10.611 36 HB2 GLU 5 HB2 GLU 5 -0.932 6.832 -9.874 37 HB3 GLU 5 HB3 GLU 5 -1.517 8.104 -10.714 38 HG2 GLU 5 HG2 GLU 5 -0.114 6.947 -12.578 39 HG3 GLU 5 HG3 GLU 5 -0.548 5.638 -11.702 40 H LYS 6 H LYS 6 -0.529 10.460 -10.053 41 HA LYS 6 HA LYS 6 0.540 11.688 -12.412 42 HB2 LYS 6 HB2 LYS 6 -2.328 11.560 -11.921 43 HB3 LYS 6 HB3 LYS 6 -1.665 12.458 -13.114 44 HG2 LYS 6 HG2 LYS 6 -1.010 10.537 -14.262 45 HG3 LYS 6 HG3 LYS 6 -1.503 9.589 -13.027 46 HD2 LYS 6 HD2 LYS 6 -3.757 10.264 -13.461 47 HD3 LYS 6 HD3 LYS 6 -3.226 11.108 -14.755 48 HE2 LYS 6 HE2 LYS 6 -2.548 9.186 -15.842 49 HE3 LYS 6 HE3 LYS 6 -2.707 8.290 -14.486 50 HZ1 LYS 6 HZ1 LYS 6 -4.451 7.812 -15.990 51 HZ2 LYS 6 HZ2 LYS 6 -4.898 9.365 -15.990 52 HZ3 LYS 6 HZ3 LYS 6 -5.056 8.478 -14.647 53 HA PRO 7 HA PRO 7 0.235 13.829 -13.465 54 HB2 PRO 7 HB2 PRO 7 1.222 16.295 -13.499 55 HB3 PRO 7 HB3 PRO 7 -0.385 16.110 -13.270 56 HG2 PRO 7 HG2 PRO 7 1.626 16.541 -11.307 57 HG3 PRO 7 HG3 PRO 7 0.164 17.259 -11.423 58 HD2 PRO 7 HD2 PRO 7 0.588 15.234 -9.788 59 HD3 PRO 7 HD3 PRO 7 -0.889 15.529 -10.420 60 H GLY 8 H GLY 8 1.814 13.045 -14.657 61 HA2 GLY 8 HA2 GLY 8 3.962 12.463 -15.123 62 HA3 GLY 8 HA3 GLY 8 4.497 13.624 -14.105 63 H SER 9 H SER 9 6.175 11.768 -13.800 64 HA SER 9 HA SER 9 5.336 10.393 -11.428 65 HB2 SER 9 HB2 SER 9 5.121 8.684 -13.062 66 HB3 SER 9 HB3 SER 9 6.615 9.002 -13.639 67 HG SER 9 HG SER 9 6.706 8.461 -11.058 68 H ARG 10 H ARG 10 6.844 10.396 -9.792 69 HA ARG 10 HA ARG 10 9.128 11.899 -10.225 70 HB2 ARG 10 HB2 ARG 10 9.698 11.483 -7.962 71 HB3 ARG 10 HB3 ARG 10 8.106 11.829 -8.076 72 HG2 ARG 10 HG2 ARG 10 7.600 9.513 -7.845 73 HG3 ARG 10 HG3 ARG 10 9.193 9.191 -7.689 74 HD2 ARG 10 HD2 ARG 10 7.752 10.901 -5.851 75 HD3 ARG 10 HD3 ARG 10 8.060 9.327 -5.543 76 HE ARG 10 HE ARG 10 10.499 10.418 -6.022 77 HH11 ARG 10 HH11 ARG 10 11.872 11.104 -4.431 78 HH12 ARG 10 HH12 ARG 10 11.262 11.576 -2.880 79 HH21 ARG 10 HH21 ARG 10 7.958 10.956 -3.642 80 HH22 ARG 10 HH22 ARG 10 9.082 11.493 -2.439 81 H ALA 11 H ALA 11 8.543 8.613 -10.627 82 HA ALA 11 HA ALA 11 11.094 7.648 -10.242 83 HB1 ALA 11 HB1 ALA 11 9.180 6.170 -10.438 84 HB2 ALA 11 HB2 ALA 11 10.322 5.696 -11.479 85 HB3 ALA 11 HB3 ALA 11 9.047 6.539 -12.006 86 H ALA 12 H ALA 12 9.677 9.220 -12.939 87 HA ALA 12 HA ALA 12 11.620 8.548 -14.798 88 HB1 ALA 12 HB1 ALA 12 9.465 9.436 -15.477 89 HB2 ALA 12 HB2 ALA 12 10.637 10.328 -16.144 90 HB3 ALA 12 HB3 ALA 12 9.850 10.872 -14.841 91 H LEU 13 H LEU 13 11.489 10.957 -12.399 92 HA LEU 13 HA LEU 13 13.726 12.391 -13.418 93 HB2 LEU 13 HB2 LEU 13 12.277 12.752 -10.933 94 HB3 LEU 13 HB3 LEU 13 13.390 13.807 -11.495 95 HG LEU 13 HG LEU 13 10.925 13.310 -12.883 96 HD11 LEU 13 HD11 LEU 13 10.091 15.346 -11.893 97 HD12 LEU 13 HD12 LEU 13 11.439 15.467 -11.008 98 HD13 LEU 13 HD13 LEU 13 10.401 14.257 -10.738 99 HD21 LEU 13 HD21 LEU 13 11.400 15.349 -14.029 100 HD22 LEU 13 HD22 LEU 13 12.594 14.284 -14.263 101 HD23 LEU 13 HD23 LEU 13 12.785 15.494 -13.207 102 H CYS 14 H CYS 14 13.026 10.001 -11.171 103 HA CYS 14 HA CYS 14 15.217 10.186 -9.500 104 HB2 CYS 14 HB2 CYS 14 13.206 8.978 -9.079 105 HB3 CYS 14 HB3 CYS 14 13.640 7.899 -10.226 106 H SER 15 H SER 15 14.681 8.387 -12.392 107 HA SER 15 HA SER 15 17.016 6.920 -12.225 108 HB2 SER 15 HB2 SER 15 15.185 6.176 -13.614 109 HB3 SER 15 HB3 SER 15 15.390 7.467 -14.593 110 HG SER 15 HG SER 15 17.552 5.886 -14.282 111 H GLU 16 H GLU 16 19.026 7.053 -13.111 112 HA GLU 16 HA GLU 16 20.050 9.544 -13.667 113 HB2 GLU 16 HB2 GLU 16 21.125 6.905 -14.163 114 HB3 GLU 16 HB3 GLU 16 22.010 8.244 -14.466 115 HG2 GLU 16 HG2 GLU 16 22.675 7.396 -12.409 116 HG3 GLU 16 HG3 GLU 16 21.888 8.802 -12.142 117 H ALA 17 H ALA 17 18.366 7.404 -15.600 118 HA ALA 17 HA ALA 17 19.328 8.033 -18.083 119 HB1 ALA 17 HB1 ALA 17 17.773 6.195 -17.698 120 HB2 ALA 17 HB2 ALA 17 17.217 7.119 -18.904 121 HB3 ALA 17 HB3 ALA 17 16.585 7.257 -17.421 122 H PHE 18 H PHE 18 17.751 10.071 -16.001 123 HA PHE 18 HA PHE 18 16.511 11.647 -17.983 124 HB2 PHE 18 HB2 PHE 18 15.753 11.367 -15.603 125 HB3 PHE 18 HB3 PHE 18 16.897 12.470 -15.227 126 HD1 PHE 18 HD1 PHE 18 16.458 14.805 -15.412 127 HD2 PHE 18 HD2 PHE 18 13.831 12.049 -17.090 128 HE1 PHE 18 HE1 PHE 18 14.911 16.590 -15.900 129 HE2 PHE 18 HE2 PHE 18 12.273 13.827 -17.589 130 HZ PHE 18 HZ PHE 18 12.823 16.108 -17.008 131 H GLY 19 H GLY 19 19.664 11.388 -17.151 132 HA2 GLY 19 HA2 GLY 19 20.370 13.614 -18.625 133 HA3 GLY 19 HA3 GLY 19 20.481 14.011 -17.045 134 H PHE 20 H PHE 20 21.422 11.430 -16.213 135 HA PHE 20 HA PHE 20 23.290 10.418 -15.848 136 HB2 PHE 20 HB2 PHE 20 22.968 9.871 -18.289 137 HB3 PHE 20 HB3 PHE 20 24.247 10.851 -18.554 138 HD1 PHE 20 HD1 PHE 20 23.360 7.875 -16.662 139 HD2 PHE 20 HD2 PHE 20 26.404 9.939 -18.610 140 HE1 PHE 20 HE1 PHE 20 24.861 6.029 -16.257 141 HE2 PHE 20 HE2 PHE 20 27.914 8.096 -18.220 142 HZ PHE 20 HZ PHE 20 27.144 6.135 -17.038 143 H LEU 21 H LEU 21 23.506 13.551 -16.127 144 HA LEU 21 HA LEU 21 26.305 13.827 -16.014 145 HB2 LEU 21 HB2 LEU 21 24.267 15.750 -15.311 146 HB3 LEU 21 HB3 LEU 21 25.852 16.123 -15.437 147 HG LEU 21 HG LEU 21 24.212 15.325 -17.660 148 HD11 LEU 21 HD11 LEU 21 24.306 17.654 -18.319 149 HD12 LEU 21 HD12 LEU 21 25.126 18.000 -16.969 150 HD13 LEU 21 HD13 LEU 21 23.586 17.515 -16.878 151 HD21 LEU 21 HD21 LEU 21 26.042 15.993 -19.057 152 HD22 LEU 21 HD22 LEU 21 26.498 14.791 -18.076 153 HD23 LEU 21 HD23 LEU 21 26.932 16.314 -17.745 154 H ASN 22 H ASN 22 23.820 13.253 -13.805 155 HA ASN 22 HA ASN 22 25.592 12.703 -11.696 156 HB2 ASN 22 HB2 ASN 22 25.317 15.121 -11.443 157 HB3 ASN 22 HB3 ASN 22 23.734 14.851 -11.145 158 HD21 ASN 22 HD21 ASN 22 24.608 14.997 -7.785 159 HD22 ASN 22 HD22 ASN 22 23.878 15.854 -9.101 160 H LEU 23 H LEU 23 24.361 11.731 -9.813 161 HA LEU 23 HA LEU 23 22.039 10.368 -10.606 162 HB2 LEU 23 HB2 LEU 23 23.334 10.596 -8.059 163 HB3 LEU 23 HB3 LEU 23 21.928 9.779 -8.212 164 HG LEU 23 HG LEU 23 23.128 8.348 -9.804 165 HD11 LEU 23 HD11 LEU 23 25.501 8.155 -9.560 166 HD12 LEU 23 HD12 LEU 23 25.511 9.458 -8.603 167 HD13 LEU 23 HD13 LEU 23 25.107 9.603 -10.162 168 HD21 LEU 23 HD21 LEU 23 23.985 6.977 -7.968 169 HD22 LEU 23 HD22 LEU 23 22.538 7.585 -7.580 170 HD23 LEU 23 HD23 LEU 23 23.883 8.254 -6.982 171 H ASN 24 H ASN 24 19.843 10.659 -9.618 172 HA ASN 24 HA ASN 24 19.476 13.234 -8.452 173 HB2 ASN 24 HB2 ASN 24 19.222 13.384 -10.931 174 HB3 ASN 24 HB3 ASN 24 17.855 12.508 -10.753 175 HD21 ASN 24 HD21 ASN 24 16.488 15.759 -10.978 176 HD22 ASN 24 HD22 ASN 24 17.000 14.415 -11.943 177 H CYS 25 H CYS 25 19.217 11.105 -6.924 178 HA CYS 25 HA CYS 25 16.471 11.196 -6.320 179 HB2 CYS 25 HB2 CYS 25 17.117 9.294 -7.897 180 HB3 CYS 25 HB3 CYS 25 17.508 8.551 -6.497 181 H GLY 26 H GLY 26 19.466 9.704 -5.391 182 HA2 GLY 26 HA2 GLY 26 20.330 9.608 -3.290 183 HA3 GLY 26 HA3 GLY 26 19.043 10.420 -2.697 184 H SER 27 H SER 27 19.994 8.550 -1.065 185 HA SER 27 HA SER 27 18.963 6.016 -1.598 186 HB2 SER 27 HB2 SER 27 20.866 6.482 -0.068 187 HB3 SER 27 HB3 SER 27 19.767 6.943 1.049 188 HG SER 27 HG SER 27 19.745 4.987 1.627 189 H VAL 28 H VAL 28 17.454 8.732 -0.504 190 HA VAL 28 HA VAL 28 15.631 7.632 1.221 191 HB VAL 28 HB VAL 28 14.719 9.941 -0.258 192 HG11 VAL 28 HG11 VAL 28 14.193 10.815 1.929 193 HG12 VAL 28 HG12 VAL 28 14.910 9.538 2.613 194 HG13 VAL 28 HG13 VAL 28 13.556 9.339 1.752 195 HG21 VAL 28 HG21 VAL 28 16.319 11.468 0.723 196 HG22 VAL 28 HG22 VAL 28 17.084 10.407 -0.228 197 HG23 VAL 28 HG23 VAL 28 17.113 10.221 1.378 198 H MET 29 H MET 29 15.891 7.189 -1.984 199 HA MET 29 HA MET 29 13.290 7.210 -2.803 200 HB2 MET 29 HB2 MET 29 14.135 6.064 -4.772 201 HB3 MET 29 HB3 MET 29 15.194 7.221 -4.316 202 HG2 MET 29 HG2 MET 29 16.582 5.616 -4.689 203 HG3 MET 29 HG3 MET 29 16.291 5.373 -3.100 204 HE1 MET 29 HE1 MET 29 16.684 1.702 -4.179 205 HE2 MET 29 HE2 MET 29 17.114 2.801 -3.073 206 HE3 MET 29 HE3 MET 29 17.589 2.971 -4.609 207 H TYR 30 H TYR 30 14.468 4.991 -0.697 208 HA TYR 30 HA TYR 30 13.295 2.723 -1.837 209 HB2 TYR 30 HB2 TYR 30 15.132 2.507 -0.315 210 HB3 TYR 30 HB3 TYR 30 14.250 3.191 0.876 211 HD1 TYR 30 HD1 TYR 30 14.627 0.150 -1.049 212 HD2 TYR 30 HD2 TYR 30 12.792 1.872 2.267 213 HE1 TYR 30 HE1 TYR 30 13.913 -2.039 -0.297 214 HE2 TYR 30 HE2 TYR 30 12.057 -0.301 2.994 215 HH TYR 30 HH TYR 30 12.411 -2.572 2.786 216 H GLU 31 H GLU 31 12.206 4.900 0.673 217 HA GLU 31 HA GLU 31 9.592 4.212 -0.050 218 HB2 GLU 31 HB2 GLU 31 8.762 3.620 2.128 219 HB3 GLU 31 HB3 GLU 31 9.847 2.538 1.564 220 HG2 GLU 31 HG2 GLU 31 11.488 3.470 3.038 221 HG3 GLU 31 HG3 GLU 31 10.341 4.463 3.645 222 HA PRO 32 HA PRO 32 10.134 8.437 1.440 223 HB2 PRO 32 HB2 PRO 32 9.780 9.876 -0.778 224 HB3 PRO 32 HB3 PRO 32 11.245 9.203 -0.513 225 HG2 PRO 32 HG2 PRO 32 9.115 8.163 -2.111 226 HG3 PRO 32 HG3 PRO 32 10.685 8.325 -2.529 227 HD2 PRO 32 HD2 PRO 32 9.808 6.032 -1.701 228 HD3 PRO 32 HD3 PRO 32 11.318 6.511 -1.303 229 H GLN 33 H GLN 33 7.685 6.839 -0.055 230 HA GLN 33 HA GLN 33 5.790 8.838 0.692 231 HB2 GLN 33 HB2 GLN 33 5.703 7.653 -1.504 232 HB3 GLN 33 HB3 GLN 33 5.024 6.426 -0.666 233 HG2 GLN 33 HG2 GLN 33 3.138 7.654 -0.193 234 HG3 GLN 33 HG3 GLN 33 3.864 9.062 -0.591 235 HE21 GLN 33 HE21 GLN 33 1.475 7.585 -3.168 236 HE22 GLN 33 HE22 GLN 33 1.430 7.395 -1.447 237 H SER 34 H SER 34 7.292 6.630 2.410 238 HA SER 34 HA SER 34 4.904 5.687 3.732 239 HB2 SER 34 HB2 SER 34 6.906 4.208 3.150 240 HB3 SER 34 HB3 SER 34 7.538 4.811 4.530 241 HG SER 34 HG SER 34 5.813 3.986 5.662 242 H LEU 35 H LEU 35 4.259 7.654 4.709 243 HA LEU 35 HA LEU 35 5.820 8.240 7.067 244 HB2 LEU 35 HB2 LEU 35 4.228 10.130 5.603 245 HB3 LEU 35 HB3 LEU 35 4.980 10.470 7.012 246 HG LEU 35 HG LEU 35 6.380 9.889 4.569 247 HD11 LEU 35 HD11 LEU 35 6.817 12.273 4.479 248 HD12 LEU 35 HD12 LEU 35 5.901 12.487 5.795 249 HD13 LEU 35 HD13 LEU 35 5.224 12.002 4.408 250 HD21 LEU 35 HD21 LEU 35 8.336 10.679 5.682 251 HD22 LEU 35 HD22 LEU 35 7.732 9.394 6.456 252 HD23 LEU 35 HD23 LEU 35 7.488 10.880 7.044 253 H GLU 36 H GLU 36 4.780 7.843 9.018 254 HA GLU 36 HA GLU 36 1.900 7.931 8.930 255 HB2 GLU 36 HB2 GLU 36 3.488 5.868 10.145 256 HB3 GLU 36 HB3 GLU 36 1.957 6.126 10.652 257 HG2 GLU 36 HG2 GLU 36 1.170 5.655 8.468 258 HG3 GLU 36 HG3 GLU 36 2.703 5.355 7.992 259 H ALA 37 H ALA 37 0.811 8.710 10.784 260 HA ALA 37 HA ALA 37 2.519 9.678 12.896 261 HB1 ALA 37 HB1 ALA 37 1.983 11.603 11.559 262 HB2 ALA 37 HB2 ALA 37 1.237 11.742 12.987 263 HB3 ALA 37 HB3 ALA 37 0.405 11.273 11.682 264 H LYS 38 H LYS 38 1.868 8.961 14.879 265 HA LYS 38 HA LYS 38 -0.488 7.502 15.196 266 HB2 LYS 38 HB2 LYS 38 1.416 7.265 16.625 267 HB3 LYS 38 HB3 LYS 38 1.083 8.725 17.276 268 HG2 LYS 38 HG2 LYS 38 -0.593 7.936 18.508 269 HG3 LYS 38 HG3 LYS 38 -0.953 6.755 17.439 270 HD2 LYS 38 HD2 LYS 38 0.899 5.496 18.151 271 HD3 LYS 38 HD3 LYS 38 1.369 6.702 19.147 272 HE2 LYS 38 HE2 LYS 38 -0.331 6.307 20.611 273 HE3 LYS 38 HE3 LYS 38 -1.199 5.476 19.505 274 HZ1 LYS 38 HZ1 LYS 38 -0.277 3.985 21.106 275 HZ2 LYS 38 HZ2 LYS 38 1.212 4.501 20.744 276 HZ3 LYS 38 HZ3 LYS 38 0.353 3.678 19.648 277 H LYS 39 H LYS 39 -2.546 8.038 15.969 278 HA LYS 39 HA LYS 39 -3.456 10.572 15.418 279 HB2 LYS 39 HB2 LYS 39 -4.626 8.546 17.084 280 HB3 LYS 39 HB3 LYS 39 -5.423 9.914 16.685 281 HG2 LYS 39 HG2 LYS 39 -5.486 9.318 14.450 282 HG3 LYS 39 HG3 LYS 39 -4.440 8.087 14.691 283 HD2 LYS 39 HD2 LYS 39 -6.092 6.964 15.984 284 HD3 LYS 39 HD3 LYS 39 -7.138 8.179 15.677 285 HE2 LYS 39 HE2 LYS 39 -7.083 7.693 13.378 286 HE3 LYS 39 HE3 LYS 39 -5.948 6.545 13.624 287 HZ1 LYS 39 HZ1 LYS 39 -8.072 5.544 13.336 288 HZ2 LYS 39 HZ2 LYS 39 -8.652 6.389 14.587 289 HZ3 LYS 39 HZ3 LYS 39 -7.528 5.252 14.831 290 H GLY 40 H GLY 40 -3.539 12.496 16.447 291 HA2 GLY 40 HA2 GLY 40 -1.816 12.714 18.650 292 HA3 GLY 40 HA3 GLY 40 -2.550 13.942 17.862 293 H PHE 41 H PHE 41 -3.406 11.356 20.061 294 HA PHE 41 HA PHE 41 -4.972 13.237 21.579 295 HB2 PHE 41 HB2 PHE 41 -4.899 10.364 21.784 296 HB3 PHE 41 HB3 PHE 41 -5.855 11.316 22.704 297 HD1 PHE 41 HD1 PHE 41 -5.716 9.497 19.749 298 HD2 PHE 41 HD2 PHE 41 -7.578 12.797 21.470 299 HE1 PHE 41 HE1 PHE 41 -7.435 9.404 18.056 300 HE2 PHE 41 HE2 PHE 41 -9.286 12.731 19.770 301 HZ PHE 41 HZ PHE 41 -9.216 11.033 18.056 302 HA PRO 42 HA PRO 42 -5.024 14.647 23.335 303 HB2 PRO 42 HB2 PRO 42 -3.702 16.436 24.782 304 HB3 PRO 42 HB3 PRO 42 -4.309 15.129 25.552 305 HG2 PRO 42 HG2 PRO 42 -1.654 15.507 24.590 306 HG3 PRO 42 HG3 PRO 42 -2.118 14.997 26.071 307 HD2 PRO 42 HD2 PRO 42 -1.417 13.263 24.251 308 HD3 PRO 42 HD3 PRO 42 -2.591 12.892 25.324 309 H HIS 43 H HIS 43 -5.348 16.708 22.389 310 HA HIS 43 HA HIS 43 -3.963 16.780 20.015 311 HB2 HIS 43 HB2 HIS 43 -6.270 17.671 20.523 312 HB3 HIS 43 HB3 HIS 43 -5.504 19.060 20.912 313 HD1 HIS 43 HD1 HIS 43 -6.358 16.927 17.992 314 HD2 HIS 43 HD2 HIS 43 -4.691 20.592 18.741 315 HE1 HIS 43 HE1 HIS 43 -6.175 18.168 15.841 316 HE2 HIS 43 HE2 HIS 43 -5.157 20.374 16.267 317 H SER 44 H SER 44 -3.456 18.635 22.849 318 HA SER 44 HA SER 44 -1.906 20.158 23.340 319 HB2 SER 44 HB2 SER 44 -0.434 18.256 23.019 320 HB3 SER 44 HB3 SER 44 -0.142 18.765 21.495 321 HG SER 44 HG SER 44 1.460 19.348 23.000 322 H GLY 45 H GLY 45 -0.068 20.350 20.490 323 HA2 GLY 45 HA2 GLY 45 -0.672 23.036 20.090 324 HA3 GLY 45 HA3 GLY 45 0.166 22.088 19.058 325 HA PRO 46 HA PRO 46 -4.151 22.741 17.743 326 HB2 PRO 46 HB2 PRO 46 -4.238 24.880 16.103 327 HB3 PRO 46 HB3 PRO 46 -4.316 25.127 17.716 328 HG2 PRO 46 HG2 PRO 46 -1.999 25.249 16.046 329 HG3 PRO 46 HG3 PRO 46 -2.495 26.353 17.143 330 HD2 PRO 46 HD2 PRO 46 -0.669 24.618 17.808 331 HD3 PRO 46 HD3 PRO 46 -1.776 25.080 18.916 332 H ALA 47 H ALA 47 -1.432 22.799 15.713 333 HA ALA 47 HA ALA 47 -2.871 22.243 13.403 334 HB1 ALA 47 HB1 ALA 47 -0.649 23.242 13.316 335 HB2 ALA 47 HB2 ALA 47 -0.680 21.924 12.380 336 HB3 ALA 47 HB3 ALA 47 -0.005 21.858 13.848 337 H ASP 48 H ASP 48 -3.813 20.471 12.645 338 HA ASP 48 HA ASP 48 -3.698 18.128 14.050 339 HB2 ASP 48 HB2 ASP 48 -4.720 18.704 11.392 340 HB3 ASP 48 HB3 ASP 48 -4.904 17.214 12.035 341 H GLY 49 H GLY 49 -2.818 16.098 13.809 342 HA2 GLY 49 HA2 GLY 49 -1.438 14.552 12.897 343 HA3 GLY 49 HA3 GLY 49 -1.217 15.486 11.575 344 H GLN 50 H GLN 50 -0.281 17.753 13.141 345 HA GLN 50 HA GLN 50 2.401 17.127 12.905 346 HB2 GLN 50 HB2 GLN 50 1.280 19.518 14.120 347 HB3 GLN 50 HB3 GLN 50 2.791 19.412 13.507 348 HG2 GLN 50 HG2 GLN 50 0.330 19.546 12.035 349 HG3 GLN 50 HG3 GLN 50 1.601 20.566 11.928 350 HE21 GLN 50 HE21 GLN 50 1.270 17.722 9.295 351 HE22 GLN 50 HE22 GLN 50 0.000 18.370 10.279 352 H ILE 51 H ILE 51 0.410 16.566 15.396 353 HA ILE 51 HA ILE 51 1.993 17.087 17.549 354 HB ILE 51 HB ILE 51 -0.018 14.954 17.340 355 HG12 ILE 51 HG12 ILE 51 -1.313 16.735 18.679 356 HG13 ILE 51 HG13 ILE 51 -0.339 17.727 17.823 357 HG21 ILE 51 HG21 ILE 51 -0.218 15.048 19.770 358 HG22 ILE 51 HG22 ILE 51 0.957 16.158 19.823 359 HG23 ILE 51 HG23 ILE 51 1.294 14.645 19.361 360 HD11 ILE 51 HD11 ILE 51 -2.458 17.509 16.717 361 HD12 ILE 51 HD12 ILE 51 -2.263 15.907 16.624 362 HD13 ILE 51 HD13 ILE 51 -1.298 16.889 15.776 363 H ALA 52 H ALA 52 1.556 14.072 15.821 364 HA ALA 52 HA ALA 52 3.627 12.862 17.321 365 HB1 ALA 52 HB1 ALA 52 1.656 11.563 16.749 366 HB2 ALA 52 HB2 ALA 52 2.975 10.824 16.175 367 HB3 ALA 52 HB3 ALA 52 2.033 11.684 15.181 368 H SER 53 H SER 53 3.368 14.328 14.284 369 HA SER 53 HA SER 53 5.684 13.052 13.281 370 HB2 SER 53 HB2 SER 53 5.257 14.386 11.266 371 HB3 SER 53 HB3 SER 53 3.886 13.638 11.743 372 HG SER 53 HG SER 53 4.584 16.263 12.142 373 H ALA 54 H ALA 54 5.467 15.252 15.488 374 HA ALA 54 HA ALA 54 6.694 16.981 16.190 375 HB1 ALA 54 HB1 ALA 54 8.500 15.371 16.223 376 HB2 ALA 54 HB2 ALA 54 9.101 16.838 15.907 377 HB3 ALA 54 HB3 ALA 54 8.899 15.771 14.709 378 H GLY 55 H GLY 55 5.050 17.750 14.275 379 HA2 GLY 55 HA2 GLY 55 6.268 18.855 12.048 380 HA3 GLY 55 HA3 GLY 55 4.728 19.105 12.532 381 H GLY 56 H GLY 56 7.123 20.083 14.741 382 HA2 GLY 56 HA2 GLY 56 6.588 22.824 14.356 383 HA3 GLY 56 HA3 GLY 56 7.763 22.204 15.306 384 H LEU 57 H LEU 57 8.569 20.530 12.976 385 HA LEU 57 HA LEU 57 10.573 22.054 11.899 386 HB2 LEU 57 HB2 LEU 57 9.380 19.604 10.896 387 HB3 LEU 57 HB3 LEU 57 10.779 20.197 10.297 388 HG LEU 57 HG LEU 57 10.520 19.322 13.025 389 HD11 LEU 57 HD11 LEU 57 11.614 17.284 12.338 390 HD12 LEU 57 HD12 LEU 57 11.571 17.780 10.799 391 HD13 LEU 57 HD13 LEU 57 10.196 17.433 11.575 392 HD21 LEU 57 HD21 LEU 57 12.917 19.323 13.036 393 HD22 LEU 57 HD22 LEU 57 12.364 20.804 12.695 394 HD23 LEU 57 HD23 LEU 57 12.930 19.860 11.511 395 H PHE 58 H PHE 58 7.368 22.144 11.171 396 HA PHE 58 HA PHE 58 7.226 22.679 8.532 397 HB2 PHE 58 HB2 PHE 58 5.321 22.554 10.012 398 HB3 PHE 58 HB3 PHE 58 5.751 23.978 10.686 399 HD1 PHE 58 HD1 PHE 58 5.229 26.089 9.618 400 HD2 PHE 58 HD2 PHE 58 4.239 22.471 7.819 401 HE1 PHE 58 HE1 PHE 58 3.767 27.253 8.099 402 HE2 PHE 58 HE2 PHE 58 2.785 23.624 6.284 403 HZ PHE 58 HZ PHE 58 2.544 26.027 6.424 404 H GLY 59 H GLY 59 8.385 24.861 10.969 405 HA2 GLY 59 HA2 GLY 59 8.438 27.080 9.234 406 HA3 GLY 59 HA3 GLY 59 9.173 26.982 10.689 407 H GLY 60 H GLY 60 10.635 24.561 9.934 408 HA2 GLY 60 HA2 GLY 60 12.865 25.905 8.817 409 HA3 GLY 60 HA3 GLY 60 12.856 24.405 9.463 410 H ILE 61 H ILE 61 10.458 24.462 7.220 411 HA ILE 61 HA ILE 61 11.676 22.585 5.700 412 HB ILE 61 HB ILE 61 9.443 24.307 4.865 413 HG12 ILE 61 HG12 ILE 61 8.947 23.086 6.831 414 HG13 ILE 61 HG13 ILE 61 7.970 22.635 5.602 415 HG21 ILE 61 HG21 ILE 61 8.807 22.639 3.227 416 HG22 ILE 61 HG22 ILE 61 10.121 21.771 3.596 417 HG23 ILE 61 HG23 ILE 61 10.279 23.216 2.887 418 HD11 ILE 61 HD11 ILE 61 8.643 20.707 6.861 419 HD12 ILE 61 HD12 ILE 61 10.199 21.044 6.576 420 HD13 ILE 61 HD13 ILE 61 9.232 20.597 5.359 421 H LEU 62 H LEU 62 11.768 25.989 5.182 422 HA LEU 62 HA LEU 62 12.740 25.881 2.607 423 HB2 LEU 62 HB2 LEU 62 12.689 27.916 4.604 424 HB3 LEU 62 HB3 LEU 62 13.693 28.180 3.344 425 HG LEU 62 HG LEU 62 11.773 28.017 1.887 426 HD11 LEU 62 HD11 LEU 62 9.575 28.274 2.785 427 HD12 LEU 62 HD12 LEU 62 10.165 28.122 4.282 428 HD13 LEU 62 HD13 LEU 62 10.221 26.870 3.259 429 HD21 LEU 62 HD21 LEU 62 11.011 30.275 2.390 430 HD22 LEU 62 HD22 LEU 62 12.620 30.189 2.523 431 HD23 LEU 62 HD23 LEU 62 11.698 30.172 3.850 432 H ASP 63 H ASP 63 14.339 25.593 5.603 433 HA ASP 63 HA ASP 63 16.923 26.030 4.552 434 HB2 ASP 63 HB2 ASP 63 16.168 26.538 6.885 435 HB3 ASP 63 HB3 ASP 63 16.356 24.943 7.181 436 H GLN 64 H GLN 64 14.925 23.437 4.677 437 HA GLN 64 HA GLN 64 16.794 21.402 5.004 438 HB2 GLN 64 HB2 GLN 64 14.095 21.265 3.966 439 HB3 GLN 64 HB3 GLN 64 14.980 19.929 4.279 440 HG2 GLN 64 HG2 GLN 64 15.079 20.549 6.576 441 HG3 GLN 64 HG3 GLN 64 14.159 21.859 6.252 442 HE21 GLN 64 HE21 GLN 64 12.116 19.132 7.700 443 HE22 GLN 64 HE22 GLN 64 13.621 19.851 8.167 444 H GLN 65 H GLN 65 16.932 23.418 2.696 445 HA GLN 65 HA GLN 65 16.998 21.930 0.401 446 HB2 GLN 65 HB2 GLN 65 18.321 23.861 -0.459 447 HB3 GLN 65 HB3 GLN 65 16.838 24.208 0.128 448 HG2 GLN 65 HG2 GLN 65 17.897 24.942 2.177 449 HG3 GLN 65 HG3 GLN 65 19.342 24.746 1.443 450 HE21 GLN 65 HE21 GLN 65 18.739 28.264 1.093 451 HE22 GLN 65 HE22 GLN 65 19.233 27.120 2.297 452 H SER 66 H SER 66 18.016 20.021 0.656 453 HA SER 66 HA SER 66 20.870 20.018 0.278 454 HB2 SER 66 HB2 SER 66 20.620 19.900 2.685 455 HB3 SER 66 HB3 SER 66 19.760 18.525 2.492 456 HG SER 66 HG SER 66 21.469 17.418 2.072 457 H GLU 67 H GLU 67 21.300 17.317 0.217 458 HA GLU 67 HA GLU 67 19.797 16.398 -1.898 459 HB2 GLU 67 HB2 GLU 67 21.363 14.852 -0.020 460 HB3 GLU 67 HB3 GLU 67 20.798 14.235 -1.423 461 HG2 GLU 67 HG2 GLU 67 22.132 15.870 -2.593 462 HG3 GLU 67 HG3 GLU 67 22.792 16.286 -1.158 463 H ASN 68 H ASN 68 19.229 16.307 1.442 464 HA ASN 68 HA ASN 68 17.175 14.370 1.247 465 HB2 ASN 68 HB2 ASN 68 18.053 15.894 3.578 466 HB3 ASN 68 HB3 ASN 68 17.041 14.615 3.671 467 HD21 ASN 68 HD21 ASN 68 19.487 12.153 3.384 468 HD22 ASN 68 HD22 ASN 68 17.797 12.485 3.202 469 H ARG 69 H ARG 69 16.909 17.114 0.043 470 HA ARG 69 HA ARG 69 14.873 18.440 1.421 471 HB2 ARG 69 HB2 ARG 69 16.300 19.317 -0.410 472 HB3 ARG 69 HB3 ARG 69 15.233 18.615 -1.428 473 HG2 ARG 69 HG2 ARG 69 13.538 20.067 -0.703 474 HG3 ARG 69 HG3 ARG 69 14.542 20.724 0.405 475 HD2 ARG 69 HD2 ARG 69 15.982 21.282 -1.588 476 HD3 ARG 69 HD3 ARG 69 14.604 21.076 -2.440 477 HE ARG 69 HE ARG 69 13.862 22.796 -0.518 478 HH11 ARG 69 HH11 ARG 69 13.985 25.006 -0.602 479 HH12 ARG 69 HH12 ARG 69 15.029 25.790 -1.740 480 HH21 ARG 69 HH21 ARG 69 16.321 22.874 -3.042 481 HH22 ARG 69 HH22 ARG 69 16.328 24.606 -3.098 482 H TRP 70 H TRP 70 12.571 18.735 0.596 483 HA TRP 70 HA TRP 70 11.466 16.150 0.212 484 HB2 TRP 70 HB2 TRP 70 10.205 18.741 0.504 485 HB3 TRP 70 HB3 TRP 70 9.328 17.382 0.279 486 HD1 TRP 70 HD1 TRP 70 11.078 19.213 2.913 487 HE1 TRP 70 HE1 TRP 70 10.816 18.186 5.177 488 HE3 TRP 70 HE3 TRP 70 8.931 14.956 1.413 489 HZ2 TRP 70 HZ2 TRP 70 9.748 15.754 6.138 490 HZ3 TRP 70 HZ3 TRP 70 8.335 13.298 3.070 491 HH2 TRP 70 HH2 TRP 70 8.735 13.713 5.418 492 H PHE 71 H PHE 71 10.118 15.526 -1.585 493 HA PHE 71 HA PHE 71 11.199 16.193 -3.989 494 HB2 PHE 71 HB2 PHE 71 9.965 14.192 -3.731 495 HB3 PHE 71 HB3 PHE 71 8.586 15.044 -3.527 496 HD1 PHE 71 HD1 PHE 71 11.082 14.181 -5.991 497 HD2 PHE 71 HD2 PHE 71 7.257 15.703 -5.383 498 HE1 PHE 71 HE1 PHE 71 10.688 14.121 -8.369 499 HE2 PHE 71 HE2 PHE 71 6.842 15.634 -7.758 500 HZ PHE 71 HZ PHE 71 8.554 14.831 -9.256 501 H LYS 72 H LYS 72 11.006 17.789 -5.415 502 HA LYS 72 HA LYS 72 8.765 19.565 -5.148 503 HB2 LYS 72 HB2 LYS 72 10.664 20.497 -3.970 504 HB3 LYS 72 HB3 LYS 72 11.537 20.415 -5.348 505 HG2 LYS 72 HG2 LYS 72 10.136 22.045 -6.325 506 HG3 LYS 72 HG3 LYS 72 9.281 22.136 -4.936 507 HD2 LYS 72 HD2 LYS 72 11.284 22.809 -3.803 508 HD3 LYS 72 HD3 LYS 72 12.055 22.828 -5.242 509 HE2 LYS 72 HE2 LYS 72 11.186 24.753 -5.800 510 HE3 LYS 72 HE3 LYS 72 9.714 24.348 -5.221 511 HZ1 LYS 72 HZ1 LYS 72 10.620 26.133 -3.971 512 HZ2 LYS 72 HZ2 LYS 72 11.910 25.231 -3.602 513 HZ3 LYS 72 HZ3 LYS 72 10.453 24.830 -3.028 514 H HIS 73 H HIS 73 7.742 20.007 -7.031 515 HA HIS 73 HA HIS 73 9.432 19.915 -9.361 516 HB2 HIS 73 HB2 HIS 73 7.717 18.109 -9.188 517 HB3 HIS 73 HB3 HIS 73 6.651 19.267 -9.626 518 HD1 HIS 73 HD1 HIS 73 9.788 17.676 -10.947 519 HD2 HIS 73 HD2 HIS 73 6.422 19.562 -12.329 520 HE1 HIS 73 HE1 HIS 73 9.822 17.632 -13.437 521 HE2 HIS 73 HE2 HIS 73 7.799 18.764 -14.290 522 H ILE 74 H ILE 74 9.151 21.419 -11.057 523 HA ILE 74 HA ILE 74 7.746 23.782 -10.268 524 HB ILE 74 HB ILE 74 9.451 23.436 -12.608 525 HG12 ILE 74 HG12 ILE 74 10.168 24.806 -10.173 526 HG13 ILE 74 HG13 ILE 74 10.622 23.269 -10.489 527 HG21 ILE 74 HG21 ILE 74 9.401 25.856 -12.809 528 HG22 ILE 74 HG22 ILE 74 8.384 25.945 -11.555 529 HG23 ILE 74 HG23 ILE 74 7.900 25.269 -12.942 530 HD11 ILE 74 HD11 ILE 74 12.428 24.770 -10.965 531 HD12 ILE 74 HD12 ILE 74 11.503 25.572 -12.021 532 HD13 ILE 74 HD13 ILE 74 11.953 24.051 -12.334 533 H MET 75 H MET 75 5.772 24.424 -11.244 534 HA MET 75 HA MET 75 4.942 23.145 -13.680 535 HB2 MET 75 HB2 MET 75 4.223 21.710 -11.820 536 HB3 MET 75 HB3 MET 75 3.214 22.920 -11.391 537 HG2 MET 75 HG2 MET 75 2.041 22.706 -13.338 538 HG3 MET 75 HG3 MET 75 3.112 21.611 -13.906 539 HE1 MET 75 HE1 MET 75 -0.099 19.432 -13.358 540 HE2 MET 75 HE2 MET 75 0.999 19.876 -14.459 541 HE3 MET 75 HE3 MET 75 -0.053 20.961 -13.883 542 H THR 76 H THR 76 2.910 24.241 -14.564 543 HA THR 76 HA THR 76 3.041 26.993 -13.820 544 HB THR 76 HB THR 76 1.667 27.325 -15.869 545 HG1 THR 76 HG1 THR 76 0.567 25.638 -16.355 546 HG21 THR 76 HG21 THR 76 3.394 26.734 -17.431 547 HG22 THR 76 HG22 THR 76 4.075 25.760 -16.335 548 HG23 THR 76 HG23 THR 76 4.087 27.361 -16.112 549 H GLY 77 H GLY 77 0.899 28.281 -13.751 550 HA2 GLY 77 HA2 GLY 77 -0.892 27.095 -11.980 551 HA3 GLY 77 HA3 GLY 77 -1.121 28.509 -12.765 552 H GLY 78 H GLY 78 -3.393 27.327 -12.443 553 HA2 GLY 78 HA2 GLY 78 -5.001 26.912 -14.201 554 HA3 GLY 78 HA3 GLY 78 -3.928 25.916 -14.924 555 H GLU 79 H GLU 79 -6.074 24.483 -14.713 556 HA GLU 79 HA GLU 79 -6.356 23.460 -12.103 557 HB2 GLU 79 HB2 GLU 79 -8.089 22.213 -12.782 558 HB3 GLU 79 HB3 GLU 79 -8.165 23.519 -13.760 559 HG2 GLU 79 HG2 GLU 79 -8.300 22.179 -15.444 560 HG3 GLU 79 HG3 GLU 79 -6.771 21.691 -15.139 561 H HIS 80 H HIS 80 -5.667 21.543 -11.189 562 HA HIS 80 HA HIS 80 -3.672 20.122 -12.728 563 HB2 HIS 80 HB2 HIS 80 -3.584 20.762 -9.910 564 HB3 HIS 80 HB3 HIS 80 -2.546 19.707 -10.601 565 HD1 HIS 80 HD1 HIS 80 -0.672 21.388 -9.566 566 HD2 HIS 80 HD2 HIS 80 -2.897 22.726 -12.738 567 HE1 HIS 80 HE1 HIS 80 0.445 23.392 -10.536 568 HE2 HIS 80 HE2 HIS 80 -0.870 24.199 -12.454 569 H THR 81 H THR 81 -4.002 17.888 -12.854 570 HA THR 81 HA THR 81 -6.044 16.847 -11.104 571 HB THR 81 HB THR 81 -5.170 15.665 -13.606 572 HG1 THR 81 HG1 THR 81 -6.384 17.632 -13.762 573 HG21 THR 81 HG21 THR 81 -7.065 14.197 -13.348 574 HG22 THR 81 HG22 THR 81 -7.436 14.901 -11.940 575 HG23 THR 81 HG23 THR 81 -6.093 14.010 -12.069 576 H PHE 82 H PHE 82 -5.324 15.720 -9.382 577 HA PHE 82 HA PHE 82 -2.722 14.493 -9.589 578 HB2 PHE 82 HB2 PHE 82 -4.170 15.450 -7.298 579 HB3 PHE 82 HB3 PHE 82 -2.928 14.408 -7.103 580 HD1 PHE 82 HD1 PHE 82 -0.648 15.127 -7.257 581 HD2 PHE 82 HD2 PHE 82 -3.752 17.763 -8.111 582 HE1 PHE 82 HE1 PHE 82 0.917 16.964 -7.232 583 HE2 PHE 82 HE2 PHE 82 -2.205 19.615 -8.053 584 HZ PHE 82 HZ PHE 82 0.138 19.216 -7.617 585 H THR 83 H THR 83 -2.506 12.262 -9.309 586 HA THR 83 HA THR 83 -4.863 10.868 -8.398 587 HB THR 83 HB THR 83 -3.267 9.843 -10.594 588 HG1 THR 83 HG1 THR 83 -5.060 10.371 -11.882 589 HG21 THR 83 HG21 THR 83 -5.019 8.235 -10.817 590 HG22 THR 83 HG22 THR 83 -5.810 8.895 -9.570 591 HG23 THR 83 HG23 THR 83 -4.408 8.128 -9.324 592 H TRP 84 H TRP 84 -4.416 9.650 -6.644 593 HA TRP 84 HA TRP 84 -1.622 8.999 -6.126 594 HB2 TRP 84 HB2 TRP 84 -3.757 9.448 -4.259 595 HB3 TRP 84 HB3 TRP 84 -2.281 8.903 -3.822 596 HD1 TRP 84 HD1 TRP 84 -2.665 11.801 -6.180 597 HE1 TRP 84 HE1 TRP 84 -1.697 13.919 -5.270 598 HE3 TRP 84 HE3 TRP 84 -1.652 10.096 -1.588 599 HZ2 TRP 84 HZ2 TRP 84 -0.579 14.679 -2.804 600 HZ3 TRP 84 HZ3 TRP 84 -0.618 11.592 0.007 601 HH2 TRP 84 HH2 TRP 84 -0.070 13.861 -0.619 602 H THR 85 H THR 85 -1.149 6.764 -5.694 603 HA THR 85 HA THR 85 -3.430 5.082 -6.040 604 HB THR 85 HB THR 85 -1.589 3.649 -7.330 605 HG1 THR 85 HG1 THR 85 0.083 4.775 -7.743 606 HG21 THR 85 HG21 THR 85 -2.440 4.513 -9.399 607 HG22 THR 85 HG22 THR 85 -3.048 5.801 -8.632 608 HG23 THR 85 HG23 THR 85 -3.676 4.333 -8.373 609 H TYR 86 H TYR 86 -3.643 3.216 -4.986 610 HA TYR 86 HA TYR 86 -1.406 2.306 -3.351 611 HB2 TYR 86 HB2 TYR 86 -4.170 2.116 -2.612 612 HB3 TYR 86 HB3 TYR 86 -2.902 1.612 -1.715 613 HD1 TYR 86 HD1 TYR 86 -5.135 4.213 -2.133 614 HD2 TYR 86 HD2 TYR 86 -1.182 3.517 -1.022 615 HE1 TYR 86 HE1 TYR 86 -5.077 6.349 -1.004 616 HE2 TYR 86 HE2 TYR 86 -1.118 5.675 0.077 617 HH TYR 86 HH TYR 86 -3.044 8.099 -0.381 618 H THR 87 H THR 87 -1.208 -0.096 -3.421 619 HA THR 87 HA THR 87 -2.146 -1.068 -5.844 620 HB THR 87 HB THR 87 -0.022 -1.877 -4.907 621 HG1 THR 87 HG1 THR 87 -1.021 -4.264 -5.124 622 HG21 THR 87 HG21 THR 87 -0.033 -3.530 -3.171 623 HG22 THR 87 HG22 THR 87 -1.642 -3.429 -3.057 624 HG23 THR 87 HG23 THR 87 -0.720 -2.181 -2.604 625 H ALA 88 H ALA 88 -3.487 -1.110 -2.794 626 HA ALA 88 HA ALA 88 -5.699 -2.690 -3.744 627 HB1 ALA 88 HB1 ALA 88 -4.461 -4.237 -2.397 628 HB2 ALA 88 HB2 ALA 88 -5.833 -3.871 -1.622 629 HB3 ALA 88 HB3 ALA 88 -4.440 -3.188 -1.167 630 HA PRO 89 HA PRO 89 -7.703 0.694 -1.727 631 HB2 PRO 89 HB2 PRO 89 -10.135 -0.191 -1.203 632 HB3 PRO 89 HB3 PRO 89 -9.731 0.096 -2.759 633 HG2 PRO 89 HG2 PRO 89 -9.706 -2.407 -1.384 634 HG3 PRO 89 HG3 PRO 89 -10.358 -2.078 -2.844 635 HD2 PRO 89 HD2 PRO 89 -7.994 -3.162 -2.694 636 HD3 PRO 89 HD3 PRO 89 -8.321 -2.092 -3.884 637 H HIS 90 H HIS 90 -8.251 1.499 0.359 638 HA HIS 90 HA HIS 90 -7.844 -0.466 2.438 639 HB2 HIS 90 HB2 HIS 90 -5.840 0.954 2.013 640 HB3 HIS 90 HB3 HIS 90 -6.702 2.181 2.662 641 HD1 HIS 90 HD1 HIS 90 -7.174 2.173 5.269 642 HD2 HIS 90 HD2 HIS 90 -4.773 -0.834 3.854 643 HE1 HIS 90 HE1 HIS 90 -6.088 1.046 7.204 644 HE2 HIS 90 HE2 HIS 90 -4.642 -0.771 6.375 645 H ASN 91 H ASN 91 -8.930 -0.169 4.403 646 HA ASN 91 HA ASN 91 -11.335 1.149 4.361 647 HB2 ASN 91 HB2 ASN 91 -9.760 0.402 6.658 648 HB3 ASN 91 HB3 ASN 91 -11.302 0.929 6.774 649 HD21 ASN 91 HD21 ASN 91 -12.146 -2.439 6.914 650 HD22 ASN 91 HD22 ASN 91 -11.970 -0.969 7.814 651 H THR 92 H THR 92 -11.997 3.255 5.051 652 HA THR 92 HA THR 92 -9.967 5.102 5.815 653 HB THR 92 HB THR 92 -11.416 5.437 3.270 654 HG1 THR 92 HG1 THR 92 -8.800 4.813 3.811 655 HG21 THR 92 HG21 THR 92 -10.216 7.477 2.941 656 HG22 THR 92 HG22 THR 92 -9.497 7.309 4.380 657 HG23 THR 92 HG23 THR 92 -11.086 7.599 4.299 658 H SER 93 H SER 93 -10.816 6.969 6.866 659 HA SER 93 HA SER 93 -13.688 6.964 7.109 660 HB2 SER 93 HB2 SER 93 -11.788 8.161 8.960 661 HB3 SER 93 HB3 SER 93 -13.390 8.013 9.237 662 HG SER 93 HG SER 93 -12.349 6.391 10.290 663 H GLN 94 H GLN 94 -10.943 9.049 6.648 664 HA GLN 94 HA GLN 94 -12.497 10.814 5.074 665 HB2 GLN 94 HB2 GLN 94 -12.061 11.449 7.730 666 HB3 GLN 94 HB3 GLN 94 -11.216 12.514 6.825 667 HG2 GLN 94 HG2 GLN 94 -13.179 13.185 5.741 668 HG3 GLN 94 HG3 GLN 94 -14.039 12.081 6.584 669 HE21 GLN 94 HE21 GLN 94 -14.554 14.037 9.374 670 HE22 GLN 94 HE22 GLN 94 -14.792 12.497 8.617 671 H TRP 95 H TRP 95 -11.187 12.187 3.678 672 HA TRP 95 HA TRP 95 -8.416 12.272 4.354 673 HB2 TRP 95 HB2 TRP 95 -7.751 11.833 2.028 674 HB3 TRP 95 HB3 TRP 95 -8.084 10.555 2.988 675 HD1 TRP 95 HD1 TRP 95 -10.821 9.690 2.555 676 HE1 TRP 95 HE1 TRP 95 -11.927 9.087 0.392 677 HE3 TRP 95 HE3 TRP 95 -7.698 12.181 -0.462 678 HZ2 TRP 95 HZ2 TRP 95 -11.395 9.627 -2.318 679 HZ3 TRP 95 HZ3 TRP 95 -8.043 12.051 -2.861 680 HH2 TRP 95 HH2 TRP 95 -9.888 10.785 -3.765 681 H HIS 96 H HIS 96 -7.250 14.080 3.465 682 HA HIS 96 HA HIS 96 -8.914 16.024 2.268 683 HB2 HIS 96 HB2 HIS 96 -7.545 17.253 4.420 684 HB3 HIS 96 HB3 HIS 96 -9.121 17.423 4.025 685 HD1 HIS 96 HD1 HIS 96 -10.751 16.706 5.780 686 HD2 HIS 96 HD2 HIS 96 -7.181 14.699 5.948 687 HE1 HIS 96 HE1 HIS 96 -10.775 15.197 7.758 688 HE2 HIS 96 HE2 HIS 96 -8.646 13.966 7.865 689 H TYR 97 H TYR 97 -7.812 17.973 1.505 690 HA TYR 97 HA TYR 97 -4.946 17.728 1.430 691 HB2 TYR 97 HB2 TYR 97 -6.605 18.531 -0.798 692 HB3 TYR 97 HB3 TYR 97 -4.974 18.623 -0.815 693 HD1 TYR 97 HD1 TYR 97 -7.746 16.456 -1.281 694 HD2 TYR 97 HD2 TYR 97 -3.606 16.523 -0.859 695 HE1 TYR 97 HE1 TYR 97 -7.617 14.208 -2.154 696 HE2 TYR 97 HE2 TYR 97 -3.483 14.266 -1.713 697 HH TYR 97 HH TYR 97 -5.463 12.155 -1.782 698 H TYR 98 H TYR 98 -3.792 19.658 1.710 699 HA TYR 98 HA TYR 98 -5.364 22.058 2.023 700 HB2 TYR 98 HB2 TYR 98 -3.173 21.381 3.785 701 HB3 TYR 98 HB3 TYR 98 -4.153 22.678 3.942 702 HD1 TYR 98 HD1 TYR 98 -4.067 19.076 4.324 703 HD2 TYR 98 HD2 TYR 98 -6.173 22.553 5.221 704 HE1 TYR 98 HE1 TYR 98 -5.462 17.836 5.855 705 HE2 TYR 98 HE2 TYR 98 -7.545 21.312 6.780 706 HH TYR 98 HH TYR 98 -8.256 18.606 6.915 707 H ILE 99 H ILE 99 -3.984 24.069 1.735 708 HA ILE 99 HA ILE 99 -1.426 23.475 0.550 709 HB ILE 99 HB ILE 99 -1.673 25.416 -0.934 710 HG12 ILE 99 HG12 ILE 99 -4.467 25.383 -0.264 711 HG13 ILE 99 HG13 ILE 99 -3.424 26.475 0.359 712 HG21 ILE 99 HG21 ILE 99 -3.067 24.263 -2.557 713 HG22 ILE 99 HG22 ILE 99 -3.618 23.285 -1.393 714 HG23 ILE 99 HG23 ILE 99 -2.068 23.207 -1.848 715 HD11 ILE 99 HD11 ILE 99 -4.628 27.445 -1.467 716 HD12 ILE 99 HD12 ILE 99 -4.089 26.286 -2.457 717 HD13 ILE 99 HD13 ILE 99 -3.057 27.367 -1.841 718 H THR 100 H THR 100 0.317 24.867 1.198 719 HA THR 100 HA THR 100 -0.247 26.350 3.538 720 HB THR 100 HB THR 100 2.152 26.837 3.565 721 HG1 THR 100 HG1 THR 100 3.439 26.075 1.967 722 HG21 THR 100 HG21 THR 100 2.888 24.585 3.882 723 HG22 THR 100 HG22 THR 100 1.583 24.030 3.106 724 HG23 THR 100 HG23 THR 100 1.423 24.747 4.546 725 H LYS 101 H LYS 101 -0.430 28.614 3.703 726 HA LYS 101 HA LYS 101 -0.754 30.008 1.246 727 HB2 LYS 101 HB2 LYS 101 -2.127 30.304 3.264 728 HB3 LYS 101 HB3 LYS 101 -0.852 31.077 3.930 729 HG2 LYS 101 HG2 LYS 101 -1.072 32.843 2.487 730 HG3 LYS 101 HG3 LYS 101 -2.154 32.033 1.570 731 HD2 LYS 101 HD2 LYS 101 -3.597 31.957 3.544 732 HD3 LYS 101 HD3 LYS 101 -2.569 33.015 4.244 733 HE2 LYS 101 HE2 LYS 101 -3.166 34.697 2.839 734 HE3 LYS 101 HE3 LYS 101 -3.792 33.667 1.738 735 HZ1 LYS 101 HZ1 LYS 101 -5.543 34.753 2.927 736 HZ2 LYS 101 HZ2 LYS 101 -4.955 34.186 4.323 737 HZ3 LYS 101 HZ3 LYS 101 -5.575 33.165 3.233 738 H LYS 102 H LYS 102 0.913 30.819 0.096 739 HA LYS 102 HA LYS 102 3.404 31.311 1.360 740 HB2 LYS 102 HB2 LYS 102 3.169 30.639 -0.962 741 HB3 LYS 102 HB3 LYS 102 2.657 32.156 -1.284 742 HG2 LYS 102 HG2 LYS 102 4.755 33.018 -0.661 743 HG3 LYS 102 HG3 LYS 102 5.272 31.518 -0.273 744 HD2 LYS 102 HD2 LYS 102 4.897 30.891 -2.600 745 HD3 LYS 102 HD3 LYS 102 4.645 32.473 -2.919 746 HE2 LYS 102 HE2 LYS 102 7.113 31.497 -1.794 747 HE3 LYS 102 HE3 LYS 102 6.911 31.725 -3.399 748 HZ1 LYS 102 HZ1 LYS 102 8.024 33.587 -2.443 749 HZ2 LYS 102 HZ2 LYS 102 6.785 33.824 -1.431 750 HZ3 LYS 102 HZ3 LYS 102 6.585 34.049 -3.019 751 H GLY 103 H GLY 103 3.973 33.180 2.512 752 HA2 GLY 103 HA2 GLY 103 3.952 35.479 2.723 753 HA3 GLY 103 HA3 GLY 103 2.767 35.603 1.606 754 H TRP 104 H TRP 104 2.222 33.427 4.173 755 HA TRP 104 HA TRP 104 -0.111 34.547 4.911 756 HB2 TRP 104 HB2 TRP 104 0.035 33.203 6.941 757 HB3 TRP 104 HB3 TRP 104 0.458 32.348 5.615 758 HD1 TRP 104 HD1 TRP 104 2.497 34.401 8.061 759 HE1 TRP 104 HE1 TRP 104 4.606 33.253 8.742 760 HE3 TRP 104 HE3 TRP 104 1.797 30.200 5.435 761 HZ2 TRP 104 HZ2 TRP 104 5.772 30.759 8.179 762 HZ3 TRP 104 HZ3 TRP 104 3.470 28.451 5.570 763 HH2 TRP 104 HH2 TRP 104 5.440 28.746 6.942 764 H ASP 105 H ASP 105 -0.948 35.769 6.692 765 HA ASP 105 HA ASP 105 0.616 37.987 7.206 766 HB2 ASP 105 HB2 ASP 105 -1.876 37.129 8.445 767 HB3 ASP 105 HB3 ASP 105 -1.242 38.608 8.729 768 HA PRO 106 HA PRO 106 2.358 36.471 11.005 769 HB2 PRO 106 HB2 PRO 106 3.794 38.542 11.806 770 HB3 PRO 106 HB3 PRO 106 4.331 37.674 10.531 771 HG2 PRO 106 HG2 PRO 106 2.843 40.112 10.480 772 HG3 PRO 106 HG3 PRO 106 4.197 39.752 9.640 773 HD2 PRO 106 HD2 PRO 106 1.852 39.526 8.509 774 HD3 PRO 106 HD3 PRO 106 3.054 38.495 8.113 775 H ASP 107 H ASP 107 0.372 39.072 10.568 776 HA ASP 107 HA ASP 107 -0.225 39.673 13.231 777 HB2 ASP 107 HB2 ASP 107 -0.665 41.192 11.400 778 HB3 ASP 107 HB3 ASP 107 -1.737 40.131 10.775 779 H LYS 108 H LYS 108 -1.031 37.065 11.344 780 HA LYS 108 HA LYS 108 -3.442 36.514 12.862 781 HB2 LYS 108 HB2 LYS 108 -2.712 35.889 10.182 782 HB3 LYS 108 HB3 LYS 108 -3.694 34.834 10.950 783 HG2 LYS 108 HG2 LYS 108 -5.016 36.309 9.660 784 HG3 LYS 108 HG3 LYS 108 -5.317 36.582 11.242 785 HD2 LYS 108 HD2 LYS 108 -4.004 38.517 11.205 786 HD3 LYS 108 HD3 LYS 108 -3.538 38.212 9.670 787 HE2 LYS 108 HE2 LYS 108 -5.778 38.562 8.946 788 HE3 LYS 108 HE3 LYS 108 -6.199 38.931 10.480 789 HZ1 LYS 108 HZ1 LYS 108 -5.761 40.927 9.251 790 HZ2 LYS 108 HZ2 LYS 108 -4.266 40.406 8.926 791 HZ3 LYS 108 HZ3 LYS 108 -4.682 40.772 10.445 792 HA PRO 109 HA PRO 109 -1.406 33.240 14.797 793 HB2 PRO 109 HB2 PRO 109 -3.230 31.259 14.932 794 HB3 PRO 109 HB3 PRO 109 -3.331 32.548 15.929 795 HG2 PRO 109 HG2 PRO 109 -4.708 32.161 13.439 796 HG3 PRO 109 HG3 PRO 109 -5.344 32.658 14.859 797 HD2 PRO 109 HD2 PRO 109 -4.787 34.406 13.097 798 HD3 PRO 109 HD3 PRO 109 -4.444 34.739 14.659 799 H LEU 110 H LEU 110 0.276 32.413 14.053 800 HA LEU 110 HA LEU 110 0.345 31.576 11.470 801 HB2 LEU 110 HB2 LEU 110 2.179 32.198 13.416 802 HB3 LEU 110 HB3 LEU 110 2.621 30.705 12.925 803 HG LEU 110 HG LEU 110 2.621 31.740 10.626 804 HD11 LEU 110 HD11 LEU 110 3.149 34.083 10.641 805 HD12 LEU 110 HD12 LEU 110 2.944 34.124 12.244 806 HD13 LEU 110 HD13 LEU 110 1.680 33.846 11.274 807 HD21 LEU 110 HD21 LEU 110 4.941 32.302 10.871 808 HD22 LEU 110 HD22 LEU 110 4.622 30.926 11.658 809 HD23 LEU 110 HD23 LEU 110 4.775 32.310 12.480 810 H LYS 111 H LYS 111 -0.854 29.635 13.658 811 HA LYS 111 HA LYS 111 -0.067 27.378 12.057 812 HB2 LYS 111 HB2 LYS 111 -0.365 27.364 14.908 813 HB3 LYS 111 HB3 LYS 111 -0.482 25.968 14.068 814 HG2 LYS 111 HG2 LYS 111 1.865 27.513 13.631 815 HG3 LYS 111 HG3 LYS 111 1.762 26.746 15.069 816 HD2 LYS 111 HD2 LYS 111 2.972 25.360 13.605 817 HD3 LYS 111 HD3 LYS 111 1.532 24.645 13.890 818 HE2 LYS 111 HE2 LYS 111 2.089 24.441 11.596 819 HE3 LYS 111 HE3 LYS 111 0.752 25.366 11.753 820 HZ1 LYS 111 HZ1 LYS 111 2.208 26.300 10.153 821 HZ2 LYS 111 HZ2 LYS 111 3.388 26.391 11.255 822 HZ3 LYS 111 HZ3 LYS 111 2.065 27.307 11.410 823 H ARG 112 H ARG 112 -2.493 29.334 12.696 824 HA ARG 112 HA ARG 112 -4.424 27.333 11.995 825 HB2 ARG 112 HB2 ARG 112 -4.867 29.984 13.023 826 HB3 ARG 112 HB3 ARG 112 -6.098 29.063 12.470 827 HG2 ARG 112 HG2 ARG 112 -5.629 27.448 14.155 828 HG3 ARG 112 HG3 ARG 112 -4.428 28.400 14.721 829 HD2 ARG 112 HD2 ARG 112 -6.335 28.717 16.075 830 HD3 ARG 112 HD3 ARG 112 -6.065 30.093 15.238 831 HE ARG 112 HE ARG 112 -8.002 29.837 14.057 832 HH11 ARG 112 HH11 ARG 112 -10.005 28.974 13.753 833 HH12 ARG 112 HH12 ARG 112 -10.431 27.449 14.457 834 HH21 ARG 112 HH21 ARG 112 -7.387 26.945 15.982 835 HH22 ARG 112 HH22 ARG 112 -8.976 26.320 15.696 836 H ALA 113 H ALA 113 -3.469 30.530 11.059 837 HA ALA 113 HA ALA 113 -5.007 30.378 8.686 838 HB1 ALA 113 HB1 ALA 113 -4.995 32.457 10.005 839 HB2 ALA 113 HB2 ALA 113 -4.499 32.777 8.499 840 HB3 ALA 113 HB3 ALA 113 -3.419 32.637 9.694 841 H ASP 114 H ASP 114 -2.128 29.265 9.282 842 HA ASP 114 HA ASP 114 -0.713 30.331 7.111 843 HB2 ASP 114 HB2 ASP 114 1.048 28.820 7.788 844 HB3 ASP 114 HB3 ASP 114 0.464 29.628 9.082 845 H PHE 115 H PHE 115 -2.713 27.628 7.559 846 HA PHE 115 HA PHE 115 -2.152 26.857 4.842 847 HB2 PHE 115 HB2 PHE 115 -2.616 24.580 5.336 848 HB3 PHE 115 HB3 PHE 115 -1.360 25.117 6.231 849 HD1 PHE 115 HD1 PHE 115 -1.492 25.241 8.639 850 HD2 PHE 115 HD2 PHE 115 -4.789 24.078 6.384 851 HE1 PHE 115 HE1 PHE 115 -2.594 24.502 10.650 852 HE2 PHE 115 HE2 PHE 115 -5.904 23.329 8.387 853 HZ PHE 115 HZ PHE 115 -4.812 23.554 10.530 854 H GLU 116 H GLU 116 -3.922 26.148 3.529 855 HA GLU 116 HA GLU 116 -6.512 26.822 4.625 856 HB2 GLU 116 HB2 GLU 116 -5.562 27.541 1.992 857 HB3 GLU 116 HB3 GLU 116 -7.106 27.757 2.480 858 HG2 GLU 116 HG2 GLU 116 -6.333 29.296 4.156 859 HG3 GLU 116 HG3 GLU 116 -4.810 29.116 3.593 860 H LEU 117 H LEU 117 -8.241 25.450 4.086 861 HA LEU 117 HA LEU 117 -7.483 22.906 3.133 862 HB2 LEU 117 HB2 LEU 117 -9.156 23.120 4.810 863 HB3 LEU 117 HB3 LEU 117 -10.111 23.934 3.765 864 HG LEU 117 HG LEU 117 -10.214 21.853 2.463 865 HD11 LEU 117 HD11 LEU 117 -9.791 19.813 3.627 866 HD12 LEU 117 HD12 LEU 117 -9.201 20.646 4.882 867 HD13 LEU 117 HD13 LEU 117 -8.423 20.661 3.464 868 HD21 LEU 117 HD21 LEU 117 -11.988 20.966 3.846 869 HD22 LEU 117 HD22 LEU 117 -12.089 22.579 3.782 870 HD23 LEU 117 HD23 LEU 117 -11.463 21.859 5.088 871 H ILE 118 H ILE 118 -7.296 22.307 1.015 872 HA ILE 118 HA ILE 118 -8.715 23.941 -0.883 873 HB ILE 118 HB ILE 118 -6.239 23.594 -1.054 874 HG12 ILE 118 HG12 ILE 118 -6.260 23.567 -3.478 875 HG13 ILE 118 HG13 ILE 118 -7.866 23.275 -3.404 876 HG21 ILE 118 HG21 ILE 118 -5.496 21.642 -2.253 877 HG22 ILE 118 HG22 ILE 118 -6.997 21.044 -2.212 878 HG23 ILE 118 HG23 ILE 118 -6.158 21.217 -0.840 879 HD11 ILE 118 HD11 ILE 118 -7.477 25.600 -3.830 880 HD12 ILE 118 HD12 ILE 118 -6.614 25.720 -2.468 881 HD13 ILE 118 HD13 ILE 118 -8.203 25.432 -2.395 882 H GLY 119 H GLY 119 -9.019 21.030 0.605 883 HA2 GLY 119 HA2 GLY 119 -11.403 20.465 -0.525 884 HA3 GLY 119 HA3 GLY 119 -10.333 19.646 -1.447 885 H ALA 120 H ALA 120 -12.432 18.492 0.074 886 HA ALA 120 HA ALA 120 -10.862 16.677 1.624 887 HB1 ALA 120 HB1 ALA 120 -11.597 18.228 3.308 888 HB2 ALA 120 HB2 ALA 120 -12.339 16.812 3.548 889 HB3 ALA 120 HB3 ALA 120 -13.133 18.032 2.844 890 H VAL 121 H VAL 121 -11.720 14.578 1.720 891 HA VAL 121 HA VAL 121 -14.248 14.237 0.421 892 HB VAL 121 HB VAL 121 -11.973 12.493 -0.056 893 HG11 VAL 121 HG11 VAL 121 -13.401 11.278 -1.585 894 HG12 VAL 121 HG12 VAL 121 -14.645 12.226 -1.177 895 HG13 VAL 121 HG13 VAL 121 -14.010 11.213 -0.089 896 HG21 VAL 121 HG21 VAL 121 -12.040 13.269 -2.344 897 HG22 VAL 121 HG22 VAL 121 -11.773 14.513 -1.346 898 HG23 VAL 121 HG23 VAL 121 -13.246 14.278 -1.970 899 HA PRO 122 HA PRO 122 -14.368 11.831 4.162 900 HB2 PRO 122 HB2 PRO 122 -16.919 11.907 4.769 901 HB3 PRO 122 HB3 PRO 122 -16.041 13.261 5.021 902 HG2 PRO 122 HG2 PRO 122 -17.726 12.658 2.795 903 HG3 PRO 122 HG3 PRO 122 -17.662 14.047 3.652 904 HD2 PRO 122 HD2 PRO 122 -16.380 13.785 1.357 905 HD3 PRO 122 HD3 PRO 122 -15.836 14.790 2.523 906 H HIS 123 H HIS 123 -15.029 9.676 4.704 907 HA HIS 123 HA HIS 123 -15.996 8.315 2.370 908 HB2 HIS 123 HB2 HIS 123 -14.071 7.272 3.140 909 HB3 HIS 123 HB3 HIS 123 -14.637 7.234 4.672 910 HD1 HIS 123 HD1 HIS 123 -16.640 5.515 5.218 911 HD2 HIS 123 HD2 HIS 123 -14.666 5.023 1.658 912 HE1 HIS 123 HE1 HIS 123 -17.258 3.299 4.274 913 HE2 HIS 123 HE2 HIS 123 -16.067 2.973 2.138 914 H ASP 124 H ASP 124 -18.075 7.868 2.267 915 HA ASP 124 HA ASP 124 -19.460 6.945 4.640 916 HB2 ASP 124 HB2 ASP 124 -20.119 9.165 4.518 917 HB3 ASP 124 HB3 ASP 124 -20.445 9.025 2.924 918 H GLY 125 H GLY 125 -21.125 7.694 1.781 919 HA2 GLY 125 HA2 GLY 125 -21.349 4.972 0.995 920 HA3 GLY 125 HA3 GLY 125 -22.124 6.244 0.324 921 H SER 126 H SER 126 -21.731 5.815 -1.841 922 HA SER 126 HA SER 126 -18.950 5.909 -2.539 923 HB2 SER 126 HB2 SER 126 -19.968 3.754 -3.089 924 HB3 SER 126 HB3 SER 126 -21.016 4.523 -4.078 925 HG SER 126 HG SER 126 -18.282 4.389 -4.407 926 HA PRO 127 HA PRO 127 -20.743 9.394 -4.771 927 HB2 PRO 127 HB2 PRO 127 -19.235 11.378 -3.899 928 HB3 PRO 127 HB3 PRO 127 -20.459 10.878 -2.940 929 HG2 PRO 127 HG2 PRO 127 -17.709 10.117 -2.792 930 HG3 PRO 127 HG3 PRO 127 -18.665 10.640 -1.575 931 HD2 PRO 127 HD2 PRO 127 -18.279 8.093 -1.929 932 HD3 PRO 127 HD3 PRO 127 -19.722 8.635 -1.387 933 H ALA 128 H ALA 128 -19.714 10.865 -6.429 934 HA ALA 128 HA ALA 128 -17.932 9.392 -7.918 935 HB1 ALA 128 HB1 ALA 128 -19.316 11.119 -8.907 936 HB2 ALA 128 HB2 ALA 128 -17.775 11.367 -9.330 937 HB3 ALA 128 HB3 ALA 128 -18.445 12.256 -8.157 938 H SER 129 H SER 129 -17.367 11.639 -5.432 939 HA SER 129 HA SER 129 -14.674 12.075 -5.978 940 HB2 SER 129 HB2 SER 129 -14.718 13.027 -3.641 941 HB3 SER 129 HB3 SER 129 -15.789 13.706 -4.670 942 HG SER 129 HG SER 129 -17.395 12.413 -3.859 943 H ARG 130 H ARG 130 -16.066 9.342 -4.913 944 HA ARG 130 HA ARG 130 -14.184 8.340 -3.123 945 HB2 ARG 130 HB2 ARG 130 -16.296 7.280 -3.585 946 HB3 ARG 130 HB3 ARG 130 -15.742 6.858 -5.062 947 HG2 ARG 130 HG2 ARG 130 -14.169 5.398 -4.034 948 HG3 ARG 130 HG3 ARG 130 -14.777 5.794 -2.571 949 HD2 ARG 130 HD2 ARG 130 -16.868 4.865 -3.154 950 HD3 ARG 130 HD3 ARG 130 -16.331 4.548 -4.663 951 HE ARG 130 HE ARG 130 -14.701 3.220 -2.855 952 HH11 ARG 130 HH11 ARG 130 -17.956 2.981 -4.189 953 HH12 ARG 130 HH12 ARG 130 -18.033 1.272 -3.916 954 HH21 ARG 130 HH21 ARG 130 -14.882 1.034 -2.548 955 HH22 ARG 130 HH22 ARG 130 -16.325 0.192 -3.005 956 H ASN 131 H ASN 131 -14.101 8.925 -6.455 957 HA ASN 131 HA ASN 131 -12.054 7.256 -7.222 958 HB2 ASN 131 HB2 ASN 131 -13.501 8.632 -8.689 959 HB3 ASN 131 HB3 ASN 131 -12.504 9.883 -8.357 960 HD21 ASN 131 HD21 ASN 131 -11.646 8.097 -11.544 961 HD22 ASN 131 HD22 ASN 131 -13.157 8.632 -10.886 962 H LEU 132 H LEU 132 -9.888 7.237 -6.945 963 HA LEU 132 HA LEU 132 -8.745 9.004 -5.153 964 HB2 LEU 132 HB2 LEU 132 -7.950 6.693 -6.486 965 HB3 LEU 132 HB3 LEU 132 -6.701 7.736 -6.355 966 HG LEU 132 HG LEU 132 -6.653 6.136 -4.632 967 HD11 LEU 132 HD11 LEU 132 -6.398 7.633 -2.755 968 HD12 LEU 132 HD12 LEU 132 -7.165 8.791 -3.583 969 HD13 LEU 132 HD13 LEU 132 -5.720 8.263 -4.081 970 HD21 LEU 132 HD21 LEU 132 -8.335 6.081 -2.904 971 HD22 LEU 132 HD22 LEU 132 -8.976 5.678 -4.333 972 HD23 LEU 132 HD23 LEU 132 -9.213 7.159 -3.729 973 H SER 133 H SER 133 -9.321 9.418 -8.346 974 HA SER 133 HA SER 133 -7.087 11.169 -8.788 975 HB2 SER 133 HB2 SER 133 -7.766 9.660 -10.582 976 HB3 SER 133 HB3 SER 133 -9.165 10.494 -10.700 977 HG SER 133 HG SER 133 -7.427 11.052 -12.169 978 H HIS 134 H HIS 134 -7.248 13.315 -8.371 979 HA HIS 134 HA HIS 134 -9.906 14.406 -8.148 980 HB2 HIS 134 HB2 HIS 134 -8.624 13.890 -6.006 981 HB3 HIS 134 HB3 HIS 134 -7.802 15.257 -6.358 982 HD1 HIS 134 HD1 HIS 134 -9.021 17.588 -6.091 983 HD2 HIS 134 HD2 HIS 134 -11.185 14.278 -5.013 984 HE1 HIS 134 HE1 HIS 134 -11.033 18.334 -4.829 985 HE2 HIS 134 HE2 HIS 134 -12.345 16.354 -4.157 986 H HIS 135 H HIS 135 -10.356 16.344 -9.070 987 HA HIS 135 HA HIS 135 -8.190 17.689 -10.363 988 HB2 HIS 135 HB2 HIS 135 -11.039 18.180 -10.448 989 HB3 HIS 135 HB3 HIS 135 -9.979 19.151 -11.222 990 HD1 HIS 135 HD1 HIS 135 -9.210 18.532 -13.559 991 HD2 HIS 135 HD2 HIS 135 -11.217 15.543 -11.604 992 HE1 HIS 135 HE1 HIS 135 -9.635 16.689 -15.166 993 HE2 HIS 135 HE2 HIS 135 -10.844 14.875 -14.014 994 H ILE 136 H ILE 136 -7.267 19.619 -9.630 995 HA ILE 136 HA ILE 136 -8.694 21.046 -7.571 996 HB ILE 136 HB ILE 136 -5.815 20.612 -7.523 997 HG12 ILE 136 HG12 ILE 136 -6.697 19.867 -5.145 998 HG13 ILE 136 HG13 ILE 136 -7.914 19.375 -6.117 999 HG21 ILE 136 HG21 ILE 136 -5.775 21.952 -5.500 1000 HG22 ILE 136 HG22 ILE 136 -7.357 22.245 -5.662 1001 HG23 ILE 136 HG23 ILE 136 -6.310 22.846 -6.737 1002 HD11 ILE 136 HD11 ILE 136 -6.368 17.582 -5.772 1003 HD12 ILE 136 HD12 ILE 136 -5.167 18.483 -6.374 1004 HD13 ILE 136 HD13 ILE 136 -6.372 17.996 -7.336 1005 H TYR 137 H TYR 137 -9.195 23.108 -8.418 1006 HA TYR 137 HA TYR 137 -7.653 24.024 -10.624 1007 HB2 TYR 137 HB2 TYR 137 -9.954 24.464 -10.717 1008 HB3 TYR 137 HB3 TYR 137 -9.887 25.285 -9.307 1009 HD1 TYR 137 HD1 TYR 137 -9.586 27.645 -9.326 1010 HD2 TYR 137 HD2 TYR 137 -8.629 25.447 -12.726 1011 HE1 TYR 137 HE1 TYR 137 -9.165 29.693 -10.536 1012 HE2 TYR 137 HE2 TYR 137 -8.180 27.500 -13.923 1013 HH TYR 137 HH TYR 137 -8.315 29.750 -13.933 1014 H ILE 138 H ILE 138 -5.860 25.361 -10.492 1015 HA ILE 138 HA ILE 138 -5.656 26.851 -8.062 1016 HB ILE 138 HB ILE 138 -3.314 25.685 -9.394 1017 HG12 ILE 138 HG12 ILE 138 -4.423 24.838 -6.876 1018 HG13 ILE 138 HG13 ILE 138 -4.670 24.042 -8.281 1019 HG21 ILE 138 HG21 ILE 138 -2.039 26.489 -7.483 1020 HG22 ILE 138 HG22 ILE 138 -3.376 27.153 -6.862 1021 HG23 ILE 138 HG23 ILE 138 -2.740 27.742 -8.227 1022 HD11 ILE 138 HD11 ILE 138 -2.972 22.939 -7.005 1023 HD12 ILE 138 HD12 ILE 138 -2.085 24.291 -6.988 1024 HD13 ILE 138 HD13 ILE 138 -2.331 23.502 -8.378 1025 HA PRO 139 HA PRO 139 -5.009 29.940 -11.227 1026 HB2 PRO 139 HB2 PRO 139 -5.800 32.093 -9.968 1027 HB3 PRO 139 HB3 PRO 139 -6.935 31.103 -10.599 1028 HG2 PRO 139 HG2 PRO 139 -6.060 31.265 -7.892 1029 HG3 PRO 139 HG3 PRO 139 -7.590 31.131 -8.445 1030 HD2 PRO 139 HD2 PRO 139 -6.245 29.036 -7.554 1031 HD3 PRO 139 HD3 PRO 139 -7.429 28.882 -8.668 1032 H GLU 140 H GLU 140 -3.118 31.135 -11.551 1033 HA GLU 140 HA GLU 140 -1.617 31.739 -9.200 1034 HB2 GLU 140 HB2 GLU 140 -0.997 29.456 -9.877 1035 HB3 GLU 140 HB3 GLU 140 -0.297 30.128 -11.190 1036 HG2 GLU 140 HG2 GLU 140 1.417 29.826 -9.735 1037 HG3 GLU 140 HG3 GLU 140 1.072 31.419 -9.624 1038 H ASP 141 H ASP 141 -1.689 33.884 -9.581 1039 HA ASP 141 HA ASP 141 -0.836 34.895 -12.119 1040 HB2 ASP 141 HB2 ASP 141 -1.544 37.030 -11.257 1041 HB3 ASP 141 HB3 ASP 141 -2.739 35.929 -11.088 1042 H ARG 142 H ARG 142 0.799 33.601 -9.905 1043 HA ARG 142 HA ARG 142 2.788 35.664 -9.552 1044 HB2 ARG 142 HB2 ARG 142 1.892 33.863 -7.447 1045 HB3 ARG 142 HB3 ARG 142 2.999 35.047 -7.246 1046 HG2 ARG 142 HG2 ARG 142 1.382 36.682 -7.547 1047 HG3 ARG 142 HG3 ARG 142 0.264 35.557 -7.937 1048 HD2 ARG 142 HD2 ARG 142 0.598 34.736 -5.619 1049 HD3 ARG 142 HD3 ARG 142 1.257 36.206 -5.352 1050 HE ARG 142 HE ARG 142 -1.492 35.638 -5.819 1051 HH11 ARG 142 HH11 ARG 142 -2.974 37.257 -5.790 1052 HH12 ARG 142 HH12 ARG 142 -2.477 38.914 -5.701 1053 HH21 ARG 142 HH21 ARG 142 0.895 38.232 -5.733 1054 HH22 ARG 142 HH22 ARG 142 -0.326 39.458 -5.669 1055 H LEU 143 H LEU 143 4.810 34.615 -8.403 1056 HA LEU 143 HA LEU 143 5.287 32.053 -9.630 1057 HB2 LEU 143 HB2 LEU 143 7.105 34.282 -9.673 1058 HB3 LEU 143 HB3 LEU 143 7.591 32.760 -10.012 1059 HG LEU 143 HG LEU 143 5.836 32.953 -11.831 1060 HD11 LEU 143 HD11 LEU 143 5.717 35.135 -12.814 1061 HD12 LEU 143 HD12 LEU 143 6.531 35.748 -11.558 1062 HD13 LEU 143 HD13 LEU 143 5.048 35.141 -11.342 1063 HD21 LEU 143 HD21 LEU 143 7.627 33.630 -13.342 1064 HD22 LEU 143 HD22 LEU 143 8.187 32.569 -12.258 1065 HD23 LEU 143 HD23 LEU 143 8.488 34.147 -12.075 1066 H GLY 144 H GLY 144 5.961 30.532 -8.125 1067 HA2 GLY 144 HA2 GLY 144 7.867 30.688 -6.368 1068 HA3 GLY 144 HA3 GLY 144 6.715 31.518 -5.561 1069 H TYR 145 H TYR 145 7.862 29.407 -4.380 1070 HA TYR 145 HA TYR 145 6.130 27.236 -4.870 1071 HB2 TYR 145 HB2 TYR 145 7.718 25.967 -3.447 1072 HB3 TYR 145 HB3 TYR 145 8.409 26.620 -4.775 1073 HD1 TYR 145 HD1 TYR 145 9.974 28.525 -4.581 1074 HD2 TYR 145 HD2 TYR 145 8.335 26.714 -1.212 1075 HE1 TYR 145 HE1 TYR 145 11.612 29.628 -3.190 1076 HE2 TYR 145 HE2 TYR 145 9.976 27.818 0.178 1077 HH TYR 145 HH TYR 145 11.521 29.564 0.261 1078 H HIS 146 H HIS 146 4.842 26.096 -3.553 1079 HA HIS 146 HA HIS 146 4.781 26.796 -0.776 1080 HB2 HIS 146 HB2 HIS 146 2.517 27.203 -0.627 1081 HB3 HIS 146 HB3 HIS 146 3.157 28.253 -1.702 1082 HD1 HIS 146 HD1 HIS 146 2.424 28.149 -4.192 1083 HD2 HIS 146 HD2 HIS 146 0.718 25.348 -1.731 1084 HE1 HIS 146 HE1 HIS 146 0.498 27.117 -5.383 1085 HE2 HIS 146 HE2 HIS 146 -0.526 25.404 -3.927 1086 H VAL 147 H VAL 147 3.580 25.093 0.486 1087 HA VAL 147 HA VAL 147 4.054 22.621 -0.861 1088 HB VAL 147 HB VAL 147 3.691 22.992 2.028 1089 HG11 VAL 147 HG11 VAL 147 4.761 20.868 2.311 1090 HG12 VAL 147 HG12 VAL 147 4.877 20.707 0.706 1091 HG13 VAL 147 HG13 VAL 147 3.425 20.703 1.416 1092 HG21 VAL 147 HG21 VAL 147 6.112 22.981 2.240 1093 HG22 VAL 147 HG22 VAL 147 5.652 24.229 1.320 1094 HG23 VAL 147 HG23 VAL 147 6.254 22.895 0.632 1095 H ILE 148 H ILE 148 2.575 21.029 -1.242 1096 HA ILE 148 HA ILE 148 -0.135 21.557 -0.479 1097 HB ILE 148 HB ILE 148 0.854 19.434 -2.204 1098 HG12 ILE 148 HG12 ILE 148 -0.617 21.772 -3.004 1099 HG13 ILE 148 HG13 ILE 148 1.006 21.650 -3.136 1100 HG21 ILE 148 HG21 ILE 148 -1.480 18.964 -2.715 1101 HG22 ILE 148 HG22 ILE 148 -1.946 20.089 -1.652 1102 HG23 ILE 148 HG23 ILE 148 -1.218 18.740 -1.135 1103 HD11 ILE 148 HD11 ILE 148 -0.022 21.213 -5.265 1104 HD12 ILE 148 HD12 ILE 148 -0.874 20.000 -4.620 1105 HD13 ILE 148 HD13 ILE 148 0.733 19.879 -4.750 1106 H LEU 149 H LEU 149 -1.005 20.524 1.326 1107 HA LEU 149 HA LEU 149 0.597 18.447 2.548 1108 HB2 LEU 149 HB2 LEU 149 -1.486 19.963 3.833 1109 HB3 LEU 149 HB3 LEU 149 -0.373 19.029 4.580 1110 HG LEU 149 HG LEU 149 0.277 21.528 3.318 1111 HD11 LEU 149 HD11 LEU 149 0.343 22.449 5.566 1112 HD12 LEU 149 HD12 LEU 149 -0.162 21.031 6.158 1113 HD13 LEU 149 HD13 LEU 149 -1.148 21.919 5.234 1114 HD21 LEU 149 HD21 LEU 149 2.340 21.401 4.488 1115 HD22 LEU 149 HD22 LEU 149 2.175 20.138 3.491 1116 HD23 LEU 149 HD23 LEU 149 1.923 19.954 5.078 1117 H ALA 150 H ALA 150 -0.391 16.405 3.056 1118 HA ALA 150 HA ALA 150 -3.189 16.199 2.399 1119 HB1 ALA 150 HB1 ALA 150 -2.009 15.312 0.511 1120 HB2 ALA 150 HB2 ALA 150 -2.805 14.114 1.248 1121 HB3 ALA 150 HB3 ALA 150 -1.214 14.285 1.474 1122 H VAL 151 H VAL 151 -4.432 15.055 3.807 1123 HA VAL 151 HA VAL 151 -3.044 13.457 5.769 1124 HB VAL 151 HB VAL 151 -5.249 15.254 6.401 1125 HG11 VAL 151 HG11 VAL 151 -5.012 14.563 8.697 1126 HG12 VAL 151 HG12 VAL 151 -3.878 13.495 8.263 1127 HG13 VAL 151 HG13 VAL 151 -5.407 13.294 7.776 1128 HG21 VAL 151 HG21 VAL 151 -3.653 16.469 7.755 1129 HG22 VAL 151 HG22 VAL 151 -3.170 16.458 6.212 1130 HG23 VAL 151 HG23 VAL 151 -2.481 15.460 7.282 1131 H TRP 152 H TRP 152 -3.855 11.418 6.060 1132 HA TRP 152 HA TRP 152 -6.425 10.823 4.864 1133 HB2 TRP 152 HB2 TRP 152 -4.500 10.091 3.527 1134 HB3 TRP 152 HB3 TRP 152 -4.137 9.063 4.743 1135 HD1 TRP 152 HD1 TRP 152 -6.190 7.207 5.241 1136 HE1 TRP 152 HE1 TRP 152 -7.585 5.872 3.646 1137 HE3 TRP 152 HE3 TRP 152 -5.390 10.032 1.194 1138 HZ2 TRP 152 HZ2 TRP 152 -8.267 6.124 0.928 1139 HZ3 TRP 152 HZ3 TRP 152 -6.465 9.421 -0.889 1140 HH2 TRP 152 HH2 TRP 152 -7.911 7.493 -0.999 1141 H ASP 153 H ASP 153 -7.803 10.343 6.464 1142 HA ASP 153 HA ASP 153 -6.715 9.195 8.831 1143 HB2 ASP 153 HB2 ASP 153 -9.289 10.468 8.382 1144 HB3 ASP 153 HB3 ASP 153 -8.873 9.849 9.835 1145 H VAL 154 H VAL 154 -7.103 7.252 9.627 1146 HA VAL 154 HA VAL 154 -9.181 5.663 8.390 1147 HB VAL 154 HB VAL 154 -6.518 4.701 9.087 1148 HG11 VAL 154 HG11 VAL 154 -7.150 2.606 8.163 1149 HG12 VAL 154 HG12 VAL 154 -8.647 3.162 7.911 1150 HG13 VAL 154 HG13 VAL 154 -8.097 2.977 9.420 1151 HG21 VAL 154 HG21 VAL 154 -6.161 4.401 6.713 1152 HG22 VAL 154 HG22 VAL 154 -6.449 5.961 7.029 1153 HG23 VAL 154 HG23 VAL 154 -7.619 5.032 6.410 1154 H ALA 155 H ALA 155 -10.668 4.990 9.937 1155 HA ALA 155 HA ALA 155 -10.100 5.471 12.638 1156 HB1 ALA 155 HB1 ALA 155 -12.370 5.586 11.839 1157 HB2 ALA 155 HB2 ALA 155 -12.296 4.519 13.051 1158 HB3 ALA 155 HB3 ALA 155 -12.353 4.001 11.520 1159 H ASP 156 H ASP 156 -9.955 2.830 10.579 1160 HA ASP 156 HA ASP 156 -9.970 0.809 12.419 1161 HB2 ASP 156 HB2 ASP 156 -8.783 0.546 9.754 1162 HB3 ASP 156 HB3 ASP 156 -9.672 -0.596 10.512 1163 H THR 157 H THR 157 -7.485 2.835 11.923 1164 HA THR 157 HA THR 157 -5.599 0.893 12.900 1165 HB THR 157 HB THR 157 -3.827 2.131 11.617 1166 HG1 THR 157 HG1 THR 157 -5.202 3.088 9.705 1167 HG21 THR 157 HG21 THR 157 -4.316 1.046 9.522 1168 HG22 THR 157 HG22 THR 157 -5.856 0.838 9.972 1169 HG23 THR 157 HG23 THR 157 -4.677 0.025 10.723 1170 H GLU 158 H GLU 158 -3.818 1.772 14.259 1171 HA GLU 158 HA GLU 158 -4.812 3.787 15.935 1172 HB2 GLU 158 HB2 GLU 158 -3.352 1.914 16.625 1173 HB3 GLU 158 HB3 GLU 158 -2.104 2.760 15.996 1174 HG2 GLU 158 HG2 GLU 158 -2.525 4.496 17.564 1175 HG3 GLU 158 HG3 GLU 158 -3.718 3.591 18.218 1176 H ASN 159 H ASN 159 -2.892 3.803 13.203 1177 HA ASN 159 HA ASN 159 -1.916 6.448 13.747 1178 HB2 ASN 159 HB2 ASN 159 -0.910 4.482 11.846 1179 HB3 ASN 159 HB3 ASN 159 -0.284 5.987 11.960 1180 HD21 ASN 159 HD21 ASN 159 1.820 3.586 13.793 1181 HD22 ASN 159 HD22 ASN 159 1.190 3.644 12.181 1182 H ALA 160 H ALA 160 -1.735 7.943 11.898 1183 HA ALA 160 HA ALA 160 -3.779 7.535 9.874 1184 HB1 ALA 160 HB1 ALA 160 -4.463 9.319 11.280 1185 HB2 ALA 160 HB2 ALA 160 -4.053 9.934 9.842 1186 HB3 ALA 160 HB3 ALA 160 -3.035 10.055 11.093 1187 H PHE 161 H PHE 161 -3.173 8.559 7.761 1188 HA PHE 161 HA PHE 161 -0.305 8.366 7.364 1189 HB2 PHE 161 HB2 PHE 161 -1.504 6.699 6.195 1190 HB3 PHE 161 HB3 PHE 161 -2.486 7.827 5.539 1191 HD1 PHE 161 HD1 PHE 161 -2.029 8.687 3.404 1192 HD2 PHE 161 HD2 PHE 161 0.971 6.793 5.563 1193 HE1 PHE 161 HE1 PHE 161 -0.574 8.822 1.484 1194 HE2 PHE 161 HE2 PHE 161 2.450 6.970 3.685 1195 HZ PHE 161 HZ PHE 161 1.678 7.962 1.628 1196 H TYR 162 H TYR 162 0.865 10.042 6.438 1197 HA TYR 162 HA TYR 162 -0.694 12.201 5.384 1198 HB2 TYR 162 HB2 TYR 162 0.357 13.858 6.666 1199 HB3 TYR 162 HB3 TYR 162 -0.227 12.737 7.700 1200 HD1 TYR 162 HD1 TYR 162 1.349 11.172 8.870 1201 HD2 TYR 162 HD2 TYR 162 2.717 14.333 6.533 1202 HE1 TYR 162 HE1 TYR 162 3.545 10.963 9.858 1203 HE2 TYR 162 HE2 TYR 162 4.909 14.115 7.529 1204 HH TYR 162 HH TYR 162 5.570 12.338 10.272 1205 H GLN 163 H GLN 163 0.401 13.685 3.949 1206 HA GLN 163 HA GLN 163 3.062 12.939 3.218 1207 HB2 GLN 163 HB2 GLN 163 0.828 12.781 1.412 1208 HB3 GLN 163 HB3 GLN 163 2.308 13.108 0.803 1209 HG2 GLN 163 HG2 GLN 163 1.665 10.719 2.251 1210 HG3 GLN 163 HG3 GLN 163 1.754 10.808 0.623 1211 HE21 GLN 163 HE21 GLN 163 5.000 10.050 2.694 1212 HE22 GLN 163 HE22 GLN 163 3.382 9.969 3.307 1213 H VAL 164 H VAL 164 4.227 14.592 2.015 1214 HA VAL 164 HA VAL 164 2.822 17.076 1.746 1215 HB VAL 164 HB VAL 164 4.743 18.325 2.622 1216 HG11 VAL 164 HG11 VAL 164 4.296 17.907 4.964 1217 HG12 VAL 164 HG12 VAL 164 3.560 16.520 4.576 1218 HG13 VAL 164 HG13 VAL 164 2.909 17.933 4.133 1219 HG21 VAL 164 HG21 VAL 164 6.436 17.181 3.898 1220 HG22 VAL 164 HG22 VAL 164 6.476 16.690 2.358 1221 HG23 VAL 164 HG23 VAL 164 5.790 15.757 3.486 1222 H ILE 165 H ILE 165 3.371 18.302 -0.106 1223 HA ILE 165 HA ILE 165 5.605 17.337 -1.619 1224 HB ILE 165 HB ILE 165 2.996 17.782 -2.894 1225 HG12 ILE 165 HG12 ILE 165 4.350 15.251 -2.679 1226 HG13 ILE 165 HG13 ILE 165 3.120 15.697 -1.702 1227 HG21 ILE 165 HG21 ILE 165 4.053 17.081 -4.976 1228 HG22 ILE 165 HG22 ILE 165 5.472 16.940 -4.213 1229 HG23 ILE 165 HG23 ILE 165 4.800 18.398 -4.407 1230 HD11 ILE 165 HD11 ILE 165 2.307 14.230 -3.419 1231 HD12 ILE 165 HD12 ILE 165 2.842 15.244 -4.559 1232 HD13 ILE 165 HD13 ILE 165 1.624 15.686 -3.590 1233 H ASP 166 H ASP 166 6.942 19.115 -2.113 1234 HA ASP 166 HA ASP 166 5.784 21.711 -1.905 1235 HB2 ASP 166 HB2 ASP 166 8.027 21.250 -1.100 1236 HB3 ASP 166 HB3 ASP 166 8.506 21.127 -2.656 1237 H VAL 167 H VAL 167 5.145 23.047 -3.623 1238 HA VAL 167 HA VAL 167 5.934 22.128 -6.217 1239 HB VAL 167 HB VAL 167 3.707 22.733 -7.115 1240 HG11 VAL 167 HG11 VAL 167 2.656 20.651 -6.437 1241 HG12 VAL 167 HG12 VAL 167 3.724 20.508 -5.231 1242 HG13 VAL 167 HG13 VAL 167 4.220 20.400 -6.766 1243 HG21 VAL 167 HG21 VAL 167 1.843 22.860 -5.596 1244 HG22 VAL 167 HG22 VAL 167 2.870 24.078 -5.321 1245 HG23 VAL 167 HG23 VAL 167 2.858 22.794 -4.339 1246 H ASP 168 H ASP 168 6.905 23.583 -7.463 1247 HA ASP 168 HA ASP 168 6.798 26.346 -6.646 1248 HB2 ASP 168 HB2 ASP 168 8.837 24.957 -7.483 1249 HB3 ASP 168 HB3 ASP 168 8.407 25.741 -8.850 1250 H LEU 169 H LEU 169 5.032 27.441 -7.429 1251 HA LEU 169 HA LEU 169 4.120 26.602 -10.027 1252 HB2 LEU 169 HB2 LEU 169 2.550 27.799 -7.945 1253 HB3 LEU 169 HB3 LEU 169 1.964 27.425 -9.423 1254 HG LEU 169 HG LEU 169 2.743 25.589 -7.372 1255 HD11 LEU 169 HD11 LEU 169 0.423 24.865 -7.549 1256 HD12 LEU 169 HD12 LEU 169 0.178 25.971 -8.703 1257 HD13 LEU 169 HD13 LEU 169 0.490 26.440 -7.188 1258 HD21 LEU 169 HD21 LEU 169 2.217 23.756 -8.834 1259 HD22 LEU 169 HD22 LEU 169 3.470 24.598 -9.413 1260 HD23 LEU 169 HD23 LEU 169 1.999 24.793 -10.055 1261 H VAL 170 H VAL 170 3.937 27.945 -11.701 1262 HA VAL 170 HA VAL 170 4.478 30.690 -11.153 1263 HB VAL 170 HB VAL 170 6.028 30.763 -13.082 1264 HG11 VAL 170 HG11 VAL 170 7.894 29.622 -12.026 1265 HG12 VAL 170 HG12 VAL 170 6.865 28.833 -11.060 1266 HG13 VAL 170 HG13 VAL 170 7.045 30.433 -10.913 1267 HG21 VAL 170 HG21 VAL 170 6.782 28.704 -14.087 1268 HG22 VAL 170 HG22 VAL 170 5.194 28.889 -14.328 1269 HG23 VAL 170 HG23 VAL 170 5.726 27.874 -13.187 1270 H ASN 171 H ASN 171 3.846 32.263 -12.818 1271 HA ASN 171 HA ASN 171 1.554 31.498 -14.286 1272 HB2 ASN 171 HB2 ASN 171 1.910 33.737 -13.477 1273 HB3 ASN 171 HB3 ASN 171 3.051 33.920 -14.631 1274 HD21 ASN 171 HD21 ASN 171 0.402 35.468 -16.337 1275 HD22 ASN 171 HD22 ASN 171 1.732 35.775 -15.272 1276 H LYS 172 H LYS 172 1.470 31.434 -16.708 1277 HA LYS 172 HA LYS 172 3.973 30.464 -17.745 1278 HB2 LYS 172 HB2 LYS 172 2.680 29.280 -19.376 1279 HB3 LYS 172 HB3 LYS 172 2.168 28.904 -17.871 1280 HG2 LYS 172 HG2 LYS 172 0.139 29.538 -18.350 1281 HG3 LYS 172 HG3 LYS 172 0.669 31.006 -18.829 1282 HD2 LYS 172 HD2 LYS 172 0.605 28.695 -20.556 1283 HD3 LYS 172 HD3 LYS 172 -0.545 29.854 -20.560 1284 HE2 LYS 172 HE2 LYS 172 2.206 30.225 -21.371 1285 HE3 LYS 172 HE3 LYS 172 0.915 30.238 -22.371 1286 HZ1 LYS 172 HZ1 LYS 172 1.667 32.447 -21.980 1287 HZ2 LYS 172 HZ2 LYS 172 1.456 32.254 -20.388 1288 HZ3 LYS 172 HZ3 LYS 172 0.177 32.267 -21.378 Start of MODEL 3 1 H1 HIS 1 H1 HIS 1 3.527 1.883 1.706 2 H2 HIS 1 H2 HIS 1 1.926 2.023 1.528 3 H3 HIS 1 H3 HIS 1 2.906 3.180 0.966 4 HA HIS 1 HA HIS 1 3.778 1.729 -0.620 5 HB2 HIS 1 HB2 HIS 1 2.450 -0.466 -0.863 6 HB3 HIS 1 HB3 HIS 1 3.747 -0.398 0.127 7 HD1 HIS 1 HD1 HIS 1 3.450 -1.036 2.571 8 HD2 HIS 1 HD2 HIS 1 -0.065 -0.332 0.574 9 HE1 HIS 1 HE1 HIS 1 1.552 -1.643 4.065 10 HE2 HIS 1 HE2 HIS 1 -0.572 -1.224 2.884 11 H GLY 2 H GLY 2 3.047 3.278 -2.016 12 HA2 GLY 2 HA2 GLY 2 0.823 2.721 -3.598 13 HA3 GLY 2 HA3 GLY 2 0.423 3.912 -2.555 14 H PHE 3 H PHE 3 0.534 4.840 -5.138 15 HA PHE 3 HA PHE 3 2.834 6.446 -5.061 16 HB2 PHE 3 HB2 PHE 3 3.745 5.803 -7.195 17 HB3 PHE 3 HB3 PHE 3 3.701 4.504 -6.206 18 HD1 PHE 3 HD1 PHE 3 2.410 5.902 -9.205 19 HD2 PHE 3 HD2 PHE 3 2.113 2.662 -6.611 20 HE1 PHE 3 HE1 PHE 3 1.227 4.666 -10.896 21 HE2 PHE 3 HE2 PHE 3 0.918 1.414 -8.298 22 HZ PHE 3 HZ PHE 3 0.483 2.418 -10.453 23 H ILE 4 H ILE 4 3.064 7.948 -7.027 24 HA ILE 4 HA ILE 4 0.493 9.146 -7.345 25 HB ILE 4 HB ILE 4 3.079 10.276 -8.120 26 HG12 ILE 4 HG12 ILE 4 3.151 9.863 -5.805 27 HG13 ILE 4 HG13 ILE 4 3.166 11.472 -6.089 28 HG21 ILE 4 HG21 ILE 4 2.002 12.439 -8.091 29 HG22 ILE 4 HG22 ILE 4 0.593 11.733 -7.729 30 HG23 ILE 4 HG23 ILE 4 1.284 11.469 -9.167 31 HD11 ILE 4 HD11 ILE 4 1.764 10.988 -4.209 32 HD12 ILE 4 HD12 ILE 4 0.850 10.014 -5.120 33 HD13 ILE 4 HD13 ILE 4 0.864 11.606 -5.402 34 H GLU 5 H GLU 5 -0.675 9.123 -9.233 35 HA GLU 5 HA GLU 5 0.456 7.688 -11.401 36 HB2 GLU 5 HB2 GLU 5 -2.244 8.644 -10.895 37 HB3 GLU 5 HB3 GLU 5 -1.883 7.848 -12.275 38 HG2 GLU 5 HG2 GLU 5 -1.338 6.550 -9.827 39 HG3 GLU 5 HG3 GLU 5 -2.892 6.629 -10.322 40 H LYS 6 H LYS 6 1.005 10.550 -10.734 41 HA LYS 6 HA LYS 6 1.744 12.315 -11.924 42 HB2 LYS 6 HB2 LYS 6 0.592 11.383 -14.392 43 HB3 LYS 6 HB3 LYS 6 1.706 12.568 -14.239 44 HG2 LYS 6 HG2 LYS 6 3.407 11.113 -14.023 45 HG3 LYS 6 HG3 LYS 6 2.446 9.927 -13.442 46 HD2 LYS 6 HD2 LYS 6 1.456 9.771 -15.670 47 HD3 LYS 6 HD3 LYS 6 2.633 10.774 -16.193 48 HE2 LYS 6 HE2 LYS 6 4.283 9.186 -15.664 49 HE3 LYS 6 HE3 LYS 6 3.165 8.204 -14.990 50 HZ1 LYS 6 HZ1 LYS 6 3.720 7.431 -17.171 51 HZ2 LYS 6 HZ2 LYS 6 3.275 8.853 -17.800 52 HZ3 LYS 6 HZ3 LYS 6 2.168 7.881 -17.132 53 HA PRO 7 HA PRO 7 1.619 14.545 -13.325 54 HB2 PRO 7 HB2 PRO 7 0.518 16.835 -11.916 55 HB3 PRO 7 HB3 PRO 7 1.043 16.823 -13.463 56 HG2 PRO 7 HG2 PRO 7 -1.432 16.954 -13.034 57 HG3 PRO 7 HG3 PRO 7 -0.904 15.978 -14.232 58 HD2 PRO 7 HD2 PRO 7 -1.644 15.208 -11.565 59 HD3 PRO 7 HD3 PRO 7 -2.118 14.510 -12.964 60 H GLY 8 H GLY 8 3.576 15.025 -12.436 61 HA2 GLY 8 HA2 GLY 8 4.855 15.761 -10.676 62 HA3 GLY 8 HA3 GLY 8 3.599 15.600 -9.645 63 H SER 9 H SER 9 4.033 12.808 -11.392 64 HA SER 9 HA SER 9 4.689 11.373 -9.155 65 HB2 SER 9 HB2 SER 9 3.652 10.350 -11.103 66 HB3 SER 9 HB3 SER 9 5.077 10.454 -11.894 67 HG SER 9 HG SER 9 5.107 9.170 -9.513 68 H ARG 10 H ARG 10 6.513 10.708 -8.137 69 HA ARG 10 HA ARG 10 8.923 11.897 -8.879 70 HB2 ARG 10 HB2 ARG 10 8.275 11.303 -6.587 71 HB3 ARG 10 HB3 ARG 10 8.605 9.747 -6.960 72 HG2 ARG 10 HG2 ARG 10 10.861 10.161 -7.083 73 HG3 ARG 10 HG3 ARG 10 10.632 11.778 -7.093 74 HD2 ARG 10 HD2 ARG 10 9.861 11.672 -4.836 75 HD3 ARG 10 HD3 ARG 10 10.126 10.060 -4.829 76 HE ARG 10 HE ARG 10 12.536 10.937 -5.450 77 HH11 ARG 10 HH11 ARG 10 14.138 11.575 -4.110 78 HH12 ARG 10 HH12 ARG 10 13.790 12.181 -2.525 79 HH21 ARG 10 HH21 ARG 10 10.369 11.867 -2.826 80 HH22 ARG 10 HH22 ARG 10 11.685 12.345 -1.806 81 H ALA 11 H ALA 11 7.524 8.895 -9.588 82 HA ALA 11 HA ALA 11 9.790 7.478 -10.207 83 HB1 ALA 11 HB1 ALA 11 7.608 6.420 -10.015 84 HB2 ALA 11 HB2 ALA 11 8.285 5.990 -11.419 85 HB3 ALA 11 HB3 ALA 11 7.139 7.130 -11.391 86 H ALA 12 H ALA 12 8.110 9.832 -12.049 87 HA ALA 12 HA ALA 12 9.238 9.263 -14.506 88 HB1 ALA 12 HB1 ALA 12 7.341 10.756 -14.294 89 HB2 ALA 12 HB2 ALA 12 8.508 11.503 -15.128 90 HB3 ALA 12 HB3 ALA 12 8.276 11.856 -13.567 91 H LEU 13 H LEU 13 10.400 11.050 -11.827 92 HA LEU 13 HA LEU 13 12.587 12.141 -13.229 93 HB2 LEU 13 HB2 LEU 13 12.100 12.130 -10.371 94 HB3 LEU 13 HB3 LEU 13 13.207 13.081 -11.105 95 HG LEU 13 HG LEU 13 10.369 13.419 -11.413 96 HD11 LEU 13 HD11 LEU 13 10.656 15.330 -9.940 97 HD12 LEU 13 HD12 LEU 13 12.220 14.961 -9.767 98 HD13 LEU 13 HD13 LEU 13 11.086 13.977 -9.165 99 HD21 LEU 13 HD21 LEU 13 10.892 15.495 -12.445 100 HD22 LEU 13 HD22 LEU 13 11.534 14.273 -13.288 101 HD23 LEU 13 HD23 LEU 13 12.470 15.169 -12.320 102 H CYS 14 H CYS 14 11.992 9.205 -11.957 103 HA CYS 14 HA CYS 14 14.534 8.713 -10.846 104 HB2 CYS 14 HB2 CYS 14 12.455 7.681 -10.158 105 HB3 CYS 14 HB3 CYS 14 12.552 6.767 -11.507 106 H SER 15 H SER 15 13.276 8.697 -13.918 107 HA SER 15 HA SER 15 15.247 6.857 -14.895 108 HB2 SER 15 HB2 SER 15 13.031 6.549 -15.783 109 HB3 SER 15 HB3 SER 15 13.044 8.077 -16.361 110 HG SER 15 HG SER 15 15.136 6.707 -17.222 111 H GLU 16 H GLU 16 16.984 7.428 -16.183 112 HA GLU 16 HA GLU 16 17.720 10.111 -16.238 113 HB2 GLU 16 HB2 GLU 16 19.586 9.392 -17.520 114 HB3 GLU 16 HB3 GLU 16 19.342 8.370 -16.270 115 HG2 GLU 16 HG2 GLU 16 18.278 6.838 -17.766 116 HG3 GLU 16 HG3 GLU 16 18.607 7.848 -19.006 117 H ALA 17 H ALA 17 15.727 8.288 -18.210 118 HA ALA 17 HA ALA 17 15.983 9.602 -20.591 119 HB1 ALA 17 HB1 ALA 17 14.719 7.536 -20.366 120 HB2 ALA 17 HB2 ALA 17 13.814 8.634 -21.135 121 HB3 ALA 17 HB3 ALA 17 13.559 8.330 -19.567 122 H PHE 18 H PHE 18 14.872 10.873 -17.758 123 HA PHE 18 HA PHE 18 12.959 12.621 -18.855 124 HB2 PHE 18 HB2 PHE 18 13.057 11.750 -16.495 125 HB3 PHE 18 HB3 PHE 18 14.164 12.922 -16.230 126 HD1 PHE 18 HD1 PHE 18 13.505 15.240 -15.964 127 HD2 PHE 18 HD2 PHE 18 10.691 12.310 -16.858 128 HE1 PHE 18 HE1 PHE 18 11.736 16.811 -15.496 129 HE2 PHE 18 HE2 PHE 18 8.908 13.868 -16.383 130 HZ PHE 18 HZ PHE 18 9.429 16.127 -15.709 131 H GLY 19 H GLY 19 16.299 12.705 -18.786 132 HA2 GLY 19 HA2 GLY 19 16.372 15.186 -19.995 133 HA3 GLY 19 HA3 GLY 19 16.759 15.385 -18.421 134 H PHE 20 H PHE 20 18.037 12.614 -18.757 135 HA PHE 20 HA PHE 20 19.984 11.810 -19.017 136 HB2 PHE 20 HB2 PHE 20 19.507 12.411 -21.422 137 HB3 PHE 20 HB3 PHE 20 20.669 13.544 -21.244 138 HD1 PHE 20 HD1 PHE 20 20.166 9.962 -20.998 139 HD2 PHE 20 HD2 PHE 20 22.923 13.005 -21.678 140 HE1 PHE 20 HE1 PHE 20 21.841 8.311 -21.532 141 HE2 PHE 20 HE2 PHE 20 24.608 11.363 -22.224 142 HZ PHE 20 HZ PHE 20 24.068 9.010 -22.145 143 H LEU 21 H LEU 21 20.289 15.191 -18.778 144 HA LEU 21 HA LEU 21 22.985 15.222 -18.176 145 HB2 LEU 21 HB2 LEU 21 20.940 17.099 -17.348 146 HB3 LEU 21 HB3 LEU 21 22.540 17.416 -17.251 147 HG LEU 21 HG LEU 21 21.154 17.069 -19.749 148 HD11 LEU 21 HD11 LEU 21 21.270 19.479 -19.953 149 HD12 LEU 21 HD12 LEU 21 21.921 19.571 -18.476 150 HD13 LEU 21 HD13 LEU 21 20.391 19.078 -18.656 151 HD21 LEU 21 HD21 LEU 21 23.119 17.979 -20.766 152 HD22 LEU 21 HD22 LEU 21 23.482 16.619 -19.969 153 HD23 LEU 21 HD23 LEU 21 23.838 18.057 -19.320 154 H ASN 22 H ASN 22 20.256 14.433 -16.332 155 HA ASN 22 HA ASN 22 21.774 13.437 -14.211 156 HB2 ASN 22 HB2 ASN 22 21.448 15.967 -13.798 157 HB3 ASN 22 HB3 ASN 22 20.014 15.460 -13.204 158 HD21 ASN 22 HD21 ASN 22 22.553 15.712 -10.514 159 HD22 ASN 22 HD22 ASN 22 22.018 16.799 -11.752 160 H LEU 23 H LEU 23 20.273 12.559 -12.421 161 HA LEU 23 HA LEU 23 17.525 12.248 -13.247 162 HB2 LEU 23 HB2 LEU 23 17.420 10.020 -12.931 163 HB3 LEU 23 HB3 LEU 23 18.697 10.276 -13.916 164 HG LEU 23 HG LEU 23 18.963 9.629 -11.138 165 HD11 LEU 23 HD11 LEU 23 19.526 7.385 -11.932 166 HD12 LEU 23 HD12 LEU 23 19.219 7.857 -13.448 167 HD13 LEU 23 HD13 LEU 23 18.016 7.764 -12.371 168 HD21 LEU 23 HD21 LEU 23 21.251 9.136 -11.587 169 HD22 LEU 23 HD22 LEU 23 20.932 10.689 -11.905 170 HD23 LEU 23 HD23 LEU 23 21.061 9.626 -13.116 171 H ASN 24 H ASN 24 16.079 11.910 -11.328 172 HA ASN 24 HA ASN 24 17.439 12.705 -8.942 173 HB2 ASN 24 HB2 ASN 24 14.940 13.935 -9.829 174 HB3 ASN 24 HB3 ASN 24 15.751 14.387 -8.484 175 HD21 ASN 24 HD21 ASN 24 18.399 15.953 -10.390 176 HD22 ASN 24 HD22 ASN 24 18.275 14.748 -9.151 177 H CYS 25 H CYS 25 16.808 10.124 -9.105 178 HA CYS 25 HA CYS 25 14.271 9.574 -8.145 179 HB2 CYS 25 HB2 CYS 25 15.971 8.076 -9.175 180 HB3 CYS 25 HB3 CYS 25 16.447 7.818 -7.634 181 H GLY 26 H GLY 26 17.295 9.284 -6.372 182 HA2 GLY 26 HA2 GLY 26 17.664 10.077 -4.240 183 HA3 GLY 26 HA3 GLY 26 16.069 10.349 -4.021 184 H SER 27 H SER 27 17.990 9.094 -2.223 185 HA SER 27 HA SER 27 17.720 6.360 -2.319 186 HB2 SER 27 HB2 SER 27 19.474 7.532 -1.035 187 HB3 SER 27 HB3 SER 27 18.347 7.949 0.070 188 HG SER 27 HG SER 27 18.892 6.234 1.032 189 H VAL 28 H VAL 28 15.683 8.648 -0.872 190 HA VAL 28 HA VAL 28 14.366 6.937 0.857 191 HB VAL 28 HB VAL 28 14.368 9.469 0.894 192 HG11 VAL 28 HG11 VAL 28 12.607 10.587 -0.267 193 HG12 VAL 28 HG12 VAL 28 12.178 9.194 -0.967 194 HG13 VAL 28 HG13 VAL 28 13.607 9.867 -1.314 195 HG21 VAL 28 HG21 VAL 28 12.287 9.675 2.052 196 HG22 VAL 28 HG22 VAL 28 13.070 8.345 2.535 197 HG23 VAL 28 HG23 VAL 28 11.831 8.224 1.502 198 H MET 29 H MET 29 14.353 6.609 -2.291 199 HA MET 29 HA MET 29 11.778 6.230 -2.987 200 HB2 MET 29 HB2 MET 29 12.679 4.845 -4.799 201 HB3 MET 29 HB3 MET 29 13.606 6.170 -4.574 202 HG2 MET 29 HG2 MET 29 15.116 4.900 -3.324 203 HG3 MET 29 HG3 MET 29 14.189 3.575 -3.551 204 HE1 MET 29 HE1 MET 29 14.695 2.525 -7.160 205 HE2 MET 29 HE2 MET 29 13.412 3.171 -6.418 206 HE3 MET 29 HE3 MET 29 14.269 2.010 -5.688 207 H TYR 30 H TYR 30 13.276 4.371 -0.741 208 HA TYR 30 HA TYR 30 11.994 1.923 -1.263 209 HB2 TYR 30 HB2 TYR 30 14.017 1.962 -0.022 210 HB3 TYR 30 HB3 TYR 30 13.347 2.945 1.097 211 HD1 TYR 30 HD1 TYR 30 13.410 -0.477 -0.069 212 HD2 TYR 30 HD2 TYR 30 12.119 2.055 2.968 213 HE1 TYR 30 HE1 TYR 30 12.844 -2.393 1.299 214 HE2 TYR 30 HE2 TYR 30 11.544 0.151 4.321 215 HH TYR 30 HH TYR 30 11.763 -2.085 4.616 216 H GLU 31 H GLU 31 11.279 4.679 0.711 217 HA GLU 31 HA GLU 31 8.630 3.734 1.066 218 HB2 GLU 31 HB2 GLU 31 8.723 4.098 3.501 219 HB3 GLU 31 HB3 GLU 31 9.662 2.856 3.008 220 HG2 GLU 31 HG2 GLU 31 11.578 4.339 3.124 221 HG3 GLU 31 HG3 GLU 31 10.604 5.477 3.775 222 HA PRO 32 HA PRO 32 9.142 8.214 0.958 223 HB2 PRO 32 HB2 PRO 32 8.360 8.985 -1.484 224 HB3 PRO 32 HB3 PRO 32 9.881 8.423 -1.295 225 HG2 PRO 32 HG2 PRO 32 7.588 6.986 -2.179 226 HG3 PRO 32 HG3 PRO 32 9.071 7.025 -2.862 227 HD2 PRO 32 HD2 PRO 32 8.403 5.049 -1.314 228 HD3 PRO 32 HD3 PRO 32 9.943 5.593 -1.326 229 H GLN 33 H GLN 33 6.510 6.332 0.249 230 HA GLN 33 HA GLN 33 4.754 8.490 0.819 231 HB2 GLN 33 HB2 GLN 33 4.385 5.956 -0.465 232 HB3 GLN 33 HB3 GLN 33 3.066 6.558 0.286 233 HG2 GLN 33 HG2 GLN 33 2.866 7.221 -1.906 234 HG3 GLN 33 HG3 GLN 33 3.336 8.561 -1.099 235 HE21 GLN 33 HE21 GLN 33 5.778 6.866 -3.813 236 HE22 GLN 33 HE22 GLN 33 4.455 5.989 -3.120 237 H SER 34 H SER 34 6.379 6.625 2.794 238 HA SER 34 HA SER 34 4.096 6.049 4.448 239 HB2 SER 34 HB2 SER 34 6.086 4.352 3.734 240 HB3 SER 34 HB3 SER 34 6.477 4.724 5.275 241 HG SER 34 HG SER 34 3.930 4.188 5.184 242 H LEU 35 H LEU 35 3.784 7.985 5.475 243 HA LEU 35 HA LEU 35 5.636 8.362 7.683 244 HB2 LEU 35 HB2 LEU 35 4.069 10.447 6.532 245 HB3 LEU 35 HB3 LEU 35 5.084 10.606 7.801 246 HG LEU 35 HG LEU 35 6.018 9.950 5.166 247 HD11 LEU 35 HD11 LEU 35 6.623 12.276 4.937 248 HD12 LEU 35 HD12 LEU 35 5.920 12.596 6.358 249 HD13 LEU 35 HD13 LEU 35 5.020 12.133 5.097 250 HD21 LEU 35 HD21 LEU 35 8.172 10.603 5.985 251 HD22 LEU 35 HD22 LEU 35 7.585 9.384 6.870 252 HD23 LEU 35 HD23 LEU 35 7.535 10.896 7.442 253 H GLU 36 H GLU 36 4.629 8.104 9.756 254 HA GLU 36 HA GLU 36 1.778 7.874 9.647 255 HB2 GLU 36 HB2 GLU 36 3.457 5.980 11.084 256 HB3 GLU 36 HB3 GLU 36 1.832 5.868 10.974 257 HG2 GLU 36 HG2 GLU 36 2.148 5.622 8.558 258 HG3 GLU 36 HG3 GLU 36 3.736 5.412 8.879 259 H ALA 37 H ALA 37 0.495 8.312 11.445 260 HA ALA 37 HA ALA 37 1.869 9.214 13.830 261 HB1 ALA 37 HB1 ALA 37 1.246 11.225 12.698 262 HB2 ALA 37 HB2 ALA 37 0.326 11.077 14.019 263 HB3 ALA 37 HB3 ALA 37 -0.280 10.709 12.566 264 H LYS 38 H LYS 38 0.619 8.750 15.828 265 HA LYS 38 HA LYS 38 -1.277 6.682 15.423 266 HB2 LYS 38 HB2 LYS 38 0.238 6.669 17.308 267 HB3 LYS 38 HB3 LYS 38 -0.628 7.892 17.956 268 HG2 LYS 38 HG2 LYS 38 -2.517 6.498 18.131 269 HG3 LYS 38 HG3 LYS 38 -1.708 5.279 17.405 270 HD2 LYS 38 HD2 LYS 38 -0.216 5.205 19.259 271 HD3 LYS 38 HD3 LYS 38 -1.102 6.365 19.992 272 HE2 LYS 38 HE2 LYS 38 -2.996 4.918 20.001 273 HE3 LYS 38 HE3 LYS 38 -2.119 3.760 19.255 274 HZ1 LYS 38 HZ1 LYS 38 -2.263 3.308 21.574 275 HZ2 LYS 38 HZ2 LYS 38 -1.593 4.741 21.907 276 HZ3 LYS 38 HZ3 LYS 38 -0.725 3.594 21.168 277 H LYS 39 H LYS 39 -3.536 6.756 15.576 278 HA LYS 39 HA LYS 39 -4.739 9.232 15.294 279 HB2 LYS 39 HB2 LYS 39 -5.862 6.636 15.877 280 HB3 LYS 39 HB3 LYS 39 -6.830 7.938 15.688 281 HG2 LYS 39 HG2 LYS 39 -6.502 8.024 13.482 282 HG3 LYS 39 HG3 LYS 39 -5.035 7.311 13.576 283 HD2 LYS 39 HD2 LYS 39 -6.525 5.830 12.550 284 HD3 LYS 39 HD3 LYS 39 -6.098 5.224 14.005 285 HE2 LYS 39 HE2 LYS 39 -8.181 5.965 14.912 286 HE3 LYS 39 HE3 LYS 39 -8.609 6.532 13.441 287 HZ1 LYS 39 HZ1 LYS 39 -9.558 4.376 13.794 288 HZ2 LYS 39 HZ2 LYS 39 -8.082 3.756 14.023 289 HZ3 LYS 39 HZ3 LYS 39 -8.506 4.317 12.567 290 H GLY 40 H GLY 40 -5.695 10.680 16.678 291 HA2 GLY 40 HA2 GLY 40 -6.594 10.037 19.206 292 HA3 GLY 40 HA3 GLY 40 -5.075 10.618 19.359 293 H PHE 41 H PHE 41 -6.733 12.164 20.634 294 HA PHE 41 HA PHE 41 -7.692 14.198 18.888 295 HB2 PHE 41 HB2 PHE 41 -7.800 13.985 21.774 296 HB3 PHE 41 HB3 PHE 41 -8.439 15.255 20.970 297 HD1 PHE 41 HD1 PHE 41 -8.937 11.844 21.858 298 HD2 PHE 41 HD2 PHE 41 -10.484 15.000 19.629 299 HE1 PHE 41 HE1 PHE 41 -11.025 10.652 21.631 300 HE2 PHE 41 HE2 PHE 41 -12.576 13.819 19.394 301 HZ PHE 41 HZ PHE 41 -12.848 11.640 20.393 302 HA PRO 42 HA PRO 42 -7.929 16.506 18.599 303 HB2 PRO 42 HB2 PRO 42 -6.880 18.684 17.550 304 HB3 PRO 42 HB3 PRO 42 -7.133 18.681 19.164 305 HG2 PRO 42 HG2 PRO 42 -4.707 18.123 17.776 306 HG3 PRO 42 HG3 PRO 42 -4.923 19.120 19.052 307 HD2 PRO 42 HD2 PRO 42 -4.045 16.665 19.387 308 HD3 PRO 42 HD3 PRO 42 -4.939 17.402 20.539 309 H HIS 43 H HIS 43 -8.566 16.846 16.328 310 HA HIS 43 HA HIS 43 -6.625 15.845 14.493 311 HB2 HIS 43 HB2 HIS 43 -8.071 14.005 15.572 312 HB3 HIS 43 HB3 HIS 43 -9.131 14.449 14.411 313 HD1 HIS 43 HD1 HIS 43 -5.475 13.494 14.474 314 HD2 HIS 43 HD2 HIS 43 -8.855 12.883 12.229 315 HE1 HIS 43 HE1 HIS 43 -4.915 11.962 12.592 316 HE2 HIS 43 HE2 HIS 43 -6.944 11.560 11.248 317 H SER 44 H SER 44 -7.977 18.336 14.799 318 HA SER 44 HA SER 44 -9.767 18.396 12.597 319 HB2 SER 44 HB2 SER 44 -10.278 19.683 14.632 320 HB3 SER 44 HB3 SER 44 -9.014 20.659 14.290 321 HG SER 44 HG SER 44 -10.122 21.068 12.269 322 H GLY 45 H GLY 45 -6.552 19.280 13.213 323 HA2 GLY 45 HA2 GLY 45 -6.376 20.643 10.657 324 HA3 GLY 45 HA3 GLY 45 -5.388 20.950 11.920 325 HA PRO 46 HA PRO 46 -3.571 17.595 9.437 326 HB2 PRO 46 HB2 PRO 46 -1.739 18.752 7.883 327 HB3 PRO 46 HB3 PRO 46 -3.296 18.799 7.392 328 HG2 PRO 46 HG2 PRO 46 -1.826 20.806 8.755 329 HG3 PRO 46 HG3 PRO 46 -2.801 20.978 7.456 330 HD2 PRO 46 HD2 PRO 46 -3.657 21.514 9.899 331 HD3 PRO 46 HD3 PRO 46 -4.682 21.011 8.732 332 H ALA 47 H ALA 47 -2.187 20.002 11.317 333 HA ALA 47 HA ALA 47 0.319 18.779 11.584 334 HB1 ALA 47 HB1 ALA 47 0.069 21.119 12.095 335 HB2 ALA 47 HB2 ALA 47 0.650 20.363 13.401 336 HB3 ALA 47 HB3 ALA 47 -0.915 20.762 13.328 337 H ASP 48 H ASP 48 0.964 17.099 12.839 338 HA ASP 48 HA ASP 48 -0.603 16.356 15.123 339 HB2 ASP 48 HB2 ASP 48 -1.331 15.129 13.008 340 HB3 ASP 48 HB3 ASP 48 -0.040 14.193 13.363 341 H GLY 49 H GLY 49 0.607 14.518 16.343 342 HA2 GLY 49 HA2 GLY 49 2.544 13.625 17.061 343 HA3 GLY 49 HA3 GLY 49 3.311 14.152 15.719 344 H GLN 50 H GLN 50 2.763 16.958 16.198 345 HA GLN 50 HA GLN 50 4.443 17.402 18.504 346 HB2 GLN 50 HB2 GLN 50 4.597 18.820 15.992 347 HB3 GLN 50 HB3 GLN 50 5.401 19.306 17.328 348 HG2 GLN 50 HG2 GLN 50 6.584 17.192 17.270 349 HG3 GLN 50 HG3 GLN 50 5.906 16.928 15.808 350 HE21 GLN 50 HE21 GLN 50 8.548 18.444 14.202 351 HE22 GLN 50 HE22 GLN 50 7.486 17.080 14.315 352 H ILE 51 H ILE 51 1.770 17.350 18.810 353 HA ILE 51 HA ILE 51 0.475 19.664 18.253 354 HB ILE 51 HB ILE 51 -0.088 17.828 20.483 355 HG12 ILE 51 HG12 ILE 51 -0.153 16.695 18.422 356 HG13 ILE 51 HG13 ILE 51 -1.639 16.727 19.099 357 HG21 ILE 51 HG21 ILE 51 -2.358 18.664 20.546 358 HG22 ILE 51 HG22 ILE 51 -1.989 19.758 19.415 359 HG23 ILE 51 HG23 ILE 51 -1.317 19.855 20.882 360 HD11 ILE 51 HD11 ILE 51 -1.809 17.117 16.737 361 HD12 ILE 51 HD12 ILE 51 -0.835 18.402 16.863 362 HD13 ILE 51 HD13 ILE 51 -2.306 18.433 17.533 363 H ALA 52 H ALA 52 2.229 18.863 21.147 364 HA ALA 52 HA ALA 52 1.383 21.083 22.543 365 HB1 ALA 52 HB1 ALA 52 2.321 19.099 23.650 366 HB2 ALA 52 HB2 ALA 52 3.082 20.421 24.186 367 HB3 ALA 52 HB3 ALA 52 3.785 19.478 23.076 368 H SER 53 H SER 53 4.132 20.699 20.507 369 HA SER 53 HA SER 53 5.127 23.238 21.349 370 HB2 SER 53 HB2 SER 53 7.135 22.577 20.036 371 HB3 SER 53 HB3 SER 53 6.757 21.439 21.144 372 HG SER 53 HG SER 53 6.272 20.074 19.670 373 H ALA 54 H ALA 54 3.378 21.962 18.848 374 HA ALA 54 HA ALA 54 2.897 22.590 16.773 375 HB1 ALA 54 HB1 ALA 54 1.895 24.516 17.812 376 HB2 ALA 54 HB2 ALA 54 2.449 24.927 16.349 377 HB3 ALA 54 HB3 ALA 54 3.285 25.330 17.673 378 H GLY 55 H GLY 55 5.625 21.887 17.333 379 HA2 GLY 55 HA2 GLY 55 7.362 23.647 16.058 380 HA3 GLY 55 HA3 GLY 55 7.703 22.113 16.503 381 H GLY 56 H GLY 56 5.363 21.237 14.786 382 HA2 GLY 56 HA2 GLY 56 6.848 20.553 12.554 383 HA3 GLY 56 HA3 GLY 56 5.229 20.396 12.699 384 H LEU 57 H LEU 57 5.073 23.375 13.175 385 HA LEU 57 HA LEU 57 4.495 24.105 10.573 386 HB2 LEU 57 HB2 LEU 57 4.974 25.850 12.835 387 HB3 LEU 57 HB3 LEU 57 4.198 26.314 11.474 388 HG LEU 57 HG LEU 57 3.130 24.361 13.309 389 HD11 LEU 57 HD11 LEU 57 1.651 26.103 14.030 390 HD12 LEU 57 HD12 LEU 57 2.404 27.151 13.055 391 HD13 LEU 57 HD13 LEU 57 3.182 26.526 14.328 392 HD21 LEU 57 HD21 LEU 57 1.098 24.607 12.127 393 HD22 LEU 57 HD22 LEU 57 2.260 24.079 11.134 394 HD23 LEU 57 HD23 LEU 57 1.809 25.632 11.097 395 H PHE 58 H PHE 58 7.261 24.574 12.538 396 HA PHE 58 HA PHE 58 8.568 26.337 10.827 397 HB2 PHE 58 HB2 PHE 58 9.747 24.726 12.921 398 HB3 PHE 58 HB3 PHE 58 10.440 26.054 12.271 399 HD1 PHE 58 HD1 PHE 58 8.669 24.956 14.969 400 HD2 PHE 58 HD2 PHE 58 8.960 28.260 12.464 401 HE1 PHE 58 HE1 PHE 58 7.556 26.303 16.635 402 HE2 PHE 58 HE2 PHE 58 7.868 29.628 14.128 403 HZ PHE 58 HZ PHE 58 7.150 28.646 16.212 404 H GLY 59 H GLY 59 8.069 23.080 10.588 405 HA2 GLY 59 HA2 GLY 59 10.369 22.179 9.419 406 HA3 GLY 59 HA3 GLY 59 8.878 21.582 9.124 407 H GLY 60 H GLY 60 8.002 24.255 8.029 408 HA2 GLY 60 HA2 GLY 60 8.664 23.810 5.362 409 HA3 GLY 60 HA3 GLY 60 7.945 25.153 5.951 410 H ILE 61 H ILE 61 10.211 25.641 7.793 411 HA ILE 61 HA ILE 61 11.822 27.133 6.029 412 HB ILE 61 HB ILE 61 12.226 26.725 8.897 413 HG12 ILE 61 HG12 ILE 61 10.153 27.762 8.536 414 HG13 ILE 61 HG13 ILE 61 11.179 28.810 9.254 415 HG21 ILE 61 HG21 ILE 61 13.655 28.667 8.860 416 HG22 ILE 61 HG22 ILE 61 13.478 28.773 7.256 417 HG23 ILE 61 HG23 ILE 61 14.261 27.514 7.902 418 HD11 ILE 61 HD11 ILE 61 9.905 29.950 7.556 419 HD12 ILE 61 HD12 ILE 61 10.452 28.922 6.434 420 HD13 ILE 61 HD13 ILE 61 11.469 29.959 7.145 421 H LEU 62 H LEU 62 12.098 24.241 7.903 422 HA LEU 62 HA LEU 62 14.766 23.740 7.385 423 HB2 LEU 62 HB2 LEU 62 12.626 22.092 8.300 424 HB3 LEU 62 HB3 LEU 62 14.006 21.345 7.849 425 HG LEU 62 HG LEU 62 15.155 22.626 9.538 426 HD11 LEU 62 HD11 LEU 62 13.923 23.638 11.316 427 HD12 LEU 62 HD12 LEU 62 12.545 23.384 10.510 428 HD13 LEU 62 HD13 LEU 62 13.648 24.410 9.922 429 HD21 LEU 62 HD21 LEU 62 14.373 21.184 11.351 430 HD22 LEU 62 HD22 LEU 62 14.495 20.335 9.981 431 HD23 LEU 62 HD23 LEU 62 13.047 20.841 10.492 432 H ASP 63 H ASP 63 11.915 23.138 5.566 433 HA ASP 63 HA ASP 63 13.036 21.331 3.812 434 HB2 ASP 63 HB2 ASP 63 10.618 21.755 4.081 435 HB3 ASP 63 HB3 ASP 63 10.814 23.045 3.099 436 H GLN 64 H GLN 64 13.693 24.574 4.081 437 HA GLN 64 HA GLN 64 14.259 25.132 1.409 438 HB2 GLN 64 HB2 GLN 64 15.393 26.326 3.758 439 HB3 GLN 64 HB3 GLN 64 15.672 26.885 2.249 440 HG2 GLN 64 HG2 GLN 64 13.319 27.327 2.020 441 HG3 GLN 64 HG3 GLN 64 13.108 26.863 3.572 442 HE21 GLN 64 HE21 GLN 64 14.694 30.470 2.723 443 HE22 GLN 64 HE22 GLN 64 14.639 29.204 1.543 444 H GLN 65 H GLN 65 16.145 23.836 4.050 445 HA GLN 65 HA GLN 65 17.607 22.242 2.277 446 HB2 GLN 65 HB2 GLN 65 18.953 24.259 2.254 447 HB3 GLN 65 HB3 GLN 65 19.203 24.071 3.857 448 HG2 GLN 65 HG2 GLN 65 19.980 21.873 2.252 449 HG3 GLN 65 HG3 GLN 65 20.895 23.215 2.083 450 HE21 GLN 65 HE21 GLN 65 21.593 20.771 5.088 451 HE22 GLN 65 HE22 GLN 65 20.528 20.414 3.769 452 H SER 66 H SER 66 17.288 20.310 3.221 453 HA SER 66 HA SER 66 18.427 19.890 5.813 454 HB2 SER 66 HB2 SER 66 16.166 20.341 6.420 455 HB3 SER 66 HB3 SER 66 15.651 19.185 5.388 456 HG SER 66 HG SER 66 16.557 18.936 7.856 457 H GLU 67 H GLU 67 18.666 17.474 6.187 458 HA GLU 67 HA GLU 67 19.350 16.193 3.800 459 HB2 GLU 67 HB2 GLU 67 19.264 15.263 6.529 460 HB3 GLU 67 HB3 GLU 67 19.726 14.265 5.322 461 HG2 GLU 67 HG2 GLU 67 21.645 15.139 6.367 462 HG3 GLU 67 HG3 GLU 67 21.561 15.724 4.844 463 H ASN 68 H ASN 68 16.556 16.240 5.753 464 HA ASN 68 HA ASN 68 15.383 14.101 4.254 465 HB2 ASN 68 HB2 ASN 68 13.779 13.870 5.941 466 HB3 ASN 68 HB3 ASN 68 15.195 14.113 6.719 467 HD21 ASN 68 HD21 ASN 68 12.290 16.277 7.878 468 HD22 ASN 68 HD22 ASN 68 12.268 14.652 7.279 469 H ARG 69 H ARG 69 15.818 16.877 3.337 470 HA ARG 69 HA ARG 69 13.477 18.267 3.018 471 HB2 ARG 69 HB2 ARG 69 15.588 19.159 2.415 472 HB3 ARG 69 HB3 ARG 69 15.740 18.054 1.222 473 HG2 ARG 69 HG2 ARG 69 14.249 19.148 -0.107 474 HG3 ARG 69 HG3 ARG 69 13.730 20.083 1.127 475 HD2 ARG 69 HD2 ARG 69 15.177 21.324 -0.320 476 HD3 ARG 69 HD3 ARG 69 15.826 21.205 1.174 477 HE ARG 69 HE ARG 69 16.813 19.109 -0.314 478 HH11 ARG 69 HH11 ARG 69 17.154 22.617 -0.178 479 HH12 ARG 69 HH12 ARG 69 18.740 22.567 -0.872 480 HH21 ARG 69 HH21 ARG 69 18.836 19.143 -1.190 481 HH22 ARG 69 HH22 ARG 69 19.672 20.641 -1.432 482 H TRP 70 H TRP 70 11.865 18.464 1.408 483 HA TRP 70 HA TRP 70 11.232 15.895 0.347 484 HB2 TRP 70 HB2 TRP 70 9.588 18.289 0.289 485 HB3 TRP 70 HB3 TRP 70 9.043 16.768 0.052 486 HD1 TRP 70 HD1 TRP 70 10.078 15.304 2.542 487 HE1 TRP 70 HE1 TRP 70 9.353 15.768 4.894 488 HE3 TRP 70 HE3 TRP 70 8.310 19.918 1.755 489 HZ2 TRP 70 HZ2 TRP 70 8.171 17.965 6.205 490 HZ3 TRP 70 HZ3 TRP 70 7.414 21.166 3.630 491 HH2 TRP 70 HH2 TRP 70 7.356 20.184 5.837 492 H PHE 71 H PHE 71 10.647 15.484 -1.881 493 HA PHE 71 HA PHE 71 12.251 17.013 -3.638 494 HB2 PHE 71 HB2 PHE 71 12.006 15.415 -5.160 495 HB3 PHE 71 HB3 PHE 71 11.753 14.559 -3.793 496 HD1 PHE 71 HD1 PHE 71 9.175 14.423 -3.057 497 HD2 PHE 71 HD2 PHE 71 10.556 15.076 -6.928 498 HE1 PHE 71 HE1 PHE 71 7.045 13.703 -3.933 499 HE2 PHE 71 HE2 PHE 71 8.442 14.327 -7.816 500 HZ PHE 71 HZ PHE 71 6.673 13.665 -6.317 501 H LYS 72 H LYS 72 11.663 18.567 -5.131 502 HA LYS 72 HA LYS 72 8.981 19.543 -4.736 503 HB2 LYS 72 HB2 LYS 72 11.333 21.011 -5.595 504 HB3 LYS 72 HB3 LYS 72 9.868 21.701 -5.380 505 HG2 LYS 72 HG2 LYS 72 10.007 21.530 -3.094 506 HG3 LYS 72 HG3 LYS 72 11.225 20.445 -3.174 507 HD2 LYS 72 HD2 LYS 72 12.301 22.337 -2.544 508 HD3 LYS 72 HD3 LYS 72 12.556 22.309 -4.157 509 HE2 LYS 72 HE2 LYS 72 11.939 24.448 -3.921 510 HE3 LYS 72 HE3 LYS 72 10.469 23.784 -4.180 511 HZ1 LYS 72 HZ1 LYS 72 10.392 25.231 -2.297 512 HZ2 LYS 72 HZ2 LYS 72 11.553 24.368 -1.573 513 HZ3 LYS 72 HZ3 LYS 72 10.097 23.711 -1.829 514 H HIS 73 H HIS 73 7.579 20.041 -6.419 515 HA HIS 73 HA HIS 73 8.648 19.544 -9.068 516 HB2 HIS 73 HB2 HIS 73 6.372 18.485 -7.958 517 HB3 HIS 73 HB3 HIS 73 5.973 19.352 -9.283 518 HD1 HIS 73 HD1 HIS 73 7.380 16.155 -8.250 519 HD2 HIS 73 HD2 HIS 73 7.175 18.359 -11.700 520 HE1 HIS 73 HE1 HIS 73 8.033 14.698 -10.163 521 HE2 HIS 73 HE2 HIS 73 7.930 16.013 -12.250 522 H ILE 74 H ILE 74 8.296 21.103 -10.682 523 HA ILE 74 HA ILE 74 7.232 23.586 -9.692 524 HB ILE 74 HB ILE 74 8.811 23.181 -12.117 525 HG12 ILE 74 HG12 ILE 74 9.760 24.340 -9.651 526 HG13 ILE 74 HG13 ILE 74 10.039 22.783 -10.060 527 HG21 ILE 74 HG21 ILE 74 9.018 25.596 -12.206 528 HG22 ILE 74 HG22 ILE 74 8.065 25.731 -10.907 529 HG23 ILE 74 HG23 ILE 74 7.458 25.179 -12.300 530 HD11 ILE 74 HD11 ILE 74 11.975 24.111 -10.534 531 HD12 ILE 74 HD12 ILE 74 11.103 25.061 -11.510 532 HD13 ILE 74 HD13 ILE 74 11.378 23.520 -11.916 533 H MET 75 H MET 75 5.325 24.497 -10.537 534 HA MET 75 HA MET 75 4.349 23.348 -12.952 535 HB2 MET 75 HB2 MET 75 3.177 22.842 -10.525 536 HB3 MET 75 HB3 MET 75 2.131 23.788 -11.348 537 HG2 MET 75 HG2 MET 75 2.150 22.273 -13.103 538 HG3 MET 75 HG3 MET 75 3.181 21.323 -12.265 539 HE1 MET 75 HE1 MET 75 -0.298 19.457 -12.305 540 HE2 MET 75 HE2 MET 75 1.228 19.352 -12.831 541 HE3 MET 75 HE3 MET 75 0.232 20.462 -13.456 542 H THR 76 H THR 76 2.951 24.577 -14.254 543 HA THR 76 HA THR 76 2.874 27.365 -13.625 544 HB THR 76 HB THR 76 2.019 27.621 -15.921 545 HG1 THR 76 HG1 THR 76 1.849 24.978 -15.667 546 HG21 THR 76 HG21 THR 76 4.099 27.089 -17.000 547 HG22 THR 76 HG22 THR 76 4.522 26.144 -15.758 548 HG23 THR 76 HG23 THR 76 4.424 27.746 -15.558 549 H GLY 77 H GLY 77 0.634 28.447 -14.312 550 HA2 GLY 77 HA2 GLY 77 -1.225 27.383 -12.553 551 HA3 GLY 77 HA3 GLY 77 -1.438 28.683 -13.518 552 H GLY 78 H GLY 78 -3.639 27.839 -13.243 553 HA2 GLY 78 HA2 GLY 78 -5.275 27.229 -14.808 554 HA3 GLY 78 HA3 GLY 78 -4.260 26.141 -15.482 555 H GLU 79 H GLU 79 -6.742 25.255 -14.993 556 HA GLU 79 HA GLU 79 -6.873 24.012 -12.483 557 HB2 GLU 79 HB2 GLU 79 -8.512 24.069 -14.743 558 HB3 GLU 79 HB3 GLU 79 -8.521 22.605 -14.021 559 HG2 GLU 79 HG2 GLU 79 -9.190 25.054 -12.675 560 HG3 GLU 79 HG3 GLU 79 -10.298 24.006 -13.259 561 H HIS 80 H HIS 80 -6.212 21.921 -11.863 562 HA HIS 80 HA HIS 80 -5.180 20.253 -13.973 563 HB2 HIS 80 HB2 HIS 80 -3.704 20.839 -11.564 564 HB3 HIS 80 HB3 HIS 80 -3.268 19.673 -12.621 565 HD1 HIS 80 HD1 HIS 80 -2.949 23.237 -11.972 566 HD2 HIS 80 HD2 HIS 80 -2.310 20.716 -15.134 567 HE1 HIS 80 HE1 HIS 80 -1.525 24.407 -13.636 568 HE2 HIS 80 HE2 HIS 80 -1.167 22.930 -15.574 569 H THR 81 H THR 81 -5.092 17.950 -13.409 570 HA THR 81 HA THR 81 -6.828 17.321 -11.169 571 HB THR 81 HB THR 81 -6.881 15.884 -13.691 572 HG1 THR 81 HG1 THR 81 -7.765 18.138 -13.535 573 HG21 THR 81 HG21 THR 81 -8.841 14.847 -12.810 574 HG22 THR 81 HG22 THR 81 -8.702 15.700 -11.444 575 HG23 THR 81 HG23 THR 81 -7.609 14.564 -11.802 576 H PHE 82 H PHE 82 -5.927 15.931 -9.714 577 HA PHE 82 HA PHE 82 -3.473 14.659 -10.553 578 HB2 PHE 82 HB2 PHE 82 -4.157 15.614 -7.906 579 HB3 PHE 82 HB3 PHE 82 -2.753 14.859 -8.263 580 HD1 PHE 82 HD1 PHE 82 -0.906 16.045 -9.246 581 HD2 PHE 82 HD2 PHE 82 -4.581 17.931 -8.726 582 HE1 PHE 82 HE1 PHE 82 0.111 18.170 -9.773 583 HE2 PHE 82 HE2 PHE 82 -3.577 20.052 -9.272 584 HZ PHE 82 HZ PHE 82 -1.229 20.177 -9.783 585 H THR 83 H THR 83 -3.110 12.495 -10.108 586 HA THR 83 HA THR 83 -5.298 11.144 -8.813 587 HB THR 83 HB THR 83 -3.897 10.078 -11.151 588 HG1 THR 83 HG1 THR 83 -5.136 11.211 -12.323 589 HG21 THR 83 HG21 THR 83 -5.630 8.422 -11.211 590 HG22 THR 83 HG22 THR 83 -6.325 9.076 -9.906 591 HG23 THR 83 HG23 THR 83 -4.890 8.342 -9.775 592 H TRP 84 H TRP 84 -4.782 9.718 -7.224 593 HA TRP 84 HA TRP 84 -1.992 8.915 -6.975 594 HB2 TRP 84 HB2 TRP 84 -3.748 9.383 -4.752 595 HB3 TRP 84 HB3 TRP 84 -2.152 9.044 -4.669 596 HD1 TRP 84 HD1 TRP 84 -1.379 11.304 -6.887 597 HE1 TRP 84 HE1 TRP 84 -1.259 13.732 -6.283 598 HE3 TRP 84 HE3 TRP 84 -4.147 11.045 -2.726 599 HZ2 TRP 84 HZ2 TRP 84 -2.292 15.299 -4.180 600 HZ3 TRP 84 HZ3 TRP 84 -4.547 13.076 -1.461 601 HH2 TRP 84 HH2 TRP 84 -3.613 15.179 -2.192 602 H THR 85 H THR 85 -1.727 6.626 -6.284 603 HA THR 85 HA THR 85 -4.177 5.218 -6.024 604 HB THR 85 HB THR 85 -3.583 5.091 -8.439 605 HG1 THR 85 HG1 THR 85 -5.004 3.599 -7.750 606 HG21 THR 85 HG21 THR 85 -1.857 3.579 -9.066 607 HG22 THR 85 HG22 THR 85 -1.487 3.326 -7.513 608 HG23 THR 85 HG23 THR 85 -1.210 4.771 -8.185 609 H TYR 86 H TYR 86 -3.970 2.925 -5.321 610 HA TYR 86 HA TYR 86 -1.520 2.537 -3.828 611 HB2 TYR 86 HB2 TYR 86 -4.186 1.806 -3.020 612 HB3 TYR 86 HB3 TYR 86 -2.846 1.354 -2.202 613 HD1 TYR 86 HD1 TYR 86 -5.205 3.945 -2.626 614 HD2 TYR 86 HD2 TYR 86 -1.417 3.144 -1.101 615 HE1 TYR 86 HE1 TYR 86 -5.299 5.977 -1.321 616 HE2 TYR 86 HE2 TYR 86 -1.512 5.184 0.194 617 HH TYR 86 HH TYR 86 -3.449 7.641 -0.274 618 H THR 87 H THR 87 -0.738 0.336 -3.648 619 HA THR 87 HA THR 87 -1.180 -1.046 -6.016 620 HB THR 87 HB THR 87 1.009 -1.128 -4.930 621 HG1 THR 87 HG1 THR 87 0.631 -3.726 -4.801 622 HG21 THR 87 HG21 THR 87 1.341 -2.453 -2.946 623 HG22 THR 87 HG22 THR 87 -0.238 -2.800 -2.893 624 HG23 THR 87 HG23 THR 87 0.268 -1.290 -2.615 625 H ALA 88 H ALA 88 -2.769 -1.155 -3.147 626 HA ALA 88 HA ALA 88 -4.301 -3.494 -3.920 627 HB1 ALA 88 HB1 ALA 88 -2.839 -4.343 -2.244 628 HB2 ALA 88 HB2 ALA 88 -4.323 -4.243 -1.610 629 HB3 ALA 88 HB3 ALA 88 -3.213 -3.122 -1.252 630 HA PRO 89 HA PRO 89 -7.375 -0.532 -2.823 631 HB2 PRO 89 HB2 PRO 89 -9.339 -1.877 -1.624 632 HB3 PRO 89 HB3 PRO 89 -9.159 -1.984 -3.244 633 HG2 PRO 89 HG2 PRO 89 -8.192 -3.802 -1.260 634 HG3 PRO 89 HG3 PRO 89 -9.012 -4.161 -2.626 635 HD2 PRO 89 HD2 PRO 89 -6.442 -4.393 -2.622 636 HD3 PRO 89 HD3 PRO 89 -7.174 -3.798 -3.956 637 H HIS 90 H HIS 90 -7.876 0.905 -1.222 638 HA HIS 90 HA HIS 90 -6.399 0.311 1.188 639 HB2 HIS 90 HB2 HIS 90 -5.751 2.210 -0.356 640 HB3 HIS 90 HB3 HIS 90 -7.016 2.998 0.311 641 HD1 HIS 90 HD1 HIS 90 -6.848 3.074 3.159 642 HD2 HIS 90 HD2 HIS 90 -3.448 2.818 0.890 643 HE1 HIS 90 HE1 HIS 90 -4.917 3.828 4.535 644 HE2 HIS 90 HE2 HIS 90 -2.859 3.682 3.190 645 H ASN 91 H ASN 91 -7.542 -0.130 2.983 646 HA ASN 91 HA ASN 91 -10.230 0.518 3.272 647 HB2 ASN 91 HB2 ASN 91 -8.287 -0.177 5.269 648 HB3 ASN 91 HB3 ASN 91 -9.855 0.082 5.646 649 HD21 ASN 91 HD21 ASN 91 -9.399 -3.537 5.212 650 HD22 ASN 91 HD22 ASN 91 -8.761 -2.328 6.276 651 H THR 92 H THR 92 -11.285 2.397 3.885 652 HA THR 92 HA THR 92 -9.668 4.557 4.790 653 HB THR 92 HB THR 92 -11.245 4.756 2.302 654 HG1 THR 92 HG1 THR 92 -8.556 4.466 2.716 655 HG21 THR 92 HG21 THR 92 -10.380 6.973 2.039 656 HG22 THR 92 HG22 THR 92 -9.576 6.846 3.436 657 HG23 THR 92 HG23 THR 92 -11.192 6.897 3.435 658 H SER 93 H SER 93 -10.712 5.901 6.226 659 HA SER 93 HA SER 93 -13.586 5.685 6.270 660 HB2 SER 93 HB2 SER 93 -13.318 6.790 8.504 661 HB3 SER 93 HB3 SER 93 -12.788 5.249 8.403 662 HG SER 93 HG SER 93 -10.788 5.839 8.540 663 H GLN 94 H GLN 94 -10.968 7.907 5.960 664 HA GLN 94 HA GLN 94 -12.587 9.831 4.657 665 HB2 GLN 94 HB2 GLN 94 -13.041 10.342 6.982 666 HB3 GLN 94 HB3 GLN 94 -11.440 10.553 7.227 667 HG2 GLN 94 HG2 GLN 94 -12.457 12.256 5.282 668 HG3 GLN 94 HG3 GLN 94 -13.136 12.485 6.749 669 HE21 GLN 94 HE21 GLN 94 -10.246 13.711 8.313 670 HE22 GLN 94 HE22 GLN 94 -11.753 12.909 8.602 671 H TRP 95 H TRP 95 -11.283 11.234 3.318 672 HA TRP 95 HA TRP 95 -8.536 11.393 4.111 673 HB2 TRP 95 HB2 TRP 95 -7.678 11.060 1.929 674 HB3 TRP 95 HB3 TRP 95 -8.331 9.712 2.579 675 HD1 TRP 95 HD1 TRP 95 -10.922 9.159 1.553 676 HE1 TRP 95 HE1 TRP 95 -11.736 9.156 -0.820 677 HE3 TRP 95 HE3 TRP 95 -7.379 12.156 -0.329 678 HZ2 TRP 95 HZ2 TRP 95 -10.820 10.303 -3.224 679 HZ3 TRP 95 HZ3 TRP 95 -7.414 12.660 -2.702 680 HH2 TRP 95 HH2 TRP 95 -9.123 11.725 -4.127 681 H HIS 96 H HIS 96 -7.543 13.359 3.770 682 HA HIS 96 HA HIS 96 -8.952 15.305 2.267 683 HB2 HIS 96 HB2 HIS 96 -9.142 16.894 4.078 684 HB3 HIS 96 HB3 HIS 96 -10.078 15.577 4.315 685 HD1 HIS 96 HD1 HIS 96 -9.458 17.297 6.717 686 HD2 HIS 96 HD2 HIS 96 -7.194 14.075 5.579 687 HE1 HIS 96 HE1 HIS 96 -8.220 16.455 8.705 688 HE2 HIS 96 HE2 HIS 96 -6.853 14.516 8.041 689 H TYR 97 H TYR 97 -7.834 17.412 2.042 690 HA TYR 97 HA TYR 97 -5.039 17.177 2.507 691 HB2 TYR 97 HB2 TYR 97 -4.637 17.740 0.098 692 HB3 TYR 97 HB3 TYR 97 -5.006 16.188 0.451 693 HD1 TYR 97 HD1 TYR 97 -7.314 15.293 -0.104 694 HD2 TYR 97 HD2 TYR 97 -6.024 19.038 -1.361 695 HE1 TYR 97 HE1 TYR 97 -9.137 15.388 -1.697 696 HE2 TYR 97 HE2 TYR 97 -7.842 19.134 -2.945 697 HH TYR 97 HH TYR 97 -9.322 17.389 -4.233 698 H TYR 98 H TYR 98 -3.794 19.024 2.451 699 HA TYR 98 HA TYR 98 -5.344 21.437 2.648 700 HB2 TYR 98 HB2 TYR 98 -3.231 20.577 4.454 701 HB3 TYR 98 HB3 TYR 98 -3.908 22.061 4.536 702 HD1 TYR 98 HD1 TYR 98 -4.709 18.544 5.002 703 HD2 TYR 98 HD2 TYR 98 -5.795 22.455 5.917 704 HE1 TYR 98 HE1 TYR 98 -6.265 17.727 6.650 705 HE2 TYR 98 HE2 TYR 98 -7.358 21.631 7.570 706 HH TYR 98 HH TYR 98 -8.671 19.037 7.816 707 H ILE 99 H ILE 99 -3.965 23.469 2.557 708 HA ILE 99 HA ILE 99 -1.426 23.014 1.295 709 HB ILE 99 HB ILE 99 -1.799 24.984 -0.147 710 HG12 ILE 99 HG12 ILE 99 -4.563 24.841 0.632 711 HG13 ILE 99 HG13 ILE 99 -3.531 25.947 1.248 712 HG21 ILE 99 HG21 ILE 99 -3.202 23.843 -1.749 713 HG22 ILE 99 HG22 ILE 99 -3.676 22.806 -0.603 714 HG23 ILE 99 HG23 ILE 99 -2.140 22.804 -1.110 715 HD11 ILE 99 HD11 ILE 99 -4.836 26.932 -0.497 716 HD12 ILE 99 HD12 ILE 99 -4.301 25.822 -1.543 717 HD13 ILE 99 HD13 ILE 99 -3.279 26.916 -0.933 718 H THR 100 H THR 100 0.210 24.740 1.700 719 HA THR 100 HA THR 100 -0.460 26.190 4.040 720 HB THR 100 HB THR 100 1.937 26.845 4.134 721 HG1 THR 100 HG1 THR 100 3.344 25.973 2.670 722 HG21 THR 100 HG21 THR 100 2.795 24.689 4.638 723 HG22 THR 100 HG22 THR 100 1.552 23.994 3.872 724 HG23 THR 100 HG23 THR 100 1.302 24.812 5.244 725 H LYS 101 H LYS 101 -0.448 28.538 4.216 726 HA LYS 101 HA LYS 101 -0.635 29.794 1.677 727 HB2 LYS 101 HB2 LYS 101 -1.107 30.791 4.353 728 HB3 LYS 101 HB3 LYS 101 -1.154 31.810 3.079 729 HG2 LYS 101 HG2 LYS 101 -2.885 29.547 3.304 730 HG3 LYS 101 HG3 LYS 101 -3.307 31.036 3.826 731 HD2 LYS 101 HD2 LYS 101 -3.049 31.857 1.557 732 HD3 LYS 101 HD3 LYS 101 -2.758 30.326 1.069 733 HE2 LYS 101 HE2 LYS 101 -4.852 29.672 1.882 734 HE3 LYS 101 HE3 LYS 101 -5.143 31.207 2.359 735 HZ1 LYS 101 HZ1 LYS 101 -6.352 30.712 0.418 736 HZ2 LYS 101 HZ2 LYS 101 -4.983 30.355 -0.366 737 HZ3 LYS 101 HZ3 LYS 101 -5.272 31.874 0.106 738 H LYS 102 H LYS 102 1.199 30.345 0.623 739 HA LYS 102 HA LYS 102 3.381 31.538 1.982 740 HB2 LYS 102 HB2 LYS 102 4.142 32.120 -0.232 741 HB3 LYS 102 HB3 LYS 102 3.916 30.519 0.000 742 HG2 LYS 102 HG2 LYS 102 1.881 30.616 -1.220 743 HG3 LYS 102 HG3 LYS 102 2.070 32.225 -1.425 744 HD2 LYS 102 HD2 LYS 102 4.021 31.825 -2.743 745 HD3 LYS 102 HD3 LYS 102 3.822 30.216 -2.544 746 HE2 LYS 102 HE2 LYS 102 1.770 30.301 -3.740 747 HE3 LYS 102 HE3 LYS 102 1.909 31.921 -3.893 748 HZ1 LYS 102 HZ1 LYS 102 2.520 30.856 -5.914 749 HZ2 LYS 102 HZ2 LYS 102 3.666 30.015 -5.142 750 HZ3 LYS 102 HZ3 LYS 102 3.803 31.619 -5.293 751 H GLY 103 H GLY 103 3.796 33.869 2.216 752 HA2 GLY 103 HA2 GLY 103 3.315 36.033 1.633 753 HA3 GLY 103 HA3 GLY 103 1.979 35.554 0.824 754 H TRP 104 H TRP 104 2.096 34.535 4.063 755 HA TRP 104 HA TRP 104 -0.237 35.758 4.668 756 HB2 TRP 104 HB2 TRP 104 0.413 35.296 7.053 757 HB3 TRP 104 HB3 TRP 104 0.421 34.003 6.055 758 HD1 TRP 104 HD1 TRP 104 3.108 36.509 6.975 759 HE1 TRP 104 HE1 TRP 104 5.308 35.411 7.434 760 HE3 TRP 104 HE3 TRP 104 1.596 31.793 6.286 761 HZ2 TRP 104 HZ2 TRP 104 6.208 32.741 7.501 762 HZ3 TRP 104 HZ3 TRP 104 3.193 29.999 6.602 763 HH2 TRP 104 HH2 TRP 104 5.479 30.484 7.200 764 H ASP 105 H ASP 105 -0.997 37.487 5.921 765 HA ASP 105 HA ASP 105 0.579 39.801 5.720 766 HB2 ASP 105 HB2 ASP 105 -1.939 39.519 7.141 767 HB3 ASP 105 HB3 ASP 105 -1.306 40.937 6.634 768 HA PRO 106 HA PRO 106 2.229 39.480 9.760 769 HB2 PRO 106 HB2 PRO 106 3.045 41.952 10.344 770 HB3 PRO 106 HB3 PRO 106 3.828 41.135 9.167 771 HG2 PRO 106 HG2 PRO 106 1.718 43.040 8.857 772 HG3 PRO 106 HG3 PRO 106 3.147 43.001 8.068 773 HD2 PRO 106 HD2 PRO 106 1.027 42.002 6.936 774 HD3 PRO 106 HD3 PRO 106 2.478 41.289 6.701 775 H ASP 107 H ASP 107 -0.367 41.498 9.215 776 HA ASP 107 HA ASP 107 -0.995 42.084 11.869 777 HB2 ASP 107 HB2 ASP 107 -1.906 43.278 9.950 778 HB3 ASP 107 HB3 ASP 107 -2.769 41.947 9.560 779 H LYS 108 H LYS 108 -1.338 39.332 9.994 780 HA LYS 108 HA LYS 108 -3.452 38.260 11.629 781 HB2 LYS 108 HB2 LYS 108 -2.397 37.310 9.106 782 HB3 LYS 108 HB3 LYS 108 -3.647 36.603 9.884 783 HG2 LYS 108 HG2 LYS 108 -4.988 38.490 9.548 784 HG3 LYS 108 HG3 LYS 108 -3.729 39.316 8.917 785 HD2 LYS 108 HD2 LYS 108 -3.691 37.718 7.108 786 HD3 LYS 108 HD3 LYS 108 -5.079 37.096 7.702 787 HE2 LYS 108 HE2 LYS 108 -6.242 39.063 7.277 788 HE3 LYS 108 HE3 LYS 108 -4.861 39.886 6.989 789 HZ1 LYS 108 HZ1 LYS 108 -5.970 39.411 4.950 790 HZ2 LYS 108 HZ2 LYS 108 -5.914 37.828 5.275 791 HZ3 LYS 108 HZ3 LYS 108 -4.547 38.643 4.989 792 HA PRO 109 HA PRO 109 -0.618 35.644 13.634 793 HB2 PRO 109 HB2 PRO 109 -2.154 33.725 14.615 794 HB3 PRO 109 HB3 PRO 109 -2.267 35.226 15.249 795 HG2 PRO 109 HG2 PRO 109 -3.959 34.033 13.277 796 HG3 PRO 109 HG3 PRO 109 -4.410 34.863 14.609 797 HD2 PRO 109 HD2 PRO 109 -4.341 36.034 12.287 798 HD3 PRO 109 HD3 PRO 109 -3.985 36.870 13.645 799 H LEU 110 H LEU 110 0.720 35.099 12.027 800 HA LEU 110 HA LEU 110 0.015 33.536 9.976 801 HB2 LEU 110 HB2 LEU 110 2.422 33.219 9.600 802 HB3 LEU 110 HB3 LEU 110 2.004 34.777 9.853 803 HG LEU 110 HG LEU 110 3.064 33.305 12.034 804 HD11 LEU 110 HD11 LEU 110 5.318 33.866 11.350 805 HD12 LEU 110 HD12 LEU 110 4.740 34.462 9.962 806 HD13 LEU 110 HD13 LEU 110 4.632 32.878 10.269 807 HD21 LEU 110 HD21 LEU 110 3.960 35.435 12.718 808 HD22 LEU 110 HD22 LEU 110 2.360 35.544 12.511 809 HD23 LEU 110 HD23 LEU 110 3.363 36.119 11.381 810 H LYS 111 H LYS 111 1.341 32.349 12.972 811 HA LYS 111 HA LYS 111 1.649 29.777 11.956 812 HB2 LYS 111 HB2 LYS 111 2.287 29.109 14.081 813 HB3 LYS 111 HB3 LYS 111 2.857 30.626 13.883 814 HG2 LYS 111 HG2 LYS 111 1.103 31.462 15.243 815 HG3 LYS 111 HG3 LYS 111 0.535 29.944 15.442 816 HD2 LYS 111 HD2 LYS 111 3.171 30.756 16.322 817 HD3 LYS 111 HD3 LYS 111 1.881 30.718 17.323 818 HE2 LYS 111 HE2 LYS 111 1.708 28.346 17.002 819 HE3 LYS 111 HE3 LYS 111 3.008 28.388 16.015 820 HZ1 LYS 111 HZ1 LYS 111 3.645 27.638 18.173 821 HZ2 LYS 111 HZ2 LYS 111 3.083 29.005 18.829 822 HZ3 LYS 111 HZ3 LYS 111 4.370 29.047 17.852 823 H ARG 112 H ARG 112 -1.086 31.352 13.025 824 HA ARG 112 HA ARG 112 -2.595 28.973 13.449 825 HB2 ARG 112 HB2 ARG 112 -3.087 31.087 14.564 826 HB3 ARG 112 HB3 ARG 112 -3.645 31.639 13.132 827 HG2 ARG 112 HG2 ARG 112 -5.312 29.875 13.198 828 HG3 ARG 112 HG3 ARG 112 -4.825 29.551 14.722 829 HD2 ARG 112 HD2 ARG 112 -5.906 32.097 13.888 830 HD3 ARG 112 HD3 ARG 112 -6.755 30.973 14.714 831 HE ARG 112 HE ARG 112 -4.571 31.510 16.255 832 HH11 ARG 112 HH11 ARG 112 -7.399 33.283 15.130 833 HH12 ARG 112 HH12 ARG 112 -7.368 34.362 16.484 834 HH21 ARG 112 HH21 ARG 112 -4.594 32.936 17.951 835 HH22 ARG 112 HH22 ARG 112 -5.807 34.168 18.053 836 H ALA 113 H ALA 113 -2.177 31.374 11.064 837 HA ALA 113 HA ALA 113 -4.122 30.375 9.298 838 HB1 ALA 113 HB1 ALA 113 -3.666 32.776 9.423 839 HB2 ALA 113 HB2 ALA 113 -3.445 32.274 7.902 840 HB3 ALA 113 HB3 ALA 113 -2.170 32.521 8.865 841 H ASP 114 H ASP 114 -1.531 28.921 10.008 842 HA ASP 114 HA ASP 114 0.052 28.997 7.766 843 HB2 ASP 114 HB2 ASP 114 0.123 27.753 10.213 844 HB3 ASP 114 HB3 ASP 114 0.376 26.571 9.115 845 H PHE 115 H PHE 115 -2.644 26.996 8.463 846 HA PHE 115 HA PHE 115 -2.263 25.780 5.906 847 HB2 PHE 115 HB2 PHE 115 -3.541 24.460 8.173 848 HB3 PHE 115 HB3 PHE 115 -3.307 23.745 6.724 849 HD1 PHE 115 HD1 PHE 115 -2.080 23.962 9.893 850 HD2 PHE 115 HD2 PHE 115 -0.769 23.618 5.962 851 HE1 PHE 115 HE1 PHE 115 -0.001 23.042 10.676 852 HE2 PHE 115 HE2 PHE 115 1.339 22.733 6.741 853 HZ PHE 115 HZ PHE 115 1.715 22.425 9.099 854 H GLU 116 H GLU 116 -3.979 25.572 4.453 855 HA GLU 116 HA GLU 116 -6.588 26.116 5.548 856 HB2 GLU 116 HB2 GLU 116 -5.529 27.122 3.104 857 HB3 GLU 116 HB3 GLU 116 -7.133 26.821 3.172 858 HG2 GLU 116 HG2 GLU 116 -7.222 28.307 5.093 859 HG3 GLU 116 HG3 GLU 116 -5.683 28.730 4.747 860 H LEU 117 H LEU 117 -8.294 24.753 4.886 861 HA LEU 117 HA LEU 117 -7.489 22.271 3.779 862 HB2 LEU 117 HB2 LEU 117 -9.098 22.340 5.535 863 HB3 LEU 117 HB3 LEU 117 -10.111 23.193 4.579 864 HG LEU 117 HG LEU 117 -10.213 21.205 3.149 865 HD11 LEU 117 HD11 LEU 117 -9.656 19.113 4.150 866 HD12 LEU 117 HD12 LEU 117 -9.042 19.884 5.432 867 HD13 LEU 117 HD13 LEU 117 -8.331 20.026 3.987 868 HD21 LEU 117 HD21 LEU 117 -11.893 20.170 4.552 869 HD22 LEU 117 HD22 LEU 117 -12.043 21.779 4.611 870 HD23 LEU 117 HD23 LEU 117 -11.330 20.989 5.828 871 H ILE 118 H ILE 118 -7.267 21.988 1.584 872 HA ILE 118 HA ILE 118 -8.886 23.691 -0.073 873 HB ILE 118 HB ILE 118 -6.410 23.578 -0.377 874 HG12 ILE 118 HG12 ILE 118 -6.521 23.736 -2.797 875 HG13 ILE 118 HG13 ILE 118 -8.094 23.309 -2.696 876 HG21 ILE 118 HG21 ILE 118 -5.557 21.817 -1.749 877 HG22 ILE 118 HG22 ILE 118 -6.999 21.087 -1.711 878 HG23 ILE 118 HG23 ILE 118 -6.127 21.226 -0.357 879 HD11 ILE 118 HD11 ILE 118 -7.908 25.687 -2.939 880 HD12 ILE 118 HD12 ILE 118 -7.004 25.767 -1.601 881 HD13 ILE 118 HD13 ILE 118 -8.562 25.344 -1.500 882 H GLY 119 H GLY 119 -8.930 20.597 1.075 883 HA2 GLY 119 HA2 GLY 119 -11.297 20.062 -0.214 884 HA3 GLY 119 HA3 GLY 119 -10.123 19.273 -1.030 885 H ALA 120 H ALA 120 -12.403 18.198 0.388 886 HA ALA 120 HA ALA 120 -10.990 16.284 1.964 887 HB1 ALA 120 HB1 ALA 120 -11.689 17.876 3.640 888 HB2 ALA 120 HB2 ALA 120 -12.527 16.508 3.847 889 HB3 ALA 120 HB3 ALA 120 -13.217 17.777 3.119 890 H VAL 121 H VAL 121 -11.980 14.237 2.024 891 HA VAL 121 HA VAL 121 -14.568 14.070 0.895 892 HB VAL 121 HB VAL 121 -13.336 11.964 -0.331 893 HG11 VAL 121 HG11 VAL 121 -14.014 13.087 -2.364 894 HG12 VAL 121 HG12 VAL 121 -14.253 14.452 -1.531 895 HG13 VAL 121 HG13 VAL 121 -15.200 13.167 -1.269 896 HG21 VAL 121 HG21 VAL 121 -11.591 12.969 -1.649 897 HG22 VAL 121 HG22 VAL 121 -11.196 13.020 -0.081 898 HG23 VAL 121 HG23 VAL 121 -11.749 14.348 -0.820 899 HA PRO 122 HA PRO 122 -14.285 11.136 4.302 900 HB2 PRO 122 HB2 PRO 122 -16.760 11.376 5.193 901 HB3 PRO 122 HB3 PRO 122 -15.651 12.488 5.641 902 HG2 PRO 122 HG2 PRO 122 -17.573 12.678 3.556 903 HG3 PRO 122 HG3 PRO 122 -17.221 13.787 4.702 904 HD2 PRO 122 HD2 PRO 122 -16.210 14.010 2.322 905 HD3 PRO 122 HD3 PRO 122 -15.342 14.474 3.625 906 H HIS 123 H HIS 123 -15.350 9.005 4.606 907 HA HIS 123 HA HIS 123 -16.056 8.120 1.934 908 HB2 HIS 123 HB2 HIS 123 -14.270 6.981 3.048 909 HB3 HIS 123 HB3 HIS 123 -15.293 6.569 4.253 910 HD1 HIS 123 HD1 HIS 123 -17.264 4.824 3.657 911 HD2 HIS 123 HD2 HIS 123 -14.166 5.178 0.995 912 HE1 HIS 123 HE1 HIS 123 -17.282 2.840 2.154 913 HE2 HIS 123 HE2 HIS 123 -15.424 3.034 0.540 914 H ASP 124 H ASP 124 -18.118 8.827 1.761 915 HA ASP 124 HA ASP 124 -20.014 7.955 3.737 916 HB2 ASP 124 HB2 ASP 124 -20.596 9.694 1.489 917 HB3 ASP 124 HB3 ASP 124 -21.476 9.569 2.859 918 H GLY 125 H GLY 125 -18.641 6.679 1.233 919 HA2 GLY 125 HA2 GLY 125 -19.362 4.979 -0.145 920 HA3 GLY 125 HA3 GLY 125 -20.916 5.237 0.287 921 H SER 126 H SER 126 -20.185 8.190 -0.225 922 HA SER 126 HA SER 126 -21.281 8.507 -2.710 923 HB2 SER 126 HB2 SER 126 -21.154 10.383 -1.261 924 HB3 SER 126 HB3 SER 126 -19.522 10.315 -1.249 925 HG SER 126 HG SER 126 -20.280 10.558 -3.715 926 HA PRO 127 HA PRO 127 -17.914 7.421 -5.158 927 HB2 PRO 127 HB2 PRO 127 -18.562 8.260 -7.611 928 HB3 PRO 127 HB3 PRO 127 -19.444 7.054 -6.951 929 HG2 PRO 127 HG2 PRO 127 -20.045 9.848 -6.955 930 HG3 PRO 127 HG3 PRO 127 -21.027 8.618 -7.394 931 HD2 PRO 127 HD2 PRO 127 -21.212 9.609 -4.993 932 HD3 PRO 127 HD3 PRO 127 -21.418 8.004 -5.215 933 H ALA 128 H ALA 128 -18.508 10.484 -4.500 934 HA ALA 128 HA ALA 128 -16.398 11.707 -5.803 935 HB1 ALA 128 HB1 ALA 128 -18.119 12.998 -4.710 936 HB2 ALA 128 HB2 ALA 128 -16.677 13.465 -4.145 937 HB3 ALA 128 HB3 ALA 128 -17.610 12.479 -3.266 938 H SER 129 H SER 129 -16.608 9.933 -2.859 939 HA SER 129 HA SER 129 -13.906 10.423 -2.150 940 HB2 SER 129 HB2 SER 129 -15.622 10.158 -0.432 941 HB3 SER 129 HB3 SER 129 -15.762 8.588 -0.857 942 HG SER 129 HG SER 129 -14.464 8.945 0.975 943 H ARG 130 H ARG 130 -15.713 7.979 -3.710 944 HA ARG 130 HA ARG 130 -13.809 5.964 -3.556 945 HB2 ARG 130 HB2 ARG 130 -15.872 6.309 -5.556 946 HB3 ARG 130 HB3 ARG 130 -15.004 4.935 -5.398 947 HG2 ARG 130 HG2 ARG 130 -16.001 4.514 -3.308 948 HG3 ARG 130 HG3 ARG 130 -16.822 5.924 -3.395 949 HD2 ARG 130 HD2 ARG 130 -17.886 5.054 -5.432 950 HD3 ARG 130 HD3 ARG 130 -17.226 3.604 -5.071 951 HE ARG 130 HE ARG 130 -19.290 4.925 -3.544 952 HH11 ARG 130 HH11 ARG 130 -20.662 3.662 -2.411 953 HH12 ARG 130 HH12 ARG 130 -20.414 1.951 -2.299 954 HH21 ARG 130 HH21 ARG 130 -17.577 1.922 -4.251 955 HH22 ARG 130 HH22 ARG 130 -18.695 0.981 -3.323 956 H ASN 131 H ASN 131 -14.368 8.560 -5.740 957 HA ASN 131 HA ASN 131 -12.436 7.756 -7.600 958 HB2 ASN 131 HB2 ASN 131 -14.291 9.168 -8.232 959 HB3 ASN 131 HB3 ASN 131 -13.634 10.383 -7.361 960 HD21 ASN 131 HD21 ASN 131 -12.670 11.244 -10.683 961 HD22 ASN 131 HD22 ASN 131 -14.042 11.326 -9.629 962 H LEU 132 H LEU 132 -10.335 7.704 -7.178 963 HA LEU 132 HA LEU 132 -9.209 9.341 -5.234 964 HB2 LEU 132 HB2 LEU 132 -8.423 7.140 -6.701 965 HB3 LEU 132 HB3 LEU 132 -7.208 8.231 -6.725 966 HG LEU 132 HG LEU 132 -6.878 6.614 -5.043 967 HD11 LEU 132 HD11 LEU 132 -6.403 8.116 -3.212 968 HD12 LEU 132 HD12 LEU 132 -7.309 9.255 -3.917 969 HD13 LEU 132 HD13 LEU 132 -5.934 8.768 -4.615 970 HD21 LEU 132 HD21 LEU 132 -8.312 6.498 -3.111 971 HD22 LEU 132 HD22 LEU 132 -9.124 6.085 -4.448 972 HD23 LEU 132 HD23 LEU 132 -9.323 7.555 -3.802 973 H SER 133 H SER 133 -9.885 9.977 -8.397 974 HA SER 133 HA SER 133 -7.635 11.725 -8.768 975 HB2 SER 133 HB2 SER 133 -8.316 10.271 -10.612 976 HB3 SER 133 HB3 SER 133 -9.711 11.114 -10.712 977 HG SER 133 HG SER 133 -7.970 11.695 -12.162 978 H HIS 134 H HIS 134 -7.735 13.870 -8.343 979 HA HIS 134 HA HIS 134 -10.348 15.055 -8.216 980 HB2 HIS 134 HB2 HIS 134 -8.415 14.946 -6.076 981 HB3 HIS 134 HB3 HIS 134 -9.403 16.246 -6.132 982 HD1 HIS 134 HD1 HIS 134 -10.824 15.883 -4.062 983 HD2 HIS 134 HD2 HIS 134 -10.668 12.654 -6.576 984 HE1 HIS 134 HE1 HIS 134 -12.494 14.204 -3.302 985 HE2 HIS 134 HE2 HIS 134 -12.410 12.247 -4.797 986 H HIS 135 H HIS 135 -10.571 17.306 -8.494 987 HA HIS 135 HA HIS 135 -8.478 18.393 -10.051 988 HB2 HIS 135 HB2 HIS 135 -10.944 19.739 -9.300 989 HB3 HIS 135 HB3 HIS 135 -9.982 20.171 -10.547 990 HD1 HIS 135 HD1 HIS 135 -9.720 18.069 -12.452 991 HD2 HIS 135 HD2 HIS 135 -13.121 18.415 -10.192 992 HE1 HIS 135 HE1 HIS 135 -11.550 16.804 -13.573 993 HE2 HIS 135 HE2 HIS 135 -13.608 17.001 -12.226 994 H ILE 136 H ILE 136 -6.954 19.925 -9.440 995 HA ILE 136 HA ILE 136 -7.559 21.473 -7.097 996 HB ILE 136 HB ILE 136 -4.899 20.366 -7.525 997 HG12 ILE 136 HG12 ILE 136 -6.703 19.768 -5.360 998 HG13 ILE 136 HG13 ILE 136 -6.470 18.780 -6.639 999 HG21 ILE 136 HG21 ILE 136 -4.275 21.477 -5.453 1000 HG22 ILE 136 HG22 ILE 136 -5.750 22.132 -5.353 1001 HG23 ILE 136 HG23 ILE 136 -4.745 22.580 -6.537 1002 HD11 ILE 136 HD11 ILE 136 -5.221 17.981 -4.753 1003 HD12 ILE 136 HD12 ILE 136 -4.429 19.388 -4.663 1004 HD13 ILE 136 HD13 ILE 136 -4.198 18.410 -5.930 1005 H TYR 137 H TYR 137 -7.624 23.631 -7.695 1006 HA TYR 137 HA TYR 137 -6.575 24.418 -10.149 1007 HB2 TYR 137 HB2 TYR 137 -8.465 25.566 -9.291 1008 HB3 TYR 137 HB3 TYR 137 -7.615 26.046 -7.982 1009 HD1 TYR 137 HD1 TYR 137 -6.594 28.188 -7.974 1010 HD2 TYR 137 HD2 TYR 137 -7.644 26.450 -11.607 1011 HE1 TYR 137 HE1 TYR 137 -5.933 30.201 -9.132 1012 HE2 TYR 137 HE2 TYR 137 -6.965 28.460 -12.763 1013 HH TYR 137 HH TYR 137 -5.884 30.443 -12.626 1014 H ILE 138 H ILE 138 -4.730 25.565 -10.720 1015 HA ILE 138 HA ILE 138 -2.897 26.183 -8.565 1016 HB ILE 138 HB ILE 138 -2.183 25.406 -11.278 1017 HG12 ILE 138 HG12 ILE 138 -2.876 23.524 -10.022 1018 HG13 ILE 138 HG13 ILE 138 -1.281 23.420 -10.359 1019 HG21 ILE 138 HG21 ILE 138 0.112 25.489 -10.602 1020 HG22 ILE 138 HG22 ILE 138 -0.332 26.056 -9.154 1021 HG23 ILE 138 HG23 ILE 138 -0.568 26.952 -10.480 1022 HD11 ILE 138 HD11 ILE 138 -1.692 22.684 -8.115 1023 HD12 ILE 138 HD12 ILE 138 -2.349 24.115 -7.747 1024 HD13 ILE 138 HD13 ILE 138 -0.770 24.012 -8.081 1025 HA PRO 139 HA PRO 139 -3.645 30.181 -10.220 1026 HB2 PRO 139 HB2 PRO 139 -1.945 31.710 -8.837 1027 HB3 PRO 139 HB3 PRO 139 -3.250 31.099 -8.069 1028 HG2 PRO 139 HG2 PRO 139 -0.603 30.034 -8.117 1029 HG3 PRO 139 HG3 PRO 139 -1.546 30.300 -6.811 1030 HD2 PRO 139 HD2 PRO 139 -1.430 27.921 -7.823 1031 HD3 PRO 139 HD3 PRO 139 -2.854 28.470 -7.242 1032 H GLU 140 H GLU 140 -3.018 31.586 -11.770 1033 HA GLU 140 HA GLU 140 -0.573 30.807 -13.095 1034 HB2 GLU 140 HB2 GLU 140 -2.814 30.916 -14.229 1035 HB3 GLU 140 HB3 GLU 140 -2.595 32.535 -14.222 1036 HG2 GLU 140 HG2 GLU 140 -1.932 31.976 -16.303 1037 HG3 GLU 140 HG3 GLU 140 -0.509 32.039 -15.503 1038 H ASP 141 H ASP 141 -1.674 33.032 -11.020 1039 HA ASP 141 HA ASP 141 -0.097 35.166 -12.085 1040 HB2 ASP 141 HB2 ASP 141 -1.660 36.685 -11.051 1041 HB3 ASP 141 HB3 ASP 141 -2.519 35.587 -11.901 1042 H ARG 142 H ARG 142 0.467 32.996 -9.965 1043 HA ARG 142 HA ARG 142 1.776 34.830 -8.176 1044 HB2 ARG 142 HB2 ARG 142 0.532 32.372 -7.283 1045 HB3 ARG 142 HB3 ARG 142 1.354 33.391 -6.306 1046 HG2 ARG 142 HG2 ARG 142 -1.122 34.097 -7.587 1047 HG3 ARG 142 HG3 ARG 142 -1.031 33.550 -6.051 1048 HD2 ARG 142 HD2 ARG 142 -0.470 35.536 -5.283 1049 HD3 ARG 142 HD3 ARG 142 0.615 35.774 -6.479 1050 HE ARG 142 HE ARG 142 -1.898 36.026 -7.575 1051 HH11 ARG 142 HH11 ARG 142 -2.756 37.959 -8.081 1052 HH12 ARG 142 HH12 ARG 142 -2.214 39.409 -7.304 1053 HH21 ARG 142 HH21 ARG 142 0.145 37.834 -5.344 1054 HH22 ARG 142 HH22 ARG 142 -0.592 39.342 -5.773 1055 H LEU 143 H LEU 143 3.859 34.365 -7.550 1056 HA LEU 143 HA LEU 143 4.972 31.932 -8.622 1057 HB2 LEU 143 HB2 LEU 143 6.330 34.426 -8.107 1058 HB3 LEU 143 HB3 LEU 143 7.110 33.072 -8.582 1059 HG LEU 143 HG LEU 143 5.314 33.444 -10.498 1060 HD11 LEU 143 HD11 LEU 143 5.559 35.732 -11.194 1061 HD12 LEU 143 HD12 LEU 143 6.403 36.052 -9.852 1062 HD13 LEU 143 HD13 LEU 143 4.837 35.665 -9.749 1063 HD21 LEU 143 HD21 LEU 143 7.216 33.975 -11.877 1064 HD22 LEU 143 HD22 LEU 143 7.571 32.746 -10.887 1065 HD23 LEU 143 HD23 LEU 143 8.104 34.235 -10.551 1066 H GLY 144 H GLY 144 6.528 30.713 -7.330 1067 HA2 GLY 144 HA2 GLY 144 7.803 30.777 -5.289 1068 HA3 GLY 144 HA3 GLY 144 6.530 31.481 -4.545 1069 H TYR 145 H TYR 145 7.954 29.251 -3.628 1070 HA TYR 145 HA TYR 145 6.303 27.040 -4.188 1071 HB2 TYR 145 HB2 TYR 145 7.906 25.805 -2.798 1072 HB3 TYR 145 HB3 TYR 145 8.582 26.544 -4.088 1073 HD1 TYR 145 HD1 TYR 145 10.142 28.401 -3.811 1074 HD2 TYR 145 HD2 TYR 145 8.387 26.568 -0.511 1075 HE1 TYR 145 HE1 TYR 145 11.701 29.530 -2.352 1076 HE2 TYR 145 HE2 TYR 145 9.966 27.683 0.943 1077 HH TYR 145 HH TYR 145 11.439 29.483 1.094 1078 H HIS 146 H HIS 146 5.105 25.753 -2.857 1079 HA HIS 146 HA HIS 146 4.652 26.641 -0.171 1080 HB2 HIS 146 HB2 HIS 146 2.553 27.286 -0.332 1081 HB3 HIS 146 HB3 HIS 146 3.031 27.701 -1.837 1082 HD1 HIS 146 HD1 HIS 146 2.745 25.452 -3.630 1083 HD2 HIS 146 HD2 HIS 146 0.211 25.975 -0.453 1084 HE1 HIS 146 HE1 HIS 146 0.712 24.067 -4.000 1085 HE2 HIS 146 HE2 HIS 146 -0.840 24.389 -2.111 1086 H VAL 147 H VAL 147 3.410 24.947 1.085 1087 HA VAL 147 HA VAL 147 4.092 22.433 -0.048 1088 HB VAL 147 HB VAL 147 3.255 22.688 2.730 1089 HG11 VAL 147 HG11 VAL 147 4.775 20.883 3.123 1090 HG12 VAL 147 HG12 VAL 147 5.204 20.902 1.564 1091 HG13 VAL 147 HG13 VAL 147 3.702 20.474 1.984 1092 HG21 VAL 147 HG21 VAL 147 5.509 23.258 3.421 1093 HG22 VAL 147 HG22 VAL 147 4.924 24.425 2.468 1094 HG23 VAL 147 HG23 VAL 147 5.967 23.342 1.873 1095 H ILE 148 H ILE 148 2.744 20.678 -0.356 1096 HA ILE 148 HA ILE 148 -0.055 21.136 0.179 1097 HB ILE 148 HB ILE 148 1.048 19.296 -1.785 1098 HG12 ILE 148 HG12 ILE 148 -0.485 21.693 -2.250 1099 HG13 ILE 148 HG13 ILE 148 1.134 21.595 -2.445 1100 HG21 ILE 148 HG21 ILE 148 -1.259 18.800 -2.402 1101 HG22 ILE 148 HG22 ILE 148 -1.790 19.753 -1.208 1102 HG23 ILE 148 HG23 ILE 148 -1.012 18.378 -0.861 1103 HD11 ILE 148 HD11 ILE 148 0.045 21.464 -4.580 1104 HD12 ILE 148 HD12 ILE 148 -0.790 20.169 -4.091 1105 HD13 ILE 148 HD13 ILE 148 0.813 20.072 -4.283 1106 H LEU 149 H LEU 149 -1.026 19.808 1.700 1107 HA LEU 149 HA LEU 149 0.587 17.658 2.754 1108 HB2 LEU 149 HB2 LEU 149 -1.414 19.198 4.155 1109 HB3 LEU 149 HB3 LEU 149 -0.553 17.985 4.831 1110 HG LEU 149 HG LEU 149 0.226 19.860 5.767 1111 HD11 LEU 149 HD11 LEU 149 2.520 19.987 5.091 1112 HD12 LEU 149 HD12 LEU 149 2.159 19.173 3.742 1113 HD13 LEU 149 HD13 LEU 149 2.025 18.451 5.182 1114 HD21 LEU 149 HD21 LEU 149 0.961 21.824 4.581 1115 HD22 LEU 149 HD22 LEU 149 -0.606 21.539 4.300 1116 HD23 LEU 149 HD23 LEU 149 0.499 21.149 3.186 1117 H ALA 150 H ALA 150 -0.408 15.584 2.909 1118 HA ALA 150 HA ALA 150 -3.260 15.513 2.393 1119 HB1 ALA 150 HB1 ALA 150 -2.189 14.742 0.398 1120 HB2 ALA 150 HB2 ALA 150 -2.949 13.495 1.095 1121 HB3 ALA 150 HB3 ALA 150 -1.347 13.653 1.246 1122 H VAL 151 H VAL 151 -4.432 14.318 3.875 1123 HA VAL 151 HA VAL 151 -2.898 12.612 5.627 1124 HB VAL 151 HB VAL 151 -4.987 14.397 6.567 1125 HG11 VAL 151 HG11 VAL 151 -4.494 13.597 8.789 1126 HG12 VAL 151 HG12 VAL 151 -3.430 12.544 8.177 1127 HG13 VAL 151 HG13 VAL 151 -5.007 12.375 7.862 1128 HG21 VAL 151 HG21 VAL 151 -3.243 15.543 7.784 1129 HG22 VAL 151 HG22 VAL 151 -2.941 15.603 6.196 1130 HG23 VAL 151 HG23 VAL 151 -2.138 14.557 7.133 1131 H TRP 152 H TRP 152 -3.692 10.599 5.915 1132 HA TRP 152 HA TRP 152 -6.260 10.052 4.733 1133 HB2 TRP 152 HB2 TRP 152 -4.128 9.217 3.630 1134 HB3 TRP 152 HB3 TRP 152 -4.139 8.090 4.811 1135 HD1 TRP 152 HD1 TRP 152 -6.298 6.415 4.793 1136 HE1 TRP 152 HE1 TRP 152 -7.687 5.480 2.935 1137 HE3 TRP 152 HE3 TRP 152 -4.941 9.707 1.283 1138 HZ2 TRP 152 HZ2 TRP 152 -8.148 6.205 0.255 1139 HZ3 TRP 152 HZ3 TRP 152 -5.933 9.539 -0.920 1140 HH2 TRP 152 HH2 TRP 152 -7.541 7.806 -1.410 1141 H ASP 153 H ASP 153 -7.787 9.457 6.138 1142 HA ASP 153 HA ASP 153 -6.915 8.293 8.590 1143 HB2 ASP 153 HB2 ASP 153 -9.354 9.610 7.866 1144 HB3 ASP 153 HB3 ASP 153 -9.359 8.639 9.179 1145 H VAL 154 H VAL 154 -7.247 6.287 9.249 1146 HA VAL 154 HA VAL 154 -8.839 4.558 7.561 1147 HB VAL 154 HB VAL 154 -6.283 3.848 8.762 1148 HG11 VAL 154 HG11 VAL 154 -6.433 1.791 7.559 1149 HG12 VAL 154 HG12 VAL 154 -7.893 2.213 7.008 1150 HG13 VAL 154 HG13 VAL 154 -7.676 1.930 8.585 1151 HG21 VAL 154 HG21 VAL 154 -5.396 3.818 6.520 1152 HG22 VAL 154 HG22 VAL 154 -5.938 5.299 6.876 1153 HG23 VAL 154 HG23 VAL 154 -6.823 4.316 5.945 1154 H ALA 155 H ALA 155 -10.482 3.566 8.694 1155 HA ALA 155 HA ALA 155 -10.573 3.909 11.473 1156 HB1 ALA 155 HB1 ALA 155 -12.617 3.804 10.191 1157 HB2 ALA 155 HB2 ALA 155 -12.659 2.660 11.333 1158 HB3 ALA 155 HB3 ALA 155 -12.311 2.264 9.804 1159 H ASP 156 H ASP 156 -9.567 1.502 9.377 1160 HA ASP 156 HA ASP 156 -9.707 -0.696 11.025 1161 HB2 ASP 156 HB2 ASP 156 -9.412 -0.353 8.445 1162 HB3 ASP 156 HB3 ASP 156 -7.827 -0.523 8.799 1163 H THR 157 H THR 157 -7.393 1.652 11.156 1164 HA THR 157 HA THR 157 -5.602 -0.148 12.500 1165 HB THR 157 HB THR 157 -3.722 1.304 11.600 1166 HG1 THR 157 HG1 THR 157 -4.999 2.138 9.479 1167 HG21 THR 157 HG21 THR 157 -3.683 0.258 9.440 1168 HG22 THR 157 HG22 THR 157 -5.250 -0.119 9.575 1169 HG23 THR 157 HG23 THR 157 -4.160 -0.836 10.531 1170 H GLU 158 H GLU 158 -4.117 0.852 14.124 1171 HA GLU 158 HA GLU 158 -5.478 2.808 15.590 1172 HB2 GLU 158 HB2 GLU 158 -2.774 1.875 16.088 1173 HB3 GLU 158 HB3 GLU 158 -3.735 2.595 17.196 1174 HG2 GLU 158 HG2 GLU 158 -4.111 0.562 17.873 1175 HG3 GLU 158 HG3 GLU 158 -5.158 0.504 16.621 1176 H ASN 159 H ASN 159 -3.396 2.938 13.064 1177 HA ASN 159 HA ASN 159 -2.395 5.523 13.784 1178 HB2 ASN 159 HB2 ASN 159 -1.284 3.524 11.996 1179 HB3 ASN 159 HB3 ASN 159 -0.729 5.059 11.938 1180 HD21 ASN 159 HD21 ASN 159 1.642 3.286 13.996 1181 HD22 ASN 159 HD22 ASN 159 1.138 3.290 12.339 1182 H ALA 160 H ALA 160 -2.116 7.148 12.162 1183 HA ALA 160 HA ALA 160 -3.988 7.014 9.942 1184 HB1 ALA 160 HB1 ALA 160 -4.781 8.638 11.461 1185 HB2 ALA 160 HB2 ALA 160 -4.202 9.411 10.164 1186 HB3 ALA 160 HB3 ALA 160 -3.328 9.345 11.523 1187 H PHE 161 H PHE 161 -3.107 8.233 8.014 1188 HA PHE 161 HA PHE 161 -0.208 8.047 7.995 1189 HB2 PHE 161 HB2 PHE 161 -1.959 7.205 5.844 1190 HB3 PHE 161 HB3 PHE 161 -0.341 6.986 5.887 1191 HD1 PHE 161 HD1 PHE 161 -3.456 5.813 7.288 1192 HD2 PHE 161 HD2 PHE 161 0.633 5.092 7.021 1193 HE1 PHE 161 HE1 PHE 161 -3.769 3.677 8.366 1194 HE2 PHE 161 HE2 PHE 161 0.322 2.943 8.081 1195 HZ PHE 161 HZ PHE 161 -1.879 2.245 8.769 1196 H TYR 162 H TYR 162 0.960 9.595 6.794 1197 HA TYR 162 HA TYR 162 -0.682 11.473 5.417 1198 HB2 TYR 162 HB2 TYR 162 0.367 13.372 6.457 1199 HB3 TYR 162 HB3 TYR 162 -0.488 12.480 7.525 1200 HD1 TYR 162 HD1 TYR 162 0.721 11.042 9.201 1201 HD2 TYR 162 HD2 TYR 162 2.723 13.757 6.759 1202 HE1 TYR 162 HE1 TYR 162 2.649 10.931 10.651 1203 HE2 TYR 162 HE2 TYR 162 4.635 13.664 8.236 1204 HH TYR 162 HH TYR 162 4.594 12.178 11.295 1205 H GLN 163 H GLN 163 0.309 12.860 3.870 1206 HA GLN 163 HA GLN 163 2.987 12.069 3.128 1207 HB2 GLN 163 HB2 GLN 163 0.763 12.208 1.315 1208 HB3 GLN 163 HB3 GLN 163 2.312 12.187 0.797 1209 HG2 GLN 163 HG2 GLN 163 1.675 10.022 0.561 1210 HG3 GLN 163 HG3 GLN 163 2.479 10.005 1.983 1211 HE21 GLN 163 HE21 GLN 163 -0.112 8.321 3.490 1212 HE22 GLN 163 HE22 GLN 163 1.592 8.461 3.213 1213 H VAL 164 H VAL 164 4.254 13.812 2.292 1214 HA VAL 164 HA VAL 164 2.924 16.344 2.121 1215 HB VAL 164 HB VAL 164 3.722 16.492 4.326 1216 HG11 VAL 164 HG11 VAL 164 5.936 15.860 5.008 1217 HG12 VAL 164 HG12 VAL 164 6.281 15.407 3.495 1218 HG13 VAL 164 HG13 VAL 164 5.179 14.591 4.352 1219 HG21 VAL 164 HG21 VAL 164 5.383 18.174 4.294 1220 HG22 VAL 164 HG22 VAL 164 4.255 18.465 3.173 1221 HG23 VAL 164 HG23 VAL 164 5.686 17.852 2.739 1222 H ILE 165 H ILE 165 3.476 17.553 0.394 1223 HA ILE 165 HA ILE 165 6.051 17.077 -0.747 1224 HB ILE 165 HB ILE 165 3.645 17.072 -2.431 1225 HG12 ILE 165 HG12 ILE 165 5.443 14.853 -2.042 1226 HG13 ILE 165 HG13 ILE 165 4.005 14.989 -1.278 1227 HG21 ILE 165 HG21 ILE 165 5.124 16.686 -4.330 1228 HG22 ILE 165 HG22 ILE 165 6.410 16.793 -3.355 1229 HG23 ILE 165 HG23 ILE 165 5.495 18.097 -3.632 1230 HD11 ILE 165 HD11 ILE 165 3.805 13.476 -3.132 1231 HD12 ILE 165 HD12 ILE 165 4.293 14.634 -4.149 1232 HD13 ILE 165 HD13 ILE 165 2.870 14.769 -3.393 1233 H ASP 166 H ASP 166 7.088 19.066 -1.057 1234 HA ASP 166 HA ASP 166 5.462 21.401 -1.147 1235 HB2 ASP 166 HB2 ASP 166 7.445 21.580 0.081 1236 HB3 ASP 166 HB3 ASP 166 8.330 21.179 -1.231 1237 H VAL 167 H VAL 167 5.111 22.750 -2.960 1238 HA VAL 167 HA VAL 167 6.385 21.893 -5.363 1239 HB VAL 167 HB VAL 167 4.289 22.170 -6.638 1240 HG11 VAL 167 HG11 VAL 167 3.344 20.028 -6.021 1241 HG12 VAL 167 HG12 VAL 167 4.191 20.050 -4.643 1242 HG13 VAL 167 HG13 VAL 167 4.957 19.926 -6.062 1243 HG21 VAL 167 HG21 VAL 167 2.207 22.183 -5.456 1244 HG22 VAL 167 HG22 VAL 167 3.060 23.510 -5.104 1245 HG23 VAL 167 HG23 VAL 167 3.001 22.284 -4.051 1246 H ASP 168 H ASP 168 6.863 23.468 -6.912 1247 HA ASP 168 HA ASP 168 6.603 26.165 -5.940 1248 HB2 ASP 168 HB2 ASP 168 8.754 25.167 -6.740 1249 HB3 ASP 168 HB3 ASP 168 8.176 25.530 -8.224 1250 H LEU 169 H LEU 169 5.057 27.487 -6.733 1251 HA LEU 169 HA LEU 169 3.760 26.634 -9.195 1252 HB2 LEU 169 HB2 LEU 169 2.524 28.061 -7.035 1253 HB3 LEU 169 HB3 LEU 169 1.766 27.507 -8.371 1254 HG LEU 169 HG LEU 169 2.838 25.851 -6.269 1255 HD11 LEU 169 HD11 LEU 169 0.507 25.339 -5.819 1256 HD12 LEU 169 HD12 LEU 169 0.062 26.357 -6.993 1257 HD13 LEU 169 HD13 LEU 169 0.768 26.926 -5.655 1258 HD21 LEU 169 HD21 LEU 169 1.925 23.953 -7.380 1259 HD22 LEU 169 HD22 LEU 169 3.059 24.653 -8.296 1260 HD23 LEU 169 HD23 LEU 169 1.493 24.883 -8.630 1261 H VAL 170 H VAL 170 4.061 27.999 -10.884 1262 HA VAL 170 HA VAL 170 4.733 30.659 -10.203 1263 HB VAL 170 HB VAL 170 6.648 30.592 -11.845 1264 HG11 VAL 170 HG11 VAL 170 8.191 29.395 -10.430 1265 HG12 VAL 170 HG12 VAL 170 6.950 28.723 -9.641 1266 HG13 VAL 170 HG13 VAL 170 7.212 30.314 -9.529 1267 HG21 VAL 170 HG21 VAL 170 7.417 28.446 -12.629 1268 HG22 VAL 170 HG22 VAL 170 5.921 28.731 -13.173 1269 HG23 VAL 170 HG23 VAL 170 6.149 27.730 -11.924 1270 H ASN 171 H ASN 171 4.829 32.274 -11.898 1271 HA ASN 171 HA ASN 171 2.770 32.048 -13.765 1272 HB2 ASN 171 HB2 ASN 171 4.885 34.012 -13.496 1273 HB3 ASN 171 HB3 ASN 171 3.736 34.150 -14.648 1274 HD21 ASN 171 HD21 ASN 171 1.877 36.149 -12.592 1275 HD22 ASN 171 HD22 ASN 171 2.559 35.868 -14.159 1276 H LYS 172 H LYS 172 3.087 32.094 -16.175 1277 HA LYS 172 HA LYS 172 5.199 30.508 -17.073 1278 HB2 LYS 172 HB2 LYS 172 3.342 32.154 -18.539 1279 HB3 LYS 172 HB3 LYS 172 4.431 31.201 -19.296 1280 HG2 LYS 172 HG2 LYS 172 3.401 29.285 -18.398 1281 HG3 LYS 172 HG3 LYS 172 2.334 30.222 -17.592 1282 HD2 LYS 172 HD2 LYS 172 1.249 29.460 -19.498 1283 HD3 LYS 172 HD3 LYS 172 1.556 31.047 -19.732 1284 HE2 LYS 172 HE2 LYS 172 3.491 30.443 -21.040 1285 HE3 LYS 172 HE3 LYS 172 3.082 28.870 -20.871 1286 HZ1 LYS 172 HZ1 LYS 172 2.335 29.688 -22.958 1287 HZ2 LYS 172 HZ2 LYS 172 1.470 30.833 -22.213 1288 HZ3 LYS 172 HZ3 LYS 172 1.065 29.277 -22.045 Start of MODEL 4 1 H1 HIS 1 H1 HIS 1 3.422 -0.356 1.986 2 H2 HIS 1 H2 HIS 1 2.287 -1.001 1.031 3 H3 HIS 1 H3 HIS 1 2.068 0.469 1.669 4 HA HIS 1 HA HIS 1 3.815 1.322 0.394 5 HB2 HIS 1 HB2 HIS 1 4.109 -1.391 -0.566 6 HB3 HIS 1 HB3 HIS 1 4.770 -0.136 -1.375 7 HD1 HIS 1 HD1 HIS 1 6.171 -2.655 0.276 8 HD2 HIS 1 HD2 HIS 1 6.187 1.366 1.113 9 HE1 HIS 1 HE1 HIS 1 8.123 -2.151 1.744 10 HE2 HIS 1 HE2 HIS 1 8.144 0.263 2.260 11 H GLY 2 H GLY 2 3.688 1.970 -1.903 12 HA2 GLY 2 HA2 GLY 2 1.584 1.385 -3.562 13 HA3 GLY 2 HA3 GLY 2 1.030 2.532 -2.540 14 H PHE 3 H PHE 3 1.159 3.953 -4.648 15 HA PHE 3 HA PHE 3 3.541 5.391 -4.405 16 HB2 PHE 3 HB2 PHE 3 4.119 5.266 -6.811 17 HB3 PHE 3 HB3 PHE 3 4.451 3.918 -5.950 18 HD1 PHE 3 HD1 PHE 3 2.523 5.230 -8.623 19 HD2 PHE 3 HD2 PHE 3 3.059 1.879 -6.219 20 HE1 PHE 3 HE1 PHE 3 1.293 3.900 -10.217 21 HE2 PHE 3 HE2 PHE 3 1.785 0.542 -7.776 22 HZ PHE 3 HZ PHE 3 0.921 1.552 -9.795 23 H ILE 4 H ILE 4 3.645 7.381 -5.742 24 HA ILE 4 HA ILE 4 1.019 8.493 -5.950 25 HB ILE 4 HB ILE 4 3.537 9.900 -6.285 26 HG12 ILE 4 HG12 ILE 4 3.437 9.083 -4.094 27 HG13 ILE 4 HG13 ILE 4 3.324 10.712 -4.094 28 HG21 ILE 4 HG21 ILE 4 2.241 11.926 -6.011 29 HG22 ILE 4 HG22 ILE 4 0.886 11.048 -5.918 30 HG23 ILE 4 HG23 ILE 4 1.720 11.104 -7.302 31 HD11 ILE 4 HD11 ILE 4 1.794 9.788 -2.482 32 HD12 ILE 4 HD12 ILE 4 1.068 8.927 -3.642 33 HD13 ILE 4 HD13 ILE 4 0.957 10.541 -3.643 34 H GLU 5 H GLU 5 -0.028 8.229 -7.884 35 HA GLU 5 HA GLU 5 1.372 7.482 -10.207 36 HB2 GLU 5 HB2 GLU 5 -0.857 6.761 -9.752 37 HB3 GLU 5 HB3 GLU 5 -1.379 8.301 -9.910 38 HG2 GLU 5 HG2 GLU 5 -1.961 7.263 -11.850 39 HG3 GLU 5 HG3 GLU 5 -0.666 8.183 -12.230 40 H LYS 6 H LYS 6 -0.169 10.391 -9.091 41 HA LYS 6 HA LYS 6 1.526 11.956 -10.755 42 HB2 LYS 6 HB2 LYS 6 -0.419 11.437 -12.134 43 HB3 LYS 6 HB3 LYS 6 -1.307 12.331 -11.095 44 HG2 LYS 6 HG2 LYS 6 -0.259 14.272 -11.741 45 HG3 LYS 6 HG3 LYS 6 0.887 13.449 -12.564 46 HD2 LYS 6 HD2 LYS 6 -1.890 13.417 -13.355 47 HD3 LYS 6 HD3 LYS 6 -0.823 14.481 -13.983 48 HE2 LYS 6 HE2 LYS 6 0.481 12.616 -14.816 49 HE3 LYS 6 HE3 LYS 6 -0.682 11.602 -14.278 50 HZ1 LYS 6 HZ1 LYS 6 -0.932 11.970 -16.606 51 HZ2 LYS 6 HZ2 LYS 6 -1.067 13.562 -16.354 52 HZ3 LYS 6 HZ3 LYS 6 -2.218 12.559 -15.822 53 HA PRO 7 HA PRO 7 2.370 14.135 -10.855 54 HB2 PRO 7 HB2 PRO 7 4.215 15.329 -9.336 55 HB3 PRO 7 HB3 PRO 7 2.867 16.153 -9.747 56 HG2 PRO 7 HG2 PRO 7 3.362 14.718 -7.335 57 HG3 PRO 7 HG3 PRO 7 2.798 16.243 -7.493 58 HD2 PRO 7 HD2 PRO 7 1.112 14.333 -7.095 59 HD3 PRO 7 HD3 PRO 7 0.715 15.524 -8.139 60 H GLY 8 H GLY 8 4.012 13.111 -11.786 61 HA2 GLY 8 HA2 GLY 8 4.616 10.625 -10.841 62 HA3 GLY 8 HA3 GLY 8 5.482 11.421 -11.975 63 H SER 9 H SER 9 6.530 9.572 -10.143 64 HA SER 9 HA SER 9 7.539 10.784 -7.910 65 HB2 SER 9 HB2 SER 9 8.951 8.787 -7.735 66 HB3 SER 9 HB3 SER 9 7.451 8.347 -8.207 67 HG SER 9 HG SER 9 8.922 7.331 -9.485 68 H ARG 10 H ARG 10 9.650 11.400 -7.210 69 HA ARG 10 HA ARG 10 10.935 12.990 -9.055 70 HB2 ARG 10 HB2 ARG 10 12.523 13.483 -7.380 71 HB3 ARG 10 HB3 ARG 10 11.036 13.439 -6.707 72 HG2 ARG 10 HG2 ARG 10 11.528 11.254 -5.838 73 HG3 ARG 10 HG3 ARG 10 13.038 11.376 -6.449 74 HD2 ARG 10 HD2 ARG 10 12.004 13.231 -4.490 75 HD3 ARG 10 HD3 ARG 10 12.907 11.934 -4.081 76 HE ARG 10 HE ARG 10 14.409 13.336 -5.879 77 HH11 ARG 10 HH11 ARG 10 16.079 14.660 -5.226 78 HH12 ARG 10 HH12 ARG 10 16.051 15.403 -3.662 79 HH21 ARG 10 HH21 ARG 10 13.097 13.953 -2.672 80 HH22 ARG 10 HH22 ARG 10 14.400 15.012 -2.247 81 H ALA 11 H ALA 11 11.236 9.720 -8.549 82 HA ALA 11 HA ALA 11 13.843 9.270 -9.163 83 HB1 ALA 11 HB1 ALA 11 12.364 7.509 -8.379 84 HB2 ALA 11 HB2 ALA 11 13.131 7.002 -9.709 85 HB3 ALA 11 HB3 ALA 11 11.599 7.510 -9.803 86 H ALA 12 H ALA 12 11.234 9.973 -11.317 87 HA ALA 12 HA ALA 12 12.466 9.240 -13.660 88 HB1 ALA 12 HB1 ALA 12 10.108 9.827 -13.567 89 HB2 ALA 12 HB2 ALA 12 10.818 10.686 -14.739 90 HB3 ALA 12 HB3 ALA 12 10.497 11.376 -13.313 91 H LEU 13 H LEU 13 12.762 12.114 -11.805 92 HA LEU 13 HA LEU 13 14.387 13.378 -13.767 93 HB2 LEU 13 HB2 LEU 13 13.576 14.374 -11.167 94 HB3 LEU 13 HB3 LEU 13 14.351 15.282 -12.281 95 HG LEU 13 HG LEU 13 12.201 14.621 -13.596 96 HD11 LEU 13 HD11 LEU 13 10.295 14.911 -12.132 97 HD12 LEU 13 HD12 LEU 13 11.284 14.975 -10.853 98 HD13 LEU 13 HD13 LEU 13 11.132 13.600 -11.691 99 HD21 LEU 13 HD21 LEU 13 11.475 16.890 -13.161 100 HD22 LEU 13 HD22 LEU 13 13.070 16.859 -13.424 101 HD23 LEU 13 HD23 LEU 13 12.502 16.976 -11.915 102 H CYS 14 H CYS 14 14.883 11.220 -11.425 103 HA CYS 14 HA CYS 14 17.428 12.186 -10.533 104 HB2 CYS 14 HB2 CYS 14 15.990 11.175 -9.012 105 HB3 CYS 14 HB3 CYS 14 15.990 9.809 -9.908 106 H SER 15 H SER 15 16.089 10.304 -12.937 107 HA SER 15 HA SER 15 18.107 8.497 -13.423 108 HB2 SER 15 HB2 SER 15 15.983 8.261 -14.504 109 HB3 SER 15 HB3 SER 15 16.218 9.656 -15.319 110 HG SER 15 HG SER 15 17.392 7.220 -15.727 111 H GLU 16 H GLU 16 19.905 8.471 -14.785 112 HA GLU 16 HA GLU 16 21.259 10.847 -15.055 113 HB2 GLU 16 HB2 GLU 16 21.746 8.305 -16.343 114 HB3 GLU 16 HB3 GLU 16 22.809 9.542 -16.423 115 HG2 GLU 16 HG2 GLU 16 23.631 8.154 -14.775 116 HG3 GLU 16 HG3 GLU 16 22.966 9.411 -13.973 117 H ALA 17 H ALA 17 18.929 9.402 -17.037 118 HA ALA 17 HA ALA 17 19.504 10.575 -19.448 119 HB1 ALA 17 HB1 ALA 17 17.782 8.887 -19.192 120 HB2 ALA 17 HB2 ALA 17 17.166 10.159 -19.976 121 HB3 ALA 17 HB3 ALA 17 16.852 9.949 -18.404 122 H PHE 18 H PHE 18 18.384 12.036 -16.617 123 HA PHE 18 HA PHE 18 17.363 14.296 -17.997 124 HB2 PHE 18 HB2 PHE 18 16.381 13.225 -15.899 125 HB3 PHE 18 HB3 PHE 18 17.463 14.159 -15.110 126 HD1 PHE 18 HD1 PHE 18 17.017 16.464 -14.677 127 HD2 PHE 18 HD2 PHE 18 14.555 14.321 -17.247 128 HE1 PHE 18 HE1 PHE 18 15.488 18.327 -14.754 129 HE2 PHE 18 HE2 PHE 18 13.011 16.174 -17.329 130 HZ PHE 18 HZ PHE 18 13.478 18.182 -16.084 131 H GLY 19 H GLY 19 20.405 13.529 -17.147 132 HA2 GLY 19 HA2 GLY 19 21.343 16.107 -17.453 133 HA3 GLY 19 HA3 GLY 19 21.271 15.800 -15.851 134 H PHE 20 H PHE 20 22.001 13.061 -16.094 135 HA PHE 20 HA PHE 20 23.692 11.771 -16.129 136 HB2 PHE 20 HB2 PHE 20 23.743 12.647 -18.576 137 HB3 PHE 20 HB3 PHE 20 25.218 13.196 -18.140 138 HD1 PHE 20 HD1 PHE 20 23.348 10.330 -19.039 139 HD2 PHE 20 HD2 PHE 20 27.054 11.603 -17.637 140 HE1 PHE 20 HE1 PHE 20 24.284 8.173 -19.585 141 HE2 PHE 20 HE2 PHE 20 28.001 9.445 -18.170 142 HZ PHE 20 HZ PHE 20 26.614 7.726 -19.153 143 H LEU 21 H LEU 21 25.062 14.941 -16.057 144 HA LEU 21 HA LEU 21 27.454 13.990 -14.950 145 HB2 LEU 21 HB2 LEU 21 26.470 16.717 -15.142 146 HB3 LEU 21 HB3 LEU 21 28.011 16.349 -14.745 147 HG LEU 21 HG LEU 21 26.859 15.837 -17.333 148 HD11 LEU 21 HD11 LEU 21 28.210 17.704 -18.088 149 HD12 LEU 21 HD12 LEU 21 28.696 17.963 -16.568 150 HD13 LEU 21 HD13 LEU 21 27.150 18.204 -16.974 151 HD21 LEU 21 HD21 LEU 21 29.086 15.349 -18.067 152 HD22 LEU 21 HD22 LEU 21 28.644 14.319 -16.902 153 HD23 LEU 21 HD23 LEU 21 29.633 15.551 -16.559 154 H ASN 22 H ASN 22 24.502 14.870 -13.658 155 HA ASN 22 HA ASN 22 25.490 14.536 -11.001 156 HB2 ASN 22 HB2 ASN 22 24.202 16.974 -11.879 157 HB3 ASN 22 HB3 ASN 22 24.158 16.550 -10.302 158 HD21 ASN 22 HD21 ASN 22 27.313 18.410 -11.774 159 HD22 ASN 22 HD22 ASN 22 25.903 18.052 -12.715 160 H LEU 23 H LEU 23 23.839 13.899 -9.467 161 HA LEU 23 HA LEU 23 21.147 13.786 -10.404 162 HB2 LEU 23 HB2 LEU 23 20.805 11.512 -9.977 163 HB3 LEU 23 HB3 LEU 23 21.946 11.698 -11.131 164 HG LEU 23 HG LEU 23 23.040 11.364 -8.589 165 HD11 LEU 23 HD11 LEU 23 22.512 9.017 -8.394 166 HD12 LEU 23 HD12 LEU 23 21.529 9.131 -9.673 167 HD13 LEU 23 HD13 LEU 23 21.159 9.897 -8.299 168 HD21 LEU 23 HD21 LEU 23 24.472 9.827 -9.750 169 HD22 LEU 23 HD22 LEU 23 24.393 11.228 -10.553 170 HD23 LEU 23 HD23 LEU 23 23.543 9.952 -11.068 171 H ASN 24 H ASN 24 19.581 13.402 -8.596 172 HA ASN 24 HA ASN 24 20.688 13.423 -6.001 173 HB2 ASN 24 HB2 ASN 24 20.709 15.780 -6.604 174 HB3 ASN 24 HB3 ASN 24 19.081 15.725 -6.711 175 HD21 ASN 24 HD21 ASN 24 20.166 17.059 -3.408 176 HD22 ASN 24 HD22 ASN 24 20.581 17.453 -5.043 177 H CYS 25 H CYS 25 19.567 11.435 -5.898 178 HA CYS 25 HA CYS 25 16.786 11.421 -6.103 179 HB2 CYS 25 HB2 CYS 25 18.783 9.575 -5.512 180 HB3 CYS 25 HB3 CYS 25 17.376 9.246 -4.752 181 H GLY 26 H GLY 26 18.965 11.582 -3.416 182 HA2 GLY 26 HA2 GLY 26 18.557 12.168 -1.274 183 HA3 GLY 26 HA3 GLY 26 17.061 12.669 -1.696 184 H SER 27 H SER 27 17.213 11.643 0.773 185 HA SER 27 HA SER 27 16.879 8.898 0.906 186 HB2 SER 27 HB2 SER 27 17.312 10.207 2.888 187 HB3 SER 27 HB3 SER 27 15.828 10.879 2.772 188 HG SER 27 HG SER 27 15.700 9.307 4.261 189 H VAL 28 H VAL 28 14.766 11.391 0.112 190 HA VAL 28 HA VAL 28 12.346 10.188 0.492 191 HB VAL 28 HB VAL 28 12.895 12.173 -1.603 192 HG11 VAL 28 HG11 VAL 28 10.684 13.034 -1.202 193 HG12 VAL 28 HG12 VAL 28 10.439 11.893 -0.082 194 HG13 VAL 28 HG13 VAL 28 10.606 11.478 -1.636 195 HG21 VAL 28 HG21 VAL 28 12.645 13.925 0.075 196 HG22 VAL 28 HG22 VAL 28 13.895 12.975 0.460 197 HG23 VAL 28 HG23 VAL 28 12.481 12.800 1.224 198 H MET 29 H MET 29 14.619 9.327 -1.777 199 HA MET 29 HA MET 29 12.948 8.462 -3.765 200 HB2 MET 29 HB2 MET 29 14.793 7.257 -4.632 201 HB3 MET 29 HB3 MET 29 15.394 8.617 -3.956 202 HG2 MET 29 HG2 MET 29 15.960 7.390 -2.032 203 HG3 MET 29 HG3 MET 29 15.398 6.033 -2.746 204 HE1 MET 29 HE1 MET 29 17.947 5.161 -5.443 205 HE2 MET 29 HE2 MET 29 16.468 5.799 -5.586 206 HE3 MET 29 HE3 MET 29 16.728 4.583 -4.552 207 H TYR 30 H TYR 30 13.359 7.103 -0.707 208 HA TYR 30 HA TYR 30 13.010 4.428 -1.496 209 HB2 TYR 30 HB2 TYR 30 14.175 4.902 0.507 210 HB3 TYR 30 HB3 TYR 30 12.853 5.626 1.135 211 HD1 TYR 30 HD1 TYR 30 13.822 2.323 -0.143 212 HD2 TYR 30 HD2 TYR 30 11.598 4.416 2.687 213 HE1 TYR 30 HE1 TYR 30 13.098 0.241 0.842 214 HE2 TYR 30 HE2 TYR 30 10.926 2.330 3.694 215 HH TYR 30 HH TYR 30 11.464 0.063 3.870 216 H GLU 31 H GLU 31 10.875 6.722 0.101 217 HA GLU 31 HA GLU 31 8.823 5.700 -1.460 218 HB2 GLU 31 HB2 GLU 31 7.222 5.330 0.392 219 HB3 GLU 31 HB3 GLU 31 8.333 4.164 0.119 220 HG2 GLU 31 HG2 GLU 31 9.570 5.081 1.993 221 HG3 GLU 31 HG3 GLU 31 8.237 5.963 2.327 222 HA PRO 32 HA PRO 32 8.153 10.047 -0.888 223 HB2 PRO 32 HB2 PRO 32 7.359 10.661 -3.365 224 HB3 PRO 32 HB3 PRO 32 8.953 10.429 -3.100 225 HG2 PRO 32 HG2 PRO 32 7.059 8.533 -4.080 226 HG3 PRO 32 HG3 PRO 32 8.513 8.913 -4.721 227 HD2 PRO 32 HD2 PRO 32 8.304 6.822 -3.200 228 HD3 PRO 32 HD3 PRO 32 9.654 7.737 -3.116 229 H GLN 33 H GLN 33 6.203 7.554 -1.176 230 HA GLN 33 HA GLN 33 3.842 9.112 -1.096 231 HB2 GLN 33 HB2 GLN 33 2.671 6.997 -1.416 232 HB3 GLN 33 HB3 GLN 33 3.826 7.184 -2.556 233 HG2 GLN 33 HG2 GLN 33 4.565 5.208 -2.017 234 HG3 GLN 33 HG3 GLN 33 5.051 5.840 -0.592 235 HE21 GLN 33 HE21 GLN 33 3.127 3.617 1.167 236 HE22 GLN 33 HE22 GLN 33 4.636 4.448 0.987 237 H SER 34 H SER 34 5.892 7.918 1.179 238 HA SER 34 HA SER 34 3.785 7.828 3.088 239 HB2 SER 34 HB2 SER 34 4.656 5.510 2.544 240 HB3 SER 34 HB3 SER 34 6.035 5.946 3.304 241 HG SER 34 HG SER 34 3.534 5.622 4.414 242 H LEU 35 H LEU 35 3.919 9.074 4.837 243 HA LEU 35 HA LEU 35 6.553 9.241 6.042 244 HB2 LEU 35 HB2 LEU 35 4.431 11.130 6.325 245 HB3 LEU 35 HB3 LEU 35 5.780 11.148 7.245 246 HG LEU 35 HG LEU 35 5.777 11.581 4.404 247 HD11 LEU 35 HD11 LEU 35 6.162 13.907 4.971 248 HD12 LEU 35 HD12 LEU 35 6.030 13.542 6.541 249 HD13 LEU 35 HD13 LEU 35 4.741 13.421 5.572 250 HD21 LEU 35 HD21 LEU 35 8.057 12.269 4.666 251 HD22 LEU 35 HD22 LEU 35 7.885 10.729 5.129 252 HD23 LEU 35 HD23 LEU 35 7.995 11.900 6.239 253 H GLU 36 H GLU 36 6.658 8.380 8.246 254 HA GLU 36 HA GLU 36 4.332 6.953 8.996 255 HB2 GLU 36 HB2 GLU 36 6.905 7.094 10.290 256 HB3 GLU 36 HB3 GLU 36 5.686 6.179 10.877 257 HG2 GLU 36 HG2 GLU 36 5.809 5.237 8.488 258 HG3 GLU 36 HG3 GLU 36 7.370 5.674 8.686 259 H ALA 37 H ALA 37 2.687 7.774 10.096 260 HA ALA 37 HA ALA 37 3.228 9.562 12.279 261 HB1 ALA 37 HB1 ALA 37 2.701 11.041 10.496 262 HB2 ALA 37 HB2 ALA 37 1.501 11.078 11.579 263 HB3 ALA 37 HB3 ALA 37 1.327 10.239 10.208 264 H LYS 38 H LYS 38 1.440 9.614 13.881 265 HA LYS 38 HA LYS 38 -0.455 7.486 13.465 266 HB2 LYS 38 HB2 LYS 38 1.492 7.218 15.201 267 HB3 LYS 38 HB3 LYS 38 0.351 7.881 16.162 268 HG2 LYS 38 HG2 LYS 38 -1.016 5.971 15.085 269 HG3 LYS 38 HG3 LYS 38 0.468 5.290 15.107 270 HD2 LYS 38 HD2 LYS 38 0.597 5.658 17.441 271 HD3 LYS 38 HD3 LYS 38 -0.894 6.325 17.414 272 HE2 LYS 38 HE2 LYS 38 -1.774 4.236 16.617 273 HE3 LYS 38 HE3 LYS 38 -0.285 3.582 16.759 274 HZ1 LYS 38 HZ1 LYS 38 -1.616 2.992 18.624 275 HZ2 LYS 38 HZ2 LYS 38 -1.849 4.555 18.968 276 HZ3 LYS 38 HZ3 LYS 38 -0.374 3.907 19.108 277 H LYS 39 H LYS 39 -2.405 7.587 14.943 278 HA LYS 39 HA LYS 39 -3.437 10.226 15.152 279 HB2 LYS 39 HB2 LYS 39 -4.423 7.776 16.269 280 HB3 LYS 39 HB3 LYS 39 -5.231 9.194 16.326 281 HG2 LYS 39 HG2 LYS 39 -5.456 9.175 13.947 282 HG3 LYS 39 HG3 LYS 39 -4.615 7.778 13.869 283 HD2 LYS 39 HD2 LYS 39 -6.340 6.643 15.024 284 HD3 LYS 39 HD3 LYS 39 -7.168 8.040 15.198 285 HE2 LYS 39 HE2 LYS 39 -8.243 7.013 13.457 286 HE3 LYS 39 HE3 LYS 39 -7.266 8.085 12.706 287 HZ1 LYS 39 HZ1 LYS 39 -7.225 6.014 11.578 288 HZ2 LYS 39 HZ2 LYS 39 -6.727 5.269 12.924 289 HZ3 LYS 39 HZ3 LYS 39 -5.759 6.331 12.181 290 H GLY 40 H GLY 40 -4.005 11.185 17.416 291 HA2 GLY 40 HA2 GLY 40 -1.676 11.192 18.952 292 HA3 GLY 40 HA3 GLY 40 -3.068 11.969 19.309 293 H PHE 41 H PHE 41 -3.177 8.595 18.968 294 HA PHE 41 HA PHE 41 -3.446 8.281 21.812 295 HB2 PHE 41 HB2 PHE 41 -4.338 6.459 19.744 296 HB3 PHE 41 HB3 PHE 41 -4.711 6.329 21.329 297 HD1 PHE 41 HD1 PHE 41 -6.025 7.186 18.358 298 HD2 PHE 41 HD2 PHE 41 -5.909 8.568 22.283 299 HE1 PHE 41 HE1 PHE 41 -8.040 8.446 17.962 300 HE2 PHE 41 HE2 PHE 41 -7.931 9.834 21.902 301 HZ PHE 41 HZ PHE 41 -9.004 9.763 19.740 302 HA PRO 42 HA PRO 42 -2.876 7.110 23.586 303 HB2 PRO 42 HB2 PRO 42 -1.008 6.318 25.286 304 HB3 PRO 42 HB3 PRO 42 -1.849 5.163 24.496 305 HG2 PRO 42 HG2 PRO 42 0.726 6.207 23.839 306 HG3 PRO 42 HG3 PRO 42 0.270 4.640 23.903 307 HD2 PRO 42 HD2 PRO 42 0.355 5.942 21.614 308 HD3 PRO 42 HD3 PRO 42 -0.703 4.721 21.851 309 H HIS 43 H HIS 43 -2.960 8.847 24.913 310 HA HIS 43 HA HIS 43 -1.243 10.924 24.153 311 HB2 HIS 43 HB2 HIS 43 -2.543 12.300 25.574 312 HB3 HIS 43 HB3 HIS 43 -3.575 11.239 24.884 313 HD1 HIS 43 HD1 HIS 43 -1.827 11.858 28.135 314 HD2 HIS 43 HD2 HIS 43 -5.012 9.726 26.680 315 HE1 HIS 43 HE1 HIS 43 -3.050 10.856 30.055 316 HE2 HIS 43 HE2 HIS 43 -4.985 9.581 29.202 317 H SER 44 H SER 44 -0.503 8.498 25.957 318 HA SER 44 HA SER 44 0.821 9.884 28.052 319 HB2 SER 44 HB2 SER 44 -0.375 7.732 28.427 320 HB3 SER 44 HB3 SER 44 0.855 7.000 27.641 321 HG SER 44 HG SER 44 0.722 7.703 30.143 322 H GLY 45 H GLY 45 1.542 8.930 24.992 323 HA2 GLY 45 HA2 GLY 45 4.347 8.540 25.511 324 HA3 GLY 45 HA3 GLY 45 3.595 8.274 24.086 325 HA PRO 46 HA PRO 46 5.472 12.406 23.708 326 HB2 PRO 46 HB2 PRO 46 6.708 12.117 21.386 327 HB3 PRO 46 HB3 PRO 46 7.457 11.579 22.733 328 HG2 PRO 46 HG2 PRO 46 5.902 10.067 20.883 329 HG3 PRO 46 HG3 PRO 46 7.390 9.715 21.458 330 HD2 PRO 46 HD2 PRO 46 5.303 8.606 22.542 331 HD3 PRO 46 HD3 PRO 46 6.568 9.029 23.484 332 H ALA 47 H ALA 47 4.996 14.120 22.134 333 HA ALA 47 HA ALA 47 2.338 13.889 21.414 334 HB1 ALA 47 HB1 ALA 47 3.340 16.036 21.879 335 HB2 ALA 47 HB2 ALA 47 2.627 16.090 20.429 336 HB3 ALA 47 HB3 ALA 47 4.232 15.922 20.535 337 H ASP 48 H ASP 48 1.273 13.181 19.655 338 HA ASP 48 HA ASP 48 2.642 13.044 17.110 339 HB2 ASP 48 HB2 ASP 48 2.757 10.849 18.229 340 HB3 ASP 48 HB3 ASP 48 1.154 10.751 17.930 341 H GLY 49 H GLY 49 0.997 12.972 15.329 342 HA2 GLY 49 HA2 GLY 49 -0.962 13.674 14.480 343 HA3 GLY 49 HA3 GLY 49 -1.701 13.272 15.880 344 H GLN 50 H GLN 50 0.768 15.479 16.349 345 HA GLN 50 HA GLN 50 -1.039 17.325 17.337 346 HB2 GLN 50 HB2 GLN 50 1.452 16.914 17.897 347 HB3 GLN 50 HB3 GLN 50 1.651 18.202 16.915 348 HG2 GLN 50 HG2 GLN 50 0.083 19.391 18.372 349 HG3 GLN 50 HG3 GLN 50 0.250 18.149 19.419 350 HE21 GLN 50 HE21 GLN 50 3.075 19.382 20.912 351 HE22 GLN 50 HE22 GLN 50 1.772 18.241 20.949 352 H ILE 51 H ILE 51 -0.073 16.908 14.237 353 HA ILE 51 HA ILE 51 -0.141 19.526 13.302 354 HB ILE 51 HB ILE 51 -0.730 17.097 11.797 355 HG12 ILE 51 HG12 ILE 51 1.777 18.536 11.994 356 HG13 ILE 51 HG13 ILE 51 1.474 17.132 12.771 357 HG21 ILE 51 HG21 ILE 51 -0.274 18.391 9.791 358 HG22 ILE 51 HG22 ILE 51 -0.068 19.722 10.686 359 HG23 ILE 51 HG23 ILE 51 -1.530 19.040 10.576 360 HD11 ILE 51 HD11 ILE 51 2.827 16.724 10.846 361 HD12 ILE 51 HD12 ILE 51 1.697 17.382 9.894 362 HD13 ILE 51 HD13 ILE 51 1.397 15.991 10.663 363 H ALA 52 H ALA 52 -2.595 17.250 14.126 364 HA ALA 52 HA ALA 52 -4.715 18.509 12.893 365 HB1 ALA 52 HB1 ALA 52 -4.908 16.252 13.782 366 HB2 ALA 52 HB2 ALA 52 -6.123 17.153 14.356 367 HB3 ALA 52 HB3 ALA 52 -4.841 16.835 15.289 368 H SER 53 H SER 53 -3.142 19.223 15.847 369 HA SER 53 HA SER 53 -5.089 21.246 16.503 370 HB2 SER 53 HB2 SER 53 -3.903 21.365 18.636 371 HB3 SER 53 HB3 SER 53 -4.477 19.865 18.341 372 HG SER 53 HG SER 53 -2.566 19.087 18.170 373 H ALA 54 H ALA 54 -2.878 21.116 14.458 374 HA ALA 54 HA ALA 54 -1.444 22.411 13.491 375 HB1 ALA 54 HB1 ALA 54 -3.322 24.002 13.431 376 HB2 ALA 54 HB2 ALA 54 -1.924 24.814 13.425 377 HB3 ALA 54 HB3 ALA 54 -2.778 24.684 14.792 378 H GLY 55 H GLY 55 -0.748 21.583 16.295 379 HA2 GLY 55 HA2 GLY 55 0.957 23.619 17.229 380 HA3 GLY 55 HA3 GLY 55 0.874 22.093 17.807 381 H GLY 56 H GLY 56 1.396 20.751 15.385 382 HA2 GLY 56 HA2 GLY 56 4.191 20.800 15.498 383 HA3 GLY 56 HA3 GLY 56 3.276 19.851 14.533 384 H LEU 57 H LEU 57 2.290 22.848 13.792 385 HA LEU 57 HA LEU 57 3.516 22.762 11.334 386 HB2 LEU 57 HB2 LEU 57 2.180 24.997 12.589 387 HB3 LEU 57 HB3 LEU 57 2.622 25.019 11.017 388 HG LEU 57 HG LEU 57 0.656 23.223 12.105 389 HD11 LEU 57 HD11 LEU 57 -0.943 24.633 10.960 390 HD12 LEU 57 HD12 LEU 57 0.257 25.616 10.504 391 HD13 LEU 57 HD13 LEU 57 -0.139 25.495 12.067 392 HD21 LEU 57 HD21 LEU 57 0.112 22.660 9.856 393 HD22 LEU 57 HD22 LEU 57 1.648 22.269 10.173 394 HD23 LEU 57 HD23 LEU 57 1.313 23.601 9.321 395 H PHE 58 H PHE 58 4.520 24.261 14.237 396 HA PHE 58 HA PHE 58 6.369 25.977 13.138 397 HB2 PHE 58 HB2 PHE 58 6.345 24.734 15.741 398 HB3 PHE 58 HB3 PHE 58 7.457 25.863 15.345 399 HD1 PHE 58 HD1 PHE 58 4.595 25.498 17.069 400 HD2 PHE 58 HD2 PHE 58 6.283 28.077 14.278 401 HE1 PHE 58 HE1 PHE 58 3.110 27.257 17.802 402 HE2 PHE 58 HE2 PHE 58 4.774 29.830 14.972 403 HZ PHE 58 HZ PHE 58 3.198 29.428 16.747 404 H GLY 59 H GLY 59 6.478 22.589 13.541 405 HA2 GLY 59 HA2 GLY 59 9.256 22.306 13.292 406 HA3 GLY 59 HA3 GLY 59 8.148 21.125 13.081 407 H GLY 60 H GLY 60 6.719 22.720 11.036 408 HA2 GLY 60 HA2 GLY 60 8.040 21.756 8.785 409 HA3 GLY 60 HA3 GLY 60 6.777 22.792 8.776 410 H ILE 61 H ILE 61 8.296 24.666 10.486 411 HA ILE 61 HA ILE 61 9.404 26.226 8.483 412 HB ILE 61 HB ILE 61 9.788 26.566 11.353 413 HG12 ILE 61 HG12 ILE 61 7.488 26.536 10.907 414 HG13 ILE 61 HG13 ILE 61 7.926 28.055 11.314 415 HG21 ILE 61 HG21 ILE 61 10.230 28.899 10.902 416 HG22 ILE 61 HG22 ILE 61 10.106 28.618 9.314 417 HG23 ILE 61 HG23 ILE 61 11.324 27.970 10.157 418 HD11 ILE 61 HD11 ILE 61 6.352 28.124 9.475 419 HD12 ILE 61 HD12 ILE 61 7.339 27.211 8.577 420 HD13 ILE 61 HD13 ILE 61 7.773 28.716 8.980 421 H LEU 62 H LEU 62 10.697 23.884 10.606 422 HA LEU 62 HA LEU 62 13.376 24.426 9.854 423 HB2 LEU 62 HB2 LEU 62 12.248 22.405 11.551 424 HB3 LEU 62 HB3 LEU 62 13.827 22.342 11.138 425 HG LEU 62 HG LEU 62 14.092 24.475 12.265 426 HD11 LEU 62 HD11 LEU 62 12.492 25.127 13.919 427 HD12 LEU 62 HD12 LEU 62 11.483 23.974 13.403 428 HD13 LEU 62 HD13 LEU 62 11.848 25.221 12.439 429 HD21 LEU 62 HD21 LEU 62 14.205 23.388 14.464 430 HD22 LEU 62 HD22 LEU 62 14.779 22.392 13.327 431 HD23 LEU 62 HD23 LEU 62 13.282 22.184 13.903 432 H ASP 63 H ASP 63 10.900 22.106 9.195 433 HA ASP 63 HA ASP 63 12.397 20.244 7.840 434 HB2 ASP 63 HB2 ASP 63 10.069 20.004 8.627 435 HB3 ASP 63 HB3 ASP 63 9.610 20.794 7.274 436 H GLN 64 H GLN 64 10.839 23.081 6.641 437 HA GLN 64 HA GLN 64 11.266 22.569 3.982 438 HB2 GLN 64 HB2 GLN 64 10.698 24.867 3.611 439 HB3 GLN 64 HB3 GLN 64 9.741 24.275 4.795 440 HG2 GLN 64 HG2 GLN 64 11.156 25.294 6.409 441 HG3 GLN 64 HG3 GLN 64 12.042 25.937 5.198 442 HE21 GLN 64 HE21 GLN 64 9.844 28.578 6.365 443 HE22 GLN 64 HE22 GLN 64 11.126 27.623 7.034 444 H GLN 65 H GLN 65 13.628 22.964 6.098 445 HA GLN 65 HA GLN 65 15.501 23.571 4.035 446 HB2 GLN 65 HB2 GLN 65 16.731 25.083 5.480 447 HB3 GLN 65 HB3 GLN 65 15.290 25.674 4.988 448 HG2 GLN 65 HG2 GLN 65 14.389 25.010 7.148 449 HG3 GLN 65 HG3 GLN 65 15.922 24.692 7.614 450 HE21 GLN 65 HE21 GLN 65 14.682 28.181 8.450 451 HE22 GLN 65 HE22 GLN 65 13.850 26.662 8.482 452 H SER 66 H SER 66 14.768 21.119 5.180 453 HA SER 66 HA SER 66 17.109 20.449 6.729 454 HB2 SER 66 HB2 SER 66 14.969 20.195 7.926 455 HB3 SER 66 HB3 SER 66 14.546 19.049 6.842 456 HG SER 66 HG SER 66 16.070 18.838 8.995 457 H GLU 67 H GLU 67 17.691 18.019 6.676 458 HA GLU 67 HA GLU 67 18.235 17.301 4.029 459 HB2 GLU 67 HB2 GLU 67 19.643 16.688 5.887 460 HB3 GLU 67 HB3 GLU 67 18.468 15.694 6.434 461 HG2 GLU 67 HG2 GLU 67 20.098 14.387 5.430 462 HG3 GLU 67 HG3 GLU 67 18.768 14.338 4.484 463 H ASN 68 H ASN 68 15.878 16.270 6.331 464 HA ASN 68 HA ASN 68 14.895 14.213 4.700 465 HB2 ASN 68 HB2 ASN 68 13.300 13.848 6.469 466 HB3 ASN 68 HB3 ASN 68 14.754 14.142 7.152 467 HD21 ASN 68 HD21 ASN 68 11.668 16.541 7.851 468 HD22 ASN 68 HD22 ASN 68 11.568 15.130 6.852 469 H ARG 69 H ARG 69 14.667 17.247 4.132 470 HA ARG 69 HA ARG 69 12.054 17.961 4.058 471 HB2 ARG 69 HB2 ARG 69 13.851 19.492 3.690 472 HB3 ARG 69 HB3 ARG 69 14.216 18.750 2.281 473 HG2 ARG 69 HG2 ARG 69 12.367 19.662 1.245 474 HG3 ARG 69 HG3 ARG 69 11.792 20.233 2.663 475 HD2 ARG 69 HD2 ARG 69 12.813 21.958 1.428 476 HD3 ARG 69 HD3 ARG 69 13.616 21.699 2.826 477 HE ARG 69 HE ARG 69 14.830 20.192 0.851 478 HH11 ARG 69 HH11 ARG 69 14.524 23.571 1.800 479 HH12 ARG 69 HH12 ARG 69 16.030 24.002 1.062 480 HH21 ARG 69 HH21 ARG 69 16.747 20.823 -0.053 481 HH22 ARG 69 HH22 ARG 69 17.265 22.473 0.032 482 H TRP 70 H TRP 70 10.432 18.265 2.595 483 HA TRP 70 HA TRP 70 9.941 16.006 1.057 484 HB2 TRP 70 HB2 TRP 70 7.940 17.365 0.390 485 HB3 TRP 70 HB3 TRP 70 8.095 17.101 1.995 486 HD1 TRP 70 HD1 TRP 70 9.056 19.871 -0.386 487 HE1 TRP 70 HE1 TRP 70 8.870 22.141 0.651 488 HE3 TRP 70 HE3 TRP 70 7.680 18.352 4.173 489 HZ2 TRP 70 HZ2 TRP 70 8.171 23.094 3.209 490 HZ3 TRP 70 HZ3 TRP 70 7.281 20.024 5.890 491 HH2 TRP 70 HH2 TRP 70 7.526 22.372 5.396 492 H PHE 71 H PHE 71 9.341 15.912 -1.258 493 HA PHE 71 HA PHE 71 11.364 17.276 -2.685 494 HB2 PHE 71 HB2 PHE 71 10.908 15.819 -4.485 495 HB3 PHE 71 HB3 PHE 71 10.934 14.935 -3.112 496 HD1 PHE 71 HD1 PHE 71 8.803 14.035 -2.155 497 HD2 PHE 71 HD2 PHE 71 8.932 16.006 -5.820 498 HE1 PHE 71 HE1 PHE 71 6.614 13.165 -2.694 499 HE2 PHE 71 HE2 PHE 71 6.751 15.127 -6.380 500 HZ PHE 71 HZ PHE 71 5.595 13.693 -4.821 501 H LYS 72 H LYS 72 11.150 18.578 -4.587 502 HA LYS 72 HA LYS 72 8.546 19.765 -4.783 503 HB2 LYS 72 HB2 LYS 72 10.170 21.298 -3.829 504 HB3 LYS 72 HB3 LYS 72 11.014 21.224 -5.225 505 HG2 LYS 72 HG2 LYS 72 9.438 22.419 -6.371 506 HG3 LYS 72 HG3 LYS 72 8.292 22.145 -5.241 507 HD2 LYS 72 HD2 LYS 72 8.819 24.317 -4.988 508 HD3 LYS 72 HD3 LYS 72 9.603 23.567 -3.767 509 HE2 LYS 72 HE2 LYS 72 11.631 23.727 -4.927 510 HE3 LYS 72 HE3 LYS 72 10.869 24.376 -6.218 511 HZ1 LYS 72 HZ1 LYS 72 11.846 26.108 -4.891 512 HZ2 LYS 72 HZ2 LYS 72 10.990 25.616 -3.610 513 HZ3 LYS 72 HZ3 LYS 72 10.236 26.258 -4.888 514 H HIS 73 H HIS 73 7.597 20.151 -6.767 515 HA HIS 73 HA HIS 73 9.225 19.545 -9.100 516 HB2 HIS 73 HB2 HIS 73 6.445 18.986 -8.692 517 HB3 HIS 73 HB3 HIS 73 7.076 19.048 -10.196 518 HD1 HIS 73 HD1 HIS 73 9.660 17.579 -8.315 519 HD2 HIS 73 HD2 HIS 73 6.099 16.222 -9.826 520 HE1 HIS 73 HE1 HIS 73 9.737 15.091 -8.419 521 HE2 HIS 73 HE2 HIS 73 7.595 14.254 -9.312 522 H ILE 74 H ILE 74 8.996 21.057 -10.915 523 HA ILE 74 HA ILE 74 7.848 23.602 -10.164 524 HB ILE 74 HB ILE 74 9.498 22.999 -12.482 525 HG12 ILE 74 HG12 ILE 74 10.304 24.452 -10.121 526 HG13 ILE 74 HG13 ILE 74 10.638 22.868 -10.334 527 HG21 ILE 74 HG21 ILE 74 9.635 25.400 -12.815 528 HG22 ILE 74 HG22 ILE 74 8.628 25.637 -11.572 529 HG23 ILE 74 HG23 ILE 74 8.093 24.926 -12.921 530 HD11 ILE 74 HD11 ILE 74 12.566 24.190 -10.875 531 HD12 ILE 74 HD12 ILE 74 11.718 24.994 -11.993 532 HD13 ILE 74 HD13 ILE 74 12.050 23.425 -12.203 533 H MET 75 H MET 75 6.046 24.506 -11.339 534 HA MET 75 HA MET 75 4.908 22.934 -13.428 535 HB2 MET 75 HB2 MET 75 4.144 22.223 -11.067 536 HB3 MET 75 HB3 MET 75 3.129 23.490 -11.244 537 HG2 MET 75 HG2 MET 75 2.132 22.520 -13.046 538 HG3 MET 75 HG3 MET 75 3.236 21.316 -13.061 539 HE1 MET 75 HE1 MET 75 0.326 19.114 -11.990 540 HE2 MET 75 HE2 MET 75 1.654 19.195 -12.909 541 HE3 MET 75 HE3 MET 75 0.412 20.191 -13.193 542 H THR 76 H THR 76 2.998 23.973 -14.474 543 HA THR 76 HA THR 76 3.008 26.853 -14.116 544 HB THR 76 HB THR 76 1.947 26.884 -16.347 545 HG1 THR 76 HG1 THR 76 2.062 24.281 -15.915 546 HG21 THR 76 HG21 THR 76 4.012 26.564 -17.516 547 HG22 THR 76 HG22 THR 76 4.625 25.763 -16.252 548 HG23 THR 76 HG23 THR 76 4.318 27.347 -16.135 549 H GLY 77 H GLY 77 0.628 27.783 -14.639 550 HA2 GLY 77 HA2 GLY 77 -1.053 26.644 -12.735 551 HA3 GLY 77 HA3 GLY 77 -1.437 27.868 -13.746 552 H GLY 78 H GLY 78 -3.609 26.854 -13.482 553 HA2 GLY 78 HA2 GLY 78 -5.134 25.956 -15.026 554 HA3 GLY 78 HA3 GLY 78 -3.992 24.942 -15.604 555 H GLU 79 H GLU 79 -6.208 23.616 -15.287 556 HA GLU 79 HA GLU 79 -6.551 22.685 -12.694 557 HB2 GLU 79 HB2 GLU 79 -7.452 21.574 -15.191 558 HB3 GLU 79 HB3 GLU 79 -7.782 20.821 -13.779 559 HG2 GLU 79 HG2 GLU 79 -8.880 22.914 -13.122 560 HG3 GLU 79 HG3 GLU 79 -8.817 23.307 -14.706 561 H HIS 80 H HIS 80 -5.592 20.973 -11.579 562 HA HIS 80 HA HIS 80 -3.733 19.343 -13.097 563 HB2 HIS 80 HB2 HIS 80 -3.253 20.421 -10.458 564 HB3 HIS 80 HB3 HIS 80 -2.211 19.456 -11.264 565 HD1 HIS 80 HD1 HIS 80 -1.591 22.422 -10.240 566 HD2 HIS 80 HD2 HIS 80 -2.447 21.252 -14.074 567 HE1 HIS 80 HE1 HIS 80 -0.773 24.171 -11.810 568 HE2 HIS 80 HE2 HIS 80 -1.247 23.468 -14.122 569 H THR 81 H THR 81 -3.674 17.184 -12.763 570 HA THR 81 HA THR 81 -5.709 16.247 -10.977 571 HB THR 81 HB THR 81 -4.450 14.742 -13.144 572 HG1 THR 81 HG1 THR 81 -5.668 15.863 -14.376 573 HG21 THR 81 HG21 THR 81 -6.248 13.177 -12.878 574 HG22 THR 81 HG22 THR 81 -6.857 14.056 -11.664 575 HG23 THR 81 HG23 THR 81 -5.449 13.284 -11.476 576 H PHE 82 H PHE 82 -5.227 15.268 -9.111 577 HA PHE 82 HA PHE 82 -2.524 14.292 -8.730 578 HB2 PHE 82 HB2 PHE 82 -4.386 15.320 -6.780 579 HB3 PHE 82 HB3 PHE 82 -2.955 14.647 -6.374 580 HD1 PHE 82 HD1 PHE 82 -0.930 15.897 -6.433 581 HD2 PHE 82 HD2 PHE 82 -4.425 17.518 -8.002 582 HE1 PHE 82 HE1 PHE 82 0.170 18.029 -6.656 583 HE2 PHE 82 HE2 PHE 82 -3.335 19.656 -8.235 584 HZ PHE 82 HZ PHE 82 -1.034 19.918 -7.557 585 H THR 83 H THR 83 -2.253 12.121 -8.339 586 HA THR 83 HA THR 83 -4.592 10.646 -7.609 587 HB THR 83 HB THR 83 -2.878 9.808 -9.834 588 HG1 THR 83 HG1 THR 83 -4.057 10.897 -11.112 589 HG21 THR 83 HG21 THR 83 -4.506 8.101 -10.257 590 HG22 THR 83 HG22 THR 83 -5.381 8.599 -8.992 591 HG23 THR 83 HG23 THR 83 -3.934 7.916 -8.756 592 H TRP 84 H TRP 84 -4.284 9.030 -6.124 593 HA TRP 84 HA TRP 84 -1.550 8.212 -5.657 594 HB2 TRP 84 HB2 TRP 84 -3.616 8.175 -3.638 595 HB3 TRP 84 HB3 TRP 84 -2.029 7.888 -3.385 596 HD1 TRP 84 HD1 TRP 84 -1.236 10.648 -5.001 597 HE1 TRP 84 HE1 TRP 84 -1.326 12.839 -3.787 598 HE3 TRP 84 HE3 TRP 84 -4.212 9.167 -1.264 599 HZ2 TRP 84 HZ2 TRP 84 -2.596 13.741 -1.436 600 HZ3 TRP 84 HZ3 TRP 84 -4.866 10.777 0.420 601 HH2 TRP 84 HH2 TRP 84 -4.061 13.041 0.323 602 H THR 85 H THR 85 -1.260 5.860 -5.323 603 HA THR 85 HA THR 85 -3.669 4.325 -5.289 604 HB THR 85 HB THR 85 -3.093 4.394 -7.643 605 HG1 THR 85 HG1 THR 85 -4.252 2.660 -7.115 606 HG21 THR 85 HG21 THR 85 -1.164 3.231 -8.402 607 HG22 THR 85 HG22 THR 85 -0.721 2.930 -6.876 608 HG23 THR 85 HG23 THR 85 -0.698 4.445 -7.440 609 H TYR 86 H TYR 86 -3.346 2.059 -4.573 610 HA TYR 86 HA TYR 86 -0.882 1.778 -3.091 611 HB2 TYR 86 HB2 TYR 86 -3.534 1.194 -2.143 612 HB3 TYR 86 HB3 TYR 86 -2.211 0.596 -1.396 613 HD1 TYR 86 HD1 TYR 86 -4.176 3.547 -1.876 614 HD2 TYR 86 HD2 TYR 86 -0.690 2.082 -0.138 615 HE1 TYR 86 HE1 TYR 86 -3.945 5.589 -0.602 616 HE2 TYR 86 HE2 TYR 86 -0.472 4.118 1.140 617 HH TYR 86 HH TYR 86 -2.010 6.916 0.530 618 H THR 87 H THR 87 -0.066 -0.401 -2.806 619 HA THR 87 HA THR 87 -0.576 -1.894 -5.088 620 HB THR 87 HB THR 87 1.048 -3.513 -4.125 621 HG1 THR 87 HG1 THR 87 0.211 -2.687 -1.932 622 HG21 THR 87 HG21 THR 87 2.928 -2.009 -4.076 623 HG22 THR 87 HG22 THR 87 1.933 -0.746 -3.903 624 HG23 THR 87 HG23 THR 87 1.956 -1.573 -5.292 625 H ALA 88 H ALA 88 -1.947 -1.889 -2.047 626 HA ALA 88 HA ALA 88 -3.659 -4.107 -2.754 627 HB1 ALA 88 HB1 ALA 88 -2.166 -5.085 -1.192 628 HB2 ALA 88 HB2 ALA 88 -3.617 -4.942 -0.492 629 HB3 ALA 88 HB3 ALA 88 -2.440 -3.891 -0.136 630 HA PRO 89 HA PRO 89 -6.325 -0.862 -1.571 631 HB2 PRO 89 HB2 PRO 89 -8.725 -2.001 -1.417 632 HB3 PRO 89 HB3 PRO 89 -8.031 -1.835 -2.886 633 HG2 PRO 89 HG2 PRO 89 -8.010 -4.145 -1.200 634 HG3 PRO 89 HG3 PRO 89 -8.376 -4.077 -2.790 635 HD2 PRO 89 HD2 PRO 89 -5.982 -4.785 -2.046 636 HD3 PRO 89 HD3 PRO 89 -6.177 -3.900 -3.405 637 H HIS 90 H HIS 90 -7.083 0.244 0.137 638 HA HIS 90 HA HIS 90 -7.378 -1.265 2.589 639 HB2 HIS 90 HB2 HIS 90 -5.875 1.179 2.319 640 HB3 HIS 90 HB3 HIS 90 -6.249 0.514 3.763 641 HD1 HIS 90 HD1 HIS 90 -5.297 -2.054 4.139 642 HD2 HIS 90 HD2 HIS 90 -3.469 0.337 1.355 643 HE1 HIS 90 HE1 HIS 90 -3.094 -3.053 3.565 644 HE2 HIS 90 HE2 HIS 90 -1.975 -1.632 1.886 645 H ASN 91 H ASN 91 -8.780 -0.285 4.232 646 HA ASN 91 HA ASN 91 -10.888 1.107 3.008 647 HB2 ASN 91 HB2 ASN 91 -10.488 0.330 5.747 648 HB3 ASN 91 HB3 ASN 91 -11.802 1.192 5.300 649 HD21 ASN 91 HD21 ASN 91 -11.916 -2.687 5.025 650 HD22 ASN 91 HD22 ASN 91 -10.790 -1.774 5.971 651 H THR 92 H THR 92 -11.591 3.244 3.299 652 HA THR 92 HA THR 92 -9.654 4.995 4.518 653 HB THR 92 HB THR 92 -11.122 5.583 2.042 654 HG1 THR 92 HG1 THR 92 -8.521 4.756 2.385 655 HG21 THR 92 HG21 THR 92 -9.735 7.506 1.820 656 HG22 THR 92 HG22 THR 92 -8.991 7.154 3.212 657 HG23 THR 92 HG23 THR 92 -10.544 7.603 3.217 658 H SER 93 H SER 93 -10.535 6.409 6.027 659 HA SER 93 HA SER 93 -13.374 6.479 6.195 660 HB2 SER 93 HB2 SER 93 -12.112 6.275 8.253 661 HB3 SER 93 HB3 SER 93 -11.431 7.733 7.975 662 HG SER 93 HG SER 93 -14.035 7.961 7.878 663 H GLN 94 H GLN 94 -10.725 8.666 5.698 664 HA GLN 94 HA GLN 94 -12.357 10.516 4.290 665 HB2 GLN 94 HB2 GLN 94 -12.729 11.154 6.590 666 HB3 GLN 94 HB3 GLN 94 -11.118 11.331 6.786 667 HG2 GLN 94 HG2 GLN 94 -11.160 13.177 5.286 668 HG3 GLN 94 HG3 GLN 94 -12.781 13.018 5.162 669 HE21 GLN 94 HE21 GLN 94 -11.421 14.195 8.791 670 HE22 GLN 94 HE22 GLN 94 -10.657 12.899 7.934 671 H TRP 95 H TRP 95 -11.069 12.028 3.005 672 HA TRP 95 HA TRP 95 -8.286 12.105 3.673 673 HB2 TRP 95 HB2 TRP 95 -7.551 11.831 1.413 674 HB3 TRP 95 HB3 TRP 95 -8.039 10.468 2.170 675 HD1 TRP 95 HD1 TRP 95 -10.855 9.997 1.484 676 HE1 TRP 95 HE1 TRP 95 -11.827 9.761 -0.809 677 HE3 TRP 95 HE3 TRP 95 -7.190 12.348 -0.984 678 HZ2 TRP 95 HZ2 TRP 95 -11.009 10.544 -3.385 679 HZ3 TRP 95 HZ3 TRP 95 -7.345 12.530 -3.395 680 HH2 TRP 95 HH2 TRP 95 -9.244 11.637 -4.568 681 H HIS 96 H HIS 96 -7.268 14.085 3.180 682 HA HIS 96 HA HIS 96 -8.895 16.070 1.996 683 HB2 HIS 96 HB2 HIS 96 -8.584 17.492 4.122 684 HB3 HIS 96 HB3 HIS 96 -9.868 16.491 3.994 685 HD1 HIS 96 HD1 HIS 96 -7.525 17.460 6.384 686 HD2 HIS 96 HD2 HIS 96 -9.103 13.844 5.278 687 HE1 HIS 96 HE1 HIS 96 -7.199 15.843 8.250 688 HE2 HIS 96 HE2 HIS 96 -8.122 13.654 7.594 689 H TYR 97 H TYR 97 -7.910 18.227 1.799 690 HA TYR 97 HA TYR 97 -5.050 18.006 1.745 691 HB2 TYR 97 HB2 TYR 97 -6.741 19.106 -0.348 692 HB3 TYR 97 HB3 TYR 97 -5.118 19.288 -0.366 693 HD1 TYR 97 HD1 TYR 97 -7.758 16.859 -0.809 694 HD2 TYR 97 HD2 TYR 97 -3.675 17.565 -1.207 695 HE1 TYR 97 HE1 TYR 97 -7.534 14.855 -2.148 696 HE2 TYR 97 HE2 TYR 97 -3.459 15.573 -2.551 697 HH TYR 97 HH TYR 97 -5.343 13.160 -2.672 698 H TYR 98 H TYR 98 -3.869 19.797 2.360 699 HA TYR 98 HA TYR 98 -5.307 22.277 2.741 700 HB2 TYR 98 HB2 TYR 98 -3.118 21.388 4.397 701 HB3 TYR 98 HB3 TYR 98 -3.964 22.768 4.610 702 HD1 TYR 98 HD1 TYR 98 -4.019 19.226 5.132 703 HD2 TYR 98 HD2 TYR 98 -6.175 22.742 5.676 704 HE1 TYR 98 HE1 TYR 98 -5.505 18.084 6.644 705 HE2 TYR 98 HE2 TYR 98 -7.641 21.597 7.221 706 HH TYR 98 HH TYR 98 -8.380 18.945 7.484 707 H ILE 99 H ILE 99 -3.830 24.232 2.430 708 HA ILE 99 HA ILE 99 -1.413 23.522 1.085 709 HB ILE 99 HB ILE 99 -1.727 25.477 -0.457 710 HG12 ILE 99 HG12 ILE 99 -4.512 25.348 0.203 711 HG13 ILE 99 HG13 ILE 99 -3.525 26.422 0.937 712 HG21 ILE 99 HG21 ILE 99 -3.129 24.229 -1.998 713 HG22 ILE 99 HG22 ILE 99 -3.594 23.257 -0.792 714 HG23 ILE 99 HG23 ILE 99 -2.060 23.235 -1.304 715 HD11 ILE 99 HD11 ILE 99 -4.676 27.474 -0.871 716 HD12 ILE 99 HD12 ILE 99 -4.067 26.393 -1.908 717 HD13 ILE 99 HD13 ILE 99 -3.089 27.456 -1.181 718 H THR 100 H THR 100 0.440 24.738 1.535 719 HA THR 100 HA THR 100 0.186 26.486 3.744 720 HB THR 100 HB THR 100 2.630 25.726 2.335 721 HG1 THR 100 HG1 THR 100 1.972 24.664 4.761 722 HG21 THR 100 HG21 THR 100 3.801 26.388 4.320 723 HG22 THR 100 HG22 THR 100 2.409 26.826 5.017 724 HG23 THR 100 HG23 THR 100 2.982 27.663 3.758 725 H LYS 101 H LYS 101 0.244 28.686 3.780 726 HA LYS 101 HA LYS 101 0.266 29.982 1.270 727 HB2 LYS 101 HB2 LYS 101 -0.172 31.112 3.930 728 HB3 LYS 101 HB3 LYS 101 -0.526 31.903 2.546 729 HG2 LYS 101 HG2 LYS 101 -2.249 30.343 2.107 730 HG3 LYS 101 HG3 LYS 101 -1.906 29.581 3.510 731 HD2 LYS 101 HD2 LYS 101 -3.518 30.887 4.300 732 HD3 LYS 101 HD3 LYS 101 -2.303 31.971 4.424 733 HE2 LYS 101 HE2 LYS 101 -2.924 32.994 2.428 734 HE3 LYS 101 HE3 LYS 101 -3.998 31.809 2.100 735 HZ1 LYS 101 HZ1 LYS 101 -5.130 33.731 2.932 736 HZ2 LYS 101 HZ2 LYS 101 -4.250 33.672 4.288 737 HZ3 LYS 101 HZ3 LYS 101 -5.314 32.498 3.963 738 H LYS 102 H LYS 102 2.039 30.964 0.316 739 HA LYS 102 HA LYS 102 4.225 31.774 1.894 740 HB2 LYS 102 HB2 LYS 102 3.518 32.407 -0.818 741 HB3 LYS 102 HB3 LYS 102 4.804 33.128 -0.115 742 HG2 LYS 102 HG2 LYS 102 5.854 31.041 0.122 743 HG3 LYS 102 HG3 LYS 102 4.562 30.308 -0.557 744 HD2 LYS 102 HD2 LYS 102 6.160 30.512 -2.248 745 HD3 LYS 102 HD3 LYS 102 4.996 31.607 -2.582 746 HE2 LYS 102 HE2 LYS 102 6.348 33.342 -1.684 747 HE3 LYS 102 HE3 LYS 102 7.504 32.255 -1.297 748 HZ1 LYS 102 HZ1 LYS 102 8.080 33.377 -3.311 749 HZ2 LYS 102 HZ2 LYS 102 6.700 32.882 -3.995 750 HZ3 LYS 102 HZ3 LYS 102 7.845 31.806 -3.611 751 H GLY 103 H GLY 103 4.543 33.852 2.929 752 HA2 GLY 103 HA2 GLY 103 4.155 36.100 3.063 753 HA3 GLY 103 HA3 GLY 103 2.962 35.995 1.953 754 H TRP 104 H TRP 104 2.717 33.963 4.690 755 HA TRP 104 HA TRP 104 0.286 34.952 5.384 756 HB2 TRP 104 HB2 TRP 104 0.541 33.711 7.466 757 HB3 TRP 104 HB3 TRP 104 0.928 32.822 6.152 758 HD1 TRP 104 HD1 TRP 104 2.979 34.938 8.542 759 HE1 TRP 104 HE1 TRP 104 5.137 33.830 9.152 760 HE3 TRP 104 HE3 TRP 104 2.328 30.781 5.842 761 HZ2 TRP 104 HZ2 TRP 104 6.372 31.391 8.458 762 HZ3 TRP 104 HZ3 TRP 104 4.046 29.083 5.876 763 HH2 TRP 104 HH2 TRP 104 6.050 29.399 7.177 764 H ASP 105 H ASP 105 -0.556 36.140 7.230 765 HA ASP 105 HA ASP 105 0.850 38.468 7.731 766 HB2 ASP 105 HB2 ASP 105 -1.405 37.344 9.170 767 HB3 ASP 105 HB3 ASP 105 -0.886 38.875 9.408 768 HA PRO 106 HA PRO 106 3.115 36.663 11.084 769 HB2 PRO 106 HB2 PRO 106 4.912 38.554 11.622 770 HB3 PRO 106 HB3 PRO 106 5.082 37.704 10.237 771 HG2 PRO 106 HG2 PRO 106 3.874 40.256 10.582 772 HG3 PRO 106 HG3 PRO 106 4.981 39.814 9.466 773 HD2 PRO 106 HD2 PRO 106 2.436 39.876 8.855 774 HD3 PRO 106 HD3 PRO 106 3.423 38.771 8.166 775 H ASP 107 H ASP 107 1.354 39.466 11.212 776 HA ASP 107 HA ASP 107 1.558 39.923 13.979 777 HB2 ASP 107 HB2 ASP 107 0.654 41.340 11.944 778 HB3 ASP 107 HB3 ASP 107 -0.757 40.868 12.617 779 H LYS 108 H LYS 108 -0.084 37.708 12.137 780 HA LYS 108 HA LYS 108 -2.131 37.226 14.145 781 HB2 LYS 108 HB2 LYS 108 -2.013 36.295 11.421 782 HB3 LYS 108 HB3 LYS 108 -3.246 35.995 12.450 783 HG2 LYS 108 HG2 LYS 108 -3.768 38.307 12.510 784 HG3 LYS 108 HG3 LYS 108 -2.522 38.620 11.502 785 HD2 LYS 108 HD2 LYS 108 -3.652 37.225 9.853 786 HD3 LYS 108 HD3 LYS 108 -4.950 37.238 10.845 787 HE2 LYS 108 HE2 LYS 108 -5.280 39.496 10.554 788 HE3 LYS 108 HE3 LYS 108 -3.778 39.713 9.949 789 HZ1 LYS 108 HZ1 LYS 108 -5.384 39.840 8.213 790 HZ2 LYS 108 HZ2 LYS 108 -5.905 38.351 8.570 791 HZ3 LYS 108 HZ3 LYS 108 -4.418 38.566 7.971 792 HA PRO 109 HA PRO 109 0.146 33.812 15.346 793 HB2 PRO 109 HB2 PRO 109 -1.612 31.906 16.016 794 HB3 PRO 109 HB3 PRO 109 -1.399 33.196 16.995 795 HG2 PRO 109 HG2 PRO 109 -3.433 32.839 15.004 796 HG3 PRO 109 HG3 PRO 109 -3.630 33.334 16.548 797 HD2 PRO 109 HD2 PRO 109 -3.549 35.101 14.684 798 HD3 PRO 109 HD3 PRO 109 -2.802 35.422 16.101 799 H LEU 110 H LEU 110 1.441 32.585 14.324 800 HA LEU 110 HA LEU 110 1.029 31.996 11.702 801 HB2 LEU 110 HB2 LEU 110 3.166 32.041 12.868 802 HB3 LEU 110 HB3 LEU 110 2.816 30.565 13.473 803 HG LEU 110 HG LEU 110 2.979 30.788 10.654 804 HD11 LEU 110 HD11 LEU 110 5.405 30.566 10.741 805 HD12 LEU 110 HD12 LEU 110 5.353 30.713 12.350 806 HD13 LEU 110 HD13 LEU 110 4.956 31.968 11.410 807 HD21 LEU 110 HD21 LEU 110 3.892 28.573 10.779 808 HD22 LEU 110 HD22 LEU 110 2.473 28.633 11.551 809 HD23 LEU 110 HD23 LEU 110 3.852 28.642 12.394 810 H LYS 111 H LYS 111 0.346 29.981 14.422 811 HA LYS 111 HA LYS 111 -0.101 27.692 13.036 812 HB2 LYS 111 HB2 LYS 111 -1.393 28.515 15.499 813 HB3 LYS 111 HB3 LYS 111 -1.453 26.978 14.952 814 HG2 LYS 111 HG2 LYS 111 1.046 27.082 15.076 815 HG3 LYS 111 HG3 LYS 111 0.791 28.353 16.069 816 HD2 LYS 111 HD2 LYS 111 -0.407 25.786 16.580 817 HD3 LYS 111 HD3 LYS 111 1.059 26.175 17.186 818 HE2 LYS 111 HE2 LYS 111 0.082 27.916 18.439 819 HE3 LYS 111 HE3 LYS 111 -1.385 27.533 17.830 820 HZ1 LYS 111 HZ1 LYS 111 -1.097 26.511 19.970 821 HZ2 LYS 111 HZ2 LYS 111 0.225 25.750 19.435 822 HZ3 LYS 111 HZ3 LYS 111 -1.227 25.371 18.832 823 H ARG 112 H ARG 112 -2.109 30.407 13.040 824 HA ARG 112 HA ARG 112 -4.209 28.893 11.829 825 HB2 ARG 112 HB2 ARG 112 -4.180 31.499 12.995 826 HB3 ARG 112 HB3 ARG 112 -5.290 31.243 11.826 827 HG2 ARG 112 HG2 ARG 112 -6.474 30.777 13.668 828 HG3 ARG 112 HG3 ARG 112 -5.966 29.288 13.231 829 HD2 ARG 112 HD2 ARG 112 -4.230 29.402 14.840 830 HD3 ARG 112 HD3 ARG 112 -4.722 30.899 15.270 831 HE ARG 112 HE ARG 112 -6.734 28.908 15.517 832 HH11 ARG 112 HH11 ARG 112 -4.193 30.630 17.249 833 HH12 ARG 112 HH12 ARG 112 -4.862 30.232 18.796 834 HH21 ARG 112 HH21 ARG 112 -7.531 28.452 17.523 835 HH22 ARG 112 HH22 ARG 112 -6.722 29.019 18.946 836 H ALA 113 H ALA 113 -2.040 31.487 11.157 837 HA ALA 113 HA ALA 113 -3.221 32.074 8.697 838 HB1 ALA 113 HB1 ALA 113 -2.092 33.803 10.040 839 HB2 ALA 113 HB2 ALA 113 -1.465 33.790 8.550 840 HB3 ALA 113 HB3 ALA 113 -0.672 33.078 9.766 841 H ASP 114 H ASP 114 -1.005 29.771 9.499 842 HA ASP 114 HA ASP 114 0.614 29.892 7.267 843 HB2 ASP 114 HB2 ASP 114 1.384 28.716 9.195 844 HB3 ASP 114 HB3 ASP 114 0.059 27.761 9.192 845 H PHE 115 H PHE 115 -2.299 28.072 7.741 846 HA PHE 115 HA PHE 115 -2.035 27.243 5.044 847 HB2 PHE 115 HB2 PHE 115 -2.705 24.977 5.565 848 HB3 PHE 115 HB3 PHE 115 -1.463 25.372 6.550 849 HD1 PHE 115 HD1 PHE 115 -1.877 25.851 8.952 850 HD2 PHE 115 HD2 PHE 115 -4.877 24.471 6.428 851 HE1 PHE 115 HE1 PHE 115 -3.233 25.302 10.876 852 HE2 PHE 115 HE2 PHE 115 -6.238 23.904 8.339 853 HZ PHE 115 HZ PHE 115 -5.415 24.312 10.572 854 H GLU 116 H GLU 116 -3.843 26.371 3.845 855 HA GLU 116 HA GLU 116 -6.380 27.284 4.885 856 HB2 GLU 116 HB2 GLU 116 -5.531 27.405 2.121 857 HB3 GLU 116 HB3 GLU 116 -7.069 27.700 2.587 858 HG2 GLU 116 HG2 GLU 116 -4.885 29.295 3.493 859 HG3 GLU 116 HG3 GLU 116 -5.712 29.651 2.130 860 H LEU 117 H LEU 117 -8.201 25.816 4.469 861 HA LEU 117 HA LEU 117 -7.466 23.176 3.669 862 HB2 LEU 117 HB2 LEU 117 -9.062 23.377 5.386 863 HB3 LEU 117 HB3 LEU 117 -10.043 24.243 4.408 864 HG LEU 117 HG LEU 117 -10.263 22.201 3.059 865 HD11 LEU 117 HD11 LEU 117 -9.858 20.108 4.129 866 HD12 LEU 117 HD12 LEU 117 -9.174 20.874 5.378 867 HD13 LEU 117 HD13 LEU 117 -8.472 20.913 3.922 868 HD21 LEU 117 HD21 LEU 117 -11.991 21.318 4.517 869 HD22 LEU 117 HD22 LEU 117 -12.051 22.934 4.503 870 HD23 LEU 117 HD23 LEU 117 -11.373 22.161 5.751 871 H ILE 118 H ILE 118 -7.236 22.730 1.467 872 HA ILE 118 HA ILE 118 -8.768 24.365 -0.304 873 HB ILE 118 HB ILE 118 -6.352 23.978 -0.756 874 HG12 ILE 118 HG12 ILE 118 -7.967 23.262 -3.020 875 HG13 ILE 118 HG13 ILE 118 -7.935 24.788 -2.438 876 HG21 ILE 118 HG21 ILE 118 -5.690 21.944 -1.802 877 HG22 ILE 118 HG22 ILE 118 -7.172 21.336 -1.582 878 HG23 ILE 118 HG23 ILE 118 -6.230 21.651 -0.306 879 HD11 ILE 118 HD11 ILE 118 -6.461 24.599 -4.317 880 HD12 ILE 118 HD12 ILE 118 -5.632 23.431 -3.567 881 HD13 ILE 118 HD13 ILE 118 -5.601 24.942 -2.992 882 H GLY 119 H GLY 119 -9.041 21.363 1.098 883 HA2 GLY 119 HA2 GLY 119 -11.543 20.962 0.171 884 HA3 GLY 119 HA3 GLY 119 -10.601 20.174 -0.905 885 H ALA 120 H ALA 120 -12.602 18.964 0.591 886 HA ALA 120 HA ALA 120 -11.040 16.990 1.957 887 HB1 ALA 120 HB1 ALA 120 -11.746 18.423 3.763 888 HB2 ALA 120 HB2 ALA 120 -12.532 17.016 3.890 889 HB3 ALA 120 HB3 ALA 120 -13.284 18.310 3.278 890 H VAL 121 H VAL 121 -11.977 14.880 1.858 891 HA VAL 121 HA VAL 121 -14.567 14.708 0.683 892 HB VAL 121 HB VAL 121 -13.507 14.600 -1.340 893 HG11 VAL 121 HG11 VAL 121 -11.392 13.549 -1.747 894 HG12 VAL 121 HG12 VAL 121 -11.316 13.093 -0.198 895 HG13 VAL 121 HG13 VAL 121 -11.254 14.662 -0.582 896 HG21 VAL 121 HG21 VAL 121 -13.566 12.357 -2.142 897 HG22 VAL 121 HG22 VAL 121 -14.868 12.673 -1.237 898 HG23 VAL 121 HG23 VAL 121 -13.646 11.811 -0.621 899 HA PRO 122 HA PRO 122 -14.257 11.495 3.648 900 HB2 PRO 122 HB2 PRO 122 -16.700 11.504 4.652 901 HB3 PRO 122 HB3 PRO 122 -15.803 12.843 4.915 902 HG2 PRO 122 HG2 PRO 122 -17.751 12.421 2.869 903 HG3 PRO 122 HG3 PRO 122 -17.618 13.706 3.868 904 HD2 PRO 122 HD2 PRO 122 -16.599 13.741 1.420 905 HD3 PRO 122 HD3 PRO 122 -15.961 14.643 2.622 906 H HIS 123 H HIS 123 -15.384 9.445 4.301 907 HA HIS 123 HA HIS 123 -16.428 8.097 1.935 908 HB2 HIS 123 HB2 HIS 123 -14.584 7.036 3.002 909 HB3 HIS 123 HB3 HIS 123 -15.397 7.028 4.418 910 HD1 HIS 123 HD1 HIS 123 -17.831 5.591 4.265 911 HD2 HIS 123 HD2 HIS 123 -14.691 4.616 1.815 912 HE1 HIS 123 HE1 HIS 123 -18.179 3.277 3.418 913 HE2 HIS 123 HE2 HIS 123 -16.287 2.659 1.956 914 H ASP 124 H ASP 124 -18.557 8.954 1.959 915 HA ASP 124 HA ASP 124 -20.220 7.989 4.036 916 HB2 ASP 124 HB2 ASP 124 -19.333 10.095 4.936 917 HB3 ASP 124 HB3 ASP 124 -20.086 10.872 3.713 918 H GLY 125 H GLY 125 -20.889 6.889 2.013 919 HA2 GLY 125 HA2 GLY 125 -22.344 6.719 0.302 920 HA3 GLY 125 HA3 GLY 125 -23.179 7.973 0.934 921 H SER 126 H SER 126 -20.019 8.703 0.143 922 HA SER 126 HA SER 126 -20.791 10.706 -1.580 923 HB2 SER 126 HB2 SER 126 -18.101 10.182 -1.911 924 HB3 SER 126 HB3 SER 126 -18.752 11.385 -1.020 925 HG SER 126 HG SER 126 -18.234 10.395 0.705 926 HA PRO 127 HA PRO 127 -21.098 8.734 -5.403 927 HB2 PRO 127 HB2 PRO 127 -20.762 10.765 -7.128 928 HB3 PRO 127 HB3 PRO 127 -22.089 10.768 -6.176 929 HG2 PRO 127 HG2 PRO 127 -19.619 12.086 -5.715 930 HG3 PRO 127 HG3 PRO 127 -21.119 12.731 -5.683 931 HD2 PRO 127 HD2 PRO 127 -20.035 12.024 -3.459 932 HD3 PRO 127 HD3 PRO 127 -21.626 11.727 -3.681 933 H ALA 128 H ALA 128 -20.074 8.716 -7.754 934 HA ALA 128 HA ALA 128 -17.756 7.359 -7.463 935 HB1 ALA 128 HB1 ALA 128 -19.114 7.281 -9.487 936 HB2 ALA 128 HB2 ALA 128 -17.563 7.504 -9.887 937 HB3 ALA 128 HB3 ALA 128 -18.588 8.755 -9.894 938 H SER 129 H SER 129 -18.064 10.737 -7.710 939 HA SER 129 HA SER 129 -15.512 11.448 -8.281 940 HB2 SER 129 HB2 SER 129 -17.070 12.957 -6.347 941 HB3 SER 129 HB3 SER 129 -16.178 13.573 -7.568 942 HG SER 129 HG SER 129 -17.674 12.889 -9.037 943 H ARG 130 H ARG 130 -16.383 9.745 -5.597 944 HA ARG 130 HA ARG 130 -14.392 10.657 -3.837 945 HB2 ARG 130 HB2 ARG 130 -16.510 9.354 -3.347 946 HB3 ARG 130 HB3 ARG 130 -15.588 8.040 -3.649 947 HG2 ARG 130 HG2 ARG 130 -14.130 8.819 -1.834 948 HG3 ARG 130 HG3 ARG 130 -15.326 9.861 -1.447 949 HD2 ARG 130 HD2 ARG 130 -15.573 7.960 -0.098 950 HD3 ARG 130 HD3 ARG 130 -16.806 7.967 -1.168 951 HE ARG 130 HE ARG 130 -16.038 6.072 -2.166 952 HH11 ARG 130 HH11 ARG 130 -14.742 4.287 -2.300 953 HH12 ARG 130 HH12 ARG 130 -13.277 4.187 -1.381 954 HH21 ARG 130 HH21 ARG 130 -13.625 7.279 0.102 955 HH22 ARG 130 HH22 ARG 130 -12.652 5.853 -0.043 956 H ASN 131 H ASN 131 -13.949 9.211 -6.668 957 HA ASN 131 HA ASN 131 -12.196 7.180 -6.184 958 HB2 ASN 131 HB2 ASN 131 -12.206 9.043 -8.403 959 HB3 ASN 131 HB3 ASN 131 -11.180 7.772 -8.374 960 HD21 ASN 131 HD21 ASN 131 -14.059 5.454 -8.519 961 HD22 ASN 131 HD22 ASN 131 -12.921 5.838 -7.272 962 H LEU 132 H LEU 132 -9.851 7.065 -6.084 963 HA LEU 132 HA LEU 132 -8.752 9.076 -4.554 964 HB2 LEU 132 HB2 LEU 132 -7.943 6.564 -5.417 965 HB3 LEU 132 HB3 LEU 132 -6.672 7.588 -5.463 966 HG LEU 132 HG LEU 132 -6.638 6.377 -3.481 967 HD11 LEU 132 HD11 LEU 132 -6.498 8.175 -1.869 968 HD12 LEU 132 HD12 LEU 132 -7.268 9.151 -2.903 969 HD13 LEU 132 HD13 LEU 132 -5.791 8.599 -3.259 970 HD21 LEU 132 HD21 LEU 132 -8.380 6.565 -1.814 971 HD22 LEU 132 HD22 LEU 132 -8.955 5.894 -3.168 972 HD23 LEU 132 HD23 LEU 132 -9.259 7.449 -2.844 973 H SER 133 H SER 133 -9.141 9.091 -7.778 974 HA SER 133 HA SER 133 -6.883 10.799 -8.275 975 HB2 SER 133 HB2 SER 133 -7.413 9.188 -9.984 976 HB3 SER 133 HB3 SER 133 -8.857 9.919 -10.202 977 HG SER 133 HG SER 133 -7.169 10.513 -11.671 978 H HIS 134 H HIS 134 -7.113 12.995 -8.045 979 HA HIS 134 HA HIS 134 -9.777 14.051 -8.206 980 HB2 HIS 134 HB2 HIS 134 -8.123 14.057 -5.930 981 HB3 HIS 134 HB3 HIS 134 -8.680 15.552 -6.281 982 HD1 HIS 134 HD1 HIS 134 -10.257 15.816 -4.245 983 HD2 HIS 134 HD2 HIS 134 -10.967 12.532 -6.592 984 HE1 HIS 134 HE1 HIS 134 -12.438 14.812 -3.574 985 HE2 HIS 134 HE2 HIS 134 -12.873 12.827 -4.971 986 H HIS 135 H HIS 135 -10.061 16.230 -8.785 987 HA HIS 135 HA HIS 135 -7.759 17.269 -10.179 988 HB2 HIS 135 HB2 HIS 135 -10.520 18.026 -10.578 989 HB3 HIS 135 HB3 HIS 135 -9.270 18.497 -11.518 990 HD1 HIS 135 HD1 HIS 135 -8.097 16.595 -13.053 991 HD2 HIS 135 HD2 HIS 135 -11.732 15.714 -11.377 992 HE1 HIS 135 HE1 HIS 135 -9.050 14.617 -14.224 993 HE2 HIS 135 HE2 HIS 135 -11.238 14.063 -13.228 994 H ILE 136 H ILE 136 -6.892 19.254 -9.644 995 HA ILE 136 HA ILE 136 -8.334 20.807 -7.681 996 HB ILE 136 HB ILE 136 -5.432 20.524 -7.752 997 HG12 ILE 136 HG12 ILE 136 -6.458 18.612 -6.816 998 HG13 ILE 136 HG13 ILE 136 -5.508 19.392 -5.740 999 HG21 ILE 136 HG21 ILE 136 -5.372 21.943 -5.796 1000 HG22 ILE 136 HG22 ILE 136 -6.974 22.144 -5.890 1001 HG23 ILE 136 HG23 ILE 136 -6.014 22.745 -7.044 1002 HD11 ILE 136 HD11 ILE 136 -7.527 18.644 -4.656 1003 HD12 ILE 136 HD12 ILE 136 -8.422 19.488 -5.705 1004 HD13 ILE 136 HD13 ILE 136 -7.482 20.260 -4.639 1005 H TYR 137 H TYR 137 -8.891 22.797 -8.590 1006 HA TYR 137 HA TYR 137 -7.622 23.613 -10.982 1007 HB2 TYR 137 HB2 TYR 137 -9.867 24.182 -10.809 1008 HB3 TYR 137 HB3 TYR 137 -9.635 24.889 -9.355 1009 HD1 TYR 137 HD1 TYR 137 -9.056 27.213 -9.182 1010 HD2 TYR 137 HD2 TYR 137 -8.964 25.329 -12.894 1011 HE1 TYR 137 HE1 TYR 137 -8.716 29.344 -10.256 1012 HE2 TYR 137 HE2 TYR 137 -8.621 27.473 -13.966 1013 HH TYR 137 HH TYR 137 -8.362 29.684 -13.733 1014 H ILE 138 H ILE 138 -5.879 25.037 -11.189 1015 HA ILE 138 HA ILE 138 -5.236 26.532 -8.824 1016 HB ILE 138 HB ILE 138 -3.245 25.428 -10.656 1017 HG12 ILE 138 HG12 ILE 138 -4.143 23.797 -9.147 1018 HG13 ILE 138 HG13 ILE 138 -2.533 24.004 -8.970 1019 HG21 ILE 138 HG21 ILE 138 -1.557 26.371 -9.208 1020 HG22 ILE 138 HG22 ILE 138 -2.711 27.055 -8.305 1021 HG23 ILE 138 HG23 ILE 138 -2.477 27.548 -9.826 1022 HD11 ILE 138 HD11 ILE 138 -3.571 23.790 -6.824 1023 HD12 ILE 138 HD12 ILE 138 -4.520 25.061 -7.138 1024 HD13 ILE 138 HD13 ILE 138 -2.925 25.266 -6.962 1025 HA PRO 139 HA PRO 139 -5.601 29.658 -11.963 1026 HB2 PRO 139 HB2 PRO 139 -5.425 31.871 -10.525 1027 HB3 PRO 139 HB3 PRO 139 -6.816 31.017 -10.468 1028 HG2 PRO 139 HG2 PRO 139 -4.648 30.950 -8.610 1029 HG3 PRO 139 HG3 PRO 139 -6.242 31.077 -8.280 1030 HD2 PRO 139 HD2 PRO 139 -5.051 28.759 -8.127 1031 HD3 PRO 139 HD3 PRO 139 -6.607 28.851 -8.615 1032 H GLU 140 H GLU 140 -4.217 31.013 -13.135 1033 HA GLU 140 HA GLU 140 -1.450 30.692 -12.320 1034 HB2 GLU 140 HB2 GLU 140 -2.236 29.857 -14.502 1035 HB3 GLU 140 HB3 GLU 140 -2.270 31.424 -14.959 1036 HG2 GLU 140 HG2 GLU 140 0.034 31.612 -14.671 1037 HG3 GLU 140 HG3 GLU 140 0.113 30.110 -14.033 1038 H ASP 141 H ASP 141 -2.491 32.472 -10.762 1039 HA ASP 141 HA ASP 141 -2.589 34.973 -12.039 1040 HB2 ASP 141 HB2 ASP 141 -3.381 35.856 -9.978 1041 HB3 ASP 141 HB3 ASP 141 -4.138 34.432 -10.239 1042 H ARG 142 H ARG 142 -0.428 33.358 -9.915 1043 HA ARG 142 HA ARG 142 1.582 35.306 -10.370 1044 HB2 ARG 142 HB2 ARG 142 0.355 34.951 -7.809 1045 HB3 ARG 142 HB3 ARG 142 1.976 35.154 -7.791 1046 HG2 ARG 142 HG2 ARG 142 1.805 37.294 -8.629 1047 HG3 ARG 142 HG3 ARG 142 0.232 37.084 -9.016 1048 HD2 ARG 142 HD2 ARG 142 1.168 37.113 -6.295 1049 HD3 ARG 142 HD3 ARG 142 0.554 38.432 -7.035 1050 HE ARG 142 HE ARG 142 -1.243 36.316 -7.256 1051 HH11 ARG 142 HH11 ARG 142 -3.079 36.240 -6.096 1052 HH12 ARG 142 HH12 ARG 142 -3.285 37.222 -4.684 1053 HH21 ARG 142 HH21 ARG 142 -0.179 38.707 -4.903 1054 HH22 ARG 142 HH22 ARG 142 -1.661 38.605 -4.013 1055 H LEU 143 H LEU 143 3.728 34.697 -9.677 1056 HA LEU 143 HA LEU 143 4.051 31.869 -9.793 1057 HB2 LEU 143 HB2 LEU 143 6.235 32.244 -10.392 1058 HB3 LEU 143 HB3 LEU 143 5.357 33.372 -11.182 1059 HG LEU 143 HG LEU 143 6.947 33.982 -8.878 1060 HD11 LEU 143 HD11 LEU 143 8.572 34.835 -10.488 1061 HD12 LEU 143 HD12 LEU 143 7.634 34.315 -11.698 1062 HD13 LEU 143 HD13 LEU 143 8.353 33.250 -10.716 1063 HD21 LEU 143 HD21 LEU 143 6.747 36.271 -9.527 1064 HD22 LEU 143 HD22 LEU 143 5.287 35.645 -9.225 1065 HD23 LEU 143 HD23 LEU 143 5.780 35.848 -10.752 1066 H GLY 144 H GLY 144 5.053 30.543 -8.253 1067 HA2 GLY 144 HA2 GLY 144 6.518 31.134 -6.165 1068 HA3 GLY 144 HA3 GLY 144 5.050 31.594 -5.618 1069 H TYR 145 H TYR 145 6.776 29.575 -4.527 1070 HA TYR 145 HA TYR 145 5.599 27.129 -5.231 1071 HB2 TYR 145 HB2 TYR 145 7.021 26.223 -3.430 1072 HB3 TYR 145 HB3 TYR 145 7.846 27.010 -4.599 1073 HD1 TYR 145 HD1 TYR 145 9.098 29.027 -4.122 1074 HD2 TYR 145 HD2 TYR 145 6.756 27.249 -1.168 1075 HE1 TYR 145 HE1 TYR 145 10.124 30.440 -2.448 1076 HE2 TYR 145 HE2 TYR 145 7.761 28.688 0.492 1077 HH TYR 145 HH TYR 145 9.731 31.362 -0.264 1078 H HIS 146 H HIS 146 4.346 25.712 -4.090 1079 HA HIS 146 HA HIS 146 3.034 26.774 -1.749 1080 HB2 HIS 146 HB2 HIS 146 1.671 25.613 -4.020 1081 HB3 HIS 146 HB3 HIS 146 0.932 25.914 -2.595 1082 HD1 HIS 146 HD1 HIS 146 2.482 27.741 -5.479 1083 HD2 HIS 146 HD2 HIS 146 -0.048 28.465 -2.333 1084 HE1 HIS 146 HE1 HIS 146 1.508 30.011 -5.755 1085 HE2 HIS 146 HE2 HIS 146 -0.027 30.469 -3.873 1086 H VAL 147 H VAL 147 3.089 25.219 -0.103 1087 HA VAL 147 HA VAL 147 3.898 22.586 -0.907 1088 HB VAL 147 HB VAL 147 3.673 23.552 1.819 1089 HG11 VAL 147 HG11 VAL 147 4.971 21.604 2.420 1090 HG12 VAL 147 HG12 VAL 147 4.971 21.123 0.876 1091 HG13 VAL 147 HG13 VAL 147 3.589 21.146 1.715 1092 HG21 VAL 147 HG21 VAL 147 6.073 23.785 1.796 1093 HG22 VAL 147 HG22 VAL 147 5.415 24.755 0.682 1094 HG23 VAL 147 HG23 VAL 147 6.103 23.361 0.236 1095 H ILE 148 H ILE 148 2.401 20.973 -1.145 1096 HA ILE 148 HA ILE 148 -0.243 21.514 -0.204 1097 HB ILE 148 HB ILE 148 0.582 19.367 -1.984 1098 HG12 ILE 148 HG12 ILE 148 -0.843 21.774 -2.678 1099 HG13 ILE 148 HG13 ILE 148 0.754 21.566 -2.947 1100 HG21 ILE 148 HG21 ILE 148 -1.790 18.981 -2.337 1101 HG22 ILE 148 HG22 ILE 148 -2.145 20.130 -1.256 1102 HG23 ILE 148 HG23 ILE 148 -1.435 18.760 -0.775 1103 HD11 ILE 148 HD11 ILE 148 -0.470 21.204 -4.976 1104 HD12 ILE 148 HD12 ILE 148 -1.329 20.033 -4.266 1105 HD13 ILE 148 HD13 ILE 148 0.252 19.827 -4.532 1106 H LEU 149 H LEU 149 -0.847 20.730 1.742 1107 HA LEU 149 HA LEU 149 0.649 18.529 2.864 1108 HB2 LEU 149 HB2 LEU 149 -1.116 20.342 4.230 1109 HB3 LEU 149 HB3 LEU 149 -0.145 19.244 4.949 1110 HG LEU 149 HG LEU 149 0.860 21.554 3.560 1111 HD11 LEU 149 HD11 LEU 149 1.234 22.494 5.771 1112 HD12 LEU 149 HD12 LEU 149 0.530 21.199 6.437 1113 HD13 LEU 149 HD13 LEU 149 -0.346 22.228 5.550 1114 HD21 LEU 149 HD21 LEU 149 2.941 21.087 4.599 1115 HD22 LEU 149 HD22 LEU 149 2.488 19.851 3.660 1116 HD23 LEU 149 HD23 LEU 149 2.317 19.753 5.265 1117 H ALA 150 H ALA 150 -0.330 16.560 2.405 1118 HA ALA 150 HA ALA 150 -3.216 16.587 2.315 1119 HB1 ALA 150 HB1 ALA 150 -2.240 16.078 0.198 1120 HB2 ALA 150 HB2 ALA 150 -3.068 14.797 0.735 1121 HB3 ALA 150 HB3 ALA 150 -1.455 14.824 0.851 1122 H VAL 151 H VAL 151 -4.452 14.933 3.235 1123 HA VAL 151 HA VAL 151 -2.985 13.285 5.081 1124 HB VAL 151 HB VAL 151 -5.510 14.629 5.705 1125 HG11 VAL 151 HG11 VAL 151 -5.276 13.795 7.951 1126 HG12 VAL 151 HG12 VAL 151 -3.938 12.997 7.519 1127 HG13 VAL 151 HG13 VAL 151 -5.371 12.563 6.907 1128 HG21 VAL 151 HG21 VAL 151 -4.265 16.015 7.241 1129 HG22 VAL 151 HG22 VAL 151 -3.712 16.223 5.736 1130 HG23 VAL 151 HG23 VAL 151 -2.891 15.298 6.778 1131 H TRP 152 H TRP 152 -3.537 11.136 5.163 1132 HA TRP 152 HA TRP 152 -5.999 10.370 3.828 1133 HB2 TRP 152 HB2 TRP 152 -3.820 9.777 2.743 1134 HB3 TRP 152 HB3 TRP 152 -3.738 8.618 3.890 1135 HD1 TRP 152 HD1 TRP 152 -6.298 9.599 1.309 1136 HE1 TRP 152 HE1 TRP 152 -7.333 7.611 0.198 1137 HE3 TRP 152 HE3 TRP 152 -3.873 6.099 3.928 1138 HZ2 TRP 152 HZ2 TRP 152 -7.008 4.829 0.438 1139 HZ3 TRP 152 HZ3 TRP 152 -4.289 3.763 3.415 1140 HH2 TRP 152 HH2 TRP 152 -5.845 3.154 1.672 1141 H ASP 153 H ASP 153 -7.452 9.935 5.426 1142 HA ASP 153 HA ASP 153 -6.489 8.814 7.849 1143 HB2 ASP 153 HB2 ASP 153 -9.195 9.570 7.177 1144 HB3 ASP 153 HB3 ASP 153 -8.737 9.071 8.663 1145 H VAL 154 H VAL 154 -5.765 6.777 7.217 1146 HA VAL 154 HA VAL 154 -7.398 4.929 5.898 1147 HB VAL 154 HB VAL 154 -5.001 4.706 5.864 1148 HG11 VAL 154 HG11 VAL 154 -3.773 3.998 7.782 1149 HG12 VAL 154 HG12 VAL 154 -5.111 4.097 8.683 1150 HG13 VAL 154 HG13 VAL 154 -4.460 5.436 8.053 1151 HG21 VAL 154 HG21 VAL 154 -4.806 2.351 6.217 1152 HG22 VAL 154 HG22 VAL 154 -6.181 2.690 5.437 1153 HG23 VAL 154 HG23 VAL 154 -6.211 2.349 7.017 1154 H ALA 155 H ALA 155 -8.811 3.343 6.659 1155 HA ALA 155 HA ALA 155 -9.632 3.812 9.359 1156 HB1 ALA 155 HB1 ALA 155 -11.352 3.860 7.659 1157 HB2 ALA 155 HB2 ALA 155 -11.683 2.684 8.719 1158 HB3 ALA 155 HB3 ALA 155 -11.033 2.320 7.285 1159 H ASP 156 H ASP 156 -7.792 1.634 7.708 1160 HA ASP 156 HA ASP 156 -8.528 -0.649 9.127 1161 HB2 ASP 156 HB2 ASP 156 -6.232 -0.157 7.395 1162 HB3 ASP 156 HB3 ASP 156 -6.511 -1.640 8.020 1163 H THR 157 H THR 157 -6.618 1.882 10.032 1164 HA THR 157 HA THR 157 -5.418 0.287 12.032 1165 HB THR 157 HB THR 157 -3.188 1.369 11.751 1166 HG1 THR 157 HG1 THR 157 -3.741 2.508 9.410 1167 HG21 THR 157 HG21 THR 157 -2.528 0.446 9.653 1168 HG22 THR 157 HG22 THR 157 -4.075 0.293 9.209 1169 HG23 THR 157 HG23 THR 157 -3.484 -0.617 10.407 1170 H GLU 158 H GLU 158 -4.187 1.608 13.760 1171 HA GLU 158 HA GLU 158 -5.816 3.776 14.607 1172 HB2 GLU 158 HB2 GLU 158 -4.675 1.942 15.955 1173 HB3 GLU 158 HB3 GLU 158 -3.430 2.999 15.972 1174 HG2 GLU 158 HG2 GLU 158 -4.960 4.596 17.011 1175 HG3 GLU 158 HG3 GLU 158 -5.996 3.349 17.208 1176 H ASN 159 H ASN 159 -3.817 3.810 12.302 1177 HA ASN 159 HA ASN 159 -2.249 6.085 13.115 1178 HB2 ASN 159 HB2 ASN 159 -1.770 4.168 10.993 1179 HB3 ASN 159 HB3 ASN 159 -0.875 5.526 11.135 1180 HD21 ASN 159 HD21 ASN 159 1.447 3.994 13.106 1181 HD22 ASN 159 HD22 ASN 159 1.092 5.108 11.829 1182 H ALA 160 H ALA 160 -1.908 7.809 11.456 1183 HA ALA 160 HA ALA 160 -3.907 7.913 9.333 1184 HB1 ALA 160 HB1 ALA 160 -4.925 9.231 10.978 1185 HB2 ALA 160 HB2 ALA 160 -4.332 10.224 9.849 1186 HB3 ALA 160 HB3 ALA 160 -3.549 10.035 11.252 1187 H PHE 161 H PHE 161 -2.813 8.820 7.456 1188 HA PHE 161 HA PHE 161 -0.026 9.343 7.989 1189 HB2 PHE 161 HB2 PHE 161 -1.096 7.949 5.694 1190 HB3 PHE 161 HB3 PHE 161 0.488 8.301 5.878 1191 HD1 PHE 161 HD1 PHE 161 -1.849 5.810 6.326 1192 HD2 PHE 161 HD2 PHE 161 1.583 7.377 8.086 1193 HE1 PHE 161 HE1 PHE 161 -1.517 3.742 7.520 1194 HE2 PHE 161 HE2 PHE 161 1.923 5.317 9.284 1195 HZ PHE 161 HZ PHE 161 0.373 3.492 9.003 1196 H TYR 162 H TYR 162 1.172 10.723 6.681 1197 HA TYR 162 HA TYR 162 -0.506 12.706 5.437 1198 HB2 TYR 162 HB2 TYR 162 1.934 13.308 6.864 1199 HB3 TYR 162 HB3 TYR 162 0.869 14.406 6.291 1200 HD1 TYR 162 HD1 TYR 162 1.974 13.525 9.226 1201 HD2 TYR 162 HD2 TYR 162 -1.695 13.505 7.273 1202 HE1 TYR 162 HE1 TYR 162 0.827 13.505 11.362 1203 HE2 TYR 162 HE2 TYR 162 -2.834 13.463 9.413 1204 HH TYR 162 HH TYR 162 -2.680 13.465 11.633 1205 H GLN 163 H GLN 163 0.123 13.535 3.463 1206 HA GLN 163 HA GLN 163 2.638 12.545 2.395 1207 HB2 GLN 163 HB2 GLN 163 0.196 12.755 0.898 1208 HB3 GLN 163 HB3 GLN 163 1.642 12.337 0.266 1209 HG2 GLN 163 HG2 GLN 163 0.584 10.330 0.498 1210 HG3 GLN 163 HG3 GLN 163 1.548 10.387 1.814 1211 HE21 GLN 163 HE21 GLN 163 -2.398 11.075 2.444 1212 HE22 GLN 163 HE22 GLN 163 -1.586 11.748 1.070 1213 H VAL 164 H VAL 164 3.941 14.258 1.742 1214 HA VAL 164 HA VAL 164 2.591 16.782 1.383 1215 HB VAL 164 HB VAL 164 4.495 17.881 2.485 1216 HG11 VAL 164 HG11 VAL 164 3.792 17.332 4.745 1217 HG12 VAL 164 HG12 VAL 164 3.043 16.010 4.192 1218 HG13 VAL 164 HG13 VAL 164 2.493 17.477 3.793 1219 HG21 VAL 164 HG21 VAL 164 5.976 16.552 3.829 1220 HG22 VAL 164 HG22 VAL 164 6.130 16.147 2.272 1221 HG23 VAL 164 HG23 VAL 164 5.279 15.204 3.272 1222 H ILE 165 H ILE 165 3.029 17.972 -0.369 1223 HA ILE 165 HA ILE 165 5.319 17.202 -1.896 1224 HB ILE 165 HB ILE 165 2.674 17.417 -3.155 1225 HG12 ILE 165 HG12 ILE 165 4.249 15.024 -2.913 1226 HG13 ILE 165 HG13 ILE 165 2.964 15.363 -1.964 1227 HG21 ILE 165 HG21 ILE 165 3.783 16.829 -5.240 1228 HG22 ILE 165 HG22 ILE 165 5.211 16.813 -4.482 1229 HG23 ILE 165 HG23 ILE 165 4.409 18.205 -4.666 1230 HD11 ILE 165 HD11 ILE 165 2.324 13.812 -3.682 1231 HD12 ILE 165 HD12 ILE 165 2.787 14.861 -4.822 1232 HD13 ILE 165 HD13 ILE 165 1.515 15.197 -3.883 1233 H ASP 166 H ASP 166 6.492 19.031 -2.434 1234 HA ASP 166 HA ASP 166 5.131 21.565 -2.322 1235 HB2 ASP 166 HB2 ASP 166 7.315 21.185 -1.287 1236 HB3 ASP 166 HB3 ASP 166 7.933 21.151 -2.798 1237 H VAL 167 H VAL 167 4.654 22.835 -4.100 1238 HA VAL 167 HA VAL 167 5.760 21.942 -6.578 1239 HB VAL 167 HB VAL 167 3.488 22.562 -7.593 1240 HG11 VAL 167 HG11 VAL 167 2.816 20.244 -7.505 1241 HG12 VAL 167 HG12 VAL 167 3.877 19.980 -6.314 1242 HG13 VAL 167 HG13 VAL 167 4.402 20.349 -7.798 1243 HG21 VAL 167 HG21 VAL 167 1.630 22.012 -6.171 1244 HG22 VAL 167 HG22 VAL 167 2.437 23.277 -5.568 1245 HG23 VAL 167 HG23 VAL 167 2.639 21.807 -4.925 1246 H ASP 168 H ASP 168 6.721 23.519 -7.723 1247 HA ASP 168 HA ASP 168 6.296 26.204 -6.814 1248 HB2 ASP 168 HB2 ASP 168 8.533 25.038 -7.399 1249 HB3 ASP 168 HB3 ASP 168 8.227 25.771 -8.826 1250 H LEU 169 H LEU 169 4.387 26.891 -7.618 1251 HA LEU 169 HA LEU 169 3.725 26.404 -10.322 1252 HB2 LEU 169 HB2 LEU 169 2.463 27.747 -8.130 1253 HB3 LEU 169 HB3 LEU 169 1.881 28.008 -9.634 1254 HG LEU 169 HG LEU 169 0.652 26.463 -8.316 1255 HD11 LEU 169 HD11 LEU 169 0.301 24.898 -10.162 1256 HD12 LEU 169 HD12 LEU 169 1.676 25.416 -10.838 1257 HD13 LEU 169 HD13 LEU 169 0.410 26.414 -10.715 1258 HD21 LEU 169 HD21 LEU 169 1.351 24.222 -8.085 1259 HD22 LEU 169 HD22 LEU 169 2.275 25.232 -7.224 1260 HD23 LEU 169 HD23 LEU 169 2.820 24.632 -8.624 1261 H VAL 170 H VAL 170 4.347 27.751 -12.033 1262 HA VAL 170 HA VAL 170 4.753 30.441 -11.253 1263 HB VAL 170 HB VAL 170 6.775 30.678 -12.524 1264 HG11 VAL 170 HG11 VAL 170 8.274 29.343 -11.165 1265 HG12 VAL 170 HG12 VAL 170 7.018 28.460 -10.657 1266 HG13 VAL 170 HG13 VAL 170 7.129 30.020 -10.246 1267 HG21 VAL 170 HG21 VAL 170 7.841 28.757 -13.559 1268 HG22 VAL 170 HG22 VAL 170 6.403 29.040 -14.243 1269 HG23 VAL 170 HG23 VAL 170 6.565 27.844 -13.167 1270 H ASN 171 H ASN 171 4.748 32.102 -12.885 1271 HA ASN 171 HA ASN 171 3.007 31.475 -15.065 1272 HB2 ASN 171 HB2 ASN 171 3.965 34.009 -14.032 1273 HB3 ASN 171 HB3 ASN 171 3.071 33.933 -15.396 1274 HD21 ASN 171 HD21 ASN 171 0.138 34.261 -13.724 1275 HD22 ASN 171 HD22 ASN 171 1.089 34.575 -15.138 1276 H LYS 172 H LYS 172 3.623 32.205 -17.317 1277 HA LYS 172 HA LYS 172 6.343 31.864 -17.898 1278 HB2 LYS 172 HB2 LYS 172 5.793 32.268 -20.131 1279 HB3 LYS 172 HB3 LYS 172 4.613 31.343 -19.483 1280 HG2 LYS 172 HG2 LYS 172 3.344 32.802 -20.605 1281 HG3 LYS 172 HG3 LYS 172 3.453 33.603 -19.186 1282 HD2 LYS 172 HD2 LYS 172 5.602 34.397 -20.639 1283 HD3 LYS 172 HD3 LYS 172 4.331 34.453 -21.663 1284 HE2 LYS 172 HE2 LYS 172 3.316 36.096 -20.512 1285 HE3 LYS 172 HE3 LYS 172 4.024 35.674 -19.102 1286 HZ1 LYS 172 HZ1 LYS 172 4.936 37.714 -19.896 1287 HZ2 LYS 172 HZ2 LYS 172 5.380 36.990 -21.273 1288 HZ3 LYS 172 HZ3 LYS 172 6.082 36.573 -19.877 Start of MODEL 5 1 H1 HIS 1 H1 HIS 1 2.643 -3.308 -4.289 2 H2 HIS 1 H2 HIS 1 2.625 -1.918 -3.465 3 H3 HIS 1 H3 HIS 1 2.512 -1.902 -5.078 4 HA HIS 1 HA HIS 1 0.440 -2.953 -4.970 5 HB2 HIS 1 HB2 HIS 1 0.649 -2.738 -2.073 6 HB3 HIS 1 HB3 HIS 1 -0.661 -3.321 -2.854 7 HD1 HIS 1 HD1 HIS 1 -0.497 -5.741 -3.980 8 HD2 HIS 1 HD2 HIS 1 2.613 -4.600 -1.557 9 HE1 HIS 1 HE1 HIS 1 0.862 -7.755 -3.430 10 HE2 HIS 1 HE2 HIS 1 2.741 -7.090 -1.976 11 H GLY 2 H GLY 2 0.010 -0.970 -6.105 12 HA2 GLY 2 HA2 GLY 2 -1.273 0.973 -6.033 13 HA3 GLY 2 HA3 GLY 2 -1.112 1.062 -4.410 14 H PHE 3 H PHE 3 -0.762 3.283 -6.103 15 HA PHE 3 HA PHE 3 1.801 4.118 -5.429 16 HB2 PHE 3 HB2 PHE 3 2.624 4.438 -7.726 17 HB3 PHE 3 HB3 PHE 3 2.487 2.858 -7.334 18 HD1 PHE 3 HD1 PHE 3 1.319 5.399 -9.520 19 HD2 PHE 3 HD2 PHE 3 0.635 1.484 -8.281 20 HE1 PHE 3 HE1 PHE 3 -0.059 5.028 -11.466 21 HE2 PHE 3 HE2 PHE 3 -0.761 1.109 -10.208 22 HZ PHE 3 HZ PHE 3 -1.106 2.880 -11.812 23 H ILE 4 H ILE 4 2.277 6.373 -6.096 24 HA ILE 4 HA ILE 4 -0.082 7.901 -6.682 25 HB ILE 4 HB ILE 4 2.582 8.822 -5.971 26 HG12 ILE 4 HG12 ILE 4 0.142 9.039 -4.452 27 HG13 ILE 4 HG13 ILE 4 1.241 7.857 -4.203 28 HG21 ILE 4 HG21 ILE 4 1.715 11.067 -5.982 29 HG22 ILE 4 HG22 ILE 4 0.296 10.529 -6.539 30 HG23 ILE 4 HG23 ILE 4 1.616 10.438 -7.468 31 HD11 ILE 4 HD11 ILE 4 1.497 9.572 -2.552 32 HD12 ILE 4 HD12 ILE 4 1.742 10.672 -3.711 33 HD13 ILE 4 HD13 ILE 4 2.830 9.502 -3.465 34 H GLU 5 H GLU 5 -0.547 8.525 -8.800 35 HA GLU 5 HA GLU 5 1.441 7.928 -10.765 36 HB2 GLU 5 HB2 GLU 5 -0.832 7.182 -11.123 37 HB3 GLU 5 HB3 GLU 5 -1.322 8.739 -11.150 38 HG2 GLU 5 HG2 GLU 5 0.183 8.936 -13.135 39 HG3 GLU 5 HG3 GLU 5 0.074 7.307 -13.185 40 H LYS 6 H LYS 6 -0.539 10.578 -9.716 41 HA LYS 6 HA LYS 6 1.268 12.503 -10.843 42 HB2 LYS 6 HB2 LYS 6 -1.516 12.279 -11.619 43 HB3 LYS 6 HB3 LYS 6 -0.734 13.705 -11.780 44 HG2 LYS 6 HG2 LYS 6 0.701 12.813 -13.361 45 HG3 LYS 6 HG3 LYS 6 0.136 11.305 -13.092 46 HD2 LYS 6 HD2 LYS 6 -1.982 12.000 -13.969 47 HD3 LYS 6 HD3 LYS 6 -1.311 13.439 -14.349 48 HE2 LYS 6 HE2 LYS 6 0.046 12.509 -15.949 49 HE3 LYS 6 HE3 LYS 6 -0.131 11.006 -15.336 50 HZ1 LYS 6 HZ1 LYS 6 -1.344 11.212 -17.357 51 HZ2 LYS 6 HZ2 LYS 6 -2.191 12.442 -16.737 52 HZ3 LYS 6 HZ3 LYS 6 -2.366 10.953 -16.130 53 HA PRO 7 HA PRO 7 1.028 14.959 -11.054 54 HB2 PRO 7 HB2 PRO 7 1.830 17.171 -9.771 55 HB3 PRO 7 HB3 PRO 7 0.237 17.002 -10.085 56 HG2 PRO 7 HG2 PRO 7 1.615 16.384 -7.670 57 HG3 PRO 7 HG3 PRO 7 0.227 17.228 -7.843 58 HD2 PRO 7 HD2 PRO 7 0.178 14.686 -7.208 59 HD3 PRO 7 HD3 PRO 7 -1.021 15.346 -8.100 60 H GLY 8 H GLY 8 2.855 14.716 -12.037 61 HA2 GLY 8 HA2 GLY 8 5.088 14.479 -12.216 62 HA3 GLY 8 HA3 GLY 8 5.272 15.127 -10.728 63 H SER 9 H SER 9 7.155 13.553 -10.899 64 HA SER 9 HA SER 9 6.418 11.233 -9.401 65 HB2 SER 9 HB2 SER 9 6.394 10.276 -11.564 66 HB3 SER 9 HB3 SER 9 7.835 10.957 -11.922 67 HG SER 9 HG SER 9 7.312 8.694 -10.623 68 H ARG 10 H ARG 10 8.177 10.419 -8.086 69 HA ARG 10 HA ARG 10 10.141 12.347 -7.615 70 HB2 ARG 10 HB2 ARG 10 10.899 10.932 -5.856 71 HB3 ARG 10 HB3 ARG 10 9.266 10.946 -5.841 72 HG2 ARG 10 HG2 ARG 10 9.209 8.822 -6.847 73 HG3 ARG 10 HG3 ARG 10 10.837 8.813 -6.971 74 HD2 ARG 10 HD2 ARG 10 10.997 8.800 -4.580 75 HD3 ARG 10 HD3 ARG 10 9.368 8.741 -4.487 76 HE ARG 10 HE ARG 10 9.347 6.524 -5.048 77 HH11 ARG 10 HH11 ARG 10 12.615 7.820 -5.372 78 HH12 ARG 10 HH12 ARG 10 13.300 6.247 -5.611 79 HH21 ARG 10 HH21 ARG 10 10.294 4.570 -5.410 80 HH22 ARG 10 HH22 ARG 10 12.007 4.440 -5.632 81 H ALA 11 H ALA 11 10.008 9.725 -9.678 82 HA ALA 11 HA ALA 11 12.583 8.840 -9.579 83 HB1 ALA 11 HB1 ALA 11 10.798 7.620 -10.728 84 HB2 ALA 11 HB2 ALA 11 12.080 7.741 -11.706 85 HB3 ALA 11 HB3 ALA 11 10.811 8.722 -11.911 86 H ALA 12 H ALA 12 11.355 11.544 -11.258 87 HA ALA 12 HA ALA 12 13.419 11.875 -13.025 88 HB1 ALA 12 HB1 ALA 12 11.326 13.124 -13.191 89 HB2 ALA 12 HB2 ALA 12 12.569 14.156 -13.269 90 HB3 ALA 12 HB3 ALA 12 11.740 13.990 -11.890 91 H LEU 13 H LEU 13 13.329 12.606 -9.700 92 HA LEU 13 HA LEU 13 15.634 14.258 -9.872 93 HB2 LEU 13 HB2 LEU 13 14.036 13.534 -7.575 94 HB3 LEU 13 HB3 LEU 13 15.354 14.488 -7.440 95 HG LEU 13 HG LEU 13 14.102 16.015 -8.968 96 HD11 LEU 13 HD11 LEU 13 11.715 15.958 -8.742 97 HD12 LEU 13 HD12 LEU 13 11.823 14.566 -7.927 98 HD13 LEU 13 HD13 LEU 13 12.243 14.624 -9.487 99 HD21 LEU 13 HD21 LEU 13 13.116 17.098 -7.015 100 HD22 LEU 13 HD22 LEU 13 14.605 16.573 -6.665 101 HD23 LEU 13 HD23 LEU 13 13.314 15.734 -6.170 102 H CYS 14 H CYS 14 15.028 11.065 -9.593 103 HA CYS 14 HA CYS 14 17.354 10.464 -8.005 104 HB2 CYS 14 HB2 CYS 14 15.313 9.419 -7.482 105 HB3 CYS 14 HB3 CYS 14 15.267 8.772 -8.981 106 H SER 15 H SER 15 16.464 10.807 -11.155 107 HA SER 15 HA SER 15 17.917 8.761 -12.319 108 HB2 SER 15 HB2 SER 15 16.236 9.928 -13.579 109 HB3 SER 15 HB3 SER 15 17.124 11.298 -13.519 110 HG SER 15 HG SER 15 18.754 9.836 -14.596 111 H GLU 16 H GLU 16 19.898 8.734 -13.443 112 HA GLU 16 HA GLU 16 21.992 10.064 -12.258 113 HB2 GLU 16 HB2 GLU 16 22.000 8.872 -14.898 114 HB3 GLU 16 HB3 GLU 16 23.324 9.110 -13.971 115 HG2 GLU 16 HG2 GLU 16 22.956 6.879 -13.747 116 HG3 GLU 16 HG3 GLU 16 22.279 7.489 -12.392 117 H ALA 17 H ALA 17 19.945 10.794 -14.872 118 HA ALA 17 HA ALA 17 21.418 12.806 -16.038 119 HB1 ALA 17 HB1 ALA 17 19.526 11.741 -17.158 120 HB2 ALA 17 HB2 ALA 17 19.327 13.345 -17.192 121 HB3 ALA 17 HB3 ALA 17 18.511 12.452 -16.120 122 H PHE 18 H PHE 18 19.921 12.842 -13.089 123 HA PHE 18 HA PHE 18 19.243 15.585 -13.102 124 HB2 PHE 18 HB2 PHE 18 18.091 13.779 -11.797 125 HB3 PHE 18 HB3 PHE 18 19.317 13.925 -10.728 126 HD1 PHE 18 HD1 PHE 18 16.767 15.974 -12.316 127 HD2 PHE 18 HD2 PHE 18 19.052 15.349 -8.899 128 HE1 PHE 18 HE1 PHE 18 15.557 17.738 -11.193 129 HE2 PHE 18 HE2 PHE 18 17.855 17.108 -7.762 130 HZ PHE 18 HZ PHE 18 16.112 18.317 -8.915 131 H GLY 19 H GLY 19 22.134 14.195 -12.979 132 HA2 GLY 19 HA2 GLY 19 23.728 16.155 -12.645 133 HA3 GLY 19 HA3 GLY 19 23.218 16.085 -11.095 134 H PHE 20 H PHE 20 23.356 13.042 -12.234 135 HA PHE 20 HA PHE 20 24.669 11.358 -11.803 136 HB2 PHE 20 HB2 PHE 20 26.031 12.705 -13.491 137 HB3 PHE 20 HB3 PHE 20 27.097 12.834 -12.261 138 HD1 PHE 20 HD1 PHE 20 25.338 10.309 -14.184 139 HD2 PHE 20 HD2 PHE 20 28.751 11.186 -11.977 140 HE1 PHE 20 HE1 PHE 20 26.245 8.146 -14.748 141 HE2 PHE 20 HE2 PHE 20 29.682 9.034 -12.544 142 HZ PHE 20 HZ PHE 20 28.429 7.509 -13.937 143 H LEU 21 H LEU 21 24.109 13.040 -9.508 144 HA LEU 21 HA LEU 21 26.258 12.820 -7.746 145 HB2 LEU 21 HB2 LEU 21 23.452 12.978 -7.124 146 HB3 LEU 21 HB3 LEU 21 24.639 13.163 -6.017 147 HG LEU 21 HG LEU 21 24.188 14.986 -8.200 148 HD11 LEU 21 HD11 LEU 21 23.302 16.481 -6.512 149 HD12 LEU 21 HD12 LEU 21 23.498 15.330 -5.393 150 HD13 LEU 21 HD13 LEU 21 22.413 15.132 -6.575 151 HD21 LEU 21 HD21 LEU 21 25.744 16.439 -7.115 152 HD22 LEU 21 HD22 LEU 21 26.465 15.049 -7.519 153 HD23 LEU 21 HD23 LEU 21 26.019 15.313 -5.987 154 H ASN 22 H ASN 22 23.532 10.892 -8.519 155 HA ASN 22 HA ASN 22 23.055 8.779 -8.266 156 HB2 ASN 22 HB2 ASN 22 25.907 8.283 -8.033 157 HB3 ASN 22 HB3 ASN 22 24.815 7.156 -8.484 158 HD21 ASN 22 HD21 ASN 22 26.619 8.638 -11.404 159 HD22 ASN 22 HD22 ASN 22 27.166 8.020 -9.881 160 H LEU 23 H LEU 23 23.283 10.329 -5.850 161 HA LEU 23 HA LEU 23 23.087 8.147 -4.025 162 HB2 LEU 23 HB2 LEU 23 24.426 9.064 -2.386 163 HB3 LEU 23 HB3 LEU 23 25.293 9.167 -3.766 164 HG LEU 23 HG LEU 23 24.086 11.531 -3.579 165 HD11 LEU 23 HD11 LEU 23 24.656 12.319 -1.361 166 HD12 LEU 23 HD12 LEU 23 25.127 10.826 -0.955 167 HD13 LEU 23 HD13 LEU 23 23.568 11.126 -1.263 168 HD21 LEU 23 HD21 LEU 23 26.298 12.402 -3.226 169 HD22 LEU 23 HD22 LEU 23 26.323 11.256 -4.367 170 HD23 LEU 23 HD23 LEU 23 26.827 10.917 -2.868 171 H ASN 24 H ASN 24 21.864 8.545 -2.095 172 HA ASN 24 HA ASN 24 20.036 9.158 -1.213 173 HB2 ASN 24 HB2 ASN 24 21.390 11.011 -0.428 174 HB3 ASN 24 HB3 ASN 24 20.851 11.923 -1.671 175 HD21 ASN 24 HD21 ASN 24 18.633 13.299 0.617 176 HD22 ASN 24 HD22 ASN 24 20.120 13.544 -0.237 177 H CYS 25 H CYS 25 18.697 8.227 -2.838 178 HA CYS 25 HA CYS 25 17.039 10.130 -4.152 179 HB2 CYS 25 HB2 CYS 25 17.017 7.283 -4.073 180 HB3 CYS 25 HB3 CYS 25 15.868 8.129 -4.865 181 H GLY 26 H GLY 26 17.232 9.719 -1.165 182 HA2 GLY 26 HA2 GLY 26 15.746 10.033 0.506 183 HA3 GLY 26 HA3 GLY 26 14.508 10.038 -0.560 184 H SER 27 H SER 27 14.288 8.896 1.979 185 HA SER 27 HA SER 27 14.698 6.197 2.044 186 HB2 SER 27 HB2 SER 27 13.957 7.469 3.988 187 HB3 SER 27 HB3 SER 27 12.466 7.573 3.329 188 HG SER 27 HG SER 27 12.850 5.910 4.937 189 H VAL 28 H VAL 28 12.271 7.988 0.485 190 HA VAL 28 HA VAL 28 10.480 6.061 0.044 191 HB VAL 28 HB VAL 28 10.545 7.706 -2.254 192 HG11 VAL 28 HG11 VAL 28 8.420 8.516 -1.456 193 HG12 VAL 28 HG12 VAL 28 8.679 7.791 -0.034 194 HG13 VAL 28 HG13 VAL 28 8.473 6.903 -1.369 195 HG21 VAL 28 HG21 VAL 28 10.513 9.904 -1.244 196 HG22 VAL 28 HG22 VAL 28 11.945 9.199 -0.986 197 HG23 VAL 28 HG23 VAL 28 10.845 9.250 0.198 198 H MET 29 H MET 29 13.534 6.056 -1.302 199 HA MET 29 HA MET 29 12.890 4.667 -3.632 200 HB2 MET 29 HB2 MET 29 15.143 4.308 -3.965 201 HB3 MET 29 HB3 MET 29 15.013 5.790 -3.291 202 HG2 MET 29 HG2 MET 29 15.617 4.882 -1.225 203 HG3 MET 29 HG3 MET 29 15.793 3.421 -1.934 204 HE1 MET 29 HE1 MET 29 19.523 4.282 -1.356 205 HE2 MET 29 HE2 MET 29 18.401 3.131 -1.179 206 HE3 MET 29 HE3 MET 29 18.286 4.508 -0.339 207 H TYR 30 H TYR 30 13.308 3.737 -0.397 208 HA TYR 30 HA TYR 30 13.333 0.934 -0.974 209 HB2 TYR 30 HB2 TYR 30 14.738 1.578 0.788 210 HB3 TYR 30 HB3 TYR 30 13.551 2.460 1.481 211 HD1 TYR 30 HD1 TYR 30 14.662 -0.944 0.945 212 HD2 TYR 30 HD2 TYR 30 12.081 1.502 3.110 213 HE1 TYR 30 HE1 TYR 30 14.123 -2.794 2.407 214 HE2 TYR 30 HE2 TYR 30 11.544 -0.347 4.563 215 HH TYR 30 HH TYR 30 12.422 -2.444 5.339 216 H GLU 31 H GLU 31 11.284 3.360 0.332 217 HA GLU 31 HA GLU 31 9.105 1.476 0.406 218 HB2 GLU 31 HB2 GLU 31 8.155 3.091 2.098 219 HB3 GLU 31 HB3 GLU 31 9.315 2.053 2.593 220 HG2 GLU 31 HG2 GLU 31 10.938 3.758 2.461 221 HG3 GLU 31 HG3 GLU 31 9.825 4.799 1.874 222 HA PRO 32 HA PRO 32 8.109 4.745 -2.469 223 HB2 PRO 32 HB2 PRO 32 7.278 3.350 -4.616 224 HB3 PRO 32 HB3 PRO 32 8.882 3.549 -4.381 225 HG2 PRO 32 HG2 PRO 32 7.278 1.301 -3.612 226 HG3 PRO 32 HG3 PRO 32 8.695 1.278 -4.425 227 HD2 PRO 32 HD2 PRO 32 8.699 0.869 -1.874 228 HD3 PRO 32 HD3 PRO 32 9.912 1.733 -2.542 229 H GLN 33 H GLN 33 6.190 2.128 -1.554 230 HA GLN 33 HA GLN 33 3.898 3.770 -1.967 231 HB2 GLN 33 HB2 GLN 33 2.614 1.681 -2.180 232 HB3 GLN 33 HB3 GLN 33 3.810 1.756 -3.290 233 HG2 GLN 33 HG2 GLN 33 4.587 -0.145 -2.571 234 HG3 GLN 33 HG3 GLN 33 4.850 0.522 -1.103 235 HE21 GLN 33 HE21 GLN 33 1.662 -0.635 0.188 236 HE22 GLN 33 HE22 GLN 33 2.521 0.864 0.075 237 H SER 34 H SER 34 5.651 2.750 0.575 238 HA SER 34 HA SER 34 3.426 1.917 2.144 239 HB2 SER 34 HB2 SER 34 5.560 0.782 2.428 240 HB3 SER 34 HB3 SER 34 6.209 2.169 2.996 241 HG SER 34 HG SER 34 4.006 1.218 4.256 242 H LEU 35 H LEU 35 2.073 3.661 2.501 243 HA LEU 35 HA LEU 35 3.278 5.732 4.092 244 HB2 LEU 35 HB2 LEU 35 1.185 5.909 2.122 245 HB3 LEU 35 HB3 LEU 35 1.281 7.067 3.269 246 HG LEU 35 HG LEU 35 3.498 7.565 2.419 247 HD11 LEU 35 HD11 LEU 35 4.063 6.961 0.179 248 HD12 LEU 35 HD12 LEU 35 2.777 5.984 0.116 249 HD13 LEU 35 HD13 LEU 35 3.996 5.652 1.126 250 HD21 LEU 35 HD21 LEU 35 2.578 8.907 0.573 251 HD22 LEU 35 HD22 LEU 35 1.588 8.970 1.849 252 HD23 LEU 35 HD23 LEU 35 1.239 8.002 0.602 253 H GLU 36 H GLU 36 2.910 4.319 5.994 254 HA GLU 36 HA GLU 36 0.409 5.143 7.115 255 HB2 GLU 36 HB2 GLU 36 1.177 2.424 6.935 256 HB3 GLU 36 HB3 GLU 36 0.506 2.872 8.355 257 HG2 GLU 36 HG2 GLU 36 -1.411 3.672 7.109 258 HG3 GLU 36 HG3 GLU 36 -0.753 3.006 5.770 259 H ALA 37 H ALA 37 0.723 6.230 9.040 260 HA ALA 37 HA ALA 37 2.918 5.362 10.684 261 HB1 ALA 37 HB1 ALA 37 3.692 7.356 9.552 262 HB2 ALA 37 HB2 ALA 37 3.533 7.680 11.128 263 HB3 ALA 37 HB3 ALA 37 2.402 8.173 10.083 264 H LYS 38 H LYS 38 2.412 5.132 12.895 265 HA LYS 38 HA LYS 38 -0.237 5.466 13.648 266 HB2 LYS 38 HB2 LYS 38 1.188 3.980 14.801 267 HB3 LYS 38 HB3 LYS 38 2.016 5.247 15.414 268 HG2 LYS 38 HG2 LYS 38 0.141 5.908 16.674 269 HG3 LYS 38 HG3 LYS 38 -0.761 4.728 15.997 270 HD2 LYS 38 HD2 LYS 38 1.532 4.097 17.586 271 HD3 LYS 38 HD3 LYS 38 0.063 4.305 18.270 272 HE2 LYS 38 HE2 LYS 38 -0.519 2.567 16.404 273 HE3 LYS 38 HE3 LYS 38 1.002 2.106 16.782 274 HZ1 LYS 38 HZ1 LYS 38 -0.565 0.939 18.137 275 HZ2 LYS 38 HZ2 LYS 38 -1.146 2.344 18.690 276 HZ3 LYS 38 HZ3 LYS 38 0.360 1.888 19.064 277 H LYS 39 H LYS 39 -1.409 7.094 14.610 278 HA LYS 39 HA LYS 39 -0.418 9.657 14.287 279 HB2 LYS 39 HB2 LYS 39 -2.743 8.771 15.776 280 HB3 LYS 39 HB3 LYS 39 -2.470 10.340 15.413 281 HG2 LYS 39 HG2 LYS 39 -2.679 9.831 13.097 282 HG3 LYS 39 HG3 LYS 39 -2.977 8.270 13.473 283 HD2 LYS 39 HD2 LYS 39 -4.982 8.917 14.581 284 HD3 LYS 39 HD3 LYS 39 -4.683 10.480 14.214 285 HE2 LYS 39 HE2 LYS 39 -4.804 9.928 11.889 286 HE3 LYS 39 HE3 LYS 39 -5.182 8.391 12.293 287 HZ1 LYS 39 HZ1 LYS 39 -7.117 9.567 11.656 288 HZ2 LYS 39 HZ2 LYS 39 -6.851 10.665 12.814 289 HZ3 LYS 39 HZ3 LYS 39 -7.224 9.143 13.213 290 H GLY 40 H GLY 40 0.647 11.100 15.595 291 HA2 GLY 40 HA2 GLY 40 0.849 11.989 17.756 292 HA3 GLY 40 HA3 GLY 40 0.628 10.506 18.405 293 H PHE 41 H PHE 41 2.488 12.389 19.178 294 HA PHE 41 HA PHE 41 5.053 11.281 18.499 295 HB2 PHE 41 HB2 PHE 41 5.953 13.061 19.776 296 HB3 PHE 41 HB3 PHE 41 4.941 13.625 18.625 297 HD1 PHE 41 HD1 PHE 41 5.346 13.175 22.156 298 HD2 PHE 41 HD2 PHE 41 2.885 14.766 19.201 299 HE1 PHE 41 HE1 PHE 41 4.114 14.378 23.842 300 HE2 PHE 41 HE2 PHE 41 1.641 15.975 20.879 301 HZ PHE 41 HZ PHE 41 2.256 15.778 23.208 302 HA PRO 42 HA PRO 42 7.276 11.243 20.004 303 HB2 PRO 42 HB2 PRO 42 8.700 9.136 20.810 304 HB3 PRO 42 HB3 PRO 42 8.310 10.283 21.904 305 HG2 PRO 42 HG2 PRO 42 6.950 7.830 21.395 306 HG3 PRO 42 HG3 PRO 42 7.427 8.426 22.838 307 HD2 PRO 42 HD2 PRO 42 4.976 8.761 22.085 308 HD3 PRO 42 HD3 PRO 42 5.732 9.964 22.891 309 H HIS 43 H HIS 43 8.493 10.835 18.212 310 HA HIS 43 HA HIS 43 7.668 8.558 16.722 311 HB2 HIS 43 HB2 HIS 43 6.330 10.787 16.303 312 HB3 HIS 43 HB3 HIS 43 7.527 10.988 15.210 313 HD1 HIS 43 HD1 HIS 43 4.381 9.212 15.767 314 HD2 HIS 43 HD2 HIS 43 7.481 9.091 13.087 315 HE1 HIS 43 HE1 HIS 43 3.688 7.834 13.812 316 HE2 HIS 43 HE2 HIS 43 5.539 7.757 12.183 317 H SER 44 H SER 44 10.103 9.866 17.847 318 HA SER 44 HA SER 44 12.231 10.069 17.384 319 HB2 SER 44 HB2 SER 44 11.885 7.928 16.056 320 HB3 SER 44 HB3 SER 44 12.208 8.878 14.767 321 HG SER 44 HG SER 44 13.865 8.594 16.949 322 H GLY 45 H GLY 45 10.661 10.706 14.302 323 HA2 GLY 45 HA2 GLY 45 12.185 13.053 13.863 324 HA3 GLY 45 HA3 GLY 45 10.934 12.527 12.955 325 HA PRO 46 HA PRO 46 9.528 16.012 15.582 326 HB2 PRO 46 HB2 PRO 46 8.740 17.752 13.713 327 HB3 PRO 46 HB3 PRO 46 10.321 17.706 14.121 328 HG2 PRO 46 HG2 PRO 46 9.051 16.388 11.929 329 HG3 PRO 46 HG3 PRO 46 10.396 17.313 11.891 330 HD2 PRO 46 HD2 PRO 46 10.644 14.736 11.989 331 HD3 PRO 46 HD3 PRO 46 11.692 15.665 12.830 332 H ALA 47 H ALA 47 7.452 16.789 16.122 333 HA ALA 47 HA ALA 47 5.493 14.897 15.434 334 HB1 ALA 47 HB1 ALA 47 5.495 15.856 17.647 335 HB2 ALA 47 HB2 ALA 47 4.070 16.169 16.951 336 HB3 ALA 47 HB3 ALA 47 5.201 17.322 17.030 337 H ASP 48 H ASP 48 4.250 14.912 13.620 338 HA ASP 48 HA ASP 48 3.414 17.475 12.631 339 HB2 ASP 48 HB2 ASP 48 5.265 16.664 11.271 340 HB3 ASP 48 HB3 ASP 48 4.292 15.446 10.783 341 H GLY 49 H GLY 49 1.735 16.929 10.635 342 HA2 GLY 49 HA2 GLY 49 -0.252 15.856 10.166 343 HA3 GLY 49 HA3 GLY 49 -0.099 14.906 11.486 344 H GLN 50 H GLN 50 0.732 17.609 12.707 345 HA GLN 50 HA GLN 50 -1.800 18.181 13.850 346 HB2 GLN 50 HB2 GLN 50 0.806 19.300 14.455 347 HB3 GLN 50 HB3 GLN 50 -0.529 19.583 15.353 348 HG2 GLN 50 HG2 GLN 50 0.481 16.910 15.070 349 HG3 GLN 50 HG3 GLN 50 1.081 17.901 16.221 350 HE21 GLN 50 HE21 GLN 50 -1.230 16.713 18.475 351 HE22 GLN 50 HE22 GLN 50 0.437 16.979 18.089 352 H ILE 51 H ILE 51 -1.832 18.782 11.225 353 HA ILE 51 HA ILE 51 -1.193 21.401 10.639 354 HB ILE 51 HB ILE 51 -3.171 19.698 9.299 355 HG12 ILE 51 HG12 ILE 51 -0.468 20.206 8.426 356 HG13 ILE 51 HG13 ILE 51 -0.880 18.882 9.289 357 HG21 ILE 51 HG21 ILE 51 -3.050 21.181 7.392 358 HG22 ILE 51 HG22 ILE 51 -2.065 22.168 8.212 359 HG23 ILE 51 HG23 ILE 51 -3.604 21.990 8.678 360 HD11 ILE 51 HD11 ILE 51 -0.722 18.328 6.967 361 HD12 ILE 51 HD12 ILE 51 -1.840 19.441 6.611 362 HD13 ILE 51 HD13 ILE 51 -2.248 18.130 7.465 363 H ALA 52 H ALA 52 -4.096 19.922 11.833 364 HA ALA 52 HA ALA 52 -5.723 22.138 11.664 365 HB1 ALA 52 HB1 ALA 52 -6.604 19.907 12.065 366 HB2 ALA 52 HB2 ALA 52 -7.191 20.919 13.181 367 HB3 ALA 52 HB3 ALA 52 -5.974 19.922 13.554 368 H SER 53 H SER 53 -3.443 21.249 14.051 369 HA SER 53 HA SER 53 -4.235 23.349 15.806 370 HB2 SER 53 HB2 SER 53 -1.975 21.533 16.127 371 HB3 SER 53 HB3 SER 53 -2.649 22.411 17.328 372 HG SER 53 HG SER 53 -4.609 21.202 16.811 373 H ALA 54 H ALA 54 -2.545 23.188 13.126 374 HA ALA 54 HA ALA 54 -0.864 24.260 12.180 375 HB1 ALA 54 HB1 ALA 54 -2.292 26.157 12.491 376 HB2 ALA 54 HB2 ALA 54 -0.745 26.628 12.510 377 HB3 ALA 54 HB3 ALA 54 -1.563 26.484 13.898 378 H GLY 55 H GLY 55 -0.027 22.534 14.159 379 HA2 GLY 55 HA2 GLY 55 2.140 23.920 15.460 380 HA3 GLY 55 HA3 GLY 55 1.534 22.474 15.919 381 H GLY 56 H GLY 56 1.546 21.125 13.474 382 HA2 GLY 56 HA2 GLY 56 4.239 20.319 13.463 383 HA3 GLY 56 HA3 GLY 56 3.050 19.718 12.519 384 H LEU 57 H LEU 57 2.597 22.637 11.750 385 HA LEU 57 HA LEU 57 3.834 22.506 9.312 386 HB2 LEU 57 HB2 LEU 57 2.814 24.873 10.639 387 HB3 LEU 57 HB3 LEU 57 3.090 24.784 9.032 388 HG LEU 57 HG LEU 57 1.075 23.221 10.367 389 HD11 LEU 57 HD11 LEU 57 -0.522 24.762 9.454 390 HD12 LEU 57 HD12 LEU 57 0.684 25.665 8.867 391 HD13 LEU 57 HD13 LEU 57 0.478 25.530 10.465 392 HD21 LEU 57 HD21 LEU 57 0.242 22.754 8.173 393 HD22 LEU 57 HD22 LEU 57 1.762 22.221 8.315 394 HD23 LEU 57 HD23 LEU 57 1.458 23.598 7.524 395 H PHE 58 H PHE 58 4.970 23.809 12.250 396 HA PHE 58 HA PHE 58 7.028 25.324 11.171 397 HB2 PHE 58 HB2 PHE 58 6.679 24.245 13.828 398 HB3 PHE 58 HB3 PHE 58 7.943 25.213 13.466 399 HD1 PHE 58 HD1 PHE 58 4.396 25.153 13.975 400 HD2 PHE 58 HD2 PHE 58 7.659 27.606 13.167 401 HE1 PHE 58 HE1 PHE 58 3.032 27.091 14.383 402 HE2 PHE 58 HE2 PHE 58 6.301 29.558 13.582 403 HZ PHE 58 HZ PHE 58 3.982 29.301 14.194 404 H GLY 59 H GLY 59 6.759 21.976 11.757 405 HA2 GLY 59 HA2 GLY 59 9.515 21.415 11.587 406 HA3 GLY 59 HA3 GLY 59 8.304 20.330 11.433 407 H GLY 60 H GLY 60 6.952 21.810 9.342 408 HA2 GLY 60 HA2 GLY 60 8.239 20.739 7.116 409 HA3 GLY 60 HA3 GLY 60 6.965 21.761 7.083 410 H ILE 61 H ILE 61 8.586 23.734 8.683 411 HA ILE 61 HA ILE 61 9.625 25.173 6.564 412 HB ILE 61 HB ILE 61 10.250 25.560 9.390 413 HG12 ILE 61 HG12 ILE 61 7.938 25.748 9.046 414 HG13 ILE 61 HG13 ILE 61 8.562 27.203 9.447 415 HG21 ILE 61 HG21 ILE 61 10.919 27.813 8.825 416 HG22 ILE 61 HG22 ILE 61 10.667 27.498 7.259 417 HG23 ILE 61 HG23 ILE 61 11.858 26.746 8.054 418 HD11 ILE 61 HD11 ILE 61 6.921 27.470 7.708 419 HD12 ILE 61 HD12 ILE 61 7.753 26.470 6.748 420 HD13 ILE 61 HD13 ILE 61 8.371 27.910 7.145 421 H LEU 62 H LEU 62 11.059 23.131 8.972 422 HA LEU 62 HA LEU 62 13.675 23.502 8.103 423 HB2 LEU 62 HB2 LEU 62 12.469 21.628 9.913 424 HB3 LEU 62 HB3 LEU 62 14.029 21.402 9.487 425 HG LEU 62 HG LEU 62 14.508 23.565 10.462 426 HD11 LEU 62 HD11 LEU 62 12.995 24.506 12.048 427 HD12 LEU 62 HD12 LEU 62 11.869 23.427 11.620 428 HD13 LEU 62 HD13 LEU 62 12.358 24.547 10.562 429 HD21 LEU 62 HD21 LEU 62 14.519 22.656 12.733 430 HD22 LEU 62 HD22 LEU 62 14.983 21.519 11.681 431 HD23 LEU 62 HD23 LEU 62 13.477 21.510 12.269 432 H ASP 63 H ASP 63 11.191 21.257 7.306 433 HA ASP 63 HA ASP 63 12.789 19.348 6.190 434 HB2 ASP 63 HB2 ASP 63 10.431 18.997 6.641 435 HB3 ASP 63 HB3 ASP 63 10.085 19.860 5.298 436 H GLN 64 H GLN 64 11.752 22.333 4.911 437 HA GLN 64 HA GLN 64 12.116 21.746 2.245 438 HB2 GLN 64 HB2 GLN 64 12.126 24.277 3.639 439 HB3 GLN 64 HB3 GLN 64 12.279 24.228 2.013 440 HG2 GLN 64 HG2 GLN 64 10.153 23.392 1.747 441 HG3 GLN 64 HG3 GLN 64 10.021 23.042 3.337 442 HE21 GLN 64 HE21 GLN 64 8.429 25.945 4.143 443 HE22 GLN 64 HE22 GLN 64 8.776 24.291 4.520 444 H GLN 65 H GLN 65 14.475 21.909 4.525 445 HA GLN 65 HA GLN 65 16.458 21.926 2.437 446 HB2 GLN 65 HB2 GLN 65 16.423 23.964 3.919 447 HB3 GLN 65 HB3 GLN 65 17.161 22.993 5.005 448 HG2 GLN 65 HG2 GLN 65 19.021 22.752 3.627 449 HG3 GLN 65 HG3 GLN 65 18.262 23.506 2.392 450 HE21 GLN 65 HE21 GLN 65 20.462 26.075 3.472 451 HE22 GLN 65 HE22 GLN 65 20.454 24.630 2.517 452 H SER 66 H SER 66 15.027 19.746 3.732 453 HA SER 66 HA SER 66 16.963 18.543 5.434 454 HB2 SER 66 HB2 SER 66 14.645 18.273 6.029 455 HB3 SER 66 HB3 SER 66 14.341 17.560 4.591 456 HG SER 66 HG SER 66 15.313 16.507 6.839 457 H GLU 67 H GLU 67 17.833 16.394 5.208 458 HA GLU 67 HA GLU 67 18.778 15.797 2.684 459 HB2 GLU 67 HB2 GLU 67 19.824 15.024 4.717 460 HB3 GLU 67 HB3 GLU 67 18.550 14.040 4.991 461 HG2 GLU 67 HG2 GLU 67 19.164 12.816 3.002 462 HG3 GLU 67 HG3 GLU 67 20.522 13.722 2.927 463 H ASN 68 H ASN 68 16.108 14.590 4.506 464 HA ASN 68 HA ASN 68 15.342 12.815 2.365 465 HB2 ASN 68 HB2 ASN 68 15.111 12.646 5.175 466 HB3 ASN 68 HB3 ASN 68 13.794 12.105 4.376 467 HD21 ASN 68 HD21 ASN 68 17.106 9.915 4.532 468 HD22 ASN 68 HD22 ASN 68 16.955 11.458 5.305 469 H ARG 69 H ARG 69 14.939 15.676 2.483 470 HA ARG 69 HA ARG 69 12.305 16.386 2.723 471 HB2 ARG 69 HB2 ARG 69 13.992 17.971 2.354 472 HB3 ARG 69 HB3 ARG 69 14.363 17.298 0.913 473 HG2 ARG 69 HG2 ARG 69 12.300 18.147 0.027 474 HG3 ARG 69 HG3 ARG 69 12.024 18.892 1.454 475 HD2 ARG 69 HD2 ARG 69 12.982 20.430 -0.034 476 HD3 ARG 69 HD3 ARG 69 14.049 20.124 1.164 477 HE ARG 69 HE ARG 69 14.401 18.426 -1.072 478 HH11 ARG 69 HH11 ARG 69 15.334 21.572 0.211 479 HH12 ARG 69 HH12 ARG 69 16.778 21.620 -0.745 480 HH21 ARG 69 HH21 ARG 69 16.269 18.549 -2.222 481 HH22 ARG 69 HH22 ARG 69 17.296 19.938 -2.098 482 H TRP 70 H TRP 70 10.565 16.699 1.191 483 HA TRP 70 HA TRP 70 10.333 14.422 -0.445 484 HB2 TRP 70 HB2 TRP 70 8.522 16.637 0.040 485 HB3 TRP 70 HB3 TRP 70 8.105 15.397 -0.937 486 HD1 TRP 70 HD1 TRP 70 8.642 16.104 2.679 487 HE1 TRP 70 HE1 TRP 70 7.588 14.380 4.163 488 HE3 TRP 70 HE3 TRP 70 7.309 12.906 -0.932 489 HZ2 TRP 70 HZ2 TRP 70 6.313 11.904 3.721 490 HZ3 TRP 70 HZ3 TRP 70 6.204 10.838 -0.316 491 HH2 TRP 70 HH2 TRP 70 5.711 10.355 2.003 492 H PHE 71 H PHE 71 9.713 14.431 -2.737 493 HA PHE 71 HA PHE 71 11.574 15.870 -4.152 494 HB2 PHE 71 HB2 PHE 71 10.518 14.939 -6.125 495 HB3 PHE 71 HB3 PHE 71 10.797 13.805 -4.983 496 HD1 PHE 71 HD1 PHE 71 8.938 12.719 -3.802 497 HD2 PHE 71 HD2 PHE 71 8.249 15.610 -6.711 498 HE1 PHE 71 HE1 PHE 71 6.611 12.078 -3.877 499 HE2 PHE 71 HE2 PHE 71 5.920 14.976 -6.803 500 HZ PHE 71 HZ PHE 71 5.099 13.206 -5.383 501 H LYS 72 H LYS 72 11.581 17.637 -5.528 502 HA LYS 72 HA LYS 72 9.268 19.318 -5.196 503 HB2 LYS 72 HB2 LYS 72 11.939 20.300 -5.769 504 HB3 LYS 72 HB3 LYS 72 10.678 21.210 -5.270 505 HG2 LYS 72 HG2 LYS 72 10.931 19.619 -3.230 506 HG3 LYS 72 HG3 LYS 72 12.486 19.714 -3.720 507 HD2 LYS 72 HD2 LYS 72 10.876 22.012 -3.084 508 HD3 LYS 72 HD3 LYS 72 11.939 21.341 -2.042 509 HE2 LYS 72 HE2 LYS 72 13.723 21.959 -3.481 510 HE3 LYS 72 HE3 LYS 72 12.651 22.659 -4.495 511 HZ1 LYS 72 HZ1 LYS 72 13.563 24.307 -3.007 512 HZ2 LYS 72 HZ2 LYS 72 13.038 23.456 -1.737 513 HZ3 LYS 72 HZ3 LYS 72 11.976 24.148 -2.741 514 H HIS 73 H HIS 73 8.145 20.094 -6.971 515 HA HIS 73 HA HIS 73 9.600 20.022 -9.457 516 HB2 HIS 73 HB2 HIS 73 6.873 19.168 -9.087 517 HB3 HIS 73 HB3 HIS 73 7.442 19.531 -10.574 518 HD1 HIS 73 HD1 HIS 73 9.713 18.089 -11.308 519 HD2 HIS 73 HD2 HIS 73 7.200 16.532 -8.470 520 HE1 HIS 73 HE1 HIS 73 10.204 15.664 -11.062 521 HE2 HIS 73 HE2 HIS 73 8.703 14.705 -9.357 522 H ILE 74 H ILE 74 9.308 21.640 -11.011 523 HA ILE 74 HA ILE 74 7.997 23.999 -10.026 524 HB ILE 74 HB ILE 74 10.193 24.263 -11.017 525 HG12 ILE 74 HG12 ILE 74 8.273 25.731 -12.562 526 HG13 ILE 74 HG13 ILE 74 8.553 26.068 -10.989 527 HG21 ILE 74 HG21 ILE 74 10.501 24.051 -13.394 528 HG22 ILE 74 HG22 ILE 74 8.993 23.487 -13.547 529 HG23 ILE 74 HG23 ILE 74 10.104 22.619 -12.756 530 HD11 ILE 74 HD11 ILE 74 9.789 27.577 -12.380 531 HD12 ILE 74 HD12 ILE 74 10.541 26.331 -13.086 532 HD13 ILE 74 HD13 ILE 74 10.818 26.665 -11.528 533 H MET 75 H MET 75 6.072 24.819 -10.854 534 HA MET 75 HA MET 75 4.921 23.572 -13.152 535 HB2 MET 75 HB2 MET 75 4.336 22.291 -11.039 536 HB3 MET 75 HB3 MET 75 3.281 23.514 -10.798 537 HG2 MET 75 HG2 MET 75 2.183 23.018 -12.739 538 HG3 MET 75 HG3 MET 75 3.296 21.885 -13.120 539 HE1 MET 75 HE1 MET 75 0.291 19.554 -12.485 540 HE2 MET 75 HE2 MET 75 1.506 19.886 -13.499 541 HE3 MET 75 HE3 MET 75 0.312 20.956 -13.290 542 H THR 76 H THR 76 2.842 24.710 -13.825 543 HA THR 76 HA THR 76 2.867 27.438 -12.895 544 HB THR 76 HB THR 76 1.374 27.869 -14.796 545 HG1 THR 76 HG1 THR 76 0.395 26.212 -15.529 546 HG21 THR 76 HG21 THR 76 3.051 27.611 -16.495 547 HG22 THR 76 HG22 THR 76 3.866 26.575 -15.558 548 HG23 THR 76 HG23 THR 76 3.766 28.135 -15.142 549 H GLY 77 H GLY 77 0.530 28.428 -12.607 550 HA2 GLY 77 HA2 GLY 77 -0.918 26.796 -10.850 551 HA3 GLY 77 HA3 GLY 77 -1.368 28.273 -11.382 552 H GLY 78 H GLY 78 -3.562 27.268 -11.262 553 HA2 GLY 78 HA2 GLY 78 -5.225 26.931 -12.900 554 HA3 GLY 78 HA3 GLY 78 -4.176 26.087 -13.824 555 H GLU 79 H GLU 79 -6.436 24.788 -13.698 556 HA GLU 79 HA GLU 79 -6.628 23.232 -11.388 557 HB2 GLU 79 HB2 GLU 79 -8.491 23.606 -12.914 558 HB3 GLU 79 HB3 GLU 79 -7.809 22.510 -13.915 559 HG2 GLU 79 HG2 GLU 79 -7.943 20.959 -11.981 560 HG3 GLU 79 HG3 GLU 79 -9.006 22.034 -11.363 561 H HIS 80 H HIS 80 -5.676 21.304 -10.821 562 HA HIS 80 HA HIS 80 -4.167 19.973 -12.907 563 HB2 HIS 80 HB2 HIS 80 -3.301 20.219 -10.162 564 HB3 HIS 80 HB3 HIS 80 -2.465 19.464 -11.345 565 HD1 HIS 80 HD1 HIS 80 -1.259 21.806 -9.653 566 HD2 HIS 80 HD2 HIS 80 -2.905 22.142 -13.392 567 HE1 HIS 80 HE1 HIS 80 -0.423 23.901 -10.704 568 HE2 HIS 80 HE2 HIS 80 -1.399 24.123 -12.955 569 H THR 81 H THR 81 -3.987 17.636 -12.690 570 HA THR 81 HA THR 81 -6.214 16.577 -11.202 571 HB THR 81 HB THR 81 -4.864 15.275 -13.430 572 HG1 THR 81 HG1 THR 81 -6.628 15.873 -14.661 573 HG21 THR 81 HG21 THR 81 -6.747 13.783 -13.443 574 HG22 THR 81 HG22 THR 81 -7.397 14.565 -12.186 575 HG23 THR 81 HG23 THR 81 -6.042 13.706 -11.990 576 H PHE 82 H PHE 82 -5.861 15.395 -9.433 577 HA PHE 82 HA PHE 82 -3.153 14.496 -8.912 578 HB2 PHE 82 HB2 PHE 82 -5.304 15.074 -7.091 579 HB3 PHE 82 HB3 PHE 82 -3.885 14.419 -6.615 580 HD1 PHE 82 HD1 PHE 82 -2.221 15.845 -5.796 581 HD2 PHE 82 HD2 PHE 82 -5.099 17.394 -8.376 582 HE1 PHE 82 HE1 PHE 82 -1.267 18.045 -5.545 583 HE2 PHE 82 HE2 PHE 82 -4.151 19.587 -8.127 584 HZ PHE 82 HZ PHE 82 -2.225 19.916 -6.730 585 H THR 83 H THR 83 -2.772 12.345 -9.119 586 HA THR 83 HA THR 83 -5.084 10.646 -9.090 587 HB THR 83 HB THR 83 -2.886 10.321 -10.993 588 HG1 THR 83 HG1 THR 83 -4.610 10.919 -12.511 589 HG21 THR 83 HG21 THR 83 -4.305 8.722 -12.073 590 HG22 THR 83 HG22 THR 83 -5.454 8.963 -10.962 591 HG23 THR 83 HG23 THR 83 -4.065 8.248 -10.546 592 H TRP 84 H TRP 84 -4.960 9.423 -7.340 593 HA TRP 84 HA TRP 84 -2.417 8.131 -6.734 594 HB2 TRP 84 HB2 TRP 84 -4.438 8.958 -4.872 595 HB3 TRP 84 HB3 TRP 84 -3.170 8.011 -4.468 596 HD1 TRP 84 HD1 TRP 84 -2.389 10.969 -6.564 597 HE1 TRP 84 HE1 TRP 84 -1.112 12.740 -5.340 598 HE3 TRP 84 HE3 TRP 84 -2.779 8.972 -1.993 599 HZ2 TRP 84 HZ2 TRP 84 -0.389 13.154 -2.654 600 HZ3 TRP 84 HZ3 TRP 84 -1.733 10.116 -0.126 601 HH2 TRP 84 HH2 TRP 84 -0.573 12.204 -0.470 602 H THR 85 H THR 85 -2.658 5.791 -6.560 603 HA THR 85 HA THR 85 -5.335 4.833 -6.529 604 HB THR 85 HB THR 85 -5.245 4.648 -8.816 605 HG1 THR 85 HG1 THR 85 -5.694 2.635 -8.473 606 HG21 THR 85 HG21 THR 85 -3.246 4.196 -10.064 607 HG22 THR 85 HG22 THR 85 -2.413 3.995 -8.693 608 HG23 THR 85 HG23 THR 85 -2.974 5.458 -9.091 609 H TYR 86 H TYR 86 -5.570 3.213 -5.094 610 HA TYR 86 HA TYR 86 -3.222 1.606 -4.587 611 HB2 TYR 86 HB2 TYR 86 -4.909 2.808 -2.603 612 HB3 TYR 86 HB3 TYR 86 -3.951 1.537 -2.238 613 HD1 TYR 86 HD1 TYR 86 -1.554 1.818 -1.925 614 HD2 TYR 86 HD2 TYR 86 -3.876 5.022 -3.230 615 HE1 TYR 86 HE1 TYR 86 0.318 3.317 -1.594 616 HE2 TYR 86 HE2 TYR 86 -1.987 6.504 -2.936 617 HH TYR 86 HH TYR 86 1.191 5.368 -2.042 618 H THR 87 H THR 87 -3.472 -0.437 -5.016 619 HA THR 87 HA THR 87 -6.115 -1.335 -5.486 620 HB THR 87 HB THR 87 -4.375 -1.845 -7.155 621 HG1 THR 87 HG1 THR 87 -6.221 -3.226 -6.888 622 HG21 THR 87 HG21 THR 87 -2.698 -3.499 -6.662 623 HG22 THR 87 HG22 THR 87 -3.250 -3.634 -5.148 624 HG23 THR 87 HG23 THR 87 -2.527 -2.269 -5.626 625 H ALA 88 H ALA 88 -4.137 -1.402 -2.906 626 HA ALA 88 HA ALA 88 -4.897 -3.958 -1.899 627 HB1 ALA 88 HB1 ALA 88 -2.787 -3.089 -1.207 628 HB2 ALA 88 HB2 ALA 88 -3.722 -3.256 0.102 629 HB3 ALA 88 HB3 ALA 88 -3.503 -1.794 -0.554 630 HA PRO 89 HA PRO 89 -8.608 -2.118 -0.500 631 HB2 PRO 89 HB2 PRO 89 -9.742 -4.047 0.952 632 HB3 PRO 89 HB3 PRO 89 -9.702 -4.201 -0.674 633 HG2 PRO 89 HG2 PRO 89 -7.906 -5.339 1.232 634 HG3 PRO 89 HG3 PRO 89 -8.632 -6.086 -0.025 635 HD2 PRO 89 HD2 PRO 89 -6.178 -5.250 -0.252 636 HD3 PRO 89 HD3 PRO 89 -7.178 -5.195 -1.542 637 H HIS 90 H HIS 90 -8.577 -0.452 0.723 638 HA HIS 90 HA HIS 90 -8.111 -0.954 3.515 639 HB2 HIS 90 HB2 HIS 90 -6.689 0.840 1.909 640 HB3 HIS 90 HB3 HIS 90 -7.301 1.573 3.234 641 HD1 HIS 90 HD1 HIS 90 -6.233 -1.925 3.618 642 HD2 HIS 90 HD2 HIS 90 -4.695 1.814 4.297 643 HE1 HIS 90 HE1 HIS 90 -4.202 -2.148 5.044 644 HE2 HIS 90 HE2 HIS 90 -3.249 0.094 5.442 645 H ASN 91 H ASN 91 -9.646 -0.194 4.910 646 HA ASN 91 HA ASN 91 -11.717 1.454 3.868 647 HB2 ASN 91 HB2 ASN 91 -11.299 0.383 6.490 648 HB3 ASN 91 HB3 ASN 91 -12.514 1.428 6.175 649 HD21 ASN 91 HD21 ASN 91 -13.110 -2.368 5.584 650 HD22 ASN 91 HD22 ASN 91 -11.868 -1.676 6.574 651 H THR 92 H THR 92 -12.086 3.640 4.553 652 HA THR 92 HA THR 92 -9.821 4.959 5.795 653 HB THR 92 HB THR 92 -11.073 6.022 3.395 654 HG1 THR 92 HG1 THR 92 -9.316 4.065 3.555 655 HG21 THR 92 HG21 THR 92 -9.188 7.444 3.292 656 HG22 THR 92 HG22 THR 92 -8.572 6.757 4.620 657 HG23 THR 92 HG23 THR 92 -9.920 7.645 4.719 658 H SER 93 H SER 93 -10.511 6.874 7.010 659 HA SER 93 HA SER 93 -13.352 6.983 7.391 660 HB2 SER 93 HB2 SER 93 -12.816 8.541 9.189 661 HB3 SER 93 HB3 SER 93 -12.110 7.081 9.387 662 HG SER 93 HG SER 93 -10.196 7.851 8.874 663 H GLN 94 H GLN 94 -10.691 8.956 6.328 664 HA GLN 94 HA GLN 94 -12.252 10.322 4.473 665 HB2 GLN 94 HB2 GLN 94 -11.937 12.565 5.410 666 HB3 GLN 94 HB3 GLN 94 -12.912 11.645 6.343 667 HG2 GLN 94 HG2 GLN 94 -11.125 11.253 7.839 668 HG3 GLN 94 HG3 GLN 94 -10.135 12.152 6.901 669 HE21 GLN 94 HE21 GLN 94 -12.133 13.908 9.745 670 HE22 GLN 94 HE22 GLN 94 -11.850 12.204 9.615 671 H TRP 95 H TRP 95 -10.958 11.949 3.155 672 HA TRP 95 HA TRP 95 -8.238 12.172 4.027 673 HB2 TRP 95 HB2 TRP 95 -7.249 11.825 1.962 674 HB3 TRP 95 HB3 TRP 95 -8.058 10.483 2.424 675 HD1 TRP 95 HD1 TRP 95 -8.531 13.302 0.006 676 HE1 TRP 95 HE1 TRP 95 -9.771 12.580 -2.048 677 HE3 TRP 95 HE3 TRP 95 -9.567 8.654 1.516 678 HZ2 TRP 95 HZ2 TRP 95 -11.030 10.184 -2.859 679 HZ3 TRP 95 HZ3 TRP 95 -10.825 7.195 0.046 680 HH2 TRP 95 HH2 TRP 95 -11.546 7.969 -2.125 681 H HIS 96 H HIS 96 -7.264 14.229 3.462 682 HA HIS 96 HA HIS 96 -8.961 16.085 2.092 683 HB2 HIS 96 HB2 HIS 96 -8.658 17.648 4.075 684 HB3 HIS 96 HB3 HIS 96 -9.876 16.560 4.119 685 HD1 HIS 96 HD1 HIS 96 -10.030 15.033 6.128 686 HD2 HIS 96 HD2 HIS 96 -6.348 16.751 5.618 687 HE1 HIS 96 HE1 HIS 96 -8.575 14.365 8.033 688 HE2 HIS 96 HE2 HIS 96 -6.366 15.420 7.767 689 H TYR 97 H TYR 97 -7.911 18.172 1.611 690 HA TYR 97 HA TYR 97 -5.097 18.030 1.938 691 HB2 TYR 97 HB2 TYR 97 -5.281 18.967 -0.584 692 HB3 TYR 97 HB3 TYR 97 -4.761 17.474 -0.177 693 HD1 TYR 97 HD1 TYR 97 -7.686 19.297 -1.290 694 HD2 TYR 97 HD2 TYR 97 -6.057 15.509 -0.715 695 HE1 TYR 97 HE1 TYR 97 -9.496 18.321 -2.555 696 HE2 TYR 97 HE2 TYR 97 -7.878 14.541 -1.981 697 HH TYR 97 HH TYR 97 -9.572 15.700 -4.016 698 H TYR 98 H TYR 98 -3.857 19.928 1.687 699 HA TYR 98 HA TYR 98 -5.382 22.355 1.904 700 HB2 TYR 98 HB2 TYR 98 -3.064 21.799 3.558 701 HB3 TYR 98 HB3 TYR 98 -4.082 23.063 3.739 702 HD1 TYR 98 HD1 TYR 98 -3.658 19.561 4.416 703 HD2 TYR 98 HD2 TYR 98 -6.175 22.830 4.976 704 HE1 TYR 98 HE1 TYR 98 -4.899 18.321 6.073 705 HE2 TYR 98 HE2 TYR 98 -7.392 21.593 6.664 706 HH TYR 98 HH TYR 98 -7.115 19.709 8.199 707 H ILE 99 H ILE 99 -4.048 24.352 1.440 708 HA ILE 99 HA ILE 99 -1.532 23.736 0.195 709 HB ILE 99 HB ILE 99 -1.866 25.475 -1.487 710 HG12 ILE 99 HG12 ILE 99 -4.615 25.603 -0.647 711 HG13 ILE 99 HG13 ILE 99 -3.509 26.726 -0.219 712 HG21 ILE 99 HG21 ILE 99 -3.376 24.217 -2.894 713 HG22 ILE 99 HG22 ILE 99 -3.879 23.376 -1.608 714 HG23 ILE 99 HG23 ILE 99 -2.361 23.210 -2.139 715 HD11 ILE 99 HD11 ILE 99 -4.803 27.518 -2.067 716 HD12 ILE 99 HD12 ILE 99 -4.356 26.237 -2.948 717 HD13 ILE 99 HD13 ILE 99 -3.261 27.349 -2.524 718 H THR 100 H THR 100 0.141 25.425 0.450 719 HA THR 100 HA THR 100 -0.303 26.924 2.766 720 HB THR 100 HB THR 100 2.015 27.808 2.339 721 HG1 THR 100 HG1 THR 100 3.127 26.816 0.661 722 HG21 THR 100 HG21 THR 100 3.088 25.747 2.822 723 HG22 THR 100 HG22 THR 100 1.768 24.929 2.370 724 HG23 THR 100 HG23 THR 100 1.735 25.846 3.702 725 H LYS 101 H LYS 101 -1.050 28.992 2.939 726 HA LYS 101 HA LYS 101 -1.402 30.552 0.560 727 HB2 LYS 101 HB2 LYS 101 -3.066 30.336 2.337 728 HB3 LYS 101 HB3 LYS 101 -2.074 31.224 3.282 729 HG2 LYS 101 HG2 LYS 101 -2.375 33.073 1.851 730 HG3 LYS 101 HG3 LYS 101 -3.381 32.183 0.922 731 HD2 LYS 101 HD2 LYS 101 -4.693 31.820 2.991 732 HD3 LYS 101 HD3 LYS 101 -3.826 33.050 3.625 733 HE2 LYS 101 HE2 LYS 101 -4.710 34.548 2.090 734 HE3 LYS 101 HE3 LYS 101 -5.423 33.341 1.252 735 HZ1 LYS 101 HZ1 LYS 101 -7.025 34.433 2.634 736 HZ2 LYS 101 HZ2 LYS 101 -6.137 34.095 3.943 737 HZ3 LYS 101 HZ3 LYS 101 -6.843 32.900 3.114 738 H LYS 102 H LYS 102 0.293 31.743 -0.204 739 HA LYS 102 HA LYS 102 2.318 32.606 1.600 740 HB2 LYS 102 HB2 LYS 102 2.095 33.406 -1.144 741 HB3 LYS 102 HB3 LYS 102 3.447 33.434 -0.228 742 HG2 LYS 102 HG2 LYS 102 2.151 31.036 -1.162 743 HG3 LYS 102 HG3 LYS 102 3.520 31.657 -1.800 744 HD2 LYS 102 HD2 LYS 102 3.415 30.664 0.903 745 HD3 LYS 102 HD3 LYS 102 3.859 29.720 -0.353 746 HE2 LYS 102 HE2 LYS 102 5.622 31.417 -0.773 747 HE3 LYS 102 HE3 LYS 102 5.298 31.950 0.737 748 HZ1 LYS 102 HZ1 LYS 102 7.106 30.404 0.787 749 HZ2 LYS 102 HZ2 LYS 102 6.170 29.272 0.111 750 HZ3 LYS 102 HZ3 LYS 102 5.849 29.800 1.605 751 H GLY 103 H GLY 103 2.808 34.885 2.160 752 HA2 GLY 103 HA2 GLY 103 2.232 37.135 1.767 753 HA3 GLY 103 HA3 GLY 103 0.735 36.686 1.292 754 H TRP 104 H TRP 104 1.539 35.168 4.156 755 HA TRP 104 HA TRP 104 -0.323 36.572 5.610 756 HB2 TRP 104 HB2 TRP 104 0.647 35.491 7.565 757 HB3 TRP 104 HB3 TRP 104 0.258 34.453 6.365 758 HD1 TRP 104 HD1 TRP 104 3.397 36.184 7.541 759 HE1 TRP 104 HE1 TRP 104 5.425 34.747 7.252 760 HE3 TRP 104 HE3 TRP 104 1.110 32.328 5.332 761 HZ2 TRP 104 HZ2 TRP 104 5.888 32.170 6.203 762 HZ3 TRP 104 HZ3 TRP 104 2.417 30.387 4.719 763 HH2 TRP 104 HH2 TRP 104 4.787 30.314 5.173 764 H ASP 105 H ASP 105 -0.092 38.014 7.436 765 HA ASP 105 HA ASP 105 2.307 39.677 7.381 766 HB2 ASP 105 HB2 ASP 105 -0.437 40.555 7.588 767 HB3 ASP 105 HB3 ASP 105 0.832 41.537 7.897 768 HA PRO 106 HA PRO 106 1.965 38.737 11.657 769 HB2 PRO 106 HB2 PRO 106 3.018 40.806 12.973 770 HB3 PRO 106 HB3 PRO 106 4.008 39.858 12.085 771 HG2 PRO 106 HG2 PRO 106 2.803 42.327 11.304 772 HG3 PRO 106 HG3 PRO 106 4.374 41.901 11.175 773 HD2 PRO 106 HD2 PRO 106 2.820 41.661 9.109 774 HD3 PRO 106 HD3 PRO 106 3.973 40.536 9.374 775 H ASP 107 H ASP 107 0.418 41.416 10.468 776 HA ASP 107 HA ASP 107 -1.229 42.081 12.621 777 HB2 ASP 107 HB2 ASP 107 -0.871 43.263 10.432 778 HB3 ASP 107 HB3 ASP 107 -2.007 42.251 9.838 779 H LYS 108 H LYS 108 -1.242 39.586 10.326 780 HA LYS 108 HA LYS 108 -3.864 38.638 11.042 781 HB2 LYS 108 HB2 LYS 108 -2.015 37.657 9.044 782 HB3 LYS 108 HB3 LYS 108 -3.544 37.111 9.228 783 HG2 LYS 108 HG2 LYS 108 -4.446 39.009 8.343 784 HG3 LYS 108 HG3 LYS 108 -3.072 39.864 8.570 785 HD2 LYS 108 HD2 LYS 108 -2.016 38.539 6.863 786 HD3 LYS 108 HD3 LYS 108 -3.446 37.798 6.593 787 HE2 LYS 108 HE2 LYS 108 -4.396 39.733 5.768 788 HE3 LYS 108 HE3 LYS 108 -3.166 40.651 6.327 789 HZ1 LYS 108 HZ1 LYS 108 -2.975 40.376 3.973 790 HZ2 LYS 108 HZ2 LYS 108 -2.932 38.769 4.153 791 HZ3 LYS 108 HZ3 LYS 108 -1.714 39.678 4.706 792 HA PRO 109 HA PRO 109 -1.882 35.701 13.661 793 HB2 PRO 109 HB2 PRO 109 -3.690 33.783 13.924 794 HB3 PRO 109 HB3 PRO 109 -3.913 35.204 14.697 795 HG2 PRO 109 HG2 PRO 109 -5.060 34.369 12.209 796 HG3 PRO 109 HG3 PRO 109 -5.817 35.091 13.463 797 HD2 PRO 109 HD2 PRO 109 -5.067 36.489 11.401 798 HD3 PRO 109 HD3 PRO 109 -5.043 37.150 12.895 799 H LEU 110 H LEU 110 -0.111 34.974 12.724 800 HA LEU 110 HA LEU 110 -0.089 33.983 10.201 801 HB2 LEU 110 HB2 LEU 110 1.828 34.830 11.452 802 HB3 LEU 110 HB3 LEU 110 1.883 33.408 12.253 803 HG LEU 110 HG LEU 110 2.333 33.428 9.444 804 HD11 LEU 110 HD11 LEU 110 4.720 33.795 9.905 805 HD12 LEU 110 HD12 LEU 110 4.372 33.996 11.472 806 HD13 LEU 110 HD13 LEU 110 3.864 35.080 10.386 807 HD21 LEU 110 HD21 LEU 110 3.710 31.516 9.840 808 HD22 LEU 110 HD22 LEU 110 2.214 31.259 10.397 809 HD23 LEU 110 HD23 LEU 110 3.408 31.621 11.425 810 H LYS 111 H LYS 111 -0.211 32.077 13.102 811 HA LYS 111 HA LYS 111 0.146 29.683 11.829 812 HB2 LYS 111 HB2 LYS 111 -1.206 30.260 14.311 813 HB3 LYS 111 HB3 LYS 111 -1.004 28.718 13.812 814 HG2 LYS 111 HG2 LYS 111 1.432 29.373 13.699 815 HG3 LYS 111 HG3 LYS 111 0.978 30.541 14.747 816 HD2 LYS 111 HD2 LYS 111 0.539 27.744 15.263 817 HD3 LYS 111 HD3 LYS 111 1.855 28.541 15.810 818 HE2 LYS 111 HE2 LYS 111 0.421 29.958 17.097 819 HE3 LYS 111 HE3 LYS 111 -0.860 29.074 16.601 820 HZ1 LYS 111 HZ1 LYS 111 -0.119 28.308 18.739 821 HZ2 LYS 111 HZ2 LYS 111 1.350 28.014 18.131 822 HZ3 LYS 111 HZ3 LYS 111 0.082 27.139 17.640 823 H ARG 112 H ARG 112 -2.812 31.447 12.229 824 HA ARG 112 HA ARG 112 -4.354 29.429 11.052 825 HB2 ARG 112 HB2 ARG 112 -4.904 31.939 12.105 826 HB3 ARG 112 HB3 ARG 112 -5.732 31.738 10.711 827 HG2 ARG 112 HG2 ARG 112 -7.206 31.002 12.243 828 HG3 ARG 112 HG3 ARG 112 -6.519 29.609 11.740 829 HD2 ARG 112 HD2 ARG 112 -6.570 29.484 14.049 830 HD3 ARG 112 HD3 ARG 112 -5.013 29.795 13.665 831 HE ARG 112 HE ARG 112 -6.228 32.229 14.051 832 HH11 ARG 112 HH11 ARG 112 -6.047 33.379 15.929 833 HH12 ARG 112 HH12 ARG 112 -5.581 32.596 17.403 834 HH21 ARG 112 HH21 ARG 112 -5.295 29.458 16.008 835 HH22 ARG 112 HH22 ARG 112 -5.162 30.411 17.448 836 H ALA 113 H ALA 113 -2.742 32.227 9.917 837 HA ALA 113 HA ALA 113 -4.001 32.222 7.427 838 HB1 ALA 113 HB1 ALA 113 -3.209 34.312 8.472 839 HB2 ALA 113 HB2 ALA 113 -2.571 34.184 6.992 840 HB3 ALA 113 HB3 ALA 113 -1.681 33.815 8.291 841 H ASP 114 H ASP 114 -1.580 30.330 8.478 842 HA ASP 114 HA ASP 114 0.129 30.480 6.307 843 HB2 ASP 114 HB2 ASP 114 0.823 29.558 8.446 844 HB3 ASP 114 HB3 ASP 114 -0.218 28.315 8.248 845 H PHE 115 H PHE 115 -2.565 28.384 6.890 846 HA PHE 115 HA PHE 115 -2.229 27.443 4.219 847 HB2 PHE 115 HB2 PHE 115 -2.825 25.204 4.830 848 HB3 PHE 115 HB3 PHE 115 -1.561 25.682 5.746 849 HD1 PHE 115 HD1 PHE 115 -1.897 26.253 8.142 850 HD2 PHE 115 HD2 PHE 115 -4.933 24.630 5.808 851 HE1 PHE 115 HE1 PHE 115 -3.128 25.708 10.141 852 HE2 PHE 115 HE2 PHE 115 -6.171 24.063 7.800 853 HZ PHE 115 HZ PHE 115 -5.263 24.592 9.974 854 H GLU 116 H GLU 116 -4.050 26.523 3.063 855 HA GLU 116 HA GLU 116 -6.597 27.363 4.132 856 HB2 GLU 116 HB2 GLU 116 -5.711 27.628 1.399 857 HB3 GLU 116 HB3 GLU 116 -7.295 27.710 1.789 858 HG2 GLU 116 HG2 GLU 116 -5.380 29.533 2.879 859 HG3 GLU 116 HG3 GLU 116 -6.168 29.844 1.482 860 H LEU 117 H LEU 117 -8.349 25.847 3.828 861 HA LEU 117 HA LEU 117 -7.568 23.218 3.098 862 HB2 LEU 117 HB2 LEU 117 -9.187 23.486 4.788 863 HB3 LEU 117 HB3 LEU 117 -10.188 24.232 3.735 864 HG LEU 117 HG LEU 117 -10.269 22.090 2.528 865 HD11 LEU 117 HD11 LEU 117 -9.782 20.114 3.783 866 HD12 LEU 117 HD12 LEU 117 -9.189 21.020 4.985 867 HD13 LEU 117 HD13 LEU 117 -8.436 20.980 3.555 868 HD21 LEU 117 HD21 LEU 117 -11.999 21.232 3.982 869 HD22 LEU 117 HD22 LEU 117 -12.137 22.837 3.843 870 HD23 LEU 117 HD23 LEU 117 -11.474 22.195 5.170 871 H ILE 118 H ILE 118 -7.359 22.611 0.948 872 HA ILE 118 HA ILE 118 -8.850 24.166 -0.955 873 HB ILE 118 HB ILE 118 -6.384 23.812 -1.178 874 HG12 ILE 118 HG12 ILE 118 -6.463 23.729 -3.591 875 HG13 ILE 118 HG13 ILE 118 -8.061 23.411 -3.482 876 HG21 ILE 118 HG21 ILE 118 -5.673 21.822 -2.325 877 HG22 ILE 118 HG22 ILE 118 -7.173 21.227 -2.227 878 HG23 ILE 118 HG23 ILE 118 -6.301 21.446 -0.883 879 HD11 ILE 118 HD11 ILE 118 -7.722 25.728 -3.980 880 HD12 ILE 118 HD12 ILE 118 -6.838 25.903 -2.637 881 HD13 ILE 118 HD13 ILE 118 -8.421 25.588 -2.529 882 H GLY 119 H GLY 119 -9.160 21.327 0.642 883 HA2 GLY 119 HA2 GLY 119 -11.580 20.761 -0.356 884 HA3 GLY 119 HA3 GLY 119 -10.581 19.928 -1.343 885 H ALA 120 H ALA 120 -12.564 18.726 0.193 886 HA ALA 120 HA ALA 120 -10.949 16.948 1.751 887 HB1 ALA 120 HB1 ALA 120 -11.736 18.494 3.420 888 HB2 ALA 120 HB2 ALA 120 -12.457 17.066 3.658 889 HB3 ALA 120 HB3 ALA 120 -13.262 18.268 2.936 890 H VAL 121 H VAL 121 -11.712 14.820 1.745 891 HA VAL 121 HA VAL 121 -14.250 14.414 0.472 892 HB VAL 121 HB VAL 121 -11.906 12.830 -0.205 893 HG11 VAL 121 HG11 VAL 121 -13.303 11.731 -1.847 894 HG12 VAL 121 HG12 VAL 121 -14.576 12.592 -1.344 895 HG13 VAL 121 HG13 VAL 121 -13.905 11.494 -0.365 896 HG21 VAL 121 HG21 VAL 121 -12.021 13.839 -2.393 897 HG22 VAL 121 HG22 VAL 121 -11.781 14.977 -1.269 898 HG23 VAL 121 HG23 VAL 121 -13.253 14.765 -1.903 899 HA PRO 122 HA PRO 122 -14.020 11.814 4.091 900 HB2 PRO 122 HB2 PRO 122 -16.509 11.791 4.874 901 HB3 PRO 122 HB3 PRO 122 -15.634 13.141 5.155 902 HG2 PRO 122 HG2 PRO 122 -17.454 12.657 3.008 903 HG3 PRO 122 HG3 PRO 122 -17.377 13.972 3.974 904 HD2 PRO 122 HD2 PRO 122 -16.245 13.977 1.606 905 HD3 PRO 122 HD3 PRO 122 -15.611 14.846 2.835 906 H HIS 123 H HIS 123 -14.622 9.626 4.544 907 HA HIS 123 HA HIS 123 -15.509 8.274 2.102 908 HB2 HIS 123 HB2 HIS 123 -13.380 7.635 2.907 909 HB3 HIS 123 HB3 HIS 123 -14.022 7.296 4.370 910 HD1 HIS 123 HD1 HIS 123 -15.836 5.228 4.415 911 HD2 HIS 123 HD2 HIS 123 -13.187 5.456 1.299 912 HE1 HIS 123 HE1 HIS 123 -15.715 2.997 3.320 913 HE2 HIS 123 HE2 HIS 123 -14.131 3.115 1.428 914 H ASP 124 H ASP 124 -17.712 8.670 2.319 915 HA ASP 124 HA ASP 124 -18.917 7.747 4.769 916 HB2 ASP 124 HB2 ASP 124 -20.086 9.404 2.685 917 HB3 ASP 124 HB3 ASP 124 -20.869 9.004 4.061 918 H GLY 125 H GLY 125 -18.597 7.131 1.488 919 HA2 GLY 125 HA2 GLY 125 -19.348 4.789 0.945 920 HA3 GLY 125 HA3 GLY 125 -20.823 5.279 1.446 921 H SER 126 H SER 126 -21.770 4.945 -0.617 922 HA SER 126 HA SER 126 -22.444 5.633 -2.610 923 HB2 SER 126 HB2 SER 126 -21.334 8.262 -1.951 924 HB3 SER 126 HB3 SER 126 -22.546 8.012 -3.016 925 HG SER 126 HG SER 126 -23.939 7.821 -1.499 926 HA PRO 127 HA PRO 127 -19.274 5.285 -5.414 927 HB2 PRO 127 HB2 PRO 127 -19.971 6.334 -7.757 928 HB3 PRO 127 HB3 PRO 127 -20.819 5.051 -7.209 929 HG2 PRO 127 HG2 PRO 127 -21.478 7.813 -6.950 930 HG3 PRO 127 HG3 PRO 127 -22.436 6.607 -7.492 931 HD2 PRO 127 HD2 PRO 127 -22.616 7.382 -5.009 932 HD3 PRO 127 HD3 PRO 127 -22.815 5.804 -5.379 933 H ALA 128 H ALA 128 -19.903 8.162 -4.270 934 HA ALA 128 HA ALA 128 -17.959 9.716 -5.466 935 HB1 ALA 128 HB1 ALA 128 -19.619 10.687 -4.016 936 HB2 ALA 128 HB2 ALA 128 -18.153 11.096 -3.470 937 HB3 ALA 128 HB3 ALA 128 -18.985 9.915 -2.745 938 H SER 129 H SER 129 -17.886 7.428 -2.889 939 HA SER 129 HA SER 129 -15.276 7.879 -2.058 940 HB2 SER 129 HB2 SER 129 -16.896 6.703 -0.681 941 HB3 SER 129 HB3 SER 129 -16.888 5.459 -1.740 942 HG SER 129 HG SER 129 -15.566 5.440 0.282 943 H ARG 130 H ARG 130 -16.529 6.042 -4.636 944 HA ARG 130 HA ARG 130 -14.307 4.414 -5.045 945 HB2 ARG 130 HB2 ARG 130 -16.473 3.967 -6.019 946 HB3 ARG 130 HB3 ARG 130 -16.250 5.225 -7.035 947 HG2 ARG 130 HG2 ARG 130 -14.473 4.073 -8.093 948 HG3 ARG 130 HG3 ARG 130 -14.656 2.823 -7.058 949 HD2 ARG 130 HD2 ARG 130 -16.734 3.631 -8.889 950 HD3 ARG 130 HD3 ARG 130 -15.675 2.436 -9.232 951 HE ARG 130 HE ARG 130 -17.900 2.283 -7.459 952 HH11 ARG 130 HH11 ARG 130 -18.482 0.295 -6.685 953 HH12 ARG 130 HH12 ARG 130 -17.426 -1.067 -6.861 954 HH21 ARG 130 HH21 ARG 130 -14.947 0.662 -8.502 955 HH22 ARG 130 HH22 ARG 130 -15.465 -0.864 -7.869 956 H ASN 131 H ASN 131 -14.976 7.651 -5.893 957 HA ASN 131 HA ASN 131 -12.920 7.798 -7.819 958 HB2 ASN 131 HB2 ASN 131 -14.465 9.906 -6.565 959 HB3 ASN 131 HB3 ASN 131 -13.383 10.206 -7.750 960 HD21 ASN 131 HD21 ASN 131 -17.030 9.541 -8.783 961 HD22 ASN 131 HD22 ASN 131 -16.462 10.170 -7.272 962 H LEU 132 H LEU 132 -10.857 7.425 -7.104 963 HA LEU 132 HA LEU 132 -10.044 8.666 -4.666 964 HB2 LEU 132 HB2 LEU 132 -9.298 6.406 -5.857 965 HB3 LEU 132 HB3 LEU 132 -8.007 7.380 -6.088 966 HG LEU 132 HG LEU 132 -9.067 6.728 -3.498 967 HD11 LEU 132 HD11 LEU 132 -7.123 5.284 -3.273 968 HD12 LEU 132 HD12 LEU 132 -6.694 5.635 -4.792 969 HD13 LEU 132 HD13 LEU 132 -8.041 4.787 -4.508 970 HD21 LEU 132 HD21 LEU 132 -7.076 7.692 -2.593 971 HD22 LEU 132 HD22 LEU 132 -7.913 8.800 -3.420 972 HD23 LEU 132 HD23 LEU 132 -6.603 8.119 -4.079 973 H SER 133 H SER 133 -9.750 9.084 -8.029 974 HA SER 133 HA SER 133 -7.615 10.978 -7.786 975 HB2 SER 133 HB2 SER 133 -7.460 9.518 -9.657 976 HB3 SER 133 HB3 SER 133 -8.931 9.995 -10.182 977 HG SER 133 HG SER 133 -7.352 11.012 -11.348 978 H HIS 134 H HIS 134 -7.804 13.186 -8.169 979 HA HIS 134 HA HIS 134 -10.454 14.158 -8.532 980 HB2 HIS 134 HB2 HIS 134 -8.853 14.637 -6.169 981 HB3 HIS 134 HB3 HIS 134 -10.017 15.708 -6.574 982 HD1 HIS 134 HD1 HIS 134 -9.564 12.260 -5.256 983 HD2 HIS 134 HD2 HIS 134 -12.609 14.897 -6.014 984 HE1 HIS 134 HE1 HIS 134 -11.660 11.362 -4.263 985 HE2 HIS 134 HE2 HIS 134 -13.508 12.928 -4.718 986 H HIS 135 H HIS 135 -10.754 16.244 -9.234 987 HA HIS 135 HA HIS 135 -8.445 17.518 -10.364 988 HB2 HIS 135 HB2 HIS 135 -11.260 18.138 -10.548 989 HB3 HIS 135 HB3 HIS 135 -10.107 19.024 -11.292 990 HD1 HIS 135 HD1 HIS 135 -9.200 18.264 -13.551 991 HD2 HIS 135 HD2 HIS 135 -11.691 15.574 -11.727 992 HE1 HIS 135 HE1 HIS 135 -9.703 16.440 -15.164 993 HE2 HIS 135 HE2 HIS 135 -11.211 14.807 -14.087 994 H ILE 136 H ILE 136 -7.438 19.265 -9.312 995 HA ILE 136 HA ILE 136 -8.997 20.588 -7.282 996 HB ILE 136 HB ILE 136 -6.217 19.834 -6.949 997 HG12 ILE 136 HG12 ILE 136 -7.231 19.141 -4.675 998 HG13 ILE 136 HG13 ILE 136 -8.596 19.054 -5.567 999 HG21 ILE 136 HG21 ILE 136 -6.214 21.110 -4.853 1000 HG22 ILE 136 HG22 ILE 136 -7.715 21.620 -5.172 1001 HG23 ILE 136 HG23 ILE 136 -6.482 22.106 -6.098 1002 HD11 ILE 136 HD11 ILE 136 -7.619 16.908 -5.357 1003 HD12 ILE 136 HD12 ILE 136 -6.249 17.446 -6.027 1004 HD13 ILE 136 HD13 ILE 136 -7.600 17.359 -6.910 1005 H TYR 137 H TYR 137 -9.101 22.824 -7.710 1006 HA TYR 137 HA TYR 137 -7.461 23.862 -9.743 1007 HB2 TYR 137 HB2 TYR 137 -9.603 24.782 -9.524 1008 HB3 TYR 137 HB3 TYR 137 -9.268 25.278 -8.005 1009 HD1 TYR 137 HD1 TYR 137 -8.170 27.381 -7.604 1010 HD2 TYR 137 HD2 TYR 137 -8.403 25.879 -11.478 1011 HE1 TYR 137 HE1 TYR 137 -7.316 29.465 -8.465 1012 HE2 TYR 137 HE2 TYR 137 -7.529 27.967 -12.334 1013 HH TYR 137 HH TYR 137 -6.711 30.004 -11.880 1014 H ILE 138 H ILE 138 -5.413 24.692 -9.512 1015 HA ILE 138 HA ILE 138 -4.605 25.291 -6.821 1016 HB ILE 138 HB ILE 138 -2.889 24.520 -9.045 1017 HG12 ILE 138 HG12 ILE 138 -4.106 22.679 -8.166 1018 HG13 ILE 138 HG13 ILE 138 -2.504 22.498 -7.904 1019 HG21 ILE 138 HG21 ILE 138 -1.049 24.520 -7.498 1020 HG22 ILE 138 HG22 ILE 138 -2.022 25.081 -6.335 1021 HG23 ILE 138 HG23 ILE 138 -1.677 26.005 -7.616 1022 HD11 ILE 138 HD11 ILE 138 -3.733 21.812 -5.950 1023 HD12 ILE 138 HD12 ILE 138 -4.410 23.277 -5.843 1024 HD13 ILE 138 HD13 ILE 138 -2.824 23.098 -5.584 1025 HA PRO 139 HA PRO 139 -4.383 29.324 -8.614 1026 HB2 PRO 139 HB2 PRO 139 -4.386 30.828 -6.430 1027 HB3 PRO 139 HB3 PRO 139 -5.790 30.122 -6.873 1028 HG2 PRO 139 HG2 PRO 139 -3.906 29.199 -4.942 1029 HG3 PRO 139 HG3 PRO 139 -5.525 29.335 -4.773 1030 HD2 PRO 139 HD2 PRO 139 -4.454 27.027 -5.374 1031 HD3 PRO 139 HD3 PRO 139 -5.925 27.427 -5.960 1032 H GLU 140 H GLU 140 -2.838 31.027 -8.800 1033 HA GLU 140 HA GLU 140 -0.341 30.498 -7.413 1034 HB2 GLU 140 HB2 GLU 140 -0.103 29.818 -9.678 1035 HB3 GLU 140 HB3 GLU 140 -0.476 31.336 -10.152 1036 HG2 GLU 140 HG2 GLU 140 1.569 31.669 -8.469 1037 HG3 GLU 140 HG3 GLU 140 1.983 30.350 -9.340 1038 H ASP 141 H ASP 141 -0.163 32.225 -6.002 1039 HA ASP 141 HA ASP 141 -1.469 34.652 -6.709 1040 HB2 ASP 141 HB2 ASP 141 -1.053 35.334 -4.446 1041 HB3 ASP 141 HB3 ASP 141 -1.699 33.834 -4.449 1042 H ARG 142 H ARG 142 1.641 33.385 -6.313 1043 HA ARG 142 HA ARG 142 2.958 35.636 -7.481 1044 HB2 ARG 142 HB2 ARG 142 3.702 34.748 -4.828 1045 HB3 ARG 142 HB3 ARG 142 4.587 35.791 -5.720 1046 HG2 ARG 142 HG2 ARG 142 2.933 37.424 -5.524 1047 HG3 ARG 142 HG3 ARG 142 1.950 36.378 -4.746 1048 HD2 ARG 142 HD2 ARG 142 3.666 36.284 -2.996 1049 HD3 ARG 142 HD3 ARG 142 4.340 37.583 -3.720 1050 HE ARG 142 HE ARG 142 1.655 38.127 -3.314 1051 HH11 ARG 142 HH11 ARG 142 0.939 39.411 -1.669 1052 HH12 ARG 142 HH12 ARG 142 1.956 39.756 -0.310 1053 HH21 ARG 142 HH21 ARG 142 4.618 37.882 -1.429 1054 HH22 ARG 142 HH22 ARG 142 4.003 38.906 -0.175 1055 H LEU 143 H LEU 143 5.227 34.923 -8.080 1056 HA LEU 143 HA LEU 143 5.276 32.123 -8.559 1057 HB2 LEU 143 HB2 LEU 143 7.140 32.480 -9.878 1058 HB3 LEU 143 HB3 LEU 143 6.005 33.591 -10.258 1059 HG LEU 143 HG LEU 143 8.276 34.295 -8.681 1060 HD11 LEU 143 HD11 LEU 143 9.323 35.000 -10.779 1061 HD12 LEU 143 HD12 LEU 143 8.065 34.402 -11.599 1062 HD13 LEU 143 HD13 LEU 143 9.062 33.404 -10.809 1063 HD21 LEU 143 HD21 LEU 143 7.846 36.523 -9.425 1064 HD22 LEU 143 HD22 LEU 143 6.557 35.935 -8.645 1065 HD23 LEU 143 HD23 LEU 143 6.563 36.004 -10.261 1066 H GLY 144 H GLY 144 6.545 30.601 -7.518 1067 HA2 GLY 144 HA2 GLY 144 8.711 30.698 -6.119 1068 HA3 GLY 144 HA3 GLY 144 7.754 31.529 -5.089 1069 H TYR 145 H TYR 145 8.587 29.582 -3.711 1070 HA TYR 145 HA TYR 145 7.305 27.175 -4.432 1071 HB2 TYR 145 HB2 TYR 145 8.445 26.258 -2.461 1072 HB3 TYR 145 HB3 TYR 145 9.461 26.939 -3.544 1073 HD1 TYR 145 HD1 TYR 145 10.611 29.068 -3.032 1074 HD2 TYR 145 HD2 TYR 145 8.166 27.202 -0.228 1075 HE1 TYR 145 HE1 TYR 145 11.486 30.514 -1.300 1076 HE2 TYR 145 HE2 TYR 145 9.055 28.634 1.499 1077 HH TYR 145 HH TYR 145 10.950 31.392 0.874 1078 H HIS 146 H HIS 146 5.686 26.112 -3.617 1079 HA HIS 146 HA HIS 146 4.167 27.253 -1.421 1080 HB2 HIS 146 HB2 HIS 146 3.068 26.290 -3.908 1081 HB3 HIS 146 HB3 HIS 146 2.163 26.649 -2.597 1082 HD1 HIS 146 HD1 HIS 146 4.556 28.487 -4.877 1083 HD2 HIS 146 HD2 HIS 146 1.129 29.138 -2.724 1084 HE1 HIS 146 HE1 HIS 146 3.736 30.784 -5.372 1085 HE2 HIS 146 HE2 HIS 146 1.687 31.205 -4.067 1086 H VAL 147 H VAL 147 2.955 25.386 -0.306 1087 HA VAL 147 HA VAL 147 4.018 22.824 -1.116 1088 HB VAL 147 HB VAL 147 3.400 23.449 1.659 1089 HG11 VAL 147 HG11 VAL 147 4.597 21.437 2.185 1090 HG12 VAL 147 HG12 VAL 147 4.851 21.171 0.611 1091 HG13 VAL 147 HG13 VAL 147 3.351 21.104 1.210 1092 HG21 VAL 147 HG21 VAL 147 5.772 23.666 2.063 1093 HG22 VAL 147 HG22 VAL 147 5.290 24.795 1.011 1094 HG23 VAL 147 HG23 VAL 147 6.064 23.476 0.484 1095 H ILE 148 H ILE 148 2.530 21.187 -1.481 1096 HA ILE 148 HA ILE 148 -0.211 21.770 -0.764 1097 HB ILE 148 HB ILE 148 0.688 19.791 -2.683 1098 HG12 ILE 148 HG12 ILE 148 -0.644 22.305 -3.122 1099 HG13 ILE 148 HG13 ILE 148 0.910 21.985 -3.509 1100 HG21 ILE 148 HG21 ILE 148 -1.673 19.405 -3.136 1101 HG22 ILE 148 HG22 ILE 148 -2.076 20.445 -1.965 1102 HG23 ILE 148 HG23 ILE 148 -1.359 19.045 -1.591 1103 HD11 ILE 148 HD11 ILE 148 -0.450 21.929 -5.476 1104 HD12 ILE 148 HD12 ILE 148 -1.374 20.774 -4.822 1105 HD13 ILE 148 HD13 ILE 148 0.165 20.458 -5.206 1106 H LEU 149 H LEU 149 -1.102 20.601 0.932 1107 HA LEU 149 HA LEU 149 0.512 18.443 1.979 1108 HB2 LEU 149 HB2 LEU 149 -1.247 20.183 3.470 1109 HB3 LEU 149 HB3 LEU 149 -0.333 19.003 4.133 1110 HG LEU 149 HG LEU 149 1.542 20.464 3.164 1111 HD11 LEU 149 HD11 LEU 149 1.069 22.806 3.496 1112 HD12 LEU 149 HD12 LEU 149 -0.478 22.451 3.806 1113 HD13 LEU 149 HD13 LEU 149 0.127 22.208 2.326 1114 HD21 LEU 149 HD21 LEU 149 1.807 21.370 5.401 1115 HD22 LEU 149 HD22 LEU 149 1.401 19.807 5.478 1116 HD23 LEU 149 HD23 LEU 149 0.285 20.946 5.746 1117 H ALA 150 H ALA 150 -0.490 16.417 2.232 1118 HA ALA 150 HA ALA 150 -3.370 16.402 2.050 1119 HB1 ALA 150 HB1 ALA 150 -2.553 15.746 -0.119 1120 HB2 ALA 150 HB2 ALA 150 -3.273 14.475 0.575 1121 HB3 ALA 150 HB3 ALA 150 -1.659 14.579 0.555 1122 H VAL 151 H VAL 151 -4.455 14.913 3.374 1123 HA VAL 151 HA VAL 151 -2.726 13.204 4.914 1124 HB VAL 151 HB VAL 151 -4.956 14.656 6.066 1125 HG11 VAL 151 HG11 VAL 151 -4.265 13.766 8.207 1126 HG12 VAL 151 HG12 VAL 151 -3.111 12.900 7.475 1127 HG13 VAL 151 HG13 VAL 151 -4.669 12.560 7.208 1128 HG21 VAL 151 HG21 VAL 151 -3.320 15.916 7.312 1129 HG22 VAL 151 HG22 VAL 151 -3.108 16.137 5.724 1130 HG23 VAL 151 HG23 VAL 151 -2.133 15.137 6.538 1131 H TRP 152 H TRP 152 -3.324 11.113 5.101 1132 HA TRP 152 HA TRP 152 -5.940 10.351 4.094 1133 HB2 TRP 152 HB2 TRP 152 -4.083 9.680 2.702 1134 HB3 TRP 152 HB3 TRP 152 -3.465 8.849 3.965 1135 HD1 TRP 152 HD1 TRP 152 -6.952 8.626 2.558 1136 HE1 TRP 152 HE1 TRP 152 -7.563 6.274 1.949 1137 HE3 TRP 152 HE3 TRP 152 -2.551 6.526 3.673 1138 HZ2 TRP 152 HZ2 TRP 152 -6.191 3.811 1.934 1139 HZ3 TRP 152 HZ3 TRP 152 -2.263 4.146 3.310 1140 HH2 TRP 152 HH2 TRP 152 -4.074 2.815 2.428 1141 H ASP 153 H ASP 153 -7.282 9.782 5.746 1142 HA ASP 153 HA ASP 153 -6.051 8.738 8.106 1143 HB2 ASP 153 HB2 ASP 153 -8.665 9.896 7.680 1144 HB3 ASP 153 HB3 ASP 153 -8.320 9.143 9.087 1145 H VAL 154 H VAL 154 -5.651 6.582 7.662 1146 HA VAL 154 HA VAL 154 -7.494 4.875 6.515 1147 HB VAL 154 HB VAL 154 -5.315 4.083 8.310 1148 HG11 VAL 154 HG11 VAL 154 -5.270 1.989 7.143 1149 HG12 VAL 154 HG12 VAL 154 -6.522 2.461 6.235 1150 HG13 VAL 154 HG13 VAL 154 -6.721 2.216 7.821 1151 HG21 VAL 154 HG21 VAL 154 -3.897 3.937 6.355 1152 HG22 VAL 154 HG22 VAL 154 -4.425 5.455 6.537 1153 HG23 VAL 154 HG23 VAL 154 -5.107 4.489 5.434 1154 H ALA 155 H ALA 155 -9.013 3.360 7.357 1155 HA ALA 155 HA ALA 155 -9.749 3.950 10.061 1156 HB1 ALA 155 HB1 ALA 155 -11.509 4.265 8.414 1157 HB2 ALA 155 HB2 ALA 155 -11.965 3.128 9.469 1158 HB3 ALA 155 HB3 ALA 155 -11.414 2.703 8.009 1159 H ASP 156 H ASP 156 -8.506 1.441 8.188 1160 HA ASP 156 HA ASP 156 -9.404 -0.656 9.767 1161 HB2 ASP 156 HB2 ASP 156 -7.192 -0.566 7.869 1162 HB3 ASP 156 HB3 ASP 156 -7.638 -1.969 8.576 1163 H THR 157 H THR 157 -6.895 1.519 10.146 1164 HA THR 157 HA THR 157 -5.711 -0.070 12.191 1165 HB THR 157 HB THR 157 -3.431 0.611 11.408 1166 HG1 THR 157 HG1 THR 157 -4.047 1.304 8.970 1167 HG21 THR 157 HG21 THR 157 -3.305 -0.811 9.483 1168 HG22 THR 157 HG22 THR 157 -4.914 -0.774 9.327 1169 HG23 THR 157 HG23 THR 157 -4.242 -1.527 10.590 1170 H GLU 158 H GLU 158 -4.129 1.186 13.585 1171 HA GLU 158 HA GLU 158 -5.281 3.640 14.392 1172 HB2 GLU 158 HB2 GLU 158 -4.044 1.778 15.682 1173 HB3 GLU 158 HB3 GLU 158 -2.749 2.726 15.376 1174 HG2 GLU 158 HG2 GLU 158 -3.812 4.492 16.587 1175 HG3 GLU 158 HG3 GLU 158 -5.020 3.461 16.968 1176 H ASN 159 H ASN 159 -3.824 3.270 11.774 1177 HA ASN 159 HA ASN 159 -1.772 5.227 12.121 1178 HB2 ASN 159 HB2 ASN 159 -2.001 3.260 9.980 1179 HB3 ASN 159 HB3 ASN 159 -0.718 4.253 10.169 1180 HD21 ASN 159 HD21 ASN 159 -0.222 0.770 11.524 1181 HD22 ASN 159 HD22 ASN 159 -1.047 1.309 10.100 1182 H ALA 160 H ALA 160 -1.329 6.783 10.458 1183 HA ALA 160 HA ALA 160 -3.268 7.147 8.371 1184 HB1 ALA 160 HB1 ALA 160 -4.318 8.398 10.068 1185 HB2 ALA 160 HB2 ALA 160 -3.710 9.426 8.979 1186 HB3 ALA 160 HB3 ALA 160 -2.942 9.188 10.382 1187 H PHE 161 H PHE 161 -2.354 9.056 6.918 1188 HA PHE 161 HA PHE 161 0.389 9.498 7.564 1189 HB2 PHE 161 HB2 PHE 161 0.121 7.637 5.903 1190 HB3 PHE 161 HB3 PHE 161 -0.184 8.830 4.830 1191 HD1 PHE 161 HD1 PHE 161 1.589 10.258 4.000 1192 HD2 PHE 161 HD2 PHE 161 2.361 7.348 6.865 1193 HE1 PHE 161 HE1 PHE 161 3.954 10.542 3.637 1194 HE2 PHE 161 HE2 PHE 161 4.729 7.601 6.496 1195 HZ PHE 161 HZ PHE 161 5.532 9.203 4.879 1196 H TYR 162 H TYR 162 1.334 11.362 6.992 1197 HA TYR 162 HA TYR 162 -0.370 13.326 5.686 1198 HB2 TYR 162 HB2 TYR 162 1.472 14.707 6.977 1199 HB3 TYR 162 HB3 TYR 162 -0.072 14.512 7.472 1200 HD1 TYR 162 HD1 TYR 162 3.309 13.679 8.180 1201 HD2 TYR 162 HD2 TYR 162 -0.623 12.782 9.216 1202 HE1 TYR 162 HE1 TYR 162 4.087 12.532 10.161 1203 HE2 TYR 162 HE2 TYR 162 0.163 11.615 11.183 1204 HH TYR 162 HH TYR 162 2.733 11.922 12.666 1205 H GLN 163 H GLN 163 0.329 13.823 3.675 1206 HA GLN 163 HA GLN 163 3.090 13.209 2.964 1207 HB2 GLN 163 HB2 GLN 163 1.346 11.677 2.124 1208 HB3 GLN 163 HB3 GLN 163 0.845 12.922 1.193 1209 HG2 GLN 163 HG2 GLN 163 3.511 11.918 0.976 1210 HG3 GLN 163 HG3 GLN 163 2.289 11.249 0.124 1211 HE21 GLN 163 HE21 GLN 163 4.205 14.134 -1.525 1212 HE22 GLN 163 HE22 GLN 163 4.784 13.023 -0.328 1213 H VAL 164 H VAL 164 4.205 14.931 2.006 1214 HA VAL 164 HA VAL 164 2.530 17.100 1.169 1215 HB VAL 164 HB VAL 164 4.137 18.717 2.055 1216 HG11 VAL 164 HG11 VAL 164 3.627 18.416 4.405 1217 HG12 VAL 164 HG12 VAL 164 3.173 16.892 4.112 1218 HG13 VAL 164 HG13 VAL 164 2.309 18.122 3.515 1219 HG21 VAL 164 HG21 VAL 164 5.916 18.007 3.489 1220 HG22 VAL 164 HG22 VAL 164 6.125 17.409 2.002 1221 HG23 VAL 164 HG23 VAL 164 5.554 16.462 3.181 1222 H ILE 165 H ILE 165 3.180 18.402 -0.604 1223 HA ILE 165 HA ILE 165 5.482 17.379 -1.973 1224 HB ILE 165 HB ILE 165 3.007 18.062 -3.382 1225 HG12 ILE 165 HG12 ILE 165 4.159 15.436 -3.151 1226 HG13 ILE 165 HG13 ILE 165 2.905 15.950 -2.240 1227 HG21 ILE 165 HG21 ILE 165 4.144 17.321 -5.414 1228 HG22 ILE 165 HG22 ILE 165 5.493 17.047 -4.565 1229 HG23 ILE 165 HG23 ILE 165 4.957 18.559 -4.765 1230 HD11 ILE 165 HD11 ILE 165 2.098 14.580 -4.042 1231 HD12 ILE 165 HD12 ILE 165 2.775 15.576 -5.121 1232 HD13 ILE 165 HD13 ILE 165 1.533 16.084 -4.218 1233 H ASP 166 H ASP 166 6.971 18.962 -2.241 1234 HA ASP 166 HA ASP 166 6.238 21.656 -2.022 1235 HB2 ASP 166 HB2 ASP 166 8.697 20.312 -2.491 1236 HB3 ASP 166 HB3 ASP 166 8.634 21.876 -2.958 1237 H VAL 167 H VAL 167 5.431 22.934 -3.656 1238 HA VAL 167 HA VAL 167 6.215 22.206 -6.320 1239 HB VAL 167 HB VAL 167 4.001 23.150 -7.057 1240 HG11 VAL 167 HG11 VAL 167 2.908 21.003 -6.788 1241 HG12 VAL 167 HG12 VAL 167 4.009 20.582 -5.682 1242 HG13 VAL 167 HG13 VAL 167 4.450 20.786 -7.224 1243 HG21 VAL 167 HG21 VAL 167 2.206 23.006 -5.451 1244 HG22 VAL 167 HG22 VAL 167 3.292 24.103 -4.969 1245 HG23 VAL 167 HG23 VAL 167 3.269 22.636 -4.290 1246 H ASP 168 H ASP 168 7.323 23.702 -7.396 1247 HA ASP 168 HA ASP 168 7.409 26.400 -6.370 1248 HB2 ASP 168 HB2 ASP 168 9.416 25.310 -7.046 1249 HB3 ASP 168 HB3 ASP 168 8.863 25.327 -8.582 1250 H LEU 169 H LEU 169 5.374 27.258 -6.788 1251 HA LEU 169 HA LEU 169 4.195 26.774 -9.343 1252 HB2 LEU 169 HB2 LEU 169 3.129 28.202 -7.095 1253 HB3 LEU 169 HB3 LEU 169 2.309 27.964 -8.487 1254 HG LEU 169 HG LEU 169 3.094 25.837 -6.724 1255 HD11 LEU 169 HD11 LEU 169 0.768 25.787 -6.072 1256 HD12 LEU 169 HD12 LEU 169 0.480 27.071 -7.011 1257 HD13 LEU 169 HD13 LEU 169 1.416 27.222 -5.701 1258 HD21 LEU 169 HD21 LEU 169 1.637 24.450 -8.026 1259 HD22 LEU 169 HD22 LEU 169 2.813 25.049 -8.961 1260 HD23 LEU 169 HD23 LEU 169 1.330 25.691 -9.017 1261 H VAL 170 H VAL 170 4.571 28.141 -11.031 1262 HA VAL 170 HA VAL 170 5.175 30.823 -10.331 1263 HB VAL 170 HB VAL 170 7.057 30.902 -11.870 1264 HG11 VAL 170 HG11 VAL 170 8.630 29.484 -10.678 1265 HG12 VAL 170 HG12 VAL 170 7.396 28.691 -9.998 1266 HG13 VAL 170 HG13 VAL 170 7.661 30.243 -9.630 1267 HG21 VAL 170 HG21 VAL 170 7.839 28.897 -12.985 1268 HG22 VAL 170 HG22 VAL 170 6.342 29.260 -13.475 1269 HG23 VAL 170 HG23 VAL 170 6.576 28.078 -12.396 1270 H ASN 171 H ASN 171 5.073 32.443 -12.077 1271 HA ASN 171 HA ASN 171 2.932 31.917 -13.840 1272 HB2 ASN 171 HB2 ASN 171 3.248 34.094 -12.909 1273 HB3 ASN 171 HB3 ASN 171 4.639 34.242 -13.752 1274 HD21 ASN 171 HD21 ASN 171 2.897 35.978 -16.161 1275 HD22 ASN 171 HD22 ASN 171 4.129 36.025 -14.944 1276 H LYS 172 H LYS 172 3.088 32.099 -16.206 1277 HA LYS 172 HA LYS 172 5.433 30.839 -17.195 1278 HB2 LYS 172 HB2 LYS 172 4.218 30.612 -19.230 1279 HB3 LYS 172 HB3 LYS 172 3.272 30.143 -17.984 1280 HG2 LYS 172 HG2 LYS 172 2.127 32.199 -18.051 1281 HG3 LYS 172 HG3 LYS 172 3.105 32.722 -19.250 1282 HD2 LYS 172 HD2 LYS 172 2.259 30.966 -20.633 1283 HD3 LYS 172 HD3 LYS 172 1.201 30.591 -19.446 1284 HE2 LYS 172 HE2 LYS 172 0.241 32.752 -19.603 1285 HE3 LYS 172 HE3 LYS 172 1.319 33.157 -20.761 1286 HZ1 LYS 172 HZ1 LYS 172 -0.760 32.598 -21.740 1287 HZ2 LYS 172 HZ2 LYS 172 -0.701 31.134 -21.057 1288 HZ3 LYS 172 HZ3 LYS 172 0.367 31.534 -22.203 Start of MODEL 6 1 H1 HIS 1 H1 HIS 1 1.411 0.763 2.362 2 H2 HIS 1 H2 HIS 1 1.157 0.421 0.802 3 H3 HIS 1 H3 HIS 1 0.023 1.196 1.656 4 HA HIS 1 HA HIS 1 1.412 3.072 1.853 5 HB2 HIS 1 HB2 HIS 1 3.313 1.542 0.299 6 HB3 HIS 1 HB3 HIS 1 3.516 3.118 0.676 7 HD1 HIS 1 HD1 HIS 1 5.497 0.749 1.519 8 HD2 HIS 1 HD2 HIS 1 2.729 2.632 3.895 9 HE1 HIS 1 HE1 HIS 1 6.129 0.412 3.906 10 HE2 HIS 1 HE2 HIS 1 4.470 1.527 5.349 11 H GLY 2 H GLY 2 1.583 4.798 0.191 12 HA2 GLY 2 HA2 GLY 2 -0.417 4.224 -1.769 13 HA3 GLY 2 HA3 GLY 2 0.109 5.707 -1.334 14 H PHE 3 H PHE 3 -0.343 5.264 -3.930 15 HA PHE 3 HA PHE 3 2.322 5.364 -5.030 16 HB2 PHE 3 HB2 PHE 3 0.122 3.994 -6.317 17 HB3 PHE 3 HB3 PHE 3 1.620 4.145 -6.951 18 HD1 PHE 3 HD1 PHE 3 3.489 2.796 -6.103 19 HD2 PHE 3 HD2 PHE 3 -0.370 2.333 -4.617 20 HE1 PHE 3 HE1 PHE 3 4.151 0.728 -5.049 21 HE2 PHE 3 HE2 PHE 3 0.286 0.280 -3.536 22 HZ PHE 3 HZ PHE 3 2.544 -0.537 -3.769 23 H ILE 4 H ILE 4 2.649 7.042 -6.536 24 HA ILE 4 HA ILE 4 0.394 8.771 -6.872 25 HB ILE 4 HB ILE 4 3.201 9.394 -7.389 26 HG12 ILE 4 HG12 ILE 4 1.552 10.398 -5.240 27 HG13 ILE 4 HG13 ILE 4 2.579 9.142 -5.052 28 HG21 ILE 4 HG21 ILE 4 2.512 11.695 -7.724 29 HG22 ILE 4 HG22 ILE 4 0.962 11.265 -7.552 30 HG23 ILE 4 HG23 ILE 4 1.806 10.753 -8.832 31 HD11 ILE 4 HD11 ILE 4 3.572 11.147 -4.189 32 HD12 ILE 4 HD12 ILE 4 3.423 11.860 -5.633 33 HD13 ILE 4 HD13 ILE 4 4.440 10.617 -5.446 34 H GLU 5 H GLU 5 -0.867 8.473 -8.591 35 HA GLU 5 HA GLU 5 0.258 7.397 -10.987 36 HB2 GLU 5 HB2 GLU 5 -2.481 7.763 -10.158 37 HB3 GLU 5 HB3 GLU 5 -2.116 7.264 -11.670 38 HG2 GLU 5 HG2 GLU 5 -1.463 5.818 -9.281 39 HG3 GLU 5 HG3 GLU 5 -2.694 5.443 -10.286 40 H LYS 6 H LYS 6 1.027 9.927 -10.299 41 HA LYS 6 HA LYS 6 1.701 11.678 -11.480 42 HB2 LYS 6 HB2 LYS 6 -0.115 11.021 -13.643 43 HB3 LYS 6 HB3 LYS 6 1.130 12.072 -13.759 44 HG2 LYS 6 HG2 LYS 6 2.691 10.388 -13.762 45 HG3 LYS 6 HG3 LYS 6 1.627 9.295 -13.178 46 HD2 LYS 6 HD2 LYS 6 0.430 9.485 -15.288 47 HD3 LYS 6 HD3 LYS 6 1.695 10.353 -15.848 48 HE2 LYS 6 HE2 LYS 6 3.139 8.517 -15.554 49 HE3 LYS 6 HE3 LYS 6 1.943 7.652 -14.854 50 HZ1 LYS 6 HZ1 LYS 6 2.247 6.955 -17.101 51 HZ2 LYS 6 HZ2 LYS 6 1.961 8.460 -17.618 52 HZ3 LYS 6 HZ3 LYS 6 0.777 7.604 -16.926 53 HA PRO 7 HA PRO 7 1.809 13.828 -12.835 54 HB2 PRO 7 HB2 PRO 7 2.077 16.386 -12.107 55 HB3 PRO 7 HB3 PRO 7 0.884 16.003 -13.155 56 HG2 PRO 7 HG2 PRO 7 0.703 16.314 -10.344 57 HG3 PRO 7 HG3 PRO 7 -0.249 16.980 -11.492 58 HD2 PRO 7 HD2 PRO 7 -1.022 14.826 -10.259 59 HD3 PRO 7 HD3 PRO 7 -1.390 15.036 -11.836 60 H GLY 8 H GLY 8 3.938 13.882 -12.592 61 HA2 GLY 8 HA2 GLY 8 5.831 14.249 -11.319 62 HA3 GLY 8 HA3 GLY 8 4.944 14.325 -9.951 63 H SER 9 H SER 9 7.393 12.929 -10.399 64 HA SER 9 HA SER 9 6.685 10.420 -9.291 65 HB2 SER 9 HB2 SER 9 6.504 9.706 -11.531 66 HB3 SER 9 HB3 SER 9 7.904 10.446 -11.929 67 HG SER 9 HG SER 9 7.509 8.041 -10.880 68 H ARG 10 H ARG 10 8.459 9.652 -7.973 69 HA ARG 10 HA ARG 10 10.673 11.395 -7.865 70 HB2 ARG 10 HB2 ARG 10 11.431 10.259 -6.027 71 HB3 ARG 10 HB3 ARG 10 9.804 10.294 -5.891 72 HG2 ARG 10 HG2 ARG 10 10.151 8.192 -5.277 73 HG3 ARG 10 HG3 ARG 10 10.009 7.950 -6.886 74 HD2 ARG 10 HD2 ARG 10 12.306 7.744 -7.148 75 HD3 ARG 10 HD3 ARG 10 12.595 8.338 -5.655 76 HE ARG 10 HE ARG 10 11.304 6.168 -4.989 77 HH11 ARG 10 HH11 ARG 10 13.900 6.537 -7.347 78 HH12 ARG 10 HH12 ARG 10 14.453 4.912 -7.110 79 HH21 ARG 10 HH21 ARG 10 12.093 4.130 -4.730 80 HH22 ARG 10 HH22 ARG 10 13.448 3.578 -5.656 81 H ALA 11 H ALA 11 9.978 8.443 -9.391 82 HA ALA 11 HA ALA 11 12.580 7.583 -9.787 83 HB1 ALA 11 HB1 ALA 11 10.692 6.086 -10.058 84 HB2 ALA 11 HB2 ALA 11 11.605 6.039 -11.392 85 HB3 ALA 11 HB3 ALA 11 10.234 6.895 -11.381 86 H ALA 12 H ALA 12 10.613 9.776 -11.529 87 HA ALA 12 HA ALA 12 12.078 9.862 -13.852 88 HB1 ALA 12 HB1 ALA 12 9.885 10.896 -13.667 89 HB2 ALA 12 HB2 ALA 12 10.933 11.982 -14.248 90 HB3 ALA 12 HB3 ALA 12 10.496 12.031 -12.691 91 H LEU 13 H LEU 13 12.524 11.548 -10.868 92 HA LEU 13 HA LEU 13 14.632 13.118 -11.933 93 HB2 LEU 13 HB2 LEU 13 13.165 13.118 -9.513 94 HB3 LEU 13 HB3 LEU 13 14.708 13.631 -9.355 95 HG LEU 13 HG LEU 13 14.285 15.384 -10.880 96 HD11 LEU 13 HD11 LEU 13 12.079 15.883 -11.667 97 HD12 LEU 13 HD12 LEU 13 11.530 14.512 -11.008 98 HD13 LEU 13 HD13 LEU 13 12.574 14.455 -12.242 99 HD21 LEU 13 HD21 LEU 13 12.841 16.685 -9.404 100 HD22 LEU 13 HD22 LEU 13 13.896 15.826 -8.530 101 HD23 LEU 13 HD23 LEU 13 12.367 15.320 -8.678 102 H CYS 14 H CYS 14 14.312 10.175 -10.464 103 HA CYS 14 HA CYS 14 16.802 9.987 -9.199 104 HB2 CYS 14 HB2 CYS 14 14.866 8.666 -8.735 105 HB3 CYS 14 HB3 CYS 14 15.069 7.925 -10.176 106 H SER 15 H SER 15 15.868 9.848 -12.386 107 HA SER 15 HA SER 15 17.631 7.957 -13.333 108 HB2 SER 15 HB2 SER 15 15.750 8.668 -14.670 109 HB3 SER 15 HB3 SER 15 16.382 10.170 -14.786 110 HG SER 15 HG SER 15 18.206 8.725 -15.725 111 H GLU 16 H GLU 16 19.636 7.950 -14.193 112 HA GLU 16 HA GLU 16 21.394 9.926 -13.477 113 HB2 GLU 16 HB2 GLU 16 21.778 7.839 -15.447 114 HB3 GLU 16 HB3 GLU 16 23.002 8.726 -14.829 115 HG2 GLU 16 HG2 GLU 16 23.210 6.948 -13.517 116 HG3 GLU 16 HG3 GLU 16 22.113 7.766 -12.625 117 H ALA 17 H ALA 17 19.286 9.803 -16.072 118 HA ALA 17 HA ALA 17 20.535 11.420 -17.892 119 HB1 ALA 17 HB1 ALA 17 18.393 10.405 -18.346 120 HB2 ALA 17 HB2 ALA 17 18.294 11.991 -18.646 121 HB3 ALA 17 HB3 ALA 17 17.686 11.387 -17.274 122 H PHE 18 H PHE 18 19.174 12.184 -14.847 123 HA PHE 18 HA PHE 18 19.765 14.983 -15.217 124 HB2 PHE 18 HB2 PHE 18 18.026 13.825 -13.212 125 HB3 PHE 18 HB3 PHE 18 18.215 15.427 -13.469 126 HD1 PHE 18 HD1 PHE 18 17.405 16.412 -15.666 127 HD2 PHE 18 HD2 PHE 18 16.374 12.591 -14.380 128 HE1 PHE 18 HE1 PHE 18 15.603 16.367 -17.270 129 HE2 PHE 18 HE2 PHE 18 14.572 12.529 -15.983 130 HZ PHE 18 HZ PHE 18 14.175 14.422 -17.429 131 H GLY 19 H GLY 19 20.743 12.207 -13.733 132 HA2 GLY 19 HA2 GLY 19 22.442 13.602 -11.845 133 HA3 GLY 19 HA3 GLY 19 21.985 12.041 -11.694 134 H PHE 20 H PHE 20 23.336 14.001 -14.230 135 HA PHE 20 HA PHE 20 24.614 11.825 -15.366 136 HB2 PHE 20 HB2 PHE 20 23.810 13.885 -16.530 137 HB3 PHE 20 HB3 PHE 20 25.170 14.617 -15.998 138 HD1 PHE 20 HD1 PHE 20 23.977 12.016 -18.185 139 HD2 PHE 20 HD2 PHE 20 27.232 14.406 -17.182 140 HE1 PHE 20 HE1 PHE 20 25.140 11.243 -20.151 141 HE2 PHE 20 HE2 PHE 20 28.411 13.636 -19.144 142 HZ PHE 20 HZ PHE 20 27.366 12.048 -20.630 143 H LEU 21 H LEU 21 25.746 14.059 -13.099 144 HA LEU 21 HA LEU 21 28.459 13.290 -13.625 145 HB2 LEU 21 HB2 LEU 21 27.492 15.439 -11.940 146 HB3 LEU 21 HB3 LEU 21 29.076 15.162 -12.225 147 HG LEU 21 HG LEU 21 27.209 16.010 -14.253 148 HD11 LEU 21 HD11 LEU 21 28.302 18.160 -14.098 149 HD12 LEU 21 HD12 LEU 21 29.216 17.606 -12.884 150 HD13 LEU 21 HD13 LEU 21 27.622 17.782 -12.680 151 HD21 LEU 21 HD21 LEU 21 29.122 16.359 -15.651 152 HD22 LEU 21 HD22 LEU 21 29.022 14.803 -15.226 153 HD23 LEU 21 HD23 LEU 21 30.085 15.774 -14.491 154 H ASN 22 H ASN 22 26.024 12.943 -11.337 155 HA ASN 22 HA ASN 22 27.470 10.958 -9.909 156 HB2 ASN 22 HB2 ASN 22 27.301 11.895 -7.764 157 HB3 ASN 22 HB3 ASN 22 28.175 12.906 -8.702 158 HD21 ASN 22 HD21 ASN 22 24.892 14.188 -6.912 159 HD22 ASN 22 HD22 ASN 22 25.566 12.610 -6.672 160 H LEU 23 H LEU 23 25.846 9.679 -8.575 161 HA LEU 23 HA LEU 23 23.304 9.840 -9.778 162 HB2 LEU 23 HB2 LEU 23 24.598 7.937 -8.386 163 HB3 LEU 23 HB3 LEU 23 23.237 8.248 -7.540 164 HG LEU 23 HG LEU 23 23.177 7.581 -10.334 165 HD11 LEU 23 HD11 LEU 23 22.587 5.328 -9.677 166 HD12 LEU 23 HD12 LEU 23 22.814 5.725 -8.126 167 HD13 LEU 23 HD13 LEU 23 24.070 5.693 -9.144 168 HD21 LEU 23 HD21 LEU 23 20.853 7.111 -9.969 169 HD22 LEU 23 HD22 LEU 23 21.179 8.649 -9.590 170 HD23 LEU 23 HD23 LEU 23 21.005 7.548 -8.419 171 H ASN 24 H ASN 24 21.633 11.050 -9.233 172 HA ASN 24 HA ASN 24 21.925 12.634 -6.873 173 HB2 ASN 24 HB2 ASN 24 20.602 14.270 -8.036 174 HB3 ASN 24 HB3 ASN 24 21.750 13.741 -9.071 175 HD21 ASN 24 HD21 ASN 24 18.188 13.731 -10.430 176 HD22 ASN 24 HD22 ASN 24 18.959 14.851 -9.357 177 H CYS 25 H CYS 25 20.523 9.947 -7.251 178 HA CYS 25 HA CYS 25 17.832 10.481 -6.900 179 HB2 CYS 25 HB2 CYS 25 18.920 8.438 -7.689 180 HB3 CYS 25 HB3 CYS 25 19.151 8.066 -6.116 181 H GLY 26 H GLY 26 20.340 10.208 -4.608 182 HA2 GLY 26 HA2 GLY 26 20.259 10.790 -2.411 183 HA3 GLY 26 HA3 GLY 26 18.664 11.121 -2.531 184 H SER 27 H SER 27 19.624 9.920 -0.212 185 HA SER 27 HA SER 27 19.253 7.131 -0.458 186 HB2 SER 27 HB2 SER 27 20.718 8.062 1.256 187 HB3 SER 27 HB3 SER 27 19.401 8.642 2.029 188 HG SER 27 HG SER 27 19.560 6.854 3.054 189 H VAL 28 H VAL 28 17.355 9.789 0.525 190 HA VAL 28 HA VAL 28 15.335 8.460 1.793 191 HB VAL 28 HB VAL 28 15.761 10.944 1.787 192 HG11 VAL 28 HG11 VAL 28 14.703 12.288 0.097 193 HG12 VAL 28 HG12 VAL 28 14.245 10.950 -0.685 194 HG13 VAL 28 HG13 VAL 28 15.814 11.321 -0.570 195 HG21 VAL 28 HG21 VAL 28 13.505 11.618 2.203 196 HG22 VAL 28 HG22 VAL 28 13.821 10.209 2.932 197 HG23 VAL 28 HG23 VAL 28 12.970 10.236 1.557 198 H MET 29 H MET 29 15.930 8.412 -1.448 199 HA MET 29 HA MET 29 13.422 8.278 -2.473 200 HB2 MET 29 HB2 MET 29 14.480 7.256 -4.390 201 HB3 MET 29 HB3 MET 29 15.463 8.416 -3.795 202 HG2 MET 29 HG2 MET 29 16.953 6.891 -4.021 203 HG3 MET 29 HG3 MET 29 16.432 6.486 -2.527 204 HE1 MET 29 HE1 MET 29 17.050 2.920 -3.677 205 HE2 MET 29 HE2 MET 29 17.162 3.948 -2.434 206 HE3 MET 29 HE3 MET 29 18.009 4.217 -3.785 207 H TYR 30 H TYR 30 14.761 6.004 -0.478 208 HA TYR 30 HA TYR 30 13.687 3.745 -1.707 209 HB2 TYR 30 HB2 TYR 30 15.578 3.496 -0.289 210 HB3 TYR 30 HB3 TYR 30 14.789 4.203 0.954 211 HD1 TYR 30 HD1 TYR 30 14.609 1.181 -1.093 212 HD2 TYR 30 HD2 TYR 30 13.899 2.855 2.648 213 HE1 TYR 30 HE1 TYR 30 13.958 -0.991 -0.237 214 HE2 TYR 30 HE2 TYR 30 13.234 0.695 3.491 215 HH TYR 30 HH TYR 30 13.077 -1.497 3.137 216 H GLU 31 H GLU 31 12.479 5.800 0.816 217 HA GLU 31 HA GLU 31 10.027 4.511 0.536 218 HB2 GLU 31 HB2 GLU 31 9.833 3.936 2.948 219 HB3 GLU 31 HB3 GLU 31 11.078 3.149 2.243 220 HG2 GLU 31 HG2 GLU 31 12.558 4.831 3.165 221 HG3 GLU 31 HG3 GLU 31 11.283 5.415 4.002 222 HA PRO 32 HA PRO 32 9.193 8.654 2.011 223 HB2 PRO 32 HB2 PRO 32 8.431 9.977 -0.164 224 HB3 PRO 32 HB3 PRO 32 10.019 9.939 0.216 225 HG2 PRO 32 HG2 PRO 32 8.628 8.280 -1.639 226 HG3 PRO 32 HG3 PRO 32 10.034 9.077 -1.870 227 HD2 PRO 32 HD2 PRO 32 10.061 6.549 -1.247 228 HD3 PRO 32 HD3 PRO 32 11.234 7.537 -0.686 229 H GLN 33 H GLN 33 7.650 6.502 -0.097 230 HA GLN 33 HA GLN 33 5.095 7.402 0.563 231 HB2 GLN 33 HB2 GLN 33 4.273 5.589 -0.717 232 HB3 GLN 33 HB3 GLN 33 5.547 6.238 -1.507 233 HG2 GLN 33 HG2 GLN 33 5.832 3.857 0.093 234 HG3 GLN 33 HG3 GLN 33 5.448 3.778 -1.492 235 HE21 GLN 33 HE21 GLN 33 9.110 3.314 -0.990 236 HE22 GLN 33 HE22 GLN 33 7.711 2.576 -0.285 237 H SER 34 H SER 34 7.156 6.004 2.538 238 HA SER 34 HA SER 34 5.140 4.425 3.891 239 HB2 SER 34 HB2 SER 34 7.218 3.249 3.352 240 HB3 SER 34 HB3 SER 34 8.017 4.288 4.326 241 HG SER 34 HG SER 34 6.808 3.532 6.063 242 H LEU 35 H LEU 35 4.381 6.719 4.396 243 HA LEU 35 HA LEU 35 5.612 7.521 6.887 244 HB2 LEU 35 HB2 LEU 35 5.644 9.098 4.949 245 HB3 LEU 35 HB3 LEU 35 4.072 9.348 5.317 246 HG LEU 35 HG LEU 35 6.253 9.957 7.083 247 HD11 LEU 35 HD11 LEU 35 5.759 12.283 6.525 248 HD12 LEU 35 HD12 LEU 35 4.624 11.784 5.486 249 HD13 LEU 35 HD13 LEU 35 6.184 11.475 5.191 250 HD21 LEU 35 HD21 LEU 35 4.685 11.103 8.460 251 HD22 LEU 35 HD22 LEU 35 4.318 9.531 8.367 252 HD23 LEU 35 HD23 LEU 35 3.478 10.610 7.504 253 H GLU 36 H GLU 36 4.488 6.731 8.544 254 HA GLU 36 HA GLU 36 1.616 7.126 8.500 255 HB2 GLU 36 HB2 GLU 36 2.990 4.784 9.448 256 HB3 GLU 36 HB3 GLU 36 1.444 5.106 9.863 257 HG2 GLU 36 HG2 GLU 36 0.799 4.979 7.603 258 HG3 GLU 36 HG3 GLU 36 2.347 4.690 7.170 259 H ALA 37 H ALA 37 0.761 8.006 10.420 260 HA ALA 37 HA ALA 37 2.672 8.439 12.553 261 HB1 ALA 37 HB1 ALA 37 2.382 10.531 11.424 262 HB2 ALA 37 HB2 ALA 37 1.717 10.640 12.893 263 HB3 ALA 37 HB3 ALA 37 0.778 10.425 11.595 264 H LYS 38 H LYS 38 1.852 8.235 14.689 265 HA LYS 38 HA LYS 38 -0.758 7.053 14.718 266 HB2 LYS 38 HB2 LYS 38 1.122 5.714 15.593 267 HB3 LYS 38 HB3 LYS 38 1.200 6.763 16.843 268 HG2 LYS 38 HG2 LYS 38 -1.144 6.185 17.274 269 HG3 LYS 38 HG3 LYS 38 -0.919 4.935 16.248 270 HD2 LYS 38 HD2 LYS 38 0.657 3.997 17.691 271 HD3 LYS 38 HD3 LYS 38 0.529 5.278 18.696 272 HE2 LYS 38 HE2 LYS 38 -1.805 4.820 18.922 273 HE3 LYS 38 HE3 LYS 38 -1.608 3.487 17.998 274 HZ1 LYS 38 HZ1 LYS 38 -1.819 2.899 20.244 275 HZ2 LYS 38 HZ2 LYS 38 -0.542 3.815 20.625 276 HZ3 LYS 38 HZ3 LYS 38 -0.347 2.496 19.711 277 H LYS 39 H LYS 39 -2.457 7.849 15.885 278 HA LYS 39 HA LYS 39 -2.182 10.312 17.211 279 HB2 LYS 39 HB2 LYS 39 -4.467 9.981 17.835 280 HB3 LYS 39 HB3 LYS 39 -4.236 9.761 16.233 281 HG2 LYS 39 HG2 LYS 39 -4.104 7.312 16.860 282 HG3 LYS 39 HG3 LYS 39 -4.910 7.792 18.197 283 HD2 LYS 39 HD2 LYS 39 -6.703 8.565 16.892 284 HD3 LYS 39 HD3 LYS 39 -5.881 8.245 15.517 285 HE2 LYS 39 HE2 LYS 39 -5.863 5.894 16.229 286 HE3 LYS 39 HE3 LYS 39 -6.952 6.320 17.369 287 HZ1 LYS 39 HZ1 LYS 39 -8.056 5.390 15.492 288 HZ2 LYS 39 HZ2 LYS 39 -7.406 6.518 14.533 289 HZ3 LYS 39 HZ3 LYS 39 -8.484 6.940 15.662 290 H GLY 40 H GLY 40 -1.744 10.791 19.364 291 HA2 GLY 40 HA2 GLY 40 -1.489 10.271 21.566 292 HA3 GLY 40 HA3 GLY 40 -2.032 8.754 21.301 293 H PHE 41 H PHE 41 -0.564 7.642 22.528 294 HA PHE 41 HA PHE 41 2.191 7.874 21.721 295 HB2 PHE 41 HB2 PHE 41 2.764 6.969 23.877 296 HB3 PHE 41 HB3 PHE 41 1.923 8.363 24.007 297 HD1 PHE 41 HD1 PHE 41 1.767 4.829 24.530 298 HD2 PHE 41 HD2 PHE 41 -0.289 8.417 24.985 299 HE1 PHE 41 HE1 PHE 41 0.182 3.733 25.976 300 HE2 PHE 41 HE2 PHE 41 -1.882 7.334 26.431 301 HZ PHE 41 HZ PHE 41 -1.647 4.985 26.931 302 HA PRO 42 HA PRO 42 4.292 6.330 22.279 303 HB2 PRO 42 HB2 PRO 42 5.788 5.033 20.510 304 HB3 PRO 42 HB3 PRO 42 5.297 4.253 21.858 305 HG2 PRO 42 HG2 PRO 42 4.102 4.180 19.270 306 HG3 PRO 42 HG3 PRO 42 4.488 2.915 20.229 307 HD2 PRO 42 HD2 PRO 42 2.054 3.770 20.207 308 HD3 PRO 42 HD3 PRO 42 2.708 3.285 21.623 309 H HIS 43 H HIS 43 5.345 8.124 21.637 310 HA HIS 43 HA HIS 43 3.841 9.325 19.610 311 HB2 HIS 43 HB2 HIS 43 4.362 10.551 21.619 312 HB3 HIS 43 HB3 HIS 43 5.943 10.538 21.211 313 HD1 HIS 43 HD1 HIS 43 2.761 11.722 19.582 314 HD2 HIS 43 HD2 HIS 43 6.659 12.884 20.079 315 HE1 HIS 43 HE1 HIS 43 3.103 13.883 18.401 316 HE2 HIS 43 HE2 HIS 43 5.441 14.603 18.696 317 H SER 44 H SER 44 7.225 8.771 19.982 318 HA SER 44 HA SER 44 8.847 8.708 18.600 319 HB2 SER 44 HB2 SER 44 7.402 7.026 17.424 320 HB3 SER 44 HB3 SER 44 7.027 8.191 16.342 321 HG SER 44 HG SER 44 9.621 7.430 16.799 322 H GLY 45 H GLY 45 6.600 10.499 16.569 323 HA2 GLY 45 HA2 GLY 45 8.834 11.889 15.455 324 HA3 GLY 45 HA3 GLY 45 7.325 11.833 14.832 325 HA PRO 46 HA PRO 46 7.719 16.063 16.415 326 HB2 PRO 46 HB2 PRO 46 6.593 17.311 14.373 327 HB3 PRO 46 HB3 PRO 46 8.130 16.790 14.194 328 HG2 PRO 46 HG2 PRO 46 5.743 15.478 13.371 329 HG3 PRO 46 HG3 PRO 46 7.073 15.786 12.474 330 HD2 PRO 46 HD2 PRO 46 6.788 13.449 13.562 331 HD3 PRO 46 HD3 PRO 46 8.276 14.115 13.478 332 H ALA 47 H ALA 47 5.847 17.871 16.551 333 HA ALA 47 HA ALA 47 3.859 16.482 17.957 334 HB1 ALA 47 HB1 ALA 47 4.578 18.687 18.678 335 HB2 ALA 47 HB2 ALA 47 2.976 18.697 18.463 336 HB3 ALA 47 HB3 ALA 47 3.947 19.338 17.339 337 H ASP 48 H ASP 48 2.878 15.098 16.501 338 HA ASP 48 HA ASP 48 1.498 16.062 14.271 339 HB2 ASP 48 HB2 ASP 48 1.427 13.500 15.613 340 HB3 ASP 48 HB3 ASP 48 0.541 13.780 14.270 341 H GLY 49 H GLY 49 -0.717 16.309 13.895 342 HA2 GLY 49 HA2 GLY 49 -2.856 16.670 14.532 343 HA3 GLY 49 HA3 GLY 49 -2.555 16.026 16.002 344 H GLN 50 H GLN 50 -0.408 17.846 16.646 345 HA GLN 50 HA GLN 50 -1.969 20.056 17.528 346 HB2 GLN 50 HB2 GLN 50 -0.168 18.798 18.794 347 HB3 GLN 50 HB3 GLN 50 0.846 19.828 18.034 348 HG2 GLN 50 HG2 GLN 50 -0.209 21.660 19.081 349 HG3 GLN 50 HG3 GLN 50 -1.259 20.648 19.816 350 HE21 GLN 50 HE21 GLN 50 0.733 20.682 22.635 351 HE22 GLN 50 HE22 GLN 50 -0.823 21.007 21.947 352 H ILE 51 H ILE 51 -1.806 20.000 14.801 353 HA ILE 51 HA ILE 51 0.302 21.352 13.735 354 HB ILE 51 HB ILE 51 -2.420 21.280 12.644 355 HG12 ILE 51 HG12 ILE 51 -1.688 19.080 13.016 356 HG13 ILE 51 HG13 ILE 51 -1.790 19.350 11.409 357 HG21 ILE 51 HG21 ILE 51 -1.460 21.625 10.452 358 HG22 ILE 51 HG22 ILE 51 0.008 21.764 11.116 359 HG23 ILE 51 HG23 ILE 51 -1.123 22.881 11.414 360 HD11 ILE 51 HD11 ILE 51 0.193 18.071 11.899 361 HD12 ILE 51 HD12 ILE 51 0.722 19.240 12.883 362 HD13 ILE 51 HD13 ILE 51 0.622 19.507 11.292 363 H ALA 52 H ALA 52 -2.537 22.596 15.193 364 HA ALA 52 HA ALA 52 -2.300 25.180 14.286 365 HB1 ALA 52 HB1 ALA 52 -4.345 24.309 15.327 366 HB2 ALA 52 HB2 ALA 52 -3.941 25.709 16.026 367 HB3 ALA 52 HB3 ALA 52 -3.606 24.310 16.765 368 H SER 53 H SER 53 -0.275 23.700 16.454 369 HA SER 53 HA SER 53 0.434 26.119 17.783 370 HB2 SER 53 HB2 SER 53 1.955 24.756 19.067 371 HB3 SER 53 HB3 SER 53 0.519 23.981 18.996 372 HG SER 53 HG SER 53 1.284 22.502 17.718 373 H ALA 54 H ALA 54 1.073 24.708 14.980 374 HA ALA 54 HA ALA 54 2.655 24.599 13.516 375 HB1 ALA 54 HB1 ALA 54 2.501 27.034 13.495 376 HB2 ALA 54 HB2 ALA 54 3.995 26.583 13.072 377 HB3 ALA 54 HB3 ALA 54 3.706 27.118 14.570 378 H GLY 55 H GLY 55 3.322 23.582 16.315 379 HA2 GLY 55 HA2 GLY 55 6.067 23.671 16.596 380 HA3 GLY 55 HA3 GLY 55 5.090 22.531 17.240 381 H GLY 56 H GLY 56 4.053 21.323 14.985 382 HA2 GLY 56 HA2 GLY 56 6.224 19.730 14.176 383 HA3 GLY 56 HA3 GLY 56 4.692 19.620 13.622 384 H LEU 57 H LEU 57 4.633 22.458 12.847 385 HA LEU 57 HA LEU 57 5.492 22.076 10.239 386 HB2 LEU 57 HB2 LEU 57 4.650 24.556 11.471 387 HB3 LEU 57 HB3 LEU 57 4.791 24.351 9.856 388 HG LEU 57 HG LEU 57 2.824 23.050 11.507 389 HD11 LEU 57 HD11 LEU 57 1.238 24.477 10.374 390 HD12 LEU 57 HD12 LEU 57 2.451 25.188 9.577 391 HD13 LEU 57 HD13 LEU 57 2.317 25.374 11.178 392 HD21 LEU 57 HD21 LEU 57 1.851 22.220 9.476 393 HD22 LEU 57 HD22 LEU 57 3.354 21.647 9.649 394 HD23 LEU 57 HD23 LEU 57 3.065 22.866 8.625 395 H PHE 58 H PHE 58 6.967 23.619 12.936 396 HA PHE 58 HA PHE 58 8.945 24.912 11.517 397 HB2 PHE 58 HB2 PHE 58 9.107 23.949 14.248 398 HB3 PHE 58 HB3 PHE 58 10.157 25.025 13.611 399 HD1 PHE 58 HD1 PHE 58 8.051 25.125 15.988 400 HD2 PHE 58 HD2 PHE 58 8.335 26.877 12.219 401 HE1 PHE 58 HE1 PHE 58 6.602 26.911 16.711 402 HE2 PHE 58 HE2 PHE 58 6.879 28.661 12.935 403 HZ PHE 58 HZ PHE 58 6.028 28.686 15.185 404 H GLY 59 H GLY 59 8.572 21.633 12.314 405 HA2 GLY 59 HA2 GLY 59 11.234 20.841 12.002 406 HA3 GLY 59 HA3 GLY 59 9.929 19.865 11.897 407 H GLY 60 H GLY 60 8.799 21.662 9.782 408 HA2 GLY 60 HA2 GLY 60 9.776 20.292 7.568 409 HA3 GLY 60 HA3 GLY 60 8.767 21.575 7.530 410 H ILE 61 H ILE 61 10.894 23.095 9.095 411 HA ILE 61 HA ILE 61 12.132 24.282 6.921 412 HB ILE 61 HB ILE 61 12.912 24.490 9.729 413 HG12 ILE 61 HG12 ILE 61 10.704 25.253 9.403 414 HG13 ILE 61 HG13 ILE 61 11.674 26.500 9.815 415 HG21 ILE 61 HG21 ILE 61 14.110 26.511 9.156 416 HG22 ILE 61 HG22 ILE 61 13.763 26.277 7.594 417 HG23 ILE 61 HG23 ILE 61 14.743 25.249 8.367 418 HD11 ILE 61 HD11 ILE 61 10.149 27.188 8.091 419 HD12 ILE 61 HD12 ILE 61 10.700 26.022 7.116 420 HD13 ILE 61 HD13 ILE 61 11.661 27.257 7.523 421 H LEU 62 H LEU 62 13.101 21.854 9.181 422 HA LEU 62 HA LEU 62 15.724 21.650 8.255 423 HB2 LEU 62 HB2 LEU 62 14.152 19.893 9.906 424 HB3 LEU 62 HB3 LEU 62 15.684 19.499 9.499 425 HG LEU 62 HG LEU 62 16.396 21.483 10.700 426 HD11 LEU 62 HD11 LEU 62 14.962 22.421 12.367 427 HD12 LEU 62 HD12 LEU 62 13.728 21.539 11.808 428 HD13 LEU 62 HD13 LEU 62 14.372 22.703 10.889 429 HD21 LEU 62 HD21 LEU 62 16.235 20.331 12.855 430 HD22 LEU 62 HD22 LEU 62 16.591 19.272 11.687 431 HD23 LEU 62 HD23 LEU 62 15.078 19.380 12.247 432 H ASP 63 H ASP 63 12.760 20.015 7.580 433 HA ASP 63 HA ASP 63 13.810 17.913 6.120 434 HB2 ASP 63 HB2 ASP 63 11.517 18.058 7.005 435 HB3 ASP 63 HB3 ASP 63 11.158 19.037 5.748 436 H GLN 64 H GLN 64 12.685 21.032 5.068 437 HA GLN 64 HA GLN 64 13.208 20.439 2.376 438 HB2 GLN 64 HB2 GLN 64 12.464 22.601 1.877 439 HB3 GLN 64 HB3 GLN 64 11.500 22.024 3.062 440 HG2 GLN 64 HG2 GLN 64 12.851 23.288 4.636 441 HG3 GLN 64 HG3 GLN 64 13.563 23.996 3.348 442 HE21 GLN 64 HE21 GLN 64 9.835 25.025 4.439 443 HE22 GLN 64 HE22 GLN 64 10.614 23.611 5.068 444 H GLN 65 H GLN 65 15.286 20.972 4.750 445 HA GLN 65 HA GLN 65 17.296 21.989 2.963 446 HB2 GLN 65 HB2 GLN 65 16.471 23.715 4.525 447 HB3 GLN 65 HB3 GLN 65 17.249 22.880 5.693 448 HG2 GLN 65 HG2 GLN 65 19.310 23.234 4.534 449 HG3 GLN 65 HG3 GLN 65 18.512 24.133 3.429 450 HE21 GLN 65 HE21 GLN 65 19.608 25.703 6.936 451 HE22 GLN 65 HE22 GLN 65 19.796 24.019 6.575 452 H SER 66 H SER 66 17.162 19.448 3.082 453 HA SER 66 HA SER 66 19.300 18.604 4.832 454 HB2 SER 66 HB2 SER 66 17.281 17.814 5.869 455 HB3 SER 66 HB3 SER 66 16.803 17.137 4.462 456 HG SER 66 HG SER 66 17.582 15.464 5.453 457 H GLU 67 H GLU 67 20.414 16.579 4.063 458 HA GLU 67 HA GLU 67 20.731 16.538 1.287 459 HB2 GLU 67 HB2 GLU 67 22.392 15.765 2.883 460 HB3 GLU 67 HB3 GLU 67 21.479 14.430 3.113 461 HG2 GLU 67 HG2 GLU 67 23.219 13.876 1.670 462 HG3 GLU 67 HG3 GLU 67 21.828 13.845 0.815 463 H ASN 68 H ASN 68 18.683 14.976 3.496 464 HA ASN 68 HA ASN 68 17.620 13.184 1.528 465 HB2 ASN 68 HB2 ASN 68 17.346 13.300 4.396 466 HB3 ASN 68 HB3 ASN 68 16.342 12.351 3.525 467 HD21 ASN 68 HD21 ASN 68 19.658 10.799 4.721 468 HD22 ASN 68 HD22 ASN 68 18.762 12.086 5.458 469 H ARG 69 H ARG 69 17.219 16.108 1.612 470 HA ARG 69 HA ARG 69 14.581 16.756 2.065 471 HB2 ARG 69 HB2 ARG 69 16.104 18.426 1.543 472 HB3 ARG 69 HB3 ARG 69 16.499 17.702 0.133 473 HG2 ARG 69 HG2 ARG 69 14.359 18.349 -0.735 474 HG3 ARG 69 HG3 ARG 69 14.095 19.183 0.645 475 HD2 ARG 69 HD2 ARG 69 14.939 20.654 -0.995 476 HD3 ARG 69 HD3 ARG 69 16.047 20.492 0.194 477 HE ARG 69 HE ARG 69 16.458 18.648 -1.903 478 HH11 ARG 69 HH11 ARG 69 17.176 21.947 -0.916 479 HH12 ARG 69 HH12 ARG 69 18.579 22.034 -1.927 480 HH21 ARG 69 HH21 ARG 69 18.276 18.818 -3.139 481 HH22 ARG 69 HH22 ARG 69 19.192 20.288 -3.166 482 H TRP 70 H TRP 70 12.666 16.712 0.827 483 HA TRP 70 HA TRP 70 12.619 14.473 -0.879 484 HB2 TRP 70 HB2 TRP 70 10.514 16.234 0.030 485 HB3 TRP 70 HB3 TRP 70 10.198 15.019 -1.014 486 HD1 TRP 70 HD1 TRP 70 12.366 14.549 2.014 487 HE1 TRP 70 HE1 TRP 70 11.423 12.887 3.625 488 HE3 TRP 70 HE3 TRP 70 8.005 13.809 -0.333 489 HZ2 TRP 70 HZ2 TRP 70 9.007 11.450 3.799 490 HZ3 TRP 70 HZ3 TRP 70 6.407 12.270 0.638 491 HH2 TRP 70 HH2 TRP 70 6.910 11.119 2.701 492 H PHE 71 H PHE 71 11.557 14.464 -3.019 493 HA PHE 71 HA PHE 71 12.873 16.209 -4.672 494 HB2 PHE 71 HB2 PHE 71 11.432 15.212 -6.422 495 HB3 PHE 71 HB3 PHE 71 12.216 14.109 -5.509 496 HD1 PHE 71 HD1 PHE 71 11.009 12.504 -4.187 497 HD2 PHE 71 HD2 PHE 71 8.989 15.639 -6.025 498 HE1 PHE 71 HE1 PHE 71 8.902 11.475 -3.615 499 HE2 PHE 71 HE2 PHE 71 6.876 14.621 -5.467 500 HZ PHE 71 HZ PHE 71 6.830 12.530 -4.259 501 H LYS 72 H LYS 72 12.284 17.933 -6.040 502 HA LYS 72 HA LYS 72 9.728 19.101 -5.392 503 HB2 LYS 72 HB2 LYS 72 12.168 20.538 -5.965 504 HB3 LYS 72 HB3 LYS 72 10.715 21.281 -5.905 505 HG2 LYS 72 HG2 LYS 72 10.555 20.440 -3.611 506 HG3 LYS 72 HG3 LYS 72 12.148 20.101 -3.735 507 HD2 LYS 72 HD2 LYS 72 11.985 22.156 -2.661 508 HD3 LYS 72 HD3 LYS 72 12.541 22.457 -4.166 509 HE2 LYS 72 HE2 LYS 72 10.589 23.416 -4.827 510 HE3 LYS 72 HE3 LYS 72 9.718 22.640 -3.684 511 HZ1 LYS 72 HZ1 LYS 72 9.893 24.945 -3.152 512 HZ2 LYS 72 HZ2 LYS 72 11.506 24.835 -3.152 513 HZ3 LYS 72 HZ3 LYS 72 10.644 24.067 -2.021 514 H HIS 73 H HIS 73 8.403 19.848 -7.041 515 HA HIS 73 HA HIS 73 9.492 19.546 -9.697 516 HB2 HIS 73 HB2 HIS 73 6.788 18.860 -8.948 517 HB3 HIS 73 HB3 HIS 73 7.378 18.754 -10.467 518 HD1 HIS 73 HD1 HIS 73 9.867 17.174 -10.347 519 HD2 HIS 73 HD2 HIS 73 6.644 16.354 -7.950 520 HE1 HIS 73 HE1 HIS 73 10.074 14.837 -9.513 521 HE2 HIS 73 HE2 HIS 73 8.130 14.316 -8.084 522 H ILE 74 H ILE 74 9.167 21.156 -11.186 523 HA ILE 74 HA ILE 74 7.948 23.539 -10.217 524 HB ILE 74 HB ILE 74 9.181 23.112 -12.814 525 HG12 ILE 74 HG12 ILE 74 10.336 24.499 -10.569 526 HG13 ILE 74 HG13 ILE 74 10.706 22.953 -10.945 527 HG21 ILE 74 HG21 ILE 74 9.139 25.532 -13.048 528 HG22 ILE 74 HG22 ILE 74 8.366 25.660 -11.633 529 HG23 ILE 74 HG23 ILE 74 7.628 24.976 -12.899 530 HD11 ILE 74 HD11 ILE 74 12.418 24.424 -11.758 531 HD12 ILE 74 HD12 ILE 74 11.327 25.231 -12.637 532 HD13 ILE 74 HD13 ILE 74 11.694 23.700 -13.009 533 H MET 75 H MET 75 5.856 24.154 -10.706 534 HA MET 75 HA MET 75 4.479 22.809 -12.843 535 HB2 MET 75 HB2 MET 75 3.501 23.005 -10.141 536 HB3 MET 75 HB3 MET 75 2.541 22.595 -11.398 537 HG2 MET 75 HG2 MET 75 3.888 20.711 -11.773 538 HG3 MET 75 HG3 MET 75 4.777 21.109 -10.462 539 HE1 MET 75 HE1 MET 75 0.524 19.509 -10.432 540 HE2 MET 75 HE2 MET 75 1.520 19.479 -11.706 541 HE3 MET 75 HE3 MET 75 0.918 20.886 -11.184 542 H THR 76 H THR 76 2.352 24.013 -13.320 543 HA THR 76 HA THR 76 2.921 26.800 -13.097 544 HB THR 76 HB THR 76 1.308 27.070 -14.953 545 HG1 THR 76 HG1 THR 76 -0.142 25.598 -14.989 546 HG21 THR 76 HG21 THR 76 2.570 25.942 -16.652 547 HG22 THR 76 HG22 THR 76 3.276 25.010 -15.535 548 HG23 THR 76 HG23 THR 76 3.602 26.593 -15.591 549 H GLY 77 H GLY 77 0.902 28.328 -13.004 550 HA2 GLY 77 HA2 GLY 77 -0.889 27.545 -10.991 551 HA3 GLY 77 HA3 GLY 77 -1.043 28.858 -11.949 552 H GLY 78 H GLY 78 -3.421 28.109 -11.747 553 HA2 GLY 78 HA2 GLY 78 -5.088 27.445 -13.190 554 HA3 GLY 78 HA3 GLY 78 -4.017 26.628 -14.113 555 H GLU 79 H GLU 79 -6.070 25.137 -13.985 556 HA GLU 79 HA GLU 79 -6.058 23.680 -11.573 557 HB2 GLU 79 HB2 GLU 79 -8.090 24.160 -13.028 558 HB3 GLU 79 HB3 GLU 79 -7.644 22.793 -13.803 559 HG2 GLU 79 HG2 GLU 79 -7.689 21.787 -11.486 560 HG3 GLU 79 HG3 GLU 79 -8.659 23.055 -11.144 561 H HIS 80 H HIS 80 -5.495 21.534 -11.212 562 HA HIS 80 HA HIS 80 -4.343 20.071 -13.436 563 HB2 HIS 80 HB2 HIS 80 -3.101 20.106 -10.843 564 HB3 HIS 80 HB3 HIS 80 -2.492 19.448 -12.208 565 HD1 HIS 80 HD1 HIS 80 -1.933 21.317 -14.225 566 HD2 HIS 80 HD2 HIS 80 -2.103 22.571 -10.324 567 HE1 HIS 80 HE1 HIS 80 -0.790 23.522 -14.044 568 HE2 HIS 80 HE2 HIS 80 -0.896 24.298 -11.711 569 H THR 81 H THR 81 -4.432 17.660 -13.002 570 HA THR 81 HA THR 81 -6.363 17.055 -10.917 571 HB THR 81 HB THR 81 -6.203 15.631 -13.439 572 HG1 THR 81 HG1 THR 81 -7.134 17.843 -13.355 573 HG21 THR 81 HG21 THR 81 -8.215 14.540 -12.720 574 HG22 THR 81 HG22 THR 81 -8.187 15.367 -11.331 575 HG23 THR 81 HG23 THR 81 -7.056 14.251 -11.631 576 H PHE 82 H PHE 82 -5.596 15.726 -9.349 577 HA PHE 82 HA PHE 82 -3.091 14.407 -9.897 578 HB2 PHE 82 HB2 PHE 82 -4.214 15.327 -7.390 579 HB3 PHE 82 HB3 PHE 82 -2.893 14.368 -7.425 580 HD1 PHE 82 HD1 PHE 82 -0.749 15.305 -7.531 581 HD2 PHE 82 HD2 PHE 82 -4.038 17.631 -8.568 582 HE1 PHE 82 HE1 PHE 82 0.672 17.250 -7.649 583 HE2 PHE 82 HE2 PHE 82 -2.628 19.585 -8.677 584 HZ PHE 82 HZ PHE 82 -0.269 19.398 -8.211 585 H THR 83 H THR 83 -2.919 12.145 -9.659 586 HA THR 83 HA THR 83 -5.254 10.882 -8.520 587 HB THR 83 HB THR 83 -3.710 9.797 -10.732 588 HG1 THR 83 HG1 THR 83 -4.960 10.861 -11.967 589 HG21 THR 83 HG21 THR 83 -5.398 8.077 -10.835 590 HG22 THR 83 HG22 THR 83 -6.161 8.727 -9.566 591 HG23 THR 83 HG23 THR 83 -4.712 8.035 -9.372 592 H TRP 84 H TRP 84 -4.829 9.801 -6.676 593 HA TRP 84 HA TRP 84 -2.171 8.651 -6.357 594 HB2 TRP 84 HB2 TRP 84 -3.805 9.857 -4.334 595 HB3 TRP 84 HB3 TRP 84 -2.550 8.877 -3.967 596 HD1 TRP 84 HD1 TRP 84 -1.614 11.078 -6.694 597 HE1 TRP 84 HE1 TRP 84 -0.153 12.998 -6.024 598 HE3 TRP 84 HE3 TRP 84 -2.155 10.582 -1.742 599 HZ2 TRP 84 HZ2 TRP 84 0.613 14.137 -3.570 600 HZ3 TRP 84 HZ3 TRP 84 -0.988 12.128 -0.282 601 HH2 TRP 84 HH2 TRP 84 0.370 13.898 -1.205 602 H THR 85 H THR 85 -2.237 6.459 -5.438 603 HA THR 85 HA THR 85 -4.870 5.413 -5.110 604 HB THR 85 HB THR 85 -4.186 3.348 -6.385 605 HG1 THR 85 HG1 THR 85 -1.912 4.026 -6.094 606 HG21 THR 85 HG21 THR 85 -4.430 4.296 -8.569 607 HG22 THR 85 HG22 THR 85 -4.109 5.770 -7.987 608 HG23 THR 85 HG23 THR 85 -5.481 5.019 -7.576 609 H TYR 86 H TYR 86 -5.027 3.398 -3.875 610 HA TYR 86 HA TYR 86 -2.582 2.581 -2.530 611 HB2 TYR 86 HB2 TYR 86 -5.117 3.015 -1.288 612 HB3 TYR 86 HB3 TYR 86 -4.043 1.970 -0.639 613 HD1 TYR 86 HD1 TYR 86 -2.237 2.750 0.739 614 HD2 TYR 86 HD2 TYR 86 -4.510 5.473 -1.432 615 HE1 TYR 86 HE1 TYR 86 -1.184 4.582 1.929 616 HE2 TYR 86 HE2 TYR 86 -3.461 7.296 -0.246 617 HH TYR 86 HH TYR 86 -1.527 7.859 1.019 618 H THR 87 H THR 87 -2.245 0.366 -3.060 619 HA THR 87 HA THR 87 -4.363 -0.845 -4.481 620 HB THR 87 HB THR 87 -2.003 -1.060 -5.273 621 HG1 THR 87 HG1 THR 87 -3.043 -3.572 -4.964 622 HG21 THR 87 HG21 THR 87 -0.607 -2.719 -4.263 623 HG22 THR 87 HG22 THR 87 -1.736 -3.018 -3.145 624 HG23 THR 87 HG23 THR 87 -0.963 -1.598 -3.153 625 H ALA 88 H ALA 88 -3.202 -1.046 -1.338 626 HA ALA 88 HA ALA 88 -4.292 -3.616 -0.818 627 HB1 ALA 88 HB1 ALA 88 -2.384 -2.900 0.465 628 HB2 ALA 88 HB2 ALA 88 -3.611 -3.187 1.478 629 HB3 ALA 88 HB3 ALA 88 -3.234 -1.667 1.074 630 HA PRO 89 HA PRO 89 -8.260 -1.872 -0.206 631 HB2 PRO 89 HB2 PRO 89 -9.642 -3.955 0.754 632 HB3 PRO 89 HB3 PRO 89 -9.245 -3.925 -0.830 633 HG2 PRO 89 HG2 PRO 89 -7.851 -5.244 1.289 634 HG3 PRO 89 HG3 PRO 89 -8.295 -5.870 -0.152 635 HD2 PRO 89 HD2 PRO 89 -5.872 -5.025 0.147 636 HD3 PRO 89 HD3 PRO 89 -6.629 -4.757 -1.276 637 H HIS 90 H HIS 90 -8.975 -0.490 1.153 638 HA HIS 90 HA HIS 90 -8.792 -1.147 3.944 639 HB2 HIS 90 HB2 HIS 90 -7.648 1.167 2.688 640 HB3 HIS 90 HB3 HIS 90 -8.132 1.282 4.244 641 HD1 HIS 90 HD1 HIS 90 -5.617 -0.477 2.117 642 HD2 HIS 90 HD2 HIS 90 -6.409 0.182 6.079 643 HE1 HIS 90 HE1 HIS 90 -3.714 -1.354 3.466 644 HE2 HIS 90 HE2 HIS 90 -4.171 -0.952 5.856 645 H ASN 91 H ASN 91 -10.251 0.021 5.385 646 HA ASN 91 HA ASN 91 -12.561 1.003 4.015 647 HB2 ASN 91 HB2 ASN 91 -12.821 -0.352 5.985 648 HB3 ASN 91 HB3 ASN 91 -12.139 0.843 6.866 649 HD21 ASN 91 HD21 ASN 91 -15.583 1.400 7.515 650 HD22 ASN 91 HD22 ASN 91 -14.247 0.432 8.042 651 H THR 92 H THR 92 -11.695 2.873 2.982 652 HA THR 92 HA THR 92 -10.297 4.768 4.497 653 HB THR 92 HB THR 92 -11.410 5.140 1.822 654 HG1 THR 92 HG1 THR 92 -10.086 3.362 1.811 655 HG21 THR 92 HG21 THR 92 -9.714 6.790 1.530 656 HG22 THR 92 HG22 THR 92 -9.180 6.534 3.035 657 HG23 THR 92 HG23 THR 92 -10.631 7.206 2.795 658 H SER 93 H SER 93 -11.016 6.521 5.633 659 HA SER 93 HA SER 93 -13.836 6.881 5.645 660 HB2 SER 93 HB2 SER 93 -11.891 8.137 7.430 661 HB3 SER 93 HB3 SER 93 -13.489 8.004 7.737 662 HG SER 93 HG SER 93 -12.441 6.453 8.874 663 H GLN 94 H GLN 94 -10.997 8.816 5.103 664 HA GLN 94 HA GLN 94 -12.387 10.489 3.389 665 HB2 GLN 94 HB2 GLN 94 -12.211 12.575 4.601 666 HB3 GLN 94 HB3 GLN 94 -13.099 11.520 5.475 667 HG2 GLN 94 HG2 GLN 94 -11.391 11.186 6.966 668 HG3 GLN 94 HG3 GLN 94 -10.316 11.946 6.000 669 HE21 GLN 94 HE21 GLN 94 -11.994 14.000 8.824 670 HE22 GLN 94 HE22 GLN 94 -11.828 12.277 8.763 671 H TRP 95 H TRP 95 -11.023 12.406 2.580 672 HA TRP 95 HA TRP 95 -8.319 12.277 3.472 673 HB2 TRP 95 HB2 TRP 95 -7.441 12.457 1.206 674 HB3 TRP 95 HB3 TRP 95 -7.965 10.977 1.654 675 HD1 TRP 95 HD1 TRP 95 -8.808 13.694 -0.701 676 HE1 TRP 95 HE1 TRP 95 -10.383 12.943 -2.499 677 HE3 TRP 95 HE3 TRP 95 -9.849 9.198 1.219 678 HZ2 TRP 95 HZ2 TRP 95 -11.898 10.618 -2.949 679 HZ3 TRP 95 HZ3 TRP 95 -11.357 7.730 0.013 680 HH2 TRP 95 HH2 TRP 95 -12.373 8.455 -2.054 681 H HIS 96 H HIS 96 -7.188 14.251 3.348 682 HA HIS 96 HA HIS 96 -8.610 16.521 2.346 683 HB2 HIS 96 HB2 HIS 96 -8.349 17.652 4.552 684 HB3 HIS 96 HB3 HIS 96 -9.585 16.594 4.414 685 HD1 HIS 96 HD1 HIS 96 -6.621 17.299 6.404 686 HD2 HIS 96 HD2 HIS 96 -9.120 14.116 5.769 687 HE1 HIS 96 HE1 HIS 96 -6.269 15.632 8.222 688 HE2 HIS 96 HE2 HIS 96 -7.741 13.696 7.835 689 H TYR 97 H TYR 97 -7.322 18.488 2.252 690 HA TYR 97 HA TYR 97 -4.529 18.074 2.590 691 HB2 TYR 97 HB2 TYR 97 -4.151 18.629 0.180 692 HB3 TYR 97 HB3 TYR 97 -4.686 17.115 0.476 693 HD1 TYR 97 HD1 TYR 97 -6.956 16.416 -0.211 694 HD2 TYR 97 HD2 TYR 97 -5.598 20.280 -0.918 695 HE1 TYR 97 HE1 TYR 97 -8.871 16.831 -1.634 696 HE2 TYR 97 HE2 TYR 97 -7.518 20.696 -2.319 697 HH TYR 97 HH TYR 97 -9.158 19.139 -3.786 698 H TYR 98 H TYR 98 -3.222 19.929 2.506 699 HA TYR 98 HA TYR 98 -4.589 22.429 2.229 700 HB2 TYR 98 HB2 TYR 98 -3.453 23.064 4.426 701 HB3 TYR 98 HB3 TYR 98 -4.955 22.424 4.419 702 HD1 TYR 98 HD1 TYR 98 -5.270 19.987 5.040 703 HD2 TYR 98 HD2 TYR 98 -1.660 21.979 5.588 704 HE1 TYR 98 HE1 TYR 98 -4.542 18.256 6.561 705 HE2 TYR 98 HE2 TYR 98 -0.957 20.269 7.137 706 HH TYR 98 HH TYR 98 -2.198 18.512 8.715 707 H ILE 99 H ILE 99 -3.121 24.301 2.086 708 HA ILE 99 HA ILE 99 -0.480 23.490 1.411 709 HB ILE 99 HB ILE 99 -0.408 24.633 -0.686 710 HG12 ILE 99 HG12 ILE 99 -1.588 26.572 -0.148 711 HG13 ILE 99 HG13 ILE 99 -2.067 25.968 -1.588 712 HG21 ILE 99 HG21 ILE 99 -2.082 23.472 -1.990 713 HG22 ILE 99 HG22 ILE 99 -2.878 23.100 -0.633 714 HG23 ILE 99 HG23 ILE 99 -1.414 22.472 -0.909 715 HD11 ILE 99 HD11 ILE 99 -3.947 26.811 -0.391 716 HD12 ILE 99 HD12 ILE 99 -3.636 25.812 0.842 717 HD13 ILE 99 HD13 ILE 99 -4.110 25.214 -0.584 718 H THR 100 H THR 100 1.151 25.314 1.240 719 HA THR 100 HA THR 100 0.737 27.053 3.341 720 HB THR 100 HB THR 100 2.875 28.129 2.544 721 HG1 THR 100 HG1 THR 100 3.948 26.903 0.920 722 HG21 THR 100 HG21 THR 100 4.221 26.253 3.131 723 HG22 THR 100 HG22 THR 100 2.958 25.264 2.930 724 HG23 THR 100 HG23 THR 100 2.963 26.331 4.144 725 H LYS 101 H LYS 101 0.266 29.314 3.458 726 HA LYS 101 HA LYS 101 -1.034 30.192 1.097 727 HB2 LYS 101 HB2 LYS 101 -2.086 30.483 3.271 728 HB3 LYS 101 HB3 LYS 101 -0.912 31.547 3.667 729 HG2 LYS 101 HG2 LYS 101 -1.687 33.073 2.094 730 HG3 LYS 101 HG3 LYS 101 -2.758 31.987 1.510 731 HD2 LYS 101 HD2 LYS 101 -3.814 32.001 3.669 732 HD3 LYS 101 HD3 LYS 101 -2.843 33.251 4.069 733 HE2 LYS 101 HE2 LYS 101 -3.810 34.601 2.419 734 HE3 LYS 101 HE3 LYS 101 -4.670 33.340 1.838 735 HZ1 LYS 101 HZ1 LYS 101 -6.047 34.715 3.184 736 HZ2 LYS 101 HZ2 LYS 101 -5.048 34.504 4.438 737 HZ3 LYS 101 HZ3 LYS 101 -5.899 33.255 3.862 738 H LYS 102 H LYS 102 -0.130 31.331 -0.494 739 HA LYS 102 HA LYS 102 2.103 33.001 0.012 740 HB2 LYS 102 HB2 LYS 102 1.846 33.760 -2.228 741 HB3 LYS 102 HB3 LYS 102 1.977 32.136 -2.115 742 HG2 LYS 102 HG2 LYS 102 -0.385 31.943 -2.453 743 HG3 LYS 102 HG3 LYS 102 -0.477 33.564 -2.625 744 HD2 LYS 102 HD2 LYS 102 0.891 33.431 -4.578 745 HD3 LYS 102 HD3 LYS 102 0.968 31.808 -4.409 746 HE2 LYS 102 HE2 LYS 102 -1.417 31.707 -4.674 747 HE3 LYS 102 HE3 LYS 102 -1.428 33.317 -4.948 748 HZ1 LYS 102 HZ1 LYS 102 -1.561 32.139 -6.996 749 HZ2 LYS 102 HZ2 LYS 102 -0.169 31.385 -6.669 750 HZ3 LYS 102 HZ3 LYS 102 -0.180 32.979 -6.940 751 H GLY 103 H GLY 103 2.042 35.196 0.727 752 HA2 GLY 103 HA2 GLY 103 1.029 37.224 0.951 753 HA3 GLY 103 HA3 GLY 103 -0.264 36.696 0.106 754 H TRP 104 H TRP 104 0.691 35.005 2.956 755 HA TRP 104 HA TRP 104 -1.776 35.160 4.034 756 HB2 TRP 104 HB2 TRP 104 -0.569 34.598 6.215 757 HB3 TRP 104 HB3 TRP 104 -0.512 33.518 4.991 758 HD1 TRP 104 HD1 TRP 104 1.734 36.507 5.471 759 HE1 TRP 104 HE1 TRP 104 4.154 35.863 5.494 760 HE3 TRP 104 HE3 TRP 104 1.064 31.557 5.181 761 HZ2 TRP 104 HZ2 TRP 104 5.549 33.415 5.402 762 HZ3 TRP 104 HZ3 TRP 104 3.005 30.113 5.168 763 HH2 TRP 104 HH2 TRP 104 5.227 31.048 5.283 764 H ASP 105 H ASP 105 -2.873 36.193 5.631 765 HA ASP 105 HA ASP 105 -2.449 38.918 5.662 766 HB2 ASP 105 HB2 ASP 105 -4.201 37.596 7.552 767 HB3 ASP 105 HB3 ASP 105 -4.451 39.046 6.843 768 HA PRO 106 HA PRO 106 0.151 38.859 9.221 769 HB2 PRO 106 HB2 PRO 106 0.605 41.447 9.627 770 HB3 PRO 106 HB3 PRO 106 1.291 40.734 8.327 771 HG2 PRO 106 HG2 PRO 106 -1.137 42.231 8.412 772 HG3 PRO 106 HG3 PRO 106 0.109 42.410 7.372 773 HD2 PRO 106 HD2 PRO 106 -1.975 41.026 6.656 774 HD3 PRO 106 HD3 PRO 106 -0.490 40.563 6.158 775 H ASP 107 H ASP 107 -2.841 40.221 9.074 776 HA ASP 107 HA ASP 107 -3.261 40.873 11.733 777 HB2 ASP 107 HB2 ASP 107 -4.816 41.570 10.102 778 HB3 ASP 107 HB3 ASP 107 -5.053 40.033 9.604 779 H LYS 108 H LYS 108 -3.203 37.895 10.092 780 HA LYS 108 HA LYS 108 -4.525 36.518 12.237 781 HB2 LYS 108 HB2 LYS 108 -3.691 35.560 9.635 782 HB3 LYS 108 HB3 LYS 108 -4.507 34.641 10.711 783 HG2 LYS 108 HG2 LYS 108 -6.403 35.978 10.499 784 HG3 LYS 108 HG3 LYS 108 -5.592 37.052 9.576 785 HD2 LYS 108 HD2 LYS 108 -5.321 35.317 7.925 786 HD3 LYS 108 HD3 LYS 108 -6.314 34.380 8.822 787 HE2 LYS 108 HE2 LYS 108 -8.115 35.784 8.456 788 HE3 LYS 108 HE3 LYS 108 -7.154 36.967 7.870 789 HZ1 LYS 108 HZ1 LYS 108 -8.288 35.881 6.095 790 HZ2 LYS 108 HZ2 LYS 108 -7.646 34.465 6.540 791 HZ3 LYS 108 HZ3 LYS 108 -6.695 35.636 5.959 792 HA PRO 109 HA PRO 109 -0.677 35.282 13.724 793 HB2 PRO 109 HB2 PRO 109 -1.213 33.149 15.228 794 HB3 PRO 109 HB3 PRO 109 -1.627 34.634 15.769 795 HG2 PRO 109 HG2 PRO 109 -3.303 32.735 14.433 796 HG3 PRO 109 HG3 PRO 109 -3.639 33.578 15.791 797 HD2 PRO 109 HD2 PRO 109 -4.552 34.413 13.515 798 HD3 PRO 109 HD3 PRO 109 -4.060 35.502 14.629 799 H LEU 110 H LEU 110 0.953 34.469 12.703 800 HA LEU 110 HA LEU 110 0.580 32.812 10.575 801 HB2 LEU 110 HB2 LEU 110 2.720 34.032 11.765 802 HB3 LEU 110 HB3 LEU 110 3.164 32.487 11.477 803 HG LEU 110 HG LEU 110 3.915 33.883 9.756 804 HD11 LEU 110 HD11 LEU 110 3.067 32.668 7.891 805 HD12 LEU 110 HD12 LEU 110 1.872 32.088 8.814 806 HD13 LEU 110 HD13 LEU 110 3.405 31.672 9.120 807 HD21 LEU 110 HD21 LEU 110 2.380 35.032 8.297 808 HD22 LEU 110 HD22 LEU 110 2.249 35.602 9.805 809 HD23 LEU 110 HD23 LEU 110 1.144 34.570 9.232 810 H LYS 111 H LYS 111 1.028 32.026 13.820 811 HA LYS 111 HA LYS 111 1.800 29.437 13.720 812 HB2 LYS 111 HB2 LYS 111 0.959 31.027 15.645 813 HB3 LYS 111 HB3 LYS 111 -0.285 29.971 15.589 814 HG2 LYS 111 HG2 LYS 111 0.859 28.801 17.009 815 HG3 LYS 111 HG3 LYS 111 1.768 28.359 15.727 816 HD2 LYS 111 HD2 LYS 111 2.416 30.595 17.444 817 HD3 LYS 111 HD3 LYS 111 3.119 29.127 17.575 818 HE2 LYS 111 HE2 LYS 111 4.004 29.404 15.348 819 HE3 LYS 111 HE3 LYS 111 3.389 30.916 15.326 820 HZ1 LYS 111 HZ1 LYS 111 5.697 30.982 15.880 821 HZ2 LYS 111 HZ2 LYS 111 5.431 30.019 17.152 822 HZ3 LYS 111 HZ3 LYS 111 4.822 31.517 17.130 823 H ARG 112 H ARG 112 -1.342 30.684 13.093 824 HA ARG 112 HA ARG 112 -2.305 28.076 12.442 825 HB2 ARG 112 HB2 ARG 112 -3.590 30.587 12.880 826 HB3 ARG 112 HB3 ARG 112 -4.371 29.543 11.896 827 HG2 ARG 112 HG2 ARG 112 -5.261 29.289 14.023 828 HG3 ARG 112 HG3 ARG 112 -4.392 27.946 13.698 829 HD2 ARG 112 HD2 ARG 112 -2.697 28.588 15.128 830 HD3 ARG 112 HD3 ARG 112 -3.278 30.110 15.239 831 HE ARG 112 HE ARG 112 -5.261 28.540 16.228 832 HH11 ARG 112 HH11 ARG 112 -1.915 29.168 17.122 833 HH12 ARG 112 HH12 ARG 112 -2.220 28.864 18.800 834 HH21 ARG 112 HH21 ARG 112 -5.573 28.204 18.386 835 HH22 ARG 112 HH22 ARG 112 -4.254 28.329 19.501 836 H ALA 113 H ALA 113 -1.598 31.103 10.957 837 HA ALA 113 HA ALA 113 -2.766 30.399 8.545 838 HB1 ALA 113 HB1 ALA 113 -2.677 32.758 9.354 839 HB2 ALA 113 HB2 ALA 113 -2.110 32.683 7.841 840 HB3 ALA 113 HB3 ALA 113 -1.082 32.768 9.086 841 H ASP 114 H ASP 114 0.016 29.230 9.480 842 HA ASP 114 HA ASP 114 1.676 29.698 7.321 843 HB2 ASP 114 HB2 ASP 114 1.603 27.760 9.400 844 HB3 ASP 114 HB3 ASP 114 2.427 27.276 8.076 845 H PHE 115 H PHE 115 -0.800 27.349 7.899 846 HA PHE 115 HA PHE 115 -0.826 26.702 5.094 847 HB2 PHE 115 HB2 PHE 115 -1.091 24.913 7.320 848 HB3 PHE 115 HB3 PHE 115 -1.893 24.533 5.949 849 HD1 PHE 115 HD1 PHE 115 1.435 25.009 7.290 850 HD2 PHE 115 HD2 PHE 115 -0.783 23.540 4.096 851 HE1 PHE 115 HE1 PHE 115 3.407 23.913 6.424 852 HE2 PHE 115 HE2 PHE 115 1.172 22.427 3.227 853 HZ PHE 115 HZ PHE 115 3.272 22.603 4.402 854 H GLU 116 H GLU 116 -2.888 26.663 4.025 855 HA GLU 116 HA GLU 116 -5.138 27.039 5.795 856 HB2 GLU 116 HB2 GLU 116 -4.658 28.440 3.356 857 HB3 GLU 116 HB3 GLU 116 -6.205 28.192 3.818 858 HG2 GLU 116 HG2 GLU 116 -5.638 29.308 5.922 859 HG3 GLU 116 HG3 GLU 116 -4.224 29.738 5.226 860 H LEU 117 H LEU 117 -7.065 25.888 5.365 861 HA LEU 117 HA LEU 117 -6.657 23.520 3.916 862 HB2 LEU 117 HB2 LEU 117 -7.980 23.575 5.924 863 HB3 LEU 117 HB3 LEU 117 -9.107 24.455 5.137 864 HG LEU 117 HG LEU 117 -9.436 22.511 3.687 865 HD11 LEU 117 HD11 LEU 117 -8.731 20.374 4.529 866 HD12 LEU 117 HD12 LEU 117 -7.936 21.106 5.732 867 HD13 LEU 117 HD13 LEU 117 -7.442 21.294 4.204 868 HD21 LEU 117 HD21 LEU 117 -10.885 21.416 5.274 869 HD22 LEU 117 HD22 LEU 117 -11.026 23.021 5.410 870 HD23 LEU 117 HD23 LEU 117 -10.145 22.192 6.484 871 H ILE 118 H ILE 118 -7.053 23.072 1.833 872 HA ILE 118 HA ILE 118 -8.761 24.926 0.410 873 HB ILE 118 HB ILE 118 -6.491 25.067 -0.385 874 HG12 ILE 118 HG12 ILE 118 -7.950 23.768 -2.469 875 HG13 ILE 118 HG13 ILE 118 -8.309 25.285 -1.985 876 HG21 ILE 118 HG21 ILE 118 -5.366 23.175 -1.301 877 HG22 ILE 118 HG22 ILE 118 -6.618 22.230 -0.911 878 HG23 ILE 118 HG23 ILE 118 -5.726 22.911 0.253 879 HD11 ILE 118 HD11 ILE 118 -6.920 25.358 -3.940 880 HD12 ILE 118 HD12 ILE 118 -5.773 24.515 -3.173 881 HD13 ILE 118 HD13 ILE 118 -6.128 26.018 -2.694 882 H GLY 119 H GLY 119 -8.528 21.753 1.455 883 HA2 GLY 119 HA2 GLY 119 -11.067 21.244 0.495 884 HA3 GLY 119 HA3 GLY 119 -9.996 20.489 -0.480 885 H ALA 120 H ALA 120 -12.125 19.483 1.159 886 HA ALA 120 HA ALA 120 -10.707 17.328 2.405 887 HB1 ALA 120 HB1 ALA 120 -10.962 18.797 4.277 888 HB2 ALA 120 HB2 ALA 120 -11.974 17.552 4.477 889 HB3 ALA 120 HB3 ALA 120 -12.537 18.976 3.959 890 H VAL 121 H VAL 121 -11.831 15.420 1.819 891 HA VAL 121 HA VAL 121 -14.641 15.681 1.426 892 HB VAL 121 HB VAL 121 -13.781 16.137 -0.785 893 HG11 VAL 121 HG11 VAL 121 -12.640 14.477 -2.050 894 HG12 VAL 121 HG12 VAL 121 -12.602 13.507 -0.756 895 HG13 VAL 121 HG13 VAL 121 -11.771 14.894 -0.751 896 HG21 VAL 121 HG21 VAL 121 -15.129 14.594 -2.020 897 HG22 VAL 121 HG22 VAL 121 -15.926 15.111 -0.711 898 HG23 VAL 121 HG23 VAL 121 -15.244 13.644 -0.717 899 HA PRO 122 HA PRO 122 -14.158 11.782 3.169 900 HB2 PRO 122 HB2 PRO 122 -16.564 11.243 4.080 901 HB3 PRO 122 HB3 PRO 122 -15.832 12.568 4.693 902 HG2 PRO 122 HG2 PRO 122 -17.743 12.452 2.572 903 HG3 PRO 122 HG3 PRO 122 -17.747 13.453 3.863 904 HD2 PRO 122 HD2 PRO 122 -16.762 14.207 1.508 905 HD3 PRO 122 HD3 PRO 122 -16.242 14.868 2.908 906 H HIS 123 H HIS 123 -15.088 9.566 3.313 907 HA HIS 123 HA HIS 123 -16.114 8.694 0.753 908 HB2 HIS 123 HB2 HIS 123 -13.774 8.353 0.653 909 HB3 HIS 123 HB3 HIS 123 -13.799 7.602 2.102 910 HD1 HIS 123 HD1 HIS 123 -14.041 6.970 -1.456 911 HD2 HIS 123 HD2 HIS 123 -14.979 4.986 2.004 912 HE1 HIS 123 HE1 HIS 123 -14.469 4.578 -2.004 913 HE2 HIS 123 HE2 HIS 123 -15.032 3.364 0.071 914 H ASP 124 H ASP 124 -17.950 7.529 1.138 915 HA ASP 124 HA ASP 124 -18.145 6.235 3.701 916 HB2 ASP 124 HB2 ASP 124 -20.481 6.798 3.771 917 HB3 ASP 124 HB3 ASP 124 -19.616 8.165 3.550 918 H GLY 125 H GLY 125 -17.664 5.464 0.723 919 HA2 GLY 125 HA2 GLY 125 -18.112 2.924 0.593 920 HA3 GLY 125 HA3 GLY 125 -19.665 3.417 0.480 921 H SER 126 H SER 126 -20.519 4.156 -1.438 922 HA SER 126 HA SER 126 -18.601 4.463 -3.535 923 HB2 SER 126 HB2 SER 126 -19.836 2.372 -3.831 924 HB3 SER 126 HB3 SER 126 -21.227 3.223 -3.915 925 HG SER 126 HG SER 126 -19.142 3.407 -5.710 926 HA PRO 127 HA PRO 127 -21.306 8.077 -3.903 927 HB2 PRO 127 HB2 PRO 127 -19.939 10.040 -2.825 928 HB3 PRO 127 HB3 PRO 127 -20.728 9.042 -1.801 929 HG2 PRO 127 HG2 PRO 127 -17.985 8.941 -2.568 930 HG3 PRO 127 HG3 PRO 127 -18.602 8.885 -1.057 931 HD2 PRO 127 HD2 PRO 127 -17.934 6.700 -2.324 932 HD3 PRO 127 HD3 PRO 127 -19.153 6.705 -1.237 933 H ALA 128 H ALA 128 -20.717 10.264 -5.100 934 HA ALA 128 HA ALA 128 -19.259 9.626 -7.348 935 HB1 ALA 128 HB1 ALA 128 -20.799 11.479 -7.336 936 HB2 ALA 128 HB2 ALA 128 -19.361 11.999 -7.861 937 HB3 ALA 128 HB3 ALA 128 -19.825 12.302 -6.342 938 H SER 129 H SER 129 -18.306 10.907 -4.326 939 HA SER 129 HA SER 129 -15.695 11.526 -5.110 940 HB2 SER 129 HB2 SER 129 -15.376 12.027 -2.705 941 HB3 SER 129 HB3 SER 129 -16.693 12.780 -3.309 942 HG SER 129 HG SER 129 -17.970 11.131 -2.487 943 H ARG 130 H ARG 130 -16.816 8.591 -4.974 944 HA ARG 130 HA ARG 130 -15.217 7.327 -3.151 945 HB2 ARG 130 HB2 ARG 130 -15.758 5.291 -4.167 946 HB3 ARG 130 HB3 ARG 130 -17.068 6.253 -4.330 947 HG2 ARG 130 HG2 ARG 130 -16.403 6.683 -6.600 948 HG3 ARG 130 HG3 ARG 130 -15.201 5.593 -6.415 949 HD2 ARG 130 HD2 ARG 130 -16.967 3.963 -5.845 950 HD3 ARG 130 HD3 ARG 130 -18.030 5.059 -6.424 951 HE ARG 130 HE ARG 130 -16.123 4.649 -8.375 952 HH11 ARG 130 HH11 ARG 130 -18.825 2.905 -6.927 953 HH12 ARG 130 HH12 ARG 130 -19.048 1.921 -8.335 954 HH21 ARG 130 HH21 ARG 130 -16.465 3.337 -10.119 955 HH22 ARG 130 HH22 ARG 130 -17.738 2.161 -10.107 956 H ASN 131 H ASN 131 -14.387 8.613 -6.143 957 HA ASN 131 HA ASN 131 -12.044 7.089 -6.468 958 HB2 ASN 131 HB2 ASN 131 -12.930 9.468 -7.878 959 HB3 ASN 131 HB3 ASN 131 -11.621 8.606 -8.336 960 HD21 ASN 131 HD21 ASN 131 -14.809 7.731 -10.172 961 HD22 ASN 131 HD22 ASN 131 -14.197 9.266 -9.655 962 H LEU 132 H LEU 132 -10.032 7.449 -5.721 963 HA LEU 132 HA LEU 132 -9.567 9.587 -3.975 964 HB2 LEU 132 HB2 LEU 132 -8.589 7.387 -3.769 965 HB3 LEU 132 HB3 LEU 132 -7.653 7.719 -5.066 966 HG LEU 132 HG LEU 132 -6.318 9.126 -3.849 967 HD11 LEU 132 HD11 LEU 132 -6.671 9.708 -1.574 968 HD12 LEU 132 HD12 LEU 132 -8.092 8.937 -1.591 969 HD13 LEU 132 HD13 LEU 132 -7.880 10.260 -2.496 970 HD21 LEU 132 HD21 LEU 132 -5.503 7.593 -2.130 971 HD22 LEU 132 HD22 LEU 132 -5.860 6.769 -3.474 972 HD23 LEU 132 HD23 LEU 132 -6.887 6.763 -2.226 973 H SER 133 H SER 133 -9.489 9.529 -7.251 974 HA SER 133 HA SER 133 -7.354 11.356 -7.606 975 HB2 SER 133 HB2 SER 133 -7.945 9.866 -9.410 976 HB3 SER 133 HB3 SER 133 -9.404 10.590 -9.527 977 HG SER 133 HG SER 133 -7.772 11.242 -11.052 978 H HIS 134 H HIS 134 -7.480 13.626 -7.857 979 HA HIS 134 HA HIS 134 -10.089 14.750 -7.753 980 HB2 HIS 134 HB2 HIS 134 -8.978 14.402 -5.438 981 HB3 HIS 134 HB3 HIS 134 -8.260 15.821 -5.810 982 HD1 HIS 134 HD1 HIS 134 -9.697 18.025 -5.802 983 HD2 HIS 134 HD2 HIS 134 -11.679 14.587 -4.768 984 HE1 HIS 134 HE1 HIS 134 -11.893 18.646 -4.804 985 HE2 HIS 134 HE2 HIS 134 -13.102 16.590 -4.173 986 H HIS 135 H HIS 135 -10.411 16.751 -8.609 987 HA HIS 135 HA HIS 135 -8.269 17.898 -10.043 988 HB2 HIS 135 HB2 HIS 135 -10.966 18.791 -9.609 989 HB3 HIS 135 HB3 HIS 135 -9.905 19.667 -10.488 990 HD1 HIS 135 HD1 HIS 135 -10.198 19.425 -12.947 991 HD2 HIS 135 HD2 HIS 135 -11.121 16.015 -10.871 992 HE1 HIS 135 HE1 HIS 135 -10.873 17.669 -14.572 993 HE2 HIS 135 HE2 HIS 135 -11.452 15.611 -13.342 994 H ILE 136 H ILE 136 -7.005 19.692 -9.478 995 HA ILE 136 HA ILE 136 -7.537 20.900 -6.920 996 HB ILE 136 HB ILE 136 -4.866 20.145 -7.834 997 HG12 ILE 136 HG12 ILE 136 -6.083 18.260 -7.049 998 HG13 ILE 136 HG13 ILE 136 -4.745 18.550 -6.158 999 HG21 ILE 136 HG21 ILE 136 -4.020 20.977 -5.726 1000 HG22 ILE 136 HG22 ILE 136 -5.505 21.479 -5.327 1001 HG23 ILE 136 HG23 ILE 136 -4.720 22.174 -6.558 1002 HD11 ILE 136 HD11 ILE 136 -6.556 17.923 -4.734 1003 HD12 ILE 136 HD12 ILE 136 -7.441 19.158 -5.287 1004 HD13 ILE 136 HD13 ILE 136 -6.117 19.444 -4.404 1005 H TYR 137 H TYR 137 -7.810 23.120 -7.220 1006 HA TYR 137 HA TYR 137 -6.679 24.223 -9.612 1007 HB2 TYR 137 HB2 TYR 137 -8.995 24.673 -9.275 1008 HB3 TYR 137 HB3 TYR 137 -8.659 25.388 -7.845 1009 HD1 TYR 137 HD1 TYR 137 -8.042 27.715 -7.741 1010 HD2 TYR 137 HD2 TYR 137 -8.257 25.788 -11.425 1011 HE1 TYR 137 HE1 TYR 137 -7.762 29.829 -8.869 1012 HE2 TYR 137 HE2 TYR 137 -7.954 27.905 -12.547 1013 HH TYR 137 HH TYR 137 -7.588 30.103 -12.372 1014 H ILE 138 H ILE 138 -5.079 25.735 -9.690 1015 HA ILE 138 HA ILE 138 -4.172 26.766 -7.149 1016 HB ILE 138 HB ILE 138 -2.544 26.294 -9.521 1017 HG12 ILE 138 HG12 ILE 138 -3.047 24.267 -8.461 1018 HG13 ILE 138 HG13 ILE 138 -1.452 24.593 -8.330 1019 HG21 ILE 138 HG21 ILE 138 -0.632 26.991 -8.219 1020 HG22 ILE 138 HG22 ILE 138 -1.605 27.357 -6.980 1021 HG23 ILE 138 HG23 ILE 138 -1.687 28.209 -8.352 1022 HD11 ILE 138 HD11 ILE 138 -2.273 23.685 -6.261 1023 HD12 ILE 138 HD12 ILE 138 -3.355 24.881 -6.147 1024 HD13 ILE 138 HD13 ILE 138 -1.776 25.204 -6.017 1025 HA PRO 139 HA PRO 139 -5.395 30.440 -9.263 1026 HB2 PRO 139 HB2 PRO 139 -4.910 32.332 -7.488 1027 HB3 PRO 139 HB3 PRO 139 -6.179 31.333 -7.245 1028 HG2 PRO 139 HG2 PRO 139 -3.557 31.124 -6.123 1029 HG3 PRO 139 HG3 PRO 139 -4.985 31.037 -5.337 1030 HD2 PRO 139 HD2 PRO 139 -3.752 28.845 -6.013 1031 HD3 PRO 139 HD3 PRO 139 -5.384 28.900 -6.063 1032 H GLU 140 H GLU 140 -4.593 31.906 -10.605 1033 HA GLU 140 HA GLU 140 -1.777 31.541 -11.001 1034 HB2 GLU 140 HB2 GLU 140 -3.728 31.221 -12.679 1035 HB3 GLU 140 HB3 GLU 140 -3.455 32.806 -12.963 1036 HG2 GLU 140 HG2 GLU 140 -1.342 32.367 -13.780 1037 HG3 GLU 140 HG3 GLU 140 -1.425 30.808 -13.298 1038 H ASP 141 H ASP 141 -3.177 33.609 -9.253 1039 HA ASP 141 HA ASP 141 -2.689 36.057 -10.327 1040 HB2 ASP 141 HB2 ASP 141 -2.821 36.873 -7.997 1041 HB3 ASP 141 HB3 ASP 141 -4.014 35.809 -8.331 1042 H ARG 142 H ARG 142 -0.483 34.078 -8.561 1043 HA ARG 142 HA ARG 142 1.668 35.739 -9.337 1044 HB2 ARG 142 HB2 ARG 142 1.142 35.278 -6.513 1045 HB3 ARG 142 HB3 ARG 142 2.583 35.842 -7.035 1046 HG2 ARG 142 HG2 ARG 142 1.402 37.788 -7.886 1047 HG3 ARG 142 HG3 ARG 142 0.078 37.246 -7.098 1048 HD2 ARG 142 HD2 ARG 142 1.056 38.802 -5.706 1049 HD3 ARG 142 HD3 ARG 142 1.391 37.346 -5.047 1050 HE ARG 142 HE ARG 142 3.500 37.933 -6.699 1051 HH11 ARG 142 HH11 ARG 142 2.145 39.219 -3.713 1052 HH12 ARG 142 HH12 ARG 142 3.671 39.857 -3.197 1053 HH21 ARG 142 HH21 ARG 142 5.404 38.785 -5.981 1054 HH22 ARG 142 HH22 ARG 142 5.487 39.614 -4.463 1055 H LEU 143 H LEU 143 3.784 34.836 -9.061 1056 HA LEU 143 HA LEU 143 3.801 31.990 -9.108 1057 HB2 LEU 143 HB2 LEU 143 5.936 32.174 -9.946 1058 HB3 LEU 143 HB3 LEU 143 5.081 33.375 -10.649 1059 HG LEU 143 HG LEU 143 6.937 33.853 -8.520 1060 HD11 LEU 143 HD11 LEU 143 8.477 34.540 -10.292 1061 HD12 LEU 143 HD12 LEU 143 7.385 34.096 -11.399 1062 HD13 LEU 143 HD13 LEU 143 8.095 32.979 -10.470 1063 HD21 LEU 143 HD21 LEU 143 6.895 36.140 -9.181 1064 HD22 LEU 143 HD22 LEU 143 5.419 35.656 -8.732 1065 HD23 LEU 143 HD23 LEU 143 5.779 35.804 -10.302 1066 H GLY 144 H GLY 144 5.094 30.624 -7.671 1067 HA2 GLY 144 HA2 GLY 144 6.769 31.540 -5.774 1068 HA3 GLY 144 HA3 GLY 144 5.301 31.624 -5.064 1069 H TYR 145 H TYR 145 7.517 30.139 -4.154 1070 HA TYR 145 HA TYR 145 7.043 27.425 -4.754 1071 HB2 TYR 145 HB2 TYR 145 8.606 27.151 -2.786 1072 HB3 TYR 145 HB3 TYR 145 9.208 27.757 -4.178 1073 HD1 TYR 145 HD1 TYR 145 10.126 29.981 -4.274 1074 HD2 TYR 145 HD2 TYR 145 8.100 28.716 -0.865 1075 HE1 TYR 145 HE1 TYR 145 10.838 31.974 -3.110 1076 HE2 TYR 145 HE2 TYR 145 8.807 30.715 0.290 1077 HH TYR 145 HH TYR 145 10.371 33.358 -1.283 1078 H HIS 146 H HIS 146 6.108 25.813 -3.442 1079 HA HIS 146 HA HIS 146 4.622 26.762 -1.192 1080 HB2 HIS 146 HB2 HIS 146 3.429 25.613 -3.560 1081 HB3 HIS 146 HB3 HIS 146 2.653 25.468 -2.131 1082 HD1 HIS 146 HD1 HIS 146 3.753 28.109 -4.554 1083 HD2 HIS 146 HD2 HIS 146 1.179 27.639 -1.401 1084 HE1 HIS 146 HE1 HIS 146 2.375 30.166 -4.346 1085 HE2 HIS 146 HE2 HIS 146 0.802 29.895 -2.459 1086 H VAL 147 H VAL 147 3.776 25.087 0.215 1087 HA VAL 147 HA VAL 147 5.014 22.508 -0.252 1088 HB VAL 147 HB VAL 147 4.321 23.484 2.384 1089 HG11 VAL 147 HG11 VAL 147 5.704 21.701 3.165 1090 HG12 VAL 147 HG12 VAL 147 5.992 21.248 1.640 1091 HG13 VAL 147 HG13 VAL 147 4.502 21.116 2.255 1092 HG21 VAL 147 HG21 VAL 147 6.651 24.000 2.727 1093 HG22 VAL 147 HG22 VAL 147 6.062 24.911 1.529 1094 HG23 VAL 147 HG23 VAL 147 6.969 23.617 1.189 1095 H ILE 148 H ILE 148 3.564 20.781 -0.422 1096 HA ILE 148 HA ILE 148 0.797 21.398 0.146 1097 HB ILE 148 HB ILE 148 1.787 19.480 -1.827 1098 HG12 ILE 148 HG12 ILE 148 0.378 21.933 -2.356 1099 HG13 ILE 148 HG13 ILE 148 1.996 21.771 -2.503 1100 HG21 ILE 148 HG21 ILE 148 -0.541 19.094 -2.430 1101 HG22 ILE 148 HG22 ILE 148 -1.020 20.084 -1.245 1102 HG23 ILE 148 HG23 ILE 148 -0.308 18.678 -0.885 1103 HD11 ILE 148 HD11 ILE 148 0.961 21.634 -4.669 1104 HD12 ILE 148 HD12 ILE 148 0.065 20.381 -4.176 1105 HD13 ILE 148 HD13 ILE 148 1.668 20.221 -4.322 1106 H LEU 149 H LEU 149 -0.140 20.220 1.806 1107 HA LEU 149 HA LEU 149 1.170 17.734 2.538 1108 HB2 LEU 149 HB2 LEU 149 1.664 19.380 4.138 1109 HB3 LEU 149 HB3 LEU 149 0.070 19.677 4.340 1110 HG LEU 149 HG LEU 149 -0.233 17.821 5.589 1111 HD11 LEU 149 HD11 LEU 149 1.317 16.061 5.929 1112 HD12 LEU 149 HD12 LEU 149 2.324 16.736 4.859 1113 HD13 LEU 149 HD13 LEU 149 0.893 16.163 4.372 1114 HD21 LEU 149 HD21 LEU 149 1.481 18.091 7.348 1115 HD22 LEU 149 HD22 LEU 149 1.036 19.543 6.792 1116 HD23 LEU 149 HD23 LEU 149 2.421 18.875 6.291 1117 H ALA 150 H ALA 150 -0.057 16.008 2.265 1118 HA ALA 150 HA ALA 150 -2.918 16.375 2.370 1119 HB1 ALA 150 HB1 ALA 150 -2.200 15.837 0.134 1120 HB2 ALA 150 HB2 ALA 150 -3.090 14.616 0.709 1121 HB3 ALA 150 HB3 ALA 150 -1.478 14.495 0.675 1122 H VAL 151 H VAL 151 -4.221 14.809 3.356 1123 HA VAL 151 HA VAL 151 -2.791 12.870 4.934 1124 HB VAL 151 HB VAL 151 -5.109 14.280 5.960 1125 HG11 VAL 151 HG11 VAL 151 -4.431 13.432 8.115 1126 HG12 VAL 151 HG12 VAL 151 -3.181 12.674 7.424 1127 HG13 VAL 151 HG13 VAL 151 -4.693 12.208 7.091 1128 HG21 VAL 151 HG21 VAL 151 -3.634 15.676 7.264 1129 HG22 VAL 151 HG22 VAL 151 -3.380 15.918 5.685 1130 HG23 VAL 151 HG23 VAL 151 -2.355 15.003 6.537 1131 H TRP 152 H TRP 152 -3.733 10.827 5.107 1132 HA TRP 152 HA TRP 152 -6.253 10.410 3.705 1133 HB2 TRP 152 HB2 TRP 152 -4.325 9.776 2.385 1134 HB3 TRP 152 HB3 TRP 152 -3.952 8.683 3.540 1135 HD1 TRP 152 HD1 TRP 152 -6.624 9.237 0.982 1136 HE1 TRP 152 HE1 TRP 152 -7.615 7.080 0.184 1137 HE3 TRP 152 HE3 TRP 152 -4.213 6.235 4.166 1138 HZ2 TRP 152 HZ2 TRP 152 -7.265 4.366 0.881 1139 HZ3 TRP 152 HZ3 TRP 152 -4.573 3.842 4.028 1140 HH2 TRP 152 HH2 TRP 152 -6.088 2.928 2.383 1141 H ASP 153 H ASP 153 -7.758 9.736 5.098 1142 HA ASP 153 HA ASP 153 -6.822 8.470 7.490 1143 HB2 ASP 153 HB2 ASP 153 -9.289 9.936 7.058 1144 HB3 ASP 153 HB3 ASP 153 -8.936 9.213 8.480 1145 H VAL 154 H VAL 154 -7.452 6.485 8.161 1146 HA VAL 154 HA VAL 154 -9.538 5.155 6.671 1147 HB VAL 154 HB VAL 154 -7.829 4.221 5.517 1148 HG11 VAL 154 HG11 VAL 154 -5.596 3.889 6.390 1149 HG12 VAL 154 HG12 VAL 154 -6.084 4.401 7.845 1150 HG13 VAL 154 HG13 VAL 154 -6.039 5.430 6.598 1151 HG21 VAL 154 HG21 VAL 154 -7.297 2.080 6.339 1152 HG22 VAL 154 HG22 VAL 154 -8.872 2.394 6.526 1153 HG23 VAL 154 HG23 VAL 154 -7.872 2.490 7.793 1154 H ALA 155 H ALA 155 -10.850 3.788 7.837 1155 HA ALA 155 HA ALA 155 -10.651 4.254 10.584 1156 HB1 ALA 155 HB1 ALA 155 -12.837 4.305 9.416 1157 HB2 ALA 155 HB2 ALA 155 -12.920 3.274 10.659 1158 HB3 ALA 155 HB3 ALA 155 -12.720 2.713 9.156 1159 H ASP 156 H ASP 156 -9.585 1.697 8.764 1160 HA ASP 156 HA ASP 156 -10.040 -0.198 10.814 1161 HB2 ASP 156 HB2 ASP 156 -9.131 -1.836 9.235 1162 HB3 ASP 156 HB3 ASP 156 -10.343 -0.966 8.572 1163 H THR 157 H THR 157 -7.910 2.005 10.919 1164 HA THR 157 HA THR 157 -6.062 0.354 12.310 1165 HB THR 157 HB THR 157 -4.930 0.470 10.207 1166 HG1 THR 157 HG1 THR 157 -3.850 1.461 12.354 1167 HG21 THR 157 HG21 THR 157 -4.423 2.544 9.153 1168 HG22 THR 157 HG22 THR 157 -5.181 3.350 10.332 1169 HG23 THR 157 HG23 THR 157 -6.027 2.419 9.316 1170 H GLU 158 H GLU 158 -4.506 1.537 13.719 1171 HA GLU 158 HA GLU 158 -5.849 3.751 14.898 1172 HB2 GLU 158 HB2 GLU 158 -4.687 1.805 16.073 1173 HB3 GLU 158 HB3 GLU 158 -3.372 2.766 15.949 1174 HG2 GLU 158 HG2 GLU 158 -4.517 4.450 17.205 1175 HG3 GLU 158 HG3 GLU 158 -5.783 3.433 17.378 1176 H ASN 159 H ASN 159 -3.887 3.513 12.423 1177 HA ASN 159 HA ASN 159 -2.291 5.812 13.059 1178 HB2 ASN 159 HB2 ASN 159 -1.848 3.742 11.048 1179 HB3 ASN 159 HB3 ASN 159 -0.906 5.074 11.111 1180 HD21 ASN 159 HD21 ASN 159 0.980 2.468 12.730 1181 HD22 ASN 159 HD22 ASN 159 0.386 2.810 11.139 1182 H ALA 160 H ALA 160 -1.891 7.438 11.349 1183 HA ALA 160 HA ALA 160 -3.910 7.444 9.261 1184 HB1 ALA 160 HB1 ALA 160 -4.450 9.183 10.794 1185 HB2 ALA 160 HB2 ALA 160 -3.958 9.851 9.406 1186 HB3 ALA 160 HB3 ALA 160 -2.955 9.788 10.673 1187 H PHE 161 H PHE 161 -3.180 8.358 7.196 1188 HA PHE 161 HA PHE 161 -0.328 8.065 6.912 1189 HB2 PHE 161 HB2 PHE 161 -2.431 7.830 4.943 1190 HB3 PHE 161 HB3 PHE 161 -0.853 7.822 4.520 1191 HD1 PHE 161 HD1 PHE 161 -3.291 5.946 6.450 1192 HD2 PHE 161 HD2 PHE 161 0.389 5.822 4.511 1193 HE1 PHE 161 HE1 PHE 161 -3.199 3.558 6.788 1194 HE2 PHE 161 HE2 PHE 161 0.471 3.425 4.813 1195 HZ PHE 161 HZ PHE 161 -1.317 2.298 5.968 1196 H TYR 162 H TYR 162 0.966 9.740 6.181 1197 HA TYR 162 HA TYR 162 -0.409 12.143 5.356 1198 HB2 TYR 162 HB2 TYR 162 1.852 11.975 7.145 1199 HB3 TYR 162 HB3 TYR 162 1.428 13.383 6.435 1200 HD1 TYR 162 HD1 TYR 162 0.175 10.888 8.781 1201 HD2 TYR 162 HD2 TYR 162 -0.152 14.820 7.453 1202 HE1 TYR 162 HE1 TYR 162 -1.315 11.390 10.619 1203 HE2 TYR 162 HE2 TYR 162 -1.630 15.318 9.296 1204 HH TYR 162 HH TYR 162 -3.333 13.764 10.814 1205 H GLN 163 H GLN 163 0.645 13.370 3.656 1206 HA GLN 163 HA GLN 163 3.242 12.440 2.890 1207 HB2 GLN 163 HB2 GLN 163 1.652 11.220 1.514 1208 HB3 GLN 163 HB3 GLN 163 1.202 12.649 0.864 1209 HG2 GLN 163 HG2 GLN 163 2.653 12.033 -0.697 1210 HG3 GLN 163 HG3 GLN 163 3.700 12.778 0.310 1211 HE21 GLN 163 HE21 GLN 163 4.944 9.612 1.620 1212 HE22 GLN 163 HE22 GLN 163 4.249 11.059 2.269 1213 H VAL 164 H VAL 164 4.593 14.105 2.468 1214 HA VAL 164 HA VAL 164 3.363 16.674 1.980 1215 HB VAL 164 HB VAL 164 4.506 16.584 4.124 1216 HG11 VAL 164 HG11 VAL 164 6.895 16.405 4.241 1217 HG12 VAL 164 HG12 VAL 164 6.959 16.130 2.649 1218 HG13 VAL 164 HG13 VAL 164 6.264 15.047 3.630 1219 HG21 VAL 164 HG21 VAL 164 5.751 18.604 3.918 1220 HG22 VAL 164 HG22 VAL 164 4.354 18.714 3.112 1221 HG23 VAL 164 HG23 VAL 164 5.733 18.454 2.308 1222 H ILE 165 H ILE 165 3.999 17.859 0.179 1223 HA ILE 165 HA ILE 165 6.296 16.870 -1.193 1224 HB ILE 165 HB ILE 165 3.812 17.379 -2.651 1225 HG12 ILE 165 HG12 ILE 165 5.176 14.855 -2.344 1226 HG13 ILE 165 HG13 ILE 165 3.814 15.261 -1.541 1227 HG21 ILE 165 HG21 ILE 165 5.035 16.733 -4.666 1228 HG22 ILE 165 HG22 ILE 165 6.388 16.566 -3.796 1229 HG23 ILE 165 HG23 ILE 165 5.736 18.031 -4.005 1230 HD11 ILE 165 HD11 ILE 165 3.288 13.800 -3.353 1231 HD12 ILE 165 HD12 ILE 165 3.948 14.838 -4.402 1232 HD13 ILE 165 HD13 ILE 165 2.599 15.241 -3.607 1233 H ASP 166 H ASP 166 7.709 18.529 -1.459 1234 HA ASP 166 HA ASP 166 6.799 21.201 -1.356 1235 HB2 ASP 166 HB2 ASP 166 9.409 20.042 -1.674 1236 HB3 ASP 166 HB3 ASP 166 9.203 21.657 -1.805 1237 H VAL 167 H VAL 167 6.431 22.604 -3.082 1238 HA VAL 167 HA VAL 167 7.222 21.656 -5.651 1239 HB VAL 167 HB VAL 167 5.020 22.288 -6.618 1240 HG11 VAL 167 HG11 VAL 167 3.794 20.370 -5.842 1241 HG12 VAL 167 HG12 VAL 167 4.814 20.216 -4.597 1242 HG13 VAL 167 HG13 VAL 167 5.338 19.968 -6.107 1243 HG21 VAL 167 HG21 VAL 167 3.172 22.697 -5.143 1244 HG22 VAL 167 HG22 VAL 167 4.305 23.833 -4.938 1245 HG23 VAL 167 HG23 VAL 167 4.166 22.628 -3.869 1246 H ASP 168 H ASP 168 7.065 23.332 -7.421 1247 HA ASP 168 HA ASP 168 7.236 26.017 -6.333 1248 HB2 ASP 168 HB2 ASP 168 9.372 25.206 -7.095 1249 HB3 ASP 168 HB3 ASP 168 8.751 25.141 -8.604 1250 H LEU 169 H LEU 169 5.294 26.950 -6.845 1251 HA LEU 169 HA LEU 169 4.037 26.143 -9.322 1252 HB2 LEU 169 HB2 LEU 169 2.932 27.319 -6.929 1253 HB3 LEU 169 HB3 LEU 169 2.048 27.179 -8.295 1254 HG LEU 169 HG LEU 169 3.171 24.852 -7.064 1255 HD11 LEU 169 HD11 LEU 169 1.118 24.514 -5.858 1256 HD12 LEU 169 HD12 LEU 169 0.581 25.952 -6.366 1257 HD13 LEU 169 HD13 LEU 169 1.840 25.871 -5.355 1258 HD21 LEU 169 HD21 LEU 169 1.397 23.723 -8.221 1259 HD22 LEU 169 HD22 LEU 169 2.302 24.557 -9.269 1260 HD23 LEU 169 HD23 LEU 169 0.869 25.138 -8.797 1261 H VAL 170 H VAL 170 4.647 27.473 -10.995 1262 HA VAL 170 HA VAL 170 4.586 30.215 -10.345 1263 HB VAL 170 HB VAL 170 6.714 30.638 -11.520 1264 HG11 VAL 170 HG11 VAL 170 8.229 29.594 -9.956 1265 HG12 VAL 170 HG12 VAL 170 7.046 28.605 -9.470 1266 HG13 VAL 170 HG13 VAL 170 6.945 30.192 -9.175 1267 HG21 VAL 170 HG21 VAL 170 8.050 28.795 -12.318 1268 HG22 VAL 170 HG22 VAL 170 6.643 28.851 -13.113 1269 HG23 VAL 170 HG23 VAL 170 6.862 27.767 -11.933 1270 H ASN 171 H ASN 171 4.635 31.832 -12.026 1271 HA ASN 171 HA ASN 171 3.139 30.987 -14.325 1272 HB2 ASN 171 HB2 ASN 171 3.745 33.612 -13.301 1273 HB3 ASN 171 HB3 ASN 171 2.999 33.401 -14.738 1274 HD21 ASN 171 HD21 ASN 171 0.174 34.035 -12.760 1275 HD22 ASN 171 HD22 ASN 171 1.386 34.801 -13.733 1276 H LYS 172 H LYS 172 3.932 31.697 -16.521 1277 HA LYS 172 HA LYS 172 6.790 31.753 -16.658 1278 HB2 LYS 172 HB2 LYS 172 4.825 31.641 -18.752 1279 HB3 LYS 172 HB3 LYS 172 6.424 31.756 -19.066 1280 HG2 LYS 172 HG2 LYS 172 6.739 29.645 -17.952 1281 HG3 LYS 172 HG3 LYS 172 5.117 29.523 -17.806 1282 HD2 LYS 172 HD2 LYS 172 5.673 28.285 -19.678 1283 HD3 LYS 172 HD3 LYS 172 4.986 29.656 -20.238 1284 HE2 LYS 172 HE2 LYS 172 7.187 30.560 -20.635 1285 HE3 LYS 172 HE3 LYS 172 7.833 29.140 -20.153 1286 HZ1 LYS 172 HZ1 LYS 172 7.760 29.246 -22.511 1287 HZ2 LYS 172 HZ2 LYS 172 6.158 29.462 -22.465 1288 HZ3 LYS 172 HZ3 LYS 172 6.799 28.056 -21.988 Start of MODEL 7 1 H1 HIS 1 H1 HIS 1 0.472 4.301 3.880 2 H2 HIS 1 H2 HIS 1 1.606 4.390 2.731 3 H3 HIS 1 H3 HIS 1 1.076 2.948 3.233 4 HA HIS 1 HA HIS 1 -1.033 3.360 2.318 5 HB2 HIS 1 HB2 HIS 1 -1.679 5.305 1.300 6 HB3 HIS 1 HB3 HIS 1 -0.867 5.813 2.622 7 HD1 HIS 1 HD1 HIS 1 -1.284 7.657 0.151 8 HD2 HIS 1 HD2 HIS 1 2.075 5.437 0.919 9 HE1 HIS 1 HE1 HIS 1 0.617 8.630 -1.122 10 HE2 HIS 1 HE2 HIS 1 2.651 7.307 -0.676 11 H GLY 2 H GLY 2 -1.329 3.975 -0.380 12 HA2 GLY 2 HA2 GLY 2 0.400 2.048 -1.552 13 HA3 GLY 2 HA3 GLY 2 -0.842 2.810 -2.288 14 H PHE 3 H PHE 3 0.048 3.573 -4.206 15 HA PHE 3 HA PHE 3 2.465 5.100 -3.866 16 HB2 PHE 3 HB2 PHE 3 1.572 3.810 -6.315 17 HB3 PHE 3 HB3 PHE 3 3.013 4.560 -6.144 18 HD1 PHE 3 HD1 PHE 3 4.516 3.581 -4.176 19 HD2 PHE 3 HD2 PHE 3 1.545 1.487 -6.207 20 HE1 PHE 3 HE1 PHE 3 5.508 1.500 -3.467 21 HE2 PHE 3 HE2 PHE 3 2.534 -0.601 -5.514 22 HZ PHE 3 HZ PHE 3 4.520 -0.597 -4.142 23 H ILE 4 H ILE 4 2.897 6.988 -5.179 24 HA ILE 4 HA ILE 4 0.468 8.388 -5.832 25 HB ILE 4 HB ILE 4 3.109 9.556 -5.389 26 HG12 ILE 4 HG12 ILE 4 0.819 9.674 -3.640 27 HG13 ILE 4 HG13 ILE 4 2.095 8.683 -3.395 28 HG21 ILE 4 HG21 ILE 4 2.020 11.708 -5.495 29 HG22 ILE 4 HG22 ILE 4 0.613 10.991 -5.840 30 HG23 ILE 4 HG23 ILE 4 1.831 10.935 -6.902 31 HD11 ILE 4 HD11 ILE 4 2.263 10.601 -1.966 32 HD12 ILE 4 HD12 ILE 4 2.235 11.581 -3.252 33 HD13 ILE 4 HD13 ILE 4 3.498 10.600 -3.009 34 H GLU 5 H GLU 5 -0.105 8.525 -7.990 35 HA GLU 5 HA GLU 5 1.903 7.854 -9.877 36 HB2 GLU 5 HB2 GLU 5 -0.921 8.392 -10.298 37 HB3 GLU 5 HB3 GLU 5 0.067 7.871 -11.490 38 HG2 GLU 5 HG2 GLU 5 0.344 5.823 -10.345 39 HG3 GLU 5 HG3 GLU 5 -0.684 6.344 -9.188 40 H LYS 6 H LYS 6 -0.045 10.546 -8.992 41 HA LYS 6 HA LYS 6 1.454 12.259 -10.742 42 HB2 LYS 6 HB2 LYS 6 -1.443 12.377 -10.638 43 HB3 LYS 6 HB3 LYS 6 -0.507 13.373 -11.532 44 HG2 LYS 6 HG2 LYS 6 0.149 11.497 -12.863 45 HG3 LYS 6 HG3 LYS 6 -0.887 10.566 -12.011 46 HD2 LYS 6 HD2 LYS 6 -2.656 12.091 -12.762 47 HD3 LYS 6 HD3 LYS 6 -1.563 12.686 -13.820 48 HE2 LYS 6 HE2 LYS 6 -2.474 9.944 -13.745 49 HE3 LYS 6 HE3 LYS 6 -2.876 11.030 -14.897 50 HZ1 LYS 6 HZ1 LYS 6 -1.202 9.563 -15.708 51 HZ2 LYS 6 HZ2 LYS 6 -0.219 9.993 -14.499 52 HZ3 LYS 6 HZ3 LYS 6 -0.617 11.069 -15.638 53 HA PRO 7 HA PRO 7 1.644 14.605 -11.071 54 HB2 PRO 7 HB2 PRO 7 2.986 16.721 -10.127 55 HB3 PRO 7 HB3 PRO 7 1.358 16.813 -10.205 56 HG2 PRO 7 HG2 PRO 7 2.964 16.152 -7.944 57 HG3 PRO 7 HG3 PRO 7 1.711 17.197 -8.011 58 HD2 PRO 7 HD2 PRO 7 1.378 14.748 -7.135 59 HD3 PRO 7 HD3 PRO 7 0.170 15.536 -7.901 60 H GLY 8 H GLY 8 2.962 13.237 -11.974 61 HA2 GLY 8 HA2 GLY 8 5.013 12.527 -12.544 62 HA3 GLY 8 HA3 GLY 8 5.676 13.686 -11.604 63 H SER 9 H SER 9 7.128 11.522 -11.823 64 HA SER 9 HA SER 9 6.499 9.755 -9.705 65 HB2 SER 9 HB2 SER 9 7.563 8.793 -11.628 66 HB3 SER 9 HB3 SER 9 8.838 9.800 -11.457 67 HG SER 9 HG SER 9 8.910 8.697 -9.277 68 H ARG 10 H ARG 10 7.218 9.798 -7.622 69 HA ARG 10 HA ARG 10 8.877 11.868 -6.752 70 HB2 ARG 10 HB2 ARG 10 7.307 10.800 -5.283 71 HB3 ARG 10 HB3 ARG 10 8.186 9.425 -5.349 72 HG2 ARG 10 HG2 ARG 10 9.945 10.473 -4.159 73 HG3 ARG 10 HG3 ARG 10 9.107 11.874 -4.130 74 HD2 ARG 10 HD2 ARG 10 7.415 10.806 -2.802 75 HD3 ARG 10 HD3 ARG 10 8.313 9.441 -2.787 76 HE ARG 10 HE ARG 10 9.903 11.438 -1.770 77 HH11 ARG 10 HH11 ARG 10 10.193 11.749 0.410 78 HH12 ARG 10 HH12 ARG 10 9.077 11.079 1.552 79 HH21 ARG 10 HH21 ARG 10 7.026 9.655 -0.808 80 HH22 ARG 10 HH22 ARG 10 7.322 9.918 0.879 81 H ALA 11 H ALA 11 9.400 8.578 -7.617 82 HA ALA 11 HA ALA 11 11.915 8.300 -6.570 83 HB1 ALA 11 HB1 ALA 11 10.573 6.390 -7.294 84 HB2 ALA 11 HB2 ALA 11 12.045 6.288 -7.954 85 HB3 ALA 11 HB3 ALA 11 10.798 6.817 -8.837 86 H ALA 12 H ALA 12 10.960 9.646 -9.576 87 HA ALA 12 HA ALA 12 13.404 9.557 -10.835 88 HB1 ALA 12 HB1 ALA 12 11.375 10.159 -12.015 89 HB2 ALA 12 HB2 ALA 12 12.499 11.290 -12.285 90 HB3 ALA 12 HB3 ALA 12 11.318 11.563 -11.215 91 H LEU 13 H LEU 13 12.131 11.838 -8.586 92 HA LEU 13 HA LEU 13 14.383 13.549 -8.829 93 HB2 LEU 13 HB2 LEU 13 12.097 13.724 -7.060 94 HB3 LEU 13 HB3 LEU 13 13.219 14.903 -7.186 95 HG LEU 13 HG LEU 13 11.473 14.155 -9.353 96 HD11 LEU 13 HD11 LEU 13 10.260 16.171 -8.836 97 HD12 LEU 13 HD12 LEU 13 11.224 16.426 -7.563 98 HD13 LEU 13 HD13 LEU 13 10.214 15.163 -7.572 99 HD21 LEU 13 HD21 LEU 13 12.205 16.159 -10.405 100 HD22 LEU 13 HD22 LEU 13 13.464 15.179 -10.140 101 HD23 LEU 13 HD23 LEU 13 13.211 16.449 -9.172 102 H CYS 14 H CYS 14 13.664 10.861 -7.125 103 HA CYS 14 HA CYS 14 15.169 11.446 -4.784 104 HB2 CYS 14 HB2 CYS 14 13.305 10.045 -4.722 105 HB3 CYS 14 HB3 CYS 14 14.023 9.029 -5.780 106 H SER 15 H SER 15 15.694 10.206 -7.879 107 HA SER 15 HA SER 15 17.913 8.653 -7.261 108 HB2 SER 15 HB2 SER 15 18.152 8.353 -9.625 109 HB3 SER 15 HB3 SER 15 16.550 8.354 -9.303 110 HG SER 15 HG SER 15 17.172 9.625 -11.099 111 H GLU 16 H GLU 16 20.137 8.930 -7.595 112 HA GLU 16 HA GLU 16 21.071 11.501 -7.157 113 HB2 GLU 16 HB2 GLU 16 22.540 9.151 -8.006 114 HB3 GLU 16 HB3 GLU 16 23.269 10.510 -7.468 115 HG2 GLU 16 HG2 GLU 16 22.333 10.180 -5.333 116 HG3 GLU 16 HG3 GLU 16 21.572 8.837 -5.866 117 H ALA 17 H ALA 17 20.220 9.912 -9.973 118 HA ALA 17 HA ALA 17 21.871 11.109 -11.796 119 HB1 ALA 17 HB1 ALA 17 20.408 9.260 -12.376 120 HB2 ALA 17 HB2 ALA 17 20.189 10.461 -13.436 121 HB3 ALA 17 HB3 ALA 17 19.121 10.231 -12.244 122 H PHE 18 H PHE 18 19.406 12.500 -9.988 123 HA PHE 18 HA PHE 18 18.966 14.609 -11.790 124 HB2 PHE 18 HB2 PHE 18 17.345 13.642 -10.070 125 HB3 PHE 18 HB3 PHE 18 18.031 14.727 -9.059 126 HD1 PHE 18 HD1 PHE 18 17.278 16.978 -9.008 127 HD2 PHE 18 HD2 PHE 18 16.182 14.491 -12.158 128 HE1 PHE 18 HE1 PHE 18 15.801 18.694 -9.839 129 HE2 PHE 18 HE2 PHE 18 14.698 16.197 -13.002 130 HZ PHE 18 HZ PHE 18 14.519 18.314 -11.851 131 H GLY 19 H GLY 19 21.523 14.106 -9.843 132 HA2 GLY 19 HA2 GLY 19 22.494 16.647 -10.205 133 HA3 GLY 19 HA3 GLY 19 21.862 16.598 -8.701 134 H PHE 20 H PHE 20 22.667 13.967 -8.075 135 HA PHE 20 HA PHE 20 24.258 12.911 -7.149 136 HB2 PHE 20 HB2 PHE 20 25.129 12.624 -9.402 137 HB3 PHE 20 HB3 PHE 20 26.049 13.961 -9.216 138 HD1 PHE 20 HD1 PHE 20 25.657 10.592 -7.931 139 HD2 PHE 20 HD2 PHE 20 28.269 13.790 -8.435 140 HE1 PHE 20 HE1 PHE 20 27.465 9.233 -7.102 141 HE2 PHE 20 HE2 PHE 20 30.092 12.442 -7.610 142 HZ PHE 20 HZ PHE 20 29.691 10.154 -6.939 143 H LEU 21 H LEU 21 25.443 16.122 -7.476 144 HA LEU 21 HA LEU 21 27.491 15.853 -5.651 145 HB2 LEU 21 HB2 LEU 21 26.033 18.253 -6.368 146 HB3 LEU 21 HB3 LEU 21 27.468 18.277 -5.588 147 HG LEU 21 HG LEU 21 27.158 17.334 -8.289 148 HD11 LEU 21 HD11 LEU 21 28.150 19.438 -8.958 149 HD12 LEU 21 HD12 LEU 21 28.153 19.925 -7.416 150 HD13 LEU 21 HD13 LEU 21 26.751 19.707 -8.192 151 HD21 LEU 21 HD21 LEU 21 29.547 17.416 -8.411 152 HD22 LEU 21 HD22 LEU 21 29.083 16.388 -7.252 153 HD23 LEU 21 HD23 LEU 21 29.616 17.863 -6.858 154 H ASN 22 H ASN 22 24.193 16.133 -5.168 155 HA ASN 22 HA ASN 22 24.551 16.069 -2.318 156 HB2 ASN 22 HB2 ASN 22 22.846 17.997 -3.629 157 HB3 ASN 22 HB3 ASN 22 22.660 17.617 -2.051 158 HD21 ASN 22 HD21 ASN 22 25.390 20.260 -3.180 159 HD22 ASN 22 HD22 ASN 22 24.364 19.434 -4.305 160 H LEU 23 H LEU 23 22.811 14.864 -1.274 161 HA LEU 23 HA LEU 23 20.657 14.038 -2.957 162 HB2 LEU 23 HB2 LEU 23 20.874 11.797 -2.724 163 HB3 LEU 23 HB3 LEU 23 22.362 12.325 -3.142 164 HG LEU 23 HG LEU 23 21.697 11.562 -0.459 165 HD11 LEU 23 HD11 LEU 23 22.807 9.458 -0.967 166 HD12 LEU 23 HD12 LEU 23 22.993 9.934 -2.501 167 HD13 LEU 23 HD13 LEU 23 21.513 9.643 -1.919 168 HD21 LEU 23 HD21 LEU 23 24.046 11.435 -0.075 169 HD22 LEU 23 HD22 LEU 23 23.627 12.935 -0.508 170 HD23 LEU 23 HD23 LEU 23 24.327 11.950 -1.582 171 H ASN 24 H ASN 24 18.710 13.783 -1.862 172 HA ASN 24 HA ASN 24 18.851 13.996 1.016 173 HB2 ASN 24 HB2 ASN 24 17.126 15.581 -0.684 174 HB3 ASN 24 HB3 ASN 24 16.927 15.505 0.936 175 HD21 ASN 24 HD21 ASN 24 19.093 18.361 -0.403 176 HD22 ASN 24 HD22 ASN 24 17.744 17.580 -1.158 177 H CYS 25 H CYS 25 18.609 11.592 -0.186 178 HA CYS 25 HA CYS 25 15.916 10.882 0.361 179 HB2 CYS 25 HB2 CYS 25 16.394 11.435 -2.066 180 HB3 CYS 25 HB3 CYS 25 17.010 9.923 -2.095 181 H GLY 26 H GLY 26 18.788 10.230 1.211 182 HA2 GLY 26 HA2 GLY 26 19.395 7.671 0.522 183 HA3 GLY 26 HA3 GLY 26 19.878 8.392 1.906 184 H SER 27 H SER 27 17.986 8.454 3.661 185 HA SER 27 HA SER 27 17.424 5.725 4.092 186 HB2 SER 27 HB2 SER 27 17.946 7.236 5.952 187 HB3 SER 27 HB3 SER 27 16.501 7.962 5.727 188 HG SER 27 HG SER 27 16.250 6.547 7.348 189 H VAL 28 H VAL 28 15.861 8.117 2.485 190 HA VAL 28 HA VAL 28 13.238 7.461 3.170 191 HB VAL 28 HB VAL 28 14.133 9.040 0.859 192 HG11 VAL 28 HG11 VAL 28 11.992 10.130 0.896 193 HG12 VAL 28 HG12 VAL 28 11.526 9.181 2.120 194 HG13 VAL 28 HG13 VAL 28 11.804 8.541 0.661 195 HG21 VAL 28 HG21 VAL 28 13.911 11.017 2.230 196 HG22 VAL 28 HG22 VAL 28 15.013 10.022 2.869 197 HG23 VAL 28 HG23 VAL 28 13.526 10.094 3.500 198 H MET 29 H MET 29 15.365 6.453 0.707 199 HA MET 29 HA MET 29 13.415 5.689 -1.061 200 HB2 MET 29 HB2 MET 29 15.219 4.752 -2.361 201 HB3 MET 29 HB3 MET 29 15.725 6.158 -1.701 202 HG2 MET 29 HG2 MET 29 17.451 5.009 -1.209 203 HG3 MET 29 HG3 MET 29 16.549 4.620 0.096 204 HE1 MET 29 HE1 MET 29 17.504 1.927 -3.425 205 HE2 MET 29 HE2 MET 29 18.291 3.287 -3.041 206 HE3 MET 29 HE3 MET 29 16.784 3.362 -3.622 207 H TYR 30 H TYR 30 14.185 4.027 1.677 208 HA TYR 30 HA TYR 30 13.852 1.458 0.579 209 HB2 TYR 30 HB2 TYR 30 15.141 1.671 2.558 210 HB3 TYR 30 HB3 TYR 30 13.870 2.319 3.353 211 HD1 TYR 30 HD1 TYR 30 14.994 -0.804 1.848 212 HD2 TYR 30 HD2 TYR 30 12.392 0.927 4.598 213 HE1 TYR 30 HE1 TYR 30 14.318 -3.000 2.604 214 HE2 TYR 30 HE2 TYR 30 11.713 -1.271 5.337 215 HH TYR 30 HH TYR 30 12.472 -3.553 5.400 216 H GLU 31 H GLU 31 11.775 3.643 2.326 217 HA GLU 31 HA GLU 31 9.594 2.335 1.130 218 HB2 GLU 31 HB2 GLU 31 8.294 2.136 3.195 219 HB3 GLU 31 HB3 GLU 31 9.535 1.083 3.063 220 HG2 GLU 31 HG2 GLU 31 10.793 2.422 4.581 221 HG3 GLU 31 HG3 GLU 31 9.498 3.402 4.756 222 HA PRO 32 HA PRO 32 8.981 6.786 1.355 223 HB2 PRO 32 HB2 PRO 32 8.537 7.283 -1.236 224 HB3 PRO 32 HB3 PRO 32 10.078 7.168 -0.708 225 HG2 PRO 32 HG2 PRO 32 8.496 5.115 -1.912 226 HG3 PRO 32 HG3 PRO 32 10.008 5.576 -2.323 227 HD2 PRO 32 HD2 PRO 32 9.701 3.523 -0.791 228 HD3 PRO 32 HD3 PRO 32 10.937 4.549 -0.497 229 H GLN 33 H GLN 33 7.129 4.213 0.568 230 HA GLN 33 HA GLN 33 4.768 5.721 0.384 231 HB2 GLN 33 HB2 GLN 33 3.651 3.648 0.031 232 HB3 GLN 33 HB3 GLN 33 5.024 3.643 -0.854 233 HG2 GLN 33 HG2 GLN 33 4.969 2.325 1.708 234 HG3 GLN 33 HG3 GLN 33 4.447 1.539 0.375 235 HE21 GLN 33 HE21 GLN 33 7.873 0.471 0.874 236 HE22 GLN 33 HE22 GLN 33 6.349 0.298 1.678 237 H SER 34 H SER 34 6.561 4.850 2.956 238 HA SER 34 HA SER 34 4.287 4.399 4.654 239 HB2 SER 34 HB2 SER 34 6.062 2.647 4.589 240 HB3 SER 34 HB3 SER 34 7.052 3.716 5.328 241 HG SER 34 HG SER 34 4.664 2.928 6.425 242 H LEU 35 H LEU 35 3.575 6.376 5.265 243 HA LEU 35 HA LEU 35 5.395 7.815 6.988 244 HB2 LEU 35 HB2 LEU 35 4.722 8.855 4.764 245 HB3 LEU 35 HB3 LEU 35 3.430 9.343 5.636 246 HG LEU 35 HG LEU 35 6.114 9.944 6.440 247 HD11 LEU 35 HD11 LEU 35 5.822 12.143 5.459 248 HD12 LEU 35 HD12 LEU 35 4.391 11.682 4.864 249 HD13 LEU 35 HD13 LEU 35 5.753 11.007 4.311 250 HD21 LEU 35 HD21 LEU 35 5.129 11.641 7.804 251 HD22 LEU 35 HD22 LEU 35 4.558 10.184 8.209 252 HD23 LEU 35 HD23 LEU 35 3.658 11.184 7.312 253 H GLU 36 H GLU 36 4.627 6.637 8.802 254 HA GLU 36 HA GLU 36 1.832 6.937 9.336 255 HB2 GLU 36 HB2 GLU 36 3.766 5.176 10.614 256 HB3 GLU 36 HB3 GLU 36 2.161 5.118 10.913 257 HG2 GLU 36 HG2 GLU 36 3.361 4.429 8.380 258 HG3 GLU 36 HG3 GLU 36 2.834 3.338 9.475 259 H ALA 37 H ALA 37 0.919 7.984 11.091 260 HA ALA 37 HA ALA 37 2.755 8.903 13.121 261 HB1 ALA 37 HB1 ALA 37 2.269 10.796 11.702 262 HB2 ALA 37 HB2 ALA 37 1.637 11.058 13.167 263 HB3 ALA 37 HB3 ALA 37 0.685 10.587 11.948 264 H LYS 38 H LYS 38 2.225 8.028 15.067 265 HA LYS 38 HA LYS 38 -0.342 6.938 15.370 266 HB2 LYS 38 HB2 LYS 38 1.654 5.892 16.299 267 HB3 LYS 38 HB3 LYS 38 1.722 7.091 17.407 268 HG2 LYS 38 HG2 LYS 38 -0.039 6.286 18.572 269 HG3 LYS 38 HG3 LYS 38 -0.634 5.473 17.286 270 HD2 LYS 38 HD2 LYS 38 1.773 4.622 18.598 271 HD3 LYS 38 HD3 LYS 38 0.307 4.093 19.086 272 HE2 LYS 38 HE2 LYS 38 -0.025 3.306 16.771 273 HE3 LYS 38 HE3 LYS 38 1.571 3.573 16.549 274 HZ1 LYS 38 HZ1 LYS 38 1.181 1.293 17.020 275 HZ2 LYS 38 HZ2 LYS 38 0.484 1.687 18.425 276 HZ3 LYS 38 HZ3 LYS 38 2.064 1.951 18.205 277 H LYS 39 H LYS 39 -2.079 7.420 16.608 278 HA LYS 39 HA LYS 39 -2.397 10.074 17.362 279 HB2 LYS 39 HB2 LYS 39 -4.575 9.391 18.061 280 HB3 LYS 39 HB3 LYS 39 -4.220 8.595 16.680 281 HG2 LYS 39 HG2 LYS 39 -3.459 6.758 18.264 282 HG3 LYS 39 HG3 LYS 39 -4.443 7.515 19.325 283 HD2 LYS 39 HD2 LYS 39 -5.367 6.541 16.783 284 HD3 LYS 39 HD3 LYS 39 -5.481 5.664 18.157 285 HE2 LYS 39 HE2 LYS 39 -6.899 7.359 19.079 286 HE3 LYS 39 HE3 LYS 39 -6.840 8.150 17.651 287 HZ1 LYS 39 HZ1 LYS 39 -8.819 6.816 17.764 288 HZ2 LYS 39 HZ2 LYS 39 -7.921 5.491 17.991 289 HZ3 LYS 39 HZ3 LYS 39 -7.863 6.275 16.578 290 H GLY 40 H GLY 40 -2.767 11.083 19.416 291 HA2 GLY 40 HA2 GLY 40 -2.765 11.089 21.693 292 HA3 GLY 40 HA3 GLY 40 -2.397 9.498 21.730 293 H PHE 41 H PHE 41 -1.167 10.260 23.644 294 HA PHE 41 HA PHE 41 1.369 11.400 22.929 295 HB2 PHE 41 HB2 PHE 41 0.282 10.853 25.555 296 HB3 PHE 41 HB3 PHE 41 1.702 11.617 25.300 297 HD1 PHE 41 HD1 PHE 41 1.444 13.746 23.661 298 HD2 PHE 41 HD2 PHE 41 -1.521 12.199 26.137 299 HE1 PHE 41 HE1 PHE 41 0.284 15.859 23.581 300 HE2 PHE 41 HE2 PHE 41 -2.685 14.311 26.076 301 HZ PHE 41 HZ PHE 41 -1.781 16.146 24.800 302 HA PRO 42 HA PRO 42 3.627 11.383 23.954 303 HB2 PRO 42 HB2 PRO 42 6.012 10.419 23.332 304 HB3 PRO 42 HB3 PRO 42 5.419 10.085 24.816 305 HG2 PRO 42 HG2 PRO 42 5.321 8.440 22.490 306 HG3 PRO 42 HG3 PRO 42 5.800 8.018 23.993 307 HD2 PRO 42 HD2 PRO 42 3.369 7.491 23.199 308 HD3 PRO 42 HD3 PRO 42 3.653 7.871 24.761 309 H HIS 43 H HIS 43 4.666 12.836 22.480 310 HA HIS 43 HA HIS 43 3.505 12.633 19.979 311 HB2 HIS 43 HB2 HIS 43 4.240 14.724 21.082 312 HB3 HIS 43 HB3 HIS 43 5.744 14.381 20.547 313 HD1 HIS 43 HD1 HIS 43 6.202 14.480 17.925 314 HD2 HIS 43 HD2 HIS 43 2.601 15.939 19.221 315 HE1 HIS 43 HE1 HIS 43 5.160 15.760 16.072 316 HE2 HIS 43 HE2 HIS 43 2.990 16.653 16.829 317 H SER 44 H SER 44 6.425 11.496 21.171 318 HA SER 44 HA SER 44 8.062 10.326 20.319 319 HB2 SER 44 HB2 SER 44 6.322 8.812 19.560 320 HB3 SER 44 HB3 SER 44 6.321 9.560 18.108 321 HG SER 44 HG SER 44 7.547 7.577 18.332 322 H GLY 45 H GLY 45 7.115 10.944 17.023 323 HA2 GLY 45 HA2 GLY 45 9.683 11.897 16.415 324 HA3 GLY 45 HA3 GLY 45 8.413 11.822 15.391 325 HA PRO 46 HA PRO 46 9.126 16.212 16.448 326 HB2 PRO 46 HB2 PRO 46 9.866 17.206 14.096 327 HB3 PRO 46 HB3 PRO 46 10.997 16.437 14.988 328 HG2 PRO 46 HG2 PRO 46 9.422 15.352 12.867 329 HG3 PRO 46 HG3 PRO 46 11.043 15.268 13.046 330 HD2 PRO 46 HD2 PRO 46 9.558 13.272 13.814 331 HD3 PRO 46 HD3 PRO 46 10.895 13.657 14.668 332 H ALA 47 H ALA 47 8.016 18.224 15.723 333 HA ALA 47 HA ALA 47 5.444 17.501 14.684 334 HB1 ALA 47 HB1 ALA 47 5.451 19.029 16.522 335 HB2 ALA 47 HB2 ALA 47 4.828 19.781 15.233 336 HB3 ALA 47 HB3 ALA 47 6.354 20.075 15.681 337 H ASP 48 H ASP 48 5.248 17.339 12.495 338 HA ASP 48 HA ASP 48 6.254 19.467 10.875 339 HB2 ASP 48 HB2 ASP 48 8.049 17.873 10.868 340 HB3 ASP 48 HB3 ASP 48 7.027 16.765 10.239 341 H GLY 49 H GLY 49 5.051 19.700 8.896 342 HA2 GLY 49 HA2 GLY 49 3.217 19.369 7.609 343 HA3 GLY 49 HA3 GLY 49 3.075 17.844 8.174 344 H GLN 50 H GLN 50 3.172 19.278 10.866 345 HA GLN 50 HA GLN 50 0.349 19.293 11.271 346 HB2 GLN 50 HB2 GLN 50 2.577 19.330 13.116 347 HB3 GLN 50 HB3 GLN 50 1.023 19.324 13.617 348 HG2 GLN 50 HG2 GLN 50 0.728 17.167 13.096 349 HG3 GLN 50 HG3 GLN 50 1.853 17.201 11.912 350 HE21 GLN 50 HE21 GLN 50 4.193 15.606 13.828 351 HE22 GLN 50 HE22 GLN 50 3.452 15.826 12.278 352 H ILE 51 H ILE 51 1.024 21.318 9.718 353 HA ILE 51 HA ILE 51 1.597 23.681 10.977 354 HB ILE 51 HB ILE 51 -0.065 23.422 8.572 355 HG12 ILE 51 HG12 ILE 51 2.807 23.640 8.686 356 HG13 ILE 51 HG13 ILE 51 1.996 22.279 8.290 357 HG21 ILE 51 HG21 ILE 51 0.620 25.670 8.029 358 HG22 ILE 51 HG22 ILE 51 1.451 25.762 9.413 359 HG23 ILE 51 HG23 ILE 51 -0.163 25.667 9.443 360 HD11 ILE 51 HD11 ILE 51 2.845 23.325 6.320 361 HD12 ILE 51 HD12 ILE 51 2.032 24.679 6.670 362 HD13 ILE 51 HD13 ILE 51 1.229 23.331 6.278 363 H ALA 52 H ALA 52 -1.381 22.022 10.416 364 HA ALA 52 HA ALA 52 -3.063 23.951 11.417 365 HB1 ALA 52 HB1 ALA 52 -3.856 22.075 10.058 366 HB2 ALA 52 HB2 ALA 52 -4.747 22.177 11.403 367 HB3 ALA 52 HB3 ALA 52 -3.576 21.068 11.292 368 H SER 53 H SER 53 -1.126 21.761 13.079 369 HA SER 53 HA SER 53 -2.544 22.060 15.537 370 HB2 SER 53 HB2 SER 53 -1.461 19.934 14.988 371 HB3 SER 53 HB3 SER 53 -0.014 20.674 15.154 372 HG SER 53 HG SER 53 -0.992 21.220 17.325 373 H ALA 54 H ALA 54 -0.819 24.063 13.920 374 HA ALA 54 HA ALA 54 0.480 25.755 14.303 375 HB1 ALA 54 HB1 ALA 54 -1.271 26.426 15.900 376 HB2 ALA 54 HB2 ALA 54 0.151 27.042 16.361 377 HB3 ALA 54 HB3 ALA 54 -0.437 25.727 17.096 378 H GLY 55 H GLY 55 1.681 23.152 14.711 379 HA2 GLY 55 HA2 GLY 55 4.024 24.048 16.159 380 HA3 GLY 55 HA3 GLY 55 3.496 22.504 16.227 381 H GLY 56 H GLY 56 2.870 22.283 13.422 382 HA2 GLY 56 HA2 GLY 56 5.530 21.689 12.570 383 HA3 GLY 56 HA3 GLY 56 4.152 21.163 11.869 384 H LEU 57 H LEU 57 4.247 24.473 12.432 385 HA LEU 57 HA LEU 57 4.047 25.007 9.738 386 HB2 LEU 57 HB2 LEU 57 3.981 27.316 10.336 387 HB3 LEU 57 HB3 LEU 57 3.039 26.439 11.342 388 HG LEU 57 HG LEU 57 5.638 27.129 12.259 389 HD11 LEU 57 HD11 LEU 57 4.840 29.279 13.015 390 HD12 LEU 57 HD12 LEU 57 3.436 29.022 12.257 391 HD13 LEU 57 HD13 LEU 57 4.795 29.209 11.400 392 HD21 LEU 57 HD21 LEU 57 4.578 27.221 14.399 393 HD22 LEU 57 HD22 LEU 57 4.296 25.790 13.700 394 HD23 LEU 57 HD23 LEU 57 3.145 26.926 13.710 395 H PHE 58 H PHE 58 6.742 24.872 11.762 396 HA PHE 58 HA PHE 58 8.385 26.538 10.252 397 HB2 PHE 58 HB2 PHE 58 9.217 24.504 12.150 398 HB3 PHE 58 HB3 PHE 58 10.121 25.791 11.709 399 HD1 PHE 58 HD1 PHE 58 7.971 24.608 14.137 400 HD2 PHE 58 HD2 PHE 58 9.100 28.142 12.252 401 HE1 PHE 58 HE1 PHE 58 7.024 25.872 15.958 402 HE2 PHE 58 HE2 PHE 58 8.148 29.420 14.063 403 HZ PHE 58 HZ PHE 58 7.120 28.285 15.930 404 H GLY 59 H GLY 59 7.502 23.313 9.866 405 HA2 GLY 59 HA2 GLY 59 9.721 22.341 8.553 406 HA3 GLY 59 HA3 GLY 59 8.199 21.776 8.370 407 H GLY 60 H GLY 60 7.056 24.199 7.325 408 HA2 GLY 60 HA2 GLY 60 7.616 23.835 4.635 409 HA3 GLY 60 HA3 GLY 60 6.753 25.070 5.265 410 H ILE 61 H ILE 61 9.141 25.814 6.923 411 HA ILE 61 HA ILE 61 10.445 27.355 4.931 412 HB ILE 61 HB ILE 61 10.829 27.454 7.829 413 HG12 ILE 61 HG12 ILE 61 8.666 28.178 7.260 414 HG13 ILE 61 HG13 ILE 61 9.540 29.436 7.825 415 HG21 ILE 61 HG21 ILE 61 12.033 29.523 7.509 416 HG22 ILE 61 HG22 ILE 61 11.902 29.356 5.906 417 HG23 ILE 61 HG23 ILE 61 12.799 28.314 6.757 418 HD11 ILE 61 HD11 ILE 61 8.222 30.144 5.928 419 HD12 ILE 61 HD12 ILE 61 8.927 29.021 5.001 420 HD13 ILE 61 HD13 ILE 61 9.793 30.267 5.561 421 H LEU 62 H LEU 62 11.231 24.944 7.298 422 HA LEU 62 HA LEU 62 13.951 25.000 6.782 423 HB2 LEU 62 HB2 LEU 62 12.225 23.422 8.404 424 HB3 LEU 62 HB3 LEU 62 13.627 22.677 8.021 425 HG LEU 62 HG LEU 62 14.814 24.459 9.085 426 HD11 LEU 62 HD11 LEU 62 13.691 25.989 10.537 427 HD12 LEU 62 HD12 LEU 62 12.262 25.437 10.019 428 HD13 LEU 62 HD13 LEU 62 13.239 26.228 9.002 429 HD21 LEU 62 HD21 LEU 62 14.302 23.711 11.348 430 HD22 LEU 62 HD22 LEU 62 14.344 22.447 10.340 431 HD23 LEU 62 HD23 LEU 62 12.923 23.059 10.810 432 H ASP 63 H ASP 63 11.484 23.304 5.248 433 HA ASP 63 HA ASP 63 12.816 21.083 4.494 434 HB2 ASP 63 HB2 ASP 63 10.427 21.450 4.114 435 HB3 ASP 63 HB3 ASP 63 10.809 22.405 2.845 436 H GLN 64 H GLN 64 13.217 24.179 3.207 437 HA GLN 64 HA GLN 64 14.089 23.546 0.720 438 HB2 GLN 64 HB2 GLN 64 15.055 25.721 0.639 439 HB3 GLN 64 HB3 GLN 64 13.646 25.804 1.461 440 HG2 GLN 64 HG2 GLN 64 14.909 25.783 3.508 441 HG3 GLN 64 HG3 GLN 64 16.275 25.870 2.617 442 HE21 GLN 64 HE21 GLN 64 14.424 29.175 3.626 443 HE22 GLN 64 HE22 GLN 64 14.172 27.618 4.342 444 H GLN 65 H GLN 65 15.779 23.019 3.602 445 HA GLN 65 HA GLN 65 17.971 21.955 2.067 446 HB2 GLN 65 HB2 GLN 65 18.477 24.205 3.050 447 HB3 GLN 65 HB3 GLN 65 18.610 23.396 4.462 448 HG2 GLN 65 HG2 GLN 65 20.428 22.182 3.670 449 HG3 GLN 65 HG3 GLN 65 20.220 22.768 2.160 450 HE21 GLN 65 HE21 GLN 65 22.430 25.347 2.583 451 HE22 GLN 65 HE22 GLN 65 21.699 24.181 1.532 452 H SER 66 H SER 66 15.802 20.568 3.107 453 HA SER 66 HA SER 66 16.679 19.426 5.553 454 HB2 SER 66 HB2 SER 66 14.333 19.702 5.322 455 HB3 SER 66 HB3 SER 66 14.328 18.823 3.945 456 HG SER 66 HG SER 66 14.429 17.988 6.518 457 H GLU 67 H GLU 67 17.363 17.345 5.969 458 HA GLU 67 HA GLU 67 18.763 15.946 4.026 459 HB2 GLU 67 HB2 GLU 67 19.118 15.753 6.409 460 HB3 GLU 67 HB3 GLU 67 17.664 15.025 6.557 461 HG2 GLU 67 HG2 GLU 67 18.576 13.190 5.251 462 HG3 GLU 67 HG3 GLU 67 20.039 13.892 5.432 463 H ASN 68 H ASN 68 15.524 15.969 4.900 464 HA ASN 68 HA ASN 68 14.909 13.663 3.260 465 HB2 ASN 68 HB2 ASN 68 13.570 14.567 5.661 466 HB3 ASN 68 HB3 ASN 68 12.964 13.388 4.709 467 HD21 ASN 68 HD21 ASN 68 15.872 12.591 7.333 468 HD22 ASN 68 HD22 ASN 68 15.270 14.193 7.067 469 H ARG 69 H ARG 69 15.280 16.377 2.441 470 HA ARG 69 HA ARG 69 13.059 17.887 2.334 471 HB2 ARG 69 HB2 ARG 69 14.920 18.961 1.603 472 HB3 ARG 69 HB3 ARG 69 15.336 17.740 0.602 473 HG2 ARG 69 HG2 ARG 69 13.851 18.457 -1.007 474 HG3 ARG 69 HG3 ARG 69 13.182 19.538 0.018 475 HD2 ARG 69 HD2 ARG 69 15.085 20.872 -0.038 476 HD3 ARG 69 HD3 ARG 69 15.922 19.728 -0.849 477 HE ARG 69 HE ARG 69 13.781 20.331 -2.434 478 HH11 ARG 69 HH11 ARG 69 16.577 22.105 -1.223 479 HH12 ARG 69 HH12 ARG 69 16.616 23.142 -2.610 480 HH21 ARG 69 HH21 ARG 69 13.935 21.669 -4.180 481 HH22 ARG 69 HH22 ARG 69 15.151 22.900 -4.248 482 H TRP 70 H TRP 70 11.322 18.384 1.050 483 HA TRP 70 HA TRP 70 10.218 15.995 0.055 484 HB2 TRP 70 HB2 TRP 70 8.998 18.626 0.015 485 HB3 TRP 70 HB3 TRP 70 8.191 17.209 -0.069 486 HD1 TRP 70 HD1 TRP 70 9.594 15.818 2.439 487 HE1 TRP 70 HE1 TRP 70 9.101 16.475 4.805 488 HE3 TRP 70 HE3 TRP 70 7.710 20.359 1.461 489 HZ2 TRP 70 HZ2 TRP 70 8.040 18.765 6.039 490 HZ3 TRP 70 HZ3 TRP 70 7.010 21.750 3.320 491 HH2 TRP 70 HH2 TRP 70 7.168 20.939 5.585 492 H PHE 71 H PHE 71 9.443 15.514 -2.023 493 HA PHE 71 HA PHE 71 11.159 16.458 -4.005 494 HB2 PHE 71 HB2 PHE 71 10.135 14.944 -5.437 495 HB3 PHE 71 HB3 PHE 71 10.207 14.225 -3.972 496 HD1 PHE 71 HD1 PHE 71 8.098 14.083 -2.564 497 HD2 PHE 71 HD2 PHE 71 8.063 15.259 -6.558 498 HE1 PHE 71 HE1 PHE 71 5.723 13.666 -2.661 499 HE2 PHE 71 HE2 PHE 71 5.690 14.830 -6.670 500 HZ PHE 71 HZ PHE 71 4.521 14.017 -4.725 501 H LYS 72 H LYS 72 10.972 17.977 -5.614 502 HA LYS 72 HA LYS 72 8.521 19.440 -5.517 503 HB2 LYS 72 HB2 LYS 72 11.188 20.573 -5.818 504 HB3 LYS 72 HB3 LYS 72 9.842 21.484 -5.978 505 HG2 LYS 72 HG2 LYS 72 9.306 20.936 -3.691 506 HG3 LYS 72 HG3 LYS 72 10.783 20.249 -3.573 507 HD2 LYS 72 HD2 LYS 72 11.021 22.347 -2.679 508 HD3 LYS 72 HD3 LYS 72 11.718 22.427 -4.154 509 HE2 LYS 72 HE2 LYS 72 10.248 23.921 -4.879 510 HE3 LYS 72 HE3 LYS 72 8.993 23.143 -4.181 511 HZ1 LYS 72 HZ1 LYS 72 9.305 25.264 -3.167 512 HZ2 LYS 72 HZ2 LYS 72 10.822 24.864 -2.776 513 HZ3 LYS 72 HZ3 LYS 72 9.579 24.094 -2.085 514 H HIS 73 H HIS 73 7.462 20.122 -7.299 515 HA HIS 73 HA HIS 73 8.900 19.839 -9.800 516 HB2 HIS 73 HB2 HIS 73 6.052 19.576 -9.415 517 HB3 HIS 73 HB3 HIS 73 6.778 19.531 -10.878 518 HD1 HIS 73 HD1 HIS 73 8.806 17.516 -10.974 519 HD2 HIS 73 HD2 HIS 73 5.548 17.079 -8.528 520 HE1 HIS 73 HE1 HIS 73 8.560 15.103 -10.405 521 HE2 HIS 73 HE2 HIS 73 6.601 14.822 -8.933 522 H ILE 74 H ILE 74 8.982 21.656 -11.176 523 HA ILE 74 HA ILE 74 7.741 24.061 -10.188 524 HB ILE 74 HB ILE 74 9.487 23.797 -12.473 525 HG12 ILE 74 HG12 ILE 74 10.109 24.964 -9.908 526 HG13 ILE 74 HG13 ILE 74 10.542 23.443 -10.316 527 HG21 ILE 74 HG21 ILE 74 9.507 26.226 -12.504 528 HG22 ILE 74 HG22 ILE 74 8.440 26.256 -11.289 529 HG23 ILE 74 HG23 ILE 74 7.998 25.694 -12.740 530 HD11 ILE 74 HD11 ILE 74 12.409 24.923 -10.583 531 HD12 ILE 74 HD12 ILE 74 11.561 25.828 -11.620 532 HD13 ILE 74 HD13 ILE 74 11.990 24.322 -12.025 533 H MET 75 H MET 75 5.737 24.691 -11.036 534 HA MET 75 HA MET 75 4.847 23.455 -13.471 535 HB2 MET 75 HB2 MET 75 3.375 23.389 -10.980 536 HB3 MET 75 HB3 MET 75 2.714 22.966 -12.412 537 HG2 MET 75 HG2 MET 75 4.279 21.220 -12.578 538 HG3 MET 75 HG3 MET 75 4.848 21.621 -11.100 539 HE1 MET 75 HE1 MET 75 0.909 19.560 -12.020 540 HE2 MET 75 HE2 MET 75 2.169 19.674 -13.027 541 HE3 MET 75 HE3 MET 75 1.294 20.988 -12.675 542 H THR 76 H THR 76 2.908 24.606 -14.385 543 HA THR 76 HA THR 76 2.895 27.378 -13.664 544 HB THR 76 HB THR 76 1.325 27.600 -15.542 545 HG1 THR 76 HG1 THR 76 0.305 25.871 -16.007 546 HG21 THR 76 HG21 THR 76 2.914 27.139 -17.271 547 HG22 THR 76 HG22 THR 76 3.771 26.210 -16.262 548 HG23 THR 76 HG23 THR 76 3.693 27.807 -16.021 549 H GLY 77 H GLY 77 0.509 28.335 -13.415 550 HA2 GLY 77 HA2 GLY 77 -0.945 26.778 -11.581 551 HA3 GLY 77 HA3 GLY 77 -1.424 28.200 -12.228 552 H GLY 78 H GLY 78 -3.602 27.207 -12.295 553 HA2 GLY 78 HA2 GLY 78 -5.085 26.621 -14.014 554 HA3 GLY 78 HA3 GLY 78 -3.921 25.750 -14.758 555 H GLU 79 H GLU 79 -6.056 24.351 -14.778 556 HA GLU 79 HA GLU 79 -6.575 22.965 -12.404 557 HB2 GLU 79 HB2 GLU 79 -8.100 23.155 -14.323 558 HB3 GLU 79 HB3 GLU 79 -7.218 21.978 -15.034 559 HG2 GLU 79 HG2 GLU 79 -8.098 21.244 -12.507 560 HG3 GLU 79 HG3 GLU 79 -9.336 21.573 -13.520 561 H HIS 80 H HIS 80 -5.614 21.186 -11.487 562 HA HIS 80 HA HIS 80 -3.670 19.788 -13.110 563 HB2 HIS 80 HB2 HIS 80 -3.306 20.574 -10.344 564 HB3 HIS 80 HB3 HIS 80 -2.289 19.555 -11.113 565 HD1 HIS 80 HD1 HIS 80 -2.879 21.814 -13.662 566 HD2 HIS 80 HD2 HIS 80 -0.737 22.044 -10.178 567 HE1 HIS 80 HE1 HIS 80 -1.283 23.703 -13.838 568 HE2 HIS 80 HE2 HIS 80 0.018 23.861 -11.758 569 H THR 81 H THR 81 -3.280 17.513 -12.441 570 HA THR 81 HA THR 81 -5.517 16.493 -10.940 571 HB THR 81 HB THR 81 -4.222 15.112 -13.161 572 HG1 THR 81 HG1 THR 81 -5.514 16.182 -14.355 573 HG21 THR 81 HG21 THR 81 -5.965 13.467 -12.953 574 HG22 THR 81 HG22 THR 81 -6.589 14.264 -11.692 575 HG23 THR 81 HG23 THR 81 -5.152 13.535 -11.557 576 H PHE 82 H PHE 82 -5.103 15.432 -9.122 577 HA PHE 82 HA PHE 82 -2.396 14.495 -8.636 578 HB2 PHE 82 HB2 PHE 82 -4.438 15.287 -6.762 579 HB3 PHE 82 HB3 PHE 82 -3.015 14.626 -6.306 580 HD1 PHE 82 HD1 PHE 82 -1.116 15.972 -5.944 581 HD2 PHE 82 HD2 PHE 82 -4.402 17.553 -7.948 582 HE1 PHE 82 HE1 PHE 82 -0.074 18.147 -5.928 583 HE2 PHE 82 HE2 PHE 82 -3.375 19.734 -7.934 584 HZ PHE 82 HZ PHE 82 -1.197 20.030 -6.942 585 H THR 83 H THR 83 -2.099 12.266 -8.222 586 HA THR 83 HA THR 83 -4.501 10.746 -8.031 587 HB THR 83 HB THR 83 -2.421 10.085 -10.006 588 HG1 THR 83 HG1 THR 83 -4.174 10.531 -11.510 589 HG21 THR 83 HG21 THR 83 -3.888 8.380 -10.804 590 HG22 THR 83 HG22 THR 83 -4.975 8.756 -9.667 591 HG23 THR 83 HG23 THR 83 -3.560 8.095 -9.247 592 H TRP 84 H TRP 84 -4.507 9.210 -6.530 593 HA TRP 84 HA TRP 84 -1.954 8.086 -5.742 594 HB2 TRP 84 HB2 TRP 84 -4.313 8.497 -4.154 595 HB3 TRP 84 HB3 TRP 84 -3.135 7.476 -3.668 596 HD1 TRP 84 HD1 TRP 84 -1.823 10.575 -5.103 597 HE1 TRP 84 HE1 TRP 84 -0.883 12.152 -3.398 598 HE3 TRP 84 HE3 TRP 84 -3.541 8.201 -1.050 599 HZ2 TRP 84 HZ2 TRP 84 -0.884 12.246 -0.581 600 HZ3 TRP 84 HZ3 TRP 84 -3.033 9.106 1.142 601 HH2 TRP 84 HH2 TRP 84 -1.710 11.118 1.359 602 H THR 85 H THR 85 -1.906 5.733 -5.521 603 HA THR 85 HA THR 85 -4.295 4.369 -6.340 604 HB THR 85 HB THR 85 -2.898 4.568 -8.333 605 HG1 THR 85 HG1 THR 85 -4.320 2.857 -8.191 606 HG21 THR 85 HG21 THR 85 -0.867 3.294 -8.465 607 HG22 THR 85 HG22 THR 85 -1.027 2.847 -6.919 608 HG23 THR 85 HG23 THR 85 -0.715 4.391 -7.286 609 H TYR 86 H TYR 86 -4.314 2.024 -5.783 610 HA TYR 86 HA TYR 86 -2.393 1.321 -3.748 611 HB2 TYR 86 HB2 TYR 86 -4.833 2.088 -3.064 612 HB3 TYR 86 HB3 TYR 86 -4.972 0.461 -3.090 613 HD1 TYR 86 HD1 TYR 86 -2.968 -0.796 -1.767 614 HD2 TYR 86 HD2 TYR 86 -4.308 3.071 -1.001 615 HE1 TYR 86 HE1 TYR 86 -1.980 -0.886 0.437 616 HE2 TYR 86 HE2 TYR 86 -3.348 2.958 1.210 617 HH TYR 86 HH TYR 86 -2.714 0.971 2.908 618 H THR 87 H THR 87 -1.885 -0.920 -3.695 619 HA THR 87 HA THR 87 -2.676 -2.289 -6.010 620 HB THR 87 HB THR 87 -1.193 -4.096 -5.017 621 HG1 THR 87 HG1 THR 87 -1.670 -3.006 -2.878 622 HG21 THR 87 HG21 THR 87 0.842 -2.859 -5.365 623 HG22 THR 87 HG22 THR 87 0.030 -1.464 -5.265 624 HG23 THR 87 HG23 THR 87 -0.210 -2.451 -6.523 625 H ALA 88 H ALA 88 -3.830 -2.161 -2.893 626 HA ALA 88 HA ALA 88 -5.635 -4.354 -3.367 627 HB1 ALA 88 HB1 ALA 88 -3.949 -5.309 -1.949 628 HB2 ALA 88 HB2 ALA 88 -5.317 -5.171 -1.098 629 HB3 ALA 88 HB3 ALA 88 -4.124 -4.099 -0.890 630 HA PRO 89 HA PRO 89 -8.309 -1.275 -1.805 631 HB2 PRO 89 HB2 PRO 89 -10.406 -2.587 -0.837 632 HB3 PRO 89 HB3 PRO 89 -10.183 -2.539 -2.454 633 HG2 PRO 89 HG2 PRO 89 -9.423 -4.623 -0.651 634 HG3 PRO 89 HG3 PRO 89 -10.224 -4.772 -2.067 635 HD2 PRO 89 HD2 PRO 89 -7.666 -5.196 -1.995 636 HD3 PRO 89 HD3 PRO 89 -8.323 -4.474 -3.304 637 H HIS 90 H HIS 90 -8.597 -0.011 -0.048 638 HA HIS 90 HA HIS 90 -7.943 -1.257 2.477 639 HB2 HIS 90 HB2 HIS 90 -6.162 0.213 1.347 640 HB3 HIS 90 HB3 HIS 90 -7.017 1.410 2.055 641 HD1 HIS 90 HD1 HIS 90 -7.177 1.389 4.761 642 HD2 HIS 90 HD2 HIS 90 -4.402 -1.066 3.005 643 HE1 HIS 90 HE1 HIS 90 -5.576 0.622 6.505 644 HE2 HIS 90 HE2 HIS 90 -3.897 -0.856 5.469 645 H ASN 91 H ASN 91 -9.034 -0.456 4.349 646 HA ASN 91 HA ASN 91 -11.360 1.035 3.807 647 HB2 ASN 91 HB2 ASN 91 -10.235 0.297 6.351 648 HB3 ASN 91 HB3 ASN 91 -11.686 1.027 6.192 649 HD21 ASN 91 HD21 ASN 91 -11.622 -2.818 6.212 650 HD22 ASN 91 HD22 ASN 91 -10.512 -1.732 6.980 651 H THR 92 H THR 92 -11.863 3.156 4.719 652 HA THR 92 HA THR 92 -9.728 4.824 5.578 653 HB THR 92 HB THR 92 -10.986 5.547 3.035 654 HG1 THR 92 HG1 THR 92 -9.592 3.822 2.706 655 HG21 THR 92 HG21 THR 92 -9.357 7.274 2.919 656 HG22 THR 92 HG22 THR 92 -8.729 6.805 4.333 657 HG23 THR 92 HG23 THR 92 -10.209 7.453 4.281 658 H SER 93 H SER 93 -10.722 6.681 6.700 659 HA SER 93 HA SER 93 -13.584 6.587 6.853 660 HB2 SER 93 HB2 SER 93 -12.487 6.894 8.923 661 HB3 SER 93 HB3 SER 93 -11.681 8.192 8.345 662 HG SER 93 HG SER 93 -13.231 9.404 8.873 663 H GLN 94 H GLN 94 -11.075 8.923 6.173 664 HA GLN 94 HA GLN 94 -12.588 10.068 4.080 665 HB2 GLN 94 HB2 GLN 94 -12.598 12.296 4.940 666 HB3 GLN 94 HB3 GLN 94 -13.380 11.322 5.993 667 HG2 GLN 94 HG2 GLN 94 -11.490 11.303 7.416 668 HG3 GLN 94 HG3 GLN 94 -10.655 12.212 6.346 669 HE21 GLN 94 HE21 GLN 94 -12.922 13.934 9.076 670 HE22 GLN 94 HE22 GLN 94 -12.684 12.221 8.981 671 H TRP 95 H TRP 95 -11.301 11.812 2.887 672 HA TRP 95 HA TRP 95 -8.615 12.054 3.818 673 HB2 TRP 95 HB2 TRP 95 -7.637 11.637 1.665 674 HB3 TRP 95 HB3 TRP 95 -8.204 10.304 2.419 675 HD1 TRP 95 HD1 TRP 95 -10.478 9.227 1.368 676 HE1 TRP 95 HE1 TRP 95 -11.372 9.116 -0.972 677 HE3 TRP 95 HE3 TRP 95 -7.741 12.962 -0.523 678 HZ2 TRP 95 HZ2 TRP 95 -10.830 10.506 -3.357 679 HZ3 TRP 95 HZ3 TRP 95 -7.972 13.508 -2.871 680 HH2 TRP 95 HH2 TRP 95 -9.500 12.268 -4.269 681 H HIS 96 H HIS 96 -7.645 14.046 3.312 682 HA HIS 96 HA HIS 96 -9.150 15.782 1.643 683 HB2 HIS 96 HB2 HIS 96 -9.382 17.481 3.414 684 HB3 HIS 96 HB3 HIS 96 -10.341 16.175 3.614 685 HD1 HIS 96 HD1 HIS 96 -10.547 15.525 6.016 686 HD2 HIS 96 HD2 HIS 96 -6.815 16.884 5.005 687 HE1 HIS 96 HE1 HIS 96 -9.104 15.449 8.039 688 HE2 HIS 96 HE2 HIS 96 -6.856 16.281 7.459 689 H TYR 97 H TYR 97 -8.206 17.812 1.125 690 HA TYR 97 HA TYR 97 -5.341 17.694 1.388 691 HB2 TYR 97 HB2 TYR 97 -6.983 18.264 -0.901 692 HB3 TYR 97 HB3 TYR 97 -5.508 18.962 -0.838 693 HD1 TYR 97 HD1 TYR 97 -6.756 15.528 -0.350 694 HD2 TYR 97 HD2 TYR 97 -3.938 17.959 -2.215 695 HE1 TYR 97 HE1 TYR 97 -5.748 13.581 -1.390 696 HE2 TYR 97 HE2 TYR 97 -2.954 16.020 -3.262 697 HH TYR 97 HH TYR 97 -3.593 12.858 -2.366 698 H TYR 98 H TYR 98 -4.307 19.465 2.155 699 HA TYR 98 HA TYR 98 -5.749 21.974 2.189 700 HB2 TYR 98 HB2 TYR 98 -3.974 20.884 4.168 701 HB3 TYR 98 HB3 TYR 98 -4.218 22.497 4.093 702 HD1 TYR 98 HD1 TYR 98 -5.967 19.369 4.699 703 HD2 TYR 98 HD2 TYR 98 -6.071 23.502 5.172 704 HE1 TYR 98 HE1 TYR 98 -7.902 19.164 6.133 705 HE2 TYR 98 HE2 TYR 98 -8.008 23.291 6.597 706 HH TYR 98 HH TYR 98 -10.000 21.068 6.747 707 H ILE 99 H ILE 99 -4.286 23.905 1.941 708 HA ILE 99 HA ILE 99 -1.703 23.238 0.835 709 HB ILE 99 HB ILE 99 -1.851 25.130 -0.671 710 HG12 ILE 99 HG12 ILE 99 -4.640 25.360 -0.010 711 HG13 ILE 99 HG13 ILE 99 -3.513 26.321 0.677 712 HG21 ILE 99 HG21 ILE 99 -3.363 24.116 -2.264 713 HG22 ILE 99 HG22 ILE 99 -3.985 23.194 -1.091 714 HG23 ILE 99 HG23 ILE 99 -2.454 22.976 -1.565 715 HD11 ILE 99 HD11 ILE 99 -4.570 27.469 -1.133 716 HD12 ILE 99 HD12 ILE 99 -4.121 26.300 -2.156 717 HD13 ILE 99 HD13 ILE 99 -3.005 27.251 -1.475 718 H THR 100 H THR 100 -0.075 25.091 1.181 719 HA THR 100 HA THR 100 -1.021 26.817 3.247 720 HB THR 100 HB THR 100 0.482 25.284 4.325 721 HG1 THR 100 HG1 THR 100 1.259 27.917 4.201 722 HG21 THR 100 HG21 THR 100 2.808 25.271 3.805 723 HG22 THR 100 HG22 THR 100 2.566 26.330 2.607 724 HG23 THR 100 HG23 THR 100 1.977 24.829 2.490 725 H LYS 101 H LYS 101 -0.652 28.984 3.168 726 HA LYS 101 HA LYS 101 0.813 29.849 0.845 727 HB2 LYS 101 HB2 LYS 101 -1.401 31.095 2.237 728 HB3 LYS 101 HB3 LYS 101 -0.565 31.907 1.093 729 HG2 LYS 101 HG2 LYS 101 -1.476 30.749 -0.581 730 HG3 LYS 101 HG3 LYS 101 -1.666 29.404 0.326 731 HD2 LYS 101 HD2 LYS 101 -3.777 30.191 -0.119 732 HD3 LYS 101 HD3 LYS 101 -3.483 30.518 1.454 733 HE2 LYS 101 HE2 LYS 101 -3.040 32.785 0.915 734 HE3 LYS 101 HE3 LYS 101 -3.284 32.467 -0.668 735 HZ1 LYS 101 HZ1 LYS 101 -5.244 33.426 0.284 736 HZ2 LYS 101 HZ2 LYS 101 -5.313 32.229 1.368 737 HZ3 LYS 101 HZ3 LYS 101 -5.554 31.914 -0.199 738 H LYS 102 H LYS 102 2.798 30.622 1.138 739 HA LYS 102 HA LYS 102 3.531 31.934 3.528 740 HB2 LYS 102 HB2 LYS 102 5.573 32.422 2.462 741 HB3 LYS 102 HB3 LYS 102 5.193 30.840 2.317 742 HG2 LYS 102 HG2 LYS 102 4.525 31.210 0.071 743 HG3 LYS 102 HG3 LYS 102 4.915 32.789 0.217 744 HD2 LYS 102 HD2 LYS 102 7.187 32.162 0.634 745 HD3 LYS 102 HD3 LYS 102 6.779 30.598 0.406 746 HE2 LYS 102 HE2 LYS 102 6.256 31.020 -1.846 747 HE3 LYS 102 HE3 LYS 102 6.515 32.619 -1.637 748 HZ1 LYS 102 HZ1 LYS 102 8.400 31.617 -2.685 749 HZ2 LYS 102 HZ2 LYS 102 8.565 30.601 -1.438 750 HZ3 LYS 102 HZ3 LYS 102 8.821 32.184 -1.230 751 H GLY 103 H GLY 103 4.077 34.279 3.730 752 HA2 GLY 103 HA2 GLY 103 3.906 36.405 2.617 753 HA3 GLY 103 HA3 GLY 103 2.604 35.859 1.797 754 H TRP 104 H TRP 104 2.482 34.863 4.913 755 HA TRP 104 HA TRP 104 0.312 36.353 5.633 756 HB2 TRP 104 HB2 TRP 104 0.891 35.497 7.915 757 HB3 TRP 104 HB3 TRP 104 0.841 34.326 6.778 758 HD1 TRP 104 HD1 TRP 104 3.460 36.391 8.527 759 HE1 TRP 104 HE1 TRP 104 5.681 35.242 8.644 760 HE3 TRP 104 HE3 TRP 104 2.195 32.335 5.896 761 HZ2 TRP 104 HZ2 TRP 104 6.700 32.805 7.658 762 HZ3 TRP 104 HZ3 TRP 104 3.848 30.600 5.557 763 HH2 TRP 104 HH2 TRP 104 6.080 30.847 6.434 764 H ASP 105 H ASP 105 -0.025 37.911 7.406 765 HA ASP 105 HA ASP 105 1.825 39.983 7.512 766 HB2 ASP 105 HB2 ASP 105 -0.387 39.307 9.223 767 HB3 ASP 105 HB3 ASP 105 0.557 40.591 9.580 768 HA PRO 106 HA PRO 106 4.294 37.990 10.523 769 HB2 PRO 106 HB2 PRO 106 5.866 39.911 11.529 770 HB3 PRO 106 HB3 PRO 106 6.084 39.467 9.973 771 HG2 PRO 106 HG2 PRO 106 4.548 41.673 10.956 772 HG3 PRO 106 HG3 PRO 106 5.661 41.691 9.761 773 HD2 PRO 106 HD2 PRO 106 3.123 41.525 9.178 774 HD3 PRO 106 HD3 PRO 106 4.224 40.753 8.252 775 H ASP 107 H ASP 107 2.299 40.488 11.574 776 HA ASP 107 HA ASP 107 2.648 39.679 14.311 777 HB2 ASP 107 HB2 ASP 107 2.886 42.069 13.683 778 HB3 ASP 107 HB3 ASP 107 1.269 42.083 13.453 779 H LYS 108 H LYS 108 0.998 38.260 12.355 780 HA LYS 108 HA LYS 108 -1.521 38.339 13.826 781 HB2 LYS 108 HB2 LYS 108 -1.249 37.664 11.046 782 HB3 LYS 108 HB3 LYS 108 -2.653 37.680 11.879 783 HG2 LYS 108 HG2 LYS 108 -1.095 40.035 11.377 784 HG3 LYS 108 HG3 LYS 108 -2.360 39.583 10.447 785 HD2 LYS 108 HD2 LYS 108 -3.846 40.003 12.166 786 HD3 LYS 108 HD3 LYS 108 -2.623 40.275 13.213 787 HE2 LYS 108 HE2 LYS 108 -3.528 42.356 12.418 788 HE3 LYS 108 HE3 LYS 108 -1.963 42.199 11.977 789 HZ1 LYS 108 HZ1 LYS 108 -3.247 43.032 10.152 790 HZ2 LYS 108 HZ2 LYS 108 -4.204 41.730 10.214 791 HZ3 LYS 108 HZ3 LYS 108 -2.655 41.575 9.776 792 HA PRO 109 HA PRO 109 -0.443 34.182 14.435 793 HB2 PRO 109 HB2 PRO 109 -2.688 32.832 14.822 794 HB3 PRO 109 HB3 PRO 109 -2.264 33.957 15.928 795 HG2 PRO 109 HG2 PRO 109 -4.093 34.256 13.748 796 HG3 PRO 109 HG3 PRO 109 -4.320 34.690 15.306 797 HD2 PRO 109 HD2 PRO 109 -3.566 36.459 13.531 798 HD3 PRO 109 HD3 PRO 109 -3.070 36.581 15.082 799 H LEU 110 H LEU 110 0.573 34.110 12.433 800 HA LEU 110 HA LEU 110 -0.606 33.196 10.144 801 HB2 LEU 110 HB2 LEU 110 1.641 32.542 9.509 802 HB3 LEU 110 HB3 LEU 110 1.523 34.083 10.036 803 HG LEU 110 HG LEU 110 2.318 32.426 12.097 804 HD11 LEU 110 HD11 LEU 110 4.465 31.818 11.256 805 HD12 LEU 110 HD12 LEU 110 4.060 32.390 9.799 806 HD13 LEU 110 HD13 LEU 110 3.302 31.094 10.398 807 HD21 LEU 110 HD21 LEU 110 4.075 34.048 12.315 808 HD22 LEU 110 HD22 LEU 110 2.652 34.798 12.146 809 HD23 LEU 110 HD23 LEU 110 3.665 34.692 10.889 810 H LYS 111 H LYS 111 0.720 31.412 12.779 811 HA LYS 111 HA LYS 111 0.450 28.917 11.759 812 HB2 LYS 111 HB2 LYS 111 0.438 28.188 14.103 813 HB3 LYS 111 HB3 LYS 111 1.623 29.262 13.776 814 HG2 LYS 111 HG2 LYS 111 -0.732 30.461 14.738 815 HG3 LYS 111 HG3 LYS 111 -0.018 29.474 15.824 816 HD2 LYS 111 HD2 LYS 111 1.421 31.630 14.547 817 HD3 LYS 111 HD3 LYS 111 0.669 31.825 15.984 818 HE2 LYS 111 HE2 LYS 111 2.095 30.143 16.934 819 HE3 LYS 111 HE3 LYS 111 2.871 30.013 15.503 820 HZ1 LYS 111 HZ1 LYS 111 4.115 31.406 16.983 821 HZ2 LYS 111 HZ2 LYS 111 2.849 32.401 17.129 822 HZ3 LYS 111 HZ3 LYS 111 3.617 32.272 15.712 823 H ARG 112 H ARG 112 -2.116 30.897 12.647 824 HA ARG 112 HA ARG 112 -3.928 28.712 12.623 825 HB2 ARG 112 HB2 ARG 112 -4.363 31.546 13.007 826 HB3 ARG 112 HB3 ARG 112 -5.632 30.527 12.882 827 HG2 ARG 112 HG2 ARG 112 -3.670 30.421 14.986 828 HG3 ARG 112 HG3 ARG 112 -5.169 31.048 15.152 829 HD2 ARG 112 HD2 ARG 112 -6.063 28.846 14.634 830 HD3 ARG 112 HD3 ARG 112 -4.537 28.269 14.701 831 HE ARG 112 HE ARG 112 -5.126 29.603 17.076 832 HH11 ARG 112 HH11 ARG 112 -5.754 26.540 15.453 833 HH12 ARG 112 HH12 ARG 112 -6.059 25.713 16.944 834 HH21 ARG 112 HH21 ARG 112 -5.538 28.478 18.937 835 HH22 ARG 112 HH22 ARG 112 -5.938 26.794 18.884 836 H ALA 113 H ALA 113 -3.207 31.487 10.717 837 HA ALA 113 HA ALA 113 -5.274 30.928 8.907 838 HB1 ALA 113 HB1 ALA 113 -4.706 33.262 9.548 839 HB2 ALA 113 HB2 ALA 113 -4.654 33.123 7.938 840 HB3 ALA 113 HB3 ALA 113 -3.283 33.105 8.796 841 H ASP 114 H ASP 114 -2.120 29.952 8.912 842 HA ASP 114 HA ASP 114 -1.537 30.425 6.276 843 HB2 ASP 114 HB2 ASP 114 -0.318 28.600 8.198 844 HB3 ASP 114 HB3 ASP 114 0.295 28.684 6.687 845 H PHE 115 H PHE 115 -3.212 27.821 7.657 846 HA PHE 115 HA PHE 115 -2.838 26.265 5.276 847 HB2 PHE 115 HB2 PHE 115 -3.599 24.361 6.547 848 HB3 PHE 115 HB3 PHE 115 -2.291 25.058 7.234 849 HD1 PHE 115 HD1 PHE 115 -2.557 26.425 9.322 850 HD2 PHE 115 HD2 PHE 115 -5.678 24.184 7.722 851 HE1 PHE 115 HE1 PHE 115 -3.760 26.626 11.399 852 HE2 PHE 115 HE2 PHE 115 -6.887 24.372 9.802 853 HZ PHE 115 HZ PHE 115 -5.932 25.607 11.642 854 H GLU 116 H GLU 116 -4.324 25.995 3.760 855 HA GLU 116 HA GLU 116 -7.035 26.692 4.470 856 HB2 GLU 116 HB2 GLU 116 -5.655 27.405 2.031 857 HB3 GLU 116 HB3 GLU 116 -7.266 27.602 2.212 858 HG2 GLU 116 HG2 GLU 116 -6.848 29.140 3.989 859 HG3 GLU 116 HG3 GLU 116 -5.244 28.982 3.722 860 H LEU 117 H LEU 117 -8.722 25.440 3.671 861 HA LEU 117 HA LEU 117 -7.951 22.877 2.778 862 HB2 LEU 117 HB2 LEU 117 -9.793 23.173 4.278 863 HB3 LEU 117 HB3 LEU 117 -10.597 24.004 3.124 864 HG LEU 117 HG LEU 117 -10.645 21.917 1.845 865 HD11 LEU 117 HD11 LEU 117 -10.393 19.875 3.071 866 HD12 LEU 117 HD12 LEU 117 -9.908 20.709 4.368 867 HD13 LEU 117 HD13 LEU 117 -8.992 20.683 3.036 868 HD21 LEU 117 HD21 LEU 117 -12.571 21.095 3.050 869 HD22 LEU 117 HD22 LEU 117 -12.617 22.709 2.967 870 HD23 LEU 117 HD23 LEU 117 -12.145 21.983 4.333 871 H ILE 118 H ILE 118 -7.798 22.119 0.683 872 HA ILE 118 HA ILE 118 -9.025 23.796 -1.325 873 HB ILE 118 HB ILE 118 -6.534 23.590 -1.398 874 HG12 ILE 118 HG12 ILE 118 -7.758 22.925 -3.898 875 HG13 ILE 118 HG13 ILE 118 -7.967 24.397 -3.221 876 HG21 ILE 118 HG21 ILE 118 -5.618 21.647 -2.448 877 HG22 ILE 118 HG22 ILE 118 -7.077 20.949 -2.454 878 HG23 ILE 118 HG23 ILE 118 -6.326 21.242 -1.052 879 HD11 ILE 118 HD11 ILE 118 -6.228 24.493 -4.865 880 HD12 ILE 118 HD12 ILE 118 -5.400 23.351 -4.076 881 HD13 ILE 118 HD13 ILE 118 -5.606 24.808 -3.406 882 H GLY 119 H GLY 119 -9.437 20.968 0.211 883 HA2 GLY 119 HA2 GLY 119 -11.665 20.283 -1.139 884 HA3 GLY 119 HA3 GLY 119 -10.487 19.449 -1.904 885 H ALA 120 H ALA 120 -12.769 18.424 -0.438 886 HA ALA 120 HA ALA 120 -11.318 16.678 1.311 887 HB1 ALA 120 HB1 ALA 120 -12.262 18.316 2.814 888 HB2 ALA 120 HB2 ALA 120 -12.991 16.895 3.067 889 HB3 ALA 120 HB3 ALA 120 -13.735 18.045 2.207 890 H VAL 121 H VAL 121 -12.039 14.554 1.335 891 HA VAL 121 HA VAL 121 -14.439 14.039 -0.110 892 HB VAL 121 HB VAL 121 -11.937 12.622 -0.660 893 HG11 VAL 121 HG11 VAL 121 -13.122 11.385 -2.347 894 HG12 VAL 121 HG12 VAL 121 -14.497 12.122 -1.923 895 HG13 VAL 121 HG13 VAL 121 -13.772 11.108 -0.892 896 HG21 VAL 121 HG21 VAL 121 -12.021 13.577 -2.873 897 HG22 VAL 121 HG22 VAL 121 -11.953 14.754 -1.766 898 HG23 VAL 121 HG23 VAL 121 -13.360 14.391 -2.475 899 HA PRO 122 HA PRO 122 -14.382 11.180 3.270 900 HB2 PRO 122 HB2 PRO 122 -16.920 10.649 3.616 901 HB3 PRO 122 HB3 PRO 122 -16.387 12.125 4.069 902 HG2 PRO 122 HG2 PRO 122 -17.711 11.417 1.632 903 HG3 PRO 122 HG3 PRO 122 -18.035 12.685 2.609 904 HD2 PRO 122 HD2 PRO 122 -16.530 12.961 0.451 905 HD3 PRO 122 HD3 PRO 122 -16.326 13.924 1.754 906 H HIS 123 H HIS 123 -14.554 8.911 3.556 907 HA HIS 123 HA HIS 123 -14.992 7.473 1.033 908 HB2 HIS 123 HB2 HIS 123 -12.868 7.121 1.918 909 HB3 HIS 123 HB3 HIS 123 -13.495 6.771 3.385 910 HD1 HIS 123 HD1 HIS 123 -14.989 4.477 3.529 911 HD2 HIS 123 HD2 HIS 123 -12.366 4.905 0.407 912 HE1 HIS 123 HE1 HIS 123 -14.539 2.228 2.563 913 HE2 HIS 123 HE2 HIS 123 -12.960 2.461 0.678 914 H ASP 124 H ASP 124 -17.263 7.428 1.086 915 HA ASP 124 HA ASP 124 -18.440 5.829 3.104 916 HB2 ASP 124 HB2 ASP 124 -18.336 8.086 4.096 917 HB3 ASP 124 HB3 ASP 124 -19.354 8.583 2.919 918 H GLY 125 H GLY 125 -18.442 4.973 0.694 919 HA2 GLY 125 HA2 GLY 125 -19.769 4.420 -1.044 920 HA3 GLY 125 HA3 GLY 125 -21.061 4.907 -0.171 921 H SER 126 H SER 126 -18.786 7.271 -0.679 922 HA SER 126 HA SER 126 -20.545 9.017 -1.771 923 HB2 SER 126 HB2 SER 126 -17.953 9.828 -2.400 924 HB3 SER 126 HB3 SER 126 -18.788 10.304 -1.079 925 HG SER 126 HG SER 126 -18.018 8.577 0.063 926 HA PRO 127 HA PRO 127 -20.628 8.573 -6.089 927 HB2 PRO 127 HB2 PRO 127 -21.005 11.048 -6.979 928 HB3 PRO 127 HB3 PRO 127 -22.196 10.353 -6.103 929 HG2 PRO 127 HG2 PRO 127 -20.155 12.107 -5.178 930 HG3 PRO 127 HG3 PRO 127 -21.766 12.237 -4.942 931 HD2 PRO 127 HD2 PRO 127 -20.312 11.175 -3.091 932 HD3 PRO 127 HD3 PRO 127 -21.788 10.545 -3.396 933 H ALA 128 H ALA 128 -19.694 10.111 -8.177 934 HA ALA 128 HA ALA 128 -17.285 9.051 -8.447 935 HB1 ALA 128 HB1 ALA 128 -18.599 10.105 -10.271 936 HB2 ALA 128 HB2 ALA 128 -17.042 10.519 -10.408 937 HB3 ALA 128 HB3 ALA 128 -18.101 11.557 -9.763 938 H SER 129 H SER 129 -17.669 11.951 -6.717 939 HA SER 129 HA SER 129 -15.079 12.836 -6.841 940 HB2 SER 129 HB2 SER 129 -16.922 14.112 -5.829 941 HB3 SER 129 HB3 SER 129 -16.815 13.150 -4.514 942 HG SER 129 HG SER 129 -14.503 13.922 -4.608 943 H ARG 130 H ARG 130 -16.258 10.113 -5.307 944 HA ARG 130 HA ARG 130 -14.533 9.748 -3.214 945 HB2 ARG 130 HB2 ARG 130 -16.533 8.383 -3.870 946 HB3 ARG 130 HB3 ARG 130 -15.539 7.588 -4.894 947 HG2 ARG 130 HG2 ARG 130 -14.264 7.038 -2.785 948 HG3 ARG 130 HG3 ARG 130 -15.691 7.361 -2.058 949 HD2 ARG 130 HD2 ARG 130 -15.282 5.320 -4.076 950 HD3 ARG 130 HD3 ARG 130 -15.570 5.030 -2.495 951 HE ARG 130 HE ARG 130 -17.709 6.460 -3.493 952 HH11 ARG 130 HH11 ARG 130 -19.622 5.496 -4.012 953 HH12 ARG 130 HH12 ARG 130 -19.710 3.787 -4.280 954 HH21 ARG 130 HH21 ARG 130 -16.366 3.211 -3.725 955 HH22 ARG 130 HH22 ARG 130 -17.902 2.516 -4.122 956 H ASN 131 H ASN 131 -13.891 9.458 -6.512 957 HA ASN 131 HA ASN 131 -11.895 7.618 -6.450 958 HB2 ASN 131 HB2 ASN 131 -12.485 9.759 -8.295 959 HB3 ASN 131 HB3 ASN 131 -11.140 8.870 -8.554 960 HD21 ASN 131 HD21 ASN 131 -14.506 7.590 -9.997 961 HD22 ASN 131 HD22 ASN 131 -14.139 9.221 -9.544 962 H LEU 132 H LEU 132 -9.768 7.489 -6.110 963 HA LEU 132 HA LEU 132 -8.581 9.525 -4.630 964 HB2 LEU 132 HB2 LEU 132 -7.767 6.942 -5.459 965 HB3 LEU 132 HB3 LEU 132 -6.554 7.965 -5.073 966 HG LEU 132 HG LEU 132 -7.061 6.508 -3.304 967 HD11 LEU 132 HD11 LEU 132 -7.217 8.157 -1.522 968 HD12 LEU 132 HD12 LEU 132 -7.663 9.271 -2.606 969 HD13 LEU 132 HD13 LEU 132 -6.174 8.645 -2.657 970 HD21 LEU 132 HD21 LEU 132 -9.122 6.672 -2.068 971 HD22 LEU 132 HD22 LEU 132 -9.394 6.164 -3.579 972 HD23 LEU 132 HD23 LEU 132 -9.696 7.701 -3.175 973 H SER 133 H SER 133 -8.900 9.142 -7.862 974 HA SER 133 HA SER 133 -6.630 10.810 -8.522 975 HB2 SER 133 HB2 SER 133 -7.104 8.978 -10.009 976 HB3 SER 133 HB3 SER 133 -8.533 9.680 -10.371 977 HG SER 133 HG SER 133 -6.807 10.094 -11.846 978 H HIS 134 H HIS 134 -6.981 13.031 -8.467 979 HA HIS 134 HA HIS 134 -9.681 13.905 -8.762 980 HB2 HIS 134 HB2 HIS 134 -8.463 13.750 -6.344 981 HB3 HIS 134 HB3 HIS 134 -8.414 15.343 -6.702 982 HD1 HIS 134 HD1 HIS 134 -10.580 16.756 -6.519 983 HD2 HIS 134 HD2 HIS 134 -11.062 12.726 -5.935 984 HE1 HIS 134 HE1 HIS 134 -12.873 16.347 -5.628 985 HE2 HIS 134 HE2 HIS 134 -13.178 13.926 -5.269 986 H HIS 135 H HIS 135 -10.092 15.731 -9.808 987 HA HIS 135 HA HIS 135 -7.897 17.247 -10.802 988 HB2 HIS 135 HB2 HIS 135 -10.737 17.603 -11.138 989 HB3 HIS 135 HB3 HIS 135 -9.627 18.549 -11.872 990 HD1 HIS 135 HD1 HIS 135 -8.420 17.696 -13.984 991 HD2 HIS 135 HD2 HIS 135 -10.979 15.006 -12.255 992 HE1 HIS 135 HE1 HIS 135 -8.739 15.797 -15.551 993 HE2 HIS 135 HE2 HIS 135 -10.263 14.151 -14.525 994 H ILE 136 H ILE 136 -7.173 19.199 -9.997 995 HA ILE 136 HA ILE 136 -8.665 20.431 -7.847 996 HB ILE 136 HB ILE 136 -5.774 20.042 -7.856 997 HG12 ILE 136 HG12 ILE 136 -6.944 18.093 -7.165 998 HG13 ILE 136 HG13 ILE 136 -5.988 18.686 -5.981 999 HG21 ILE 136 HG21 ILE 136 -5.697 21.202 -5.738 1000 HG22 ILE 136 HG22 ILE 136 -7.280 21.512 -5.850 1001 HG23 ILE 136 HG23 ILE 136 -6.248 22.187 -6.895 1002 HD11 ILE 136 HD11 ILE 136 -8.087 17.959 -5.048 1003 HD12 ILE 136 HD12 ILE 136 -8.889 18.969 -6.023 1004 HD13 ILE 136 HD13 ILE 136 -7.942 19.557 -4.851 1005 H TYR 137 H TYR 137 -8.983 22.676 -8.261 1006 HA TYR 137 HA TYR 137 -7.567 23.700 -10.521 1007 HB2 TYR 137 HB2 TYR 137 -9.892 24.147 -10.467 1008 HB3 TYR 137 HB3 TYR 137 -9.727 24.927 -9.042 1009 HD1 TYR 137 HD1 TYR 137 -8.993 27.243 -8.955 1010 HD2 TYR 137 HD2 TYR 137 -9.023 25.187 -12.576 1011 HE1 TYR 137 HE1 TYR 137 -8.571 29.309 -10.133 1012 HE2 TYR 137 HE2 TYR 137 -8.613 27.262 -13.750 1013 HH TYR 137 HH TYR 137 -8.248 29.459 -13.632 1014 H ILE 138 H ILE 138 -5.888 25.127 -10.444 1015 HA ILE 138 HA ILE 138 -5.338 26.413 -7.904 1016 HB ILE 138 HB ILE 138 -3.340 25.216 -9.672 1017 HG12 ILE 138 HG12 ILE 138 -4.036 24.444 -6.965 1018 HG13 ILE 138 HG13 ILE 138 -4.535 23.627 -8.288 1019 HG21 ILE 138 HG21 ILE 138 -1.676 25.889 -8.096 1020 HG22 ILE 138 HG22 ILE 138 -2.800 26.653 -7.220 1021 HG23 ILE 138 HG23 ILE 138 -2.426 27.189 -8.699 1022 HD11 ILE 138 HD11 ILE 138 -2.718 22.475 -7.254 1023 HD12 ILE 138 HD12 ILE 138 -1.777 23.781 -7.417 1024 HD13 ILE 138 HD13 ILE 138 -2.271 22.972 -8.727 1025 HA PRO 139 HA PRO 139 -5.401 29.836 -10.635 1026 HB2 PRO 139 HB2 PRO 139 -4.526 31.851 -9.130 1027 HB3 PRO 139 HB3 PRO 139 -5.995 31.219 -8.797 1028 HG2 PRO 139 HG2 PRO 139 -3.505 30.574 -7.560 1029 HG3 PRO 139 HG3 PRO 139 -4.906 30.978 -6.825 1030 HD2 PRO 139 HD2 PRO 139 -4.284 28.471 -7.079 1031 HD3 PRO 139 HD3 PRO 139 -5.845 28.924 -7.236 1032 H GLU 140 H GLU 140 -4.057 31.502 -11.694 1033 HA GLU 140 HA GLU 140 -1.265 30.664 -11.780 1034 HB2 GLU 140 HB2 GLU 140 -2.659 29.845 -13.644 1035 HB3 GLU 140 HB3 GLU 140 -2.747 31.401 -14.131 1036 HG2 GLU 140 HG2 GLU 140 -0.474 31.445 -14.614 1037 HG3 GLU 140 HG3 GLU 140 -0.253 29.978 -13.931 1038 H ASP 141 H ASP 141 -2.328 32.707 -10.204 1039 HA ASP 141 HA ASP 141 -2.055 35.083 -11.688 1040 HB2 ASP 141 HB2 ASP 141 -2.929 36.201 -9.739 1041 HB3 ASP 141 HB3 ASP 141 -3.824 34.863 -10.017 1042 H ARG 142 H ARG 142 -0.147 33.443 -9.376 1043 HA ARG 142 HA ARG 142 1.922 35.391 -9.686 1044 HB2 ARG 142 HB2 ARG 142 0.986 34.600 -7.050 1045 HB3 ARG 142 HB3 ARG 142 2.339 35.485 -7.286 1046 HG2 ARG 142 HG2 ARG 142 1.065 37.276 -8.073 1047 HG3 ARG 142 HG3 ARG 142 -0.300 36.389 -7.941 1048 HD2 ARG 142 HD2 ARG 142 0.292 36.241 -5.525 1049 HD3 ARG 142 HD3 ARG 142 1.256 37.522 -5.834 1050 HE ARG 142 HE ARG 142 -1.372 37.915 -6.789 1051 HH11 ARG 142 HH11 ARG 142 -2.678 39.405 -5.846 1052 HH12 ARG 142 HH12 ARG 142 -2.273 40.094 -4.309 1053 HH21 ARG 142 HH21 ARG 142 0.643 38.296 -3.930 1054 HH22 ARG 142 HH22 ARG 142 -0.420 39.476 -3.238 1055 H LEU 143 H LEU 143 4.031 34.661 -8.626 1056 HA LEU 143 HA LEU 143 4.192 31.834 -8.915 1057 HB2 LEU 143 HB2 LEU 143 6.398 32.029 -9.611 1058 HB3 LEU 143 HB3 LEU 143 5.560 33.183 -10.408 1059 HG LEU 143 HG LEU 143 7.284 33.749 -8.192 1060 HD11 LEU 143 HD11 LEU 143 8.852 34.507 -9.923 1061 HD12 LEU 143 HD12 LEU 143 7.808 34.031 -11.062 1062 HD13 LEU 143 HD13 LEU 143 8.537 32.934 -10.124 1063 HD21 LEU 143 HD21 LEU 143 7.181 36.027 -8.837 1064 HD22 LEU 143 HD22 LEU 143 5.712 35.483 -8.439 1065 HD23 LEU 143 HD23 LEU 143 6.114 35.659 -9.995 1066 H GLY 144 H GLY 144 5.463 30.471 -7.581 1067 HA2 GLY 144 HA2 GLY 144 7.078 30.880 -5.635 1068 HA3 GLY 144 HA3 GLY 144 5.747 31.497 -4.917 1069 H TYR 145 H TYR 145 7.197 29.344 -3.841 1070 HA TYR 145 HA TYR 145 5.803 27.055 -4.665 1071 HB2 TYR 145 HB2 TYR 145 7.304 25.779 -3.440 1072 HB3 TYR 145 HB3 TYR 145 8.188 27.019 -4.030 1073 HD1 TYR 145 HD1 TYR 145 9.145 28.715 -2.525 1074 HD2 TYR 145 HD2 TYR 145 6.889 25.551 -1.036 1075 HE1 TYR 145 HE1 TYR 145 9.918 29.208 -0.280 1076 HE2 TYR 145 HE2 TYR 145 7.673 26.034 1.194 1077 HH TYR 145 HH TYR 145 8.572 27.986 2.503 1078 H HIS 146 H HIS 146 4.519 25.652 -3.595 1079 HA HIS 146 HA HIS 146 3.418 26.561 -1.097 1080 HB2 HIS 146 HB2 HIS 146 1.843 25.865 -3.416 1081 HB3 HIS 146 HB3 HIS 146 1.198 26.063 -1.928 1082 HD1 HIS 146 HD1 HIS 146 1.050 28.499 -0.917 1083 HD2 HIS 146 HD2 HIS 146 2.326 28.226 -4.802 1084 HE1 HIS 146 HE1 HIS 146 0.984 30.771 -1.936 1085 HE2 HIS 146 HE2 HIS 146 1.749 30.628 -4.280 1086 H VAL 147 H VAL 147 3.083 24.920 0.346 1087 HA VAL 147 HA VAL 147 3.717 22.291 -0.616 1088 HB VAL 147 HB VAL 147 3.486 23.102 2.159 1089 HG11 VAL 147 HG11 VAL 147 4.654 21.057 2.665 1090 HG12 VAL 147 HG12 VAL 147 4.668 20.673 1.094 1091 HG13 VAL 147 HG13 VAL 147 3.267 20.729 1.900 1092 HG21 VAL 147 HG21 VAL 147 5.900 23.218 2.205 1093 HG22 VAL 147 HG22 VAL 147 5.318 24.294 1.147 1094 HG23 VAL 147 HG23 VAL 147 5.949 22.902 0.620 1095 H ILE 148 H ILE 148 2.236 20.684 -0.720 1096 HA ILE 148 HA ILE 148 -0.470 21.363 -0.007 1097 HB ILE 148 HB ILE 148 0.400 19.345 -1.912 1098 HG12 ILE 148 HG12 ILE 148 -0.778 21.915 -2.515 1099 HG13 ILE 148 HG13 ILE 148 0.821 21.608 -2.650 1100 HG21 ILE 148 HG21 ILE 148 -1.922 19.149 -2.522 1101 HG22 ILE 148 HG22 ILE 148 -2.322 20.211 -1.370 1102 HG23 ILE 148 HG23 ILE 148 -1.730 18.762 -0.964 1103 HD11 ILE 148 HD11 ILE 148 -0.209 21.530 -4.786 1104 HD12 ILE 148 HD12 ILE 148 -1.215 20.370 -4.277 1105 HD13 ILE 148 HD13 ILE 148 0.368 20.067 -4.411 1106 H LEU 149 H LEU 149 -1.387 20.336 1.677 1107 HA LEU 149 HA LEU 149 0.096 18.191 2.883 1108 HB2 LEU 149 HB2 LEU 149 -1.926 19.858 4.087 1109 HB3 LEU 149 HB3 LEU 149 -1.049 18.739 4.891 1110 HG LEU 149 HG LEU 149 -0.271 20.681 5.638 1111 HD11 LEU 149 HD11 LEU 149 1.998 20.856 4.902 1112 HD12 LEU 149 HD12 LEU 149 1.650 19.918 3.632 1113 HD13 LEU 149 HD13 LEU 149 1.573 19.313 5.130 1114 HD21 LEU 149 HD21 LEU 149 0.349 22.581 4.267 1115 HD22 LEU 149 HD22 LEU 149 -1.213 22.215 4.062 1116 HD23 LEU 149 HD23 LEU 149 -0.126 21.775 2.948 1117 H ALA 150 H ALA 150 -0.701 16.188 2.261 1118 HA ALA 150 HA ALA 150 -3.564 15.983 1.882 1119 HB1 ALA 150 HB1 ALA 150 -2.306 15.366 -0.064 1120 HB2 ALA 150 HB2 ALA 150 -3.061 14.054 0.506 1121 HB3 ALA 150 HB3 ALA 150 -1.484 14.269 0.794 1122 H VAL 151 H VAL 151 -4.746 14.907 3.402 1123 HA VAL 151 HA VAL 151 -3.255 13.165 5.161 1124 HB VAL 151 HB VAL 151 -5.614 14.682 5.907 1125 HG11 VAL 151 HG11 VAL 151 -5.176 13.988 8.172 1126 HG12 VAL 151 HG12 VAL 151 -3.934 13.089 7.658 1127 HG13 VAL 151 HG13 VAL 151 -5.445 12.699 7.234 1128 HG21 VAL 151 HG21 VAL 151 -4.126 16.083 7.221 1129 HG22 VAL 151 HG22 VAL 151 -3.726 16.169 5.657 1130 HG23 VAL 151 HG23 VAL 151 -2.855 15.253 6.665 1131 H TRP 152 H TRP 152 -3.909 11.104 5.452 1132 HA TRP 152 HA TRP 152 -6.345 10.247 4.110 1133 HB2 TRP 152 HB2 TRP 152 -4.281 9.660 2.971 1134 HB3 TRP 152 HB3 TRP 152 -3.875 8.769 4.278 1135 HD1 TRP 152 HD1 TRP 152 -6.833 8.749 1.940 1136 HE1 TRP 152 HE1 TRP 152 -7.494 6.417 1.303 1137 HE3 TRP 152 HE3 TRP 152 -3.350 6.358 4.616 1138 HZ2 TRP 152 HZ2 TRP 152 -6.537 3.845 1.945 1139 HZ3 TRP 152 HZ3 TRP 152 -3.271 3.940 4.539 1140 HH2 TRP 152 HH2 TRP 152 -4.869 2.706 3.222 1141 H ASP 153 H ASP 153 -7.799 9.815 5.647 1142 HA ASP 153 HA ASP 153 -6.937 9.092 8.256 1143 HB2 ASP 153 HB2 ASP 153 -8.782 10.641 7.803 1144 HB3 ASP 153 HB3 ASP 153 -9.662 9.357 7.308 1145 H VAL 154 H VAL 154 -6.027 7.063 8.137 1146 HA VAL 154 HA VAL 154 -7.562 4.928 7.037 1147 HB VAL 154 HB VAL 154 -5.371 4.602 6.475 1148 HG11 VAL 154 HG11 VAL 154 -3.494 4.990 7.936 1149 HG12 VAL 154 HG12 VAL 154 -4.503 5.390 9.134 1150 HG13 VAL 154 HG13 VAL 154 -4.393 6.329 7.822 1151 HG21 VAL 154 HG21 VAL 154 -4.521 2.728 7.667 1152 HG22 VAL 154 HG22 VAL 154 -6.102 2.552 7.380 1153 HG23 VAL 154 HG23 VAL 154 -5.591 2.990 8.850 1154 H ALA 155 H ALA 155 -9.012 3.765 8.118 1155 HA ALA 155 HA ALA 155 -9.141 4.197 10.929 1156 HB1 ALA 155 HB1 ALA 155 -11.182 4.490 9.613 1157 HB2 ALA 155 HB2 ALA 155 -11.426 3.339 10.721 1158 HB3 ALA 155 HB3 ALA 155 -11.130 2.932 9.185 1159 H ASP 156 H ASP 156 -7.334 2.229 9.492 1160 HA ASP 156 HA ASP 156 -8.223 -0.195 10.723 1161 HB2 ASP 156 HB2 ASP 156 -6.098 0.123 8.748 1162 HB3 ASP 156 HB3 ASP 156 -6.722 -1.317 9.200 1163 H THR 157 H THR 157 -6.305 2.221 11.557 1164 HA THR 157 HA THR 157 -4.609 0.586 13.143 1165 HB THR 157 HB THR 157 -2.664 2.168 12.464 1166 HG1 THR 157 HG1 THR 157 -3.764 2.543 10.061 1167 HG21 THR 157 HG21 THR 157 -2.093 0.897 10.516 1168 HG22 THR 157 HG22 THR 157 -3.609 0.343 10.411 1169 HG23 THR 157 HG23 THR 157 -2.665 -0.113 11.642 1170 H GLU 158 H GLU 158 -3.293 1.870 14.828 1171 HA GLU 158 HA GLU 158 -4.851 3.964 15.878 1172 HB2 GLU 158 HB2 GLU 158 -2.212 3.161 16.733 1173 HB3 GLU 158 HB3 GLU 158 -3.202 4.137 17.591 1174 HG2 GLU 158 HG2 GLU 158 -3.404 2.163 18.639 1175 HG3 GLU 158 HG3 GLU 158 -4.725 2.201 17.680 1176 H ASN 159 H ASN 159 -2.927 3.820 13.402 1177 HA ASN 159 HA ASN 159 -1.529 6.279 13.797 1178 HB2 ASN 159 HB2 ASN 159 -1.216 4.350 11.637 1179 HB3 ASN 159 HB3 ASN 159 -0.266 5.667 11.821 1180 HD21 ASN 159 HD21 ASN 159 1.404 2.616 13.047 1181 HD22 ASN 159 HD22 ASN 159 0.571 3.003 11.578 1182 H ALA 160 H ALA 160 -1.667 7.969 12.209 1183 HA ALA 160 HA ALA 160 -3.831 7.725 10.276 1184 HB1 ALA 160 HB1 ALA 160 -4.443 9.377 11.833 1185 HB2 ALA 160 HB2 ALA 160 -4.071 10.113 10.442 1186 HB3 ALA 160 HB3 ALA 160 -3.016 10.118 11.667 1187 H PHE 161 H PHE 161 -3.241 8.587 8.153 1188 HA PHE 161 HA PHE 161 -0.374 8.694 7.821 1189 HB2 PHE 161 HB2 PHE 161 -1.387 6.839 6.704 1190 HB3 PHE 161 HB3 PHE 161 -2.401 7.852 5.921 1191 HD1 PHE 161 HD1 PHE 161 -1.552 9.315 4.097 1192 HD2 PHE 161 HD2 PHE 161 0.811 6.398 5.886 1193 HE1 PHE 161 HE1 PHE 161 0.061 9.540 2.331 1194 HE2 PHE 161 HE2 PHE 161 2.408 6.594 4.101 1195 HZ PHE 161 HZ PHE 161 2.065 8.201 2.355 1196 H TYR 162 H TYR 162 0.610 10.454 6.859 1197 HA TYR 162 HA TYR 162 -1.115 12.149 5.318 1198 HB2 TYR 162 HB2 TYR 162 -0.389 14.139 6.240 1199 HB3 TYR 162 HB3 TYR 162 -0.929 13.197 7.460 1200 HD1 TYR 162 HD1 TYR 162 0.664 12.241 9.115 1201 HD2 TYR 162 HD2 TYR 162 1.931 14.841 6.120 1202 HE1 TYR 162 HE1 TYR 162 2.748 12.591 10.292 1203 HE2 TYR 162 HE2 TYR 162 4.012 15.181 7.298 1204 HH TYR 162 HH TYR 162 4.574 14.142 10.490 1205 H GLN 163 H GLN 163 -0.034 13.380 3.650 1206 HA GLN 163 HA GLN 163 2.725 12.662 3.221 1207 HB2 GLN 163 HB2 GLN 163 0.670 11.668 1.716 1208 HB3 GLN 163 HB3 GLN 163 1.539 12.680 0.772 1209 HG2 GLN 163 HG2 GLN 163 2.723 10.467 2.184 1210 HG3 GLN 163 HG3 GLN 163 2.238 10.364 0.628 1211 HE21 GLN 163 HE21 GLN 163 4.843 12.841 -0.294 1212 HE22 GLN 163 HE22 GLN 163 3.114 12.920 -0.228 1213 H VAL 164 H VAL 164 3.874 14.249 1.947 1214 HA VAL 164 HA VAL 164 2.359 16.655 1.555 1215 HB VAL 164 HB VAL 164 4.377 17.933 2.146 1216 HG11 VAL 164 HG11 VAL 164 4.138 17.639 4.537 1217 HG12 VAL 164 HG12 VAL 164 3.359 16.244 4.288 1218 HG13 VAL 164 HG13 VAL 164 2.681 17.640 3.837 1219 HG21 VAL 164 HG21 VAL 164 6.158 16.806 3.300 1220 HG22 VAL 164 HG22 VAL 164 6.028 16.235 1.792 1221 HG23 VAL 164 HG23 VAL 164 5.437 15.383 3.033 1222 H ILE 165 H ILE 165 2.763 17.929 -0.248 1223 HA ILE 165 HA ILE 165 4.663 16.878 -2.156 1224 HB ILE 165 HB ILE 165 1.945 17.637 -2.902 1225 HG12 ILE 165 HG12 ILE 165 3.093 15.007 -3.121 1226 HG13 ILE 165 HG13 ILE 165 2.100 15.449 -1.903 1227 HG21 ILE 165 HG21 ILE 165 2.568 17.072 -5.176 1228 HG22 ILE 165 HG22 ILE 165 4.081 16.769 -4.692 1229 HG23 ILE 165 HG23 ILE 165 3.502 18.278 -4.639 1230 HD11 ILE 165 HD11 ILE 165 0.872 14.207 -3.546 1231 HD12 ILE 165 HD12 ILE 165 1.283 15.280 -4.684 1232 HD13 ILE 165 HD13 ILE 165 0.300 15.718 -3.478 1233 H ASP 166 H ASP 166 6.019 18.645 -2.762 1234 HA ASP 166 HA ASP 166 4.921 21.292 -2.240 1235 HB2 ASP 166 HB2 ASP 166 6.820 20.740 -0.910 1236 HB3 ASP 166 HB3 ASP 166 7.701 20.564 -2.274 1237 H VAL 167 H VAL 167 4.616 22.672 -3.914 1238 HA VAL 167 HA VAL 167 5.920 21.995 -6.364 1239 HB VAL 167 HB VAL 167 3.779 22.700 -7.539 1240 HG11 VAL 167 HG11 VAL 167 2.931 20.435 -7.509 1241 HG12 VAL 167 HG12 VAL 167 3.847 20.109 -6.217 1242 HG13 VAL 167 HG13 VAL 167 4.543 20.421 -7.643 1243 HG21 VAL 167 HG21 VAL 167 1.749 22.302 -6.303 1244 HG22 VAL 167 HG22 VAL 167 2.585 23.506 -5.620 1245 HG23 VAL 167 HG23 VAL 167 2.612 22.028 -4.964 1246 H ASP 168 H ASP 168 6.808 23.658 -7.491 1247 HA ASP 168 HA ASP 168 6.441 26.297 -6.406 1248 HB2 ASP 168 HB2 ASP 168 8.624 25.185 -7.231 1249 HB3 ASP 168 HB3 ASP 168 8.211 26.066 -8.543 1250 H LEU 169 H LEU 169 4.539 27.119 -7.064 1251 HA LEU 169 HA LEU 169 3.574 26.506 -9.700 1252 HB2 LEU 169 HB2 LEU 169 2.307 27.815 -7.463 1253 HB3 LEU 169 HB3 LEU 169 1.546 27.521 -8.878 1254 HG LEU 169 HG LEU 169 2.608 25.327 -7.363 1255 HD11 LEU 169 HD11 LEU 169 0.509 25.092 -6.231 1256 HD12 LEU 169 HD12 LEU 169 -0.008 26.472 -6.896 1257 HD13 LEU 169 HD13 LEU 169 1.204 26.495 -5.827 1258 HD21 LEU 169 HD21 LEU 169 0.934 24.060 -8.514 1259 HD22 LEU 169 HD22 LEU 169 1.887 24.816 -9.580 1260 HD23 LEU 169 HD23 LEU 169 0.416 25.402 -9.252 1261 H VAL 170 H VAL 170 3.629 27.978 -11.401 1262 HA VAL 170 HA VAL 170 4.285 30.611 -10.591 1263 HB VAL 170 HB VAL 170 5.924 30.865 -12.376 1264 HG11 VAL 170 HG11 VAL 170 7.613 29.277 -11.640 1265 HG12 VAL 170 HG12 VAL 170 6.471 28.409 -10.895 1266 HG13 VAL 170 HG13 VAL 170 6.838 29.890 -10.361 1267 HG21 VAL 170 HG21 VAL 170 6.470 29.057 -13.865 1268 HG22 VAL 170 HG22 VAL 170 4.926 29.498 -14.059 1269 HG23 VAL 170 HG23 VAL 170 5.286 28.164 -13.218 1270 H ASN 171 H ASN 171 3.924 32.421 -11.988 1271 HA ASN 171 HA ASN 171 1.652 32.062 -13.687 1272 HB2 ASN 171 HB2 ASN 171 1.624 34.479 -13.771 1273 HB3 ASN 171 HB3 ASN 171 1.562 33.927 -12.235 1274 HD21 ASN 171 HD21 ASN 171 4.632 36.176 -13.450 1275 HD22 ASN 171 HD22 ASN 171 3.402 35.629 -14.539 1276 H LYS 172 H LYS 172 1.670 32.989 -15.916 1277 HA LYS 172 HA LYS 172 4.105 32.506 -17.252 1278 HB2 LYS 172 HB2 LYS 172 2.936 32.974 -19.228 1279 HB3 LYS 172 HB3 LYS 172 1.946 32.095 -18.271 1280 HG2 LYS 172 HG2 LYS 172 0.896 34.200 -17.594 1281 HG3 LYS 172 HG3 LYS 172 1.756 34.931 -18.775 1282 HD2 LYS 172 HD2 LYS 172 -0.299 34.546 -19.705 1283 HD3 LYS 172 HD3 LYS 172 0.659 33.383 -20.336 1284 HE2 LYS 172 HE2 LYS 172 -0.137 31.843 -18.723 1285 HE3 LYS 172 HE3 LYS 172 -1.086 33.005 -18.077 1286 HZ1 LYS 172 HZ1 LYS 172 -2.357 31.555 -19.401 1287 HZ2 LYS 172 HZ2 LYS 172 -1.431 31.889 -20.684 1288 HZ3 LYS 172 HZ3 LYS 172 -2.370 33.039 -20.045 Start of MODEL 8 1 H1 HIS 1 H1 HIS 1 3.345 0.654 1.306 2 H2 HIS 1 H2 HIS 1 2.145 0.002 0.440 3 H3 HIS 1 H3 HIS 1 1.957 1.460 1.113 4 HA HIS 1 HA HIS 1 3.586 2.349 -0.284 5 HB2 HIS 1 HB2 HIS 1 4.608 1.081 -2.008 6 HB3 HIS 1 HB3 HIS 1 4.890 0.340 -0.579 7 HD1 HIS 1 HD1 HIS 1 3.799 -1.996 -0.110 8 HD2 HIS 1 HD2 HIS 1 3.067 -0.379 -3.805 9 HE1 HIS 1 HE1 HIS 1 2.793 -3.753 -1.557 10 HE2 HIS 1 HE2 HIS 1 2.341 -2.798 -3.788 11 H GLY 2 H GLY 2 3.168 3.158 -2.502 12 HA2 GLY 2 HA2 GLY 2 0.721 2.262 -3.688 13 HA3 GLY 2 HA3 GLY 2 0.690 3.788 -3.107 14 H PHE 3 H PHE 3 0.280 3.902 -5.677 15 HA PHE 3 HA PHE 3 2.855 4.548 -6.781 16 HB2 PHE 3 HB2 PHE 3 0.823 3.202 -8.330 17 HB3 PHE 3 HB3 PHE 3 2.343 3.530 -8.829 18 HD1 PHE 3 HD1 PHE 3 4.265 2.369 -7.479 19 HD2 PHE 3 HD2 PHE 3 0.312 1.068 -7.499 20 HE1 PHE 3 HE1 PHE 3 4.982 0.197 -6.713 21 HE2 PHE 3 HE2 PHE 3 1.017 -1.112 -6.753 22 HZ PHE 3 HZ PHE 3 3.361 -1.556 -6.374 23 H ILE 4 H ILE 4 2.763 6.105 -8.616 24 HA ILE 4 HA ILE 4 0.404 7.764 -8.445 25 HB ILE 4 HB ILE 4 3.054 8.680 -9.189 26 HG12 ILE 4 HG12 ILE 4 1.691 9.395 -6.756 27 HG13 ILE 4 HG13 ILE 4 2.727 8.134 -6.811 28 HG21 ILE 4 HG21 ILE 4 2.083 10.924 -9.122 29 HG22 ILE 4 HG22 ILE 4 0.636 10.289 -8.781 30 HG23 ILE 4 HG23 ILE 4 1.309 10.034 -10.228 31 HD11 ILE 4 HD11 ILE 4 3.819 10.051 -5.923 32 HD12 ILE 4 HD12 ILE 4 3.486 10.883 -7.269 33 HD13 ILE 4 HD13 ILE 4 4.512 9.635 -7.324 34 H GLU 5 H GLU 5 -0.886 7.786 -10.272 35 HA GLU 5 HA GLU 5 -0.029 6.226 -12.415 36 HB2 GLU 5 HB2 GLU 5 -2.401 6.756 -11.491 37 HB3 GLU 5 HB3 GLU 5 -2.386 7.842 -12.712 38 HG2 GLU 5 HG2 GLU 5 -3.390 6.115 -13.703 39 HG3 GLU 5 HG3 GLU 5 -1.837 5.844 -14.130 40 H LYS 6 H LYS 6 0.443 9.363 -11.812 41 HA LYS 6 HA LYS 6 1.426 11.004 -12.976 42 HB2 LYS 6 HB2 LYS 6 1.247 9.539 -15.455 43 HB3 LYS 6 HB3 LYS 6 2.097 10.917 -15.243 44 HG2 LYS 6 HG2 LYS 6 3.724 9.865 -14.057 45 HG3 LYS 6 HG3 LYS 6 2.773 8.576 -13.739 46 HD2 LYS 6 HD2 LYS 6 3.682 9.157 -16.416 47 HD3 LYS 6 HD3 LYS 6 4.528 8.178 -15.420 48 HE2 LYS 6 HE2 LYS 6 2.627 6.704 -15.293 49 HE3 LYS 6 HE3 LYS 6 1.833 7.665 -16.347 50 HZ1 LYS 6 HZ1 LYS 6 2.722 5.780 -17.471 51 HZ2 LYS 6 HZ2 LYS 6 4.212 6.174 -16.982 52 HZ3 LYS 6 HZ3 LYS 6 3.426 7.126 -18.027 53 HA PRO 7 HA PRO 7 1.693 13.007 -14.446 54 HB2 PRO 7 HB2 PRO 7 0.849 15.511 -14.107 55 HB3 PRO 7 HB3 PRO 7 0.674 14.821 -15.577 56 HG2 PRO 7 HG2 PRO 7 -1.274 15.015 -13.500 57 HG3 PRO 7 HG3 PRO 7 -1.457 15.396 -15.077 58 HD2 PRO 7 HD2 PRO 7 -2.271 13.079 -14.223 59 HD3 PRO 7 HD3 PRO 7 -1.603 13.194 -15.710 60 H GLY 8 H GLY 8 3.118 13.906 -12.997 61 HA2 GLY 8 HA2 GLY 8 3.395 15.001 -10.931 62 HA3 GLY 8 HA3 GLY 8 2.028 14.313 -10.364 63 H SER 9 H SER 9 3.944 12.044 -11.906 64 HA SER 9 HA SER 9 4.389 10.691 -9.547 65 HB2 SER 9 HB2 SER 9 4.368 9.489 -11.608 66 HB3 SER 9 HB3 SER 9 5.740 10.239 -12.081 67 HG SER 9 HG SER 9 5.453 8.095 -10.570 68 H ARG 10 H ARG 10 5.885 10.804 -7.950 69 HA ARG 10 HA ARG 10 7.983 12.654 -8.226 70 HB2 ARG 10 HB2 ARG 10 8.506 12.239 -5.979 71 HB3 ARG 10 HB3 ARG 10 6.881 12.326 -6.109 72 HG2 ARG 10 HG2 ARG 10 6.744 9.955 -5.981 73 HG3 ARG 10 HG3 ARG 10 8.369 9.870 -5.847 74 HD2 ARG 10 HD2 ARG 10 6.764 11.286 -3.899 75 HD3 ARG 10 HD3 ARG 10 7.161 9.714 -3.701 76 HE ARG 10 HE ARG 10 9.501 11.133 -4.082 77 HH11 ARG 10 HH11 ARG 10 10.841 11.631 -2.384 78 HH12 ARG 10 HH12 ARG 10 10.240 11.642 -0.760 79 HH21 ARG 10 HH21 ARG 10 7.036 10.730 -1.591 80 HH22 ARG 10 HH22 ARG 10 8.135 11.144 -0.318 81 H ALA 11 H ALA 11 7.630 9.388 -8.843 82 HA ALA 11 HA ALA 11 10.195 8.511 -8.371 83 HB1 ALA 11 HB1 ALA 11 8.368 6.971 -8.771 84 HB2 ALA 11 HB2 ALA 11 9.591 6.613 -9.768 85 HB3 ALA 11 HB3 ALA 11 8.310 7.431 -10.320 86 H ALA 12 H ALA 12 8.913 10.295 -11.000 87 HA ALA 12 HA ALA 12 10.986 9.844 -12.788 88 HB1 ALA 12 HB1 ALA 12 8.886 10.809 -13.506 89 HB2 ALA 12 HB2 ALA 12 10.095 11.776 -13.973 90 HB3 ALA 12 HB3 ALA 12 9.210 12.157 -12.674 91 H LEU 13 H LEU 13 10.734 11.833 -10.067 92 HA LEU 13 HA LEU 13 13.054 13.357 -10.731 93 HB2 LEU 13 HB2 LEU 13 11.031 13.655 -8.714 94 HB3 LEU 13 HB3 LEU 13 12.446 14.447 -8.518 95 HG LEU 13 HG LEU 13 11.999 15.637 -10.544 96 HD11 LEU 13 HD11 LEU 13 9.798 15.702 -11.480 97 HD12 LEU 13 HD12 LEU 13 9.343 14.496 -10.504 98 HD13 LEU 13 HD13 LEU 13 10.446 14.232 -11.656 99 HD21 LEU 13 HD21 LEU 13 10.340 17.108 -9.500 100 HD22 LEU 13 HD22 LEU 13 11.435 16.640 -8.406 101 HD23 LEU 13 HD23 LEU 13 9.981 15.934 -8.449 102 H CYS 14 H CYS 14 12.584 10.454 -9.498 103 HA CYS 14 HA CYS 14 14.198 10.596 -7.194 104 HB2 CYS 14 HB2 CYS 14 12.354 9.001 -7.800 105 HB3 CYS 14 HB3 CYS 14 13.538 8.165 -8.554 106 H SER 15 H SER 15 14.929 10.573 -10.340 107 HA SER 15 HA SER 15 16.853 8.683 -10.607 108 HB2 SER 15 HB2 SER 15 16.026 9.809 -12.554 109 HB3 SER 15 HB3 SER 15 16.574 11.246 -12.002 110 HG SER 15 HG SER 15 18.689 10.029 -12.159 111 H GLU 16 H GLU 16 19.006 8.462 -10.520 112 HA GLU 16 HA GLU 16 20.391 9.875 -8.637 113 HB2 GLU 16 HB2 GLU 16 22.276 8.593 -9.315 114 HB3 GLU 16 HB3 GLU 16 20.959 7.631 -9.405 115 HG2 GLU 16 HG2 GLU 16 22.312 8.829 -11.661 116 HG3 GLU 16 HG3 GLU 16 22.311 7.238 -11.291 117 H ALA 17 H ALA 17 19.768 10.715 -11.804 118 HA ALA 17 HA ALA 17 21.922 12.271 -12.394 119 HB1 ALA 17 HB1 ALA 17 20.200 11.702 -14.030 120 HB2 ALA 17 HB2 ALA 17 20.463 13.297 -14.066 121 HB3 ALA 17 HB3 ALA 17 19.170 12.708 -13.294 122 H PHE 18 H PHE 18 19.728 12.835 -9.988 123 HA PHE 18 HA PHE 18 19.797 15.635 -10.012 124 HB2 PHE 18 HB2 PHE 18 18.034 14.277 -8.955 125 HB3 PHE 18 HB3 PHE 18 19.098 13.895 -7.777 126 HD1 PHE 18 HD1 PHE 18 17.237 16.660 -9.168 127 HD2 PHE 18 HD2 PHE 18 19.396 15.294 -5.888 128 HE1 PHE 18 HE1 PHE 18 16.519 18.589 -7.907 129 HE2 PHE 18 HE2 PHE 18 18.717 17.228 -4.620 130 HZ PHE 18 HZ PHE 18 17.268 18.884 -5.631 131 H GLY 19 H GLY 19 22.093 13.380 -9.026 132 HA2 GLY 19 HA2 GLY 19 23.923 15.289 -8.357 133 HA3 GLY 19 HA3 GLY 19 23.241 14.822 -6.948 134 H PHE 20 H PHE 20 23.177 12.089 -8.493 135 HA PHE 20 HA PHE 20 24.345 10.263 -8.363 136 HB2 PHE 20 HB2 PHE 20 25.784 11.730 -9.899 137 HB3 PHE 20 HB3 PHE 20 26.899 11.527 -8.724 138 HD1 PHE 20 HD1 PHE 20 24.784 9.579 -10.954 139 HD2 PHE 20 HD2 PHE 20 28.325 9.665 -8.770 140 HE1 PHE 20 HE1 PHE 20 25.421 7.451 -11.912 141 HE2 PHE 20 HE2 PHE 20 28.975 7.544 -9.725 142 HZ PHE 20 HZ PHE 20 27.516 6.433 -11.298 143 H LEU 21 H LEU 21 24.000 11.576 -5.844 144 HA LEU 21 HA LEU 21 26.178 10.447 -4.350 145 HB2 LEU 21 HB2 LEU 21 24.019 12.116 -3.393 146 HB3 LEU 21 HB3 LEU 21 25.246 11.594 -2.450 147 HG LEU 21 HG LEU 21 25.552 13.455 -4.616 148 HD11 LEU 21 HD11 LEU 21 25.885 15.109 -2.859 149 HD12 LEU 21 HD12 LEU 21 25.594 13.976 -1.742 150 HD13 LEU 21 HD13 LEU 21 24.409 14.461 -2.729 151 HD21 LEU 21 HD21 LEU 21 27.779 13.786 -3.840 152 HD22 LEU 21 HD22 LEU 21 27.563 12.251 -4.300 153 HD23 LEU 21 HD23 LEU 21 27.568 12.630 -2.728 154 H ASN 22 H ASN 22 23.415 9.489 -5.603 155 HA ASN 22 HA ASN 22 22.806 7.640 -3.498 156 HB2 ASN 22 HB2 ASN 22 21.034 9.534 -4.717 157 HB3 ASN 22 HB3 ASN 22 20.385 8.072 -4.390 158 HD21 ASN 22 HD21 ASN 22 20.537 10.747 -1.568 159 HD22 ASN 22 HD22 ASN 22 20.749 11.067 -3.257 160 H LEU 23 H LEU 23 21.431 5.801 -4.170 161 HA LEU 23 HA LEU 23 22.213 4.702 -6.636 162 HB2 LEU 23 HB2 LEU 23 20.299 3.835 -4.686 163 HB3 LEU 23 HB3 LEU 23 20.496 3.022 -6.089 164 HG LEU 23 HG LEU 23 22.815 2.656 -5.381 165 HD11 LEU 23 HD11 LEU 23 23.308 2.717 -3.049 166 HD12 LEU 23 HD12 LEU 23 21.881 3.421 -2.760 167 HD13 LEU 23 HD13 LEU 23 23.014 4.207 -3.604 168 HD21 LEU 23 HD21 LEU 23 22.140 0.740 -4.026 169 HD22 LEU 23 HD22 LEU 23 21.151 0.894 -5.295 170 HD23 LEU 23 HD23 LEU 23 20.677 1.402 -3.835 171 H ASN 24 H ASN 24 20.515 4.008 -8.289 172 HA ASN 24 HA ASN 24 19.405 6.109 -9.418 173 HB2 ASN 24 HB2 ASN 24 18.293 3.405 -9.699 174 HB3 ASN 24 HB3 ASN 24 18.196 4.546 -10.863 175 HD21 ASN 24 HD21 ASN 24 20.772 2.175 -11.875 176 HD22 ASN 24 HD22 ASN 24 19.054 2.195 -11.654 177 H CYS 25 H CYS 25 17.848 4.520 -6.894 178 HA CYS 25 HA CYS 25 16.111 6.689 -6.629 179 HB2 CYS 25 HB2 CYS 25 14.885 5.325 -8.131 180 HB3 CYS 25 HB3 CYS 25 14.801 4.187 -6.962 181 H GLY 26 H GLY 26 17.613 3.887 -5.553 182 HA2 GLY 26 HA2 GLY 26 18.278 3.459 -3.415 183 HA3 GLY 26 HA3 GLY 26 17.376 4.699 -2.852 184 H SER 27 H SER 27 17.488 2.473 -1.313 185 HA SER 27 HA SER 27 15.398 0.729 -1.994 186 HB2 SER 27 HB2 SER 27 17.280 0.005 -0.607 187 HB3 SER 27 HB3 SER 27 16.687 0.912 0.614 188 HG SER 27 HG SER 27 14.729 -0.402 0.300 189 H VAL 28 H VAL 28 15.454 3.710 -0.594 190 HA VAL 28 HA VAL 28 13.318 3.476 1.179 191 HB VAL 28 HB VAL 28 15.048 5.299 1.163 192 HG11 VAL 28 HG11 VAL 28 14.624 7.242 -0.185 193 HG12 VAL 28 HG12 VAL 28 13.383 6.484 -0.892 194 HG13 VAL 28 HG13 VAL 28 14.893 5.954 -1.125 195 HG21 VAL 28 HG21 VAL 28 13.624 6.978 2.118 196 HG22 VAL 28 HG22 VAL 28 13.233 5.517 2.692 197 HG23 VAL 28 HG23 VAL 28 12.323 6.206 1.545 198 H MET 29 H MET 29 13.389 3.417 -2.086 199 HA MET 29 HA MET 29 11.198 4.854 -2.744 200 HB2 MET 29 HB2 MET 29 11.342 3.776 -4.880 201 HB3 MET 29 HB3 MET 29 12.868 3.929 -4.319 202 HG2 MET 29 HG2 MET 29 12.841 1.714 -3.621 203 HG3 MET 29 HG3 MET 29 11.307 1.558 -4.161 204 HE1 MET 29 HE1 MET 29 11.563 1.641 -7.989 205 HE2 MET 29 HE2 MET 29 11.066 2.792 -6.968 206 HE3 MET 29 HE3 MET 29 10.599 1.260 -6.748 207 H TYR 30 H TYR 30 11.011 2.100 -0.965 208 HA TYR 30 HA TYR 30 8.787 0.928 -2.124 209 HB2 TYR 30 HB2 TYR 30 10.129 -0.218 -0.512 210 HB3 TYR 30 HB3 TYR 30 9.602 0.799 0.652 211 HD1 TYR 30 HD1 TYR 30 8.544 -1.927 -1.481 212 HD2 TYR 30 HD2 TYR 30 7.563 0.377 1.833 213 HE1 TYR 30 HE1 TYR 30 6.750 -3.464 -0.931 214 HE2 TYR 30 HE2 TYR 30 5.754 -1.136 2.360 215 HH TYR 30 HH TYR 30 4.264 -2.807 1.120 216 H GLU 31 H GLU 31 8.995 3.187 0.579 217 HA GLU 31 HA GLU 31 6.641 4.404 -0.345 218 HB2 GLU 31 HB2 GLU 31 5.394 4.255 1.732 219 HB3 GLU 31 HB3 GLU 31 5.508 2.850 0.906 220 HG2 GLU 31 HG2 GLU 31 7.413 2.433 2.535 221 HG3 GLU 31 HG3 GLU 31 6.571 3.491 3.451 222 HA PRO 32 HA PRO 32 9.419 7.275 1.647 223 HB2 PRO 32 HB2 PRO 32 10.041 8.850 -0.403 224 HB3 PRO 32 HB3 PRO 32 10.774 7.393 -0.310 225 HG2 PRO 32 HG2 PRO 32 8.469 8.089 -1.825 226 HG3 PRO 32 HG3 PRO 32 9.807 7.308 -2.341 227 HD2 PRO 32 HD2 PRO 32 7.686 5.963 -1.670 228 HD3 PRO 32 HD3 PRO 32 9.172 5.347 -1.384 229 H GLN 33 H GLN 33 6.441 7.414 0.566 230 HA GLN 33 HA GLN 33 6.121 10.154 1.287 231 HB2 GLN 33 HB2 GLN 33 4.194 10.216 0.067 232 HB3 GLN 33 HB3 GLN 33 5.107 9.162 -0.784 233 HG2 GLN 33 HG2 GLN 33 2.881 8.466 0.926 234 HG3 GLN 33 HG3 GLN 33 2.925 8.312 -0.700 235 HE21 GLN 33 HE21 GLN 33 3.667 5.164 1.349 236 HE22 GLN 33 HE22 GLN 33 2.647 6.501 1.762 237 H SER 34 H SER 34 6.133 7.398 2.932 238 HA SER 34 HA SER 34 3.702 7.842 4.312 239 HB2 SER 34 HB2 SER 34 4.844 5.538 3.737 240 HB3 SER 34 HB3 SER 34 5.393 5.709 5.266 241 HG SER 34 HG SER 34 2.817 5.402 4.396 242 H LEU 35 H LEU 35 3.783 9.612 5.633 243 HA LEU 35 HA LEU 35 5.797 9.603 7.688 244 HB2 LEU 35 HB2 LEU 35 3.796 11.598 7.235 245 HB3 LEU 35 HB3 LEU 35 5.042 11.725 8.283 246 HG LEU 35 HG LEU 35 5.386 11.621 5.431 247 HD11 LEU 35 HD11 LEU 35 5.792 14.005 5.563 248 HD12 LEU 35 HD12 LEU 35 5.446 13.973 7.142 249 HD13 LEU 35 HD13 LEU 35 4.288 13.672 6.054 250 HD21 LEU 35 HD21 LEU 35 7.626 12.332 5.830 251 HD22 LEU 35 HD22 LEU 35 7.350 10.912 6.551 252 HD23 LEU 35 HD23 LEU 35 7.367 12.273 7.425 253 H GLU 36 H GLU 36 5.366 8.376 9.462 254 HA GLU 36 HA GLU 36 2.679 7.603 9.896 255 HB2 GLU 36 HB2 GLU 36 5.169 6.686 11.097 256 HB3 GLU 36 HB3 GLU 36 3.735 6.052 11.552 257 HG2 GLU 36 HG2 GLU 36 4.796 5.836 8.885 258 HG3 GLU 36 HG3 GLU 36 4.905 4.650 10.002 259 H ALA 37 H ALA 37 1.361 8.876 11.068 260 HA ALA 37 HA ALA 37 2.369 9.950 13.561 261 HB1 ALA 37 HB1 ALA 37 1.141 11.498 12.262 262 HB2 ALA 37 HB2 ALA 37 0.309 11.188 13.614 263 HB3 ALA 37 HB3 ALA 37 -0.130 10.499 12.219 264 H LYS 38 H LYS 38 1.259 9.362 15.614 265 HA LYS 38 HA LYS 38 -0.567 7.174 15.355 266 HB2 LYS 38 HB2 LYS 38 1.771 6.340 15.672 267 HB3 LYS 38 HB3 LYS 38 1.653 6.906 17.199 268 HG2 LYS 38 HG2 LYS 38 -0.077 5.398 17.656 269 HG3 LYS 38 HG3 LYS 38 -0.054 4.872 16.110 270 HD2 LYS 38 HD2 LYS 38 2.133 4.031 16.454 271 HD3 LYS 38 HD3 LYS 38 2.051 4.506 18.014 272 HE2 LYS 38 HE2 LYS 38 0.196 3.063 18.365 273 HE3 LYS 38 HE3 LYS 38 0.249 2.603 16.799 274 HZ1 LYS 38 HZ1 LYS 38 1.243 0.956 18.168 275 HZ2 LYS 38 HZ2 LYS 38 2.301 2.043 18.729 276 HZ3 LYS 38 HZ3 LYS 38 2.354 1.587 17.178 277 H LYS 39 H LYS 39 -2.033 6.775 17.014 278 HA LYS 39 HA LYS 39 -2.671 8.904 18.670 279 HB2 LYS 39 HB2 LYS 39 -3.417 6.122 18.961 280 HB3 LYS 39 HB3 LYS 39 -4.158 7.348 19.746 281 HG2 LYS 39 HG2 LYS 39 -5.207 8.068 17.828 282 HG3 LYS 39 HG3 LYS 39 -4.228 7.178 16.871 283 HD2 LYS 39 HD2 LYS 39 -5.153 5.191 17.909 284 HD3 LYS 39 HD3 LYS 39 -6.237 6.153 18.661 285 HE2 LYS 39 HE2 LYS 39 -7.288 6.664 16.669 286 HE3 LYS 39 HE3 LYS 39 -6.080 5.997 15.794 287 HZ1 LYS 39 HZ1 LYS 39 -7.946 4.503 15.881 288 HZ2 LYS 39 HZ2 LYS 39 -7.873 4.496 17.497 289 HZ3 LYS 39 HZ3 LYS 39 -6.678 3.836 16.630 290 H GLY 40 H GLY 40 -2.203 9.280 20.953 291 HA2 GLY 40 HA2 GLY 40 -1.404 7.686 22.825 292 HA3 GLY 40 HA3 GLY 40 -0.028 7.690 21.946 293 H PHE 41 H PHE 41 -1.679 9.123 24.415 294 HA PHE 41 HA PHE 41 -0.093 11.521 24.284 295 HB2 PHE 41 HB2 PHE 41 -2.443 10.943 25.862 296 HB3 PHE 41 HB3 PHE 41 -1.637 12.359 25.964 297 HD1 PHE 41 HD1 PHE 41 -4.264 10.768 24.380 298 HD2 PHE 41 HD2 PHE 41 -1.364 13.680 23.733 299 HE1 PHE 41 HE1 PHE 41 -5.554 11.642 22.534 300 HE2 PHE 41 HE2 PHE 41 -2.629 14.541 21.874 301 HZ PHE 41 HZ PHE 41 -4.736 13.525 21.276 302 HA PRO 42 HA PRO 42 0.508 13.278 25.909 303 HB2 PRO 42 HB2 PRO 42 2.831 14.147 26.888 304 HB3 PRO 42 HB3 PRO 42 1.617 13.830 27.933 305 HG2 PRO 42 HG2 PRO 42 3.790 12.129 27.214 306 HG3 PRO 42 HG3 PRO 42 3.250 12.479 28.715 307 HD2 PRO 42 HD2 PRO 42 2.515 10.270 27.543 308 HD3 PRO 42 HD3 PRO 42 1.481 11.053 28.536 309 H HIS 43 H HIS 43 2.833 11.041 25.028 310 HA HIS 43 HA HIS 43 2.833 12.071 22.444 311 HB2 HIS 43 HB2 HIS 43 5.215 12.428 22.175 312 HB3 HIS 43 HB3 HIS 43 4.605 13.453 23.291 313 HD1 HIS 43 HD1 HIS 43 6.935 10.626 22.895 314 HD2 HIS 43 HD2 HIS 43 5.527 13.012 25.917 315 HE1 HIS 43 HE1 HIS 43 8.318 10.228 24.922 316 HE2 HIS 43 HE2 HIS 43 7.495 11.659 26.760 317 H SER 44 H SER 44 3.945 9.813 24.711 318 HA SER 44 HA SER 44 4.637 7.727 24.600 319 HB2 SER 44 HB2 SER 44 2.482 7.302 23.568 320 HB3 SER 44 HB3 SER 44 3.196 7.381 22.101 321 HG SER 44 HG SER 44 2.858 5.270 23.151 322 H GLY 45 H GLY 45 4.772 7.826 21.127 323 HA2 GLY 45 HA2 GLY 45 7.541 7.224 21.123 324 HA3 GLY 45 HA3 GLY 45 6.572 7.356 19.815 325 HA PRO 46 HA PRO 46 9.051 11.145 19.807 326 HB2 PRO 46 HB2 PRO 46 9.560 11.342 17.206 327 HB3 PRO 46 HB3 PRO 46 10.464 10.309 18.092 328 HG2 PRO 46 HG2 PRO 46 8.158 9.706 16.531 329 HG3 PRO 46 HG3 PRO 46 9.608 8.955 16.500 330 HD2 PRO 46 HD2 PRO 46 7.676 7.929 17.911 331 HD3 PRO 46 HD3 PRO 46 9.204 7.852 18.481 332 H ALA 47 H ALA 47 8.662 13.311 18.873 333 HA ALA 47 HA ALA 47 5.889 13.694 18.736 334 HB1 ALA 47 HB1 ALA 47 7.283 15.410 19.728 335 HB2 ALA 47 HB2 ALA 47 6.448 16.064 18.508 336 HB3 ALA 47 HB3 ALA 47 8.002 15.668 18.303 337 H ASP 48 H ASP 48 4.664 13.267 16.988 338 HA ASP 48 HA ASP 48 5.523 14.320 14.449 339 HB2 ASP 48 HB2 ASP 48 6.060 11.862 14.665 340 HB3 ASP 48 HB3 ASP 48 4.477 11.691 14.302 341 H GLY 49 H GLY 49 3.436 13.865 12.863 342 HA2 GLY 49 HA2 GLY 49 1.185 14.146 12.640 343 HA3 GLY 49 HA3 GLY 49 0.973 13.955 14.248 344 H GLN 50 H GLN 50 3.294 16.131 14.001 345 HA GLN 50 HA GLN 50 1.630 18.203 14.837 346 HB2 GLN 50 HB2 GLN 50 4.472 18.240 14.296 347 HB3 GLN 50 HB3 GLN 50 3.691 19.475 15.025 348 HG2 GLN 50 HG2 GLN 50 4.030 16.841 16.118 349 HG3 GLN 50 HG3 GLN 50 4.782 18.191 16.645 350 HE21 GLN 50 HE21 GLN 50 1.502 17.129 18.417 351 HE22 GLN 50 HE22 GLN 50 2.637 16.117 17.587 352 H ILE 51 H ILE 51 2.229 17.175 11.855 353 HA ILE 51 HA ILE 51 2.426 19.526 10.414 354 HB ILE 51 HB ILE 51 1.171 17.011 9.593 355 HG12 ILE 51 HG12 ILE 51 3.833 17.877 8.890 356 HG13 ILE 51 HG13 ILE 51 3.561 16.956 10.211 357 HG21 ILE 51 HG21 ILE 51 1.413 17.740 7.315 358 HG22 ILE 51 HG22 ILE 51 1.981 19.167 7.822 359 HG23 ILE 51 HG23 ILE 51 0.445 18.758 8.115 360 HD11 ILE 51 HD11 ILE 51 4.291 15.587 8.398 361 HD12 ILE 51 HD12 ILE 51 3.048 16.094 7.496 362 HD13 ILE 51 HD13 ILE 51 2.779 15.182 8.804 363 H ALA 52 H ALA 52 -0.274 17.805 11.746 364 HA ALA 52 HA ALA 52 -2.212 19.440 10.594 365 HB1 ALA 52 HB1 ALA 52 -2.737 17.173 11.338 366 HB2 ALA 52 HB2 ALA 52 -3.774 18.209 12.021 367 HB3 ALA 52 HB3 ALA 52 -2.529 17.629 12.875 368 H SER 53 H SER 53 -0.351 19.787 13.394 369 HA SER 53 HA SER 53 -2.109 21.751 14.507 370 HB2 SER 53 HB2 SER 53 -0.608 21.669 16.435 371 HB3 SER 53 HB3 SER 53 -1.045 20.150 16.025 372 HG SER 53 HG SER 53 0.885 19.675 15.481 373 H ALA 54 H ALA 54 -0.054 21.800 12.195 374 HA ALA 54 HA ALA 54 1.313 23.161 11.243 375 HB1 ALA 54 HB1 ALA 54 -0.392 24.892 11.515 376 HB2 ALA 54 HB2 ALA 54 1.073 25.576 11.489 377 HB3 ALA 54 HB3 ALA 54 0.305 25.361 12.896 378 H GLY 55 H GLY 55 1.896 22.292 14.263 379 HA2 GLY 55 HA2 GLY 55 4.099 23.864 14.940 380 HA3 GLY 55 HA3 GLY 55 3.736 22.403 15.575 381 H GLY 56 H GLY 56 3.742 21.040 13.032 382 HA2 GLY 56 HA2 GLY 56 6.489 20.432 12.923 383 HA3 GLY 56 HA3 GLY 56 5.322 19.785 11.981 384 H LEU 57 H LEU 57 4.595 22.708 11.316 385 HA LEU 57 HA LEU 57 6.034 22.723 8.908 386 HB2 LEU 57 HB2 LEU 57 4.350 24.801 9.973 387 HB3 LEU 57 HB3 LEU 57 4.862 24.734 8.424 388 HG LEU 57 HG LEU 57 3.071 22.834 9.625 389 HD11 LEU 57 HD11 LEU 57 1.356 23.822 8.255 390 HD12 LEU 57 HD12 LEU 57 2.415 24.929 7.738 391 HD13 LEU 57 HD13 LEU 57 1.956 24.912 9.288 392 HD21 LEU 57 HD21 LEU 57 2.753 21.940 7.404 393 HD22 LEU 57 HD22 LEU 57 4.300 21.792 7.849 394 HD23 LEU 57 HD23 LEU 57 3.861 22.969 6.831 395 H PHE 58 H PHE 58 6.467 24.226 11.937 396 HA PHE 58 HA PHE 58 8.381 26.077 11.182 397 HB2 PHE 58 HB2 PHE 58 7.987 24.787 13.741 398 HB3 PHE 58 HB3 PHE 58 9.052 26.008 13.540 399 HD1 PHE 58 HD1 PHE 58 5.565 25.211 13.739 400 HD2 PHE 58 HD2 PHE 58 8.305 28.313 13.319 401 HE1 PHE 58 HE1 PHE 58 3.800 26.803 14.165 402 HE2 PHE 58 HE2 PHE 58 6.559 29.926 13.760 403 HZ PHE 58 HZ PHE 58 4.298 29.172 14.190 404 H GLY 59 H GLY 59 8.523 22.692 11.804 405 HA2 GLY 59 HA2 GLY 59 11.336 22.507 11.838 406 HA3 GLY 59 HA3 GLY 59 10.294 21.261 11.671 407 H GLY 60 H GLY 60 8.961 22.609 9.414 408 HA2 GLY 60 HA2 GLY 60 10.422 21.517 7.317 409 HA3 GLY 60 HA3 GLY 60 9.122 22.494 7.169 410 H ILE 61 H ILE 61 10.679 24.510 8.841 411 HA ILE 61 HA ILE 61 11.746 25.969 6.746 412 HB ILE 61 HB ILE 61 12.286 26.345 9.581 413 HG12 ILE 61 HG12 ILE 61 9.977 26.513 9.157 414 HG13 ILE 61 HG13 ILE 61 10.568 27.978 9.571 415 HG21 ILE 61 HG21 ILE 61 12.934 28.612 9.047 416 HG22 ILE 61 HG22 ILE 61 12.737 28.301 7.472 417 HG23 ILE 61 HG23 ILE 61 13.913 27.563 8.301 418 HD11 ILE 61 HD11 ILE 61 8.982 28.214 7.779 419 HD12 ILE 61 HD12 ILE 61 9.859 27.221 6.851 420 HD13 ILE 61 HD13 ILE 61 10.444 28.672 7.261 421 H LEU 62 H LEU 62 13.115 23.844 9.107 422 HA LEU 62 HA LEU 62 15.755 24.284 8.340 423 HB2 LEU 62 HB2 LEU 62 14.531 22.331 10.057 424 HB3 LEU 62 HB3 LEU 62 16.122 22.198 9.710 425 HG LEU 62 HG LEU 62 16.415 24.367 10.753 426 HD11 LEU 62 HD11 LEU 62 14.782 25.144 12.311 427 HD12 LEU 62 HD12 LEU 62 13.751 24.006 11.802 428 HD13 LEU 62 HD13 LEU 62 14.201 25.195 10.803 429 HD21 LEU 62 HD21 LEU 62 16.409 23.375 12.999 430 HD22 LEU 62 HD22 LEU 62 16.993 22.313 11.929 431 HD23 LEU 62 HD23 LEU 62 15.470 22.177 12.455 432 H ASP 63 H ASP 63 13.313 22.121 7.325 433 HA ASP 63 HA ASP 63 14.909 20.201 6.202 434 HB2 ASP 63 HB2 ASP 63 12.535 19.899 6.471 435 HB3 ASP 63 HB3 ASP 63 12.285 20.913 5.216 436 H GLN 64 H GLN 64 14.184 23.315 5.133 437 HA GLN 64 HA GLN 64 14.732 22.944 2.447 438 HB2 GLN 64 HB2 GLN 64 14.859 25.363 4.037 439 HB3 GLN 64 HB3 GLN 64 14.964 25.381 2.407 440 HG2 GLN 64 HG2 GLN 64 12.776 24.592 2.202 441 HG3 GLN 64 HG3 GLN 64 12.667 24.360 3.815 442 HE21 GLN 64 HE21 GLN 64 11.113 27.358 4.289 443 HE22 GLN 64 HE22 GLN 64 11.254 25.680 4.696 444 H GLN 65 H GLN 65 16.798 22.674 4.964 445 HA GLN 65 HA GLN 65 19.077 22.902 3.197 446 HB2 GLN 65 HB2 GLN 65 19.083 23.655 5.992 447 HB3 GLN 65 HB3 GLN 65 20.413 23.655 5.046 448 HG2 GLN 65 HG2 GLN 65 19.429 25.373 3.714 449 HG3 GLN 65 HG3 GLN 65 18.153 25.404 4.733 450 HE21 GLN 65 HE21 GLN 65 19.539 27.606 6.977 451 HE22 GLN 65 HE22 GLN 65 18.137 26.745 6.434 452 H SER 66 H SER 66 17.482 20.598 3.646 453 HA SER 66 HA SER 66 19.099 19.006 5.423 454 HB2 SER 66 HB2 SER 66 16.759 19.000 5.989 455 HB3 SER 66 HB3 SER 66 16.379 18.513 4.477 456 HG SER 66 HG SER 66 17.128 17.072 6.580 457 H GLU 67 H GLU 67 19.745 16.828 4.883 458 HA GLU 67 HA GLU 67 20.445 16.436 2.202 459 HB2 GLU 67 HB2 GLU 67 21.573 15.419 4.092 460 HB3 GLU 67 HB3 GLU 67 20.284 14.434 4.283 461 HG2 GLU 67 HG2 GLU 67 20.749 13.388 2.238 462 HG3 GLU 67 HG3 GLU 67 21.998 14.409 1.981 463 H ASN 68 H ASN 68 17.754 15.598 4.124 464 HA ASN 68 HA ASN 68 16.575 13.991 2.062 465 HB2 ASN 68 HB2 ASN 68 15.777 14.405 4.827 466 HB3 ASN 68 HB3 ASN 68 14.911 13.469 3.807 467 HD21 ASN 68 HD21 ASN 68 18.098 12.022 5.671 468 HD22 ASN 68 HD22 ASN 68 17.562 13.658 5.863 469 H ARG 69 H ARG 69 16.870 16.937 1.982 470 HA ARG 69 HA ARG 69 14.537 18.232 2.446 471 HB2 ARG 69 HB2 ARG 69 16.397 19.499 1.881 472 HB3 ARG 69 HB3 ARG 69 16.553 18.738 0.444 473 HG2 ARG 69 HG2 ARG 69 14.697 19.880 -0.392 474 HG3 ARG 69 HG3 ARG 69 14.461 20.596 1.057 475 HD2 ARG 69 HD2 ARG 69 16.563 21.685 0.851 476 HD3 ARG 69 HD3 ARG 69 16.772 20.987 -0.611 477 HE ARG 69 HE ARG 69 14.381 22.321 -0.735 478 HH11 ARG 69 HH11 ARG 69 14.152 24.319 -1.647 479 HH12 ARG 69 HH12 ARG 69 15.519 25.364 -1.845 480 HH21 ARG 69 HH21 ARG 69 17.785 23.180 -0.445 481 HH22 ARG 69 HH22 ARG 69 17.541 24.731 -1.177 482 H TRP 70 H TRP 70 12.570 18.632 1.481 483 HA TRP 70 HA TRP 70 11.850 16.576 -0.241 484 HB2 TRP 70 HB2 TRP 70 9.628 17.715 -0.224 485 HB3 TRP 70 HB3 TRP 70 10.179 17.192 1.221 486 HD1 TRP 70 HD1 TRP 70 10.888 20.518 -0.432 487 HE1 TRP 70 HE1 TRP 70 10.313 22.445 1.059 488 HE3 TRP 70 HE3 TRP 70 9.001 17.838 3.350 489 HZ2 TRP 70 HZ2 TRP 70 9.127 22.694 3.604 490 HZ3 TRP 70 HZ3 TRP 70 8.133 19.003 5.288 491 HH2 TRP 70 HH2 TRP 70 8.189 21.420 5.391 492 H PHE 71 H PHE 71 11.013 16.513 -2.301 493 HA PHE 71 HA PHE 71 12.403 18.216 -4.019 494 HB2 PHE 71 HB2 PHE 71 11.538 16.837 -5.776 495 HB3 PHE 71 HB3 PHE 71 12.004 15.871 -4.544 496 HD1 PHE 71 HD1 PHE 71 10.308 14.743 -3.117 497 HD2 PHE 71 HD2 PHE 71 9.218 16.975 -6.456 498 HE1 PHE 71 HE1 PHE 71 8.085 13.810 -3.010 499 HE2 PHE 71 HE2 PHE 71 7.006 16.016 -6.380 500 HZ PHE 71 HZ PHE 71 6.429 14.455 -4.638 501 H LYS 72 H LYS 72 11.660 19.719 -5.572 502 HA LYS 72 HA LYS 72 9.000 20.694 -5.051 503 HB2 LYS 72 HB2 LYS 72 11.198 21.937 -6.444 504 HB3 LYS 72 HB3 LYS 72 9.711 22.612 -6.395 505 HG2 LYS 72 HG2 LYS 72 9.894 22.914 -4.074 506 HG3 LYS 72 HG3 LYS 72 11.343 22.161 -4.070 507 HD2 LYS 72 HD2 LYS 72 11.759 24.460 -3.986 508 HD3 LYS 72 HD3 LYS 72 12.205 23.941 -5.469 509 HE2 LYS 72 HE2 LYS 72 10.111 24.737 -6.342 510 HE3 LYS 72 HE3 LYS 72 9.744 25.326 -4.864 511 HZ1 LYS 72 HZ1 LYS 72 10.549 27.064 -6.259 512 HZ2 LYS 72 HZ2 LYS 72 11.932 26.257 -6.488 513 HZ3 LYS 72 HZ3 LYS 72 11.569 26.841 -5.024 514 H HIS 73 H HIS 73 7.339 20.177 -6.514 515 HA HIS 73 HA HIS 73 8.237 19.313 -9.102 516 HB2 HIS 73 HB2 HIS 73 6.568 18.018 -7.781 517 HB3 HIS 73 HB3 HIS 73 5.491 19.105 -8.351 518 HD1 HIS 73 HD1 HIS 73 7.228 16.044 -9.247 519 HD2 HIS 73 HD2 HIS 73 5.200 19.007 -11.222 520 HE1 HIS 73 HE1 HIS 73 6.774 15.278 -11.574 521 HE2 HIS 73 HE2 HIS 73 5.552 17.052 -12.782 522 H ILE 74 H ILE 74 8.516 20.899 -10.561 523 HA ILE 74 HA ILE 74 7.014 23.270 -10.380 524 HB ILE 74 HB ILE 74 8.887 22.516 -12.498 525 HG12 ILE 74 HG12 ILE 74 9.491 24.175 -10.214 526 HG13 ILE 74 HG13 ILE 74 9.881 22.591 -10.284 527 HG21 ILE 74 HG21 ILE 74 9.015 24.879 -13.034 528 HG22 ILE 74 HG22 ILE 74 7.909 25.202 -11.899 529 HG23 ILE 74 HG23 ILE 74 7.494 24.361 -13.216 530 HD11 ILE 74 HD11 ILE 74 11.810 23.930 -10.792 531 HD12 ILE 74 HD12 ILE 74 11.021 24.624 -12.022 532 HD13 ILE 74 HD13 ILE 74 11.408 23.055 -12.091 533 H MET 75 H MET 75 5.246 23.964 -11.617 534 HA MET 75 HA MET 75 4.493 22.448 -13.912 535 HB2 MET 75 HB2 MET 75 3.416 21.358 -12.012 536 HB3 MET 75 HB3 MET 75 2.581 22.739 -11.764 537 HG2 MET 75 HG2 MET 75 1.244 21.226 -12.825 538 HG3 MET 75 HG3 MET 75 1.530 22.503 -13.802 539 HE1 MET 75 HE1 MET 75 1.646 20.318 -16.849 540 HE2 MET 75 HE2 MET 75 1.446 21.835 -16.327 541 HE3 MET 75 HE3 MET 75 0.475 20.660 -15.787 542 H THR 76 H THR 76 2.986 23.577 -15.324 543 HA THR 76 HA THR 76 2.967 26.398 -14.902 544 HB THR 76 HB THR 76 1.974 26.424 -17.191 545 HG1 THR 76 HG1 THR 76 1.053 24.546 -17.484 546 HG21 THR 76 HG21 THR 76 4.032 25.828 -18.290 547 HG22 THR 76 HG22 THR 76 4.525 25.032 -16.972 548 HG23 THR 76 HG23 THR 76 4.391 26.643 -16.941 549 H GLY 77 H GLY 77 0.662 27.413 -15.827 550 HA2 GLY 77 HA2 GLY 77 -1.198 26.630 -13.885 551 HA3 GLY 77 HA3 GLY 77 -1.385 27.820 -14.987 552 H GLY 78 H GLY 78 -3.653 27.101 -14.826 553 HA2 GLY 78 HA2 GLY 78 -5.282 26.180 -16.206 554 HA3 GLY 78 HA3 GLY 78 -4.217 25.099 -16.810 555 H GLU 79 H GLU 79 -6.672 24.033 -16.013 556 HA GLU 79 HA GLU 79 -6.283 23.172 -13.352 557 HB2 GLU 79 HB2 GLU 79 -8.229 21.963 -13.444 558 HB3 GLU 79 HB3 GLU 79 -8.499 23.406 -14.158 559 HG2 GLU 79 HG2 GLU 79 -8.690 22.475 -16.213 560 HG3 GLU 79 HG3 GLU 79 -7.966 21.089 -15.742 561 H HIS 80 H HIS 80 -5.744 21.040 -12.616 562 HA HIS 80 HA HIS 80 -4.714 19.292 -14.677 563 HB2 HIS 80 HB2 HIS 80 -3.258 19.735 -12.226 564 HB3 HIS 80 HB3 HIS 80 -2.724 18.923 -13.539 565 HD1 HIS 80 HD1 HIS 80 -2.134 21.940 -11.902 566 HD2 HIS 80 HD2 HIS 80 -2.633 20.932 -15.844 567 HE1 HIS 80 HE1 HIS 80 -1.262 23.788 -13.315 568 HE2 HIS 80 HE2 HIS 80 -1.550 23.207 -15.688 569 H THR 81 H THR 81 -4.612 17.007 -14.030 570 HA THR 81 HA THR 81 -6.346 16.453 -11.762 571 HB THR 81 HB THR 81 -6.337 14.929 -14.228 572 HG1 THR 81 HG1 THR 81 -7.334 17.141 -14.110 573 HG21 THR 81 HG21 THR 81 -8.257 13.830 -13.312 574 HG22 THR 81 HG22 THR 81 -8.149 14.723 -11.969 575 HG23 THR 81 HG23 THR 81 -7.012 13.623 -12.302 576 H PHE 82 H PHE 82 -5.362 15.237 -10.207 577 HA PHE 82 HA PHE 82 -2.960 13.838 -11.030 578 HB2 PHE 82 HB2 PHE 82 -3.519 14.931 -8.413 579 HB3 PHE 82 HB3 PHE 82 -2.123 14.196 -8.836 580 HD1 PHE 82 HD1 PHE 82 -0.683 15.303 -10.631 581 HD2 PHE 82 HD2 PHE 82 -3.779 17.276 -8.678 582 HE1 PHE 82 HE1 PHE 82 0.229 17.416 -11.350 583 HE2 PHE 82 HE2 PHE 82 -2.867 19.400 -9.373 584 HZ PHE 82 HZ PHE 82 -0.851 19.469 -10.708 585 H THR 83 H THR 83 -2.643 11.686 -10.411 586 HA THR 83 HA THR 83 -4.888 10.504 -9.088 587 HB THR 83 HB THR 83 -3.664 9.345 -11.495 588 HG1 THR 83 HG1 THR 83 -4.839 11.240 -11.942 589 HG21 THR 83 HG21 THR 83 -5.503 7.819 -11.535 590 HG22 THR 83 HG22 THR 83 -6.109 8.486 -10.193 591 HG23 THR 83 HG23 THR 83 -4.721 7.658 -10.129 592 H TRP 84 H TRP 84 -4.495 9.038 -7.543 593 HA TRP 84 HA TRP 84 -1.849 7.862 -7.425 594 HB2 TRP 84 HB2 TRP 84 -3.579 8.727 -5.306 595 HB3 TRP 84 HB3 TRP 84 -2.441 7.595 -5.002 596 HD1 TRP 84 HD1 TRP 84 -2.577 11.177 -6.112 597 HE1 TRP 84 HE1 TRP 84 -0.533 12.455 -5.425 598 HE3 TRP 84 HE3 TRP 84 -0.053 7.312 -4.187 599 HZ2 TRP 84 HZ2 TRP 84 1.874 11.778 -4.120 600 HZ3 TRP 84 HZ3 TRP 84 2.132 7.706 -3.214 601 HH2 TRP 84 HH2 TRP 84 3.076 9.932 -3.185 602 H THR 85 H THR 85 -1.724 5.591 -6.913 603 HA THR 85 HA THR 85 -4.253 4.241 -6.752 604 HB THR 85 HB THR 85 -3.311 2.436 -8.203 605 HG1 THR 85 HG1 THR 85 -1.140 3.437 -7.833 606 HG21 THR 85 HG21 THR 85 -3.684 3.594 -10.268 607 HG22 THR 85 HG22 THR 85 -3.537 5.018 -9.517 608 HG23 THR 85 HG23 THR 85 -4.809 4.068 -9.207 609 H TYR 86 H TYR 86 -4.075 2.015 -5.778 610 HA TYR 86 HA TYR 86 -1.703 1.736 -4.139 611 HB2 TYR 86 HB2 TYR 86 -4.406 1.524 -3.199 612 HB3 TYR 86 HB3 TYR 86 -3.150 0.904 -2.361 613 HD1 TYR 86 HD1 TYR 86 -4.903 3.900 -3.127 614 HD2 TYR 86 HD2 TYR 86 -1.431 2.431 -1.369 615 HE1 TYR 86 HE1 TYR 86 -4.551 6.031 -2.048 616 HE2 TYR 86 HE2 TYR 86 -1.065 4.578 -0.311 617 HH TYR 86 HH TYR 86 -2.520 7.369 -1.133 618 H THR 87 H THR 87 -1.306 -0.541 -3.464 619 HA THR 87 HA THR 87 -1.774 -2.178 -5.654 620 HB THR 87 HB THR 87 0.245 -2.374 -4.260 621 HG1 THR 87 HG1 THR 87 -0.303 -4.884 -4.060 622 HG21 THR 87 HG21 THR 87 0.146 -3.629 -2.205 623 HG22 THR 87 HG22 THR 87 -1.458 -3.770 -2.351 624 HG23 THR 87 HG23 THR 87 -0.797 -2.323 -2.063 625 H ALA 88 H ALA 88 -3.407 -1.855 -2.702 626 HA ALA 88 HA ALA 88 -5.422 -3.688 -3.619 627 HB1 ALA 88 HB1 ALA 88 -4.167 -5.014 -2.062 628 HB2 ALA 88 HB2 ALA 88 -5.607 -4.684 -1.405 629 HB3 ALA 88 HB3 ALA 88 -4.297 -3.860 -0.937 630 HA PRO 89 HA PRO 89 -7.755 -0.315 -1.904 631 HB2 PRO 89 HB2 PRO 89 -10.128 -1.332 -1.408 632 HB3 PRO 89 HB3 PRO 89 -9.695 -1.095 -2.964 633 HG2 PRO 89 HG2 PRO 89 -9.571 -3.518 -1.467 634 HG3 PRO 89 HG3 PRO 89 -10.178 -3.300 -2.967 635 HD2 PRO 89 HD2 PRO 89 -7.756 -4.230 -2.647 636 HD3 PRO 89 HD3 PRO 89 -8.109 -3.278 -3.926 637 H HIS 90 H HIS 90 -8.208 0.570 0.136 638 HA HIS 90 HA HIS 90 -7.942 -1.318 2.312 639 HB2 HIS 90 HB2 HIS 90 -5.883 0.019 1.862 640 HB3 HIS 90 HB3 HIS 90 -6.709 1.274 2.502 641 HD1 HIS 90 HD1 HIS 90 -7.300 1.205 5.105 642 HD2 HIS 90 HD2 HIS 90 -4.807 -1.734 3.711 643 HE1 HIS 90 HE1 HIS 90 -6.258 0.059 7.055 644 HE2 HIS 90 HE2 HIS 90 -4.721 -1.688 6.235 645 H ASN 91 H ASN 91 -9.181 -0.935 4.185 646 HA ASN 91 HA ASN 91 -11.432 0.651 3.979 647 HB2 ASN 91 HB2 ASN 91 -10.122 -0.312 6.356 648 HB3 ASN 91 HB3 ASN 91 -11.569 0.443 6.397 649 HD21 ASN 91 HD21 ASN 91 -12.268 -3.107 6.513 650 HD22 ASN 91 HD22 ASN 91 -11.518 -1.922 7.530 651 H THR 92 H THR 92 -11.823 2.837 4.473 652 HA THR 92 HA THR 92 -9.646 4.370 5.528 653 HB THR 92 HB THR 92 -10.813 5.014 2.910 654 HG1 THR 92 HG1 THR 92 -9.386 3.294 2.752 655 HG21 THR 92 HG21 THR 92 -9.208 6.756 2.777 656 HG22 THR 92 HG22 THR 92 -8.643 6.376 4.243 657 HG23 THR 92 HG23 THR 92 -10.128 6.995 4.085 658 H SER 93 H SER 93 -10.331 6.267 6.611 659 HA SER 93 HA SER 93 -13.158 6.496 6.913 660 HB2 SER 93 HB2 SER 93 -11.887 6.627 8.932 661 HB3 SER 93 HB3 SER 93 -11.026 7.881 8.339 662 HG SER 93 HG SER 93 -12.436 9.178 9.026 663 H GLN 94 H GLN 94 -10.447 8.526 6.018 664 HA GLN 94 HA GLN 94 -11.943 9.844 4.082 665 HB2 GLN 94 HB2 GLN 94 -11.833 12.096 5.031 666 HB3 GLN 94 HB3 GLN 94 -12.746 11.118 5.968 667 HG2 GLN 94 HG2 GLN 94 -11.006 10.910 7.513 668 HG3 GLN 94 HG3 GLN 94 -10.011 11.776 6.550 669 HE21 GLN 94 HE21 GLN 94 -11.178 13.992 9.218 670 HE22 GLN 94 HE22 GLN 94 -10.325 12.486 9.159 671 H TRP 95 H TRP 95 -10.698 11.608 2.901 672 HA TRP 95 HA TRP 95 -7.989 11.819 3.785 673 HB2 TRP 95 HB2 TRP 95 -7.084 11.738 1.583 674 HB3 TRP 95 HB3 TRP 95 -7.645 10.303 2.126 675 HD1 TRP 95 HD1 TRP 95 -8.522 12.897 -0.414 676 HE1 TRP 95 HE1 TRP 95 -9.926 11.964 -2.270 677 HE3 TRP 95 HE3 TRP 95 -9.274 8.386 1.586 678 HZ2 TRP 95 HZ2 TRP 95 -11.211 9.503 -2.734 679 HZ3 TRP 95 HZ3 TRP 95 -10.597 6.762 0.365 680 HH2 TRP 95 HH2 TRP 95 -11.563 7.337 -1.780 681 H HIS 96 H HIS 96 -7.036 13.887 3.506 682 HA HIS 96 HA HIS 96 -8.642 15.853 2.236 683 HB2 HIS 96 HB2 HIS 96 -8.600 17.236 4.360 684 HB3 HIS 96 HB3 HIS 96 -9.767 16.108 4.186 685 HD1 HIS 96 HD1 HIS 96 -7.655 17.327 6.670 686 HD2 HIS 96 HD2 HIS 96 -8.784 13.557 5.524 687 HE1 HIS 96 HE1 HIS 96 -7.225 15.762 8.554 688 HE2 HIS 96 HE2 HIS 96 -7.896 13.487 7.883 689 H TYR 97 H TYR 97 -7.698 18.030 2.139 690 HA TYR 97 HA TYR 97 -4.835 17.794 2.113 691 HB2 TYR 97 HB2 TYR 97 -6.364 18.936 -0.083 692 HB3 TYR 97 HB3 TYR 97 -4.756 18.652 -0.108 693 HD1 TYR 97 HD1 TYR 97 -7.965 17.188 -0.628 694 HD2 TYR 97 HD2 TYR 97 -3.893 16.342 -0.398 695 HE1 TYR 97 HE1 TYR 97 -8.358 15.011 -1.606 696 HE2 TYR 97 HE2 TYR 97 -4.294 14.168 -1.372 697 HH TYR 97 HH TYR 97 -6.625 12.525 -1.454 698 H TYR 98 H TYR 98 -3.587 19.619 2.470 699 HA TYR 98 HA TYR 98 -5.043 22.065 2.888 700 HB2 TYR 98 HB2 TYR 98 -2.931 21.149 4.651 701 HB3 TYR 98 HB3 TYR 98 -3.741 22.555 4.832 702 HD1 TYR 98 HD1 TYR 98 -4.053 18.983 5.174 703 HD2 TYR 98 HD2 TYR 98 -5.832 22.649 6.007 704 HE1 TYR 98 HE1 TYR 98 -5.616 17.886 6.638 705 HE2 TYR 98 HE2 TYR 98 -7.391 21.547 7.498 706 HH TYR 98 HH TYR 98 -8.339 18.857 7.564 707 H ILE 99 H ILE 99 -3.617 24.041 2.815 708 HA ILE 99 HA ILE 99 -1.099 23.547 1.498 709 HB ILE 99 HB ILE 99 -1.391 25.580 0.187 710 HG12 ILE 99 HG12 ILE 99 -4.146 25.518 0.999 711 HG13 ILE 99 HG13 ILE 99 -3.057 26.546 1.650 712 HG21 ILE 99 HG21 ILE 99 -2.860 24.577 -1.456 713 HG22 ILE 99 HG22 ILE 99 -3.378 23.515 -0.352 714 HG23 ILE 99 HG23 ILE 99 -1.848 23.458 -0.873 715 HD11 ILE 99 HD11 ILE 99 -4.349 27.671 -0.012 716 HD12 ILE 99 HD12 ILE 99 -3.881 26.595 -1.125 717 HD13 ILE 99 HD13 ILE 99 -2.802 27.613 -0.481 718 H THR 100 H THR 100 0.561 25.246 1.961 719 HA THR 100 HA THR 100 0.080 26.293 4.558 720 HB THR 100 HB THR 100 2.531 26.743 4.575 721 HG1 THR 100 HG1 THR 100 3.756 26.003 2.939 722 HG21 THR 100 HG21 THR 100 3.143 24.427 4.800 723 HG22 THR 100 HG22 THR 100 1.791 23.981 4.034 724 HG23 THR 100 HG23 THR 100 1.705 24.651 5.503 725 H LYS 101 H LYS 101 -0.033 28.432 5.126 726 HA LYS 101 HA LYS 101 -0.088 30.256 2.928 727 HB2 LYS 101 HB2 LYS 101 -1.871 30.097 4.632 728 HB3 LYS 101 HB3 LYS 101 -0.828 30.804 5.671 729 HG2 LYS 101 HG2 LYS 101 -0.879 32.784 4.467 730 HG3 LYS 101 HG3 LYS 101 -1.747 32.085 3.273 731 HD2 LYS 101 HD2 LYS 101 -3.452 31.635 4.960 732 HD3 LYS 101 HD3 LYS 101 -2.626 32.650 5.937 733 HE2 LYS 101 HE2 LYS 101 -3.085 34.444 4.627 734 HE3 LYS 101 HE3 LYS 101 -3.544 33.504 3.373 735 HZ1 LYS 101 HZ1 LYS 101 -5.461 34.396 4.470 736 HZ2 LYS 101 HZ2 LYS 101 -4.988 33.717 5.859 737 HZ3 LYS 101 HZ3 LYS 101 -5.442 32.786 4.617 738 H LYS 102 H LYS 102 1.915 30.851 2.319 739 HA LYS 102 HA LYS 102 3.813 31.733 4.231 740 HB2 LYS 102 HB2 LYS 102 5.144 32.297 2.388 741 HB3 LYS 102 HB3 LYS 102 4.507 30.811 2.161 742 HG2 LYS 102 HG2 LYS 102 2.771 32.015 0.797 743 HG3 LYS 102 HG3 LYS 102 3.866 33.225 0.748 744 HD2 LYS 102 HD2 LYS 102 4.370 30.553 -0.229 745 HD3 LYS 102 HD3 LYS 102 4.015 31.823 -1.192 746 HE2 LYS 102 HE2 LYS 102 6.058 32.882 -0.462 747 HE3 LYS 102 HE3 LYS 102 6.425 31.522 0.364 748 HZ1 LYS 102 HZ1 LYS 102 7.533 31.524 -1.740 749 HZ2 LYS 102 HZ2 LYS 102 6.111 31.649 -2.500 750 HZ3 LYS 102 HZ3 LYS 102 6.475 30.302 -1.682 751 H GLY 103 H GLY 103 4.418 33.909 4.773 752 HA2 GLY 103 HA2 GLY 103 4.179 36.179 4.527 753 HA3 GLY 103 HA3 GLY 103 2.941 35.972 3.482 754 H TRP 104 H TRP 104 2.731 34.385 6.491 755 HA TRP 104 HA TRP 104 0.374 35.554 7.174 756 HB2 TRP 104 HB2 TRP 104 0.841 34.664 9.440 757 HB3 TRP 104 HB3 TRP 104 0.987 33.559 8.245 758 HD1 TRP 104 HD1 TRP 104 3.349 35.810 10.159 759 HE1 TRP 104 HE1 TRP 104 5.598 34.763 10.508 760 HE3 TRP 104 HE3 TRP 104 2.438 31.552 7.698 761 HZ2 TRP 104 HZ2 TRP 104 6.771 32.309 9.768 762 HZ3 TRP 104 HZ3 TRP 104 4.179 29.871 7.592 763 HH2 TRP 104 HH2 TRP 104 6.328 30.263 8.614 764 H ASP 105 H ASP 105 -0.344 37.157 8.685 765 HA ASP 105 HA ASP 105 1.479 39.293 9.001 766 HB2 ASP 105 HB2 ASP 105 -1.229 39.019 10.010 767 HB3 ASP 105 HB3 ASP 105 -0.377 40.409 10.110 768 HA PRO 106 HA PRO 106 2.592 37.926 13.067 769 HB2 PRO 106 HB2 PRO 106 3.909 40.002 14.054 770 HB3 PRO 106 HB3 PRO 106 4.608 39.141 12.855 771 HG2 PRO 106 HG2 PRO 106 3.120 41.565 12.623 772 HG3 PRO 106 HG3 PRO 106 4.578 41.222 11.971 773 HD2 PRO 106 HD2 PRO 106 2.415 40.985 10.523 774 HD3 PRO 106 HD3 PRO 106 3.659 39.950 10.301 775 H ASP 107 H ASP 107 0.686 40.540 12.419 776 HA ASP 107 HA ASP 107 -0.267 41.116 14.956 777 HB2 ASP 107 HB2 ASP 107 -0.578 42.539 13.015 778 HB3 ASP 107 HB3 ASP 107 -1.553 41.408 12.352 779 H LYS 108 H LYS 108 -0.840 38.518 12.915 780 HA LYS 108 HA LYS 108 -3.338 37.842 14.241 781 HB2 LYS 108 HB2 LYS 108 -2.515 37.202 11.543 782 HB3 LYS 108 HB3 LYS 108 -3.934 36.730 12.200 783 HG2 LYS 108 HG2 LYS 108 -4.702 38.935 12.299 784 HG3 LYS 108 HG3 LYS 108 -3.230 39.517 11.894 785 HD2 LYS 108 HD2 LYS 108 -3.533 38.442 9.742 786 HD3 LYS 108 HD3 LYS 108 -5.090 38.205 10.175 787 HE2 LYS 108 HE2 LYS 108 -5.512 40.478 10.262 788 HE3 LYS 108 HE3 LYS 108 -3.920 40.842 10.246 789 HZ1 LYS 108 HZ1 LYS 108 -4.886 41.311 8.133 790 HZ2 LYS 108 HZ2 LYS 108 -5.365 39.773 7.998 791 HZ3 LYS 108 HZ3 LYS 108 -3.788 40.133 7.983 792 HA PRO 109 HA PRO 109 -1.443 34.372 15.799 793 HB2 PRO 109 HB2 PRO 109 -3.369 32.503 15.935 794 HB3 PRO 109 HB3 PRO 109 -3.414 33.780 16.952 795 HG2 PRO 109 HG2 PRO 109 -4.790 33.485 14.466 796 HG3 PRO 109 HG3 PRO 109 -5.412 33.958 15.901 797 HD2 PRO 109 HD2 PRO 109 -4.789 35.746 14.172 798 HD3 PRO 109 HD3 PRO 109 -4.476 36.033 15.749 799 H LEU 110 H LEU 110 0.182 33.697 14.753 800 HA LEU 110 HA LEU 110 0.155 32.801 12.194 801 HB2 LEU 110 HB2 LEU 110 2.059 33.418 13.715 802 HB3 LEU 110 HB3 LEU 110 2.039 31.855 14.187 803 HG LEU 110 HG LEU 110 2.771 32.715 11.560 804 HD11 LEU 110 HD11 LEU 110 5.067 32.216 12.354 805 HD12 LEU 110 HD12 LEU 110 4.466 31.846 13.809 806 HD13 LEU 110 HD13 LEU 110 4.413 33.372 13.276 807 HD21 LEU 110 HD21 LEU 110 3.628 30.565 11.151 808 HD22 LEU 110 HD22 LEU 110 2.031 30.519 11.400 809 HD23 LEU 110 HD23 LEU 110 3.046 30.055 12.571 810 H LYS 111 H LYS 111 0.006 30.834 15.040 811 HA LYS 111 HA LYS 111 0.242 28.394 13.867 812 HB2 LYS 111 HB2 LYS 111 -1.427 28.980 16.177 813 HB3 LYS 111 HB3 LYS 111 -0.817 27.503 15.838 814 HG2 LYS 111 HG2 LYS 111 1.371 28.311 16.240 815 HG3 LYS 111 HG3 LYS 111 0.766 29.791 16.572 816 HD2 LYS 111 HD2 LYS 111 -0.433 28.804 18.424 817 HD3 LYS 111 HD3 LYS 111 0.376 27.414 18.141 818 HE2 LYS 111 HE2 LYS 111 2.437 28.571 18.480 819 HE3 LYS 111 HE3 LYS 111 1.599 29.930 18.826 820 HZ1 LYS 111 HZ1 LYS 111 2.295 28.864 20.843 821 HZ2 LYS 111 HZ2 LYS 111 1.510 27.517 20.414 822 HZ3 LYS 111 HZ3 LYS 111 0.680 28.863 20.756 823 H ARG 112 H ARG 112 -2.609 30.283 14.213 824 HA ARG 112 HA ARG 112 -4.288 28.326 13.098 825 HB2 ARG 112 HB2 ARG 112 -4.696 31.106 13.757 826 HB3 ARG 112 HB3 ARG 112 -5.884 30.270 13.011 827 HG2 ARG 112 HG2 ARG 112 -6.029 28.797 14.861 828 HG3 ARG 112 HG3 ARG 112 -4.809 29.591 15.602 829 HD2 ARG 112 HD2 ARG 112 -6.162 31.546 15.714 830 HD3 ARG 112 HD3 ARG 112 -7.385 30.732 15.000 831 HE ARG 112 HE ARG 112 -6.746 29.277 17.217 832 HH11 ARG 112 HH11 ARG 112 -8.021 32.497 16.587 833 HH12 ARG 112 HH12 ARG 112 -8.865 32.554 18.099 834 HH21 ARG 112 HH21 ARG 112 -7.846 29.431 19.135 835 HH22 ARG 112 HH22 ARG 112 -8.766 30.848 19.515 836 H ALA 113 H ALA 113 -2.819 31.207 11.948 837 HA ALA 113 HA ALA 113 -4.149 31.232 9.525 838 HB1 ALA 113 HB1 ALA 113 -3.191 33.264 10.571 839 HB2 ALA 113 HB2 ALA 113 -2.668 33.152 9.045 840 HB3 ALA 113 HB3 ALA 113 -1.704 32.706 10.265 841 H ASP 114 H ASP 114 -1.368 29.543 10.381 842 HA ASP 114 HA ASP 114 -0.102 29.697 7.934 843 HB2 ASP 114 HB2 ASP 114 0.875 28.994 10.153 844 HB3 ASP 114 HB3 ASP 114 0.319 27.499 9.801 845 H PHE 115 H PHE 115 -2.622 27.581 8.851 846 HA PHE 115 HA PHE 115 -2.149 26.163 6.398 847 HB2 PHE 115 HB2 PHE 115 -2.891 24.121 7.350 848 HB3 PHE 115 HB3 PHE 115 -1.725 24.733 8.316 849 HD1 PHE 115 HD1 PHE 115 -2.363 25.826 10.495 850 HD2 PHE 115 HD2 PHE 115 -5.090 23.705 8.172 851 HE1 PHE 115 HE1 PHE 115 -3.862 25.682 12.381 852 HE2 PHE 115 HE2 PHE 115 -6.596 23.569 10.054 853 HZ PHE 115 HZ PHE 115 -5.983 24.560 12.155 854 H GLU 116 H GLU 116 -3.688 25.868 4.907 855 HA GLU 116 HA GLU 116 -6.362 26.676 5.654 856 HB2 GLU 116 HB2 GLU 116 -5.052 27.417 3.195 857 HB3 GLU 116 HB3 GLU 116 -6.616 27.743 3.530 858 HG2 GLU 116 HG2 GLU 116 -5.865 29.105 5.396 859 HG3 GLU 116 HG3 GLU 116 -4.330 28.877 4.887 860 H LEU 117 H LEU 117 -8.005 25.257 5.058 861 HA LEU 117 HA LEU 117 -7.214 22.813 3.886 862 HB2 LEU 117 HB2 LEU 117 -8.911 22.860 5.567 863 HB3 LEU 117 HB3 LEU 117 -9.868 23.746 4.584 864 HG LEU 117 HG LEU 117 -9.862 21.739 3.118 865 HD11 LEU 117 HD11 LEU 117 -9.564 19.647 4.247 866 HD12 LEU 117 HD12 LEU 117 -9.075 20.431 5.574 867 HD13 LEU 117 HD13 LEU 117 -8.177 20.478 4.231 868 HD21 LEU 117 HD21 LEU 117 -11.762 20.824 4.311 869 HD22 LEU 117 HD22 LEU 117 -11.840 22.439 4.304 870 HD23 LEU 117 HD23 LEU 117 -11.335 21.660 5.628 871 H ILE 118 H ILE 118 -7.045 22.400 1.710 872 HA ILE 118 HA ILE 118 -8.440 24.199 -0.035 873 HB ILE 118 HB ILE 118 -5.999 23.808 -0.398 874 HG12 ILE 118 HG12 ILE 118 -7.523 23.237 -2.763 875 HG13 ILE 118 HG13 ILE 118 -7.479 24.731 -2.104 876 HG21 ILE 118 HG21 ILE 118 -5.302 21.813 -1.502 877 HG22 ILE 118 HG22 ILE 118 -6.797 21.209 -1.381 878 HG23 ILE 118 HG23 ILE 118 -5.915 21.458 -0.049 879 HD11 ILE 118 HD11 ILE 118 -5.933 24.596 -3.925 880 HD12 ILE 118 HD12 ILE 118 -5.165 23.371 -3.202 881 HD13 ILE 118 HD13 ILE 118 -5.122 24.850 -2.550 882 H GLY 119 H GLY 119 -8.821 21.168 1.233 883 HA2 GLY 119 HA2 GLY 119 -11.254 20.755 0.175 884 HA3 GLY 119 HA3 GLY 119 -10.256 20.040 -0.903 885 H ALA 120 H ALA 120 -12.254 18.660 0.440 886 HA ALA 120 HA ALA 120 -10.662 16.708 1.788 887 HB1 ALA 120 HB1 ALA 120 -11.483 18.049 3.620 888 HB2 ALA 120 HB2 ALA 120 -12.213 16.607 3.676 889 HB3 ALA 120 HB3 ALA 120 -12.999 17.888 3.081 890 H VAL 121 H VAL 121 -11.464 14.577 1.555 891 HA VAL 121 HA VAL 121 -14.054 14.341 0.328 892 HB VAL 121 HB VAL 121 -11.758 12.809 -0.554 893 HG11 VAL 121 HG11 VAL 121 -13.225 11.759 -2.162 894 HG12 VAL 121 HG12 VAL 121 -14.485 12.552 -1.531 895 HG13 VAL 121 HG13 VAL 121 -13.718 11.427 -0.658 896 HG21 VAL 121 HG21 VAL 121 -12.046 13.923 -2.689 897 HG22 VAL 121 HG22 VAL 121 -11.756 15.013 -1.530 898 HG23 VAL 121 HG23 VAL 121 -13.263 14.790 -2.071 899 HA PRO 122 HA PRO 122 -13.787 11.470 3.727 900 HB2 PRO 122 HB2 PRO 122 -16.293 11.159 4.393 901 HB3 PRO 122 HB3 PRO 122 -15.560 12.559 4.802 902 HG2 PRO 122 HG2 PRO 122 -17.239 12.066 2.541 903 HG3 PRO 122 HG3 PRO 122 -17.328 13.311 3.594 904 HD2 PRO 122 HD2 PRO 122 -16.097 13.592 1.293 905 HD3 PRO 122 HD3 PRO 122 -15.594 14.417 2.610 906 H HIS 123 H HIS 123 -14.249 9.218 4.048 907 HA HIS 123 HA HIS 123 -15.085 8.011 1.555 908 HB2 HIS 123 HB2 HIS 123 -12.760 7.691 1.884 909 HB3 HIS 123 HB3 HIS 123 -13.045 7.033 3.351 910 HD1 HIS 123 HD1 HIS 123 -14.322 4.645 3.398 911 HD2 HIS 123 HD2 HIS 123 -12.684 5.863 -0.155 912 HE1 HIS 123 HE1 HIS 123 -14.164 2.673 1.889 913 HE2 HIS 123 HE2 HIS 123 -13.184 3.383 -0.267 914 H ASP 124 H ASP 124 -17.132 7.836 2.017 915 HA ASP 124 HA ASP 124 -17.866 5.516 3.509 916 HB2 ASP 124 HB2 ASP 124 -17.993 7.137 5.226 917 HB3 ASP 124 HB3 ASP 124 -19.026 8.013 4.313 918 H GLY 125 H GLY 125 -20.102 8.023 2.953 919 HA2 GLY 125 HA2 GLY 125 -20.940 6.924 0.422 920 HA3 GLY 125 HA3 GLY 125 -21.799 7.969 1.338 921 H SER 126 H SER 126 -20.442 7.856 -1.512 922 HA SER 126 HA SER 126 -20.061 10.633 -1.680 923 HB2 SER 126 HB2 SER 126 -17.869 10.201 -0.882 924 HB3 SER 126 HB3 SER 126 -17.689 8.952 -1.919 925 HG SER 126 HG SER 126 -17.371 10.255 -3.560 926 HA PRO 127 HA PRO 127 -20.946 9.499 -5.903 927 HB2 PRO 127 HB2 PRO 127 -20.844 11.839 -7.095 928 HB3 PRO 127 HB3 PRO 127 -22.020 11.628 -5.982 929 HG2 PRO 127 HG2 PRO 127 -19.482 12.854 -5.621 930 HG3 PRO 127 HG3 PRO 127 -20.947 13.451 -5.217 931 HD2 PRO 127 HD2 PRO 127 -19.479 12.246 -3.427 932 HD3 PRO 127 HD3 PRO 127 -21.106 12.126 -3.372 933 H ALA 128 H ALA 128 -19.733 10.767 -8.157 934 HA ALA 128 HA ALA 128 -17.571 9.176 -8.417 935 HB1 ALA 128 HB1 ALA 128 -18.726 10.258 -10.307 936 HB2 ALA 128 HB2 ALA 128 -17.128 10.436 -10.477 937 HB3 ALA 128 HB3 ALA 128 -18.024 11.661 -9.918 938 H SER 129 H SER 129 -17.534 12.105 -6.768 939 HA SER 129 HA SER 129 -14.847 12.672 -7.006 940 HB2 SER 129 HB2 SER 129 -16.466 14.263 -6.068 941 HB3 SER 129 HB3 SER 129 -16.524 13.361 -4.708 942 HG SER 129 HG SER 129 -14.107 13.771 -4.840 943 H ARG 130 H ARG 130 -16.186 10.071 -5.594 944 HA ARG 130 HA ARG 130 -14.543 9.606 -3.408 945 HB2 ARG 130 HB2 ARG 130 -16.651 8.426 -4.147 946 HB3 ARG 130 HB3 ARG 130 -15.657 7.499 -5.052 947 HG2 ARG 130 HG2 ARG 130 -14.580 6.865 -2.932 948 HG3 ARG 130 HG3 ARG 130 -15.886 7.519 -2.200 949 HD2 ARG 130 HD2 ARG 130 -15.922 5.289 -4.042 950 HD3 ARG 130 HD3 ARG 130 -16.315 5.224 -2.458 951 HE ARG 130 HE ARG 130 -18.088 6.974 -3.541 952 HH11 ARG 130 HH11 ARG 130 -20.113 6.420 -4.227 953 HH12 ARG 130 HH12 ARG 130 -20.497 4.778 -4.623 954 HH21 ARG 130 HH21 ARG 130 -17.346 3.554 -3.963 955 HH22 ARG 130 HH22 ARG 130 -18.957 3.180 -4.476 956 H ASN 131 H ASN 131 -13.876 9.584 -6.656 957 HA ASN 131 HA ASN 131 -12.012 7.573 -6.752 958 HB2 ASN 131 HB2 ASN 131 -12.672 9.777 -8.465 959 HB3 ASN 131 HB3 ASN 131 -11.231 9.067 -8.757 960 HD21 ASN 131 HD21 ASN 131 -14.463 7.506 -10.270 961 HD22 ASN 131 HD22 ASN 131 -14.328 9.110 -9.630 962 H LEU 132 H LEU 132 -9.757 7.506 -6.854 963 HA LEU 132 HA LEU 132 -8.447 9.319 -5.173 964 HB2 LEU 132 HB2 LEU 132 -7.723 6.988 -6.590 965 HB3 LEU 132 HB3 LEU 132 -6.483 8.012 -6.304 966 HG LEU 132 HG LEU 132 -6.547 6.254 -4.728 967 HD11 LEU 132 HD11 LEU 132 -6.335 7.620 -2.746 968 HD12 LEU 132 HD12 LEU 132 -7.053 8.845 -3.519 969 HD13 LEU 132 HD13 LEU 132 -5.598 8.328 -3.999 970 HD21 LEU 132 HD21 LEU 132 -8.287 6.094 -3.088 971 HD22 LEU 132 HD22 LEU 132 -8.877 5.824 -4.569 972 HD23 LEU 132 HD23 LEU 132 -9.116 7.254 -3.852 973 H SER 133 H SER 133 -9.239 9.356 -8.378 974 HA SER 133 HA SER 133 -7.114 11.069 -9.224 975 HB2 SER 133 HB2 SER 133 -8.075 9.485 -10.790 976 HB3 SER 133 HB3 SER 133 -9.465 10.342 -10.750 977 HG SER 133 HG SER 133 -7.856 10.746 -12.460 978 H HIS 134 H HIS 134 -7.199 13.281 -8.880 979 HA HIS 134 HA HIS 134 -9.809 14.435 -8.534 980 HB2 HIS 134 HB2 HIS 134 -8.726 13.872 -6.354 981 HB3 HIS 134 HB3 HIS 134 -7.657 15.061 -6.686 982 HD1 HIS 134 HD1 HIS 134 -8.448 17.574 -6.521 983 HD2 HIS 134 HD2 HIS 134 -11.202 14.739 -5.437 984 HE1 HIS 134 HE1 HIS 134 -10.320 18.704 -5.344 985 HE2 HIS 134 HE2 HIS 134 -11.995 17.018 -4.680 986 H HIS 135 H HIS 135 -10.219 16.379 -9.358 987 HA HIS 135 HA HIS 135 -8.151 17.541 -10.886 988 HB2 HIS 135 HB2 HIS 135 -10.923 18.332 -10.523 989 HB3 HIS 135 HB3 HIS 135 -9.924 19.153 -11.520 990 HD1 HIS 135 HD1 HIS 135 -10.447 18.690 -13.899 991 HD2 HIS 135 HD2 HIS 135 -10.811 15.389 -11.500 992 HE1 HIS 135 HE1 HIS 135 -11.031 16.741 -15.324 993 HE2 HIS 135 HE2 HIS 135 -11.279 14.741 -13.896 994 H ILE 136 H ILE 136 -6.979 19.424 -10.493 995 HA ILE 136 HA ILE 136 -7.888 21.066 -8.307 996 HB ILE 136 HB ILE 136 -5.048 20.509 -8.747 997 HG12 ILE 136 HG12 ILE 136 -6.653 19.719 -6.479 998 HG13 ILE 136 HG13 ILE 136 -6.194 18.695 -7.667 999 HG21 ILE 136 HG21 ILE 136 -4.639 21.900 -6.804 1000 HG22 ILE 136 HG22 ILE 136 -6.220 22.221 -6.692 1001 HG23 ILE 136 HG23 ILE 136 -5.370 22.775 -7.951 1002 HD11 ILE 136 HD11 ILE 136 -4.796 18.391 -5.741 1003 HD12 ILE 136 HD12 ILE 136 -4.354 19.945 -5.798 1004 HD13 ILE 136 HD13 ILE 136 -3.900 18.932 -6.973 1005 H TYR 137 H TYR 137 -8.380 23.120 -9.133 1006 HA TYR 137 HA TYR 137 -7.360 23.825 -11.665 1007 HB2 TYR 137 HB2 TYR 137 -9.529 24.559 -11.158 1008 HB3 TYR 137 HB3 TYR 137 -8.987 25.373 -9.850 1009 HD1 TYR 137 HD1 TYR 137 -8.118 27.623 -10.051 1010 HD2 TYR 137 HD2 TYR 137 -9.012 25.424 -13.469 1011 HE1 TYR 137 HE1 TYR 137 -7.774 29.587 -11.411 1012 HE2 TYR 137 HE2 TYR 137 -8.649 27.392 -14.825 1013 HH TYR 137 HH TYR 137 -7.899 29.497 -14.913 1014 H ILE 138 H ILE 138 -5.606 25.167 -12.159 1015 HA ILE 138 HA ILE 138 -4.407 26.529 -9.919 1016 HB ILE 138 HB ILE 138 -2.925 25.412 -12.170 1017 HG12 ILE 138 HG12 ILE 138 -3.640 23.703 -10.695 1018 HG13 ILE 138 HG13 ILE 138 -2.012 23.827 -10.715 1019 HG21 ILE 138 HG21 ILE 138 -0.919 26.088 -11.060 1020 HG22 ILE 138 HG22 ILE 138 -1.795 26.805 -9.905 1021 HG23 ILE 138 HG23 ILE 138 -1.829 27.376 -11.418 1022 HD11 ILE 138 HD11 ILE 138 -2.775 23.446 -8.483 1023 HD12 ILE 138 HD12 ILE 138 -3.688 24.779 -8.550 1024 HD13 ILE 138 HD13 ILE 138 -2.076 24.902 -8.569 1025 HA PRO 139 HA PRO 139 -5.146 29.829 -12.812 1026 HB2 PRO 139 HB2 PRO 139 -4.632 31.949 -11.327 1027 HB3 PRO 139 HB3 PRO 139 -6.037 31.153 -11.084 1028 HG2 PRO 139 HG2 PRO 139 -3.606 30.897 -9.604 1029 HG3 PRO 139 HG3 PRO 139 -5.120 31.068 -9.015 1030 HD2 PRO 139 HD2 PRO 139 -4.016 28.707 -9.167 1031 HD3 PRO 139 HD3 PRO 139 -5.628 28.880 -9.369 1032 H GLU 140 H GLU 140 -3.863 31.241 -14.095 1033 HA GLU 140 HA GLU 140 -1.009 30.849 -13.650 1034 HB2 GLU 140 HB2 GLU 140 -2.019 29.937 -15.709 1035 HB3 GLU 140 HB3 GLU 140 -2.076 31.488 -16.216 1036 HG2 GLU 140 HG2 GLU 140 0.203 31.664 -16.237 1037 HG3 GLU 140 HG3 GLU 140 0.384 30.281 -15.388 1038 H ASP 141 H ASP 141 -2.034 32.637 -12.064 1039 HA ASP 141 HA ASP 141 -1.978 35.167 -13.357 1040 HB2 ASP 141 HB2 ASP 141 -2.908 36.052 -11.340 1041 HB3 ASP 141 HB3 ASP 141 -3.738 34.703 -11.738 1042 H ARG 142 H ARG 142 -0.033 33.274 -11.333 1043 HA ARG 142 HA ARG 142 2.062 35.165 -11.376 1044 HB2 ARG 142 HB2 ARG 142 2.273 35.454 -9.031 1045 HB3 ARG 142 HB3 ARG 142 0.754 35.882 -9.451 1046 HG2 ARG 142 HG2 ARG 142 0.093 33.609 -8.758 1047 HG3 ARG 142 HG3 ARG 142 1.559 33.516 -8.046 1048 HD2 ARG 142 HD2 ARG 142 0.995 35.487 -6.766 1049 HD3 ARG 142 HD3 ARG 142 -0.511 35.413 -7.394 1050 HE ARG 142 HE ARG 142 0.548 33.783 -5.325 1051 HH11 ARG 142 HH11 ARG 142 -2.087 34.050 -7.664 1052 HH12 ARG 142 HH12 ARG 142 -3.084 32.951 -6.770 1053 HH21 ARG 142 HH21 ARG 142 -0.805 32.408 -4.265 1054 HH22 ARG 142 HH22 ARG 142 -2.377 32.045 -4.894 1055 H LEU 143 H LEU 143 4.122 34.384 -10.564 1056 HA LEU 143 HA LEU 143 4.212 31.514 -10.570 1057 HB2 LEU 143 HB2 LEU 143 6.554 31.719 -10.897 1058 HB3 LEU 143 HB3 LEU 143 5.685 32.422 -12.088 1059 HG LEU 143 HG LEU 143 6.798 34.069 -10.074 1060 HD11 LEU 143 HD11 LEU 143 8.870 34.205 -11.368 1061 HD12 LEU 143 HD12 LEU 143 8.308 33.063 -12.366 1062 HD13 LEU 143 HD13 LEU 143 8.650 32.696 -10.829 1063 HD21 LEU 143 HD21 LEU 143 6.928 35.717 -11.832 1064 HD22 LEU 143 HD22 LEU 143 5.410 35.181 -11.678 1065 HD23 LEU 143 HD23 LEU 143 6.339 34.641 -12.886 1066 H GLY 144 H GLY 144 4.847 30.291 -8.766 1067 HA2 GLY 144 HA2 GLY 144 6.307 31.227 -6.685 1068 HA3 GLY 144 HA3 GLY 144 4.757 31.577 -6.304 1069 H TYR 145 H TYR 145 6.753 29.853 -5.036 1070 HA TYR 145 HA TYR 145 5.570 27.284 -5.339 1071 HB2 TYR 145 HB2 TYR 145 7.471 26.510 -3.995 1072 HB3 TYR 145 HB3 TYR 145 7.936 27.279 -5.358 1073 HD1 TYR 145 HD1 TYR 145 8.958 29.530 -5.249 1074 HD2 TYR 145 HD2 TYR 145 7.983 27.426 -1.795 1075 HE1 TYR 145 HE1 TYR 145 10.274 31.067 -3.941 1076 HE2 TYR 145 HE2 TYR 145 9.343 28.943 -0.493 1077 HH TYR 145 HH TYR 145 11.528 30.623 -1.210 1078 H HIS 146 H HIS 146 4.600 26.016 -3.782 1079 HA HIS 146 HA HIS 146 4.488 27.035 -1.123 1080 HB2 HIS 146 HB2 HIS 146 2.199 27.080 -0.856 1081 HB3 HIS 146 HB3 HIS 146 2.522 27.967 -2.189 1082 HD1 HIS 146 HD1 HIS 146 0.921 24.793 -1.115 1083 HD2 HIS 146 HD2 HIS 146 1.501 26.941 -4.558 1084 HE1 HIS 146 HE1 HIS 146 -0.513 23.828 -2.906 1085 HE2 HIS 146 HE2 HIS 146 -0.186 25.115 -4.983 1086 H VAL 147 H VAL 147 3.542 25.408 0.418 1087 HA VAL 147 HA VAL 147 4.357 22.804 -0.416 1088 HB VAL 147 HB VAL 147 3.508 23.586 2.279 1089 HG11 VAL 147 HG11 VAL 147 4.769 21.733 3.065 1090 HG12 VAL 147 HG12 VAL 147 5.160 21.345 1.545 1091 HG13 VAL 147 HG13 VAL 147 3.623 21.240 2.036 1092 HG21 VAL 147 HG21 VAL 147 5.813 24.008 2.844 1093 HG22 VAL 147 HG22 VAL 147 5.342 25.019 1.674 1094 HG23 VAL 147 HG23 VAL 147 6.246 23.728 1.312 1095 H ILE 148 H ILE 148 2.960 20.996 -0.597 1096 HA ILE 148 HA ILE 148 0.178 21.513 -0.032 1097 HB ILE 148 HB ILE 148 1.226 19.438 -1.795 1098 HG12 ILE 148 HG12 ILE 148 -0.374 21.736 -2.482 1099 HG13 ILE 148 HG13 ILE 148 1.238 21.644 -2.729 1100 HG21 ILE 148 HG21 ILE 148 -1.091 18.835 -2.266 1101 HG22 ILE 148 HG22 ILE 148 -1.601 19.920 -1.181 1102 HG23 ILE 148 HG23 ILE 148 -0.788 18.610 -0.693 1103 HD11 ILE 148 HD11 ILE 148 0.072 21.237 -4.789 1104 HD12 ILE 148 HD12 ILE 148 -0.715 19.996 -4.114 1105 HD13 ILE 148 HD13 ILE 148 0.881 19.904 -4.358 1106 H LEU 149 H LEU 149 -0.710 20.428 1.716 1107 HA LEU 149 HA LEU 149 0.865 18.315 2.921 1108 HB2 LEU 149 HB2 LEU 149 -1.156 19.904 4.213 1109 HB3 LEU 149 HB3 LEU 149 -0.114 18.889 4.956 1110 HG LEU 149 HG LEU 149 0.712 21.352 3.730 1111 HD11 LEU 149 HD11 LEU 149 0.809 22.251 5.976 1112 HD12 LEU 149 HD12 LEU 149 0.197 20.870 6.554 1113 HD13 LEU 149 HD13 LEU 149 -0.709 21.827 5.617 1114 HD21 LEU 149 HD21 LEU 149 2.757 21.057 4.917 1115 HD22 LEU 149 HD22 LEU 149 2.509 19.820 3.906 1116 HD23 LEU 149 HD23 LEU 149 2.228 19.640 5.488 1117 H ALA 150 H ALA 150 -0.202 16.267 3.265 1118 HA ALA 150 HA ALA 150 -3.026 16.266 2.733 1119 HB1 ALA 150 HB1 ALA 150 -2.035 15.572 0.678 1120 HB2 ALA 150 HB2 ALA 150 -2.861 14.337 1.318 1121 HB3 ALA 150 HB3 ALA 150 -1.249 14.384 1.442 1122 H VAL 151 H VAL 151 -4.265 14.768 3.840 1123 HA VAL 151 HA VAL 151 -2.833 13.176 5.765 1124 HB VAL 151 HB VAL 151 -5.284 14.601 6.434 1125 HG11 VAL 151 HG11 VAL 151 -4.808 14.006 8.714 1126 HG12 VAL 151 HG12 VAL 151 -3.492 13.199 8.233 1127 HG13 VAL 151 HG13 VAL 151 -4.962 12.673 7.811 1128 HG21 VAL 151 HG21 VAL 151 -3.934 16.160 7.701 1129 HG22 VAL 151 HG22 VAL 151 -3.530 16.228 6.137 1130 HG23 VAL 151 HG23 VAL 151 -2.592 15.425 7.180 1131 H TRP 152 H TRP 152 -3.540 11.086 6.020 1132 HA TRP 152 HA TRP 152 -5.991 10.317 4.672 1133 HB2 TRP 152 HB2 TRP 152 -3.999 9.677 3.452 1134 HB3 TRP 152 HB3 TRP 152 -3.537 8.791 4.744 1135 HD1 TRP 152 HD1 TRP 152 -5.151 6.624 5.292 1136 HE1 TRP 152 HE1 TRP 152 -6.376 5.034 3.792 1137 HE3 TRP 152 HE3 TRP 152 -5.136 9.495 1.207 1138 HZ2 TRP 152 HZ2 TRP 152 -7.216 5.111 1.098 1139 HZ3 TRP 152 HZ3 TRP 152 -6.194 8.683 -0.807 1140 HH2 TRP 152 HH2 TRP 152 -7.228 6.503 -0.847 1141 H ASP 153 H ASP 153 -7.461 9.490 6.086 1142 HA ASP 153 HA ASP 153 -6.380 8.526 8.562 1143 HB2 ASP 153 HB2 ASP 153 -8.979 9.754 8.126 1144 HB3 ASP 153 HB3 ASP 153 -8.502 9.190 9.582 1145 H VAL 154 H VAL 154 -6.838 6.552 9.391 1146 HA VAL 154 HA VAL 154 -8.908 5.008 8.073 1147 HB VAL 154 HB VAL 154 -6.319 3.985 8.884 1148 HG11 VAL 154 HG11 VAL 154 -7.032 1.841 8.069 1149 HG12 VAL 154 HG12 VAL 154 -8.504 2.441 7.772 1150 HG13 VAL 154 HG13 VAL 154 -7.974 2.315 9.295 1151 HG21 VAL 154 HG21 VAL 154 -5.952 3.537 6.534 1152 HG22 VAL 154 HG22 VAL 154 -6.188 5.120 6.764 1153 HG23 VAL 154 HG23 VAL 154 -7.384 4.201 6.182 1154 H ALA 155 H ALA 155 -10.436 4.165 9.495 1155 HA ALA 155 HA ALA 155 -10.188 4.906 12.178 1156 HB1 ALA 155 HB1 ALA 155 -12.371 4.800 11.087 1157 HB2 ALA 155 HB2 ALA 155 -12.400 3.882 12.418 1158 HB3 ALA 155 HB3 ALA 155 -12.234 3.193 10.965 1159 H ASP 156 H ASP 156 -9.561 2.061 10.483 1160 HA ASP 156 HA ASP 156 -9.776 0.341 12.641 1161 HB2 ASP 156 HB2 ASP 156 -8.424 -0.165 10.084 1162 HB3 ASP 156 HB3 ASP 156 -8.934 -1.354 11.080 1163 H THR 157 H THR 157 -7.448 2.486 12.200 1164 HA THR 157 HA THR 157 -5.417 0.743 13.185 1165 HB THR 157 HB THR 157 -3.781 2.275 11.941 1166 HG1 THR 157 HG1 THR 157 -5.345 3.126 10.106 1167 HG21 THR 157 HG21 THR 157 -4.150 1.255 9.792 1168 HG22 THR 157 HG22 THR 157 -5.643 0.821 10.235 1169 HG23 THR 157 HG23 THR 157 -4.359 0.128 10.933 1170 H GLU 158 H GLU 158 -3.736 1.537 14.555 1171 HA GLU 158 HA GLU 158 -4.598 3.666 16.225 1172 HB2 GLU 158 HB2 GLU 158 -2.351 1.875 16.333 1173 HB3 GLU 158 HB3 GLU 158 -2.389 3.167 17.330 1174 HG2 GLU 158 HG2 GLU 158 -4.405 1.127 17.291 1175 HG3 GLU 158 HG3 GLU 158 -3.189 1.183 18.380 1176 H ASN 159 H ASN 159 -3.097 3.473 13.390 1177 HA ASN 159 HA ASN 159 -1.383 5.728 13.801 1178 HB2 ASN 159 HB2 ASN 159 -1.287 3.631 11.783 1179 HB3 ASN 159 HB3 ASN 159 -0.343 4.958 11.660 1180 HD21 ASN 159 HD21 ASN 159 2.216 3.338 13.251 1181 HD22 ASN 159 HD22 ASN 159 1.680 4.312 11.922 1182 H ALA 160 H ALA 160 -1.343 7.457 12.272 1183 HA ALA 160 HA ALA 160 -3.553 7.578 10.378 1184 HB1 ALA 160 HB1 ALA 160 -4.145 9.050 12.131 1185 HB2 ALA 160 HB2 ALA 160 -3.730 9.940 10.846 1186 HB3 ALA 160 HB3 ALA 160 -2.693 9.760 12.074 1187 H PHE 161 H PHE 161 -2.883 8.793 8.390 1188 HA PHE 161 HA PHE 161 -0.002 8.646 8.137 1189 HB2 PHE 161 HB2 PHE 161 -1.891 7.916 6.061 1190 HB3 PHE 161 HB3 PHE 161 -0.290 7.595 6.049 1191 HD1 PHE 161 HD1 PHE 161 -3.458 6.430 7.135 1192 HD2 PHE 161 HD2 PHE 161 0.635 5.804 7.526 1193 HE1 PHE 161 HE1 PHE 161 -3.892 4.313 8.210 1194 HE2 PHE 161 HE2 PHE 161 0.213 3.684 8.595 1195 HZ PHE 161 HZ PHE 161 -2.058 2.930 8.927 1196 H TYR 162 H TYR 162 1.146 10.177 7.166 1197 HA TYR 162 HA TYR 162 -0.380 12.338 6.013 1198 HB2 TYR 162 HB2 TYR 162 1.863 12.541 7.832 1199 HB3 TYR 162 HB3 TYR 162 1.367 13.826 6.954 1200 HD1 TYR 162 HD1 TYR 162 0.068 11.483 9.444 1201 HD2 TYR 162 HD2 TYR 162 -0.145 15.345 7.911 1202 HE1 TYR 162 HE1 TYR 162 -1.490 12.092 11.189 1203 HE2 TYR 162 HE2 TYR 162 -1.665 15.960 9.688 1204 HH TYR 162 HH TYR 162 -3.453 14.499 11.218 1205 H GLN 163 H GLN 163 0.636 13.507 4.249 1206 HA GLN 163 HA GLN 163 3.291 12.679 3.583 1207 HB2 GLN 163 HB2 GLN 163 2.863 12.247 1.317 1208 HB3 GLN 163 HB3 GLN 163 1.989 11.229 2.247 1209 HG2 GLN 163 HG2 GLN 163 0.074 12.538 1.860 1210 HG3 GLN 163 HG3 GLN 163 0.955 13.526 0.902 1211 HE21 GLN 163 HE21 GLN 163 1.330 11.067 -1.703 1212 HE22 GLN 163 HE22 GLN 163 2.319 12.161 -0.796 1213 H VAL 164 H VAL 164 4.412 14.215 2.138 1214 HA VAL 164 HA VAL 164 3.105 16.771 1.970 1215 HB VAL 164 HB VAL 164 4.459 16.883 3.977 1216 HG11 VAL 164 HG11 VAL 164 6.846 16.602 3.916 1217 HG12 VAL 164 HG12 VAL 164 6.767 16.206 2.350 1218 HG13 VAL 164 HG13 VAL 164 6.119 15.230 3.465 1219 HG21 VAL 164 HG21 VAL 164 5.768 18.813 3.505 1220 HG22 VAL 164 HG22 VAL 164 4.319 18.925 2.795 1221 HG23 VAL 164 HG23 VAL 164 5.620 18.530 1.919 1222 H ILE 165 H ILE 165 3.513 18.004 0.153 1223 HA ILE 165 HA ILE 165 5.593 17.071 -1.569 1224 HB ILE 165 HB ILE 165 2.864 17.512 -2.581 1225 HG12 ILE 165 HG12 ILE 165 4.263 15.003 -2.574 1226 HG13 ILE 165 HG13 ILE 165 3.141 15.409 -1.459 1227 HG21 ILE 165 HG21 ILE 165 3.714 16.876 -4.780 1228 HG22 ILE 165 HG22 ILE 165 5.205 16.735 -4.169 1229 HG23 ILE 165 HG23 ILE 165 4.502 18.188 -4.259 1230 HD11 ILE 165 HD11 ILE 165 2.167 13.967 -3.109 1231 HD12 ILE 165 HD12 ILE 165 2.562 15.013 -4.278 1232 HD13 ILE 165 HD13 ILE 165 1.451 15.416 -3.174 1233 H ASP 166 H ASP 166 6.888 18.855 -2.112 1234 HA ASP 166 HA ASP 166 5.700 21.428 -1.948 1235 HB2 ASP 166 HB2 ASP 166 8.339 20.519 -2.036 1236 HB3 ASP 166 HB3 ASP 166 8.126 21.861 -2.942 1237 H VAL 167 H VAL 167 5.163 22.804 -3.680 1238 HA VAL 167 HA VAL 167 5.821 21.789 -6.273 1239 HB VAL 167 HB VAL 167 3.621 22.465 -7.136 1240 HG11 VAL 167 HG11 VAL 167 2.407 20.554 -6.280 1241 HG12 VAL 167 HG12 VAL 167 3.484 20.407 -5.082 1242 HG13 VAL 167 HG13 VAL 167 3.934 20.137 -6.611 1243 HG21 VAL 167 HG21 VAL 167 1.827 22.907 -5.591 1244 HG22 VAL 167 HG22 VAL 167 2.977 24.034 -5.444 1245 HG23 VAL 167 HG23 VAL 167 2.868 22.842 -4.356 1246 H ASP 168 H ASP 168 5.899 23.388 -8.000 1247 HA ASP 168 HA ASP 168 6.012 26.140 -7.051 1248 HB2 ASP 168 HB2 ASP 168 8.200 25.045 -7.617 1249 HB3 ASP 168 HB3 ASP 168 7.743 25.369 -9.151 1250 H LEU 169 H LEU 169 4.409 27.264 -8.060 1251 HA LEU 169 HA LEU 169 3.298 26.106 -10.493 1252 HB2 LEU 169 HB2 LEU 169 2.016 27.866 -8.626 1253 HB3 LEU 169 HB3 LEU 169 1.300 27.150 -9.907 1254 HG LEU 169 HG LEU 169 2.309 25.681 -7.645 1255 HD11 LEU 169 HD11 LEU 169 0.009 25.468 -6.948 1256 HD12 LEU 169 HD12 LEU 169 -0.446 26.426 -8.168 1257 HD13 LEU 169 HD13 LEU 169 0.447 27.025 -6.960 1258 HD21 LEU 169 HD21 LEU 169 1.077 23.814 -8.518 1259 HD22 LEU 169 HD22 LEU 169 2.181 24.303 -9.593 1260 HD23 LEU 169 HD23 LEU 169 0.626 24.700 -9.792 1261 H VAL 170 H VAL 170 3.736 27.261 -12.381 1262 HA VAL 170 HA VAL 170 4.454 29.960 -11.908 1263 HB VAL 170 HB VAL 170 6.418 29.796 -13.361 1264 HG11 VAL 170 HG11 VAL 170 7.836 28.418 -11.955 1265 HG12 VAL 170 HG12 VAL 170 6.522 27.770 -11.270 1266 HG13 VAL 170 HG13 VAL 170 6.866 29.333 -11.041 1267 HG21 VAL 170 HG21 VAL 170 7.122 27.655 -14.244 1268 HG22 VAL 170 HG22 VAL 170 5.676 28.058 -14.844 1269 HG23 VAL 170 HG23 VAL 170 5.782 26.971 -13.652 1270 H ASN 171 H ASN 171 4.623 31.467 -13.686 1271 HA ASN 171 HA ASN 171 2.642 30.908 -15.677 1272 HB2 ASN 171 HB2 ASN 171 4.015 33.351 -14.967 1273 HB3 ASN 171 HB3 ASN 171 3.055 33.276 -16.287 1274 HD21 ASN 171 HD21 ASN 171 0.709 34.688 -14.139 1275 HD22 ASN 171 HD22 ASN 171 1.879 35.028 -15.370 1276 H LYS 172 H LYS 172 3.149 31.191 -17.981 1277 HA LYS 172 HA LYS 172 4.485 30.979 -19.777 1278 HB2 LYS 172 HB2 LYS 172 5.249 33.162 -18.831 1279 HB3 LYS 172 HB3 LYS 172 6.600 32.362 -18.381 1280 HG2 LYS 172 HG2 LYS 172 7.080 33.512 -20.338 1281 HG3 LYS 172 HG3 LYS 172 7.046 31.921 -20.705 1282 HD2 LYS 172 HD2 LYS 172 4.857 32.176 -21.574 1283 HD3 LYS 172 HD3 LYS 172 4.910 33.771 -21.225 1284 HE2 LYS 172 HE2 LYS 172 6.708 34.050 -22.742 1285 HE3 LYS 172 HE3 LYS 172 6.676 32.453 -23.081 1286 HZ1 LYS 172 HZ1 LYS 172 5.533 33.670 -24.773 1287 HZ2 LYS 172 HZ2 LYS 172 4.526 34.281 -23.665 1288 HZ3 LYS 172 HZ3 LYS 172 4.494 32.700 -24.001 Start of MODEL 9 1 H1 HIS 1 H1 HIS 1 0.430 2.753 2.783 2 H2 HIS 1 H2 HIS 1 -0.799 2.549 1.752 3 H3 HIS 1 H3 HIS 1 -0.031 3.970 1.822 4 HA HIS 1 HA HIS 1 1.905 3.005 0.993 5 HB2 HIS 1 HB2 HIS 1 0.388 0.540 1.049 6 HB3 HIS 1 HB3 HIS 1 1.703 0.664 0.089 7 HD1 HIS 1 HD1 HIS 1 0.723 0.001 3.581 8 HD2 HIS 1 HD2 HIS 1 4.165 0.774 1.486 9 HE1 HIS 1 HE1 HIS 1 2.676 -0.529 5.032 10 HE2 HIS 1 HE2 HIS 1 4.754 -0.068 3.794 11 H GLY 2 H GLY 2 2.170 3.980 -0.997 12 HA2 GLY 2 HA2 GLY 2 0.694 3.260 -3.214 13 HA3 GLY 2 HA3 GLY 2 -0.036 4.562 -2.552 14 H PHE 3 H PHE 3 0.451 5.438 -4.798 15 HA PHE 3 HA PHE 3 2.867 6.947 -4.679 16 HB2 PHE 3 HB2 PHE 3 3.764 6.276 -6.717 17 HB3 PHE 3 HB3 PHE 3 3.432 4.897 -5.908 18 HD1 PHE 3 HD1 PHE 3 2.860 6.678 -8.873 19 HD2 PHE 3 HD2 PHE 3 1.313 3.592 -6.537 20 HE1 PHE 3 HE1 PHE 3 1.572 5.911 -10.760 21 HE2 PHE 3 HE2 PHE 3 0.027 2.814 -8.431 22 HZ PHE 3 HZ PHE 3 0.159 3.981 -10.550 23 H ILE 4 H ILE 4 2.943 8.627 -6.606 24 HA ILE 4 HA ILE 4 0.224 9.349 -7.177 25 HB ILE 4 HB ILE 4 1.520 11.073 -5.973 26 HG12 ILE 4 HG12 ILE 4 0.516 11.957 -8.527 27 HG13 ILE 4 HG13 ILE 4 -0.428 11.684 -7.222 28 HG21 ILE 4 HG21 ILE 4 3.143 12.365 -7.152 29 HG22 ILE 4 HG22 ILE 4 3.010 11.385 -8.431 30 HG23 ILE 4 HG23 ILE 4 3.631 10.827 -7.046 31 HD11 ILE 4 HD11 ILE 4 -0.061 14.040 -7.486 32 HD12 ILE 4 HD12 ILE 4 1.538 13.816 -7.389 33 HD13 ILE 4 HD13 ILE 4 0.604 13.546 -6.097 34 H GLU 5 H GLU 5 -0.617 9.405 -9.208 35 HA GLU 5 HA GLU 5 1.039 8.494 -11.301 36 HB2 GLU 5 HB2 GLU 5 -1.797 9.171 -11.193 37 HB3 GLU 5 HB3 GLU 5 -1.121 8.680 -12.596 38 HG2 GLU 5 HG2 GLU 5 -0.945 6.963 -10.375 39 HG3 GLU 5 HG3 GLU 5 -2.377 7.076 -11.153 40 H LYS 6 H LYS 6 -0.836 11.306 -10.583 41 HA LYS 6 HA LYS 6 0.502 12.839 -12.614 42 HB2 LYS 6 HB2 LYS 6 -2.395 12.661 -12.427 43 HB3 LYS 6 HB3 LYS 6 -1.625 13.719 -13.405 44 HG2 LYS 6 HG2 LYS 6 -0.778 11.925 -14.695 45 HG3 LYS 6 HG3 LYS 6 -1.519 10.857 -13.707 46 HD2 LYS 6 HD2 LYS 6 -3.633 11.723 -14.404 47 HD3 LYS 6 HD3 LYS 6 -2.860 12.717 -15.444 48 HE2 LYS 6 HE2 LYS 6 -1.971 10.820 -16.599 49 HE3 LYS 6 HE3 LYS 6 -2.739 9.824 -15.557 50 HZ1 LYS 6 HZ1 LYS 6 -3.936 9.959 -17.590 51 HZ2 LYS 6 HZ2 LYS 6 -4.067 11.562 -17.422 52 HZ3 LYS 6 HZ3 LYS 6 -4.828 10.576 -16.390 53 HA PRO 7 HA PRO 7 0.436 15.124 -13.315 54 HB2 PRO 7 HB2 PRO 7 1.453 17.526 -12.775 55 HB3 PRO 7 HB3 PRO 7 -0.172 17.361 -12.788 56 HG2 PRO 7 HG2 PRO 7 1.570 17.366 -10.539 57 HG3 PRO 7 HG3 PRO 7 0.135 18.129 -10.702 58 HD2 PRO 7 HD2 PRO 7 0.367 15.837 -9.433 59 HD3 PRO 7 HD3 PRO 7 -1.028 16.297 -10.148 60 H GLY 8 H GLY 8 1.918 13.587 -13.778 61 HA2 GLY 8 HA2 GLY 8 4.123 13.239 -14.342 62 HA3 GLY 8 HA3 GLY 8 4.607 14.447 -13.355 63 H SER 9 H SER 9 5.473 11.623 -13.792 64 HA SER 9 HA SER 9 4.761 10.207 -11.536 65 HB2 SER 9 HB2 SER 9 5.581 9.036 -13.477 66 HB3 SER 9 HB3 SER 9 7.030 9.775 -13.338 67 HG SER 9 HG SER 9 6.814 8.629 -11.122 68 H ARG 10 H ARG 10 5.741 9.655 -9.621 69 HA ARG 10 HA ARG 10 7.478 11.502 -8.484 70 HB2 ARG 10 HB2 ARG 10 6.027 10.111 -7.180 71 HB3 ARG 10 HB3 ARG 10 6.881 8.794 -7.629 72 HG2 ARG 10 HG2 ARG 10 8.689 9.433 -6.306 73 HG3 ARG 10 HG3 ARG 10 8.014 10.888 -6.001 74 HD2 ARG 10 HD2 ARG 10 7.712 9.514 -4.113 75 HD3 ARG 10 HD3 ARG 10 6.252 9.778 -4.797 76 HE ARG 10 HE ARG 10 7.353 7.402 -5.770 77 HH11 ARG 10 HH11 ARG 10 5.641 8.696 -2.985 78 HH12 ARG 10 HH12 ARG 10 5.042 7.138 -2.521 79 HH21 ARG 10 HH21 ARG 10 6.541 5.438 -5.093 80 HH22 ARG 10 HH22 ARG 10 5.537 5.341 -3.684 81 H ALA 11 H ALA 11 7.997 8.495 -10.068 82 HA ALA 11 HA ALA 11 10.606 8.124 -9.269 83 HB1 ALA 11 HB1 ALA 11 9.231 6.315 -10.191 84 HB2 ALA 11 HB2 ALA 11 10.644 6.367 -10.974 85 HB3 ALA 11 HB3 ALA 11 9.320 6.999 -11.653 86 H ALA 12 H ALA 12 9.398 10.085 -11.762 87 HA ALA 12 HA ALA 12 11.587 10.122 -13.392 88 HB1 ALA 12 HB1 ALA 12 9.470 11.134 -14.018 89 HB2 ALA 12 HB2 ALA 12 10.662 12.198 -14.267 90 HB3 ALA 12 HB3 ALA 12 9.723 12.328 -12.957 91 H LEU 13 H LEU 13 10.958 12.053 -10.589 92 HA LEU 13 HA LEU 13 13.438 13.430 -10.897 93 HB2 LEU 13 HB2 LEU 13 11.378 13.775 -8.899 94 HB3 LEU 13 HB3 LEU 13 12.694 14.736 -9.003 95 HG LEU 13 HG LEU 13 11.530 14.891 -11.421 96 HD11 LEU 13 HD11 LEU 13 9.271 15.546 -10.928 97 HD12 LEU 13 HD12 LEU 13 9.492 15.155 -9.375 98 HD13 LEU 13 HD13 LEU 13 9.501 14.001 -10.508 99 HD21 LEU 13 HD21 LEU 13 11.183 17.194 -10.820 100 HD22 LEU 13 HD22 LEU 13 12.649 16.714 -10.336 101 HD23 LEU 13 HD23 LEU 13 11.443 16.831 -9.266 102 H CYS 14 H CYS 14 12.537 10.630 -9.646 103 HA CYS 14 HA CYS 14 14.213 10.665 -7.354 104 HB2 CYS 14 HB2 CYS 14 12.108 9.446 -7.607 105 HB3 CYS 14 HB3 CYS 14 12.963 8.370 -8.490 106 H SER 15 H SER 15 14.414 9.870 -10.620 107 HA SER 15 HA SER 15 16.550 8.084 -10.444 108 HB2 SER 15 HB2 SER 15 15.181 8.115 -12.420 109 HB3 SER 15 HB3 SER 15 15.692 9.628 -12.761 110 HG SER 15 HG SER 15 17.776 8.088 -12.484 111 H GLU 16 H GLU 16 18.738 8.409 -10.341 112 HA GLU 16 HA GLU 16 19.711 10.937 -9.749 113 HB2 GLU 16 HB2 GLU 16 21.190 8.589 -10.583 114 HB3 GLU 16 HB3 GLU 16 21.864 9.870 -9.828 115 HG2 GLU 16 HG2 GLU 16 20.633 9.379 -7.871 116 HG3 GLU 16 HG3 GLU 16 19.925 8.115 -8.624 117 H ALA 17 H ALA 17 19.428 9.208 -12.673 118 HA ALA 17 HA ALA 17 21.145 10.721 -14.193 119 HB1 ALA 17 HB1 ALA 17 20.276 8.570 -14.950 120 HB2 ALA 17 HB2 ALA 17 20.019 9.678 -16.099 121 HB3 ALA 17 HB3 ALA 17 18.808 9.224 -15.128 122 H PHE 18 H PHE 18 18.152 11.585 -12.953 123 HA PHE 18 HA PHE 18 17.485 13.399 -15.011 124 HB2 PHE 18 HB2 PHE 18 15.853 12.289 -13.542 125 HB3 PHE 18 HB3 PHE 18 16.325 13.310 -12.357 126 HD1 PHE 18 HD1 PHE 18 15.363 15.480 -12.152 127 HD2 PHE 18 HD2 PHE 18 14.719 13.235 -15.595 128 HE1 PHE 18 HE1 PHE 18 13.752 17.111 -12.908 129 HE2 PHE 18 HE2 PHE 18 13.118 14.860 -16.366 130 HZ PHE 18 HZ PHE 18 12.628 16.803 -15.021 131 H GLY 19 H GLY 19 19.475 13.515 -12.310 132 HA2 GLY 19 HA2 GLY 19 19.788 16.382 -12.652 133 HA3 GLY 19 HA3 GLY 19 19.996 15.642 -11.211 134 H PHE 20 H PHE 20 20.958 13.736 -13.627 135 HA PHE 20 HA PHE 20 22.819 12.841 -14.209 136 HB2 PHE 20 HB2 PHE 20 23.188 15.002 -15.308 137 HB3 PHE 20 HB3 PHE 20 24.187 15.396 -14.077 138 HD1 PHE 20 HD1 PHE 20 23.836 12.595 -16.394 139 HD2 PHE 20 HD2 PHE 20 26.456 15.254 -14.563 140 HE1 PHE 20 HE1 PHE 20 25.687 11.559 -17.555 141 HE2 PHE 20 HE2 PHE 20 28.316 14.234 -15.716 142 HZ PHE 20 HZ PHE 20 27.933 12.394 -17.231 143 H LEU 21 H LEU 21 24.028 15.052 -11.789 144 HA LEU 21 HA LEU 21 25.459 12.852 -10.634 145 HB2 LEU 21 HB2 LEU 21 25.944 15.684 -10.256 146 HB3 LEU 21 HB3 LEU 21 26.846 14.518 -9.554 147 HG LEU 21 HG LEU 21 26.759 15.007 -12.383 148 HD11 LEU 21 HD11 LEU 21 28.993 15.917 -12.095 149 HD12 LEU 21 HD12 LEU 21 28.871 15.692 -10.498 150 HD13 LEU 21 HD13 LEU 21 27.927 16.777 -11.236 151 HD21 LEU 21 HD21 LEU 21 28.604 13.487 -12.571 152 HD22 LEU 21 HD22 LEU 21 27.307 12.727 -11.976 153 HD23 LEU 21 HD23 LEU 21 28.508 13.170 -10.989 154 H ASN 22 H ASN 22 22.673 14.401 -10.206 155 HA ASN 22 HA ASN 22 22.660 13.975 -7.381 156 HB2 ASN 22 HB2 ASN 22 21.742 16.443 -8.639 157 HB3 ASN 22 HB3 ASN 22 21.496 16.126 -7.057 158 HD21 ASN 22 HD21 ASN 22 24.944 16.543 -6.172 159 HD22 ASN 22 HD22 ASN 22 23.677 15.389 -5.925 160 H LEU 23 H LEU 23 20.568 13.828 -6.321 161 HA LEU 23 HA LEU 23 18.310 13.493 -8.082 162 HB2 LEU 23 HB2 LEU 23 17.645 11.502 -7.286 163 HB3 LEU 23 HB3 LEU 23 19.249 11.313 -7.530 164 HG LEU 23 HG LEU 23 18.118 11.713 -4.920 165 HD11 LEU 23 HD11 LEU 23 18.368 9.333 -4.613 166 HD12 LEU 23 HD12 LEU 23 18.845 9.188 -6.151 167 HD13 LEU 23 HD13 LEU 23 17.328 9.633 -5.814 168 HD21 LEU 23 HD21 LEU 23 20.197 10.914 -4.072 169 HD22 LEU 23 HD22 LEU 23 20.428 12.246 -4.958 170 HD23 LEU 23 HD23 LEU 23 20.773 10.793 -5.578 171 H ASN 24 H ASN 24 16.198 13.831 -6.899 172 HA ASN 24 HA ASN 24 16.674 15.179 -4.394 173 HB2 ASN 24 HB2 ASN 24 14.818 16.652 -4.850 174 HB3 ASN 24 HB3 ASN 24 16.011 16.815 -5.953 175 HD21 ASN 24 HD21 ASN 24 12.512 15.154 -7.105 176 HD22 ASN 24 HD22 ASN 24 13.099 14.926 -5.491 177 H CYS 25 H CYS 25 16.097 12.399 -4.831 178 HA CYS 25 HA CYS 25 13.430 12.085 -3.959 179 HB2 CYS 25 HB2 CYS 25 14.988 10.596 -5.351 180 HB3 CYS 25 HB3 CYS 25 15.215 9.899 -3.892 181 H GLY 26 H GLY 26 16.411 12.342 -2.470 182 HA2 GLY 26 HA2 GLY 26 16.943 12.334 -0.280 183 HA3 GLY 26 HA3 GLY 26 15.362 12.203 0.109 184 H SER 27 H SER 27 16.775 10.928 1.853 185 HA SER 27 HA SER 27 17.476 8.330 1.192 186 HB2 SER 27 HB2 SER 27 17.166 8.063 3.737 187 HB3 SER 27 HB3 SER 27 18.365 9.037 3.208 188 HG SER 27 HG SER 27 16.662 10.711 3.273 189 H VAL 28 H VAL 28 14.506 9.743 1.508 190 HA VAL 28 HA VAL 28 12.943 7.679 2.369 191 HB VAL 28 HB VAL 28 12.019 9.608 0.380 192 HG11 VAL 28 HG11 VAL 28 9.909 9.522 1.544 193 HG12 VAL 28 HG12 VAL 28 10.532 8.468 2.600 194 HG13 VAL 28 HG13 VAL 28 10.334 8.041 1.053 195 HG21 VAL 28 HG21 VAL 28 11.648 11.238 2.140 196 HG22 VAL 28 HG22 VAL 28 13.224 10.894 2.034 197 HG23 VAL 28 HG23 VAL 28 12.331 10.238 3.211 198 H MET 29 H MET 29 14.615 8.009 -0.505 199 HA MET 29 HA MET 29 13.054 6.596 -2.206 200 HB2 MET 29 HB2 MET 29 15.034 6.383 -3.573 201 HB3 MET 29 HB3 MET 29 15.034 7.858 -2.873 202 HG2 MET 29 HG2 MET 29 17.085 7.335 -2.511 203 HG3 MET 29 HG3 MET 29 16.413 6.732 -1.151 204 HE1 MET 29 HE1 MET 29 18.084 4.351 -4.620 205 HE2 MET 29 HE2 MET 29 18.390 5.910 -4.318 206 HE3 MET 29 HE3 MET 29 16.926 5.459 -4.835 207 H TYR 30 H TYR 30 14.607 5.250 0.414 208 HA TYR 30 HA TYR 30 15.074 2.717 -0.669 209 HB2 TYR 30 HB2 TYR 30 16.152 3.331 1.348 210 HB3 TYR 30 HB3 TYR 30 14.711 3.515 2.096 211 HD1 TYR 30 HD1 TYR 30 16.900 0.969 0.692 212 HD2 TYR 30 HD2 TYR 30 13.699 1.688 3.253 213 HE1 TYR 30 HE1 TYR 30 16.966 -1.333 1.435 214 HE2 TYR 30 HE2 TYR 30 13.753 -0.612 3.970 215 HH TYR 30 HH TYR 30 15.387 -2.492 4.133 216 H GLU 31 H GLU 31 12.381 4.133 1.017 217 HA GLU 31 HA GLU 31 10.706 2.216 -0.216 218 HB2 GLU 31 HB2 GLU 31 9.494 1.676 1.819 219 HB3 GLU 31 HB3 GLU 31 11.003 1.056 1.749 220 HG2 GLU 31 HG2 GLU 31 11.758 2.681 3.283 221 HG3 GLU 31 HG3 GLU 31 10.266 3.344 3.331 222 HA PRO 32 HA PRO 32 8.893 6.333 0.005 223 HB2 PRO 32 HB2 PRO 32 8.582 6.907 -2.565 224 HB3 PRO 32 HB3 PRO 32 10.064 7.095 -1.906 225 HG2 PRO 32 HG2 PRO 32 9.087 4.848 -3.377 226 HG3 PRO 32 HG3 PRO 32 10.485 5.659 -3.612 227 HD2 PRO 32 HD2 PRO 32 10.487 3.464 -2.244 228 HD3 PRO 32 HD3 PRO 32 11.486 4.685 -1.818 229 H GLN 33 H GLN 33 7.927 3.432 -1.177 230 HA GLN 33 HA GLN 33 5.218 4.204 -1.536 231 HB2 GLN 33 HB2 GLN 33 6.246 2.379 -2.779 232 HB3 GLN 33 HB3 GLN 33 6.265 1.512 -1.395 233 HG2 GLN 33 HG2 GLN 33 4.036 1.174 -1.436 234 HG3 GLN 33 HG3 GLN 33 3.769 2.454 -2.415 235 HE21 GLN 33 HE21 GLN 33 4.208 -1.161 -3.962 236 HE22 GLN 33 HE22 GLN 33 4.166 -0.852 -2.258 237 H SER 34 H SER 34 7.140 3.629 1.095 238 HA SER 34 HA SER 34 5.161 2.457 2.738 239 HB2 SER 34 HB2 SER 34 7.575 2.120 3.071 240 HB3 SER 34 HB3 SER 34 7.623 3.629 3.695 241 HG SER 34 HG SER 34 6.586 3.040 5.419 242 H LEU 35 H LEU 35 3.384 3.592 3.180 243 HA LEU 35 HA LEU 35 3.776 6.302 4.130 244 HB2 LEU 35 HB2 LEU 35 1.514 5.349 2.590 245 HB3 LEU 35 HB3 LEU 35 1.706 6.890 3.097 246 HG LEU 35 HG LEU 35 3.432 5.657 1.163 247 HD11 LEU 35 HD11 LEU 35 2.218 6.923 -0.516 248 HD12 LEU 35 HD12 LEU 35 1.199 7.448 0.625 249 HD13 LEU 35 HD13 LEU 35 1.223 5.883 0.220 250 HD21 LEU 35 HD21 LEU 35 4.189 7.843 0.646 251 HD22 LEU 35 HD22 LEU 35 4.499 7.477 2.191 252 HD23 LEU 35 HD23 LEU 35 3.258 8.446 1.823 253 H GLU 36 H GLU 36 3.981 5.172 6.266 254 HA GLU 36 HA GLU 36 1.381 4.937 7.432 255 HB2 GLU 36 HB2 GLU 36 3.362 2.845 7.746 256 HB3 GLU 36 HB3 GLU 36 1.986 2.904 8.624 257 HG2 GLU 36 HG2 GLU 36 0.733 2.698 6.565 258 HG3 GLU 36 HG3 GLU 36 2.145 2.482 5.773 259 H ALA 37 H ALA 37 1.147 5.830 9.450 260 HA ALA 37 HA ALA 37 3.512 6.275 11.040 261 HB1 ALA 37 HB1 ALA 37 3.192 8.381 9.975 262 HB2 ALA 37 HB2 ALA 37 2.843 8.541 11.545 263 HB3 ALA 37 HB3 ALA 37 1.650 8.423 10.460 264 H LYS 38 H LYS 38 2.860 6.747 13.402 265 HA LYS 38 HA LYS 38 0.436 5.276 13.999 266 HB2 LYS 38 HB2 LYS 38 2.634 4.596 14.888 267 HB3 LYS 38 HB3 LYS 38 2.525 5.899 15.867 268 HG2 LYS 38 HG2 LYS 38 0.649 4.974 16.936 269 HG3 LYS 38 HG3 LYS 38 0.671 3.700 15.915 270 HD2 LYS 38 HD2 LYS 38 2.800 4.280 17.773 271 HD3 LYS 38 HD3 LYS 38 1.630 3.179 18.066 272 HE2 LYS 38 HE2 LYS 38 2.389 1.906 16.167 273 HE3 LYS 38 HE3 LYS 38 3.596 2.985 15.949 274 HZ1 LYS 38 HZ1 LYS 38 4.404 1.075 17.091 275 HZ2 LYS 38 HZ2 LYS 38 3.318 1.303 18.268 276 HZ3 LYS 38 HZ3 LYS 38 4.513 2.371 18.052 277 H LYS 39 H LYS 39 -1.185 6.041 15.410 278 HA LYS 39 HA LYS 39 -1.581 8.752 15.421 279 HB2 LYS 39 HB2 LYS 39 -3.401 8.307 16.938 280 HB3 LYS 39 HB3 LYS 39 -3.368 7.172 15.763 281 HG2 LYS 39 HG2 LYS 39 -2.319 5.654 17.276 282 HG3 LYS 39 HG3 LYS 39 -2.387 6.787 18.450 283 HD2 LYS 39 HD2 LYS 39 -4.768 6.727 18.332 284 HD3 LYS 39 HD3 LYS 39 -4.664 5.538 17.218 285 HE2 LYS 39 HE2 LYS 39 -3.532 4.168 18.834 286 HE3 LYS 39 HE3 LYS 39 -3.745 5.345 19.946 287 HZ1 LYS 39 HZ1 LYS 39 -5.365 3.645 20.237 288 HZ2 LYS 39 HZ2 LYS 39 -5.884 3.862 18.721 289 HZ3 LYS 39 HZ3 LYS 39 -6.094 5.027 19.822 290 H GLY 40 H GLY 40 -1.640 10.385 17.097 291 HA2 GLY 40 HA2 GLY 40 -0.331 9.829 19.542 292 HA3 GLY 40 HA3 GLY 40 0.567 10.747 18.533 293 H PHE 41 H PHE 41 0.492 12.456 20.147 294 HA PHE 41 HA PHE 41 -2.057 13.648 20.547 295 HB2 PHE 41 HB2 PHE 41 0.574 14.393 21.498 296 HB3 PHE 41 HB3 PHE 41 -0.735 15.312 21.830 297 HD1 PHE 41 HD1 PHE 41 1.173 12.610 22.927 298 HD2 PHE 41 HD2 PHE 41 -2.635 14.268 23.162 299 HE1 PHE 41 HE1 PHE 41 0.721 11.277 24.884 300 HE2 PHE 41 HE2 PHE 41 -3.101 12.944 25.124 301 HZ PHE 41 HZ PHE 41 -1.418 11.443 25.987 302 HA PRO 42 HA PRO 42 -3.183 15.476 20.672 303 HB2 PRO 42 HB2 PRO 42 -4.417 17.684 19.865 304 HB3 PRO 42 HB3 PRO 42 -2.935 17.887 20.520 305 HG2 PRO 42 HG2 PRO 42 -3.638 17.805 17.760 306 HG3 PRO 42 HG3 PRO 42 -2.578 18.805 18.497 307 HD2 PRO 42 HD2 PRO 42 -1.863 16.545 17.196 308 HD3 PRO 42 HD3 PRO 42 -0.890 17.339 18.241 309 H HIS 43 H HIS 43 -3.213 14.635 17.604 310 HA HIS 43 HA HIS 43 -4.630 13.739 16.225 311 HB2 HIS 43 HB2 HIS 43 -5.356 12.261 17.913 312 HB3 HIS 43 HB3 HIS 43 -6.434 13.359 18.460 313 HD1 HIS 43 HD1 HIS 43 -5.850 11.593 15.177 314 HD2 HIS 43 HD2 HIS 43 -8.931 12.744 17.621 315 HE1 HIS 43 HE1 HIS 43 -7.993 10.851 14.150 316 HE2 HIS 43 HE2 HIS 43 -9.866 11.535 15.611 317 H SER 44 H SER 44 -5.994 16.306 17.976 318 HA SER 44 HA SER 44 -8.014 16.774 16.079 319 HB2 SER 44 HB2 SER 44 -7.222 18.508 18.318 320 HB3 SER 44 HB3 SER 44 -8.693 18.535 17.611 321 HG SER 44 HG SER 44 -8.499 17.409 19.650 322 H GLY 45 H GLY 45 -4.845 17.679 16.197 323 HA2 GLY 45 HA2 GLY 45 -5.327 20.109 14.698 324 HA3 GLY 45 HA3 GLY 45 -3.966 19.798 15.546 325 HA PRO 46 HA PRO 46 -3.446 18.429 11.197 326 HB2 PRO 46 HB2 PRO 46 -2.125 20.424 10.013 327 HB3 PRO 46 HB3 PRO 46 -3.754 20.507 10.090 328 HG2 PRO 46 HG2 PRO 46 -1.860 21.733 11.821 329 HG3 PRO 46 HG3 PRO 46 -3.161 22.418 11.110 330 HD2 PRO 46 HD2 PRO 46 -3.301 21.589 13.590 331 HD3 PRO 46 HD3 PRO 46 -4.613 21.500 12.621 332 H ALA 47 H ALA 47 -1.280 19.984 13.308 333 HA ALA 47 HA ALA 47 0.902 18.320 12.443 334 HB1 ALA 47 HB1 ALA 47 1.472 20.590 12.905 335 HB2 ALA 47 HB2 ALA 47 2.215 19.647 13.987 336 HB3 ALA 47 HB3 ALA 47 0.881 20.461 14.404 337 H ASP 48 H ASP 48 1.494 16.475 13.563 338 HA ASP 48 HA ASP 48 0.295 16.066 16.158 339 HB2 ASP 48 HB2 ASP 48 -0.968 14.924 14.356 340 HB3 ASP 48 HB3 ASP 48 0.320 13.927 14.231 341 H GLY 49 H GLY 49 1.559 14.950 17.638 342 HA2 GLY 49 HA2 GLY 49 3.396 13.820 18.323 343 HA3 GLY 49 HA3 GLY 49 3.941 13.698 16.789 344 H GLN 50 H GLN 50 3.982 16.605 16.306 345 HA GLN 50 HA GLN 50 6.344 17.116 17.845 346 HB2 GLN 50 HB2 GLN 50 5.606 18.423 15.362 347 HB3 GLN 50 HB3 GLN 50 7.031 18.653 16.127 348 HG2 GLN 50 HG2 GLN 50 7.653 17.232 14.510 349 HG3 GLN 50 HG3 GLN 50 7.337 16.181 15.720 350 HE21 GLN 50 HE21 GLN 50 5.349 14.336 13.605 351 HE22 GLN 50 HE22 GLN 50 6.724 14.368 14.659 352 H ILE 51 H ILE 51 3.858 17.651 19.052 353 HA ILE 51 HA ILE 51 3.189 20.302 18.762 354 HB ILE 51 HB ILE 51 2.586 18.439 20.951 355 HG12 ILE 51 HG12 ILE 51 1.516 18.041 18.849 356 HG13 ILE 51 HG13 ILE 51 0.437 18.310 20.045 357 HG21 ILE 51 HG21 ILE 51 0.988 19.975 21.901 358 HG22 ILE 51 HG22 ILE 51 1.440 21.112 20.844 359 HG23 ILE 51 HG23 ILE 51 2.473 20.609 21.981 360 HD11 ILE 51 HD11 ILE 51 -0.272 19.488 18.025 361 HD12 ILE 51 HD12 ILE 51 1.124 20.304 17.998 362 HD13 ILE 51 HD13 ILE 51 0.055 20.569 19.182 363 H ALA 52 H ALA 52 5.469 18.864 20.901 364 HA ALA 52 HA ALA 52 5.768 20.947 22.624 365 HB1 ALA 52 HB1 ALA 52 6.791 18.755 22.978 366 HB2 ALA 52 HB2 ALA 52 7.900 19.910 23.208 367 HB3 ALA 52 HB3 ALA 52 7.875 19.078 21.822 368 H SER 53 H SER 53 7.289 20.573 19.543 369 HA SER 53 HA SER 53 8.664 23.074 19.910 370 HB2 SER 53 HB2 SER 53 9.925 22.379 17.916 371 HB3 SER 53 HB3 SER 53 10.017 21.245 19.087 372 HG SER 53 HG SER 53 8.706 19.942 18.045 373 H ALA 54 H ALA 54 5.880 21.972 18.731 374 HA ALA 54 HA ALA 54 4.435 22.523 17.173 375 HB1 ALA 54 HB1 ALA 54 4.357 24.649 18.359 376 HB2 ALA 54 HB2 ALA 54 4.003 24.887 16.799 377 HB3 ALA 54 HB3 ALA 54 5.476 25.250 17.359 378 H GLY 55 H GLY 55 7.098 21.677 16.235 379 HA2 GLY 55 HA2 GLY 55 7.559 23.144 13.871 380 HA3 GLY 55 HA3 GLY 55 8.411 21.853 14.397 381 H GLY 56 H GLY 56 5.275 20.916 14.328 382 HA2 GLY 56 HA2 GLY 56 5.678 19.113 12.299 383 HA3 GLY 56 HA3 GLY 56 4.217 19.530 12.899 384 H LEU 57 H LEU 57 4.252 22.281 12.086 385 HA LEU 57 HA LEU 57 3.714 21.846 9.325 386 HB2 LEU 57 HB2 LEU 57 3.276 24.214 10.936 387 HB3 LEU 57 HB3 LEU 57 2.808 24.114 9.374 388 HG LEU 57 HG LEU 57 1.685 22.532 11.494 389 HD11 LEU 57 HD11 LEU 57 -0.261 23.966 11.259 390 HD12 LEU 57 HD12 LEU 57 0.526 24.847 10.155 391 HD13 LEU 57 HD13 LEU 57 1.024 24.846 11.693 392 HD21 LEU 57 HD21 LEU 57 0.017 21.857 9.914 393 HD22 LEU 57 HD22 LEU 57 1.482 21.386 9.419 394 HD23 LEU 57 HD23 LEU 57 0.780 22.680 8.750 395 H PHE 58 H PHE 58 5.917 23.604 11.271 396 HA PHE 58 HA PHE 58 6.846 25.132 9.089 397 HB2 PHE 58 HB2 PHE 58 7.895 25.124 11.809 398 HB3 PHE 58 HB3 PHE 58 8.122 26.329 10.730 399 HD1 PHE 58 HD1 PHE 58 6.465 25.663 13.554 400 HD2 PHE 58 HD2 PHE 58 5.692 27.232 9.776 401 HE1 PHE 58 HE1 PHE 58 4.502 26.753 14.421 402 HE2 PHE 58 HE2 PHE 58 3.710 28.325 10.632 403 HZ PHE 58 HZ PHE 58 3.123 28.096 12.960 404 H GLY 59 H GLY 59 7.703 22.208 10.318 405 HA2 GLY 59 HA2 GLY 59 10.454 22.258 9.957 406 HA3 GLY 59 HA3 GLY 59 9.524 20.916 9.998 407 H GLY 60 H GLY 60 7.988 22.197 7.665 408 HA2 GLY 60 HA2 GLY 60 9.269 20.829 5.638 409 HA3 GLY 60 HA3 GLY 60 8.098 21.949 5.431 410 H ILE 61 H ILE 61 9.760 24.021 6.783 411 HA ILE 61 HA ILE 61 11.064 24.999 4.545 412 HB ILE 61 HB ILE 61 11.463 25.820 7.325 413 HG12 ILE 61 HG12 ILE 61 9.219 26.130 6.659 414 HG13 ILE 61 HG13 ILE 61 9.935 27.571 6.938 415 HG21 ILE 61 HG21 ILE 61 12.395 27.891 6.502 416 HG22 ILE 61 HG22 ILE 61 12.280 27.342 4.985 417 HG23 ILE 61 HG23 ILE 61 13.303 26.642 6.023 418 HD11 ILE 61 HD11 ILE 61 8.551 27.715 4.968 419 HD12 ILE 61 HD12 ILE 61 9.388 26.517 4.275 420 HD13 ILE 61 HD13 ILE 61 10.097 27.944 4.551 421 H LEU 62 H LEU 62 12.154 23.301 7.359 422 HA LEU 62 HA LEU 62 14.860 23.420 6.717 423 HB2 LEU 62 HB2 LEU 62 13.522 21.564 8.490 424 HB3 LEU 62 HB3 LEU 62 15.140 21.791 8.467 425 HG LEU 62 HG LEU 62 13.277 23.824 9.283 426 HD11 LEU 62 HD11 LEU 62 13.962 23.298 11.550 427 HD12 LEU 62 HD12 LEU 62 14.875 22.087 10.991 428 HD13 LEU 62 HD13 LEU 62 13.265 22.006 10.872 429 HD21 LEU 62 HD21 LEU 62 15.198 24.987 10.127 430 HD22 LEU 62 HD22 LEU 62 15.340 24.763 8.532 431 HD23 LEU 62 HD23 LEU 62 16.161 23.820 9.557 432 H ASP 63 H ASP 63 12.323 21.299 5.885 433 HA ASP 63 HA ASP 63 13.899 19.156 5.185 434 HB2 ASP 63 HB2 ASP 63 11.483 19.034 5.535 435 HB3 ASP 63 HB3 ASP 63 11.298 19.632 4.027 436 H GLN 64 H GLN 64 13.277 22.026 3.537 437 HA GLN 64 HA GLN 64 13.806 21.145 0.977 438 HB2 GLN 64 HB2 GLN 64 14.204 23.811 2.028 439 HB3 GLN 64 HB3 GLN 64 14.208 23.461 0.432 440 HG2 GLN 64 HG2 GLN 64 11.906 22.690 0.721 441 HG3 GLN 64 HG3 GLN 64 11.951 23.371 2.205 442 HE21 GLN 64 HE21 GLN 64 10.756 25.565 -0.759 443 HE22 GLN 64 HE22 GLN 64 10.701 23.838 -0.643 444 H GLN 65 H GLN 65 15.836 21.386 3.592 445 HA GLN 65 HA GLN 65 18.128 20.789 1.931 446 HB2 GLN 65 HB2 GLN 65 18.292 23.072 2.641 447 HB3 GLN 65 HB3 GLN 65 18.338 22.546 4.187 448 HG2 GLN 65 HG2 GLN 65 20.523 23.071 3.409 449 HG3 GLN 65 HG3 GLN 65 20.412 21.486 3.785 450 HE21 GLN 65 HE21 GLN 65 21.680 20.468 0.776 451 HE22 GLN 65 HE22 GLN 65 21.577 20.245 2.490 452 H SER 66 H SER 66 17.034 18.641 2.611 453 HA SER 66 HA SER 66 18.122 17.788 5.143 454 HB2 SER 66 HB2 SER 66 15.825 18.212 5.607 455 HB3 SER 66 HB3 SER 66 15.368 17.387 4.273 456 HG SER 66 HG SER 66 15.841 16.498 6.718 457 H GLU 67 H GLU 67 18.401 15.465 5.430 458 HA GLU 67 HA GLU 67 19.218 14.175 3.106 459 HB2 GLU 67 HB2 GLU 67 19.923 13.695 5.444 460 HB3 GLU 67 HB3 GLU 67 18.566 12.793 5.557 461 HG2 GLU 67 HG2 GLU 67 20.241 11.313 5.092 462 HG3 GLU 67 HG3 GLU 67 19.421 11.486 3.690 463 H ASN 68 H ASN 68 16.287 14.253 4.859 464 HA ASN 68 HA ASN 68 15.093 12.205 3.243 465 HB2 ASN 68 HB2 ASN 68 14.215 13.476 5.688 466 HB3 ASN 68 HB3 ASN 68 13.195 12.519 4.844 467 HD21 ASN 68 HD21 ASN 68 15.844 10.946 7.311 468 HD22 ASN 68 HD22 ASN 68 15.606 12.651 7.117 469 H ARG 69 H ARG 69 15.770 14.915 2.296 470 HA ARG 69 HA ARG 69 13.638 16.540 2.082 471 HB2 ARG 69 HB2 ARG 69 15.749 17.235 1.309 472 HB3 ARG 69 HB3 ARG 69 15.735 16.102 0.133 473 HG2 ARG 69 HG2 ARG 69 14.131 17.291 -1.065 474 HG3 ARG 69 HG3 ARG 69 13.959 18.363 0.155 475 HD2 ARG 69 HD2 ARG 69 16.248 19.031 -0.182 476 HD3 ARG 69 HD3 ARG 69 16.300 18.055 -1.490 477 HE ARG 69 HE ARG 69 14.154 19.710 -1.880 478 HH11 ARG 69 HH11 ARG 69 14.230 21.561 -3.087 479 HH12 ARG 69 HH12 ARG 69 15.744 22.317 -3.452 480 HH21 ARG 69 HH21 ARG 69 17.659 20.032 -1.732 481 HH22 ARG 69 HH22 ARG 69 17.651 21.468 -2.699 482 H TRP 70 H TRP 70 11.836 16.861 1.010 483 HA TRP 70 HA TRP 70 10.751 14.654 -0.292 484 HB2 TRP 70 HB2 TRP 70 8.830 16.245 -0.571 485 HB3 TRP 70 HB3 TRP 70 9.282 15.963 0.973 486 HD1 TRP 70 HD1 TRP 70 11.303 18.453 -0.946 487 HE1 TRP 70 HE1 TRP 70 11.035 20.803 -0.129 488 HE3 TRP 70 HE3 TRP 70 7.550 17.588 2.261 489 HZ2 TRP 70 HZ2 TRP 70 9.322 22.075 1.682 490 HZ3 TRP 70 HZ3 TRP 70 6.660 19.453 3.526 491 HH2 TRP 70 HH2 TRP 70 7.534 21.677 3.209 492 H PHE 71 H PHE 71 9.756 14.488 -2.388 493 HA PHE 71 HA PHE 71 11.453 15.608 -4.339 494 HB2 PHE 71 HB2 PHE 71 10.351 14.246 -5.907 495 HB3 PHE 71 HB3 PHE 71 10.654 13.355 -4.572 496 HD1 PHE 71 HD1 PHE 71 8.762 12.810 -2.989 497 HD2 PHE 71 HD2 PHE 71 8.133 14.560 -6.709 498 HE1 PHE 71 HE1 PHE 71 6.424 12.237 -2.853 499 HE2 PHE 71 HE2 PHE 71 5.787 14.012 -6.583 500 HZ PHE 71 HZ PHE 71 4.926 12.845 -4.653 501 H LYS 72 H LYS 72 11.144 17.423 -5.578 502 HA LYS 72 HA LYS 72 8.727 18.809 -5.063 503 HB2 LYS 72 HB2 LYS 72 9.710 20.742 -5.725 504 HB3 LYS 72 HB3 LYS 72 10.959 19.905 -5.087 505 HG2 LYS 72 HG2 LYS 72 10.545 19.954 -7.928 506 HG3 LYS 72 HG3 LYS 72 11.388 21.143 -7.191 507 HD2 LYS 72 HD2 LYS 72 12.966 19.478 -6.437 508 HD3 LYS 72 HD3 LYS 72 12.165 18.373 -7.334 509 HE2 LYS 72 HE2 LYS 72 12.661 19.569 -9.322 510 HE3 LYS 72 HE3 LYS 72 13.358 20.767 -8.458 511 HZ1 LYS 72 HZ1 LYS 72 15.013 19.411 -9.457 512 HZ2 LYS 72 HZ2 LYS 72 14.423 18.108 -8.702 513 HZ3 LYS 72 HZ3 LYS 72 15.113 19.294 -7.847 514 H HIS 73 H HIS 73 7.257 19.716 -6.589 515 HA HIS 73 HA HIS 73 7.480 18.570 -9.231 516 HB2 HIS 73 HB2 HIS 73 5.304 18.372 -7.463 517 HB3 HIS 73 HB3 HIS 73 4.868 18.816 -8.973 518 HD1 HIS 73 HD1 HIS 73 7.615 16.377 -8.328 519 HD2 HIS 73 HD2 HIS 73 3.744 16.388 -9.679 520 HE1 HIS 73 HE1 HIS 73 7.095 14.129 -9.279 521 HE2 HIS 73 HE2 HIS 73 4.767 14.113 -10.082 522 H ILE 74 H ILE 74 8.243 20.247 -10.408 523 HA ILE 74 HA ILE 74 7.234 22.838 -9.979 524 HB ILE 74 HB ILE 74 8.931 21.966 -12.197 525 HG12 ILE 74 HG12 ILE 74 9.842 23.241 -9.768 526 HG13 ILE 74 HG13 ILE 74 9.917 21.625 -9.996 527 HG21 ILE 74 HG21 ILE 74 9.501 24.305 -12.492 528 HG22 ILE 74 HG22 ILE 74 8.475 24.711 -11.309 529 HG23 ILE 74 HG23 ILE 74 7.909 24.103 -12.697 530 HD11 ILE 74 HD11 ILE 74 12.060 22.608 -10.409 531 HD12 ILE 74 HD12 ILE 74 11.422 23.557 -11.552 532 HD13 ILE 74 HD13 ILE 74 11.495 21.957 -11.777 533 H MET 75 H MET 75 5.540 23.872 -11.009 534 HA MET 75 HA MET 75 4.470 22.701 -13.384 535 HB2 MET 75 HB2 MET 75 2.951 23.145 -10.948 536 HB3 MET 75 HB3 MET 75 2.207 22.890 -12.380 537 HG2 MET 75 HG2 MET 75 3.140 20.772 -12.497 538 HG3 MET 75 HG3 MET 75 3.908 21.026 -11.078 539 HE1 MET 75 HE1 MET 75 1.223 20.931 -8.450 540 HE2 MET 75 HE2 MET 75 2.045 22.178 -9.069 541 HE3 MET 75 HE3 MET 75 2.808 20.792 -8.733 542 H THR 76 H THR 76 2.868 24.071 -14.494 543 HA THR 76 HA THR 76 3.395 26.865 -14.140 544 HB THR 76 HB THR 76 2.078 27.095 -16.205 545 HG1 THR 76 HG1 THR 76 0.667 25.564 -16.352 546 HG21 THR 76 HG21 THR 76 3.628 25.992 -17.660 547 HG22 THR 76 HG22 THR 76 4.158 25.079 -16.436 548 HG23 THR 76 HG23 THR 76 4.457 26.668 -16.447 549 H GLY 77 H GLY 77 1.150 28.256 -14.471 550 HA2 GLY 77 HA2 GLY 77 -0.627 27.452 -12.440 551 HA3 GLY 77 HA3 GLY 77 -0.831 28.720 -13.450 552 H GLY 78 H GLY 78 -3.166 27.813 -13.159 553 HA2 GLY 78 HA2 GLY 78 -4.710 27.165 -14.804 554 HA3 GLY 78 HA3 GLY 78 -3.621 26.137 -15.456 555 H GLU 79 H GLU 79 -5.389 24.578 -15.531 556 HA GLU 79 HA GLU 79 -6.344 23.626 -13.076 557 HB2 GLU 79 HB2 GLU 79 -6.765 22.919 -15.799 558 HB3 GLU 79 HB3 GLU 79 -6.999 21.690 -14.750 559 HG2 GLU 79 HG2 GLU 79 -8.401 24.187 -14.608 560 HG3 GLU 79 HG3 GLU 79 -9.016 22.842 -15.300 561 H HIS 80 H HIS 80 -5.751 21.877 -11.806 562 HA HIS 80 HA HIS 80 -3.638 20.224 -12.862 563 HB2 HIS 80 HB2 HIS 80 -3.679 21.294 -10.166 564 HB3 HIS 80 HB3 HIS 80 -2.571 20.216 -10.692 565 HD1 HIS 80 HD1 HIS 80 -3.500 23.795 -10.948 566 HD2 HIS 80 HD2 HIS 80 -0.489 21.312 -12.192 567 HE1 HIS 80 HE1 HIS 80 -1.647 25.183 -11.855 568 HE2 HIS 80 HE2 HIS 80 0.162 23.711 -12.623 569 H THR 81 H THR 81 -3.825 18.003 -12.451 570 HA THR 81 HA THR 81 -5.991 17.319 -10.655 571 HB THR 81 HB THR 81 -5.258 15.767 -12.994 572 HG1 THR 81 HG1 THR 81 -6.427 17.811 -13.266 573 HG21 THR 81 HG21 THR 81 -7.200 14.439 -12.484 574 HG22 THR 81 HG22 THR 81 -7.489 15.337 -11.171 575 HG23 THR 81 HG23 THR 81 -6.189 14.376 -11.223 576 H PHE 82 H PHE 82 -5.181 16.602 -8.776 577 HA PHE 82 HA PHE 82 -2.620 15.291 -8.805 578 HB2 PHE 82 HB2 PHE 82 -4.206 16.161 -6.571 579 HB3 PHE 82 HB3 PHE 82 -2.719 15.498 -6.439 580 HD1 PHE 82 HD1 PHE 82 -0.724 16.745 -7.287 581 HD2 PHE 82 HD2 PHE 82 -4.485 18.502 -7.041 582 HE1 PHE 82 HE1 PHE 82 0.287 18.912 -7.533 583 HE2 PHE 82 HE2 PHE 82 -3.479 20.684 -7.293 584 HZ PHE 82 HZ PHE 82 -1.090 20.889 -7.550 585 H THR 83 H THR 83 -2.536 13.135 -9.041 586 HA THR 83 HA THR 83 -4.901 11.659 -8.289 587 HB THR 83 HB THR 83 -3.156 11.033 -10.542 588 HG1 THR 83 HG1 THR 83 -4.955 11.706 -11.815 589 HG21 THR 83 HG21 THR 83 -4.829 9.458 -11.216 590 HG22 THR 83 HG22 THR 83 -5.723 9.826 -9.920 591 HG23 THR 83 HG23 THR 83 -4.309 9.065 -9.736 592 H TRP 84 H TRP 84 -4.217 11.080 -6.266 593 HA TRP 84 HA TRP 84 -1.794 9.590 -6.031 594 HB2 TRP 84 HB2 TRP 84 -3.783 9.976 -3.988 595 HB3 TRP 84 HB3 TRP 84 -2.216 9.582 -3.753 596 HD1 TRP 84 HD1 TRP 84 -0.510 11.662 -4.726 597 HE1 TRP 84 HE1 TRP 84 -0.587 14.121 -4.266 598 HE3 TRP 84 HE3 TRP 84 -5.287 11.875 -3.295 599 HZ2 TRP 84 HZ2 TRP 84 -2.568 15.899 -3.350 600 HZ3 TRP 84 HZ3 TRP 84 -6.217 14.011 -2.627 601 HH2 TRP 84 HH2 TRP 84 -4.856 16.007 -2.666 602 H THR 85 H THR 85 -1.685 7.341 -6.058 603 HA THR 85 HA THR 85 -4.207 5.929 -6.152 604 HB THR 85 HB THR 85 -2.833 4.329 -7.617 605 HG1 THR 85 HG1 THR 85 -0.936 5.012 -8.016 606 HG21 THR 85 HG21 THR 85 -3.524 5.507 -9.583 607 HG22 THR 85 HG22 THR 85 -3.735 6.859 -8.721 608 HG23 THR 85 HG23 THR 85 -4.714 5.593 -8.491 609 H TYR 86 H TYR 86 -4.388 4.093 -4.869 610 HA TYR 86 HA TYR 86 -2.034 3.456 -3.346 611 HB2 TYR 86 HB2 TYR 86 -4.702 3.896 -2.312 612 HB3 TYR 86 HB3 TYR 86 -3.599 3.078 -1.427 613 HD1 TYR 86 HD1 TYR 86 -2.095 4.256 -0.001 614 HD2 TYR 86 HD2 TYR 86 -4.132 6.318 -2.990 615 HE1 TYR 86 HE1 TYR 86 -1.196 6.362 0.815 616 HE2 TYR 86 HE2 TYR 86 -3.274 8.385 -2.140 617 HH TYR 86 HH TYR 86 -0.750 8.714 -0.096 618 H THR 87 H THR 87 -1.720 1.371 -2.624 619 HA THR 87 HA THR 87 -3.500 -0.646 -3.752 620 HB THR 87 HB THR 87 -1.481 -0.789 -4.984 621 HG1 THR 87 HG1 THR 87 -2.510 -2.734 -4.061 622 HG21 THR 87 HG21 THR 87 0.647 -1.100 -3.913 623 HG22 THR 87 HG22 THR 87 -0.049 -1.001 -2.457 624 HG23 THR 87 HG23 THR 87 0.020 0.303 -3.410 625 H ALA 88 H ALA 88 -3.680 0.785 -1.312 626 HA ALA 88 HA ALA 88 -2.600 -0.691 0.769 627 HB1 ALA 88 HB1 ALA 88 -3.303 1.600 1.102 628 HB2 ALA 88 HB2 ALA 88 -4.066 0.668 2.181 629 HB3 ALA 88 HB3 ALA 88 -4.845 1.179 0.859 630 HA PRO 89 HA PRO 89 -5.728 -3.827 0.720 631 HB2 PRO 89 HB2 PRO 89 -4.648 -5.627 2.317 632 HB3 PRO 89 HB3 PRO 89 -3.871 -5.328 0.912 633 HG2 PRO 89 HG2 PRO 89 -3.316 -4.219 3.482 634 HG3 PRO 89 HG3 PRO 89 -2.257 -4.893 2.437 635 HD2 PRO 89 HD2 PRO 89 -2.581 -2.285 2.555 636 HD3 PRO 89 HD3 PRO 89 -2.149 -3.019 1.162 637 H HIS 90 H HIS 90 -5.862 -1.488 2.471 638 HA HIS 90 HA HIS 90 -7.512 -2.676 4.488 639 HB2 HIS 90 HB2 HIS 90 -5.550 -0.588 4.940 640 HB3 HIS 90 HB3 HIS 90 -6.724 -0.887 6.036 641 HD1 HIS 90 HD1 HIS 90 -6.745 -3.871 6.320 642 HD2 HIS 90 HD2 HIS 90 -3.306 -1.655 6.070 643 HE1 HIS 90 HE1 HIS 90 -4.870 -5.217 7.248 644 HE2 HIS 90 HE2 HIS 90 -2.784 -3.899 7.105 645 H ASN 91 H ASN 91 -9.333 -1.543 5.250 646 HA ASN 91 HA ASN 91 -10.464 0.195 3.393 647 HB2 ASN 91 HB2 ASN 91 -11.733 -1.247 4.897 648 HB3 ASN 91 HB3 ASN 91 -11.390 -0.201 6.104 649 HD21 ASN 91 HD21 ASN 91 -14.522 1.140 5.459 650 HD22 ASN 91 HD22 ASN 91 -13.599 0.125 6.517 651 H THR 92 H THR 92 -11.137 2.439 3.704 652 HA THR 92 HA THR 92 -9.358 3.908 5.470 653 HB THR 92 HB THR 92 -10.271 4.891 2.888 654 HG1 THR 92 HG1 THR 92 -8.894 3.054 2.706 655 HG21 THR 92 HG21 THR 92 -8.551 6.519 3.114 656 HG22 THR 92 HG22 THR 92 -8.116 5.891 4.539 657 HG23 THR 92 HG23 THR 92 -9.545 6.631 4.384 658 H SER 93 H SER 93 -10.351 5.761 6.556 659 HA SER 93 HA SER 93 -13.202 5.531 6.612 660 HB2 SER 93 HB2 SER 93 -12.035 5.591 8.730 661 HB3 SER 93 HB3 SER 93 -11.484 7.087 8.376 662 HG SER 93 HG SER 93 -14.053 7.149 8.145 663 H GLN 94 H GLN 94 -10.899 8.178 6.476 664 HA GLN 94 HA GLN 94 -12.274 9.374 4.355 665 HB2 GLN 94 HB2 GLN 94 -12.848 11.447 5.394 666 HB3 GLN 94 HB3 GLN 94 -13.615 10.228 6.164 667 HG2 GLN 94 HG2 GLN 94 -11.172 11.142 7.293 668 HG3 GLN 94 HG3 GLN 94 -12.490 12.087 7.485 669 HE21 GLN 94 HE21 GLN 94 -11.911 9.371 10.131 670 HE22 GLN 94 HE22 GLN 94 -10.724 10.174 9.158 671 H TRP 95 H TRP 95 -11.248 11.566 3.734 672 HA TRP 95 HA TRP 95 -8.717 11.949 4.963 673 HB2 TRP 95 HB2 TRP 95 -7.627 12.266 2.773 674 HB3 TRP 95 HB3 TRP 95 -7.917 10.720 3.213 675 HD1 TRP 95 HD1 TRP 95 -9.013 13.208 0.697 676 HE1 TRP 95 HE1 TRP 95 -10.277 12.164 -1.199 677 HE3 TRP 95 HE3 TRP 95 -9.384 8.617 2.639 678 HZ2 TRP 95 HZ2 TRP 95 -11.323 9.605 -1.704 679 HZ3 TRP 95 HZ3 TRP 95 -10.494 6.890 1.357 680 HH2 TRP 95 HH2 TRP 95 -11.483 7.402 -0.789 681 H HIS 96 H HIS 96 -7.827 14.099 4.746 682 HA HIS 96 HA HIS 96 -9.507 16.022 3.425 683 HB2 HIS 96 HB2 HIS 96 -9.567 17.442 5.401 684 HB3 HIS 96 HB3 HIS 96 -10.557 16.144 5.445 685 HD1 HIS 96 HD1 HIS 96 -7.839 17.755 7.263 686 HD2 HIS 96 HD2 HIS 96 -9.667 14.084 7.221 687 HE1 HIS 96 HE1 HIS 96 -7.213 16.528 9.342 688 HE2 HIS 96 HE2 HIS 96 -8.280 14.305 9.320 689 H TYR 97 H TYR 97 -8.401 17.920 2.805 690 HA TYR 97 HA TYR 97 -5.596 17.827 3.277 691 HB2 TYR 97 HB2 TYR 97 -5.279 17.924 0.774 692 HB3 TYR 97 HB3 TYR 97 -5.648 16.464 1.406 693 HD1 TYR 97 HD1 TYR 97 -7.838 15.412 0.972 694 HD2 TYR 97 HD2 TYR 97 -6.881 19.129 -0.620 695 HE1 TYR 97 HE1 TYR 97 -9.772 15.291 -0.477 696 HE2 TYR 97 HE2 TYR 97 -8.811 19.011 -2.059 697 HH TYR 97 HH TYR 97 -10.291 17.131 -3.093 698 H TYR 98 H TYR 98 -4.325 19.577 2.717 699 HA TYR 98 HA TYR 98 -5.744 22.005 2.236 700 HB2 TYR 98 HB2 TYR 98 -4.566 22.921 4.282 701 HB3 TYR 98 HB3 TYR 98 -5.973 22.117 4.485 702 HD1 TYR 98 HD1 TYR 98 -5.938 19.746 5.370 703 HD2 TYR 98 HD2 TYR 98 -2.546 22.155 5.323 704 HE1 TYR 98 HE1 TYR 98 -4.853 18.252 6.929 705 HE2 TYR 98 HE2 TYR 98 -1.489 20.690 6.920 706 HH TYR 98 HH TYR 98 -2.308 18.979 8.758 707 H ILE 99 H ILE 99 -4.317 23.889 1.906 708 HA ILE 99 HA ILE 99 -1.666 23.101 1.130 709 HB ILE 99 HB ILE 99 -1.857 24.441 -0.941 710 HG12 ILE 99 HG12 ILE 99 -4.670 24.592 -0.364 711 HG13 ILE 99 HG13 ILE 99 -3.643 25.845 -0.161 712 HG21 ILE 99 HG21 ILE 99 -3.141 22.825 -2.187 713 HG22 ILE 99 HG22 ILE 99 -3.758 22.242 -0.810 714 HG23 ILE 99 HG23 ILE 99 -2.183 22.063 -1.131 715 HD11 ILE 99 HD11 ILE 99 -4.849 26.102 -2.213 716 HD12 ILE 99 HD12 ILE 99 -4.293 24.677 -2.736 717 HD13 ILE 99 HD13 ILE 99 -3.275 25.917 -2.535 718 H THR 100 H THR 100 -0.096 24.975 0.973 719 HA THR 100 HA THR 100 -1.000 26.914 2.816 720 HB THR 100 HB THR 100 1.078 26.194 3.619 721 HG1 THR 100 HG1 THR 100 2.571 27.970 3.078 722 HG21 THR 100 HG21 THR 100 3.007 25.933 2.278 723 HG22 THR 100 HG22 THR 100 2.203 26.466 0.981 724 HG23 THR 100 HG23 THR 100 1.806 25.049 1.651 725 H LYS 101 H LYS 101 -1.528 28.988 2.421 726 HA LYS 101 HA LYS 101 -0.769 30.029 -0.159 727 HB2 LYS 101 HB2 LYS 101 -3.090 30.191 0.537 728 HB3 LYS 101 HB3 LYS 101 -2.617 31.245 1.691 729 HG2 LYS 101 HG2 LYS 101 -1.773 32.666 -0.116 730 HG3 LYS 101 HG3 LYS 101 -2.553 31.676 -1.155 731 HD2 LYS 101 HD2 LYS 101 -3.845 33.277 0.876 732 HD3 LYS 101 HD3 LYS 101 -3.870 33.607 -0.723 733 HE2 LYS 101 HE2 LYS 101 -5.147 31.349 0.523 734 HE3 LYS 101 HE3 LYS 101 -5.921 32.657 -0.076 735 HZ1 LYS 101 HZ1 LYS 101 -6.144 30.830 -1.551 736 HZ2 LYS 101 HZ2 LYS 101 -4.536 30.714 -1.677 737 HZ3 LYS 101 HZ3 LYS 101 -5.302 32.009 -2.270 738 H LYS 102 H LYS 102 1.355 30.794 -0.028 739 HA LYS 102 HA LYS 102 2.271 32.126 2.261 740 HB2 LYS 102 HB2 LYS 102 3.357 31.667 -0.302 741 HB3 LYS 102 HB3 LYS 102 3.946 32.982 0.468 742 HG2 LYS 102 HG2 LYS 102 4.543 31.541 2.315 743 HG3 LYS 102 HG3 LYS 102 4.117 30.264 1.391 744 HD2 LYS 102 HD2 LYS 102 5.793 30.800 -0.180 745 HD3 LYS 102 HD3 LYS 102 6.178 32.149 0.657 746 HE2 LYS 102 HE2 LYS 102 6.862 30.752 2.501 747 HE3 LYS 102 HE3 LYS 102 6.589 29.440 1.567 748 HZ1 LYS 102 HZ1 LYS 102 8.898 29.995 1.540 749 HZ2 LYS 102 HZ2 LYS 102 8.546 31.472 0.983 750 HZ3 LYS 102 HZ3 LYS 102 8.276 30.174 0.058 751 H GLY 103 H GLY 103 2.687 34.416 2.562 752 HA2 GLY 103 HA2 GLY 103 2.459 36.601 1.648 753 HA3 GLY 103 HA3 GLY 103 1.195 36.097 0.744 754 H TRP 104 H TRP 104 0.990 34.823 3.791 755 HA TRP 104 HA TRP 104 -1.247 36.240 4.488 756 HB2 TRP 104 HB2 TRP 104 -0.901 35.255 6.723 757 HB3 TRP 104 HB3 TRP 104 -0.844 34.150 5.522 758 HD1 TRP 104 HD1 TRP 104 1.522 36.007 7.748 759 HE1 TRP 104 HE1 TRP 104 3.729 34.849 8.000 760 HE3 TRP 104 HE3 TRP 104 0.611 32.233 4.591 761 HZ2 TRP 104 HZ2 TRP 104 4.885 32.527 6.892 762 HZ3 TRP 104 HZ3 TRP 104 2.316 30.543 4.265 763 HH2 TRP 104 HH2 TRP 104 4.435 30.700 5.419 764 H ASP 105 H ASP 105 -1.660 37.799 6.145 765 HA ASP 105 HA ASP 105 0.281 39.812 6.325 766 HB2 ASP 105 HB2 ASP 105 -2.213 39.564 7.790 767 HB3 ASP 105 HB3 ASP 105 -1.363 40.951 7.642 768 HA PRO 106 HA PRO 106 2.161 38.363 9.979 769 HB2 PRO 106 HB2 PRO 106 3.225 40.532 11.107 770 HB3 PRO 106 HB3 PRO 106 3.831 40.025 9.678 771 HG2 PRO 106 HG2 PRO 106 1.860 42.047 10.113 772 HG3 PRO 106 HG3 PRO 106 3.214 42.155 9.206 773 HD2 PRO 106 HD2 PRO 106 0.950 41.616 8.050 774 HD3 PRO 106 HD3 PRO 106 2.313 40.899 7.507 775 H ASP 107 H ASP 107 -0.416 40.379 10.167 776 HA ASP 107 HA ASP 107 -0.741 40.393 12.948 777 HB2 ASP 107 HB2 ASP 107 -1.768 41.969 11.331 778 HB3 ASP 107 HB3 ASP 107 -2.818 40.779 10.945 779 H LYS 108 H LYS 108 -0.934 37.909 10.875 780 HA LYS 108 HA LYS 108 -3.180 36.664 12.170 781 HB2 LYS 108 HB2 LYS 108 -1.940 36.089 9.621 782 HB3 LYS 108 HB3 LYS 108 -3.173 35.199 10.217 783 HG2 LYS 108 HG2 LYS 108 -4.639 36.998 10.035 784 HG3 LYS 108 HG3 LYS 108 -3.417 38.010 9.646 785 HD2 LYS 108 HD2 LYS 108 -3.136 36.921 7.582 786 HD3 LYS 108 HD3 LYS 108 -4.289 35.834 7.976 787 HE2 LYS 108 HE2 LYS 108 -5.947 37.491 7.932 788 HE3 LYS 108 HE3 LYS 108 -4.825 38.663 7.738 789 HZ1 LYS 108 HZ1 LYS 108 -5.899 38.211 5.678 790 HZ2 LYS 108 HZ2 LYS 108 -5.444 36.662 5.765 791 HZ3 LYS 108 HZ3 LYS 108 -4.333 37.822 5.573 792 HA PRO 109 HA PRO 109 -0.396 33.972 14.114 793 HB2 PRO 109 HB2 PRO 109 -2.008 32.043 15.023 794 HB3 PRO 109 HB3 PRO 109 -2.024 33.507 15.747 795 HG2 PRO 109 HG2 PRO 109 -3.813 32.537 13.735 796 HG3 PRO 109 HG3 PRO 109 -4.199 33.287 15.134 797 HD2 PRO 109 HD2 PRO 109 -4.136 34.649 12.941 798 HD3 PRO 109 HD3 PRO 109 -3.616 35.340 14.327 799 H LEU 110 H LEU 110 1.097 32.792 13.331 800 HA LEU 110 HA LEU 110 0.876 31.879 10.827 801 HB2 LEU 110 HB2 LEU 110 2.735 31.158 12.929 802 HB3 LEU 110 HB3 LEU 110 2.952 30.536 11.435 803 HG LEU 110 HG LEU 110 4.497 32.230 11.952 804 HD11 LEU 110 HD11 LEU 110 4.302 33.430 9.882 805 HD12 LEU 110 HD12 LEU 110 2.783 32.897 9.728 806 HD13 LEU 110 HD13 LEU 110 4.017 31.854 9.665 807 HD21 LEU 110 HD21 LEU 110 3.884 34.542 12.030 808 HD22 LEU 110 HD22 LEU 110 3.244 33.736 13.277 809 HD23 LEU 110 HD23 LEU 110 2.321 34.128 12.009 810 H LYS 111 H LYS 111 0.705 29.853 13.667 811 HA LYS 111 HA LYS 111 0.619 27.522 12.203 812 HB2 LYS 111 HB2 LYS 111 0.012 26.416 14.239 813 HB3 LYS 111 HB3 LYS 111 1.221 27.483 14.496 814 HG2 LYS 111 HG2 LYS 111 -0.292 29.001 15.475 815 HG3 LYS 111 HG3 LYS 111 -1.537 27.993 15.157 816 HD2 LYS 111 HD2 LYS 111 -1.000 27.712 17.414 817 HD3 LYS 111 HD3 LYS 111 -0.506 26.362 16.637 818 HE2 LYS 111 HE2 LYS 111 1.740 27.187 16.642 819 HE3 LYS 111 HE3 LYS 111 1.242 28.527 17.432 820 HZ1 LYS 111 HZ1 LYS 111 2.225 26.996 18.958 821 HZ2 LYS 111 HZ2 LYS 111 1.152 25.864 18.533 822 HZ3 LYS 111 HZ3 LYS 111 0.660 27.190 19.315 823 H ARG 112 H ARG 112 -1.803 29.737 12.529 824 HA ARG 112 HA ARG 112 -3.755 27.812 11.710 825 HB2 ARG 112 HB2 ARG 112 -4.093 30.533 12.616 826 HB3 ARG 112 HB3 ARG 112 -5.348 29.681 12.012 827 HG2 ARG 112 HG2 ARG 112 -5.003 28.072 13.805 828 HG3 ARG 112 HG3 ARG 112 -3.928 29.116 14.453 829 HD2 ARG 112 HD2 ARG 112 -5.944 29.484 15.542 830 HD3 ARG 112 HD3 ARG 112 -5.720 30.760 14.548 831 HE ARG 112 HE ARG 112 -7.186 28.878 13.156 832 HH11 ARG 112 HH11 ARG 112 -9.371 29.081 12.871 833 HH12 ARG 112 HH12 ARG 112 -10.312 30.078 13.930 834 HH21 ARG 112 HH21 ARG 112 -7.647 31.089 15.853 835 HH22 ARG 112 HH22 ARG 112 -9.355 31.193 15.586 836 H ALA 113 H ALA 113 -2.421 30.852 10.759 837 HA ALA 113 HA ALA 113 -4.047 31.068 8.520 838 HB1 ALA 113 HB1 ALA 113 -3.192 33.022 9.760 839 HB2 ALA 113 HB2 ALA 113 -2.833 33.180 8.191 840 HB3 ALA 113 HB3 ALA 113 -1.701 32.684 9.234 841 H ASP 114 H ASP 114 -1.069 29.578 8.858 842 HA ASP 114 HA ASP 114 -0.064 30.257 6.380 843 HB2 ASP 114 HB2 ASP 114 0.655 28.108 8.182 844 HB3 ASP 114 HB3 ASP 114 1.442 28.269 6.760 845 H PHE 115 H PHE 115 -2.212 27.767 7.327 846 HA PHE 115 HA PHE 115 -2.214 26.793 4.623 847 HB2 PHE 115 HB2 PHE 115 -2.428 25.236 7.053 848 HB3 PHE 115 HB3 PHE 115 -2.922 24.600 5.633 849 HD1 PHE 115 HD1 PHE 115 0.006 25.698 7.437 850 HD2 PHE 115 HD2 PHE 115 -1.362 23.711 4.044 851 HE1 PHE 115 HE1 PHE 115 2.253 24.926 6.993 852 HE2 PHE 115 HE2 PHE 115 0.871 22.922 3.604 853 HZ PHE 115 HZ PHE 115 2.686 23.532 5.075 854 H GLU 116 H GLU 116 -4.148 26.267 3.569 855 HA GLU 116 HA GLU 116 -6.547 26.800 5.087 856 HB2 GLU 116 HB2 GLU 116 -7.525 27.932 3.271 857 HB3 GLU 116 HB3 GLU 116 -6.088 28.635 3.599 858 HG2 GLU 116 HG2 GLU 116 -5.134 27.418 1.733 859 HG3 GLU 116 HG3 GLU 116 -6.634 26.886 1.367 860 H LEU 117 H LEU 117 -8.404 25.533 4.713 861 HA LEU 117 HA LEU 117 -7.857 22.979 3.739 862 HB2 LEU 117 HB2 LEU 117 -9.482 23.402 5.465 863 HB3 LEU 117 HB3 LEU 117 -10.453 24.093 4.349 864 HG LEU 117 HG LEU 117 -10.542 21.884 3.269 865 HD11 LEU 117 HD11 LEU 117 -10.046 19.984 4.659 866 HD12 LEU 117 HD12 LEU 117 -9.482 20.968 5.811 867 HD13 LEU 117 HD13 LEU 117 -8.700 20.843 4.401 868 HD21 LEU 117 HD21 LEU 117 -12.286 21.127 4.734 869 HD22 LEU 117 HD22 LEU 117 -12.408 22.723 4.502 870 HD23 LEU 117 HD23 LEU 117 -11.774 22.151 5.875 871 H ILE 118 H ILE 118 -8.001 22.151 1.686 872 HA ILE 118 HA ILE 118 -9.494 23.753 -0.213 873 HB ILE 118 HB ILE 118 -7.015 23.716 -0.503 874 HG12 ILE 118 HG12 ILE 118 -7.184 23.546 -2.933 875 HG13 ILE 118 HG13 ILE 118 -8.764 23.200 -2.709 876 HG21 ILE 118 HG21 ILE 118 -6.098 21.861 -1.672 877 HG22 ILE 118 HG22 ILE 118 -7.503 21.073 -1.534 878 HG23 ILE 118 HG23 ILE 118 -6.630 21.406 -0.214 879 HD11 ILE 118 HD11 ILE 118 -8.505 25.527 -3.232 880 HD12 ILE 118 HD12 ILE 118 -7.530 25.719 -1.956 881 HD13 ILE 118 HD13 ILE 118 -9.094 25.375 -1.734 882 H GLY 119 H GLY 119 -9.645 21.046 1.499 883 HA2 GLY 119 HA2 GLY 119 -11.983 20.283 0.445 884 HA3 GLY 119 HA3 GLY 119 -10.896 19.401 -0.396 885 H ALA 120 H ALA 120 -12.998 18.397 1.152 886 HA ALA 120 HA ALA 120 -11.514 16.669 2.927 887 HB1 ALA 120 HB1 ALA 120 -12.375 18.291 4.433 888 HB2 ALA 120 HB2 ALA 120 -13.176 16.905 4.660 889 HB3 ALA 120 HB3 ALA 120 -13.863 18.108 3.826 890 H VAL 121 H VAL 121 -12.142 14.545 2.534 891 HA VAL 121 HA VAL 121 -14.561 14.157 1.073 892 HB VAL 121 HB VAL 121 -11.939 13.249 0.116 893 HG11 VAL 121 HG11 VAL 121 -13.008 12.243 -1.767 894 HG12 VAL 121 HG12 VAL 121 -14.454 12.620 -1.149 895 HG13 VAL 121 HG13 VAL 121 -13.506 11.550 -0.394 896 HG21 VAL 121 HG21 VAL 121 -12.316 14.633 -1.840 897 HG22 VAL 121 HG22 VAL 121 -12.344 15.548 -0.507 898 HG23 VAL 121 HG23 VAL 121 -13.729 15.122 -1.225 899 HA PRO 122 HA PRO 122 -14.248 10.578 3.642 900 HB2 PRO 122 HB2 PRO 122 -16.681 9.601 3.539 901 HB3 PRO 122 HB3 PRO 122 -16.476 11.023 4.316 902 HG2 PRO 122 HG2 PRO 122 -17.349 10.605 1.638 903 HG3 PRO 122 HG3 PRO 122 -18.018 11.575 2.768 904 HD2 PRO 122 HD2 PRO 122 -16.370 12.540 0.942 905 HD3 PRO 122 HD3 PRO 122 -16.486 13.227 2.419 906 H HIS 123 H HIS 123 -14.485 8.148 3.486 907 HA HIS 123 HA HIS 123 -13.453 7.577 0.929 908 HB2 HIS 123 HB2 HIS 123 -12.376 6.498 2.716 909 HB3 HIS 123 HB3 HIS 123 -13.792 5.907 3.276 910 HD1 HIS 123 HD1 HIS 123 -14.555 3.601 2.553 911 HD2 HIS 123 HD2 HIS 123 -11.387 5.068 0.408 912 HE1 HIS 123 HE1 HIS 123 -13.722 1.805 1.046 913 HE2 HIS 123 HE2 HIS 123 -11.809 2.662 -0.251 914 H ASP 124 H ASP 124 -14.515 7.057 -0.784 915 HA ASP 124 HA ASP 124 -15.949 6.088 -2.092 916 HB2 ASP 124 HB2 ASP 124 -14.991 4.115 -0.695 917 HB3 ASP 124 HB3 ASP 124 -16.562 3.916 -0.296 918 H GLY 125 H GLY 125 -17.180 8.017 -0.494 919 HA2 GLY 125 HA2 GLY 125 -19.786 7.214 0.085 920 HA3 GLY 125 HA3 GLY 125 -19.303 8.752 -0.174 921 H SER 126 H SER 126 -21.814 8.002 -1.068 922 HA SER 126 HA SER 126 -21.798 6.956 -3.542 923 HB2 SER 126 HB2 SER 126 -23.877 7.277 -2.303 924 HB3 SER 126 HB3 SER 126 -23.753 8.895 -2.491 925 HG SER 126 HG SER 126 -23.745 7.917 -4.853 926 HA PRO 127 HA PRO 127 -21.840 10.842 -5.855 927 HB2 PRO 127 HB2 PRO 127 -20.830 13.140 -4.937 928 HB3 PRO 127 HB3 PRO 127 -22.372 12.761 -4.556 929 HG2 PRO 127 HG2 PRO 127 -20.029 12.293 -2.985 930 HG3 PRO 127 HG3 PRO 127 -21.416 13.011 -2.509 931 HD2 PRO 127 HD2 PRO 127 -21.042 10.513 -1.981 932 HD3 PRO 127 HD3 PRO 127 -22.537 11.026 -2.393 933 H ALA 128 H ALA 128 -20.454 11.783 -7.407 934 HA ALA 128 HA ALA 128 -18.154 10.326 -7.635 935 HB1 ALA 128 HB1 ALA 128 -19.310 11.293 -9.551 936 HB2 ALA 128 HB2 ALA 128 -17.735 11.654 -9.630 937 HB3 ALA 128 HB3 ALA 128 -18.795 12.763 -9.116 938 H SER 129 H SER 129 -18.551 13.083 -5.824 939 HA SER 129 HA SER 129 -15.959 14.063 -5.927 940 HB2 SER 129 HB2 SER 129 -16.633 15.197 -3.801 941 HB3 SER 129 HB3 SER 129 -17.687 15.448 -5.024 942 HG SER 129 HG SER 129 -19.090 14.076 -4.196 943 H ARG 130 H ARG 130 -17.077 11.246 -4.662 944 HA ARG 130 HA ARG 130 -15.574 10.880 -2.432 945 HB2 ARG 130 HB2 ARG 130 -16.063 8.544 -2.721 946 HB3 ARG 130 HB3 ARG 130 -17.348 9.368 -3.301 947 HG2 ARG 130 HG2 ARG 130 -16.524 9.043 -5.543 948 HG3 ARG 130 HG3 ARG 130 -15.273 8.179 -4.946 949 HD2 ARG 130 HD2 ARG 130 -16.909 6.613 -4.073 950 HD3 ARG 130 HD3 ARG 130 -18.033 7.410 -4.950 951 HE ARG 130 HE ARG 130 -16.030 6.728 -6.696 952 HH11 ARG 130 HH11 ARG 130 -18.486 5.074 -4.784 953 HH12 ARG 130 HH12 ARG 130 -18.541 3.723 -5.867 954 HH21 ARG 130 HH21 ARG 130 -16.156 4.963 -8.026 955 HH22 ARG 130 HH22 ARG 130 -17.243 3.662 -7.672 956 H ASN 131 H ASN 131 -14.391 11.093 -5.514 957 HA ASN 131 HA ASN 131 -12.474 9.142 -5.425 958 HB2 ASN 131 HB2 ASN 131 -12.582 11.566 -7.013 959 HB3 ASN 131 HB3 ASN 131 -11.424 10.442 -7.263 960 HD21 ASN 131 HD21 ASN 131 -14.378 10.052 -9.542 961 HD22 ASN 131 HD22 ASN 131 -13.506 11.459 -9.032 962 H LEU 132 H LEU 132 -10.354 8.984 -4.865 963 HA LEU 132 HA LEU 132 -9.333 10.812 -2.985 964 HB2 LEU 132 HB2 LEU 132 -8.828 8.491 -2.983 965 HB3 LEU 132 HB3 LEU 132 -7.997 8.686 -4.375 966 HG LEU 132 HG LEU 132 -6.229 9.616 -3.315 967 HD11 LEU 132 HD11 LEU 132 -6.101 10.271 -1.054 968 HD12 LEU 132 HD12 LEU 132 -7.675 9.954 -0.863 969 HD13 LEU 132 HD13 LEU 132 -7.204 11.152 -1.842 970 HD21 LEU 132 HD21 LEU 132 -5.747 7.890 -1.626 971 HD22 LEU 132 HD22 LEU 132 -6.470 7.215 -2.905 972 HD23 LEU 132 HD23 LEU 132 -7.323 7.531 -1.568 973 H SER 133 H SER 133 -9.166 10.459 -6.370 974 HA SER 133 HA SER 133 -7.076 12.383 -6.678 975 HB2 SER 133 HB2 SER 133 -7.124 10.643 -8.295 976 HB3 SER 133 HB3 SER 133 -8.668 11.003 -8.684 977 HG SER 133 HG SER 133 -7.223 11.797 -10.198 978 H HIS 134 H HIS 134 -7.343 14.567 -7.150 979 HA HIS 134 HA HIS 134 -10.001 15.409 -7.746 980 HB2 HIS 134 HB2 HIS 134 -8.665 15.990 -5.318 981 HB3 HIS 134 HB3 HIS 134 -9.347 17.306 -6.002 982 HD1 HIS 134 HD1 HIS 134 -11.687 17.834 -5.237 983 HD2 HIS 134 HD2 HIS 134 -10.740 13.853 -5.010 984 HE1 HIS 134 HE1 HIS 134 -13.628 16.609 -4.263 985 HE2 HIS 134 HE2 HIS 134 -13.090 14.204 -4.151 986 H HIS 135 H HIS 135 -10.360 17.404 -8.716 987 HA HIS 135 HA HIS 135 -8.071 18.398 -10.105 988 HB2 HIS 135 HB2 HIS 135 -10.790 19.321 -10.444 989 HB3 HIS 135 HB3 HIS 135 -9.570 19.513 -11.512 990 HD1 HIS 135 HD1 HIS 135 -8.639 17.190 -12.672 991 HD2 HIS 135 HD2 HIS 135 -12.379 17.185 -11.001 992 HE1 HIS 135 HE1 HIS 135 -9.895 15.233 -13.553 993 HE2 HIS 135 HE2 HIS 135 -12.154 15.204 -12.555 994 H ILE 136 H ILE 136 -7.049 20.334 -9.625 995 HA ILE 136 HA ILE 136 -8.429 22.152 -7.891 996 HB ILE 136 HB ILE 136 -5.587 21.507 -7.594 997 HG12 ILE 136 HG12 ILE 136 -6.978 19.786 -6.700 998 HG13 ILE 136 HG13 ILE 136 -6.005 20.464 -5.577 999 HG21 ILE 136 HG21 ILE 136 -5.559 22.997 -5.683 1000 HG22 ILE 136 HG22 ILE 136 -7.101 23.390 -5.967 1001 HG23 ILE 136 HG23 ILE 136 -5.951 23.815 -7.022 1002 HD11 ILE 136 HD11 ILE 136 -8.183 20.081 -4.647 1003 HD12 ILE 136 HD12 ILE 136 -8.854 20.999 -5.797 1004 HD13 ILE 136 HD13 ILE 136 -7.890 21.671 -4.685 1005 H TYR 137 H TYR 137 -8.683 24.105 -8.991 1006 HA TYR 137 HA TYR 137 -6.888 24.725 -11.090 1007 HB2 TYR 137 HB2 TYR 137 -9.130 25.420 -11.328 1008 HB3 TYR 137 HB3 TYR 137 -9.010 26.343 -9.986 1009 HD1 TYR 137 HD1 TYR 137 -8.064 28.569 -10.080 1010 HD2 TYR 137 HD2 TYR 137 -7.925 26.099 -13.422 1011 HE1 TYR 137 HE1 TYR 137 -7.261 30.416 -11.409 1012 HE2 TYR 137 HE2 TYR 137 -7.140 27.958 -14.762 1013 HH TYR 137 HH TYR 137 -6.548 30.124 -14.842 1014 H ILE 138 H ILE 138 -5.160 26.190 -11.058 1015 HA ILE 138 HA ILE 138 -4.733 27.589 -8.577 1016 HB ILE 138 HB ILE 138 -2.647 26.380 -10.229 1017 HG12 ILE 138 HG12 ILE 138 -3.801 24.798 -8.836 1018 HG13 ILE 138 HG13 ILE 138 -2.206 24.886 -8.494 1019 HG21 ILE 138 HG21 ILE 138 -1.029 27.156 -8.633 1020 HG22 ILE 138 HG22 ILE 138 -2.194 27.934 -7.827 1021 HG23 ILE 138 HG23 ILE 138 -1.789 28.408 -9.319 1022 HD11 ILE 138 HD11 ILE 138 -3.471 24.738 -6.456 1023 HD12 ILE 138 HD12 ILE 138 -4.289 26.076 -6.847 1024 HD13 ILE 138 HD13 ILE 138 -2.711 26.164 -6.509 1025 HA PRO 139 HA PRO 139 -4.587 30.937 -11.501 1026 HB2 PRO 139 HB2 PRO 139 -4.130 33.011 -9.914 1027 HB3 PRO 139 HB3 PRO 139 -5.599 32.302 -9.846 1028 HG2 PRO 139 HG2 PRO 139 -3.365 31.845 -8.145 1029 HG3 PRO 139 HG3 PRO 139 -4.906 32.163 -7.708 1030 HD2 PRO 139 HD2 PRO 139 -4.069 29.703 -7.758 1031 HD3 PRO 139 HD3 PRO 139 -5.605 30.039 -8.200 1032 H GLU 140 H GLU 140 -3.084 32.632 -12.313 1033 HA GLU 140 HA GLU 140 -0.376 31.737 -11.811 1034 HB2 GLU 140 HB2 GLU 140 -1.590 31.119 -13.998 1035 HB3 GLU 140 HB3 GLU 140 -1.075 32.602 -14.448 1036 HG2 GLU 140 HG2 GLU 140 1.111 31.992 -14.253 1037 HG3 GLU 140 HG3 GLU 140 0.717 30.599 -13.497 1038 H ASP 141 H ASP 141 -1.706 33.938 -10.611 1039 HA ASP 141 HA ASP 141 -0.744 36.237 -11.884 1040 HB2 ASP 141 HB2 ASP 141 -1.694 37.442 -10.041 1041 HB3 ASP 141 HB3 ASP 141 -2.750 36.295 -10.527 1042 H ARG 142 H ARG 142 0.554 34.103 -9.652 1043 HA ARG 142 HA ARG 142 2.904 35.711 -9.386 1044 HB2 ARG 142 HB2 ARG 142 1.565 34.605 -7.065 1045 HB3 ARG 142 HB3 ARG 142 3.067 35.243 -7.003 1046 HG2 ARG 142 HG2 ARG 142 2.137 37.347 -7.679 1047 HG3 ARG 142 HG3 ARG 142 0.651 36.682 -7.559 1048 HD2 ARG 142 HD2 ARG 142 1.115 36.282 -5.223 1049 HD3 ARG 142 HD3 ARG 142 2.472 37.173 -5.403 1050 HE ARG 142 HE ARG 142 0.159 38.533 -6.301 1051 HH11 ARG 142 HH11 ARG 142 -0.550 40.319 -5.219 1052 HH12 ARG 142 HH12 ARG 142 0.038 40.681 -3.631 1053 HH21 ARG 142 HH21 ARG 142 2.123 37.950 -3.437 1054 HH22 ARG 142 HH22 ARG 142 1.524 39.365 -2.639 1055 H LEU 143 H LEU 143 4.738 34.441 -8.335 1056 HA LEU 143 HA LEU 143 4.548 31.680 -9.119 1057 HB2 LEU 143 HB2 LEU 143 6.827 31.781 -9.852 1058 HB3 LEU 143 HB3 LEU 143 5.841 32.735 -10.738 1059 HG LEU 143 HG LEU 143 7.313 34.020 -8.702 1060 HD11 LEU 143 HD11 LEU 143 9.294 34.114 -10.107 1061 HD12 LEU 143 HD12 LEU 143 8.579 33.129 -11.172 1062 HD13 LEU 143 HD13 LEU 143 8.978 32.580 -9.704 1063 HD21 LEU 143 HD21 LEU 143 7.449 35.800 -10.306 1064 HD22 LEU 143 HD22 LEU 143 5.907 35.357 -10.101 1065 HD23 LEU 143 HD23 LEU 143 6.721 34.869 -11.410 1066 H GLY 144 H GLY 144 5.730 30.114 -7.858 1067 HA2 GLY 144 HA2 GLY 144 7.601 30.392 -6.082 1068 HA3 GLY 144 HA3 GLY 144 6.369 31.051 -5.237 1069 H TYR 145 H TYR 145 7.702 28.984 -4.129 1070 HA TYR 145 HA TYR 145 6.304 26.636 -4.814 1071 HB2 TYR 145 HB2 TYR 145 7.823 25.554 -3.192 1072 HB3 TYR 145 HB3 TYR 145 8.582 26.296 -4.433 1073 HD1 TYR 145 HD1 TYR 145 9.977 28.265 -4.068 1074 HD2 TYR 145 HD2 TYR 145 7.975 26.458 -0.896 1075 HE1 TYR 145 HE1 TYR 145 11.303 29.537 -2.503 1076 HE2 TYR 145 HE2 TYR 145 9.314 27.729 0.665 1077 HH TYR 145 HH TYR 145 10.639 29.635 0.874 1078 H HIS 146 H HIS 146 5.157 25.216 -3.550 1079 HA HIS 146 HA HIS 146 3.995 26.310 -1.163 1080 HB2 HIS 146 HB2 HIS 146 2.408 25.295 -3.373 1081 HB3 HIS 146 HB3 HIS 146 1.780 25.754 -1.938 1082 HD1 HIS 146 HD1 HIS 146 1.125 28.192 -1.585 1083 HD2 HIS 146 HD2 HIS 146 3.328 27.493 -4.972 1084 HE1 HIS 146 HE1 HIS 146 1.196 30.284 -2.937 1085 HE2 HIS 146 HE2 HIS 146 2.512 29.882 -4.983 1086 H VAL 147 H VAL 147 2.889 24.633 0.164 1087 HA VAL 147 HA VAL 147 3.867 21.988 -0.462 1088 HB VAL 147 HB VAL 147 3.376 23.045 2.216 1089 HG11 VAL 147 HG11 VAL 147 4.382 21.049 3.057 1090 HG12 VAL 147 HG12 VAL 147 4.536 20.484 1.550 1091 HG13 VAL 147 HG13 VAL 147 3.066 20.686 2.192 1092 HG21 VAL 147 HG21 VAL 147 5.783 23.070 2.486 1093 HG22 VAL 147 HG22 VAL 147 5.363 24.041 1.263 1094 HG23 VAL 147 HG23 VAL 147 5.963 22.570 0.958 1095 H ILE 148 H ILE 148 2.416 20.318 -0.594 1096 HA ILE 148 HA ILE 148 -0.341 20.945 -0.003 1097 HB ILE 148 HB ILE 148 0.673 18.768 -1.654 1098 HG12 ILE 148 HG12 ILE 148 -0.689 21.139 -2.564 1099 HG13 ILE 148 HG13 ILE 148 0.927 20.927 -2.666 1100 HG21 ILE 148 HG21 ILE 148 -1.646 18.322 -2.248 1101 HG22 ILE 148 HG22 ILE 148 -2.135 19.478 -1.229 1102 HG23 ILE 148 HG23 ILE 148 -1.447 18.132 -0.655 1103 HD11 ILE 148 HD11 ILE 148 -0.089 20.496 -4.786 1104 HD12 ILE 148 HD12 ILE 148 -1.015 19.346 -4.124 1105 HD13 ILE 148 HD13 ILE 148 0.585 19.137 -4.226 1106 H LEU 149 H LEU 149 -1.286 19.928 1.799 1107 HA LEU 149 HA LEU 149 0.097 17.613 2.830 1108 HB2 LEU 149 HB2 LEU 149 -0.524 19.995 4.158 1109 HB3 LEU 149 HB3 LEU 149 -1.011 18.676 4.988 1110 HG LEU 149 HG LEU 149 1.713 19.023 4.177 1111 HD11 LEU 149 HD11 LEU 149 2.194 19.831 6.387 1112 HD12 LEU 149 HD12 LEU 149 0.615 19.818 6.736 1113 HD13 LEU 149 HD13 LEU 149 1.190 20.845 5.628 1114 HD21 LEU 149 HD21 LEU 149 2.145 17.362 5.889 1115 HD22 LEU 149 HD22 LEU 149 1.113 16.768 4.795 1116 HD23 LEU 149 HD23 LEU 149 0.564 17.295 6.222 1117 H ALA 150 H ALA 150 -1.124 15.831 3.376 1118 HA ALA 150 HA ALA 150 -3.970 16.207 3.474 1119 HB1 ALA 150 HB1 ALA 150 -3.469 15.471 1.215 1120 HB2 ALA 150 HB2 ALA 150 -4.305 14.314 1.973 1121 HB3 ALA 150 HB3 ALA 150 -2.703 14.173 1.802 1122 H VAL 151 H VAL 151 -4.967 15.201 5.145 1123 HA VAL 151 HA VAL 151 -3.440 13.221 6.570 1124 HB VAL 151 HB VAL 151 -5.904 14.505 7.379 1125 HG11 VAL 151 HG11 VAL 151 -5.554 13.529 9.550 1126 HG12 VAL 151 HG12 VAL 151 -4.258 12.740 8.991 1127 HG13 VAL 151 HG13 VAL 151 -5.731 12.366 8.440 1128 HG21 VAL 151 HG21 VAL 151 -4.518 15.754 8.927 1129 HG22 VAL 151 HG22 VAL 151 -4.049 16.048 7.408 1130 HG23 VAL 151 HG23 VAL 151 -3.201 15.029 8.333 1131 H TRP 152 H TRP 152 -3.912 11.063 6.443 1132 HA TRP 152 HA TRP 152 -6.296 10.262 4.971 1133 HB2 TRP 152 HB2 TRP 152 -4.332 10.207 3.607 1134 HB3 TRP 152 HB3 TRP 152 -3.610 9.235 4.703 1135 HD1 TRP 152 HD1 TRP 152 -6.577 8.967 2.410 1136 HE1 TRP 152 HE1 TRP 152 -6.768 6.664 1.428 1137 HE3 TRP 152 HE3 TRP 152 -2.732 6.926 4.862 1138 HZ2 TRP 152 HZ2 TRP 152 -5.347 4.248 1.758 1139 HZ3 TRP 152 HZ3 TRP 152 -2.172 4.606 4.451 1140 HH2 TRP 152 HH2 TRP 152 -3.489 3.285 2.913 1141 H ASP 153 H ASP 153 -7.621 9.254 6.344 1142 HA ASP 153 HA ASP 153 -6.422 7.990 8.603 1143 HB2 ASP 153 HB2 ASP 153 -9.207 8.722 8.121 1144 HB3 ASP 153 HB3 ASP 153 -8.692 8.105 9.542 1145 H VAL 154 H VAL 154 -5.894 5.881 8.393 1146 HA VAL 154 HA VAL 154 -7.412 4.135 6.792 1147 HB VAL 154 HB VAL 154 -5.395 3.417 8.761 1148 HG11 VAL 154 HG11 VAL 154 -5.154 1.335 7.576 1149 HG12 VAL 154 HG12 VAL 154 -6.355 1.760 6.579 1150 HG13 VAL 154 HG13 VAL 154 -6.662 1.480 8.142 1151 HG21 VAL 154 HG21 VAL 154 -3.824 3.360 6.924 1152 HG22 VAL 154 HG22 VAL 154 -4.439 4.847 7.081 1153 HG23 VAL 154 HG23 VAL 154 -4.984 3.866 5.917 1154 H ALA 155 H ALA 155 -9.116 2.724 7.381 1155 HA ALA 155 HA ALA 155 -10.241 3.310 9.902 1156 HB1 ALA 155 HB1 ALA 155 -11.692 3.084 7.951 1157 HB2 ALA 155 HB2 ALA 155 -12.157 2.022 9.077 1158 HB3 ALA 155 HB3 ALA 155 -11.274 1.528 7.816 1159 H ASP 156 H ASP 156 -8.519 0.726 8.524 1160 HA ASP 156 HA ASP 156 -9.489 -1.158 10.330 1161 HB2 ASP 156 HB2 ASP 156 -7.293 -1.352 8.397 1162 HB3 ASP 156 HB3 ASP 156 -7.801 -2.663 9.228 1163 H THR 157 H THR 157 -7.097 1.051 10.729 1164 HA THR 157 HA THR 157 -5.847 -0.553 12.697 1165 HB THR 157 HB THR 157 -3.557 0.233 11.892 1166 HG1 THR 157 HG1 THR 157 -4.257 0.888 9.459 1167 HG21 THR 157 HG21 THR 157 -3.396 -1.187 9.967 1168 HG22 THR 157 HG22 THR 157 -5.008 -1.228 9.840 1169 HG23 THR 157 HG23 THR 157 -4.277 -1.943 11.093 1170 H GLU 158 H GLU 158 -4.296 0.601 14.197 1171 HA GLU 158 HA GLU 158 -5.285 3.147 14.872 1172 HB2 GLU 158 HB2 GLU 158 -3.041 1.676 15.956 1173 HB3 GLU 158 HB3 GLU 158 -3.575 3.075 16.608 1174 HG2 GLU 158 HG2 GLU 158 -5.719 1.870 16.902 1175 HG3 GLU 158 HG3 GLU 158 -4.827 0.520 16.684 1176 H ASN 159 H ASN 159 -3.486 2.314 12.473 1177 HA ASN 159 HA ASN 159 -1.529 4.397 12.661 1178 HB2 ASN 159 HB2 ASN 159 -1.699 2.159 10.830 1179 HB3 ASN 159 HB3 ASN 159 -0.550 3.311 10.692 1180 HD21 ASN 159 HD21 ASN 159 0.699 0.296 12.495 1181 HD22 ASN 159 HD22 ASN 159 -0.205 0.493 11.031 1182 H ALA 160 H ALA 160 -1.316 5.971 10.970 1183 HA ALA 160 HA ALA 160 -3.348 6.191 8.932 1184 HB1 ALA 160 HB1 ALA 160 -4.532 7.210 10.697 1185 HB2 ALA 160 HB2 ALA 160 -4.051 8.371 9.680 1186 HB3 ALA 160 HB3 ALA 160 -3.258 8.133 11.070 1187 H PHE 161 H PHE 161 -2.594 8.259 7.538 1188 HA PHE 161 HA PHE 161 0.068 8.954 8.249 1189 HB2 PHE 161 HB2 PHE 161 0.186 7.034 6.678 1190 HB3 PHE 161 HB3 PHE 161 -0.368 8.050 5.526 1191 HD1 PHE 161 HD1 PHE 161 1.223 9.113 4.133 1192 HD2 PHE 161 HD2 PHE 161 2.346 7.868 7.934 1193 HE1 PHE 161 HE1 PHE 161 3.497 9.790 3.682 1194 HE2 PHE 161 HE2 PHE 161 4.618 8.520 7.489 1195 HZ PHE 161 HZ PHE 161 5.200 9.486 5.361 1196 H TYR 162 H TYR 162 1.030 10.796 7.426 1197 HA TYR 162 HA TYR 162 -0.870 12.651 6.293 1198 HB2 TYR 162 HB2 TYR 162 1.203 14.125 6.944 1199 HB3 TYR 162 HB3 TYR 162 -0.101 13.912 7.905 1200 HD1 TYR 162 HD1 TYR 162 3.276 12.722 7.342 1201 HD2 TYR 162 HD2 TYR 162 0.094 12.765 10.032 1202 HE1 TYR 162 HE1 TYR 162 4.685 11.744 9.031 1203 HE2 TYR 162 HE2 TYR 162 1.524 11.788 11.719 1204 HH TYR 162 HH TYR 162 3.530 11.006 12.271 1205 H GLN 163 H GLN 163 -0.720 13.011 4.122 1206 HA GLN 163 HA GLN 163 1.643 12.105 2.776 1207 HB2 GLN 163 HB2 GLN 163 -0.501 13.225 1.282 1208 HB3 GLN 163 HB3 GLN 163 0.443 11.950 0.896 1209 HG2 GLN 163 HG2 GLN 163 -1.761 11.841 2.739 1210 HG3 GLN 163 HG3 GLN 163 -1.805 11.286 1.204 1211 HE21 GLN 163 HE21 GLN 163 -0.949 8.773 3.971 1212 HE22 GLN 163 HE22 GLN 163 -1.817 10.261 4.147 1213 H VAL 164 H VAL 164 3.182 13.605 1.998 1214 HA VAL 164 HA VAL 164 2.344 16.354 1.915 1215 HB VAL 164 HB VAL 164 3.473 16.078 4.032 1216 HG11 VAL 164 HG11 VAL 164 5.799 15.523 4.147 1217 HG12 VAL 164 HG12 VAL 164 5.826 15.268 2.550 1218 HG13 VAL 164 HG13 VAL 164 4.967 14.291 3.510 1219 HG21 VAL 164 HG21 VAL 164 5.012 17.879 3.846 1220 HG22 VAL 164 HG22 VAL 164 3.651 18.211 3.038 1221 HG23 VAL 164 HG23 VAL 164 4.976 17.748 2.234 1222 H ILE 165 H ILE 165 2.988 17.528 0.173 1223 HA ILE 165 HA ILE 165 5.053 16.386 -1.438 1224 HB ILE 165 HB ILE 165 2.465 17.133 -2.610 1225 HG12 ILE 165 HG12 ILE 165 3.614 14.483 -2.535 1226 HG13 ILE 165 HG13 ILE 165 2.441 14.983 -1.515 1227 HG21 ILE 165 HG21 ILE 165 3.369 16.422 -4.762 1228 HG22 ILE 165 HG22 ILE 165 4.797 16.119 -4.067 1229 HG23 ILE 165 HG23 ILE 165 4.259 17.639 -4.179 1230 HD11 ILE 165 HD11 ILE 165 1.500 13.652 -3.253 1231 HD12 ILE 165 HD12 ILE 165 2.087 14.664 -4.368 1232 HD13 ILE 165 HD13 ILE 165 0.925 15.160 -3.359 1233 H ASP 166 H ASP 166 6.514 17.895 -2.100 1234 HA ASP 166 HA ASP 166 5.905 20.654 -1.768 1235 HB2 ASP 166 HB2 ASP 166 8.094 19.776 -1.253 1236 HB3 ASP 166 HB3 ASP 166 8.307 19.441 -2.837 1237 H VAL 167 H VAL 167 5.287 22.103 -3.387 1238 HA VAL 167 HA VAL 167 5.703 21.192 -6.071 1239 HB VAL 167 HB VAL 167 3.531 22.072 -6.775 1240 HG11 VAL 167 HG11 VAL 167 2.208 20.209 -5.951 1241 HG12 VAL 167 HG12 VAL 167 3.325 19.920 -4.817 1242 HG13 VAL 167 HG13 VAL 167 3.680 19.695 -6.379 1243 HG21 VAL 167 HG21 VAL 167 1.838 22.541 -5.141 1244 HG22 VAL 167 HG22 VAL 167 3.066 23.582 -4.992 1245 HG23 VAL 167 HG23 VAL 167 2.922 22.348 -3.957 1246 H ASP 168 H ASP 168 6.076 22.846 -7.664 1247 HA ASP 168 HA ASP 168 6.514 25.474 -6.489 1248 HB2 ASP 168 HB2 ASP 168 8.539 24.271 -7.144 1249 HB3 ASP 168 HB3 ASP 168 8.064 24.518 -8.686 1250 H LEU 169 H LEU 169 4.945 26.814 -7.177 1251 HA LEU 169 HA LEU 169 3.650 26.167 -9.692 1252 HB2 LEU 169 HB2 LEU 169 2.604 27.389 -7.303 1253 HB3 LEU 169 HB3 LEU 169 1.771 27.401 -8.708 1254 HG LEU 169 HG LEU 169 2.576 24.900 -7.558 1255 HD11 LEU 169 HD11 LEU 169 0.492 24.730 -6.395 1256 HD12 LEU 169 HD12 LEU 169 0.127 26.248 -6.817 1257 HD13 LEU 169 HD13 LEU 169 1.359 25.963 -5.810 1258 HD21 LEU 169 HD21 LEU 169 0.697 24.058 -8.825 1259 HD22 LEU 169 HD22 LEU 169 1.715 24.842 -9.807 1260 HD23 LEU 169 HD23 LEU 169 0.352 25.560 -9.316 1261 H VAL 170 H VAL 170 4.515 27.394 -11.278 1262 HA VAL 170 HA VAL 170 4.939 30.126 -10.583 1263 HB VAL 170 HB VAL 170 6.994 30.179 -11.877 1264 HG11 VAL 170 HG11 VAL 170 8.388 28.772 -10.478 1265 HG12 VAL 170 HG12 VAL 170 7.072 27.993 -9.954 1266 HG13 VAL 170 HG13 VAL 170 7.296 29.549 -9.574 1267 HG21 VAL 170 HG21 VAL 170 7.904 28.169 -12.866 1268 HG22 VAL 170 HG22 VAL 170 6.481 28.529 -13.544 1269 HG23 VAL 170 HG23 VAL 170 6.575 27.355 -12.436 1270 H ASN 171 H ASN 171 5.241 31.670 -12.491 1271 HA ASN 171 HA ASN 171 3.194 31.147 -14.350 1272 HB2 ASN 171 HB2 ASN 171 3.523 33.385 -13.632 1273 HB3 ASN 171 HB3 ASN 171 5.029 33.383 -14.266 1274 HD21 ASN 171 HD21 ASN 171 3.899 34.876 -17.140 1275 HD22 ASN 171 HD22 ASN 171 5.034 34.867 -15.832 1276 H LYS 172 H LYS 172 3.326 30.436 -16.394 1277 HA LYS 172 HA LYS 172 5.675 29.332 -17.372 1278 HB2 LYS 172 HB2 LYS 172 4.347 28.853 -19.310 1279 HB3 LYS 172 HB3 LYS 172 3.413 28.625 -17.990 1280 HG2 LYS 172 HG2 LYS 172 2.783 31.046 -18.405 1281 HG3 LYS 172 HG3 LYS 172 3.244 30.691 -19.932 1282 HD2 LYS 172 HD2 LYS 172 1.619 29.027 -20.078 1283 HD3 LYS 172 HD3 LYS 172 1.213 29.245 -18.511 1284 HE2 LYS 172 HE2 LYS 172 0.870 31.225 -20.588 1285 HE3 LYS 172 HE3 LYS 172 -0.347 30.373 -19.910 1286 HZ1 LYS 172 HZ1 LYS 172 -0.225 32.545 -18.930 1287 HZ2 LYS 172 HZ2 LYS 172 1.304 32.267 -18.482 1288 HZ3 LYS 172 HZ3 LYS 172 0.099 31.424 -17.811 Start of MODEL 10 1 H1 HIS 1 H1 HIS 1 -2.557 6.568 2.338 2 H2 HIS 1 H2 HIS 1 -1.680 5.473 1.534 3 H3 HIS 1 H3 HIS 1 -3.255 5.640 1.212 4 HA HIS 1 HA HIS 1 -2.904 7.748 0.357 5 HB2 HIS 1 HB2 HIS 1 -0.435 8.336 -0.024 6 HB3 HIS 1 HB3 HIS 1 -1.196 8.785 1.349 7 HD1 HIS 1 HD1 HIS 1 -0.449 7.760 3.624 8 HD2 HIS 1 HD2 HIS 1 1.523 6.343 0.315 9 HE1 HIS 1 HE1 HIS 1 1.497 6.402 4.377 10 HE2 HIS 1 HE2 HIS 1 2.698 5.544 2.405 11 H GLY 2 H GLY 2 -0.317 5.421 -0.303 12 HA2 GLY 2 HA2 GLY 2 -0.443 4.026 -2.214 13 HA3 GLY 2 HA3 GLY 2 -1.428 5.097 -2.956 14 H PHE 3 H PHE 3 0.067 4.812 -4.794 15 HA PHE 3 HA PHE 3 2.567 6.172 -4.495 16 HB2 PHE 3 HB2 PHE 3 1.646 4.930 -6.935 17 HB3 PHE 3 HB3 PHE 3 3.199 5.189 -6.499 18 HD1 PHE 3 HD1 PHE 3 4.040 3.835 -4.412 19 HD2 PHE 3 HD2 PHE 3 0.742 2.797 -6.728 20 HE1 PHE 3 HE1 PHE 3 4.194 1.562 -3.608 21 HE2 PHE 3 HE2 PHE 3 0.885 0.525 -5.937 22 HZ PHE 3 HZ PHE 3 2.612 -0.095 -4.369 23 H ILE 4 H ILE 4 3.153 8.010 -5.827 24 HA ILE 4 HA ILE 4 0.851 9.422 -6.798 25 HB ILE 4 HB ILE 4 3.466 10.529 -6.128 26 HG12 ILE 4 HG12 ILE 4 1.021 10.779 -4.606 27 HG13 ILE 4 HG13 ILE 4 2.182 9.690 -4.241 28 HG21 ILE 4 HG21 ILE 4 2.463 12.715 -6.380 29 HG22 ILE 4 HG22 ILE 4 1.073 12.035 -6.848 30 HG23 ILE 4 HG23 ILE 4 2.385 11.919 -7.785 31 HD11 ILE 4 HD11 ILE 4 2.331 11.548 -2.827 32 HD12 ILE 4 HD12 ILE 4 2.513 12.527 -4.101 33 HD13 ILE 4 HD13 ILE 4 3.662 11.449 -3.739 34 H GLU 5 H GLU 5 0.456 9.750 -8.916 35 HA GLU 5 HA GLU 5 2.589 9.086 -10.736 36 HB2 GLU 5 HB2 GLU 5 0.461 7.900 -10.927 37 HB3 GLU 5 HB3 GLU 5 -0.245 9.316 -11.328 38 HG2 GLU 5 HG2 GLU 5 0.089 8.093 -13.275 39 HG3 GLU 5 HG3 GLU 5 1.093 9.381 -13.307 40 H LYS 6 H LYS 6 0.403 11.602 -9.895 41 HA LYS 6 HA LYS 6 1.834 13.502 -11.532 42 HB2 LYS 6 HB2 LYS 6 0.009 12.524 -12.865 43 HB3 LYS 6 HB3 LYS 6 -1.025 13.232 -11.818 44 HG2 LYS 6 HG2 LYS 6 -0.580 15.301 -12.606 45 HG3 LYS 6 HG3 LYS 6 0.804 14.820 -13.326 46 HD2 LYS 6 HD2 LYS 6 -0.788 15.145 -15.011 47 HD3 LYS 6 HD3 LYS 6 -0.516 13.539 -14.893 48 HE2 LYS 6 HE2 LYS 6 -2.523 13.332 -13.583 49 HE3 LYS 6 HE3 LYS 6 -2.811 14.923 -13.820 50 HZ1 LYS 6 HZ1 LYS 6 -4.063 13.628 -15.363 51 HZ2 LYS 6 HZ2 LYS 6 -2.701 12.960 -15.924 52 HZ3 LYS 6 HZ3 LYS 6 -2.986 14.535 -16.158 53 HA PRO 7 HA PRO 7 1.794 15.885 -11.794 54 HB2 PRO 7 HB2 PRO 7 3.003 17.964 -10.527 55 HB3 PRO 7 HB3 PRO 7 1.396 18.049 -10.802 56 HG2 PRO 7 HG2 PRO 7 2.714 17.168 -8.435 57 HG3 PRO 7 HG3 PRO 7 1.495 18.248 -8.557 58 HD2 PRO 7 HD2 PRO 7 0.966 15.788 -7.944 59 HD3 PRO 7 HD3 PRO 7 -0.067 16.621 -8.895 60 H GLY 8 H GLY 8 3.473 15.573 -12.932 61 HA2 GLY 8 HA2 GLY 8 5.704 15.601 -13.298 62 HA3 GLY 8 HA3 GLY 8 6.003 15.758 -11.700 63 H SER 9 H SER 9 7.096 14.116 -13.984 64 HA SER 9 HA SER 9 6.637 11.476 -13.180 65 HB2 SER 9 HB2 SER 9 7.272 11.880 -15.459 66 HB3 SER 9 HB3 SER 9 8.693 12.523 -14.973 67 HG SER 9 HG SER 9 7.914 9.891 -14.876 68 H ARG 10 H ARG 10 7.974 9.964 -12.142 69 HA ARG 10 HA ARG 10 9.603 10.990 -10.160 70 HB2 ARG 10 HB2 ARG 10 9.404 8.259 -11.144 71 HB3 ARG 10 HB3 ARG 10 10.183 8.635 -9.759 72 HG2 ARG 10 HG2 ARG 10 8.145 9.277 -8.759 73 HG3 ARG 10 HG3 ARG 10 7.349 8.982 -10.154 74 HD2 ARG 10 HD2 ARG 10 7.040 7.132 -8.702 75 HD3 ARG 10 HD3 ARG 10 7.958 6.649 -9.964 76 HE ARG 10 HE ARG 10 9.642 7.490 -7.933 77 HH11 ARG 10 HH11 ARG 10 10.741 6.074 -6.691 78 HH12 ARG 10 HH12 ARG 10 10.235 4.423 -6.554 79 HH21 ARG 10 HH21 ARG 10 7.533 4.755 -8.657 80 HH22 ARG 10 HH22 ARG 10 8.447 3.685 -7.648 81 H ALA 11 H ALA 11 10.284 9.677 -13.256 82 HA ALA 11 HA ALA 11 12.955 9.197 -12.884 83 HB1 ALA 11 HB1 ALA 11 11.677 8.265 -14.760 84 HB2 ALA 11 HB2 ALA 11 13.030 8.951 -15.320 85 HB3 ALA 11 HB3 ALA 11 11.619 9.731 -15.440 86 H ALA 12 H ALA 12 11.447 12.150 -13.439 87 HA ALA 12 HA ALA 12 13.500 13.484 -14.660 88 HB1 ALA 12 HB1 ALA 12 11.255 14.417 -14.477 89 HB2 ALA 12 HB2 ALA 12 12.327 15.511 -13.957 90 HB3 ALA 12 HB3 ALA 12 11.475 14.643 -12.891 91 H LEU 13 H LEU 13 13.152 12.616 -11.387 92 HA LEU 13 HA LEU 13 15.178 14.422 -10.564 93 HB2 LEU 13 HB2 LEU 13 13.482 12.620 -9.085 94 HB3 LEU 13 HB3 LEU 13 14.745 13.328 -8.330 95 HG LEU 13 HG LEU 13 13.639 15.461 -9.017 96 HD11 LEU 13 HD11 LEU 13 11.261 15.396 -9.128 97 HD12 LEU 13 HD12 LEU 13 11.299 13.780 -9.128 98 HD13 LEU 13 HD13 LEU 13 11.907 14.603 -10.380 99 HD21 LEU 13 HD21 LEU 13 12.410 15.426 -6.913 100 HD22 LEU 13 HD22 LEU 13 13.863 14.742 -6.717 101 HD23 LEU 13 HD23 LEU 13 12.546 13.815 -6.871 102 H CYS 14 H CYS 14 15.117 11.407 -11.811 103 HA CYS 14 HA CYS 14 17.123 10.259 -10.208 104 HB2 CYS 14 HB2 CYS 14 15.450 9.009 -11.332 105 HB3 CYS 14 HB3 CYS 14 16.163 9.389 -12.752 106 H SER 15 H SER 15 17.146 12.369 -12.796 107 HA SER 15 HA SER 15 19.648 11.607 -13.826 108 HB2 SER 15 HB2 SER 15 18.106 12.792 -15.238 109 HB3 SER 15 HB3 SER 15 18.203 14.098 -14.261 110 HG SER 15 HG SER 15 20.559 13.880 -14.800 111 H GLU 16 H GLU 16 21.718 12.493 -13.494 112 HA GLU 16 HA GLU 16 22.216 13.685 -11.053 113 HB2 GLU 16 HB2 GLU 16 23.887 13.598 -13.410 114 HB3 GLU 16 HB3 GLU 16 24.440 14.111 -11.961 115 HG2 GLU 16 HG2 GLU 16 24.211 11.987 -11.051 116 HG3 GLU 16 HG3 GLU 16 23.437 11.449 -12.385 117 H ALA 17 H ALA 17 21.238 14.957 -14.013 118 HA ALA 17 HA ALA 17 22.028 17.562 -13.767 119 HB1 ALA 17 HB1 ALA 17 21.093 16.661 -15.826 120 HB2 ALA 17 HB2 ALA 17 20.316 18.026 -15.440 121 HB3 ALA 17 HB3 ALA 17 19.633 16.592 -15.134 122 H PHE 18 H PHE 18 19.852 15.963 -11.842 123 HA PHE 18 HA PHE 18 18.210 18.166 -11.241 124 HB2 PHE 18 HB2 PHE 18 17.397 15.906 -11.020 125 HB3 PHE 18 HB3 PHE 18 18.473 15.641 -9.820 126 HD1 PHE 18 HD1 PHE 18 15.693 17.873 -10.572 127 HD2 PHE 18 HD2 PHE 18 17.731 15.770 -7.617 128 HE1 PHE 18 HE1 PHE 18 14.080 18.620 -8.938 129 HE2 PHE 18 HE2 PHE 18 16.126 16.502 -5.976 130 HZ PHE 18 HZ PHE 18 14.307 17.949 -6.629 131 H GLY 19 H GLY 19 21.333 17.395 -10.306 132 HA2 GLY 19 HA2 GLY 19 21.425 19.632 -8.692 133 HA3 GLY 19 HA3 GLY 19 21.332 18.316 -7.729 134 H PHE 20 H PHE 20 23.156 17.222 -10.093 135 HA PHE 20 HA PHE 20 25.245 16.861 -10.375 136 HB2 PHE 20 HB2 PHE 20 25.365 19.257 -10.869 137 HB3 PHE 20 HB3 PHE 20 25.835 19.528 -9.329 138 HD1 PHE 20 HD1 PHE 20 26.917 17.807 -12.335 139 HD2 PHE 20 HD2 PHE 20 28.115 19.652 -8.805 140 HE1 PHE 20 HE1 PHE 20 29.224 17.579 -13.009 141 HE2 PHE 20 HE2 PHE 20 30.426 19.435 -9.465 142 HZ PHE 20 HZ PHE 20 30.983 18.391 -11.572 143 H LEU 21 H LEU 21 24.952 18.012 -7.146 144 HA LEU 21 HA LEU 21 27.188 16.385 -6.376 145 HB2 LEU 21 HB2 LEU 21 25.821 18.417 -4.832 146 HB3 LEU 21 HB3 LEU 21 27.147 17.619 -4.310 147 HG LEU 21 HG LEU 21 27.163 19.439 -6.542 148 HD11 LEU 21 HD11 LEU 21 28.277 20.984 -5.050 149 HD12 LEU 21 HD12 LEU 21 28.099 19.934 -3.833 150 HD13 LEU 21 HD13 LEU 21 26.800 20.640 -4.488 151 HD21 LEU 21 HD21 LEU 21 29.555 19.311 -6.422 152 HD22 LEU 21 HD22 LEU 21 28.934 17.848 -6.720 153 HD23 LEU 21 HD23 LEU 21 29.442 18.222 -5.231 154 H ASN 22 H ASN 22 24.057 16.035 -6.729 155 HA ASN 22 HA ASN 22 23.400 14.732 -4.312 156 HB2 ASN 22 HB2 ASN 22 21.971 15.065 -6.804 157 HB3 ASN 22 HB3 ASN 22 21.358 14.086 -5.650 158 HD21 ASN 22 HD21 ASN 22 19.980 17.553 -5.480 159 HD22 ASN 22 HD22 ASN 22 20.287 16.510 -6.828 160 H LEU 23 H LEU 23 22.295 12.419 -4.545 161 HA LEU 23 HA LEU 23 24.250 10.641 -5.500 162 HB2 LEU 23 HB2 LEU 23 21.630 10.251 -4.419 163 HB3 LEU 23 HB3 LEU 23 22.410 8.982 -5.090 164 HG LEU 23 HG LEU 23 24.122 9.255 -3.413 165 HD11 LEU 23 HD11 LEU 23 23.657 10.482 -1.429 166 HD12 LEU 23 HD12 LEU 23 22.313 11.076 -2.105 167 HD13 LEU 23 HD13 LEU 23 23.763 11.476 -2.701 168 HD21 LEU 23 HD21 LEU 23 22.761 8.162 -1.691 169 HD22 LEU 23 HD22 LEU 23 22.371 7.580 -3.148 170 HD23 LEU 23 HD23 LEU 23 21.421 8.678 -2.436 171 H ASN 24 H ASN 24 23.873 9.020 -7.230 172 HA ASN 24 HA ASN 24 23.042 10.336 -9.493 173 HB2 ASN 24 HB2 ASN 24 23.861 7.535 -9.169 174 HB3 ASN 24 HB3 ASN 24 23.691 8.205 -10.649 175 HD21 ASN 24 HD21 ASN 24 27.162 8.521 -10.508 176 HD22 ASN 24 HD22 ASN 24 25.833 7.634 -11.177 177 H CYS 25 H CYS 25 20.903 9.380 -7.573 178 HA CYS 25 HA CYS 25 18.887 9.367 -9.417 179 HB2 CYS 25 HB2 CYS 25 19.615 7.066 -9.638 180 HB3 CYS 25 HB3 CYS 25 19.004 6.821 -8.144 181 H GLY 26 H GLY 26 19.986 8.556 -6.275 182 HA2 GLY 26 HA2 GLY 26 19.153 9.538 -4.334 183 HA3 GLY 26 HA3 GLY 26 17.720 9.839 -5.058 184 H SER 27 H SER 27 18.718 8.355 -2.539 185 HA SER 27 HA SER 27 18.002 5.702 -2.927 186 HB2 SER 27 HB2 SER 27 19.425 6.482 -1.069 187 HB3 SER 27 HB3 SER 27 18.092 7.097 -0.353 188 HG SER 27 HG SER 27 18.127 5.262 0.602 189 H VAL 28 H VAL 28 16.166 8.421 -2.130 190 HA VAL 28 HA VAL 28 14.044 7.255 -0.890 191 HB VAL 28 HB VAL 28 14.529 9.716 -1.102 192 HG11 VAL 28 HG11 VAL 28 13.586 10.910 -2.971 193 HG12 VAL 28 HG12 VAL 28 13.135 9.509 -3.641 194 HG13 VAL 28 HG13 VAL 28 14.706 9.862 -3.485 195 HG21 VAL 28 HG21 VAL 28 12.275 10.473 -0.872 196 HG22 VAL 28 HG22 VAL 28 12.516 9.133 0.000 197 HG23 VAL 28 HG23 VAL 28 11.738 9.047 -1.415 198 H MET 29 H MET 29 14.792 6.867 -4.116 199 HA MET 29 HA MET 29 12.225 6.515 -5.032 200 HB2 MET 29 HB2 MET 29 13.179 5.575 -6.987 201 HB3 MET 29 HB3 MET 29 14.180 6.765 -6.487 202 HG2 MET 29 HG2 MET 29 15.659 5.264 -5.631 203 HG3 MET 29 HG3 MET 29 14.616 4.028 -5.862 204 HE1 MET 29 HE1 MET 29 17.538 3.351 -8.399 205 HE2 MET 29 HE2 MET 29 16.767 2.730 -7.120 206 HE3 MET 29 HE3 MET 29 17.695 4.043 -6.946 207 H TYR 30 H TYR 30 13.914 4.576 -2.937 208 HA TYR 30 HA TYR 30 13.015 2.100 -3.924 209 HB2 TYR 30 HB2 TYR 30 15.059 2.230 -2.686 210 HB3 TYR 30 HB3 TYR 30 14.252 2.788 -1.380 211 HD1 TYR 30 HD1 TYR 30 14.541 -0.199 -3.452 212 HD2 TYR 30 HD2 TYR 30 13.569 1.291 0.310 213 HE1 TYR 30 HE1 TYR 30 14.306 -2.456 -2.611 214 HE2 TYR 30 HE2 TYR 30 13.330 -0.959 1.140 215 HH TYR 30 HH TYR 30 13.635 -3.141 0.772 216 H GLU 31 H GLU 31 11.978 4.206 -1.359 217 HA GLU 31 HA GLU 31 9.481 2.916 -1.439 218 HB2 GLU 31 HB2 GLU 31 9.375 2.523 0.974 219 HB3 GLU 31 HB3 GLU 31 10.457 1.572 0.205 220 HG2 GLU 31 HG2 GLU 31 12.207 3.052 0.988 221 HG3 GLU 31 HG3 GLU 31 11.082 3.827 1.883 222 HA PRO 32 HA PRO 32 9.122 7.312 -0.568 223 HB2 PRO 32 HB2 PRO 32 7.778 8.147 -2.720 224 HB3 PRO 32 HB3 PRO 32 9.396 7.954 -2.839 225 HG2 PRO 32 HG2 PRO 32 7.364 6.084 -3.581 226 HG3 PRO 32 HG3 PRO 32 8.627 6.590 -4.485 227 HD2 PRO 32 HD2 PRO 32 8.815 4.352 -3.196 228 HD3 PRO 32 HD3 PRO 32 10.127 5.319 -3.305 229 H GLN 33 H GLN 33 6.994 4.852 -0.992 230 HA GLN 33 HA GLN 33 4.853 6.411 0.037 231 HB2 GLN 33 HB2 GLN 33 3.409 4.608 -0.484 232 HB3 GLN 33 HB3 GLN 33 4.365 4.889 -1.778 233 HG2 GLN 33 HG2 GLN 33 4.904 2.759 0.089 234 HG3 GLN 33 HG3 GLN 33 4.026 2.528 -1.269 235 HE21 GLN 33 HE21 GLN 33 7.727 1.742 -1.591 236 HE22 GLN 33 HE22 GLN 33 6.647 1.483 -0.261 237 H SER 34 H SER 34 7.328 4.884 1.398 238 HA SER 34 HA SER 34 5.899 3.590 3.522 239 HB2 SER 34 HB2 SER 34 8.002 2.686 2.703 240 HB3 SER 34 HB3 SER 34 8.761 3.989 3.332 241 HG SER 34 HG SER 34 8.100 3.367 5.365 242 H LEU 35 H LEU 35 4.751 5.137 4.604 243 HA LEU 35 HA LEU 35 6.298 7.223 5.889 244 HB2 LEU 35 HB2 LEU 35 3.643 7.574 4.813 245 HB3 LEU 35 HB3 LEU 35 4.535 8.745 5.522 246 HG LEU 35 HG LEU 35 5.293 7.534 3.020 247 HD11 LEU 35 HD11 LEU 35 4.403 9.490 1.952 248 HD12 LEU 35 HD12 LEU 35 3.862 10.024 3.379 249 HD13 LEU 35 HD13 LEU 35 3.225 8.692 2.720 250 HD21 LEU 35 HD21 LEU 35 6.761 9.391 2.771 251 HD22 LEU 35 HD22 LEU 35 7.127 8.567 4.114 252 HD23 LEU 35 HD23 LEU 35 6.305 9.956 4.216 253 H GLU 36 H GLU 36 5.999 7.338 8.122 254 HA GLU 36 HA GLU 36 3.581 6.084 9.078 255 HB2 GLU 36 HB2 GLU 36 6.206 5.816 10.215 256 HB3 GLU 36 HB3 GLU 36 4.878 5.503 11.112 257 HG2 GLU 36 HG2 GLU 36 5.649 4.075 8.735 258 HG3 GLU 36 HG3 GLU 36 5.736 3.489 10.257 259 H ALA 37 H ALA 37 2.298 7.212 10.425 260 HA ALA 37 HA ALA 37 3.381 9.547 11.675 261 HB1 ALA 37 HB1 ALA 37 2.497 10.367 9.622 262 HB2 ALA 37 HB2 ALA 37 1.638 10.961 10.857 263 HB3 ALA 37 HB3 ALA 37 1.051 9.737 9.978 264 H LYS 38 H LYS 38 1.875 10.551 13.280 265 HA LYS 38 HA LYS 38 0.926 8.524 14.960 266 HB2 LYS 38 HB2 LYS 38 0.776 11.423 15.223 267 HB3 LYS 38 HB3 LYS 38 0.464 10.404 16.460 268 HG2 LYS 38 HG2 LYS 38 2.685 9.783 16.628 269 HG3 LYS 38 HG3 LYS 38 3.052 10.469 15.192 270 HD2 LYS 38 HD2 LYS 38 2.632 12.616 16.156 271 HD3 LYS 38 HD3 LYS 38 2.387 11.889 17.598 272 HE2 LYS 38 HE2 LYS 38 4.615 11.155 17.661 273 HE3 LYS 38 HE3 LYS 38 4.876 11.711 16.147 274 HZ1 LYS 38 HZ1 LYS 38 5.790 13.216 17.740 275 HZ2 LYS 38 HZ2 LYS 38 4.336 13.391 18.426 276 HZ3 LYS 38 HZ3 LYS 38 4.595 13.941 16.928 277 H LYS 39 H LYS 39 -1.181 8.906 16.287 278 HA LYS 39 HA LYS 39 -3.286 8.314 14.701 279 HB2 LYS 39 HB2 LYS 39 -4.657 8.628 16.650 280 HB3 LYS 39 HB3 LYS 39 -3.249 7.925 17.086 281 HG2 LYS 39 HG2 LYS 39 -3.201 9.448 18.669 282 HG3 LYS 39 HG3 LYS 39 -2.695 10.461 17.492 283 HD2 LYS 39 HD2 LYS 39 -5.067 10.996 17.111 284 HD3 LYS 39 HD3 LYS 39 -5.378 10.213 18.510 285 HE2 LYS 39 HE2 LYS 39 -3.985 11.745 19.678 286 HE3 LYS 39 HE3 LYS 39 -3.673 12.528 18.279 287 HZ1 LYS 39 HZ1 LYS 39 -5.328 13.690 19.513 288 HZ2 LYS 39 HZ2 LYS 39 -6.270 12.376 19.511 289 HZ3 LYS 39 HZ3 LYS 39 -5.960 13.151 18.126 290 H GLY 40 H GLY 40 -5.076 9.229 13.789 291 HA2 GLY 40 HA2 GLY 40 -4.920 12.111 13.542 292 HA3 GLY 40 HA3 GLY 40 -5.418 11.126 12.339 293 H PHE 41 H PHE 41 -6.511 10.333 15.410 294 HA PHE 41 HA PHE 41 -9.178 11.050 14.687 295 HB2 PHE 41 HB2 PHE 41 -8.262 9.647 17.048 296 HB3 PHE 41 HB3 PHE 41 -9.825 9.763 16.590 297 HD1 PHE 41 HD1 PHE 41 -6.746 8.065 15.980 298 HD2 PHE 41 HD2 PHE 41 -10.706 8.396 14.750 299 HE1 PHE 41 HE1 PHE 41 -6.514 6.027 14.717 300 HE2 PHE 41 HE2 PHE 41 -10.486 6.341 13.491 301 HZ PHE 41 HZ PHE 41 -8.377 5.159 13.474 302 HA PRO 42 HA PRO 42 -11.101 12.131 15.156 303 HB2 PRO 42 HB2 PRO 42 -12.340 14.482 15.289 304 HB3 PRO 42 HB3 PRO 42 -12.348 13.538 16.621 305 HG2 PRO 42 HG2 PRO 42 -10.601 15.710 16.029 306 HG3 PRO 42 HG3 PRO 42 -11.404 15.422 17.422 307 HD2 PRO 42 HD2 PRO 42 -8.883 14.729 17.150 308 HD3 PRO 42 HD3 PRO 42 -9.889 13.871 18.109 309 H HIS 43 H HIS 43 -11.700 12.288 13.066 310 HA HIS 43 HA HIS 43 -9.678 13.257 11.438 311 HB2 HIS 43 HB2 HIS 43 -12.338 12.371 10.622 312 HB3 HIS 43 HB3 HIS 43 -11.044 12.412 9.626 313 HD1 HIS 43 HD1 HIS 43 -12.736 9.810 10.177 314 HD2 HIS 43 HD2 HIS 43 -9.149 10.796 11.903 315 HE1 HIS 43 HE1 HIS 43 -11.680 7.733 11.062 316 HE2 HIS 43 HE2 HIS 43 -9.514 8.306 12.094 317 H SER 44 H SER 44 -12.265 14.861 12.675 318 HA SER 44 HA SER 44 -12.559 16.735 10.590 319 HB2 SER 44 HB2 SER 44 -14.347 16.133 12.237 320 HB3 SER 44 HB3 SER 44 -13.560 17.082 13.308 321 HG SER 44 HG SER 44 -13.816 18.783 11.752 322 H GLY 45 H GLY 45 -10.308 16.336 12.977 323 HA2 GLY 45 HA2 GLY 45 -9.871 19.112 13.444 324 HA3 GLY 45 HA3 GLY 45 -9.099 17.875 14.179 325 HA PRO 46 HA PRO 46 -6.167 19.632 11.105 326 HB2 PRO 46 HB2 PRO 46 -4.511 20.943 12.660 327 HB3 PRO 46 HB3 PRO 46 -5.927 21.672 12.300 328 HG2 PRO 46 HG2 PRO 46 -5.282 20.176 14.639 329 HG3 PRO 46 HG3 PRO 46 -5.968 21.655 14.559 330 HD2 PRO 46 HD2 PRO 46 -7.453 19.512 14.863 331 HD3 PRO 46 HD3 PRO 46 -8.020 20.802 14.037 332 H ALA 47 H ALA 47 -3.578 19.383 11.301 333 HA ALA 47 HA ALA 47 -3.178 16.687 11.707 334 HB1 ALA 47 HB1 ALA 47 -1.732 17.966 10.272 335 HB2 ALA 47 HB2 ALA 47 -0.834 17.170 11.356 336 HB3 ALA 47 HB3 ALA 47 -1.131 18.747 11.555 337 H ASP 48 H ASP 48 -2.853 15.440 13.468 338 HA ASP 48 HA ASP 48 -2.577 16.835 15.965 339 HB2 ASP 48 HB2 ASP 48 -4.385 15.088 15.340 340 HB3 ASP 48 HB3 ASP 48 -3.265 14.058 15.934 341 H GLY 49 H GLY 49 -1.584 15.235 17.783 342 HA2 GLY 49 HA2 GLY 49 0.242 14.055 18.428 343 HA3 GLY 49 HA3 GLY 49 0.660 13.794 16.871 344 H GLN 50 H GLN 50 0.155 16.972 17.274 345 HA GLN 50 HA GLN 50 2.873 17.600 17.890 346 HB2 GLN 50 HB2 GLN 50 3.079 18.865 15.818 347 HB3 GLN 50 HB3 GLN 50 2.797 17.289 15.495 348 HG2 GLN 50 HG2 GLN 50 0.414 17.914 15.268 349 HG3 GLN 50 HG3 GLN 50 0.924 19.465 15.245 350 HE21 GLN 50 HE21 GLN 50 1.457 17.101 12.056 351 HE22 GLN 50 HE22 GLN 50 0.960 16.467 13.589 352 H ILE 51 H ILE 51 -0.079 18.174 18.643 353 HA ILE 51 HA ILE 51 -0.517 20.807 18.139 354 HB ILE 51 HB ILE 51 -1.647 19.236 20.364 355 HG12 ILE 51 HG12 ILE 51 -2.063 18.153 18.305 356 HG13 ILE 51 HG13 ILE 51 -3.466 18.666 18.966 357 HG21 ILE 51 HG21 ILE 51 -3.542 20.734 20.391 358 HG22 ILE 51 HG22 ILE 51 -2.844 21.642 19.250 359 HG23 ILE 51 HG23 ILE 51 -2.184 21.547 20.723 360 HD11 ILE 51 HD11 ILE 51 -3.485 19.067 16.593 361 HD12 ILE 51 HD12 ILE 51 -2.153 19.974 16.720 362 HD13 ILE 51 HD13 ILE 51 -3.542 20.482 17.373 363 H ALA 52 H ALA 52 1.134 19.426 20.812 364 HA ALA 52 HA ALA 52 1.044 21.503 22.530 365 HB1 ALA 52 HB1 ALA 52 2.027 19.323 23.086 366 HB2 ALA 52 HB2 ALA 52 3.025 20.500 23.569 367 HB3 ALA 52 HB3 ALA 52 3.330 19.692 22.202 368 H SER 53 H SER 53 3.248 21.204 19.875 369 HA SER 53 HA SER 53 4.280 23.797 20.559 370 HB2 SER 53 HB2 SER 53 5.648 21.816 18.891 371 HB3 SER 53 HB3 SER 53 6.347 23.164 19.491 372 HG SER 53 HG SER 53 6.132 22.344 21.554 373 H ALA 54 H ALA 54 2.451 22.263 18.311 374 HA ALA 54 HA ALA 54 1.815 22.694 16.217 375 HB1 ALA 54 HB1 ALA 54 0.881 24.711 17.144 376 HB2 ALA 54 HB2 ALA 54 1.326 24.982 15.613 377 HB3 ALA 54 HB3 ALA 54 2.253 25.506 16.829 378 H GLY 55 H GLY 55 4.444 21.858 16.471 379 HA2 GLY 55 HA2 GLY 55 6.158 23.554 15.033 380 HA3 GLY 55 HA3 GLY 55 6.509 22.053 15.572 381 H GLY 56 H GLY 56 4.013 21.178 13.946 382 HA2 GLY 56 HA2 GLY 56 5.486 20.240 11.789 383 HA3 GLY 56 HA3 GLY 56 3.862 20.160 11.935 384 H LEU 57 H LEU 57 3.802 23.150 12.175 385 HA LEU 57 HA LEU 57 3.288 23.766 9.539 386 HB2 LEU 57 HB2 LEU 57 3.972 25.630 11.648 387 HB3 LEU 57 HB3 LEU 57 3.178 26.036 10.280 388 HG LEU 57 HG LEU 57 2.044 24.351 12.322 389 HD11 LEU 57 HD11 LEU 57 0.756 26.299 12.932 390 HD12 LEU 57 HD12 LEU 57 1.553 27.170 11.826 391 HD13 LEU 57 HD13 LEU 57 2.333 26.601 13.123 392 HD21 LEU 57 HD21 LEU 57 -0.030 24.651 11.223 393 HD22 LEU 57 HD22 LEU 57 1.027 23.930 10.236 394 HD23 LEU 57 HD23 LEU 57 0.698 25.503 10.058 395 H PHE 58 H PHE 58 6.043 24.426 11.532 396 HA PHE 58 HA PHE 58 7.538 25.511 9.380 397 HB2 PHE 58 HB2 PHE 58 8.436 24.928 12.069 398 HB3 PHE 58 HB3 PHE 58 9.223 25.890 11.010 399 HD1 PHE 58 HD1 PHE 58 6.845 25.829 13.566 400 HD2 PHE 58 HD2 PHE 58 8.092 28.066 10.289 401 HE1 PHE 58 HE1 PHE 58 5.635 27.727 14.415 402 HE2 PHE 58 HE2 PHE 58 6.867 29.973 11.119 403 HZ PHE 58 HZ PHE 58 5.631 29.806 13.183 404 H GLY 59 H GLY 59 6.903 22.495 10.536 405 HA2 GLY 59 HA2 GLY 59 9.299 21.191 10.237 406 HA3 GLY 59 HA3 GLY 59 7.828 20.492 10.117 407 H GLY 60 H GLY 60 6.921 21.997 7.830 408 HA2 GLY 60 HA2 GLY 60 8.004 20.440 5.800 409 HA3 GLY 60 HA3 GLY 60 7.054 21.751 5.582 410 H ILE 61 H ILE 61 8.868 23.567 6.954 411 HA ILE 61 HA ILE 61 10.455 24.269 4.785 412 HB ILE 61 HB ILE 61 10.728 25.277 7.516 413 HG12 ILE 61 HG12 ILE 61 8.532 25.649 6.794 414 HG13 ILE 61 HG13 ILE 61 9.320 27.073 6.928 415 HG21 ILE 61 HG21 ILE 61 11.802 27.218 6.556 416 HG22 ILE 61 HG22 ILE 61 11.699 26.551 5.086 417 HG23 ILE 61 HG23 ILE 61 12.651 25.886 6.211 418 HD11 ILE 61 HD11 ILE 61 7.955 27.079 4.947 419 HD12 ILE 61 HD12 ILE 61 8.732 25.775 4.389 420 HD13 ILE 61 HD13 ILE 61 9.512 27.185 4.523 421 H LEU 62 H LEU 62 11.080 22.781 7.851 422 HA LEU 62 HA LEU 62 13.814 22.529 7.530 423 HB2 LEU 62 HB2 LEU 62 11.914 21.427 9.339 424 HB3 LEU 62 HB3 LEU 62 13.344 20.643 9.260 425 HG LEU 62 HG LEU 62 14.428 22.683 9.918 426 HD11 LEU 62 HD11 LEU 62 13.170 24.459 10.897 427 HD12 LEU 62 HD12 LEU 62 11.794 23.739 10.444 428 HD13 LEU 62 HD13 LEU 62 12.814 24.310 9.327 429 HD21 LEU 62 HD21 LEU 62 13.787 22.462 12.263 430 HD22 LEU 62 HD22 LEU 62 13.929 21.000 11.588 431 HD23 LEU 62 HD23 LEU 62 12.465 21.646 11.816 432 H ASP 63 H ASP 63 11.173 20.506 6.635 433 HA ASP 63 HA ASP 63 12.679 18.251 6.165 434 HB2 ASP 63 HB2 ASP 63 10.250 18.256 6.385 435 HB3 ASP 63 HB3 ASP 63 10.165 18.820 4.855 436 H GLN 64 H GLN 64 11.985 20.945 4.142 437 HA GLN 64 HA GLN 64 12.849 19.769 1.782 438 HB2 GLN 64 HB2 GLN 64 12.558 22.541 2.510 439 HB3 GLN 64 HB3 GLN 64 13.117 22.139 1.029 440 HG2 GLN 64 HG2 GLN 64 11.090 20.963 0.602 441 HG3 GLN 64 HG3 GLN 64 10.530 21.421 2.066 442 HE21 GLN 64 HE21 GLN 64 8.812 23.903 0.346 443 HE22 GLN 64 HE22 GLN 64 8.690 22.409 1.214 444 H GLN 65 H GLN 65 14.610 20.504 4.430 445 HA GLN 65 HA GLN 65 17.057 20.255 2.924 446 HB2 GLN 65 HB2 GLN 65 18.172 21.646 4.553 447 HB3 GLN 65 HB3 GLN 65 17.093 22.454 3.630 448 HG2 GLN 65 HG2 GLN 65 15.558 22.480 5.404 449 HG3 GLN 65 HG3 GLN 65 16.583 21.605 6.326 450 HE21 GLN 65 HE21 GLN 65 18.064 24.354 7.713 451 HE22 GLN 65 HE22 GLN 65 17.543 22.711 7.877 452 H SER 66 H SER 66 15.516 18.167 3.902 453 HA SER 66 HA SER 66 17.115 17.160 6.095 454 HB2 SER 66 HB2 SER 66 14.794 17.531 6.738 455 HB3 SER 66 HB3 SER 66 14.323 16.499 5.564 456 HG SER 66 HG SER 66 15.162 15.978 8.017 457 H GLU 67 H GLU 67 17.166 14.707 6.222 458 HA GLU 67 HA GLU 67 18.043 13.609 3.829 459 HB2 GLU 67 HB2 GLU 67 18.538 12.884 6.169 460 HB3 GLU 67 HB3 GLU 67 17.137 12.049 6.089 461 HG2 GLU 67 HG2 GLU 67 18.753 10.507 5.648 462 HG3 GLU 67 HG3 GLU 67 18.113 10.856 4.187 463 H ASN 68 H ASN 68 14.988 13.801 5.298 464 HA ASN 68 HA ASN 68 13.833 11.865 3.541 465 HB2 ASN 68 HB2 ASN 68 12.617 13.276 5.776 466 HB3 ASN 68 HB3 ASN 68 11.854 12.098 4.940 467 HD21 ASN 68 HD21 ASN 68 13.806 11.100 8.108 468 HD22 ASN 68 HD22 ASN 68 13.125 12.650 7.739 469 H ARG 69 H ARG 69 14.727 14.576 2.755 470 HA ARG 69 HA ARG 69 12.685 16.289 2.284 471 HB2 ARG 69 HB2 ARG 69 14.710 17.153 1.740 472 HB3 ARG 69 HB3 ARG 69 15.185 15.783 0.988 473 HG2 ARG 69 HG2 ARG 69 13.704 16.486 -0.865 474 HG3 ARG 69 HG3 ARG 69 13.685 17.951 -0.142 475 HD2 ARG 69 HD2 ARG 69 16.127 16.639 -0.929 476 HD3 ARG 69 HD3 ARG 69 15.384 17.755 -1.862 477 HE ARG 69 HE ARG 69 15.699 19.188 0.286 478 HH11 ARG 69 HH11 ARG 69 17.439 20.336 0.935 479 HH12 ARG 69 HH12 ARG 69 19.046 19.832 0.528 480 HH21 ARG 69 HH21 ARG 69 18.053 17.063 -1.261 481 HH22 ARG 69 HH22 ARG 69 19.390 18.008 -0.696 482 H TRP 70 H TRP 70 11.029 16.642 0.963 483 HA TRP 70 HA TRP 70 10.281 14.395 -0.591 484 HB2 TRP 70 HB2 TRP 70 8.899 16.724 0.347 485 HB3 TRP 70 HB3 TRP 70 8.261 15.978 -0.958 486 HD1 TRP 70 HD1 TRP 70 8.868 15.350 2.649 487 HE1 TRP 70 HE1 TRP 70 7.500 13.452 3.539 488 HE3 TRP 70 HE3 TRP 70 6.976 13.858 -1.727 489 HZ2 TRP 70 HZ2 TRP 70 5.776 11.553 2.375 490 HZ3 TRP 70 HZ3 TRP 70 5.494 11.941 -1.769 491 HH2 TRP 70 HH2 TRP 70 4.909 10.809 0.276 492 H PHE 71 H PHE 71 9.546 14.466 -2.788 493 HA PHE 71 HA PHE 71 11.361 15.816 -4.363 494 HB2 PHE 71 HB2 PHE 71 10.093 14.938 -6.237 495 HB3 PHE 71 HB3 PHE 71 10.429 13.781 -5.135 496 HD1 PHE 71 HD1 PHE 71 8.681 12.563 -4.040 497 HD2 PHE 71 HD2 PHE 71 7.765 15.884 -6.375 498 HE1 PHE 71 HE1 PHE 71 6.337 11.996 -3.927 499 HE2 PHE 71 HE2 PHE 71 5.419 15.341 -6.245 500 HZ PHE 71 HZ PHE 71 4.701 13.395 -5.018 501 H LYS 72 H LYS 72 11.220 17.586 -5.773 502 HA LYS 72 HA LYS 72 8.827 19.161 -5.441 503 HB2 LYS 72 HB2 LYS 72 11.522 20.074 -5.913 504 HB3 LYS 72 HB3 LYS 72 10.248 21.068 -6.146 505 HG2 LYS 72 HG2 LYS 72 9.676 20.711 -3.820 506 HG3 LYS 72 HG3 LYS 72 11.116 19.959 -3.654 507 HD2 LYS 72 HD2 LYS 72 11.473 22.118 -2.924 508 HD3 LYS 72 HD3 LYS 72 12.161 22.047 -4.404 509 HE2 LYS 72 HE2 LYS 72 10.264 23.128 -5.353 510 HE3 LYS 72 HE3 LYS 72 9.539 23.163 -3.890 511 HZ1 LYS 72 HZ1 LYS 72 10.477 25.279 -4.388 512 HZ2 LYS 72 HZ2 LYS 72 11.939 24.607 -4.549 513 HZ3 LYS 72 HZ3 LYS 72 11.220 24.642 -3.101 514 H HIS 73 H HIS 73 7.575 19.518 -7.229 515 HA HIS 73 HA HIS 73 8.902 19.212 -9.783 516 HB2 HIS 73 HB2 HIS 73 6.214 18.467 -9.125 517 HB3 HIS 73 HB3 HIS 73 6.679 18.671 -10.677 518 HD1 HIS 73 HD1 HIS 73 6.174 16.062 -8.395 519 HD2 HIS 73 HD2 HIS 73 9.088 16.887 -11.155 520 HE1 HIS 73 HE1 HIS 73 7.394 13.955 -8.914 521 HE2 HIS 73 HE2 HIS 73 9.146 14.426 -10.583 522 H ILE 74 H ILE 74 8.843 20.900 -11.207 523 HA ILE 74 HA ILE 74 7.544 23.280 -10.296 524 HB ILE 74 HB ILE 74 9.343 23.014 -12.575 525 HG12 ILE 74 HG12 ILE 74 9.991 24.142 -9.999 526 HG13 ILE 74 HG13 ILE 74 10.387 22.615 -10.421 527 HG21 ILE 74 HG21 ILE 74 9.434 25.441 -12.586 528 HG22 ILE 74 HG22 ILE 74 8.360 25.493 -11.377 529 HG23 ILE 74 HG23 ILE 74 7.912 24.955 -12.835 530 HD11 ILE 74 HD11 ILE 74 12.290 24.052 -10.671 531 HD12 ILE 74 HD12 ILE 74 11.467 24.987 -11.702 532 HD13 ILE 74 HD13 ILE 74 11.859 23.475 -12.119 533 H MET 75 H MET 75 5.714 24.164 -11.301 534 HA MET 75 HA MET 75 4.814 23.086 -13.807 535 HB2 MET 75 HB2 MET 75 3.934 21.653 -11.993 536 HB3 MET 75 HB3 MET 75 3.011 22.934 -11.574 537 HG2 MET 75 HG2 MET 75 1.937 22.869 -13.609 538 HG3 MET 75 HG3 MET 75 2.906 21.652 -14.107 539 HE1 MET 75 HE1 MET 75 -0.557 19.884 -13.786 540 HE2 MET 75 HE2 MET 75 0.662 20.190 -14.803 541 HE3 MET 75 HE3 MET 75 -0.289 21.395 -14.295 542 H THR 76 H THR 76 2.852 24.428 -14.586 543 HA THR 76 HA THR 76 3.166 27.128 -13.693 544 HB THR 76 HB THR 76 1.473 27.558 -15.484 545 HG1 THR 76 HG1 THR 76 0.496 25.873 -16.151 546 HG21 THR 76 HG21 THR 76 3.062 27.277 -17.257 547 HG22 THR 76 HG22 THR 76 3.937 26.274 -16.338 548 HG23 THR 76 HG23 THR 76 3.840 27.842 -15.957 549 H GLY 77 H GLY 77 1.026 28.383 -13.177 550 HA2 GLY 77 HA2 GLY 77 -0.369 26.972 -11.199 551 HA3 GLY 77 HA3 GLY 77 -0.665 28.503 -11.684 552 H GLY 78 H GLY 78 -2.961 27.897 -11.262 553 HA2 GLY 78 HA2 GLY 78 -4.884 27.749 -12.572 554 HA3 GLY 78 HA3 GLY 78 -4.088 26.880 -13.704 555 H GLU 79 H GLU 79 -6.336 25.720 -13.408 556 HA GLU 79 HA GLU 79 -6.525 24.114 -11.160 557 HB2 GLU 79 HB2 GLU 79 -8.395 24.596 -12.654 558 HB3 GLU 79 HB3 GLU 79 -7.778 23.491 -13.686 559 HG2 GLU 79 HG2 GLU 79 -7.973 21.903 -11.773 560 HG3 GLU 79 HG3 GLU 79 -8.987 23.013 -11.134 561 H HIS 80 H HIS 80 -5.706 22.088 -10.666 562 HA HIS 80 HA HIS 80 -4.298 20.736 -12.800 563 HB2 HIS 80 HB2 HIS 80 -3.423 20.881 -10.046 564 HB3 HIS 80 HB3 HIS 80 -2.644 20.052 -11.217 565 HD1 HIS 80 HD1 HIS 80 -1.329 22.369 -9.510 566 HD2 HIS 80 HD2 HIS 80 -2.822 22.681 -13.314 567 HE1 HIS 80 HE1 HIS 80 -0.330 24.368 -10.599 568 HE2 HIS 80 HE2 HIS 80 -1.205 24.561 -12.893 569 H THR 81 H THR 81 -4.176 18.396 -12.634 570 HA THR 81 HA THR 81 -6.279 17.342 -10.935 571 HB THR 81 HB THR 81 -5.477 16.176 -13.460 572 HG1 THR 81 HG1 THR 81 -6.616 18.207 -13.590 573 HG21 THR 81 HG21 THR 81 -7.427 14.808 -13.198 574 HG22 THR 81 HG22 THR 81 -7.759 15.521 -11.785 575 HG23 THR 81 HG23 THR 81 -6.457 14.572 -11.926 576 H PHE 82 H PHE 82 -5.453 16.269 -9.228 577 HA PHE 82 HA PHE 82 -2.712 15.395 -9.348 578 HB2 PHE 82 HB2 PHE 82 -4.546 15.691 -7.152 579 HB3 PHE 82 HB3 PHE 82 -3.086 14.986 -6.955 580 HD1 PHE 82 HD1 PHE 82 -1.209 16.284 -6.422 581 HD2 PHE 82 HD2 PHE 82 -4.579 18.140 -8.009 582 HE1 PHE 82 HE1 PHE 82 -0.180 18.436 -6.072 583 HE2 PHE 82 HE2 PHE 82 -3.558 20.299 -7.663 584 HZ PHE 82 HZ PHE 82 -1.359 20.451 -6.690 585 H THR 83 H THR 83 -2.109 13.212 -9.333 586 HA THR 83 HA THR 83 -4.316 11.376 -9.321 587 HB THR 83 HB THR 83 -2.095 11.195 -11.219 588 HG1 THR 83 HG1 THR 83 -3.932 11.581 -12.721 589 HG21 THR 83 HG21 THR 83 -3.344 9.452 -12.278 590 HG22 THR 83 HG22 THR 83 -4.511 9.588 -11.167 591 HG23 THR 83 HG23 THR 83 -3.055 9.024 -10.746 592 H TRP 84 H TRP 84 -4.192 10.018 -7.709 593 HA TRP 84 HA TRP 84 -1.587 8.969 -6.967 594 HB2 TRP 84 HB2 TRP 84 -3.823 9.501 -5.242 595 HB3 TRP 84 HB3 TRP 84 -2.532 8.619 -4.769 596 HD1 TRP 84 HD1 TRP 84 -1.621 11.649 -6.647 597 HE1 TRP 84 HE1 TRP 84 -0.649 13.464 -5.225 598 HE3 TRP 84 HE3 TRP 84 -2.661 9.590 -2.204 599 HZ2 TRP 84 HZ2 TRP 84 -0.359 13.865 -2.454 600 HZ3 TRP 84 HZ3 TRP 84 -1.978 10.756 -0.190 601 HH2 TRP 84 HH2 TRP 84 -0.815 12.866 -0.333 602 H THR 85 H THR 85 -1.561 6.619 -6.730 603 HA THR 85 HA THR 85 -4.057 5.287 -7.096 604 HB THR 85 HB THR 85 -3.196 5.511 -9.379 605 HG1 THR 85 HG1 THR 85 -4.486 3.799 -9.121 606 HG21 THR 85 HG21 THR 85 -1.219 4.322 -10.026 607 HG22 THR 85 HG22 THR 85 -0.977 3.852 -8.498 608 HG23 THR 85 HG23 THR 85 -0.821 5.411 -8.899 609 H TYR 86 H TYR 86 -4.055 2.982 -6.461 610 HA TYR 86 HA TYR 86 -1.550 2.084 -5.337 611 HB2 TYR 86 HB2 TYR 86 -2.886 2.971 -3.528 612 HB3 TYR 86 HB3 TYR 86 -3.948 1.761 -3.806 613 HD1 TYR 86 HD1 TYR 86 -3.806 0.155 -2.073 614 HD2 TYR 86 HD2 TYR 86 -0.288 1.801 -3.569 615 HE1 TYR 86 HE1 TYR 86 -2.513 -1.329 -0.680 616 HE2 TYR 86 HE2 TYR 86 0.999 0.311 -2.170 617 HH TYR 86 HH TYR 86 0.214 -1.079 0.326 618 H THR 87 H THR 87 -1.397 -0.296 -5.237 619 HA THR 87 HA THR 87 -2.632 -1.346 -7.475 620 HB THR 87 HB THR 87 -0.389 -2.098 -6.800 621 HG1 THR 87 HG1 THR 87 -1.453 -4.500 -6.700 622 HG21 THR 87 HG21 THR 87 -0.129 -3.623 -4.957 623 HG22 THR 87 HG22 THR 87 -1.711 -3.533 -4.636 624 HG23 THR 87 HG23 THR 87 -0.764 -2.244 -4.400 625 H ALA 88 H ALA 88 -3.743 -1.185 -4.389 626 HA ALA 88 HA ALA 88 -5.829 -3.086 -4.947 627 HB1 ALA 88 HB1 ALA 88 -4.280 -4.304 -3.542 628 HB2 ALA 88 HB2 ALA 88 -5.630 -4.026 -2.698 629 HB3 ALA 88 HB3 ALA 88 -4.317 -3.117 -2.445 630 HA PRO 89 HA PRO 89 -8.064 0.163 -2.971 631 HB2 PRO 89 HB2 PRO 89 -10.173 -0.972 -1.864 632 HB3 PRO 89 HB3 PRO 89 -10.129 -0.820 -3.490 633 HG2 PRO 89 HG2 PRO 89 -9.464 -3.123 -1.933 634 HG3 PRO 89 HG3 PRO 89 -10.405 -3.058 -3.266 635 HD2 PRO 89 HD2 PRO 89 -7.904 -3.788 -3.458 636 HD3 PRO 89 HD3 PRO 89 -8.607 -2.948 -4.669 637 H HIS 90 H HIS 90 -8.068 1.199 -0.942 638 HA HIS 90 HA HIS 90 -7.204 -0.509 1.232 639 HB2 HIS 90 HB2 HIS 90 -5.368 0.877 0.293 640 HB3 HIS 90 HB3 HIS 90 -6.122 2.144 0.995 641 HD1 HIS 90 HD1 HIS 90 -6.528 1.812 3.771 642 HD2 HIS 90 HD2 HIS 90 -3.508 -0.243 1.903 643 HE1 HIS 90 HE1 HIS 90 -4.936 0.994 5.502 644 HE2 HIS 90 HE2 HIS 90 -3.101 -0.229 4.395 645 H ASN 91 H ASN 91 -8.353 -0.297 3.112 646 HA ASN 91 HA ASN 91 -10.545 1.375 3.107 647 HB2 ASN 91 HB2 ASN 91 -9.321 -0.104 5.254 648 HB3 ASN 91 HB3 ASN 91 -10.640 0.816 5.536 649 HD21 ASN 91 HD21 ASN 91 -11.944 -2.491 5.085 650 HD22 ASN 91 HD22 ASN 91 -11.005 -1.620 6.251 651 H THR 92 H THR 92 -11.026 3.296 4.103 652 HA THR 92 HA THR 92 -9.179 4.673 5.752 653 HB THR 92 HB THR 92 -8.172 5.244 3.655 654 HG1 THR 92 HG1 THR 92 -8.551 7.601 3.906 655 HG21 THR 92 HG21 THR 92 -9.333 6.610 2.092 656 HG22 THR 92 HG22 THR 92 -10.684 6.502 2.974 657 HG23 THR 92 HG23 THR 92 -10.101 5.193 2.226 658 H SER 93 H SER 93 -10.414 6.425 6.800 659 HA SER 93 HA SER 93 -13.240 6.163 6.393 660 HB2 SER 93 HB2 SER 93 -12.578 6.105 8.660 661 HB3 SER 93 HB3 SER 93 -11.721 7.485 8.490 662 HG SER 93 HG SER 93 -13.409 8.655 8.729 663 H GLN 94 H GLN 94 -10.688 8.478 6.240 664 HA GLN 94 HA GLN 94 -12.202 10.213 4.575 665 HB2 GLN 94 HB2 GLN 94 -12.797 10.816 6.891 666 HB3 GLN 94 HB3 GLN 94 -11.232 11.225 7.117 667 HG2 GLN 94 HG2 GLN 94 -11.479 12.979 5.537 668 HG3 GLN 94 HG3 GLN 94 -13.054 12.585 5.365 669 HE21 GLN 94 HE21 GLN 94 -12.274 15.301 7.959 670 HE22 GLN 94 HE22 GLN 94 -11.493 14.970 6.449 671 H TRP 95 H TRP 95 -10.884 11.595 3.301 672 HA TRP 95 HA TRP 95 -8.157 11.811 4.194 673 HB2 TRP 95 HB2 TRP 95 -7.476 11.651 1.800 674 HB3 TRP 95 HB3 TRP 95 -7.610 10.305 2.715 675 HD1 TRP 95 HD1 TRP 95 -10.080 8.965 2.301 676 HE1 TRP 95 HE1 TRP 95 -11.257 8.397 0.162 677 HE3 TRP 95 HE3 TRP 95 -7.786 12.340 -0.583 678 HZ2 TRP 95 HZ2 TRP 95 -11.084 9.326 -2.495 679 HZ3 TRP 95 HZ3 TRP 95 -8.349 12.446 -2.939 680 HH2 TRP 95 HH2 TRP 95 -9.990 10.943 -3.872 681 H HIS 96 H HIS 96 -7.161 13.830 3.746 682 HA HIS 96 HA HIS 96 -8.793 15.734 2.442 683 HB2 HIS 96 HB2 HIS 96 -8.504 17.243 4.559 684 HB3 HIS 96 HB3 HIS 96 -9.841 16.334 4.329 685 HD1 HIS 96 HD1 HIS 96 -7.962 17.272 6.996 686 HD2 HIS 96 HD2 HIS 96 -9.107 13.579 5.634 687 HE1 HIS 96 HE1 HIS 96 -7.870 15.659 8.892 688 HE2 HIS 96 HE2 HIS 96 -8.519 13.424 8.081 689 H TYR 97 H TYR 97 -7.825 17.882 2.136 690 HA TYR 97 HA TYR 97 -4.971 17.697 2.202 691 HB2 TYR 97 HB2 TYR 97 -6.519 18.622 -0.084 692 HB3 TYR 97 HB3 TYR 97 -4.887 18.635 -0.042 693 HD1 TYR 97 HD1 TYR 97 -7.748 16.591 -0.614 694 HD2 TYR 97 HD2 TYR 97 -3.606 16.521 -0.233 695 HE1 TYR 97 HE1 TYR 97 -7.694 14.389 -1.600 696 HE2 TYR 97 HE2 TYR 97 -3.557 14.303 -1.197 697 HH TYR 97 HH TYR 97 -5.577 12.251 -1.321 698 H TYR 98 H TYR 98 -3.768 19.572 2.440 699 HA TYR 98 HA TYR 98 -5.246 22.032 2.804 700 HB2 TYR 98 HB2 TYR 98 -3.074 21.176 4.509 701 HB3 TYR 98 HB3 TYR 98 -3.912 22.567 4.681 702 HD1 TYR 98 HD1 TYR 98 -4.266 18.963 4.985 703 HD2 TYR 98 HD2 TYR 98 -5.859 22.652 6.069 704 HE1 TYR 98 HE1 TYR 98 -5.776 17.863 6.507 705 HE2 TYR 98 HE2 TYR 98 -7.344 21.543 7.629 706 HH TYR 98 HH TYR 98 -8.373 18.818 7.612 707 H ILE 99 H ILE 99 -3.842 23.986 2.354 708 HA ILE 99 HA ILE 99 -1.330 23.287 1.190 709 HB ILE 99 HB ILE 99 -1.512 24.674 -0.707 710 HG12 ILE 99 HG12 ILE 99 -2.622 26.525 0.015 711 HG13 ILE 99 HG13 ILE 99 -3.430 25.941 -1.278 712 HG21 ILE 99 HG21 ILE 99 -3.307 23.628 -1.943 713 HG22 ILE 99 HG22 ILE 99 -3.931 23.075 -0.557 714 HG23 ILE 99 HG23 ILE 99 -2.498 22.531 -1.073 715 HD11 ILE 99 HD11 ILE 99 -4.969 26.748 0.350 716 HD12 ILE 99 HD12 ILE 99 -4.366 25.731 1.454 717 HD13 ILE 99 HD13 ILE 99 -5.167 25.153 0.173 718 H THR 100 H THR 100 0.287 25.098 1.156 719 HA THR 100 HA THR 100 -0.338 26.890 3.281 720 HB THR 100 HB THR 100 2.115 27.290 3.419 721 HG1 THR 100 HG1 THR 100 3.453 25.946 2.266 722 HG21 THR 100 HG21 THR 100 2.624 25.158 4.409 723 HG22 THR 100 HG22 THR 100 1.340 24.496 3.682 724 HG23 THR 100 HG23 THR 100 1.131 25.590 4.855 725 H LYS 101 H LYS 101 -0.299 29.124 3.131 726 HA LYS 101 HA LYS 101 -0.190 30.156 0.476 727 HB2 LYS 101 HB2 LYS 101 -1.917 30.913 1.963 728 HB3 LYS 101 HB3 LYS 101 -0.782 31.532 2.961 729 HG2 LYS 101 HG2 LYS 101 -0.198 33.131 1.309 730 HG3 LYS 101 HG3 LYS 101 -1.329 32.511 0.307 731 HD2 LYS 101 HD2 LYS 101 -3.047 33.201 1.763 732 HD3 LYS 101 HD3 LYS 101 -1.947 33.733 2.847 733 HE2 LYS 101 HE2 LYS 101 -1.197 35.357 1.231 734 HE3 LYS 101 HE3 LYS 101 -2.385 34.866 0.224 735 HZ1 LYS 101 HZ1 LYS 101 -3.037 36.847 1.353 736 HZ2 LYS 101 HZ2 LYS 101 -2.833 36.115 2.781 737 HZ3 LYS 101 HZ3 LYS 101 -4.010 35.629 1.784 738 H LYS 102 H LYS 102 1.748 30.701 -0.418 739 HA LYS 102 HA LYS 102 3.945 31.599 1.154 740 HB2 LYS 102 HB2 LYS 102 4.325 30.604 -0.947 741 HB3 LYS 102 HB3 LYS 102 3.542 31.838 -1.677 742 HG2 LYS 102 HG2 LYS 102 5.263 33.325 -0.887 743 HG3 LYS 102 HG3 LYS 102 6.070 32.027 -0.313 744 HD2 LYS 102 HD2 LYS 102 6.306 31.175 -2.497 745 HD3 LYS 102 HD3 LYS 102 5.429 32.415 -3.095 746 HE2 LYS 102 HE2 LYS 102 7.142 33.934 -2.329 747 HE3 LYS 102 HE3 LYS 102 8.035 32.645 -1.874 748 HZ1 LYS 102 HZ1 LYS 102 8.781 33.452 -3.979 749 HZ2 LYS 102 HZ2 LYS 102 7.304 33.233 -4.600 750 HZ3 LYS 102 HZ3 LYS 102 8.189 31.957 -4.149 751 H GLY 103 H GLY 103 4.109 33.773 1.987 752 HA2 GLY 103 HA2 GLY 103 3.683 36.039 1.770 753 HA3 GLY 103 HA3 GLY 103 2.658 35.759 0.529 754 H TRP 104 H TRP 104 2.346 34.120 3.553 755 HA TRP 104 HA TRP 104 -0.264 34.699 3.939 756 HB2 TRP 104 HB2 TRP 104 0.152 34.197 6.321 757 HB3 TRP 104 HB3 TRP 104 0.681 33.053 5.283 758 HD1 TRP 104 HD1 TRP 104 2.192 35.973 7.129 759 HE1 TRP 104 HE1 TRP 104 4.588 35.569 7.746 760 HE3 TRP 104 HE3 TRP 104 2.625 31.466 5.009 761 HZ2 TRP 104 HZ2 TRP 104 6.421 33.476 7.286 762 HZ3 TRP 104 HZ3 TRP 104 4.745 30.301 5.155 763 HH2 TRP 104 HH2 TRP 104 6.621 31.314 6.286 764 H ASP 105 H ASP 105 -1.489 36.165 5.269 765 HA ASP 105 HA ASP 105 -0.571 38.760 4.886 766 HB2 ASP 105 HB2 ASP 105 -2.844 37.942 6.487 767 HB3 ASP 105 HB3 ASP 105 -2.631 39.440 5.874 768 HA PRO 106 HA PRO 106 1.525 39.092 8.708 769 HB2 PRO 106 HB2 PRO 106 2.354 41.621 8.675 770 HB3 PRO 106 HB3 PRO 106 3.033 40.571 7.625 771 HG2 PRO 106 HG2 PRO 106 0.873 42.375 7.130 772 HG3 PRO 106 HG3 PRO 106 2.226 42.174 6.237 773 HD2 PRO 106 HD2 PRO 106 0.036 40.959 5.534 774 HD3 PRO 106 HD3 PRO 106 1.471 40.208 5.329 775 H ASP 107 H ASP 107 -1.189 40.805 7.973 776 HA ASP 107 HA ASP 107 -1.604 41.986 10.485 777 HB2 ASP 107 HB2 ASP 107 -2.658 42.703 8.377 778 HB3 ASP 107 HB3 ASP 107 -3.588 41.362 8.444 779 H LYS 108 H LYS 108 -1.702 38.863 9.501 780 HA LYS 108 HA LYS 108 -3.682 38.117 11.476 781 HB2 LYS 108 HB2 LYS 108 -3.009 36.721 9.034 782 HB3 LYS 108 HB3 LYS 108 -4.100 36.174 10.119 783 HG2 LYS 108 HG2 LYS 108 -5.513 38.004 9.657 784 HG3 LYS 108 HG3 LYS 108 -4.408 38.618 8.624 785 HD2 LYS 108 HD2 LYS 108 -4.680 36.649 7.264 786 HD3 LYS 108 HD3 LYS 108 -5.899 36.191 8.249 787 HE2 LYS 108 HE2 LYS 108 -7.199 38.009 7.617 788 HE3 LYS 108 HE3 LYS 108 -5.940 38.716 6.855 789 HZ1 LYS 108 HZ1 LYS 108 -7.407 37.735 5.271 790 HZ2 LYS 108 HZ2 LYS 108 -7.219 36.292 5.975 791 HZ3 LYS 108 HZ3 LYS 108 -5.972 36.991 5.220 792 HA PRO 109 HA PRO 109 -0.483 35.996 13.445 793 HB2 PRO 109 HB2 PRO 109 -1.704 33.979 14.706 794 HB3 PRO 109 HB3 PRO 109 -1.852 35.502 15.277 795 HG2 PRO 109 HG2 PRO 109 -3.674 34.083 13.595 796 HG3 PRO 109 HG3 PRO 109 -4.020 34.951 14.935 797 HD2 PRO 109 HD2 PRO 109 -4.371 36.007 12.619 798 HD3 PRO 109 HD3 PRO 109 -3.812 36.931 13.844 799 H LEU 110 H LEU 110 1.099 34.913 12.690 800 HA LEU 110 HA LEU 110 0.838 33.659 10.304 801 HB2 LEU 110 HB2 LEU 110 2.897 34.533 11.291 802 HB3 LEU 110 HB3 LEU 110 2.965 33.196 12.226 803 HG LEU 110 HG LEU 110 3.230 33.006 9.393 804 HD11 LEU 110 HD11 LEU 110 5.671 33.133 9.782 805 HD12 LEU 110 HD12 LEU 110 5.390 33.406 11.350 806 HD13 LEU 110 HD13 LEU 110 4.971 34.514 10.249 807 HD21 LEU 110 HD21 LEU 110 4.416 30.981 9.779 808 HD22 LEU 110 HD22 LEU 110 2.923 30.893 10.393 809 HD23 LEU 110 HD23 LEU 110 4.187 31.142 11.371 810 H LYS 111 H LYS 111 1.113 32.035 13.385 811 HA LYS 111 HA LYS 111 1.174 29.554 12.170 812 HB2 LYS 111 HB2 LYS 111 0.589 30.156 14.958 813 HB3 LYS 111 HB3 LYS 111 0.953 28.653 14.434 814 HG2 LYS 111 HG2 LYS 111 3.082 29.805 13.641 815 HG3 LYS 111 HG3 LYS 111 2.704 30.855 14.833 816 HD2 LYS 111 HD2 LYS 111 3.078 28.025 15.261 817 HD3 LYS 111 HD3 LYS 111 4.229 29.143 15.568 818 HE2 LYS 111 HE2 LYS 111 2.799 30.101 17.243 819 HE3 LYS 111 HE3 LYS 111 1.726 28.898 16.977 820 HZ1 LYS 111 HZ1 LYS 111 3.097 28.368 18.863 821 HZ2 LYS 111 HZ2 LYS 111 4.422 28.488 17.944 822 HZ3 LYS 111 HZ3 LYS 111 3.361 27.297 17.681 823 H ARG 112 H ARG 112 -1.423 31.454 12.395 824 HA ARG 112 HA ARG 112 -3.204 29.208 12.280 825 HB2 ARG 112 HB2 ARG 112 -3.776 32.006 12.639 826 HB3 ARG 112 HB3 ARG 112 -4.972 30.933 12.353 827 HG2 ARG 112 HG2 ARG 112 -4.372 29.780 14.362 828 HG3 ARG 112 HG3 ARG 112 -3.254 30.933 14.660 829 HD2 ARG 112 HD2 ARG 112 -5.030 32.562 14.724 830 HD3 ARG 112 HD3 ARG 112 -6.105 31.341 14.580 831 HE ARG 112 HE ARG 112 -4.586 30.696 16.747 832 HH11 ARG 112 HH11 ARG 112 -6.809 33.292 15.906 833 HH12 ARG 112 HH12 ARG 112 -7.235 33.581 17.560 834 HH21 ARG 112 HH21 ARG 112 -5.166 31.133 18.835 835 HH22 ARG 112 HH22 ARG 112 -6.318 32.376 19.193 836 H ALA 113 H ALA 113 -2.344 32.053 10.549 837 HA ALA 113 HA ALA 113 -4.079 31.400 8.431 838 HB1 ALA 113 HB1 ALA 113 -3.903 33.741 9.243 839 HB2 ALA 113 HB2 ALA 113 -3.583 33.698 7.658 840 HB3 ALA 113 HB3 ALA 113 -2.372 33.789 8.726 841 H ASP 114 H ASP 114 -1.160 30.289 8.897 842 HA ASP 114 HA ASP 114 -0.072 30.871 6.395 843 HB2 ASP 114 HB2 ASP 114 1.731 29.387 7.008 844 HB3 ASP 114 HB3 ASP 114 1.394 30.410 8.235 845 H PHE 115 H PHE 115 -1.979 28.285 7.594 846 HA PHE 115 HA PHE 115 -1.923 27.144 4.965 847 HB2 PHE 115 HB2 PHE 115 -1.928 24.956 5.763 848 HB3 PHE 115 HB3 PHE 115 -0.802 25.730 6.658 849 HD1 PHE 115 HD1 PHE 115 -1.408 26.469 9.008 850 HD2 PHE 115 HD2 PHE 115 -3.755 23.859 6.779 851 HE1 PHE 115 HE1 PHE 115 -2.563 25.807 11.017 852 HE2 PHE 115 HE2 PHE 115 -4.907 23.168 8.784 853 HZ PHE 115 HZ PHE 115 -4.311 24.146 10.912 854 H GLU 116 H GLU 116 -3.804 26.145 4.072 855 HA GLU 116 HA GLU 116 -6.226 26.567 5.562 856 HB2 GLU 116 HB2 GLU 116 -5.867 27.535 2.857 857 HB3 GLU 116 HB3 GLU 116 -7.319 27.498 3.602 858 HG2 GLU 116 HG2 GLU 116 -6.509 29.081 5.202 859 HG3 GLU 116 HG3 GLU 116 -5.095 29.152 4.388 860 H LEU 117 H LEU 117 -8.064 25.166 4.871 861 HA LEU 117 HA LEU 117 -7.145 22.761 3.682 862 HB2 LEU 117 HB2 LEU 117 -8.721 22.585 5.436 863 HB3 LEU 117 HB3 LEU 117 -9.804 23.458 4.582 864 HG LEU 117 HG LEU 117 -9.143 21.209 3.151 865 HD11 LEU 117 HD11 LEU 117 -9.985 19.499 4.589 866 HD12 LEU 117 HD12 LEU 117 -10.093 20.565 5.799 867 HD13 LEU 117 HD13 LEU 117 -8.644 20.150 5.214 868 HD21 LEU 117 HD21 LEU 117 -11.530 20.861 3.170 869 HD22 LEU 117 HD22 LEU 117 -11.199 22.408 2.837 870 HD23 LEU 117 HD23 LEU 117 -11.685 21.986 4.321 871 H ILE 118 H ILE 118 -7.275 22.168 1.530 872 HA ILE 118 HA ILE 118 -8.844 23.922 -0.121 873 HB ILE 118 HB ILE 118 -6.405 23.701 -0.585 874 HG12 ILE 118 HG12 ILE 118 -7.902 23.146 -2.956 875 HG13 ILE 118 HG13 ILE 118 -8.102 24.564 -2.172 876 HG21 ILE 118 HG21 ILE 118 -5.653 21.811 -1.845 877 HG22 ILE 118 HG22 ILE 118 -7.100 21.110 -1.669 878 HG23 ILE 118 HG23 ILE 118 -6.154 21.349 -0.379 879 HD11 ILE 118 HD11 ILE 118 -6.545 24.839 -3.973 880 HD12 ILE 118 HD12 ILE 118 -5.592 23.695 -3.343 881 HD13 ILE 118 HD13 ILE 118 -5.791 25.099 -2.567 882 H GLY 119 H GLY 119 -8.972 20.877 1.128 883 HA2 GLY 119 HA2 GLY 119 -11.384 20.338 -0.026 884 HA3 GLY 119 HA3 GLY 119 -10.278 19.581 -0.959 885 H ALA 120 H ALA 120 -12.339 18.253 0.324 886 HA ALA 120 HA ALA 120 -10.818 16.429 1.915 887 HB1 ALA 120 HB1 ALA 120 -11.761 17.874 3.601 888 HB2 ALA 120 HB2 ALA 120 -12.474 16.427 3.708 889 HB3 ALA 120 HB3 ALA 120 -13.241 17.654 2.988 890 H VAL 121 H VAL 121 -11.516 14.286 1.683 891 HA VAL 121 HA VAL 121 -13.962 13.929 0.244 892 HB VAL 121 HB VAL 121 -11.542 12.457 -0.463 893 HG11 VAL 121 HG11 VAL 121 -12.839 11.499 -2.272 894 HG12 VAL 121 HG12 VAL 121 -14.148 12.296 -1.758 895 HG13 VAL 121 HG13 VAL 121 -13.513 11.117 -0.853 896 HG21 VAL 121 HG21 VAL 121 -11.554 13.655 -2.551 897 HG22 VAL 121 HG22 VAL 121 -11.400 14.691 -1.319 898 HG23 VAL 121 HG23 VAL 121 -12.830 14.516 -2.054 899 HA PRO 122 HA PRO 122 -13.960 10.915 3.495 900 HB2 PRO 122 HB2 PRO 122 -16.523 10.455 3.821 901 HB3 PRO 122 HB3 PRO 122 -15.948 11.899 4.321 902 HG2 PRO 122 HG2 PRO 122 -17.263 11.303 1.852 903 HG3 PRO 122 HG3 PRO 122 -17.569 12.543 2.870 904 HD2 PRO 122 HD2 PRO 122 -16.044 12.873 0.745 905 HD3 PRO 122 HD3 PRO 122 -15.811 13.764 2.094 906 H HIS 123 H HIS 123 -14.351 8.624 3.739 907 HA HIS 123 HA HIS 123 -15.351 7.395 1.340 908 HB2 HIS 123 HB2 HIS 123 -13.059 7.195 1.011 909 HB3 HIS 123 HB3 HIS 123 -12.828 6.701 2.551 910 HD1 HIS 123 HD1 HIS 123 -14.729 5.394 -0.445 911 HD2 HIS 123 HD2 HIS 123 -12.437 4.039 2.671 912 HE1 HIS 123 HE1 HIS 123 -14.549 2.913 -0.611 913 HE2 HIS 123 HE2 HIS 123 -13.160 2.081 1.253 914 H ASP 124 H ASP 124 -16.991 6.380 1.786 915 HA ASP 124 HA ASP 124 -17.266 4.320 3.713 916 HB2 ASP 124 HB2 ASP 124 -17.383 6.222 5.186 917 HB3 ASP 124 HB3 ASP 124 -18.739 6.666 4.392 918 H GLY 125 H GLY 125 -20.012 6.141 3.336 919 HA2 GLY 125 HA2 GLY 125 -20.903 4.926 0.921 920 HA3 GLY 125 HA3 GLY 125 -21.757 5.949 1.865 921 H SER 126 H SER 126 -18.768 6.103 0.088 922 HA SER 126 HA SER 126 -19.197 8.836 -0.507 923 HB2 SER 126 HB2 SER 126 -16.986 7.924 0.026 924 HB3 SER 126 HB3 SER 126 -16.995 7.181 -1.429 925 HG SER 126 HG SER 126 -16.651 8.973 -2.442 926 HA PRO 127 HA PRO 127 -20.999 8.064 -4.474 927 HB2 PRO 127 HB2 PRO 127 -21.326 10.537 -5.329 928 HB3 PRO 127 HB3 PRO 127 -22.192 10.076 -4.024 929 HG2 PRO 127 HG2 PRO 127 -19.721 11.484 -4.062 930 HG3 PRO 127 HG3 PRO 127 -21.086 11.885 -3.261 931 HD2 PRO 127 HD2 PRO 127 -19.180 10.617 -2.019 932 HD3 PRO 127 HD3 PRO 127 -20.740 10.307 -1.645 933 H ALA 128 H ALA 128 -20.520 9.566 -6.808 934 HA ALA 128 HA ALA 128 -18.335 8.280 -7.759 935 HB1 ALA 128 HB1 ALA 128 -20.021 9.329 -9.191 936 HB2 ALA 128 HB2 ALA 128 -18.544 9.740 -9.706 937 HB3 ALA 128 HB3 ALA 128 -19.414 10.784 -8.830 938 H SER 129 H SER 129 -18.275 11.105 -5.921 939 HA SER 129 HA SER 129 -15.788 12.045 -6.616 940 HB2 SER 129 HB2 SER 129 -17.329 13.340 -5.248 941 HB3 SER 129 HB3 SER 129 -17.095 12.303 -4.009 942 HG SER 129 HG SER 129 -14.810 12.955 -4.263 943 H ARG 130 H ARG 130 -16.442 9.165 -5.199 944 HA ARG 130 HA ARG 130 -14.387 8.896 -3.419 945 HB2 ARG 130 HB2 ARG 130 -14.817 6.519 -3.589 946 HB3 ARG 130 HB3 ARG 130 -16.240 7.319 -3.625 947 HG2 ARG 130 HG2 ARG 130 -16.219 7.097 -6.046 948 HG3 ARG 130 HG3 ARG 130 -14.908 6.136 -5.896 949 HD2 ARG 130 HD2 ARG 130 -16.157 4.538 -4.713 950 HD3 ARG 130 HD3 ARG 130 -17.458 5.525 -4.689 951 HE ARG 130 HE ARG 130 -18.015 4.958 -6.826 952 HH11 ARG 130 HH11 ARG 130 -17.912 3.652 -8.600 953 HH12 ARG 130 HH12 ARG 130 -16.532 2.643 -8.877 954 HH21 ARG 130 HH21 ARG 130 -14.850 3.619 -6.040 955 HH22 ARG 130 HH22 ARG 130 -14.831 2.623 -7.456 956 H ASN 131 H ASN 131 -14.086 9.126 -6.701 957 HA ASN 131 HA ASN 131 -11.985 7.413 -7.176 958 HB2 ASN 131 HB2 ASN 131 -12.686 9.866 -8.533 959 HB3 ASN 131 HB3 ASN 131 -11.508 8.882 -9.088 960 HD21 ASN 131 HD21 ASN 131 -14.745 8.215 -10.797 961 HD22 ASN 131 HD22 ASN 131 -13.862 9.670 -10.475 962 H LEU 132 H LEU 132 -9.747 7.535 -7.002 963 HA LEU 132 HA LEU 132 -8.887 9.203 -4.978 964 HB2 LEU 132 HB2 LEU 132 -7.844 7.055 -6.409 965 HB3 LEU 132 HB3 LEU 132 -6.667 8.170 -6.212 966 HG LEU 132 HG LEU 132 -6.512 6.463 -4.607 967 HD11 LEU 132 HD11 LEU 132 -6.312 7.845 -2.644 968 HD12 LEU 132 HD12 LEU 132 -7.147 9.013 -3.387 969 HD13 LEU 132 HD13 LEU 132 -5.684 8.593 -3.933 970 HD21 LEU 132 HD21 LEU 132 -8.179 6.204 -2.889 971 HD22 LEU 132 HD22 LEU 132 -8.803 5.863 -4.342 972 HD23 LEU 132 HD23 LEU 132 -9.117 7.286 -3.641 973 H SER 133 H SER 133 -8.909 9.721 -8.280 974 HA SER 133 HA SER 133 -6.841 11.729 -8.120 975 HB2 SER 133 HB2 SER 133 -6.699 10.222 -9.990 976 HB3 SER 133 HB3 SER 133 -8.154 10.750 -10.512 977 HG SER 133 HG SER 133 -6.536 11.766 -11.627 978 H HIS 134 H HIS 134 -7.276 13.919 -8.205 979 HA HIS 134 HA HIS 134 -10.007 14.615 -8.619 980 HB2 HIS 134 HB2 HIS 134 -8.599 14.846 -6.150 981 HB3 HIS 134 HB3 HIS 134 -9.466 16.177 -6.528 982 HD1 HIS 134 HD1 HIS 134 -11.812 16.255 -5.626 983 HD2 HIS 134 HD2 HIS 134 -10.376 12.455 -6.165 984 HE1 HIS 134 HE1 HIS 134 -13.551 14.636 -4.881 985 HE2 HIS 134 HE2 HIS 134 -12.696 12.340 -5.181 986 H HIS 135 H HIS 135 -10.564 16.679 -9.211 987 HA HIS 135 HA HIS 135 -8.500 18.259 -10.340 988 HB2 HIS 135 HB2 HIS 135 -11.345 18.741 -10.104 989 HB3 HIS 135 HB3 HIS 135 -10.341 19.746 -10.910 990 HD1 HIS 135 HD1 HIS 135 -9.961 19.357 -13.363 991 HD2 HIS 135 HD2 HIS 135 -11.581 16.140 -11.412 992 HE1 HIS 135 HE1 HIS 135 -10.490 17.601 -15.041 993 HE2 HIS 135 HE2 HIS 135 -11.488 15.660 -13.894 994 H ILE 136 H ILE 136 -7.484 19.989 -9.358 995 HA ILE 136 HA ILE 136 -8.668 21.055 -6.951 996 HB ILE 136 HB ILE 136 -5.818 20.528 -7.262 997 HG12 ILE 136 HG12 ILE 136 -7.052 18.566 -6.705 998 HG13 ILE 136 HG13 ILE 136 -5.950 18.958 -5.566 999 HG21 ILE 136 HG21 ILE 136 -5.516 21.428 -5.045 1000 HG22 ILE 136 HG22 ILE 136 -7.085 21.816 -4.987 1001 HG23 ILE 136 HG23 ILE 136 -6.105 22.564 -6.034 1002 HD11 ILE 136 HD11 ILE 136 -7.990 18.230 -4.512 1003 HD12 ILE 136 HD12 ILE 136 -8.816 19.394 -5.272 1004 HD13 ILE 136 HD13 ILE 136 -7.724 19.781 -4.144 1005 H TYR 137 H TYR 137 -9.132 23.227 -7.378 1006 HA TYR 137 HA TYR 137 -7.803 24.457 -9.566 1007 HB2 TYR 137 HB2 TYR 137 -10.159 24.828 -9.176 1008 HB3 TYR 137 HB3 TYR 137 -9.775 25.650 -7.818 1009 HD1 TYR 137 HD1 TYR 137 -8.730 27.895 -7.958 1010 HD2 TYR 137 HD2 TYR 137 -9.931 25.852 -11.378 1011 HE1 TYR 137 HE1 TYR 137 -8.490 29.920 -9.254 1012 HE2 TYR 137 HE2 TYR 137 -9.712 27.884 -12.666 1013 HH TYR 137 HH TYR 137 -8.912 30.006 -12.721 1014 H ILE 138 H ILE 138 -5.963 25.713 -9.444 1015 HA ILE 138 HA ILE 138 -5.444 26.824 -6.860 1016 HB ILE 138 HB ILE 138 -3.307 25.772 -8.577 1017 HG12 ILE 138 HG12 ILE 138 -4.254 24.633 -6.105 1018 HG13 ILE 138 HG13 ILE 138 -4.611 24.031 -7.580 1019 HG21 ILE 138 HG21 ILE 138 -1.808 26.247 -6.728 1020 HG22 ILE 138 HG22 ILE 138 -3.037 26.873 -5.883 1021 HG23 ILE 138 HG23 ILE 138 -2.510 27.619 -7.217 1022 HD11 ILE 138 HD11 ILE 138 -2.883 22.725 -6.562 1023 HD12 ILE 138 HD12 ILE 138 -1.948 24.037 -6.429 1024 HD13 ILE 138 HD13 ILE 138 -2.302 23.441 -7.890 1025 HA PRO 139 HA PRO 139 -5.029 30.367 -9.545 1026 HB2 PRO 139 HB2 PRO 139 -5.489 32.305 -7.833 1027 HB3 PRO 139 HB3 PRO 139 -6.764 31.460 -8.405 1028 HG2 PRO 139 HG2 PRO 139 -5.409 31.116 -5.920 1029 HG3 PRO 139 HG3 PRO 139 -7.020 31.165 -6.184 1030 HD2 PRO 139 HD2 PRO 139 -5.762 28.874 -5.929 1031 HD3 PRO 139 HD3 PRO 139 -7.088 29.002 -6.873 1032 H GLU 140 H GLU 140 -3.263 31.768 -9.917 1033 HA GLU 140 HA GLU 140 -1.235 31.778 -7.900 1034 HB2 GLU 140 HB2 GLU 140 -0.995 29.721 -9.315 1035 HB3 GLU 140 HB3 GLU 140 -0.482 30.738 -10.486 1036 HG2 GLU 140 HG2 GLU 140 1.389 29.896 -9.520 1037 HG3 GLU 140 HG3 GLU 140 1.262 31.433 -8.983 1038 H ASP 141 H ASP 141 -0.997 33.974 -7.720 1039 HA ASP 141 HA ASP 141 -1.100 35.467 -10.135 1040 HB2 ASP 141 HB2 ASP 141 -1.429 37.401 -8.798 1041 HB3 ASP 141 HB3 ASP 141 -2.334 36.218 -8.129 1042 H ARG 142 H ARG 142 1.234 34.280 -8.130 1043 HA ARG 142 HA ARG 142 3.316 35.878 -9.326 1044 HB2 ARG 142 HB2 ARG 142 3.034 35.541 -6.474 1045 HB3 ARG 142 HB3 ARG 142 4.410 36.087 -7.165 1046 HG2 ARG 142 HG2 ARG 142 3.382 38.022 -7.860 1047 HG3 ARG 142 HG3 ARG 142 1.908 37.448 -7.458 1048 HD2 ARG 142 HD2 ARG 142 2.851 37.383 -5.131 1049 HD3 ARG 142 HD3 ARG 142 3.926 38.462 -5.721 1050 HE ARG 142 HE ARG 142 1.085 38.953 -5.976 1051 HH11 ARG 142 HH11 ARG 142 0.346 40.932 -5.411 1052 HH12 ARG 142 HH12 ARG 142 1.407 42.113 -4.717 1053 HH21 ARG 142 HH21 ARG 142 4.203 40.104 -4.800 1054 HH22 ARG 142 HH22 ARG 142 3.556 41.654 -4.376 1055 H LEU 143 H LEU 143 5.548 34.852 -8.760 1056 HA LEU 143 HA LEU 143 5.219 32.070 -9.310 1057 HB2 LEU 143 HB2 LEU 143 7.559 33.749 -9.328 1058 HB3 LEU 143 HB3 LEU 143 7.640 32.148 -9.641 1059 HG LEU 143 HG LEU 143 6.222 32.602 -11.574 1060 HD11 LEU 143 HD11 LEU 143 6.254 34.781 -12.545 1061 HD12 LEU 143 HD12 LEU 143 6.955 35.368 -11.212 1062 HD13 LEU 143 HD13 LEU 143 5.446 34.789 -11.144 1063 HD21 LEU 143 HD21 LEU 143 8.181 33.269 -12.901 1064 HD22 LEU 143 HD22 LEU 143 8.606 32.164 -11.800 1065 HD23 LEU 143 HD23 LEU 143 8.926 33.728 -11.541 1066 H GLY 144 H GLY 144 5.496 30.433 -7.762 1067 HA2 GLY 144 HA2 GLY 144 7.310 30.698 -5.723 1068 HA3 GLY 144 HA3 GLY 144 5.852 31.160 -5.148 1069 H TYR 145 H TYR 145 7.294 29.306 -3.929 1070 HA TYR 145 HA TYR 145 6.338 26.754 -4.677 1071 HB2 TYR 145 HB2 TYR 145 7.664 26.087 -2.661 1072 HB3 TYR 145 HB3 TYR 145 8.526 26.736 -3.887 1073 HD1 TYR 145 HD1 TYR 145 9.658 28.871 -3.638 1074 HD2 TYR 145 HD2 TYR 145 7.238 27.406 -0.587 1075 HE1 TYR 145 HE1 TYR 145 10.459 30.612 -2.162 1076 HE2 TYR 145 HE2 TYR 145 8.042 29.143 0.885 1077 HH TYR 145 HH TYR 145 9.877 31.817 -0.194 1078 H HIS 146 H HIS 146 4.989 25.395 -3.547 1079 HA HIS 146 HA HIS 146 3.654 26.533 -1.252 1080 HB2 HIS 146 HB2 HIS 146 2.302 25.227 -3.439 1081 HB3 HIS 146 HB3 HIS 146 1.572 25.602 -2.028 1082 HD1 HIS 146 HD1 HIS 146 1.018 28.134 -1.507 1083 HD2 HIS 146 HD2 HIS 146 2.527 27.334 -5.234 1084 HE1 HIS 146 HE1 HIS 146 0.635 30.118 -2.964 1085 HE2 HIS 146 HE2 HIS 146 1.529 29.650 -5.214 1086 H VAL 147 H VAL 147 3.018 24.966 0.322 1087 HA VAL 147 HA VAL 147 4.096 22.318 -0.143 1088 HB VAL 147 HB VAL 147 3.553 23.522 2.445 1089 HG11 VAL 147 HG11 VAL 147 4.724 21.654 3.375 1090 HG12 VAL 147 HG12 VAL 147 4.905 21.024 1.897 1091 HG13 VAL 147 HG13 VAL 147 3.430 21.145 2.549 1092 HG21 VAL 147 HG21 VAL 147 5.942 23.762 2.694 1093 HG22 VAL 147 HG22 VAL 147 5.434 24.629 1.427 1094 HG23 VAL 147 HG23 VAL 147 6.160 23.203 1.193 1095 H ILE 148 H ILE 148 2.579 20.682 -0.371 1096 HA ILE 148 HA ILE 148 -0.139 21.360 0.341 1097 HB ILE 148 HB ILE 148 0.708 19.360 -1.599 1098 HG12 ILE 148 HG12 ILE 148 -0.586 21.874 -2.162 1099 HG13 ILE 148 HG13 ILE 148 1.024 21.647 -2.315 1100 HG21 ILE 148 HG21 ILE 148 -1.640 19.089 -2.129 1101 HG22 ILE 148 HG22 ILE 148 -2.034 20.129 -0.956 1102 HG23 ILE 148 HG23 ILE 148 -1.383 18.697 -0.581 1103 HD11 ILE 148 HD11 ILE 148 -0.027 21.511 -4.454 1104 HD12 ILE 148 HD12 ILE 148 -0.967 20.304 -3.932 1105 HD13 ILE 148 HD13 ILE 148 0.627 20.079 -4.084 1106 H LEU 149 H LEU 149 -0.823 20.444 2.252 1107 HA LEU 149 HA LEU 149 0.606 18.109 3.167 1108 HB2 LEU 149 HB2 LEU 149 0.456 19.980 4.645 1109 HB3 LEU 149 HB3 LEU 149 -1.170 19.819 4.654 1110 HG LEU 149 HG LEU 149 0.287 17.583 5.567 1111 HD11 LEU 149 HD11 LEU 149 0.631 18.557 7.762 1112 HD12 LEU 149 HD12 LEU 149 0.088 19.977 7.211 1113 HD13 LEU 149 HD13 LEU 149 1.480 19.373 6.654 1114 HD21 LEU 149 HD21 LEU 149 -1.507 17.409 7.157 1115 HD22 LEU 149 HD22 LEU 149 -2.100 17.505 5.656 1116 HD23 LEU 149 HD23 LEU 149 -2.123 18.804 6.620 1117 H ALA 150 H ALA 150 -0.330 16.104 3.314 1118 HA ALA 150 HA ALA 150 -3.155 16.012 2.745 1119 HB1 ALA 150 HB1 ALA 150 -1.922 15.213 0.840 1120 HB2 ALA 150 HB2 ALA 150 -2.765 13.988 1.475 1121 HB3 ALA 150 HB3 ALA 150 -1.180 14.115 1.767 1122 H VAL 151 H VAL 151 -4.451 14.528 3.795 1123 HA VAL 151 HA VAL 151 -3.170 13.065 5.912 1124 HB VAL 151 HB VAL 151 -5.810 14.285 6.175 1125 HG11 VAL 151 HG11 VAL 151 -5.651 13.715 8.512 1126 HG12 VAL 151 HG12 VAL 151 -4.213 13.024 8.252 1127 HG13 VAL 151 HG13 VAL 151 -5.550 12.375 7.614 1128 HG21 VAL 151 HG21 VAL 151 -4.818 15.929 7.602 1129 HG22 VAL 151 HG22 VAL 151 -4.181 16.022 6.119 1130 HG23 VAL 151 HG23 VAL 151 -3.355 15.307 7.311 1131 H TRP 152 H TRP 152 -3.726 10.902 6.059 1132 HA TRP 152 HA TRP 152 -6.005 9.975 4.512 1133 HB2 TRP 152 HB2 TRP 152 -3.978 9.507 3.331 1134 HB3 TRP 152 HB3 TRP 152 -3.422 8.688 4.630 1135 HD1 TRP 152 HD1 TRP 152 -4.415 6.260 5.041 1136 HE1 TRP 152 HE1 TRP 152 -5.569 4.558 3.607 1137 HE3 TRP 152 HE3 TRP 152 -5.641 9.341 1.307 1138 HZ2 TRP 152 HZ2 TRP 152 -6.848 4.636 1.095 1139 HZ3 TRP 152 HZ3 TRP 152 -6.876 8.460 -0.578 1140 HH2 TRP 152 HH2 TRP 152 -7.453 6.120 -0.680 1141 H ASP 153 H ASP 153 -7.428 9.606 6.165 1142 HA ASP 153 HA ASP 153 -6.417 8.601 8.594 1143 HB2 ASP 153 HB2 ASP 153 -9.130 9.339 7.846 1144 HB3 ASP 153 HB3 ASP 153 -8.755 8.858 9.361 1145 H VAL 154 H VAL 154 -5.952 6.460 8.720 1146 HA VAL 154 HA VAL 154 -7.827 4.563 7.617 1147 HB VAL 154 HB VAL 154 -5.265 4.087 8.877 1148 HG11 VAL 154 HG11 VAL 154 -5.423 1.853 8.091 1149 HG12 VAL 154 HG12 VAL 154 -6.910 2.147 7.528 1150 HG13 VAL 154 HG13 VAL 154 -6.630 2.169 9.120 1151 HG21 VAL 154 HG21 VAL 154 -4.502 3.644 6.610 1152 HG22 VAL 154 HG22 VAL 154 -5.062 5.158 6.703 1153 HG23 VAL 154 HG23 VAL 154 -5.975 3.997 6.044 1154 H ALA 155 H ALA 155 -9.462 3.699 8.849 1155 HA ALA 155 HA ALA 155 -9.486 4.415 11.635 1156 HB1 ALA 155 HB1 ALA 155 -11.504 4.832 10.403 1157 HB2 ALA 155 HB2 ALA 155 -11.813 3.747 11.561 1158 HB3 ALA 155 HB3 ALA 155 -11.620 3.263 10.031 1159 H ASP 156 H ASP 156 -8.644 1.970 9.677 1160 HA ASP 156 HA ASP 156 -9.400 -0.227 11.216 1161 HB2 ASP 156 HB2 ASP 156 -7.400 -0.256 9.093 1162 HB3 ASP 156 HB3 ASP 156 -8.388 -1.496 9.485 1163 H THR 157 H THR 157 -7.112 1.933 11.806 1164 HA THR 157 HA THR 157 -5.641 0.186 13.475 1165 HB THR 157 HB THR 157 -4.395 0.049 11.345 1166 HG1 THR 157 HG1 THR 157 -3.434 0.366 13.721 1167 HG21 THR 157 HG21 THR 157 -3.099 1.919 10.653 1168 HG22 THR 157 HG22 THR 157 -3.737 2.824 11.831 1169 HG23 THR 157 HG23 THR 157 -4.664 2.323 10.605 1170 H GLU 158 H GLU 158 -4.006 1.418 14.833 1171 HA GLU 158 HA GLU 158 -5.349 3.493 16.045 1172 HB2 GLU 158 HB2 GLU 158 -3.576 1.876 16.928 1173 HB3 GLU 158 HB3 GLU 158 -2.506 3.003 16.425 1174 HG2 GLU 158 HG2 GLU 158 -2.743 3.362 18.659 1175 HG3 GLU 158 HG3 GLU 158 -3.606 4.552 17.948 1176 H ASN 159 H ASN 159 -3.122 3.607 13.525 1177 HA ASN 159 HA ASN 159 -2.622 6.379 14.028 1178 HB2 ASN 159 HB2 ASN 159 -1.006 4.352 12.736 1179 HB3 ASN 159 HB3 ASN 159 -0.685 5.918 12.399 1180 HD21 ASN 159 HD21 ASN 159 1.413 4.552 15.192 1181 HD22 ASN 159 HD22 ASN 159 0.961 3.881 13.661 1182 H ALA 160 H ALA 160 -2.344 7.913 12.290 1183 HA ALA 160 HA ALA 160 -3.848 7.210 9.894 1184 HB1 ALA 160 HB1 ALA 160 -5.094 8.800 11.112 1185 HB2 ALA 160 HB2 ALA 160 -4.515 9.515 9.783 1186 HB3 ALA 160 HB3 ALA 160 -3.809 9.776 11.214 1187 H PHE 161 H PHE 161 -3.018 8.503 7.944 1188 HA PHE 161 HA PHE 161 -0.170 8.803 8.267 1189 HB2 PHE 161 HB2 PHE 161 -1.642 8.143 5.862 1190 HB3 PHE 161 HB3 PHE 161 -0.017 8.306 5.905 1191 HD1 PHE 161 HD1 PHE 161 -2.719 6.104 6.584 1192 HD2 PHE 161 HD2 PHE 161 1.371 6.646 7.084 1193 HE1 PHE 161 HE1 PHE 161 -2.481 3.776 7.193 1194 HE2 PHE 161 HE2 PHE 161 1.616 4.328 7.676 1195 HZ PHE 161 HZ PHE 161 -0.307 2.889 7.736 1196 H TYR 162 H TYR 162 0.825 10.654 8.048 1197 HA TYR 162 HA TYR 162 -0.608 12.809 6.744 1198 HB2 TYR 162 HB2 TYR 162 1.173 12.929 9.011 1199 HB3 TYR 162 HB3 TYR 162 0.713 14.271 8.203 1200 HD1 TYR 162 HD1 TYR 162 -0.469 11.705 10.463 1201 HD2 TYR 162 HD2 TYR 162 -1.471 15.251 8.535 1202 HE1 TYR 162 HE1 TYR 162 -2.393 11.952 11.906 1203 HE2 TYR 162 HE2 TYR 162 -3.409 15.467 9.947 1204 HH TYR 162 HH TYR 162 -4.935 13.944 11.336 1205 H GLN 163 H GLN 163 0.514 13.888 5.078 1206 HA GLN 163 HA GLN 163 3.342 13.537 4.934 1207 HB2 GLN 163 HB2 GLN 163 3.374 12.669 2.754 1208 HB3 GLN 163 HB3 GLN 163 2.455 11.683 3.676 1209 HG2 GLN 163 HG2 GLN 163 0.514 12.773 2.772 1210 HG3 GLN 163 HG3 GLN 163 1.503 13.565 1.743 1211 HE21 GLN 163 HE21 GLN 163 2.206 10.792 -0.301 1212 HE22 GLN 163 HE22 GLN 163 2.855 12.295 0.267 1213 H VAL 164 H VAL 164 4.374 14.928 3.216 1214 HA VAL 164 HA VAL 164 2.638 17.105 2.509 1215 HB VAL 164 HB VAL 164 4.552 18.633 2.663 1216 HG11 VAL 164 HG11 VAL 164 4.472 18.856 5.067 1217 HG12 VAL 164 HG12 VAL 164 3.804 17.388 5.182 1218 HG13 VAL 164 HG13 VAL 164 2.986 18.596 4.484 1219 HG21 VAL 164 HG21 VAL 164 6.504 17.939 3.890 1220 HG22 VAL 164 HG22 VAL 164 6.350 17.054 2.546 1221 HG23 VAL 164 HG23 VAL 164 5.920 16.433 3.975 1222 H ILE 165 H ILE 165 3.006 18.105 0.442 1223 HA ILE 165 HA ILE 165 4.793 16.657 -1.292 1224 HB ILE 165 HB ILE 165 2.163 17.620 -2.118 1225 HG12 ILE 165 HG12 ILE 165 1.930 15.677 -0.817 1226 HG13 ILE 165 HG13 ILE 165 1.462 15.409 -2.358 1227 HG21 ILE 165 HG21 ILE 165 2.619 16.615 -4.281 1228 HG22 ILE 165 HG22 ILE 165 4.101 16.203 -3.779 1229 HG23 ILE 165 HG23 ILE 165 3.714 17.763 -3.964 1230 HD11 ILE 165 HD11 ILE 165 2.685 13.547 -1.541 1231 HD12 ILE 165 HD12 ILE 165 3.958 14.496 -1.236 1232 HD13 ILE 165 HD13 ILE 165 3.495 14.230 -2.762 1233 H ASP 166 H ASP 166 6.356 18.121 -2.019 1234 HA ASP 166 HA ASP 166 5.676 20.878 -1.816 1235 HB2 ASP 166 HB2 ASP 166 8.219 19.599 -2.313 1236 HB3 ASP 166 HB3 ASP 166 8.062 21.224 -2.263 1237 H VAL 167 H VAL 167 5.322 22.293 -3.459 1238 HA VAL 167 HA VAL 167 6.013 21.388 -6.091 1239 HB VAL 167 HB VAL 167 3.915 22.292 -6.991 1240 HG11 VAL 167 HG11 VAL 167 2.512 20.435 -6.333 1241 HG12 VAL 167 HG12 VAL 167 3.512 20.114 -5.103 1242 HG13 VAL 167 HG13 VAL 167 4.014 19.915 -6.627 1243 HG21 VAL 167 HG21 VAL 167 2.089 22.761 -5.494 1244 HG22 VAL 167 HG22 VAL 167 3.312 23.781 -5.215 1245 HG23 VAL 167 HG23 VAL 167 3.064 22.526 -4.226 1246 H ASP 168 H ASP 168 6.356 23.128 -7.669 1247 HA ASP 168 HA ASP 168 6.595 25.766 -6.452 1248 HB2 ASP 168 HB2 ASP 168 8.692 24.412 -7.238 1249 HB3 ASP 168 HB3 ASP 168 8.388 25.377 -8.520 1250 H LEU 169 H LEU 169 5.222 27.177 -7.418 1251 HA LEU 169 HA LEU 169 4.195 26.357 -9.984 1252 HB2 LEU 169 HB2 LEU 169 2.694 27.541 -7.823 1253 HB3 LEU 169 HB3 LEU 169 2.056 27.195 -9.286 1254 HG LEU 169 HG LEU 169 2.986 25.223 -7.404 1255 HD11 LEU 169 HD11 LEU 169 0.660 24.662 -7.119 1256 HD12 LEU 169 HD12 LEU 169 0.250 25.870 -8.113 1257 HD13 LEU 169 HD13 LEU 169 0.923 26.196 -6.679 1258 HD21 LEU 169 HD21 LEU 169 2.043 23.571 -8.873 1259 HD22 LEU 169 HD22 LEU 169 3.213 24.389 -9.632 1260 HD23 LEU 169 HD23 LEU 169 1.662 24.730 -9.935 1261 H VAL 170 H VAL 170 4.067 27.782 -11.623 1262 HA VAL 170 HA VAL 170 4.696 30.491 -10.933 1263 HB VAL 170 HB VAL 170 6.193 30.630 -12.868 1264 HG11 VAL 170 HG11 VAL 170 8.013 29.287 -11.987 1265 HG12 VAL 170 HG12 VAL 170 6.964 28.469 -11.067 1266 HG13 VAL 170 HG13 VAL 170 7.245 30.035 -10.776 1267 HG21 VAL 170 HG21 VAL 170 6.797 28.650 -14.088 1268 HG22 VAL 170 HG22 VAL 170 5.218 28.952 -14.261 1269 HG23 VAL 170 HG23 VAL 170 5.714 27.795 -13.245 1270 H ASN 171 H ASN 171 4.174 32.171 -12.626 1271 HA ASN 171 HA ASN 171 1.669 31.584 -13.798 1272 HB2 ASN 171 HB2 ASN 171 2.229 33.791 -13.003 1273 HB3 ASN 171 HB3 ASN 171 3.253 33.944 -14.265 1274 HD21 ASN 171 HD21 ASN 171 0.625 35.659 -15.780 1275 HD22 ASN 171 HD22 ASN 171 2.124 35.832 -14.930 1276 H LYS 172 H LYS 172 1.216 31.690 -16.145 1277 HA LYS 172 HA LYS 172 3.397 30.622 -17.703 1278 HB2 LYS 172 HB2 LYS 172 1.721 29.911 -19.237 1279 HB3 LYS 172 HB3 LYS 172 1.431 29.323 -17.741 1280 HG2 LYS 172 HG2 LYS 172 -0.642 29.977 -18.197 1281 HG3 LYS 172 HG3 LYS 172 -0.092 31.410 -17.639 1282 HD2 LYS 172 HD2 LYS 172 0.443 31.275 -20.331 1283 HD3 LYS 172 HD3 LYS 172 -1.136 30.923 -20.104 1284 HE2 LYS 172 HE2 LYS 172 -1.496 33.094 -20.072 1285 HE3 LYS 172 HE3 LYS 172 -0.773 33.110 -18.608 1286 HZ1 LYS 172 HZ1 LYS 172 0.227 34.728 -20.030 1287 HZ2 LYS 172 HZ2 LYS 172 0.598 33.576 -21.102 1288 HZ3 LYS 172 HZ3 LYS 172 1.314 33.591 -19.652 Start of MODEL 11 1 H1 HIS 1 H1 HIS 1 3.146 2.501 3.137 2 H2 HIS 1 H2 HIS 1 2.150 1.543 2.297 3 H3 HIS 1 H3 HIS 1 1.584 2.891 2.987 4 HA HIS 1 HA HIS 1 2.848 4.203 1.565 5 HB2 HIS 1 HB2 HIS 1 4.026 3.151 -0.329 6 HB3 HIS 1 HB3 HIS 1 4.722 2.862 1.120 7 HD1 HIS 1 HD1 HIS 1 5.762 0.597 1.025 8 HD2 HIS 1 HD2 HIS 1 2.009 0.727 -0.618 9 HE1 HIS 1 HE1 HIS 1 5.122 -1.703 0.341 10 HE2 HIS 1 HE2 HIS 1 2.862 -1.653 -0.649 11 H GLY 2 H GLY 2 2.344 4.847 -0.629 12 HA2 GLY 2 HA2 GLY 2 0.341 3.364 -2.044 13 HA3 GLY 2 HA3 GLY 2 -0.120 4.846 -1.537 14 H PHE 3 H PHE 3 0.017 4.943 -4.224 15 HA PHE 3 HA PHE 3 2.437 6.343 -4.616 16 HB2 PHE 3 HB2 PHE 3 3.016 5.192 -6.684 17 HB3 PHE 3 HB3 PHE 3 3.150 4.240 -5.364 18 HD1 PHE 3 HD1 PHE 3 1.885 4.388 -8.567 19 HD2 PHE 3 HD2 PHE 3 1.097 2.670 -4.856 20 HE1 PHE 3 HE1 PHE 3 0.561 2.677 -9.642 21 HE2 PHE 3 HE2 PHE 3 -0.264 0.984 -5.918 22 HZ PHE 3 HZ PHE 3 -0.529 0.983 -8.315 23 H ILE 4 H ILE 4 2.633 7.824 -6.299 24 HA ILE 4 HA ILE 4 0.079 8.832 -7.046 25 HB ILE 4 HB ILE 4 2.670 10.174 -7.326 26 HG12 ILE 4 HG12 ILE 4 2.250 9.860 -5.051 27 HG13 ILE 4 HG13 ILE 4 2.128 11.450 -5.403 28 HG21 ILE 4 HG21 ILE 4 1.442 12.227 -7.669 29 HG22 ILE 4 HG22 ILE 4 0.049 11.410 -7.598 30 HG23 ILE 4 HG23 ILE 4 1.071 11.159 -8.825 31 HD11 ILE 4 HD11 ILE 4 0.386 10.815 -3.876 32 HD12 ILE 4 HD12 ILE 4 -0.154 9.711 -4.927 33 HD13 ILE 4 HD13 ILE 4 -0.275 11.285 -5.275 34 H GLU 5 H GLU 5 -0.798 8.497 -9.056 35 HA GLU 5 HA GLU 5 1.028 7.648 -11.090 36 HB2 GLU 5 HB2 GLU 5 -1.874 7.491 -11.022 37 HB3 GLU 5 HB3 GLU 5 -0.996 6.912 -12.271 38 HG2 GLU 5 HG2 GLU 5 -0.611 5.875 -9.647 39 HG3 GLU 5 HG3 GLU 5 -1.810 5.299 -10.595 40 H LYS 6 H LYS 6 -0.615 10.377 -10.231 41 HA LYS 6 HA LYS 6 0.085 11.753 -12.596 42 HB2 LYS 6 HB2 LYS 6 -2.213 10.592 -12.886 43 HB3 LYS 6 HB3 LYS 6 -2.725 11.952 -12.141 44 HG2 LYS 6 HG2 LYS 6 -2.295 13.236 -13.906 45 HG3 LYS 6 HG3 LYS 6 -1.092 12.270 -14.440 46 HD2 LYS 6 HD2 LYS 6 -3.833 11.425 -14.591 47 HD3 LYS 6 HD3 LYS 6 -3.157 12.294 -15.798 48 HE2 LYS 6 HE2 LYS 6 -1.494 10.566 -16.074 49 HE3 LYS 6 HE3 LYS 6 -2.244 9.687 -14.920 50 HZ1 LYS 6 HZ1 LYS 6 -2.856 8.903 -17.069 51 HZ2 LYS 6 HZ2 LYS 6 -3.415 10.370 -17.459 52 HZ3 LYS 6 HZ3 LYS 6 -4.157 9.499 -16.316 53 HA PRO 7 HA PRO 7 0.049 13.989 -13.351 54 HB2 PRO 7 HB2 PRO 7 1.335 16.289 -12.932 55 HB3 PRO 7 HB3 PRO 7 -0.297 16.291 -12.879 56 HG2 PRO 7 HG2 PRO 7 1.522 16.143 -10.697 57 HG3 PRO 7 HG3 PRO 7 0.205 17.097 -10.842 58 HD2 PRO 7 HD2 PRO 7 0.093 14.862 -9.490 59 HD3 PRO 7 HD3 PRO 7 -1.216 15.416 -10.293 60 H GLY 8 H GLY 8 1.542 13.047 -14.484 61 HA2 GLY 8 HA2 GLY 8 3.628 12.280 -14.934 62 HA3 GLY 8 HA3 GLY 8 4.243 13.265 -13.786 63 H SER 9 H SER 9 5.725 11.325 -13.534 64 HA SER 9 HA SER 9 4.649 9.735 -11.390 65 HB2 SER 9 HB2 SER 9 4.528 8.206 -13.178 66 HB3 SER 9 HB3 SER 9 6.057 8.554 -13.633 67 HG SER 9 HG SER 9 6.020 7.776 -11.121 68 H ARG 10 H ARG 10 6.094 9.489 -9.675 69 HA ARG 10 HA ARG 10 8.324 11.115 -9.770 70 HB2 ARG 10 HB2 ARG 10 8.817 10.287 -7.543 71 HB3 ARG 10 HB3 ARG 10 7.270 10.788 -7.698 72 HG2 ARG 10 HG2 ARG 10 6.526 8.563 -7.792 73 HG3 ARG 10 HG3 ARG 10 8.067 8.023 -7.744 74 HD2 ARG 10 HD2 ARG 10 8.337 8.796 -5.553 75 HD3 ARG 10 HD3 ARG 10 6.902 9.574 -5.602 76 HE ARG 10 HE ARG 10 5.767 7.659 -5.133 77 HH11 ARG 10 HH11 ARG 10 9.149 6.894 -5.752 78 HH12 ARG 10 HH12 ARG 10 8.973 5.279 -5.152 79 HH21 ARG 10 HH21 ARG 10 5.648 5.605 -4.358 80 HH22 ARG 10 HH22 ARG 10 7.034 4.567 -4.379 81 H ALA 11 H ALA 11 7.985 7.875 -10.632 82 HA ALA 11 HA ALA 11 10.601 7.064 -10.232 83 HB1 ALA 11 HB1 ALA 11 8.844 5.470 -10.709 84 HB2 ALA 11 HB2 ALA 11 10.057 5.246 -11.754 85 HB3 ALA 11 HB3 ALA 11 8.726 6.038 -12.218 86 H ALA 12 H ALA 12 9.102 8.763 -12.831 87 HA ALA 12 HA ALA 12 11.251 8.594 -14.592 88 HB1 ALA 12 HB1 ALA 12 9.030 9.161 -15.374 89 HB2 ALA 12 HB2 ALA 12 10.065 10.308 -15.851 90 HB3 ALA 12 HB3 ALA 12 9.100 10.568 -14.580 91 H LEU 13 H LEU 13 10.548 10.639 -11.977 92 HA LEU 13 HA LEU 13 12.499 12.578 -12.661 93 HB2 LEU 13 HB2 LEU 13 10.955 12.333 -10.223 94 HB3 LEU 13 HB3 LEU 13 11.848 13.645 -10.606 95 HG LEU 13 HG LEU 13 9.487 12.853 -12.042 96 HD11 LEU 13 HD11 LEU 13 8.407 14.712 -10.911 97 HD12 LEU 13 HD12 LEU 13 9.761 14.983 -10.070 98 HD13 LEU 13 HD13 LEU 13 8.915 13.627 -9.825 99 HD21 LEU 13 HD21 LEU 13 9.612 14.996 -13.107 100 HD22 LEU 13 HD22 LEU 13 10.939 14.132 -13.432 101 HD23 LEU 13 HD23 LEU 13 10.992 15.309 -12.325 102 H CYS 14 H CYS 14 12.665 9.628 -11.455 103 HA CYS 14 HA CYS 14 14.887 10.135 -9.664 104 HB2 CYS 14 HB2 CYS 14 13.023 9.155 -8.688 105 HB3 CYS 14 HB3 CYS 14 13.031 7.980 -9.822 106 H SER 15 H SER 15 14.069 8.954 -12.658 107 HA SER 15 HA SER 15 16.120 7.038 -12.882 108 HB2 SER 15 HB2 SER 15 14.647 8.345 -15.014 109 HB3 SER 15 HB3 SER 15 15.582 7.023 -15.225 110 HG SER 15 HG SER 15 13.106 7.221 -14.191 111 H GLU 16 H GLU 16 18.285 7.318 -13.572 112 HA GLU 16 HA GLU 16 19.124 10.015 -13.539 113 HB2 GLU 16 HB2 GLU 16 20.447 8.262 -12.557 114 HB3 GLU 16 HB3 GLU 16 20.606 7.555 -14.020 115 HG2 GLU 16 HG2 GLU 16 21.812 9.686 -14.607 116 HG3 GLU 16 HG3 GLU 16 22.012 9.799 -12.990 117 H ALA 17 H ALA 17 20.140 7.626 -15.918 118 HA ALA 17 HA ALA 17 19.561 9.581 -17.921 119 HB1 ALA 17 HB1 ALA 17 21.986 9.170 -17.687 120 HB2 ALA 17 HB2 ALA 17 21.507 8.798 -19.186 121 HB3 ALA 17 HB3 ALA 17 21.747 7.625 -18.099 122 H PHE 18 H PHE 18 19.716 6.177 -17.503 123 HA PHE 18 HA PHE 18 18.326 5.849 -19.992 124 HB2 PHE 18 HB2 PHE 18 20.176 3.978 -18.745 125 HB3 PHE 18 HB3 PHE 18 19.477 3.722 -20.199 126 HD1 PHE 18 HD1 PHE 18 19.974 5.500 -22.037 127 HD2 PHE 18 HD2 PHE 18 22.337 4.891 -18.667 128 HE1 PHE 18 HE1 PHE 18 21.805 6.628 -23.128 129 HE2 PHE 18 HE2 PHE 18 24.178 6.021 -19.746 130 HZ PHE 18 HZ PHE 18 23.906 6.910 -21.975 131 H GLY 19 H GLY 19 17.017 6.189 -17.450 132 HA2 GLY 19 HA2 GLY 19 15.055 5.200 -16.716 133 HA3 GLY 19 HA3 GLY 19 15.367 3.854 -17.587 134 H PHE 20 H PHE 20 17.610 5.324 -15.489 135 HA PHE 20 HA PHE 20 18.529 4.708 -13.625 136 HB2 PHE 20 HB2 PHE 20 16.088 4.761 -12.900 137 HB3 PHE 20 HB3 PHE 20 16.266 3.147 -12.726 138 HD1 PHE 20 HD1 PHE 20 16.902 2.300 -10.648 139 HD2 PHE 20 HD2 PHE 20 17.851 6.222 -11.635 140 HE1 PHE 20 HE1 PHE 20 17.784 2.638 -8.437 141 HE2 PHE 20 HE2 PHE 20 18.730 6.575 -9.438 142 HZ PHE 20 HZ PHE 20 18.686 4.788 -7.818 143 H LEU 21 H LEU 21 19.170 3.039 -15.739 144 HA LEU 21 HA LEU 21 19.588 0.463 -14.748 145 HB2 LEU 21 HB2 LEU 21 21.133 1.866 -16.735 146 HB3 LEU 21 HB3 LEU 21 21.246 0.259 -16.462 147 HG LEU 21 HG LEU 21 18.917 1.561 -17.536 148 HD11 LEU 21 HD11 LEU 21 19.548 0.490 -19.623 149 HD12 LEU 21 HD12 LEU 21 20.876 -0.100 -18.914 150 HD13 LEU 21 HD13 LEU 21 20.721 1.493 -19.142 151 HD21 LEU 21 HD21 LEU 21 18.044 -0.625 -17.951 152 HD22 LEU 21 HD22 LEU 21 18.269 -0.402 -16.365 153 HD23 LEU 21 HD23 LEU 21 19.326 -1.282 -17.216 154 H ASN 22 H ASN 22 20.889 3.436 -14.052 155 HA ASN 22 HA ASN 22 23.112 2.326 -12.566 156 HB2 ASN 22 HB2 ASN 22 22.948 4.953 -13.765 157 HB3 ASN 22 HB3 ASN 22 24.194 4.458 -12.832 158 HD21 ASN 22 HD21 ASN 22 26.002 3.096 -15.395 159 HD22 ASN 22 HD22 ASN 22 25.958 3.683 -13.766 160 H LEU 23 H LEU 23 23.194 2.854 -10.349 161 HA LEU 23 HA LEU 23 20.813 3.995 -9.378 162 HB2 LEU 23 HB2 LEU 23 22.967 2.577 -8.150 163 HB3 LEU 23 HB3 LEU 23 22.065 3.513 -7.161 164 HG LEU 23 HG LEU 23 20.138 2.252 -8.016 165 HD11 LEU 23 HD11 LEU 23 20.534 0.028 -8.797 166 HD12 LEU 23 HD12 LEU 23 22.121 0.330 -8.852 167 HD13 LEU 23 HD13 LEU 23 21.114 1.116 -9.844 168 HD21 LEU 23 HD21 LEU 23 20.486 0.503 -6.349 169 HD22 LEU 23 HD22 LEU 23 20.959 1.935 -5.766 170 HD23 LEU 23 HD23 LEU 23 22.058 0.877 -6.302 171 H ASN 24 H ASN 24 20.498 6.093 -9.182 172 HA ASN 24 HA ASN 24 22.482 7.644 -7.858 173 HB2 ASN 24 HB2 ASN 24 22.807 7.695 -10.381 174 HB3 ASN 24 HB3 ASN 24 21.544 8.729 -10.362 175 HD21 ASN 24 HD21 ASN 24 24.698 10.618 -10.355 176 HD22 ASN 24 HD22 ASN 24 23.957 9.455 -11.402 177 H CYS 25 H CYS 25 20.173 6.985 -6.697 178 HA CYS 25 HA CYS 25 18.719 9.452 -6.601 179 HB2 CYS 25 HB2 CYS 25 17.752 7.992 -8.251 180 HB3 CYS 25 HB3 CYS 25 17.400 6.957 -7.037 181 H GLY 26 H GLY 26 20.270 7.332 -4.888 182 HA2 GLY 26 HA2 GLY 26 20.286 7.063 -2.629 183 HA3 GLY 26 HA3 GLY 26 18.960 8.005 -2.484 184 H SER 27 H SER 27 19.016 5.997 -0.743 185 HA SER 27 HA SER 27 17.883 3.681 -1.865 186 HB2 SER 27 HB2 SER 27 19.307 3.575 0.132 187 HB3 SER 27 HB3 SER 27 18.129 4.322 0.981 188 HG SER 27 HG SER 27 16.785 2.557 0.563 189 H VAL 28 H VAL 28 16.623 6.420 -0.277 190 HA VAL 28 HA VAL 28 14.243 5.311 0.484 191 HB VAL 28 HB VAL 28 14.197 8.169 -0.022 192 HG11 VAL 28 HG11 VAL 28 13.292 8.307 2.214 193 HG12 VAL 28 HG12 VAL 28 13.550 6.724 2.418 194 HG13 VAL 28 HG13 VAL 28 12.454 7.233 1.343 195 HG21 VAL 28 HG21 VAL 28 15.741 8.725 1.756 196 HG22 VAL 28 HG22 VAL 28 16.514 7.909 0.594 197 HG23 VAL 28 HG23 VAL 28 16.080 7.157 1.959 198 H MET 29 H MET 29 15.187 5.984 -2.514 199 HA MET 29 HA MET 29 13.159 7.190 -3.723 200 HB2 MET 29 HB2 MET 29 14.030 6.074 -5.770 201 HB3 MET 29 HB3 MET 29 15.259 6.571 -4.815 202 HG2 MET 29 HG2 MET 29 15.450 4.422 -3.941 203 HG3 MET 29 HG3 MET 29 14.217 3.924 -4.890 204 HE1 MET 29 HE1 MET 29 17.631 2.319 -6.173 205 HE2 MET 29 HE2 MET 29 16.255 1.939 -5.412 206 HE3 MET 29 HE3 MET 29 17.382 2.818 -4.655 207 H TYR 30 H TYR 30 12.776 4.061 -2.549 208 HA TYR 30 HA TYR 30 10.987 3.300 -4.587 209 HB2 TYR 30 HB2 TYR 30 12.273 1.620 -3.486 210 HB3 TYR 30 HB3 TYR 30 11.594 2.011 -2.053 211 HD1 TYR 30 HD1 TYR 30 10.824 0.506 -5.269 212 HD2 TYR 30 HD2 TYR 30 9.581 0.967 -1.329 213 HE1 TYR 30 HE1 TYR 30 9.075 -1.133 -5.621 214 HE2 TYR 30 HE2 TYR 30 7.830 -0.644 -1.686 215 HH TYR 30 HH TYR 30 6.480 -1.517 -3.913 216 H GLU 31 H GLU 31 10.620 4.455 -1.334 217 HA GLU 31 HA GLU 31 8.006 5.239 -1.997 218 HB2 GLU 31 HB2 GLU 31 6.947 4.204 -0.051 219 HB3 GLU 31 HB3 GLU 31 7.419 3.136 -1.193 220 HG2 GLU 31 HG2 GLU 31 9.342 2.618 0.182 221 HG3 GLU 31 HG3 GLU 31 8.705 3.565 1.349 222 HA PRO 32 HA PRO 32 9.984 8.045 0.919 223 HB2 PRO 32 HB2 PRO 32 10.323 10.225 -0.542 224 HB3 PRO 32 HB3 PRO 32 11.408 9.016 -0.710 225 HG2 PRO 32 HG2 PRO 32 9.140 9.565 -2.350 226 HG3 PRO 32 HG3 PRO 32 10.673 9.271 -2.831 227 HD2 PRO 32 HD2 PRO 32 8.898 7.354 -2.842 228 HD3 PRO 32 HD3 PRO 32 10.464 7.024 -2.516 229 H GLN 33 H GLN 33 7.242 7.919 -0.792 230 HA GLN 33 HA GLN 33 6.057 10.114 0.549 231 HB2 GLN 33 HB2 GLN 33 4.186 9.782 -0.884 232 HB3 GLN 33 HB3 GLN 33 5.550 9.768 -1.782 233 HG2 GLN 33 HG2 GLN 33 5.443 7.422 -1.944 234 HG3 GLN 33 HG3 GLN 33 4.115 7.402 -0.995 235 HE21 GLN 33 HE21 GLN 33 1.877 8.571 -3.448 236 HE22 GLN 33 HE22 GLN 33 2.172 8.546 -1.741 237 H SER 34 H SER 34 6.710 7.167 1.573 238 HA SER 34 HA SER 34 4.124 6.648 2.702 239 HB2 SER 34 HB2 SER 34 5.777 4.863 1.911 240 HB3 SER 34 HB3 SER 34 6.413 5.038 3.405 241 HG SER 34 HG SER 34 3.781 4.778 3.495 242 H LEU 35 H LEU 35 3.795 8.377 4.135 243 HA LEU 35 HA LEU 35 5.566 8.370 6.422 244 HB2 LEU 35 HB2 LEU 35 3.959 10.601 5.609 245 HB3 LEU 35 HB3 LEU 35 5.053 10.601 6.822 246 HG LEU 35 HG LEU 35 5.813 10.290 4.065 247 HD11 LEU 35 HD11 LEU 35 6.442 12.619 4.087 248 HD12 LEU 35 HD12 LEU 35 5.833 12.769 5.577 249 HD13 LEU 35 HD13 LEU 35 4.850 12.471 4.328 250 HD21 LEU 35 HD21 LEU 35 8.025 10.819 4.819 251 HD22 LEU 35 HD22 LEU 35 7.479 9.496 5.571 252 HD23 LEU 35 HD23 LEU 35 7.487 10.918 6.341 253 H GLU 36 H GLU 36 4.664 7.004 7.912 254 HA GLU 36 HA GLU 36 1.933 7.579 8.555 255 HB2 GLU 36 HB2 GLU 36 1.765 5.120 9.135 256 HB3 GLU 36 HB3 GLU 36 1.520 5.608 7.596 257 HG2 GLU 36 HG2 GLU 36 4.174 4.928 7.970 258 HG3 GLU 36 HG3 GLU 36 3.203 3.681 8.382 259 H ALA 37 H ALA 37 1.248 7.424 10.705 260 HA ALA 37 HA ALA 37 3.348 6.974 12.629 261 HB1 ALA 37 HB1 ALA 37 3.186 9.352 12.362 262 HB2 ALA 37 HB2 ALA 37 2.666 8.954 13.840 263 HB3 ALA 37 HB3 ALA 37 1.600 9.294 12.672 264 H LYS 38 H LYS 38 2.699 6.078 14.632 265 HA LYS 38 HA LYS 38 0.057 4.998 14.549 266 HB2 LYS 38 HB2 LYS 38 1.897 3.523 15.086 267 HB3 LYS 38 HB3 LYS 38 2.143 4.368 16.462 268 HG2 LYS 38 HG2 LYS 38 0.082 3.699 17.298 269 HG3 LYS 38 HG3 LYS 38 -0.292 2.971 15.885 270 HD2 LYS 38 HD2 LYS 38 1.364 1.340 16.290 271 HD3 LYS 38 HD3 LYS 38 1.730 2.066 17.706 272 HE2 LYS 38 HE2 LYS 38 -0.495 1.754 18.450 273 HE3 LYS 38 HE3 LYS 38 -0.877 1.050 17.027 274 HZ1 LYS 38 HZ1 LYS 38 -0.691 -0.559 18.711 275 HZ2 LYS 38 HZ2 LYS 38 0.833 -0.105 19.004 276 HZ3 LYS 38 HZ3 LYS 38 0.454 -0.802 17.595 277 H LYS 39 H LYS 39 -1.613 5.379 16.013 278 HA LYS 39 HA LYS 39 -1.481 7.729 17.527 279 HB2 LYS 39 HB2 LYS 39 -3.438 5.600 17.662 280 HB3 LYS 39 HB3 LYS 39 -3.655 7.082 18.314 281 HG2 LYS 39 HG2 LYS 39 -3.797 8.057 16.193 282 HG3 LYS 39 HG3 LYS 39 -3.382 6.651 15.474 283 HD2 LYS 39 HD2 LYS 39 -5.430 5.688 16.378 284 HD3 LYS 39 HD3 LYS 39 -5.859 7.192 16.847 285 HE2 LYS 39 HE2 LYS 39 -6.943 6.923 14.846 286 HE3 LYS 39 HE3 LYS 39 -5.636 7.819 14.454 287 HZ1 LYS 39 HZ1 LYS 39 -5.934 6.074 12.871 288 HZ2 LYS 39 HZ2 LYS 39 -5.834 4.971 14.050 289 HZ3 LYS 39 HZ3 LYS 39 -4.539 5.858 13.662 290 H GLY 40 H GLY 40 -0.916 8.060 19.705 291 HA2 GLY 40 HA2 GLY 40 -1.217 6.534 21.798 292 HA3 GLY 40 HA3 GLY 40 0.041 5.755 21.105 293 H PHE 41 H PHE 41 -0.241 7.219 23.675 294 HA PHE 41 HA PHE 41 1.539 9.411 23.300 295 HB2 PHE 41 HB2 PHE 41 0.177 8.477 25.676 296 HB3 PHE 41 HB3 PHE 41 1.141 9.795 25.681 297 HD1 PHE 41 HD1 PHE 41 -2.129 8.777 25.394 298 HD2 PHE 41 HD2 PHE 41 0.501 11.652 23.927 299 HE1 PHE 41 HE1 PHE 41 -4.004 10.148 24.733 300 HE2 PHE 41 HE2 PHE 41 -1.364 13.023 23.247 301 HZ PHE 41 HZ PHE 41 -3.622 12.264 23.637 302 HA PRO 42 HA PRO 42 3.097 10.647 24.721 303 HB2 PRO 42 HB2 PRO 42 5.704 11.174 24.584 304 HB3 PRO 42 HB3 PRO 42 5.087 10.656 26.004 305 HG2 PRO 42 HG2 PRO 42 6.407 9.106 24.006 306 HG3 PRO 42 HG3 PRO 42 6.678 9.101 25.616 307 HD2 PRO 42 HD2 PRO 42 5.166 7.266 24.536 308 HD3 PRO 42 HD3 PRO 42 4.839 7.816 26.038 309 H HIS 43 H HIS 43 4.673 8.726 22.467 310 HA HIS 43 HA HIS 43 3.506 9.487 20.238 311 HB2 HIS 43 HB2 HIS 43 5.000 10.927 18.988 312 HB3 HIS 43 HB3 HIS 43 4.146 11.689 20.153 313 HD1 HIS 43 HD1 HIS 43 7.560 10.964 19.069 314 HD2 HIS 43 HD2 HIS 43 5.712 12.584 22.346 315 HE1 HIS 43 HE1 HIS 43 9.280 12.083 20.472 316 HE2 HIS 43 HE2 HIS 43 8.189 13.068 22.453 317 H SER 44 H SER 44 6.589 9.063 21.670 318 HA SER 44 HA SER 44 8.201 7.652 21.464 319 HB2 SER 44 HB2 SER 44 6.446 5.785 20.053 320 HB3 SER 44 HB3 SER 44 7.741 5.346 20.946 321 HG SER 44 HG SER 44 5.264 5.942 21.740 322 H GLY 45 H GLY 45 6.781 7.805 18.306 323 HA2 GLY 45 HA2 GLY 45 9.286 7.525 16.992 324 HA3 GLY 45 HA3 GLY 45 7.857 7.885 16.289 325 HA PRO 46 HA PRO 46 10.058 11.870 16.442 326 HB2 PRO 46 HB2 PRO 46 9.325 12.835 14.088 327 HB3 PRO 46 HB3 PRO 46 10.569 11.779 14.140 328 HG2 PRO 46 HG2 PRO 46 7.835 11.222 13.565 329 HG3 PRO 46 HG3 PRO 46 9.149 10.762 12.711 330 HD2 PRO 46 HD2 PRO 46 8.070 9.096 14.389 331 HD3 PRO 46 HD3 PRO 46 9.694 9.121 14.218 332 H ALA 47 H ALA 47 8.999 14.215 16.056 333 HA ALA 47 HA ALA 47 6.544 14.072 17.493 334 HB1 ALA 47 HB1 ALA 47 7.988 15.918 17.933 335 HB2 ALA 47 HB2 ALA 47 6.588 16.491 17.364 336 HB3 ALA 47 HB3 ALA 47 7.880 16.406 16.395 337 H ASP 48 H ASP 48 4.908 13.145 16.327 338 HA ASP 48 HA ASP 48 4.575 13.931 13.592 339 HB2 ASP 48 HB2 ASP 48 3.562 11.695 15.112 340 HB3 ASP 48 HB3 ASP 48 2.906 12.048 13.658 341 H GLY 49 H GLY 49 2.431 14.459 12.723 342 HA2 GLY 49 HA2 GLY 49 0.360 15.341 12.957 343 HA3 GLY 49 HA3 GLY 49 0.370 14.986 14.551 344 H GLN 50 H GLN 50 3.055 16.746 14.044 345 HA GLN 50 HA GLN 50 2.024 18.918 15.397 346 HB2 GLN 50 HB2 GLN 50 4.576 18.595 14.070 347 HB3 GLN 50 HB3 GLN 50 4.240 19.935 14.942 348 HG2 GLN 50 HG2 GLN 50 4.147 17.341 16.157 349 HG3 GLN 50 HG3 GLN 50 5.551 18.172 16.071 350 HE21 GLN 50 HE21 GLN 50 5.007 19.862 19.008 351 HE22 GLN 50 HE22 GLN 50 6.121 19.117 17.911 352 H ILE 51 H ILE 51 1.830 18.247 12.189 353 HA ILE 51 HA ILE 51 1.731 20.805 11.148 354 HB ILE 51 HB ILE 51 0.318 18.434 10.191 355 HG12 ILE 51 HG12 ILE 51 2.672 18.143 10.184 356 HG13 ILE 51 HG13 ILE 51 2.065 18.105 8.668 357 HG21 ILE 51 HG21 ILE 51 0.062 19.543 8.063 358 HG22 ILE 51 HG22 ILE 51 0.723 20.884 8.678 359 HG23 ILE 51 HG23 ILE 51 -0.712 20.369 9.217 360 HD11 ILE 51 HD11 ILE 51 4.130 19.351 8.691 361 HD12 ILE 51 HD12 ILE 51 3.517 20.375 9.782 362 HD13 ILE 51 HD13 ILE 51 2.916 20.338 8.281 363 H ALA 52 H ALA 52 -0.649 18.764 12.674 364 HA ALA 52 HA ALA 52 -2.805 20.514 12.329 365 HB1 ALA 52 HB1 ALA 52 -3.183 18.168 12.767 366 HB2 ALA 52 HB2 ALA 52 -3.964 19.045 13.879 367 HB3 ALA 52 HB3 ALA 52 -2.560 18.334 14.250 368 H SER 53 H SER 53 -0.421 20.100 14.766 369 HA SER 53 HA SER 53 -1.504 21.932 16.578 370 HB2 SER 53 HB2 SER 53 1.325 21.266 16.452 371 HB3 SER 53 HB3 SER 53 0.473 21.606 17.803 372 HG SER 53 HG SER 53 0.137 19.612 18.041 373 H ALA 54 H ALA 54 -0.282 22.337 13.649 374 HA ALA 54 HA ALA 54 0.595 23.944 12.460 375 HB1 ALA 54 HB1 ALA 54 -1.340 25.197 13.177 376 HB2 ALA 54 HB2 ALA 54 -0.112 26.204 12.872 377 HB3 ALA 54 HB3 ALA 54 -0.483 25.821 14.398 378 H GLY 55 H GLY 55 2.193 22.853 14.715 379 HA2 GLY 55 HA2 GLY 55 4.144 24.915 15.091 380 HA3 GLY 55 HA3 GLY 55 4.178 23.423 15.756 381 H GLY 56 H GLY 56 3.539 22.219 13.134 382 HA2 GLY 56 HA2 GLY 56 6.151 21.712 12.315 383 HA3 GLY 56 HA3 GLY 56 4.794 21.220 11.550 384 H LEU 57 H LEU 57 4.089 24.228 11.511 385 HA LEU 57 HA LEU 57 4.820 24.748 8.927 386 HB2 LEU 57 HB2 LEU 57 4.117 26.607 11.030 387 HB3 LEU 57 HB3 LEU 57 4.268 27.085 9.476 388 HG LEU 57 HG LEU 57 2.240 25.234 10.328 389 HD11 LEU 57 HD11 LEU 57 0.742 27.131 10.272 390 HD12 LEU 57 HD12 LEU 57 1.987 28.106 9.934 391 HD13 LEU 57 HD13 LEU 57 1.896 27.381 11.377 392 HD21 LEU 57 HD21 LEU 57 1.212 25.705 8.232 393 HD22 LEU 57 HD22 LEU 57 2.690 25.092 7.997 394 HD23 LEU 57 HD23 LEU 57 2.439 26.682 7.837 395 H PHE 58 H PHE 58 6.278 25.714 11.909 396 HA PHE 58 HA PHE 58 8.238 27.321 10.771 397 HB2 PHE 58 HB2 PHE 58 8.350 26.082 13.390 398 HB3 PHE 58 HB3 PHE 58 9.118 27.458 12.961 399 HD1 PHE 58 HD1 PHE 58 6.459 26.308 14.726 400 HD2 PHE 58 HD2 PHE 58 7.441 29.374 12.089 401 HE1 PHE 58 HE1 PHE 58 4.553 27.569 15.494 402 HE2 PHE 58 HE2 PHE 58 5.536 30.648 12.850 403 HZ PHE 58 HZ PHE 58 4.077 29.736 14.543 404 H GLY 59 H GLY 59 8.057 23.974 11.317 405 HA2 GLY 59 HA2 GLY 59 10.786 23.413 11.196 406 HA3 GLY 59 HA3 GLY 59 9.579 22.347 10.920 407 H GLY 60 H GLY 60 8.383 23.868 8.761 408 HA2 GLY 60 HA2 GLY 60 9.851 22.831 6.640 409 HA3 GLY 60 HA3 GLY 60 8.591 23.863 6.512 410 H ILE 61 H ILE 61 10.106 25.791 8.267 411 HA ILE 61 HA ILE 61 11.325 27.220 6.215 412 HB ILE 61 HB ILE 61 11.574 27.715 9.087 413 HG12 ILE 61 HG12 ILE 61 9.309 27.786 8.460 414 HG13 ILE 61 HG13 ILE 61 9.816 29.276 8.895 415 HG21 ILE 61 HG21 ILE 61 12.202 29.983 8.537 416 HG22 ILE 61 HG22 ILE 61 12.155 29.618 6.963 417 HG23 ILE 61 HG23 ILE 61 13.274 28.944 7.916 418 HD11 ILE 61 HD11 ILE 61 8.390 29.432 6.962 419 HD12 ILE 61 HD12 ILE 61 9.375 28.451 6.137 420 HD13 ILE 61 HD13 ILE 61 9.878 29.926 6.567 421 H LEU 62 H LEU 62 12.463 25.176 8.754 422 HA LEU 62 HA LEU 62 15.170 25.681 8.209 423 HB2 LEU 62 HB2 LEU 62 13.814 23.908 10.017 424 HB3 LEU 62 HB3 LEU 62 15.412 23.672 9.774 425 HG LEU 62 HG LEU 62 15.797 25.875 10.656 426 HD11 LEU 62 HD11 LEU 62 14.121 26.963 11.957 427 HD12 LEU 62 HD12 LEU 62 13.029 25.874 11.469 428 HD13 LEU 62 HD13 LEU 62 13.682 26.899 10.402 429 HD21 LEU 62 HD21 LEU 62 15.492 25.144 12.975 430 HD22 LEU 62 HD22 LEU 62 16.057 23.921 12.080 431 HD23 LEU 62 HD23 LEU 62 14.488 23.984 12.465 432 H ASP 63 H ASP 63 12.962 23.082 7.599 433 HA ASP 63 HA ASP 63 14.951 21.379 6.647 434 HB2 ASP 63 HB2 ASP 63 12.736 20.721 7.648 435 HB3 ASP 63 HB3 ASP 63 12.117 20.962 6.156 436 H GLN 64 H GLN 64 13.709 23.948 5.115 437 HA GLN 64 HA GLN 64 13.165 22.900 2.649 438 HB2 GLN 64 HB2 GLN 64 13.160 25.086 1.798 439 HB3 GLN 64 HB3 GLN 64 12.565 25.154 3.317 440 HG2 GLN 64 HG2 GLN 64 14.662 25.960 4.079 441 HG3 GLN 64 HG3 GLN 64 15.212 25.941 2.541 442 HE21 GLN 64 HE21 GLN 64 13.482 29.176 3.862 443 HE22 GLN 64 HE22 GLN 64 14.194 27.922 4.821 444 H GLN 65 H GLN 65 16.159 23.224 4.058 445 HA GLN 65 HA GLN 65 17.373 22.301 1.603 446 HB2 GLN 65 HB2 GLN 65 18.077 24.563 2.024 447 HB3 GLN 65 HB3 GLN 65 18.780 24.041 3.402 448 HG2 GLN 65 HG2 GLN 65 20.267 22.697 2.156 449 HG3 GLN 65 HG3 GLN 65 19.540 23.157 0.768 450 HE21 GLN 65 HE21 GLN 65 22.682 25.103 1.715 451 HE22 GLN 65 HE22 GLN 65 22.304 23.439 2.012 452 H SER 66 H SER 66 16.952 20.168 2.380 453 HA SER 66 HA SER 66 18.730 19.278 4.444 454 HB2 SER 66 HB2 SER 66 16.748 19.717 5.685 455 HB3 SER 66 HB3 SER 66 15.844 18.913 4.587 456 HG SER 66 HG SER 66 16.878 17.987 6.736 457 H GLU 67 H GLU 67 19.186 17.010 4.415 458 HA GLU 67 HA GLU 67 19.050 15.913 1.852 459 HB2 GLU 67 HB2 GLU 67 20.703 15.524 3.777 460 HB3 GLU 67 HB3 GLU 67 19.697 14.290 4.138 461 HG2 GLU 67 HG2 GLU 67 21.368 13.345 2.911 462 HG3 GLU 67 HG3 GLU 67 20.109 13.461 1.878 463 H ASN 68 H ASN 68 17.086 15.684 4.593 464 HA ASN 68 HA ASN 68 15.749 13.337 3.643 465 HB2 ASN 68 HB2 ASN 68 15.489 14.744 6.176 466 HB3 ASN 68 HB3 ASN 68 14.629 13.399 5.831 467 HD21 ASN 68 HD21 ASN 68 18.079 13.012 7.559 468 HD22 ASN 68 HD22 ASN 68 17.118 14.452 7.509 469 H ARG 69 H ARG 69 15.525 16.321 2.847 470 HA ARG 69 HA ARG 69 12.886 17.042 3.294 471 HB2 ARG 69 HB2 ARG 69 14.785 18.459 2.548 472 HB3 ARG 69 HB3 ARG 69 14.454 17.927 1.040 473 HG2 ARG 69 HG2 ARG 69 12.226 18.983 1.306 474 HG3 ARG 69 HG3 ARG 69 12.840 19.725 2.625 475 HD2 ARG 69 HD2 ARG 69 13.064 21.166 0.814 476 HD3 ARG 69 HD3 ARG 69 14.557 20.653 1.232 477 HE ARG 69 HE ARG 69 13.307 19.056 -0.763 478 HH11 ARG 69 HH11 ARG 69 15.402 21.853 -0.308 479 HH12 ARG 69 HH12 ARG 69 16.099 21.681 -1.884 480 HH21 ARG 69 HH21 ARG 69 14.274 18.875 -2.715 481 HH22 ARG 69 HH22 ARG 69 15.470 20.020 -3.225 482 H TRP 70 H TRP 70 11.298 17.496 1.564 483 HA TRP 70 HA TRP 70 10.779 15.144 0.030 484 HB2 TRP 70 HB2 TRP 70 8.678 16.427 -0.371 485 HB3 TRP 70 HB3 TRP 70 8.944 16.038 1.193 486 HD1 TRP 70 HD1 TRP 70 9.114 19.019 -1.049 487 HE1 TRP 70 HE1 TRP 70 9.143 21.197 0.190 488 HE3 TRP 70 HE3 TRP 70 9.469 17.104 3.552 489 HZ2 TRP 70 HZ2 TRP 70 9.364 21.922 2.902 490 HZ3 TRP 70 HZ3 TRP 70 9.627 18.616 5.438 491 HH2 TRP 70 HH2 TRP 70 9.572 21.006 5.101 492 H PHE 71 H PHE 71 10.015 15.473 -2.300 493 HA PHE 71 HA PHE 71 11.983 16.974 -3.618 494 HB2 PHE 71 HB2 PHE 71 11.047 16.139 -5.639 495 HB3 PHE 71 HB3 PHE 71 11.206 14.922 -4.562 496 HD1 PHE 71 HD1 PHE 71 9.242 13.836 -3.582 497 HD2 PHE 71 HD2 PHE 71 8.852 16.918 -6.354 498 HE1 PHE 71 HE1 PHE 71 6.905 13.301 -3.837 499 HE2 PHE 71 HE2 PHE 71 6.514 16.391 -6.621 500 HZ PHE 71 HZ PHE 71 5.539 14.566 -5.375 501 H LYS 72 H LYS 72 11.741 18.768 -5.043 502 HA LYS 72 HA LYS 72 9.264 20.250 -4.691 503 HB2 LYS 72 HB2 LYS 72 11.891 21.386 -5.027 504 HB3 LYS 72 HB3 LYS 72 10.514 22.259 -4.939 505 HG2 LYS 72 HG2 LYS 72 10.211 21.449 -2.691 506 HG3 LYS 72 HG3 LYS 72 11.673 20.728 -2.795 507 HD2 LYS 72 HD2 LYS 72 11.980 22.716 -1.637 508 HD3 LYS 72 HD3 LYS 72 12.654 22.918 -3.111 509 HE2 LYS 72 HE2 LYS 72 10.941 24.285 -3.818 510 HE3 LYS 72 HE3 LYS 72 9.968 23.824 -2.589 511 HZ1 LYS 72 HZ1 LYS 72 10.803 26.002 -2.196 512 HZ2 LYS 72 HZ2 LYS 72 12.320 25.448 -2.277 513 HZ3 LYS 72 HZ3 LYS 72 11.357 24.991 -1.062 514 H HIS 73 H HIS 73 8.113 20.449 -6.615 515 HA HIS 73 HA HIS 73 9.702 20.124 -8.993 516 HB2 HIS 73 HB2 HIS 73 8.219 18.240 -8.563 517 HB3 HIS 73 HB3 HIS 73 6.949 19.249 -8.754 518 HD1 HIS 73 HD1 HIS 73 9.640 17.563 -10.699 519 HD2 HIS 73 HD2 HIS 73 6.237 19.740 -11.386 520 HE1 HIS 73 HE1 HIS 73 9.155 17.526 -13.143 521 HE2 HIS 73 HE2 HIS 73 7.106 18.832 -13.575 522 H ILE 74 H ILE 74 9.764 21.697 -10.486 523 HA ILE 74 HA ILE 74 8.189 23.964 -10.135 524 HB ILE 74 HB ILE 74 9.784 23.292 -12.490 525 HG12 ILE 74 HG12 ILE 74 10.609 24.976 -10.293 526 HG13 ILE 74 HG13 ILE 74 11.036 23.403 -10.404 527 HG21 ILE 74 HG21 ILE 74 9.760 25.658 -13.011 528 HG22 ILE 74 HG22 ILE 74 8.798 25.934 -11.741 529 HG23 ILE 74 HG23 ILE 74 8.247 25.087 -13.003 530 HD11 ILE 74 HD11 ILE 74 12.841 24.794 -11.146 531 HD12 ILE 74 HD12 ILE 74 11.887 25.454 -12.274 532 HD13 ILE 74 HD13 ILE 74 12.310 23.897 -12.383 533 H MET 75 H MET 75 6.215 24.573 -10.982 534 HA MET 75 HA MET 75 5.120 23.099 -13.180 535 HB2 MET 75 HB2 MET 75 4.561 21.908 -11.075 536 HB3 MET 75 HB3 MET 75 3.588 23.177 -10.745 537 HG2 MET 75 HG2 MET 75 2.267 22.723 -12.517 538 HG3 MET 75 HG3 MET 75 3.313 21.600 -13.075 539 HE1 MET 75 HE1 MET 75 0.771 21.074 -9.311 540 HE2 MET 75 HE2 MET 75 0.660 22.358 -10.288 541 HE3 MET 75 HE3 MET 75 1.996 22.126 -9.406 542 H THR 76 H THR 76 3.184 24.182 -14.106 543 HA THR 76 HA THR 76 3.269 26.964 -13.466 544 HB THR 76 HB THR 76 1.878 27.165 -15.541 545 HG1 THR 76 HG1 THR 76 0.940 25.359 -15.988 546 HG21 THR 76 HG21 THR 76 3.701 26.678 -17.031 547 HG22 THR 76 HG22 THR 76 4.417 25.785 -15.889 548 HG23 THR 76 HG23 THR 76 4.299 27.387 -15.707 549 H GLY 77 H GLY 77 1.177 28.259 -13.365 550 HA2 GLY 77 HA2 GLY 77 -0.582 27.026 -11.565 551 HA3 GLY 77 HA3 GLY 77 -0.763 28.510 -12.222 552 H GLY 78 H GLY 78 -3.044 27.202 -11.823 553 HA2 GLY 78 HA2 GLY 78 -4.765 27.162 -13.519 554 HA3 GLY 78 HA3 GLY 78 -3.769 26.289 -14.475 555 H GLU 79 H GLU 79 -5.739 24.858 -14.618 556 HA GLU 79 HA GLU 79 -6.315 23.406 -12.307 557 HB2 GLU 79 HB2 GLU 79 -7.324 23.459 -14.913 558 HB3 GLU 79 HB3 GLU 79 -7.273 21.929 -14.345 559 HG2 GLU 79 HG2 GLU 79 -8.459 23.032 -12.364 560 HG3 GLU 79 HG3 GLU 79 -8.949 24.051 -13.542 561 H HIS 80 H HIS 80 -5.711 21.373 -11.610 562 HA HIS 80 HA HIS 80 -3.935 19.867 -13.327 563 HB2 HIS 80 HB2 HIS 80 -3.400 20.388 -10.538 564 HB3 HIS 80 HB3 HIS 80 -2.497 19.410 -11.485 565 HD1 HIS 80 HD1 HIS 80 -0.888 20.505 -13.284 566 HD2 HIS 80 HD2 HIS 80 -2.856 23.101 -10.798 567 HE1 HIS 80 HE1 HIS 80 0.151 22.757 -13.499 568 HE2 HIS 80 HE2 HIS 80 -1.031 24.336 -12.027 569 H THR 81 H THR 81 -3.891 17.529 -12.793 570 HA THR 81 HA THR 81 -6.231 16.771 -11.272 571 HB THR 81 HB THR 81 -5.396 15.420 -13.713 572 HG1 THR 81 HG1 THR 81 -6.367 17.507 -13.993 573 HG21 THR 81 HG21 THR 81 -7.443 14.181 -13.511 574 HG22 THR 81 HG22 THR 81 -7.800 14.962 -12.141 575 HG23 THR 81 HG23 THR 81 -6.556 13.930 -12.183 576 H PHE 82 H PHE 82 -5.807 15.502 -9.574 577 HA PHE 82 HA PHE 82 -3.298 14.081 -9.594 578 HB2 PHE 82 HB2 PHE 82 -4.696 15.309 -7.381 579 HB3 PHE 82 HB3 PHE 82 -3.514 14.214 -7.113 580 HD1 PHE 82 HD1 PHE 82 -1.289 14.908 -6.896 581 HD2 PHE 82 HD2 PHE 82 -4.041 17.455 -8.703 582 HE1 PHE 82 HE1 PHE 82 0.368 16.662 -6.933 583 HE2 PHE 82 HE2 PHE 82 -2.392 19.215 -8.746 584 HZ PHE 82 HZ PHE 82 -0.183 18.821 -7.859 585 H THR 83 H THR 83 -3.325 11.858 -9.173 586 HA THR 83 HA THR 83 -5.734 10.816 -8.002 587 HB THR 83 HB THR 83 -5.943 10.373 -10.388 588 HG1 THR 83 HG1 THR 83 -7.130 9.010 -9.289 589 HG21 THR 83 HG21 THR 83 -4.563 8.714 -11.382 590 HG22 THR 83 HG22 THR 83 -3.687 8.601 -10.028 591 HG23 THR 83 HG23 THR 83 -3.636 9.953 -10.914 592 H TRP 84 H TRP 84 -5.432 9.017 -6.629 593 HA TRP 84 HA TRP 84 -2.650 8.414 -6.120 594 HB2 TRP 84 HB2 TRP 84 -4.781 8.596 -4.182 595 HB3 TRP 84 HB3 TRP 84 -3.308 7.994 -3.815 596 HD1 TRP 84 HD1 TRP 84 -3.537 11.194 -5.731 597 HE1 TRP 84 HE1 TRP 84 -2.692 13.159 -4.426 598 HE3 TRP 84 HE3 TRP 84 -2.881 8.818 -1.379 599 HZ2 TRP 84 HZ2 TRP 84 -1.867 13.555 -1.760 600 HZ3 TRP 84 HZ3 TRP 84 -2.066 10.067 0.526 601 HH2 TRP 84 HH2 TRP 84 -1.582 12.424 0.326 602 H THR 85 H THR 85 -2.139 6.196 -5.797 603 HA THR 85 HA THR 85 -4.348 4.346 -5.975 604 HB THR 85 HB THR 85 -2.752 2.898 -7.283 605 HG1 THR 85 HG1 THR 85 -0.898 3.713 -7.633 606 HG21 THR 85 HG21 THR 85 -3.374 3.914 -9.360 607 HG22 THR 85 HG22 THR 85 -3.763 5.285 -8.596 608 HG23 THR 85 HG23 THR 85 -4.652 3.953 -8.371 609 H TYR 86 H TYR 86 -3.777 2.155 -5.071 610 HA TYR 86 HA TYR 86 -1.604 2.268 -3.183 611 HB2 TYR 86 HB2 TYR 86 -4.334 1.651 -2.489 612 HB3 TYR 86 HB3 TYR 86 -3.087 1.245 -1.516 613 HD1 TYR 86 HD1 TYR 86 -5.019 4.036 -2.740 614 HD2 TYR 86 HD2 TYR 86 -1.937 2.914 -0.173 615 HE1 TYR 86 HE1 TYR 86 -5.109 6.207 -1.672 616 HE2 TYR 86 HE2 TYR 86 -2.011 5.090 0.863 617 HH TYR 86 HH TYR 86 -3.589 7.729 -0.355 618 H THR 87 H THR 87 -0.821 0.157 -2.517 619 HA THR 87 HA THR 87 -1.160 -1.679 -4.605 620 HB THR 87 HB THR 87 0.567 -2.999 -3.344 621 HG1 THR 87 HG1 THR 87 0.572 -0.858 -1.603 622 HG21 THR 87 HG21 THR 87 2.347 -1.399 -3.621 623 HG22 THR 87 HG22 THR 87 1.273 -0.193 -3.699 624 HG23 THR 87 HG23 THR 87 1.353 -1.282 -4.891 625 H ALA 88 H ALA 88 -2.723 -1.214 -1.736 626 HA ALA 88 HA ALA 88 -3.984 -3.773 -1.961 627 HB1 ALA 88 HB1 ALA 88 -2.382 -4.057 -0.162 628 HB2 ALA 88 HB2 ALA 88 -3.876 -4.144 0.449 629 HB3 ALA 88 HB3 ALA 88 -3.013 -2.787 0.614 630 HA PRO 89 HA PRO 89 -7.472 -1.191 -1.306 631 HB2 PRO 89 HB2 PRO 89 -9.443 -2.940 -1.060 632 HB3 PRO 89 HB3 PRO 89 -8.762 -2.735 -2.530 633 HG2 PRO 89 HG2 PRO 89 -8.215 -4.781 -0.618 634 HG3 PRO 89 HG3 PRO 89 -8.456 -4.950 -2.225 635 HD2 PRO 89 HD2 PRO 89 -6.034 -4.897 -1.232 636 HD3 PRO 89 HD3 PRO 89 -6.335 -4.311 -2.726 637 H HIS 90 H HIS 90 -7.976 -0.024 0.387 638 HA HIS 90 HA HIS 90 -8.250 -1.423 2.895 639 HB2 HIS 90 HB2 HIS 90 -7.070 0.345 4.016 640 HB3 HIS 90 HB3 HIS 90 -6.109 -0.412 2.933 641 HD1 HIS 90 HD1 HIS 90 -5.390 0.866 0.746 642 HD2 HIS 90 HD2 HIS 90 -7.565 3.026 3.468 643 HE1 HIS 90 HE1 HIS 90 -5.249 3.279 0.143 644 HE2 HIS 90 HE2 HIS 90 -6.550 4.595 1.772 645 H ASN 91 H ASN 91 -9.584 -0.382 4.532 646 HA ASN 91 HA ASN 91 -11.665 1.174 3.416 647 HB2 ASN 91 HB2 ASN 91 -11.219 0.219 6.092 648 HB3 ASN 91 HB3 ASN 91 -12.483 1.192 5.741 649 HD21 ASN 91 HD21 ASN 91 -12.901 -2.646 5.294 650 HD22 ASN 91 HD22 ASN 91 -11.694 -1.859 6.256 651 H THR 92 H THR 92 -12.313 3.302 4.290 652 HA THR 92 HA THR 92 -10.089 4.842 5.279 653 HB THR 92 HB THR 92 -11.584 5.501 2.842 654 HG1 THR 92 HG1 THR 92 -8.965 4.722 3.250 655 HG21 THR 92 HG21 THR 92 -10.251 7.442 2.621 656 HG22 THR 92 HG22 THR 92 -9.514 7.122 4.024 657 HG23 THR 92 HG23 THR 92 -11.080 7.525 4.007 658 H SER 93 H SER 93 -10.661 6.451 6.735 659 HA SER 93 HA SER 93 -13.454 6.748 7.279 660 HB2 SER 93 HB2 SER 93 -12.045 6.701 9.177 661 HB3 SER 93 HB3 SER 93 -11.174 7.957 8.602 662 HG SER 93 HG SER 93 -12.476 9.258 9.475 663 H GLN 94 H GLN 94 -10.729 8.724 6.343 664 HA GLN 94 HA GLN 94 -12.247 10.211 4.526 665 HB2 GLN 94 HB2 GLN 94 -11.924 12.386 5.565 666 HB3 GLN 94 HB3 GLN 94 -12.903 11.434 6.460 667 HG2 GLN 94 HG2 GLN 94 -11.138 10.977 7.942 668 HG3 GLN 94 HG3 GLN 94 -10.121 11.871 7.029 669 HE21 GLN 94 HE21 GLN 94 -11.968 13.610 9.964 670 HE22 GLN 94 HE22 GLN 94 -11.696 11.908 9.788 671 H TRP 95 H TRP 95 -10.899 11.816 3.300 672 HA TRP 95 HA TRP 95 -8.143 11.906 4.079 673 HB2 TRP 95 HB2 TRP 95 -7.368 11.617 1.825 674 HB3 TRP 95 HB3 TRP 95 -7.831 10.261 2.610 675 HD1 TRP 95 HD1 TRP 95 -10.440 9.427 1.852 676 HE1 TRP 95 HE1 TRP 95 -11.427 9.174 -0.435 677 HE3 TRP 95 HE3 TRP 95 -7.300 12.513 -0.525 678 HZ2 TRP 95 HZ2 TRP 95 -10.787 10.184 -2.988 679 HZ3 TRP 95 HZ3 TRP 95 -7.542 12.810 -2.920 680 HH2 TRP 95 HH2 TRP 95 -9.267 11.632 -4.132 681 H HIS 96 H HIS 96 -7.192 13.936 3.638 682 HA HIS 96 HA HIS 96 -8.848 15.878 2.356 683 HB2 HIS 96 HB2 HIS 96 -8.671 17.279 4.485 684 HB3 HIS 96 HB3 HIS 96 -9.890 16.201 4.348 685 HD1 HIS 96 HD1 HIS 96 -7.466 17.263 6.693 686 HD2 HIS 96 HD2 HIS 96 -9.120 13.642 5.704 687 HE1 HIS 96 HE1 HIS 96 -7.081 15.666 8.571 688 HE2 HIS 96 HE2 HIS 96 -8.037 13.470 7.975 689 H TYR 97 H TYR 97 -7.797 17.885 1.848 690 HA TYR 97 HA TYR 97 -5.027 17.908 2.402 691 HB2 TYR 97 HB2 TYR 97 -4.506 18.112 -0.035 692 HB3 TYR 97 HB3 TYR 97 -4.898 16.615 0.488 693 HD1 TYR 97 HD1 TYR 97 -7.021 15.543 -0.210 694 HD2 TYR 97 HD2 TYR 97 -5.978 19.336 -1.550 695 HE1 TYR 97 HE1 TYR 97 -8.757 15.427 -1.895 696 HE2 TYR 97 HE2 TYR 97 -7.708 19.221 -3.227 697 HH TYR 97 HH TYR 97 -8.958 17.275 -4.526 698 H TYR 98 H TYR 98 -3.824 19.748 1.968 699 HA TYR 98 HA TYR 98 -5.414 22.134 1.777 700 HB2 TYR 98 HB2 TYR 98 -3.299 21.802 3.749 701 HB3 TYR 98 HB3 TYR 98 -4.370 23.034 3.702 702 HD1 TYR 98 HD1 TYR 98 -4.110 19.497 4.488 703 HD2 TYR 98 HD2 TYR 98 -6.378 22.952 4.991 704 HE1 TYR 98 HE1 TYR 98 -5.487 18.353 6.098 705 HE2 TYR 98 HE2 TYR 98 -7.738 21.805 6.634 706 HH TYR 98 HH TYR 98 -8.380 19.171 7.027 707 H ILE 99 H ILE 99 -3.983 24.123 1.365 708 HA ILE 99 HA ILE 99 -1.312 23.372 0.572 709 HB ILE 99 HB ILE 99 -1.245 25.167 -1.046 710 HG12 ILE 99 HG12 ILE 99 -4.063 25.524 -0.649 711 HG13 ILE 99 HG13 ILE 99 -2.950 26.512 0.023 712 HG21 ILE 99 HG21 ILE 99 -2.612 24.097 -2.720 713 HG22 ILE 99 HG22 ILE 99 -3.385 23.268 -1.567 714 HG23 ILE 99 HG23 ILE 99 -1.822 22.978 -1.861 715 HD11 ILE 99 HD11 ILE 99 -3.837 27.513 -1.965 716 HD12 ILE 99 HD12 ILE 99 -3.364 26.236 -2.836 717 HD13 ILE 99 HD13 ILE 99 -2.261 27.215 -2.171 718 H THR 100 H THR 100 0.354 25.078 1.090 719 HA THR 100 HA THR 100 -0.534 26.643 3.300 720 HB THR 100 HB THR 100 1.472 25.542 3.826 721 HG1 THR 100 HG1 THR 100 2.029 28.225 3.446 722 HG21 THR 100 HG21 THR 100 3.497 25.916 2.631 723 HG22 THR 100 HG22 THR 100 2.726 26.885 1.591 724 HG23 THR 100 HG23 THR 100 2.397 25.302 1.617 725 H LYS 101 H LYS 101 -0.679 28.884 3.343 726 HA LYS 101 HA LYS 101 -0.599 30.090 0.764 727 HB2 LYS 101 HB2 LYS 101 -2.412 30.434 2.417 728 HB3 LYS 101 HB3 LYS 101 -1.359 31.353 3.263 729 HG2 LYS 101 HG2 LYS 101 -1.286 32.919 1.548 730 HG3 LYS 101 HG3 LYS 101 -2.227 31.975 0.606 731 HD2 LYS 101 HD2 LYS 101 -3.951 32.183 2.341 732 HD3 LYS 101 HD3 LYS 101 -3.028 33.360 2.997 733 HE2 LYS 101 HE2 LYS 101 -4.641 34.388 1.648 734 HE3 LYS 101 HE3 LYS 101 -3.193 34.573 0.915 735 HZ1 LYS 101 HZ1 LYS 101 -4.830 33.886 -0.673 736 HZ2 LYS 101 HZ2 LYS 101 -5.131 32.558 0.199 737 HZ3 LYS 101 HZ3 LYS 101 -3.698 32.741 -0.526 738 H LYS 102 H LYS 102 1.083 31.185 -0.063 739 HA LYS 102 HA LYS 102 3.094 32.205 1.713 740 HB2 LYS 102 HB2 LYS 102 3.073 32.476 -1.133 741 HB3 LYS 102 HB3 LYS 102 4.359 32.666 -0.145 742 HG2 LYS 102 HG2 LYS 102 3.077 30.152 -0.778 743 HG3 LYS 102 HG3 LYS 102 4.573 30.601 -1.255 744 HD2 LYS 102 HD2 LYS 102 3.914 30.095 1.512 745 HD3 LYS 102 HD3 LYS 102 4.572 28.960 0.540 746 HE2 LYS 102 HE2 LYS 102 6.513 30.323 0.291 747 HE3 LYS 102 HE3 LYS 102 5.858 31.419 1.309 748 HZ1 LYS 102 HZ1 LYS 102 7.377 30.017 2.487 749 HZ2 LYS 102 HZ2 LYS 102 6.527 28.713 2.047 750 HZ3 LYS 102 HZ3 LYS 102 5.879 29.798 3.055 751 H GLY 103 H GLY 103 3.632 34.558 1.872 752 HA2 GLY 103 HA2 GLY 103 3.062 36.751 1.369 753 HA3 GLY 103 HA3 GLY 103 1.736 36.254 0.556 754 H TRP 104 H TRP 104 2.088 34.887 3.557 755 HA TRP 104 HA TRP 104 -0.269 35.726 4.544 756 HB2 TRP 104 HB2 TRP 104 0.763 35.000 6.741 757 HB3 TRP 104 HB3 TRP 104 0.788 33.883 5.549 758 HD1 TRP 104 HD1 TRP 104 3.243 36.606 6.539 759 HE1 TRP 104 HE1 TRP 104 5.615 35.808 6.536 760 HE3 TRP 104 HE3 TRP 104 2.304 31.881 5.199 761 HZ2 TRP 104 HZ2 TRP 104 6.870 33.341 6.007 762 HZ3 TRP 104 HZ3 TRP 104 4.157 30.335 4.988 763 HH2 TRP 104 HH2 TRP 104 6.422 31.073 5.396 764 H ASP 105 H ASP 105 -1.020 37.057 6.264 765 HA ASP 105 HA ASP 105 0.161 39.584 6.248 766 HB2 ASP 105 HB2 ASP 105 -2.042 38.462 7.747 767 HB3 ASP 105 HB3 ASP 105 -1.520 39.963 8.126 768 HA PRO 106 HA PRO 106 2.658 38.734 9.835 769 HB2 PRO 106 HB2 PRO 106 3.778 41.086 10.297 770 HB3 PRO 106 HB3 PRO 106 4.291 40.221 9.011 771 HG2 PRO 106 HG2 PRO 106 2.379 42.346 9.031 772 HG3 PRO 106 HG3 PRO 106 3.654 42.163 8.027 773 HD2 PRO 106 HD2 PRO 106 1.269 41.431 7.258 774 HD3 PRO 106 HD3 PRO 106 2.579 40.590 6.764 775 H ASP 107 H ASP 107 0.204 40.924 9.549 776 HA ASP 107 HA ASP 107 -0.177 41.651 12.203 777 HB2 ASP 107 HB2 ASP 107 -1.235 42.873 10.463 778 HB3 ASP 107 HB3 ASP 107 -1.933 41.517 9.877 779 H LYS 108 H LYS 108 -0.762 38.742 10.626 780 HA LYS 108 HA LYS 108 -2.585 37.894 12.716 781 HB2 LYS 108 HB2 LYS 108 -2.643 37.089 9.929 782 HB3 LYS 108 HB3 LYS 108 -3.678 36.529 11.061 783 HG2 LYS 108 HG2 LYS 108 -4.610 38.679 11.320 784 HG3 LYS 108 HG3 LYS 108 -3.520 39.302 10.275 785 HD2 LYS 108 HD2 LYS 108 -4.506 38.044 8.523 786 HD3 LYS 108 HD3 LYS 108 -5.617 37.472 9.574 787 HE2 LYS 108 HE2 LYS 108 -6.555 39.297 8.362 788 HE3 LYS 108 HE3 LYS 108 -6.409 39.714 9.935 789 HZ1 LYS 108 HZ1 LYS 108 -5.683 41.493 8.548 790 HZ2 LYS 108 HZ2 LYS 108 -4.582 40.527 7.862 791 HZ3 LYS 108 HZ3 LYS 108 -4.438 40.939 9.419 792 HA PRO 109 HA PRO 109 0.380 34.950 13.490 793 HB2 PRO 109 HB2 PRO 109 -0.888 33.049 14.877 794 HB3 PRO 109 HB3 PRO 109 -0.589 34.489 15.586 795 HG2 PRO 109 HG2 PRO 109 -2.999 33.640 14.312 796 HG3 PRO 109 HG3 PRO 109 -2.840 34.356 15.771 797 HD2 PRO 109 HD2 PRO 109 -3.493 35.793 13.716 798 HD3 PRO 109 HD3 PRO 109 -2.494 36.422 14.844 799 H LEU 110 H LEU 110 1.452 33.516 12.425 800 HA LEU 110 HA LEU 110 0.410 32.579 10.093 801 HB2 LEU 110 HB2 LEU 110 2.673 31.456 11.518 802 HB3 LEU 110 HB3 LEU 110 2.423 31.281 9.914 803 HG LEU 110 HG LEU 110 3.282 33.676 11.249 804 HD11 LEU 110 HD11 LEU 110 5.235 33.398 9.830 805 HD12 LEU 110 HD12 LEU 110 4.578 32.066 9.190 806 HD13 LEU 110 HD13 LEU 110 5.032 32.078 10.742 807 HD21 LEU 110 HD21 LEU 110 3.272 34.807 9.177 808 HD22 LEU 110 HD22 LEU 110 1.771 34.374 9.595 809 HD23 LEU 110 HD23 LEU 110 2.573 33.530 8.473 810 H LYS 111 H LYS 111 0.545 31.078 13.151 811 HA LYS 111 HA LYS 111 0.017 28.512 12.504 812 HB2 LYS 111 HB2 LYS 111 -1.044 29.918 14.804 813 HB3 LYS 111 HB3 LYS 111 -0.949 28.291 14.703 814 HG2 LYS 111 HG2 LYS 111 1.570 29.311 14.337 815 HG3 LYS 111 HG3 LYS 111 0.947 29.976 15.692 816 HD2 LYS 111 HD2 LYS 111 1.131 27.136 15.248 817 HD3 LYS 111 HD3 LYS 111 2.201 27.983 16.145 818 HE2 LYS 111 HE2 LYS 111 0.513 28.470 17.733 819 HE3 LYS 111 HE3 LYS 111 -0.588 27.678 16.824 820 HZ1 LYS 111 HZ1 LYS 111 0.166 26.281 18.593 821 HZ2 LYS 111 HZ2 LYS 111 1.690 26.428 18.071 822 HZ3 LYS 111 HZ3 LYS 111 0.599 25.644 17.171 823 H ARG 112 H ARG 112 -2.259 31.106 12.812 824 HA ARG 112 HA ARG 112 -4.427 29.476 12.087 825 HB2 ARG 112 HB2 ARG 112 -4.230 32.346 12.439 826 HB3 ARG 112 HB3 ARG 112 -5.643 31.654 11.999 827 HG2 ARG 112 HG2 ARG 112 -5.672 30.448 14.052 828 HG3 ARG 112 HG3 ARG 112 -4.285 31.187 14.494 829 HD2 ARG 112 HD2 ARG 112 -5.416 33.300 14.429 830 HD3 ARG 112 HD3 ARG 112 -6.805 32.527 14.053 831 HE ARG 112 HE ARG 112 -5.924 31.412 16.397 832 HH11 ARG 112 HH11 ARG 112 -7.119 34.552 15.341 833 HH12 ARG 112 HH12 ARG 112 -7.724 34.946 16.916 834 HH21 ARG 112 HH21 ARG 112 -6.722 31.990 18.377 835 HH22 ARG 112 HH22 ARG 112 -7.503 33.519 18.603 836 H ALA 113 H ALA 113 -2.622 31.968 10.524 837 HA ALA 113 HA ALA 113 -4.382 32.078 8.389 838 HB1 ALA 113 HB1 ALA 113 -3.095 34.060 9.223 839 HB2 ALA 113 HB2 ALA 113 -2.897 33.924 7.624 840 HB3 ALA 113 HB3 ALA 113 -1.743 33.402 8.629 841 H ASP 114 H ASP 114 -1.556 30.270 8.678 842 HA ASP 114 HA ASP 114 -0.890 30.433 6.010 843 HB2 ASP 114 HB2 ASP 114 -0.001 28.607 8.092 844 HB3 ASP 114 HB3 ASP 114 0.593 28.435 6.581 845 H PHE 115 H PHE 115 -3.258 28.550 7.397 846 HA PHE 115 HA PHE 115 -2.930 26.500 5.462 847 HB2 PHE 115 HB2 PHE 115 -4.710 26.614 7.774 848 HB3 PHE 115 HB3 PHE 115 -4.654 25.304 6.799 849 HD1 PHE 115 HD1 PHE 115 -3.104 26.948 9.509 850 HD2 PHE 115 HD2 PHE 115 -2.629 23.857 6.764 851 HE1 PHE 115 HE1 PHE 115 -1.354 26.019 10.866 852 HE2 PHE 115 HE2 PHE 115 -0.875 22.912 8.124 853 HZ PHE 115 HZ PHE 115 -0.248 23.984 10.193 854 H GLU 116 H GLU 116 -3.950 26.372 3.578 855 HA GLU 116 HA GLU 116 -6.658 27.378 3.519 856 HB2 GLU 116 HB2 GLU 116 -4.768 27.318 1.339 857 HB3 GLU 116 HB3 GLU 116 -6.345 27.684 1.122 858 HG2 GLU 116 HG2 GLU 116 -6.057 29.568 2.565 859 HG3 GLU 116 HG3 GLU 116 -4.461 29.228 2.636 860 H LEU 117 H LEU 117 -8.093 25.704 3.678 861 HA LEU 117 HA LEU 117 -7.443 23.109 2.844 862 HB2 LEU 117 HB2 LEU 117 -9.088 23.429 4.495 863 HB3 LEU 117 HB3 LEU 117 -10.032 24.228 3.429 864 HG LEU 117 HG LEU 117 -10.202 22.106 2.206 865 HD11 LEU 117 HD11 LEU 117 -9.822 20.091 3.432 866 HD12 LEU 117 HD12 LEU 117 -9.192 20.947 4.651 867 HD13 LEU 117 HD13 LEU 117 -8.434 20.894 3.224 868 HD21 LEU 117 HD21 LEU 117 -11.981 21.310 3.644 869 HD22 LEU 117 HD22 LEU 117 -12.045 22.921 3.525 870 HD23 LEU 117 HD23 LEU 117 -11.417 22.232 4.847 871 H ILE 118 H ILE 118 -7.445 22.284 0.759 872 HA ILE 118 HA ILE 118 -8.901 23.842 -1.201 873 HB ILE 118 HB ILE 118 -6.402 23.937 -1.345 874 HG12 ILE 118 HG12 ILE 118 -7.643 23.179 -3.812 875 HG13 ILE 118 HG13 ILE 118 -7.979 24.610 -3.101 876 HG21 ILE 118 HG21 ILE 118 -5.315 22.147 -2.458 877 HG22 ILE 118 HG22 ILE 118 -6.679 21.280 -2.418 878 HG23 ILE 118 HG23 ILE 118 -5.914 21.648 -1.042 879 HD11 ILE 118 HD11 ILE 118 -6.315 24.912 -4.799 880 HD12 ILE 118 HD12 ILE 118 -5.347 23.850 -4.059 881 HD13 ILE 118 HD13 ILE 118 -5.680 25.267 -3.355 882 H GLY 119 H GLY 119 -9.032 21.098 0.424 883 HA2 GLY 119 HA2 GLY 119 -11.198 20.195 -0.910 884 HA3 GLY 119 HA3 GLY 119 -9.952 19.373 -1.573 885 H ALA 120 H ALA 120 -12.279 18.492 0.000 886 HA ALA 120 HA ALA 120 -10.810 16.827 1.833 887 HB1 ALA 120 HB1 ALA 120 -11.708 18.525 3.258 888 HB2 ALA 120 HB2 ALA 120 -12.482 17.138 3.560 889 HB3 ALA 120 HB3 ALA 120 -13.189 18.278 2.658 890 H VAL 121 H VAL 121 -11.529 14.702 1.820 891 HA VAL 121 HA VAL 121 -13.931 14.204 0.338 892 HB VAL 121 HB VAL 121 -11.557 12.569 -0.072 893 HG11 VAL 121 HG11 VAL 121 -12.773 11.639 -1.952 894 HG12 VAL 121 HG12 VAL 121 -14.038 12.585 -1.603 895 HG13 VAL 121 HG13 VAL 121 -13.607 11.403 -0.587 896 HG21 VAL 121 HG21 VAL 121 -11.251 13.656 -2.207 897 HG22 VAL 121 HG22 VAL 121 -11.109 14.737 -1.012 898 HG23 VAL 121 HG23 VAL 121 -12.475 14.660 -1.875 899 HA PRO 122 HA PRO 122 -13.969 11.755 4.092 900 HB2 PRO 122 HB2 PRO 122 -16.501 11.947 4.780 901 HB3 PRO 122 HB3 PRO 122 -15.523 13.217 5.094 902 HG2 PRO 122 HG2 PRO 122 -17.279 12.875 2.868 903 HG3 PRO 122 HG3 PRO 122 -17.135 14.185 3.833 904 HD2 PRO 122 HD2 PRO 122 -15.902 14.104 1.527 905 HD3 PRO 122 HD3 PRO 122 -15.227 14.884 2.793 906 H HIS 123 H HIS 123 -14.844 9.647 4.607 907 HA HIS 123 HA HIS 123 -16.160 8.506 2.317 908 HB2 HIS 123 HB2 HIS 123 -13.975 7.662 2.223 909 HB3 HIS 123 HB3 HIS 123 -14.012 7.266 3.807 910 HD1 HIS 123 HD1 HIS 123 -15.689 5.234 4.513 911 HD2 HIS 123 HD2 HIS 123 -14.694 5.609 0.556 912 HE1 HIS 123 HE1 HIS 123 -16.327 3.138 3.341 913 HE2 HIS 123 HE2 HIS 123 -15.720 3.331 0.955 914 H ASP 124 H ASP 124 -18.098 7.831 2.761 915 HA ASP 124 HA ASP 124 -18.592 6.459 5.296 916 HB2 ASP 124 HB2 ASP 124 -19.690 8.543 5.343 917 HB3 ASP 124 HB3 ASP 124 -20.431 8.193 3.930 918 H GLY 125 H GLY 125 -20.492 7.045 2.468 919 HA2 GLY 125 HA2 GLY 125 -19.889 4.482 1.335 920 HA3 GLY 125 HA3 GLY 125 -21.454 4.768 1.702 921 H SER 126 H SER 126 -22.139 4.679 -0.451 922 HA SER 126 HA SER 126 -22.672 5.551 -2.380 923 HB2 SER 126 HB2 SER 126 -21.878 8.159 -1.305 924 HB3 SER 126 HB3 SER 126 -22.899 7.974 -2.566 925 HG SER 126 HG SER 126 -24.475 7.459 -1.315 926 HA PRO 127 HA PRO 127 -19.306 5.678 -4.924 927 HB2 PRO 127 HB2 PRO 127 -20.121 6.492 -7.323 928 HB3 PRO 127 HB3 PRO 127 -20.743 5.100 -6.737 929 HG2 PRO 127 HG2 PRO 127 -21.893 7.713 -6.601 930 HG3 PRO 127 HG3 PRO 127 -22.609 6.337 -7.113 931 HD2 PRO 127 HD2 PRO 127 -22.978 7.156 -4.661 932 HD3 PRO 127 HD3 PRO 127 -22.895 5.555 -4.976 933 H ALA 128 H ALA 128 -20.445 8.424 -3.896 934 HA ALA 128 HA ALA 128 -18.837 10.245 -5.220 935 HB1 ALA 128 HB1 ALA 128 -20.676 10.973 -3.837 936 HB2 ALA 128 HB2 ALA 128 -19.326 11.712 -3.341 937 HB3 ALA 128 HB3 ALA 128 -19.906 10.450 -2.514 938 H SER 129 H SER 129 -18.337 8.300 -2.399 939 HA SER 129 HA SER 129 -15.785 9.362 -1.870 940 HB2 SER 129 HB2 SER 129 -15.741 7.716 -0.071 941 HB3 SER 129 HB3 SER 129 -17.166 8.514 -0.064 942 HG SER 129 HG SER 129 -18.213 6.824 -0.748 943 H ARG 130 H ARG 130 -16.889 7.118 -3.995 944 HA ARG 130 HA ARG 130 -14.655 5.399 -4.034 945 HB2 ARG 130 HB2 ARG 130 -16.928 4.833 -4.818 946 HB3 ARG 130 HB3 ARG 130 -16.607 5.721 -6.150 947 HG2 ARG 130 HG2 ARG 130 -14.913 4.185 -6.767 948 HG3 ARG 130 HG3 ARG 130 -15.234 3.297 -5.434 949 HD2 ARG 130 HD2 ARG 130 -17.425 2.849 -6.251 950 HD3 ARG 130 HD3 ARG 130 -17.121 3.755 -7.576 951 HE ARG 130 HE ARG 130 -15.209 1.769 -7.477 952 HH11 ARG 130 HH11 ARG 130 -18.659 2.068 -8.123 953 HH12 ARG 130 HH12 ARG 130 -18.685 0.641 -9.104 954 HH21 ARG 130 HH21 ARG 130 -15.329 -0.045 -8.741 955 HH22 ARG 130 HH22 ARG 130 -16.834 -0.532 -9.447 956 H ASN 131 H ASN 131 -15.329 8.419 -5.351 957 HA ASN 131 HA ASN 131 -13.607 8.227 -7.543 958 HB2 ASN 131 HB2 ASN 131 -14.837 10.524 -6.282 959 HB3 ASN 131 HB3 ASN 131 -13.889 10.698 -7.600 960 HD21 ASN 131 HD21 ASN 131 -17.658 10.119 -8.164 961 HD22 ASN 131 HD22 ASN 131 -16.899 10.816 -6.772 962 H LEU 132 H LEU 132 -11.492 7.821 -7.295 963 HA LEU 132 HA LEU 132 -10.120 9.107 -5.160 964 HB2 LEU 132 HB2 LEU 132 -9.842 6.704 -6.447 965 HB3 LEU 132 HB3 LEU 132 -8.441 7.508 -6.688 966 HG LEU 132 HG LEU 132 -8.261 6.013 -4.884 967 HD11 LEU 132 HD11 LEU 132 -7.323 7.531 -3.273 968 HD12 LEU 132 HD12 LEU 132 -8.060 8.765 -4.014 969 HD13 LEU 132 HD13 LEU 132 -6.887 7.952 -4.773 970 HD21 LEU 132 HD21 LEU 132 -9.492 6.349 -2.843 971 HD22 LEU 132 HD22 LEU 132 -10.500 6.004 -4.060 972 HD23 LEU 132 HD23 LEU 132 -10.340 7.530 -3.550 973 H SER 133 H SER 133 -10.532 9.576 -8.415 974 HA SER 133 HA SER 133 -8.087 11.083 -8.715 975 HB2 SER 133 HB2 SER 133 -8.619 9.599 -10.527 976 HB3 SER 133 HB3 SER 133 -10.027 10.391 -10.761 977 HG SER 133 HG SER 133 -8.270 10.962 -12.163 978 H HIS 134 H HIS 134 -8.090 13.304 -8.534 979 HA HIS 134 HA HIS 134 -10.657 14.557 -8.736 980 HB2 HIS 134 HB2 HIS 134 -8.810 14.861 -6.530 981 HB3 HIS 134 HB3 HIS 134 -9.903 16.039 -6.825 982 HD1 HIS 134 HD1 HIS 134 -11.765 15.933 -5.141 983 HD2 HIS 134 HD2 HIS 134 -10.490 12.258 -6.423 984 HE1 HIS 134 HE1 HIS 134 -13.214 14.185 -4.113 985 HE2 HIS 134 HE2 HIS 134 -12.439 11.963 -4.852 986 H HIS 135 H HIS 135 -10.825 16.694 -9.371 987 HA HIS 135 HA HIS 135 -8.512 17.712 -10.730 988 HB2 HIS 135 HB2 HIS 135 -11.231 18.692 -10.713 989 HB3 HIS 135 HB3 HIS 135 -10.032 19.384 -11.581 990 HD1 HIS 135 HD1 HIS 135 -8.879 17.754 -13.491 991 HD2 HIS 135 HD2 HIS 135 -12.636 16.849 -12.128 992 HE1 HIS 135 HE1 HIS 135 -9.953 16.195 -15.107 993 HE2 HIS 135 HE2 HIS 135 -12.222 15.642 -14.308 994 H ILE 136 H ILE 136 -7.325 19.456 -9.902 995 HA ILE 136 HA ILE 136 -8.530 20.897 -7.725 996 HB ILE 136 HB ILE 136 -5.740 20.066 -7.724 997 HG12 ILE 136 HG12 ILE 136 -6.682 19.225 -5.419 998 HG13 ILE 136 HG13 ILE 136 -8.000 19.041 -6.366 999 HG21 ILE 136 HG21 ILE 136 -5.547 21.205 -5.577 1000 HG22 ILE 136 HG22 ILE 136 -7.076 21.714 -5.711 1001 HG23 ILE 136 HG23 ILE 136 -5.948 22.272 -6.725 1002 HD11 ILE 136 HD11 ILE 136 -6.783 16.999 -6.255 1003 HD12 ILE 136 HD12 ILE 136 -5.466 17.734 -6.837 1004 HD13 ILE 136 HD13 ILE 136 -6.770 17.552 -7.775 1005 H TYR 137 H TYR 137 -8.798 23.004 -8.448 1006 HA TYR 137 HA TYR 137 -7.103 24.030 -10.477 1007 HB2 TYR 137 HB2 TYR 137 -9.235 24.887 -10.485 1008 HB3 TYR 137 HB3 TYR 137 -9.131 25.320 -8.914 1009 HD1 TYR 137 HD1 TYR 137 -8.324 27.481 -8.293 1010 HD2 TYR 137 HD2 TYR 137 -7.785 26.134 -12.194 1011 HE1 TYR 137 HE1 TYR 137 -7.517 29.658 -8.933 1012 HE2 TYR 137 HE2 TYR 137 -6.953 28.318 -12.825 1013 HH TYR 137 HH TYR 137 -5.737 30.372 -11.338 1014 H ILE 138 H ILE 138 -5.138 25.084 -10.110 1015 HA ILE 138 HA ILE 138 -4.625 25.808 -7.367 1016 HB ILE 138 HB ILE 138 -2.582 24.793 -9.174 1017 HG12 ILE 138 HG12 ILE 138 -3.729 23.470 -6.878 1018 HG13 ILE 138 HG13 ILE 138 -4.068 23.069 -8.424 1019 HG21 ILE 138 HG21 ILE 138 -1.120 24.876 -7.265 1020 HG22 ILE 138 HG22 ILE 138 -2.310 25.513 -6.374 1021 HG23 ILE 138 HG23 ILE 138 -1.672 26.360 -7.595 1022 HD11 ILE 138 HD11 ILE 138 -2.512 21.496 -7.495 1023 HD12 ILE 138 HD12 ILE 138 -1.469 22.691 -7.179 1024 HD13 ILE 138 HD13 ILE 138 -1.804 22.294 -8.710 1025 HA PRO 139 HA PRO 139 -4.156 29.550 -9.643 1026 HB2 PRO 139 HB2 PRO 139 -4.212 31.357 -7.685 1027 HB3 PRO 139 HB3 PRO 139 -5.611 30.616 -8.088 1028 HG2 PRO 139 HG2 PRO 139 -3.823 29.934 -5.976 1029 HG3 PRO 139 HG3 PRO 139 -5.442 30.126 -5.892 1030 HD2 PRO 139 HD2 PRO 139 -4.432 27.738 -6.124 1031 HD3 PRO 139 HD3 PRO 139 -5.849 28.093 -6.854 1032 H GLU 140 H GLU 140 -2.654 31.174 -10.073 1033 HA GLU 140 HA GLU 140 -0.063 30.726 -8.817 1034 HB2 GLU 140 HB2 GLU 140 -0.106 30.383 -11.164 1035 HB3 GLU 140 HB3 GLU 140 -0.591 31.930 -11.363 1036 HG2 GLU 140 HG2 GLU 140 1.495 32.610 -10.347 1037 HG3 GLU 140 HG3 GLU 140 1.971 31.051 -10.441 1038 H ASP 141 H ASP 141 -0.494 32.049 -6.959 1039 HA ASP 141 HA ASP 141 -1.619 34.604 -7.370 1040 HB2 ASP 141 HB2 ASP 141 -1.480 34.900 -5.032 1041 HB3 ASP 141 HB3 ASP 141 -2.013 33.383 -5.318 1042 H ARG 142 H ARG 142 1.421 33.238 -7.089 1043 HA ARG 142 HA ARG 142 2.872 35.639 -7.657 1044 HB2 ARG 142 HB2 ARG 142 3.386 34.163 -5.227 1045 HB3 ARG 142 HB3 ARG 142 4.401 35.292 -5.830 1046 HG2 ARG 142 HG2 ARG 142 2.971 36.994 -5.300 1047 HG3 ARG 142 HG3 ARG 142 1.734 35.963 -5.028 1048 HD2 ARG 142 HD2 ARG 142 3.460 35.148 -3.246 1049 HD3 ARG 142 HD3 ARG 142 3.761 36.753 -3.266 1050 HE ARG 142 HE ARG 142 1.317 35.485 -2.443 1051 HH11 ARG 142 HH11 ARG 142 -0.158 36.676 -1.344 1052 HH12 ARG 142 HH12 ARG 142 0.040 38.387 -1.161 1053 HH21 ARG 142 HH21 ARG 142 2.982 38.554 -2.940 1054 HH22 ARG 142 HH22 ARG 142 1.786 39.434 -2.049 1055 H LEU 143 H LEU 143 5.226 34.899 -8.116 1056 HA LEU 143 HA LEU 143 5.284 32.211 -9.153 1057 HB2 LEU 143 HB2 LEU 143 7.104 34.394 -9.386 1058 HB3 LEU 143 HB3 LEU 143 7.564 32.881 -9.794 1059 HG LEU 143 HG LEU 143 5.764 32.928 -11.442 1060 HD11 LEU 143 HD11 LEU 143 4.997 35.032 -12.231 1061 HD12 LEU 143 HD12 LEU 143 5.741 35.769 -10.999 1062 HD13 LEU 143 HD13 LEU 143 4.499 34.773 -10.715 1063 HD21 LEU 143 HD21 LEU 143 7.175 34.132 -13.035 1064 HD22 LEU 143 HD22 LEU 143 8.089 33.190 -12.091 1065 HD23 LEU 143 HD23 LEU 143 7.998 34.778 -11.802 1066 H GLY 144 H GLY 144 5.751 30.659 -7.554 1067 HA2 GLY 144 HA2 GLY 144 7.951 30.649 -5.995 1068 HA3 GLY 144 HA3 GLY 144 6.848 31.459 -5.103 1069 H TYR 145 H TYR 145 7.841 29.216 -3.980 1070 HA TYR 145 HA TYR 145 6.216 27.105 -4.874 1071 HB2 TYR 145 HB2 TYR 145 7.587 25.662 -3.518 1072 HB3 TYR 145 HB3 TYR 145 8.544 26.658 -4.391 1073 HD1 TYR 145 HD1 TYR 145 9.862 28.438 -3.281 1074 HD2 TYR 145 HD2 TYR 145 7.511 25.792 -1.089 1075 HE1 TYR 145 HE1 TYR 145 11.004 29.099 -1.245 1076 HE2 TYR 145 HE2 TYR 145 8.629 26.477 0.937 1077 HH TYR 145 HH TYR 145 9.882 28.277 1.879 1078 H HIS 146 H HIS 146 4.768 25.839 -3.924 1079 HA HIS 146 HA HIS 146 3.770 26.735 -1.363 1080 HB2 HIS 146 HB2 HIS 146 2.165 25.974 -3.643 1081 HB3 HIS 146 HB3 HIS 146 1.538 26.172 -2.148 1082 HD1 HIS 146 HD1 HIS 146 0.635 28.442 -1.518 1083 HD2 HIS 146 HD2 HIS 146 3.159 28.504 -4.753 1084 HE1 HIS 146 HE1 HIS 146 0.544 30.706 -2.559 1085 HE2 HIS 146 HE2 HIS 146 2.068 30.767 -4.494 1086 H VAL 147 H VAL 147 3.417 25.028 0.101 1087 HA VAL 147 HA VAL 147 4.011 22.420 -0.911 1088 HB VAL 147 HB VAL 147 3.744 23.147 1.903 1089 HG11 VAL 147 HG11 VAL 147 4.893 21.081 2.378 1090 HG12 VAL 147 HG12 VAL 147 4.940 20.738 0.799 1091 HG13 VAL 147 HG13 VAL 147 3.523 20.776 1.576 1092 HG21 VAL 147 HG21 VAL 147 6.152 23.235 2.006 1093 HG22 VAL 147 HG22 VAL 147 5.603 24.345 0.965 1094 HG23 VAL 147 HG23 VAL 147 6.233 22.961 0.415 1095 H ILE 148 H ILE 148 2.504 20.827 -1.109 1096 HA ILE 148 HA ILE 148 -0.188 21.407 -0.340 1097 HB ILE 148 HB ILE 148 0.763 19.146 -1.919 1098 HG12 ILE 148 HG12 ILE 148 -0.548 21.487 -2.958 1099 HG13 ILE 148 HG13 ILE 148 1.070 21.270 -3.018 1100 HG21 ILE 148 HG21 ILE 148 -1.571 18.758 -2.465 1101 HG22 ILE 148 HG22 ILE 148 -2.006 19.979 -1.499 1102 HG23 ILE 148 HG23 ILE 148 -1.360 18.639 -0.867 1103 HD11 ILE 148 HD11 ILE 148 0.092 20.716 -5.144 1104 HD12 ILE 148 HD12 ILE 148 -0.847 19.605 -4.437 1105 HD13 ILE 148 HD13 ILE 148 0.755 19.390 -4.497 1106 H LEU 149 H LEU 149 -1.004 20.510 1.540 1107 HA LEU 149 HA LEU 149 0.584 18.472 2.858 1108 HB2 LEU 149 HB2 LEU 149 -1.252 20.363 4.043 1109 HB3 LEU 149 HB3 LEU 149 -0.338 19.303 4.885 1110 HG LEU 149 HG LEU 149 0.818 21.459 3.375 1111 HD11 LEU 149 HD11 LEU 149 1.029 22.646 5.468 1112 HD12 LEU 149 HD12 LEU 149 0.219 21.466 6.219 1113 HD13 LEU 149 HD13 LEU 149 -0.532 22.397 5.131 1114 HD21 LEU 149 HD21 LEU 149 2.786 21.046 4.659 1115 HD22 LEU 149 HD22 LEU 149 2.371 19.722 3.827 1116 HD23 LEU 149 HD23 LEU 149 2.046 19.818 5.408 1117 H ALA 150 H ALA 150 -0.383 16.427 3.078 1118 HA ALA 150 HA ALA 150 -3.252 16.395 2.844 1119 HB1 ALA 150 HB1 ALA 150 -2.340 15.725 0.698 1120 HB2 ALA 150 HB2 ALA 150 -3.119 14.472 1.360 1121 HB3 ALA 150 HB3 ALA 150 -1.505 14.543 1.417 1122 H VAL 151 H VAL 151 -4.424 14.863 3.983 1123 HA VAL 151 HA VAL 151 -2.874 13.101 5.666 1124 HB VAL 151 HB VAL 151 -5.232 14.555 6.558 1125 HG11 VAL 151 HG11 VAL 151 -4.875 13.573 8.733 1126 HG12 VAL 151 HG12 VAL 151 -3.645 12.705 8.143 1127 HG13 VAL 151 HG13 VAL 151 -5.155 12.415 7.641 1128 HG21 VAL 151 HG21 VAL 151 -3.748 15.729 8.071 1129 HG22 VAL 151 HG22 VAL 151 -3.301 15.996 6.540 1130 HG23 VAL 151 HG23 VAL 151 -2.484 14.935 7.448 1131 H TRP 152 H TRP 152 -3.603 10.966 5.757 1132 HA TRP 152 HA TRP 152 -6.182 10.440 4.585 1133 HB2 TRP 152 HB2 TRP 152 -4.391 9.808 3.063 1134 HB3 TRP 152 HB3 TRP 152 -3.916 8.700 4.165 1135 HD1 TRP 152 HD1 TRP 152 -6.140 6.965 4.825 1136 HE1 TRP 152 HE1 TRP 152 -7.686 5.721 3.304 1137 HE3 TRP 152 HE3 TRP 152 -5.271 9.676 0.713 1138 HZ2 TRP 152 HZ2 TRP 152 -8.413 5.970 0.598 1139 HZ3 TRP 152 HZ3 TRP 152 -6.449 9.109 -1.327 1140 HH2 TRP 152 HH2 TRP 152 -8.018 7.273 -1.362 1141 H ASP 153 H ASP 153 -7.538 9.467 5.978 1142 HA ASP 153 HA ASP 153 -6.371 8.210 8.295 1143 HB2 ASP 153 HB2 ASP 153 -9.006 9.319 7.883 1144 HB3 ASP 153 HB3 ASP 153 -8.567 8.576 9.270 1145 H VAL 154 H VAL 154 -5.885 6.143 7.717 1146 HA VAL 154 HA VAL 154 -7.739 4.566 6.292 1147 HB VAL 154 HB VAL 154 -5.265 3.754 7.596 1148 HG11 VAL 154 HG11 VAL 154 -5.377 1.693 6.373 1149 HG12 VAL 154 HG12 VAL 154 -6.825 2.113 5.787 1150 HG13 VAL 154 HG13 VAL 154 -6.646 1.819 7.367 1151 HG21 VAL 154 HG21 VAL 154 -4.325 3.751 5.362 1152 HG22 VAL 154 HG22 VAL 154 -4.883 5.226 5.720 1153 HG23 VAL 154 HG23 VAL 154 -5.743 4.247 4.764 1154 H ALA 155 H ALA 155 -9.428 3.400 7.097 1155 HA ALA 155 HA ALA 155 -9.898 3.654 9.833 1156 HB1 ALA 155 HB1 ALA 155 -11.725 3.730 8.204 1157 HB2 ALA 155 HB2 ALA 155 -12.050 2.603 9.317 1158 HB3 ALA 155 HB3 ALA 155 -11.484 2.167 7.866 1159 H ASP 156 H ASP 156 -8.491 1.209 8.026 1160 HA ASP 156 HA ASP 156 -9.199 -0.887 9.712 1161 HB2 ASP 156 HB2 ASP 156 -7.015 -0.813 7.762 1162 HB3 ASP 156 HB3 ASP 156 -7.635 -2.200 8.363 1163 H THR 157 H THR 157 -7.090 1.507 10.310 1164 HA THR 157 HA THR 157 -5.456 -0.213 11.837 1165 HB THR 157 HB THR 157 -3.416 1.130 11.129 1166 HG1 THR 157 HG1 THR 157 -4.473 2.283 9.028 1167 HG21 THR 157 HG21 THR 157 -3.248 0.320 8.883 1168 HG22 THR 157 HG22 THR 157 -4.839 0.033 8.848 1169 HG23 THR 157 HG23 THR 157 -3.880 -0.846 9.809 1170 H GLU 158 H GLU 158 -4.110 0.592 13.538 1171 HA GLU 158 HA GLU 158 -5.243 2.787 14.938 1172 HB2 GLU 158 HB2 GLU 158 -4.158 0.635 15.800 1173 HB3 GLU 158 HB3 GLU 158 -2.809 1.556 15.777 1174 HG2 GLU 158 HG2 GLU 158 -3.782 3.050 17.313 1175 HG3 GLU 158 HG3 GLU 158 -5.162 2.177 17.308 1176 H ASN 159 H ASN 159 -3.665 2.921 12.331 1177 HA ASN 159 HA ASN 159 -1.674 4.828 13.124 1178 HB2 ASN 159 HB2 ASN 159 -1.824 3.295 10.649 1179 HB3 ASN 159 HB3 ASN 159 -0.632 4.367 10.958 1180 HD21 ASN 159 HD21 ASN 159 0.646 1.001 11.586 1181 HD22 ASN 159 HD22 ASN 159 -0.018 1.844 10.226 1182 H ALA 160 H ALA 160 -1.298 6.716 11.708 1183 HA ALA 160 HA ALA 160 -3.585 7.456 10.064 1184 HB1 ALA 160 HB1 ALA 160 -3.696 8.817 11.990 1185 HB2 ALA 160 HB2 ALA 160 -3.246 9.740 10.740 1186 HB3 ALA 160 HB3 ALA 160 -2.146 9.246 11.818 1187 H PHE 161 H PHE 161 -2.928 8.635 8.110 1188 HA PHE 161 HA PHE 161 -0.110 8.293 7.519 1189 HB2 PHE 161 HB2 PHE 161 -2.333 7.842 5.716 1190 HB3 PHE 161 HB3 PHE 161 -0.770 7.781 5.246 1191 HD1 PHE 161 HD1 PHE 161 -3.030 6.129 7.606 1192 HD2 PHE 161 HD2 PHE 161 0.304 5.705 5.151 1193 HE1 PHE 161 HE1 PHE 161 -2.924 3.786 8.167 1194 HE2 PHE 161 HE2 PHE 161 0.384 3.349 5.672 1195 HZ PHE 161 HZ PHE 161 -1.220 2.392 7.192 1196 H TYR 162 H TYR 162 0.933 10.001 6.410 1197 HA TYR 162 HA TYR 162 -0.751 12.151 5.549 1198 HB2 TYR 162 HB2 TYR 162 0.548 13.823 6.590 1199 HB3 TYR 162 HB3 TYR 162 -0.179 12.852 7.685 1200 HD1 TYR 162 HD1 TYR 162 1.177 11.284 9.077 1201 HD2 TYR 162 HD2 TYR 162 2.962 13.998 6.470 1202 HE1 TYR 162 HE1 TYR 162 3.290 11.011 10.229 1203 HE2 TYR 162 HE2 TYR 162 5.064 13.720 7.628 1204 HH TYR 162 HH TYR 162 5.382 12.184 10.628 1205 H GLN 163 H GLN 163 0.253 13.654 3.998 1206 HA GLN 163 HA GLN 163 2.691 12.661 2.888 1207 HB2 GLN 163 HB2 GLN 163 0.370 11.946 1.763 1208 HB3 GLN 163 HB3 GLN 163 0.867 13.186 0.824 1209 HG2 GLN 163 HG2 GLN 163 2.383 10.794 1.302 1210 HG3 GLN 163 HG3 GLN 163 1.568 11.119 -0.075 1211 HE21 GLN 163 HE21 GLN 163 3.950 13.240 -1.463 1212 HE22 GLN 163 HE22 GLN 163 2.328 12.642 -1.569 1213 H VAL 164 H VAL 164 3.907 14.177 1.652 1214 HA VAL 164 HA VAL 164 2.718 16.772 1.507 1215 HB VAL 164 HB VAL 164 4.891 17.806 2.054 1216 HG11 VAL 164 HG11 VAL 164 4.741 17.440 4.444 1217 HG12 VAL 164 HG12 VAL 164 3.802 16.149 4.188 1218 HG13 VAL 164 HG13 VAL 164 3.261 17.628 3.822 1219 HG21 VAL 164 HG21 VAL 164 6.607 16.464 3.080 1220 HG22 VAL 164 HG22 VAL 164 6.357 15.975 1.560 1221 HG23 VAL 164 HG23 VAL 164 5.742 15.129 2.793 1222 H ILE 165 H ILE 165 3.111 18.010 -0.349 1223 HA ILE 165 HA ILE 165 4.994 16.923 -2.239 1224 HB ILE 165 HB ILE 165 2.305 17.712 -3.066 1225 HG12 ILE 165 HG12 ILE 165 3.408 15.064 -3.245 1226 HG13 ILE 165 HG13 ILE 165 2.405 15.531 -2.044 1227 HG21 ILE 165 HG21 ILE 165 2.998 17.099 -5.317 1228 HG22 ILE 165 HG22 ILE 165 4.485 16.768 -4.774 1229 HG23 ILE 165 HG23 ILE 165 3.942 18.291 -4.766 1230 HD11 ILE 165 HD11 ILE 165 1.174 14.306 -3.706 1231 HD12 ILE 165 HD12 ILE 165 1.624 15.366 -4.841 1232 HD13 ILE 165 HD13 ILE 165 0.631 15.828 -3.652 1233 H ASP 166 H ASP 166 6.330 18.664 -3.005 1234 HA ASP 166 HA ASP 166 5.301 21.330 -2.437 1235 HB2 ASP 166 HB2 ASP 166 7.295 20.552 -1.242 1236 HB3 ASP 166 HB3 ASP 166 8.077 20.644 -2.673 1237 H VAL 167 H VAL 167 4.877 22.678 -4.053 1238 HA VAL 167 HA VAL 167 6.063 22.027 -6.574 1239 HB VAL 167 HB VAL 167 3.917 22.825 -7.630 1240 HG11 VAL 167 HG11 VAL 167 2.943 20.605 -7.501 1241 HG12 VAL 167 HG12 VAL 167 3.901 20.260 -6.244 1242 HG13 VAL 167 HG13 VAL 167 4.543 20.494 -7.709 1243 HG21 VAL 167 HG21 VAL 167 1.922 22.570 -6.298 1244 HG22 VAL 167 HG22 VAL 167 2.857 23.735 -5.677 1245 HG23 VAL 167 HG23 VAL 167 2.827 22.270 -4.992 1246 H ASP 168 H ASP 168 7.162 23.552 -7.565 1247 HA ASP 168 HA ASP 168 7.096 26.206 -6.490 1248 HB2 ASP 168 HB2 ASP 168 9.174 25.088 -7.056 1249 HB3 ASP 168 HB3 ASP 168 8.786 25.328 -8.624 1250 H LEU 169 H LEU 169 5.216 27.194 -7.081 1251 HA LEU 169 HA LEU 169 4.189 26.715 -9.692 1252 HB2 LEU 169 HB2 LEU 169 3.075 28.118 -7.429 1253 HB3 LEU 169 HB3 LEU 169 2.277 27.989 -8.848 1254 HG LEU 169 HG LEU 169 3.075 25.623 -7.430 1255 HD11 LEU 169 HD11 LEU 169 0.940 25.591 -6.354 1256 HD12 LEU 169 HD12 LEU 169 0.599 27.041 -6.984 1257 HD13 LEU 169 HD13 LEU 169 1.780 26.892 -5.889 1258 HD21 LEU 169 HD21 LEU 169 1.286 24.591 -8.646 1259 HD22 LEU 169 HD22 LEU 169 2.325 25.276 -9.677 1260 HD23 LEU 169 HD23 LEU 169 0.925 26.008 -9.336 1261 H VAL 170 H VAL 170 4.808 27.875 -11.384 1262 HA VAL 170 HA VAL 170 5.181 30.661 -10.941 1263 HB VAL 170 HB VAL 170 7.264 30.684 -12.195 1264 HG11 VAL 170 HG11 VAL 170 8.702 29.602 -10.572 1265 HG12 VAL 170 HG12 VAL 170 7.425 28.817 -9.965 1266 HG13 VAL 170 HG13 VAL 170 7.532 30.423 -9.817 1267 HG21 VAL 170 HG21 VAL 170 8.328 28.610 -12.848 1268 HG22 VAL 170 HG22 VAL 170 6.908 28.771 -13.605 1269 HG23 VAL 170 HG23 VAL 170 7.037 27.785 -12.330 1270 H ASN 171 H ASN 171 5.648 31.862 -13.136 1271 HA ASN 171 HA ASN 171 3.422 31.493 -14.693 1272 HB2 ASN 171 HB2 ASN 171 4.675 33.591 -14.485 1273 HB3 ASN 171 HB3 ASN 171 5.821 32.958 -15.461 1274 HD21 ASN 171 HD21 ASN 171 4.347 34.556 -18.132 1275 HD22 ASN 171 HD22 ASN 171 5.746 34.398 -17.123 1276 H LYS 172 H LYS 172 3.180 31.159 -16.965 1277 HA LYS 172 HA LYS 172 4.371 28.797 -17.831 1278 HB2 LYS 172 HB2 LYS 172 2.775 30.700 -19.338 1279 HB3 LYS 172 HB3 LYS 172 3.040 29.159 -19.808 1280 HG2 LYS 172 HG2 LYS 172 1.713 28.339 -18.095 1281 HG3 LYS 172 HG3 LYS 172 1.595 29.818 -17.413 1282 HD2 LYS 172 HD2 LYS 172 0.442 30.559 -19.395 1283 HD3 LYS 172 HD3 LYS 172 0.429 29.008 -19.907 1284 HE2 LYS 172 HE2 LYS 172 -0.878 28.370 -18.057 1285 HE3 LYS 172 HE3 LYS 172 -0.787 29.880 -17.440 1286 HZ1 LYS 172 HZ1 LYS 172 -2.875 29.563 -18.518 1287 HZ2 LYS 172 HZ2 LYS 172 -2.117 29.208 -19.902 1288 HZ3 LYS 172 HZ3 LYS 172 -2.027 30.702 -19.291 Start of MODEL 12 1 H1 HIS 1 H1 HIS 1 2.081 4.011 2.699 2 H2 HIS 1 H2 HIS 1 0.667 3.932 1.919 3 H3 HIS 1 H3 HIS 1 1.830 4.923 1.388 4 HA HIS 1 HA HIS 1 3.174 3.091 0.830 5 HB2 HIS 1 HB2 HIS 1 0.950 1.427 1.680 6 HB3 HIS 1 HB3 HIS 1 2.334 0.849 1.034 7 HD1 HIS 1 HD1 HIS 1 4.492 0.699 2.544 8 HD2 HIS 1 HD2 HIS 1 1.085 2.042 4.401 9 HE1 HIS 1 HE1 HIS 1 4.871 0.707 5.005 10 HE2 HIS 1 HE2 HIS 1 2.843 1.526 6.136 11 H GLY 2 H GLY 2 3.005 4.122 -1.191 12 HA2 GLY 2 HA2 GLY 2 1.458 2.922 -3.144 13 HA3 GLY 2 HA3 GLY 2 0.654 4.253 -2.646 14 H PHE 3 H PHE 3 1.058 5.155 -4.882 15 HA PHE 3 HA PHE 3 3.429 6.684 -4.737 16 HB2 PHE 3 HB2 PHE 3 4.317 6.125 -6.860 17 HB3 PHE 3 HB3 PHE 3 4.230 4.781 -5.937 18 HD1 PHE 3 HD1 PHE 3 2.937 6.386 -8.847 19 HD2 PHE 3 HD2 PHE 3 2.682 2.972 -6.476 20 HE1 PHE 3 HE1 PHE 3 1.756 5.256 -10.612 21 HE2 PHE 3 HE2 PHE 3 1.485 1.836 -8.237 22 HZ PHE 3 HZ PHE 3 1.031 2.977 -10.316 23 H ILE 4 H ILE 4 3.597 8.346 -6.558 24 HA ILE 4 HA ILE 4 0.982 9.474 -6.737 25 HB ILE 4 HB ILE 4 3.505 10.820 -7.342 26 HG12 ILE 4 HG12 ILE 4 3.632 10.140 -5.109 27 HG13 ILE 4 HG13 ILE 4 3.449 11.762 -5.152 28 HG21 ILE 4 HG21 ILE 4 2.309 12.887 -7.039 29 HG22 ILE 4 HG22 ILE 4 0.944 12.062 -6.775 30 HG23 ILE 4 HG23 ILE 4 1.642 12.025 -8.233 31 HD11 ILE 4 HD11 ILE 4 2.103 10.834 -3.382 32 HD12 ILE 4 HD12 ILE 4 1.318 9.904 -4.447 33 HD13 ILE 4 HD13 ILE 4 1.137 11.511 -4.488 34 H GLU 5 H GLU 5 -0.226 9.530 -8.544 35 HA GLU 5 HA GLU 5 0.935 8.536 -10.935 36 HB2 GLU 5 HB2 GLU 5 -1.815 9.114 -10.240 37 HB3 GLU 5 HB3 GLU 5 -1.412 8.591 -11.734 38 HG2 GLU 5 HG2 GLU 5 -0.810 7.028 -9.425 39 HG3 GLU 5 HG3 GLU 5 -2.265 6.917 -10.159 40 H LYS 6 H LYS 6 1.428 11.203 -9.880 41 HA LYS 6 HA LYS 6 2.158 13.051 -10.779 42 HB2 LYS 6 HB2 LYS 6 1.082 12.420 -13.396 43 HB3 LYS 6 HB3 LYS 6 2.244 13.529 -13.099 44 HG2 LYS 6 HG2 LYS 6 3.867 11.984 -12.991 45 HG3 LYS 6 HG3 LYS 6 2.856 10.817 -12.458 46 HD2 LYS 6 HD2 LYS 6 1.875 10.795 -14.696 47 HD3 LYS 6 HD3 LYS 6 3.111 11.751 -15.170 48 HE2 LYS 6 HE2 LYS 6 4.665 10.061 -14.656 49 HE3 LYS 6 HE3 LYS 6 3.479 9.118 -14.048 50 HZ1 LYS 6 HZ1 LYS 6 4.054 8.395 -16.241 51 HZ2 LYS 6 HZ2 LYS 6 3.701 9.860 -16.827 52 HZ3 LYS 6 HZ3 LYS 6 2.526 8.925 -16.225 53 HA PRO 7 HA PRO 7 2.427 15.408 -11.823 54 HB2 PRO 7 HB2 PRO 7 1.426 17.570 -10.172 55 HB3 PRO 7 HB3 PRO 7 2.126 17.722 -11.640 56 HG2 PRO 7 HG2 PRO 7 -0.356 18.095 -11.448 57 HG3 PRO 7 HG3 PRO 7 0.205 17.251 -12.729 58 HD2 PRO 7 HD2 PRO 7 -0.947 16.194 -10.318 59 HD3 PRO 7 HD3 PRO 7 -1.301 15.767 -11.854 60 H GLY 8 H GLY 8 4.325 15.535 -10.610 61 HA2 GLY 8 HA2 GLY 8 5.324 15.774 -8.524 62 HA3 GLY 8 HA3 GLY 8 3.935 15.350 -7.777 63 H SER 9 H SER 9 5.041 13.216 -10.234 64 HA SER 9 HA SER 9 5.489 11.235 -8.283 65 HB2 SER 9 HB2 SER 9 4.675 10.606 -10.460 66 HB3 SER 9 HB3 SER 9 6.104 11.046 -11.117 67 HG SER 9 HG SER 9 5.448 8.772 -10.012 68 H ARG 10 H ARG 10 7.379 10.711 -7.170 69 HA ARG 10 HA ARG 10 9.691 12.182 -7.739 70 HB2 ARG 10 HB2 ARG 10 9.157 11.324 -5.501 71 HB3 ARG 10 HB3 ARG 10 9.638 9.851 -6.017 72 HG2 ARG 10 HG2 ARG 10 11.866 10.658 -6.312 73 HG3 ARG 10 HG3 ARG 10 11.397 12.158 -5.867 74 HD2 ARG 10 HD2 ARG 10 10.900 11.231 -3.643 75 HD3 ARG 10 HD3 ARG 10 11.649 9.862 -4.124 76 HE ARG 10 HE ARG 10 13.695 11.178 -4.433 77 HH11 ARG 10 HH11 ARG 10 15.067 12.491 -3.319 78 HH12 ARG 10 HH12 ARG 10 14.518 13.381 -1.939 79 HH21 ARG 10 HH21 ARG 10 11.273 12.299 -2.115 80 HH22 ARG 10 HH22 ARG 10 12.428 13.277 -1.273 81 H ALA 11 H ALA 11 8.508 9.153 -8.723 82 HA ALA 11 HA ALA 11 10.837 7.889 -9.363 83 HB1 ALA 11 HB1 ALA 11 8.678 6.760 -9.374 84 HB2 ALA 11 HB2 ALA 11 9.455 6.443 -10.757 85 HB3 ALA 11 HB3 ALA 11 8.273 7.546 -10.728 86 H ALA 12 H ALA 12 9.133 10.247 -11.195 87 HA ALA 12 HA ALA 12 10.491 9.886 -13.576 88 HB1 ALA 12 HB1 ALA 12 8.436 11.180 -13.447 89 HB2 ALA 12 HB2 ALA 12 9.575 12.068 -14.174 90 HB3 ALA 12 HB3 ALA 12 9.210 12.336 -12.622 91 H LEU 13 H LEU 13 11.337 11.570 -10.741 92 HA LEU 13 HA LEU 13 13.570 12.857 -11.952 93 HB2 LEU 13 HB2 LEU 13 12.710 12.859 -9.186 94 HB3 LEU 13 HB3 LEU 13 13.887 13.830 -9.769 95 HG LEU 13 HG LEU 13 11.108 14.094 -10.452 96 HD11 LEU 13 HD11 LEU 13 11.179 16.048 -9.004 97 HD12 LEU 13 HD12 LEU 13 12.718 15.715 -8.635 98 HD13 LEU 13 HD13 LEU 13 11.538 14.723 -8.150 99 HD21 LEU 13 HD21 LEU 13 11.698 16.161 -11.470 100 HD22 LEU 13 HD22 LEU 13 12.462 14.938 -12.201 101 HD23 LEU 13 HD23 LEU 13 13.259 15.880 -11.156 102 H CYS 14 H CYS 14 12.941 9.930 -10.768 103 HA CYS 14 HA CYS 14 15.303 9.628 -9.262 104 HB2 CYS 14 HB2 CYS 14 13.170 8.716 -8.585 105 HB3 CYS 14 HB3 CYS 14 13.267 7.677 -9.841 106 H SER 15 H SER 15 13.960 8.273 -12.156 107 HA SER 15 HA SER 15 15.924 6.346 -12.436 108 HB2 SER 15 HB2 SER 15 13.834 6.163 -13.629 109 HB3 SER 15 HB3 SER 15 14.238 7.456 -14.542 110 HG SER 15 HG SER 15 15.367 4.954 -14.567 111 H GLU 16 H GLU 16 17.963 6.355 -13.158 112 HA GLU 16 HA GLU 16 19.151 8.748 -13.933 113 HB2 GLU 16 HB2 GLU 16 21.114 7.407 -14.289 114 HB3 GLU 16 HB3 GLU 16 20.418 7.059 -12.854 115 HG2 GLU 16 HG2 GLU 16 19.366 5.143 -13.968 116 HG3 GLU 16 HG3 GLU 16 20.367 5.432 -15.226 117 H ALA 17 H ALA 17 17.571 6.293 -15.657 118 HA ALA 17 HA ALA 17 18.708 6.725 -18.123 119 HB1 ALA 17 HB1 ALA 17 17.346 4.769 -17.659 120 HB2 ALA 17 HB2 ALA 17 16.791 5.497 -18.992 121 HB3 ALA 17 HB3 ALA 17 16.026 5.700 -17.581 122 H PHE 18 H PHE 18 16.535 8.630 -16.396 123 HA PHE 18 HA PHE 18 15.479 9.919 -18.676 124 HB2 PHE 18 HB2 PHE 18 14.218 9.646 -16.592 125 HB3 PHE 18 HB3 PHE 18 15.228 10.717 -15.885 126 HD1 PHE 18 HD1 PHE 18 14.752 13.028 -15.921 127 HD2 PHE 18 HD2 PHE 18 12.741 10.467 -18.512 128 HE1 PHE 18 HE1 PHE 18 13.324 14.848 -16.599 129 HE2 PHE 18 HE2 PHE 18 11.306 12.281 -19.201 130 HZ PHE 18 HZ PHE 18 11.596 14.479 -18.242 131 H GLY 19 H GLY 19 18.303 10.290 -16.956 132 HA2 GLY 19 HA2 GLY 19 18.661 12.933 -18.074 133 HA3 GLY 19 HA3 GLY 19 19.120 12.612 -16.539 134 H PHE 20 H PHE 20 19.824 9.926 -17.926 135 HA PHE 20 HA PHE 20 21.626 8.887 -18.453 136 HB2 PHE 20 HB2 PHE 20 21.492 9.989 -20.563 137 HB3 PHE 20 HB3 PHE 20 22.408 11.218 -19.999 138 HD1 PHE 20 HD1 PHE 20 22.925 7.605 -19.867 139 HD2 PHE 20 HD2 PHE 20 24.412 11.258 -21.193 140 HE1 PHE 20 HE1 PHE 20 24.923 6.501 -20.648 141 HE2 PHE 20 HE2 PHE 20 26.414 10.166 -21.978 142 HZ PHE 20 HZ PHE 20 26.681 7.785 -21.689 143 H LEU 21 H LEU 21 22.966 12.050 -17.830 144 HA LEU 21 HA LEU 21 25.010 10.796 -16.262 145 HB2 LEU 21 HB2 LEU 21 24.919 13.518 -17.250 146 HB3 LEU 21 HB3 LEU 21 26.194 12.883 -16.451 147 HG LEU 21 HG LEU 21 25.356 12.041 -19.068 148 HD11 LEU 21 HD11 LEU 21 27.320 13.213 -19.865 149 HD12 LEU 21 HD12 LEU 21 27.622 13.723 -18.360 150 HD13 LEU 21 HD13 LEU 21 26.310 14.250 -19.144 151 HD21 LEU 21 HD21 LEU 21 27.404 10.803 -19.167 152 HD22 LEU 21 HD22 LEU 21 26.483 10.266 -17.951 153 HD23 LEU 21 HD23 LEU 21 27.742 11.233 -17.645 154 H ASN 22 H ASN 22 22.090 12.028 -15.789 155 HA ASN 22 HA ASN 22 22.754 13.055 -13.211 156 HB2 ASN 22 HB2 ASN 22 21.031 14.380 -15.163 157 HB3 ASN 22 HB3 ASN 22 21.035 14.852 -13.599 158 HD21 ASN 22 HD21 ASN 22 23.770 16.216 -16.113 159 HD22 ASN 22 HD22 ASN 22 22.500 15.139 -16.590 160 H LEU 23 H LEU 23 21.519 12.551 -11.501 161 HA LEU 23 HA LEU 23 18.754 11.904 -11.894 162 HB2 LEU 23 HB2 LEU 23 18.695 9.900 -10.918 163 HB3 LEU 23 HB3 LEU 23 19.953 9.798 -11.955 164 HG LEU 23 HG LEU 23 20.333 10.181 -9.143 165 HD11 LEU 23 HD11 LEU 23 20.741 7.785 -9.012 166 HD12 LEU 23 HD12 LEU 23 20.339 7.638 -10.571 167 HD13 LEU 23 HD13 LEU 23 19.220 8.062 -9.483 168 HD21 LEU 23 HD21 LEU 23 22.560 9.410 -9.509 169 HD22 LEU 23 HD22 LEU 23 22.270 10.739 -10.382 170 HD23 LEU 23 HD23 LEU 23 22.262 9.287 -11.093 171 H ASN 24 H ASN 24 17.559 12.187 -9.761 172 HA ASN 24 HA ASN 24 19.220 13.295 -7.700 173 HB2 ASN 24 HB2 ASN 24 17.802 15.213 -7.377 174 HB3 ASN 24 HB3 ASN 24 18.490 15.230 -8.858 175 HD21 ASN 24 HD21 ASN 24 15.562 14.968 -10.685 176 HD22 ASN 24 HD22 ASN 24 17.272 14.698 -10.726 177 H CYS 25 H CYS 25 17.991 10.784 -7.860 178 HA CYS 25 HA CYS 25 15.607 10.786 -6.537 179 HB2 CYS 25 HB2 CYS 25 16.807 8.961 -7.767 180 HB3 CYS 25 HB3 CYS 25 17.402 8.573 -6.296 181 H GLY 26 H GLY 26 18.766 10.203 -5.160 182 HA2 GLY 26 HA2 GLY 26 19.419 10.615 -3.014 183 HA3 GLY 26 HA3 GLY 26 17.917 11.123 -2.620 184 H SER 27 H SER 27 19.591 9.472 -0.958 185 HA SER 27 HA SER 27 18.886 6.805 -1.240 186 HB2 SER 27 HB2 SER 27 20.797 7.589 0.105 187 HB3 SER 27 HB3 SER 27 19.740 8.066 1.256 188 HG SER 27 HG SER 27 19.933 6.196 2.037 189 H VAL 28 H VAL 28 17.274 9.369 0.216 190 HA VAL 28 HA VAL 28 15.537 8.026 1.867 191 HB VAL 28 HB VAL 28 15.952 10.503 1.753 192 HG11 VAL 28 HG11 VAL 28 14.549 11.811 0.324 193 HG12 VAL 28 HG12 VAL 28 13.960 10.460 -0.340 194 HG13 VAL 28 HG13 VAL 28 15.513 10.855 -0.554 195 HG21 VAL 28 HG21 VAL 28 13.821 11.143 2.631 196 HG22 VAL 28 HG22 VAL 28 14.300 9.741 3.280 197 HG23 VAL 28 HG23 VAL 28 13.184 9.751 2.110 198 H MET 29 H MET 29 15.653 7.794 -1.384 199 HA MET 29 HA MET 29 13.083 7.604 -2.112 200 HB2 MET 29 HB2 MET 29 13.924 6.331 -4.017 201 HB3 MET 29 HB3 MET 29 15.014 7.485 -3.633 202 HG2 MET 29 HG2 MET 29 16.295 5.915 -2.481 203 HG3 MET 29 HG3 MET 29 15.193 4.756 -2.814 204 HE1 MET 29 HE1 MET 29 15.642 3.883 -6.476 205 HE2 MET 29 HE2 MET 29 14.450 4.673 -5.720 206 HE3 MET 29 HE3 MET 29 15.091 3.347 -5.053 207 H TYR 30 H TYR 30 14.327 5.520 0.074 208 HA TYR 30 HA TYR 30 13.289 3.135 -0.913 209 HB2 TYR 30 HB2 TYR 30 15.082 3.116 0.664 210 HB3 TYR 30 HB3 TYR 30 14.149 3.871 1.771 211 HD1 TYR 30 HD1 TYR 30 14.541 0.689 0.059 212 HD2 TYR 30 HD2 TYR 30 12.872 2.623 3.343 213 HE1 TYR 30 HE1 TYR 30 13.906 -1.446 1.002 214 HE2 TYR 30 HE2 TYR 30 12.225 0.493 4.271 215 HH TYR 30 HH TYR 30 12.564 -1.764 4.204 216 H GLU 31 H GLU 31 11.990 5.497 1.297 217 HA GLU 31 HA GLU 31 9.482 4.362 0.836 218 HB2 GLU 31 HB2 GLU 31 8.924 4.033 3.200 219 HB3 GLU 31 HB3 GLU 31 10.192 3.103 2.757 220 HG2 GLU 31 HG2 GLU 31 11.676 4.600 3.829 221 HG3 GLU 31 HG3 GLU 31 10.419 5.554 4.252 222 HA PRO 32 HA PRO 32 9.154 8.752 1.836 223 HB2 PRO 32 HB2 PRO 32 8.812 9.946 -0.542 224 HB3 PRO 32 HB3 PRO 32 10.333 9.662 -0.017 225 HG2 PRO 32 HG2 PRO 32 8.771 8.053 -1.780 226 HG3 PRO 32 HG3 PRO 32 10.307 8.566 -1.994 227 HD2 PRO 32 HD2 PRO 32 9.882 6.183 -1.091 228 HD3 PRO 32 HD3 PRO 32 11.142 7.044 -0.511 229 H GLN 33 H GLN 33 7.289 6.637 0.081 230 HA GLN 33 HA GLN 33 4.969 8.190 0.623 231 HB2 GLN 33 HB2 GLN 33 5.337 5.903 -1.064 232 HB3 GLN 33 HB3 GLN 33 3.823 6.340 -0.635 233 HG2 GLN 33 HG2 GLN 33 3.912 7.517 -2.516 234 HG3 GLN 33 HG3 GLN 33 4.664 8.613 -1.567 235 HE21 GLN 33 HE21 GLN 33 7.013 6.390 -3.999 236 HE22 GLN 33 HE22 GLN 33 5.681 5.672 -3.155 237 H SER 34 H SER 34 6.682 6.187 2.440 238 HA SER 34 HA SER 34 4.337 5.023 3.683 239 HB2 SER 34 HB2 SER 34 6.126 3.461 3.274 240 HB3 SER 34 HB3 SER 34 7.106 4.349 4.232 241 HG SER 34 HG SER 34 5.600 3.961 5.926 242 H LEU 35 H LEU 35 3.583 6.949 4.620 243 HA LEU 35 HA LEU 35 5.156 7.876 6.888 244 HB2 LEU 35 HB2 LEU 35 3.310 9.385 5.307 245 HB3 LEU 35 HB3 LEU 35 4.042 9.944 6.656 246 HG LEU 35 HG LEU 35 5.507 9.242 4.281 247 HD11 LEU 35 HD11 LEU 35 5.621 11.605 3.804 248 HD12 LEU 35 HD12 LEU 35 4.654 11.905 5.065 249 HD13 LEU 35 HD13 LEU 35 4.083 11.108 3.779 250 HD21 LEU 35 HD21 LEU 35 7.315 10.463 5.260 251 HD22 LEU 35 HD22 LEU 35 6.879 9.239 6.224 252 HD23 LEU 35 HD23 LEU 35 6.416 10.748 6.574 253 H GLU 36 H GLU 36 4.244 7.333 8.852 254 HA GLU 36 HA GLU 36 1.425 6.791 8.774 255 HB2 GLU 36 HB2 GLU 36 3.296 5.183 10.291 256 HB3 GLU 36 HB3 GLU 36 1.691 4.900 10.193 257 HG2 GLU 36 HG2 GLU 36 2.161 4.648 7.727 258 HG3 GLU 36 HG3 GLU 36 3.692 4.376 8.227 259 H ALA 37 H ALA 37 0.152 7.261 10.553 260 HA ALA 37 HA ALA 37 1.429 8.612 12.771 261 HB1 ALA 37 HB1 ALA 37 0.645 10.373 11.368 262 HB2 ALA 37 HB2 ALA 37 -0.274 10.330 12.698 263 HB3 ALA 37 HB3 ALA 37 -0.828 9.708 11.312 264 H LYS 38 H LYS 38 0.046 8.519 14.770 265 HA LYS 38 HA LYS 38 -1.749 6.260 14.611 266 HB2 LYS 38 HB2 LYS 38 0.115 6.531 16.326 267 HB3 LYS 38 HB3 LYS 38 -1.049 7.332 17.146 268 HG2 LYS 38 HG2 LYS 38 -2.381 5.460 17.243 269 HG3 LYS 38 HG3 LYS 38 -1.438 4.663 16.174 270 HD2 LYS 38 HD2 LYS 38 0.319 4.676 17.824 271 HD3 LYS 38 HD3 LYS 38 -0.754 5.293 18.889 272 HE2 LYS 38 HE2 LYS 38 -2.121 3.361 18.651 273 HE3 LYS 38 HE3 LYS 38 -1.075 2.747 17.556 274 HZ1 LYS 38 HZ1 LYS 38 -0.734 1.734 19.668 275 HZ2 LYS 38 HZ2 LYS 38 -0.454 3.182 20.331 276 HZ3 LYS 38 HZ3 LYS 38 0.581 2.574 19.247 277 H LYS 39 H LYS 39 -3.930 6.343 15.158 278 HA LYS 39 HA LYS 39 -5.133 8.841 14.866 279 HB2 LYS 39 HB2 LYS 39 -6.183 6.245 15.525 280 HB3 LYS 39 HB3 LYS 39 -7.176 7.542 15.540 281 HG2 LYS 39 HG2 LYS 39 -7.178 7.729 13.314 282 HG3 LYS 39 HG3 LYS 39 -5.700 7.053 13.159 283 HD2 LYS 39 HD2 LYS 39 -7.314 5.594 12.279 284 HD3 LYS 39 HD3 LYS 39 -6.633 4.916 13.599 285 HE2 LYS 39 HE2 LYS 39 -8.573 5.563 14.886 286 HE3 LYS 39 HE3 LYS 39 -9.260 6.129 13.517 287 HZ1 LYS 39 HZ1 LYS 39 -10.072 3.943 13.995 288 HZ2 LYS 39 HZ2 LYS 39 -8.563 3.363 13.961 289 HZ3 LYS 39 HZ3 LYS 39 -9.244 3.924 12.606 290 H GLY 40 H GLY 40 -5.871 10.330 16.298 291 HA2 GLY 40 HA2 GLY 40 -6.577 9.822 18.905 292 HA3 GLY 40 HA3 GLY 40 -5.008 10.275 18.928 293 H PHE 41 H PHE 41 -6.983 11.898 20.106 294 HA PHE 41 HA PHE 41 -7.403 13.986 18.198 295 HB2 PHE 41 HB2 PHE 41 -8.336 13.737 20.917 296 HB3 PHE 41 HB3 PHE 41 -8.701 15.018 19.972 297 HD1 PHE 41 HD1 PHE 41 -9.809 11.909 20.991 298 HD2 PHE 41 HD2 PHE 41 -9.899 14.482 17.722 299 HE1 PHE 41 HE1 PHE 41 -11.707 10.709 20.106 300 HE2 PHE 41 HE2 PHE 41 -11.790 13.286 16.822 301 HZ PHE 41 HZ PHE 41 -12.691 11.388 18.009 302 HA PRO 42 HA PRO 42 -7.659 16.317 18.059 303 HB2 PRO 42 HB2 PRO 42 -6.328 18.430 17.151 304 HB3 PRO 42 HB3 PRO 42 -6.890 18.480 18.683 305 HG2 PRO 42 HG2 PRO 42 -4.258 17.785 17.812 306 HG3 PRO 42 HG3 PRO 42 -4.671 18.826 19.000 307 HD2 PRO 42 HD2 PRO 42 -3.990 16.370 19.570 308 HD3 PRO 42 HD3 PRO 42 -5.101 17.151 20.477 309 H HIS 43 H HIS 43 -8.164 16.239 15.875 310 HA HIS 43 HA HIS 43 -6.000 15.542 14.162 311 HB2 HIS 43 HB2 HIS 43 -7.543 13.564 15.151 312 HB3 HIS 43 HB3 HIS 43 -8.132 13.770 13.641 313 HD1 HIS 43 HD1 HIS 43 -7.226 11.952 12.131 314 HD2 HIS 43 HD2 HIS 43 -4.464 13.472 14.756 315 HE1 HIS 43 HE1 HIS 43 -5.019 10.899 11.667 316 HE2 HIS 43 HE2 HIS 43 -3.342 11.813 13.226 317 H SER 44 H SER 44 -8.051 17.696 14.451 318 HA SER 44 HA SER 44 -9.437 17.469 11.982 319 HB2 SER 44 HB2 SER 44 -10.592 18.402 13.929 320 HB3 SER 44 HB3 SER 44 -9.581 19.684 13.886 321 HG SER 44 HG SER 44 -10.452 19.798 11.611 322 H GLY 45 H GLY 45 -6.831 19.308 13.258 323 HA2 GLY 45 HA2 GLY 45 -6.688 20.965 10.927 324 HA3 GLY 45 HA3 GLY 45 -5.764 21.106 12.266 325 HA PRO 46 HA PRO 46 -3.384 18.869 9.066 326 HB2 PRO 46 HB2 PRO 46 -1.632 20.698 8.220 327 HB3 PRO 46 HB3 PRO 46 -3.133 20.719 7.575 328 HG2 PRO 46 HG2 PRO 46 -2.145 22.287 9.740 329 HG3 PRO 46 HG3 PRO 46 -2.955 22.805 8.420 330 HD2 PRO 46 HD2 PRO 46 -4.238 22.399 10.656 331 HD3 PRO 46 HD3 PRO 46 -4.969 22.082 9.230 332 H ALA 47 H ALA 47 -2.587 20.565 11.820 333 HA ALA 47 HA ALA 47 0.032 19.509 12.003 334 HB1 ALA 47 HB1 ALA 47 -0.450 21.613 13.081 335 HB2 ALA 47 HB2 ALA 47 0.052 20.560 14.200 336 HB3 ALA 47 HB3 ALA 47 -1.523 20.889 14.049 337 H ASP 48 H ASP 48 0.624 17.539 12.725 338 HA ASP 48 HA ASP 48 -0.985 16.215 14.693 339 HB2 ASP 48 HB2 ASP 48 -1.812 15.429 12.542 340 HB3 ASP 48 HB3 ASP 48 -0.333 14.791 12.269 341 H GLY 49 H GLY 49 0.244 14.487 15.785 342 HA2 GLY 49 HA2 GLY 49 2.107 13.465 16.446 343 HA3 GLY 49 HA3 GLY 49 2.825 13.844 15.029 344 H GLN 50 H GLN 50 2.725 16.726 15.486 345 HA GLN 50 HA GLN 50 4.800 16.887 17.494 346 HB2 GLN 50 HB2 GLN 50 4.552 18.475 15.093 347 HB3 GLN 50 HB3 GLN 50 5.684 18.760 16.235 348 HG2 GLN 50 HG2 GLN 50 6.575 16.557 15.789 349 HG3 GLN 50 HG3 GLN 50 5.543 16.454 14.527 350 HE21 GLN 50 HE21 GLN 50 7.868 17.778 12.371 351 HE22 GLN 50 HE22 GLN 50 6.700 16.541 12.697 352 H ILE 51 H ILE 51 2.088 17.040 18.097 353 HA ILE 51 HA ILE 51 1.154 19.605 18.182 354 HB ILE 51 HB ILE 51 0.452 17.431 20.028 355 HG12 ILE 51 HG12 ILE 51 0.067 16.757 17.809 356 HG13 ILE 51 HG13 ILE 51 -1.354 16.904 18.600 357 HG21 ILE 51 HG21 ILE 51 -1.636 18.567 20.456 358 HG22 ILE 51 HG22 ILE 51 -1.160 19.800 19.525 359 HG23 ILE 51 HG23 ILE 51 -0.394 19.495 20.916 360 HD11 ILE 51 HD11 ILE 51 -1.566 17.777 16.373 361 HD12 ILE 51 HD12 ILE 51 -0.372 18.830 16.655 362 HD13 ILE 51 HD13 ILE 51 -1.779 18.975 17.438 363 H ALA 52 H ALA 52 3.130 17.874 20.420 364 HA ALA 52 HA ALA 52 2.908 19.617 22.517 365 HB1 ALA 52 HB1 ALA 52 3.858 17.365 22.740 366 HB2 ALA 52 HB2 ALA 52 4.853 18.438 23.428 367 HB3 ALA 52 HB3 ALA 52 5.185 17.854 21.957 368 H SER 53 H SER 53 5.152 19.747 19.876 369 HA SER 53 HA SER 53 6.462 21.973 21.090 370 HB2 SER 53 HB2 SER 53 8.038 21.774 19.222 371 HB3 SER 53 HB3 SER 53 7.853 20.328 19.959 372 HG SER 53 HG SER 53 6.863 19.524 18.310 373 H ALA 54 H ALA 54 4.088 21.349 18.863 374 HA ALA 54 HA ALA 54 3.040 22.500 17.321 375 HB1 ALA 54 HB1 ALA 54 2.342 23.844 19.230 376 HB2 ALA 54 HB2 ALA 54 2.346 24.759 17.896 377 HB3 ALA 54 HB3 ALA 54 3.563 24.867 18.956 378 H GLY 55 H GLY 55 5.947 22.258 16.941 379 HA2 GLY 55 HA2 GLY 55 6.515 24.598 15.366 380 HA3 GLY 55 HA3 GLY 55 7.632 23.574 15.977 381 H GLY 56 H GLY 56 5.461 21.547 14.799 382 HA2 GLY 56 HA2 GLY 56 7.067 20.706 12.740 383 HA3 GLY 56 HA3 GLY 56 5.514 20.252 12.963 384 H LEU 57 H LEU 57 4.614 23.066 12.637 385 HA LEU 57 HA LEU 57 4.109 22.968 9.918 386 HB2 LEU 57 HB2 LEU 57 3.858 25.252 11.684 387 HB3 LEU 57 HB3 LEU 57 3.134 25.148 10.224 388 HG LEU 57 HG LEU 57 2.452 23.463 12.453 389 HD11 LEU 57 HD11 LEU 57 0.474 24.844 12.660 390 HD12 LEU 57 HD12 LEU 57 1.024 25.800 11.477 391 HD13 LEU 57 HD13 LEU 57 1.801 25.737 12.894 392 HD21 LEU 57 HD21 LEU 57 0.527 22.818 11.197 393 HD22 LEU 57 HD22 LEU 57 1.877 22.409 10.406 394 HD23 LEU 57 HD23 LEU 57 1.035 23.712 9.949 395 H PHE 58 H PHE 58 6.663 24.318 11.682 396 HA PHE 58 HA PHE 58 7.533 26.002 9.581 397 HB2 PHE 58 HB2 PHE 58 8.938 25.420 12.044 398 HB3 PHE 58 HB3 PHE 58 9.238 26.695 11.068 399 HD1 PHE 58 HD1 PHE 58 7.906 25.975 14.049 400 HD2 PHE 58 HD2 PHE 58 6.938 28.130 10.626 401 HE1 PHE 58 HE1 PHE 58 6.325 27.276 15.328 402 HE2 PHE 58 HE2 PHE 58 5.354 29.442 11.891 403 HZ PHE 58 HZ PHE 58 5.045 29.016 14.247 404 H GLY 59 H GLY 59 7.676 22.830 9.899 405 HA2 GLY 59 HA2 GLY 59 10.296 22.183 9.353 406 HA3 GLY 59 HA3 GLY 59 9.002 21.267 8.963 407 H GLY 60 H GLY 60 7.990 23.595 7.299 408 HA2 GLY 60 HA2 GLY 60 9.019 22.802 4.858 409 HA3 GLY 60 HA3 GLY 60 8.136 24.150 5.122 410 H ILE 61 H ILE 61 10.251 25.071 7.089 411 HA ILE 61 HA ILE 61 11.785 26.539 5.293 412 HB ILE 61 HB ILE 61 12.282 26.140 8.143 413 HG12 ILE 61 HG12 ILE 61 10.193 27.171 7.784 414 HG13 ILE 61 HG13 ILE 61 11.218 28.213 8.514 415 HG21 ILE 61 HG21 ILE 61 13.696 28.101 8.083 416 HG22 ILE 61 HG22 ILE 61 13.498 28.198 6.481 417 HG23 ILE 61 HG23 ILE 61 14.302 26.950 7.122 418 HD11 ILE 61 HD11 ILE 61 9.939 29.368 6.833 419 HD12 ILE 61 HD12 ILE 61 10.489 28.355 5.698 420 HD13 ILE 61 HD13 ILE 61 11.503 29.387 6.420 421 H LEU 62 H LEU 62 12.345 23.656 7.132 422 HA LEU 62 HA LEU 62 15.011 23.353 6.365 423 HB2 LEU 62 HB2 LEU 62 13.165 21.510 7.559 424 HB3 LEU 62 HB3 LEU 62 14.668 21.020 7.150 425 HG LEU 62 HG LEU 62 15.502 22.704 8.702 426 HD11 LEU 62 HD11 LEU 62 14.070 23.453 10.469 427 HD12 LEU 62 HD12 LEU 62 12.797 22.795 9.721 428 HD13 LEU 62 HD13 LEU 62 13.573 24.044 9.048 429 HD21 LEU 62 HD21 LEU 62 15.156 21.213 10.611 430 HD22 LEU 62 HD22 LEU 62 15.479 20.348 9.283 431 HD23 LEU 62 HD23 LEU 62 13.956 20.483 9.809 432 H ASP 63 H ASP 63 12.004 22.474 4.992 433 HA ASP 63 HA ASP 63 13.086 20.682 3.150 434 HB2 ASP 63 HB2 ASP 63 10.726 20.667 3.817 435 HB3 ASP 63 HB3 ASP 63 10.506 21.956 2.837 436 H GLN 64 H GLN 64 13.678 23.785 3.293 437 HA GLN 64 HA GLN 64 13.671 24.201 0.453 438 HB2 GLN 64 HB2 GLN 64 13.537 25.910 2.548 439 HB3 GLN 64 HB3 GLN 64 14.912 26.265 1.743 440 HG2 GLN 64 HG2 GLN 64 13.048 27.563 0.979 441 HG3 GLN 64 HG3 GLN 64 13.720 26.678 -0.218 442 HE21 GLN 64 HE21 GLN 64 10.179 25.315 1.211 443 HE22 GLN 64 HE22 GLN 64 11.369 25.974 2.283 444 H GLN 65 H GLN 65 15.758 23.390 3.040 445 HA GLN 65 HA GLN 65 17.830 22.769 1.208 446 HB2 GLN 65 HB2 GLN 65 18.293 25.062 1.876 447 HB3 GLN 65 HB3 GLN 65 18.418 24.553 3.423 448 HG2 GLN 65 HG2 GLN 65 20.338 23.291 2.849 449 HG3 GLN 65 HG3 GLN 65 20.215 23.811 1.306 450 HE21 GLN 65 HE21 GLN 65 22.320 25.906 3.853 451 HE22 GLN 65 HE22 GLN 65 21.823 24.260 4.064 452 H SER 66 H SER 66 17.731 20.586 1.665 453 HA SER 66 HA SER 66 18.926 19.818 4.139 454 HB2 SER 66 HB2 SER 66 16.650 19.725 4.809 455 HB3 SER 66 HB3 SER 66 16.260 18.860 3.479 456 HG SER 66 HG SER 66 17.249 18.029 5.805 457 H GLU 67 H GLU 67 19.825 17.644 4.081 458 HA GLU 67 HA GLU 67 20.580 16.816 1.522 459 HB2 GLU 67 HB2 GLU 67 21.750 16.426 3.698 460 HB3 GLU 67 HB3 GLU 67 20.751 15.146 3.872 461 HG2 GLU 67 HG2 GLU 67 22.741 14.327 3.064 462 HG3 GLU 67 HG3 GLU 67 21.671 14.249 1.833 463 H ASN 68 H ASN 68 18.106 15.916 3.688 464 HA ASN 68 HA ASN 68 17.171 13.825 1.931 465 HB2 ASN 68 HB2 ASN 68 16.767 14.189 4.760 466 HB3 ASN 68 HB3 ASN 68 15.854 13.131 3.915 467 HD21 ASN 68 HD21 ASN 68 19.246 11.911 5.371 468 HD22 ASN 68 HD22 ASN 68 18.351 13.299 5.893 469 H ARG 69 H ARG 69 16.824 16.645 1.532 470 HA ARG 69 HA ARG 69 14.311 17.576 2.078 471 HB2 ARG 69 HB2 ARG 69 16.124 18.819 1.037 472 HB3 ARG 69 HB3 ARG 69 15.801 18.043 -0.363 473 HG2 ARG 69 HG2 ARG 69 13.801 19.169 -0.591 474 HG3 ARG 69 HG3 ARG 69 13.959 19.834 0.892 475 HD2 ARG 69 HD2 ARG 69 14.575 21.449 -0.725 476 HD3 ARG 69 HD3 ARG 69 15.911 21.021 0.110 477 HE ARG 69 HE ARG 69 15.769 19.394 -2.108 478 HH11 ARG 69 HH11 ARG 69 16.418 22.789 -1.391 479 HH12 ARG 69 HH12 ARG 69 17.388 22.982 -2.812 480 HH21 ARG 69 HH21 ARG 69 17.022 19.734 -3.887 481 HH22 ARG 69 HH22 ARG 69 17.722 21.288 -4.196 482 H TRP 70 H TRP 70 12.326 17.744 0.845 483 HA TRP 70 HA TRP 70 11.704 15.202 -0.254 484 HB2 TRP 70 HB2 TRP 70 9.995 17.511 0.114 485 HB3 TRP 70 HB3 TRP 70 9.450 16.034 -0.318 486 HD1 TRP 70 HD1 TRP 70 11.121 14.426 1.895 487 HE1 TRP 70 HE1 TRP 70 10.437 14.400 4.305 488 HE3 TRP 70 HE3 TRP 70 8.308 18.563 1.789 489 HZ2 TRP 70 HZ2 TRP 70 8.826 16.057 5.922 490 HZ3 TRP 70 HZ3 TRP 70 7.251 19.312 3.835 491 HH2 TRP 70 HH2 TRP 70 7.500 18.045 5.878 492 H PHE 71 H PHE 71 10.435 15.083 -2.357 493 HA PHE 71 HA PHE 71 11.948 16.397 -4.329 494 HB2 PHE 71 HB2 PHE 71 10.539 15.242 -5.882 495 HB3 PHE 71 HB3 PHE 71 11.195 14.234 -4.777 496 HD1 PHE 71 HD1 PHE 71 9.799 13.036 -3.183 497 HD2 PHE 71 HD2 PHE 71 8.146 15.787 -5.816 498 HE1 PHE 71 HE1 PHE 71 7.592 12.224 -2.636 499 HE2 PHE 71 HE2 PHE 71 5.947 15.019 -5.257 500 HZ PHE 71 HZ PHE 71 5.658 13.221 -3.681 501 H LYS 72 H LYS 72 11.426 18.159 -5.619 502 HA LYS 72 HA LYS 72 8.918 19.496 -4.989 503 HB2 LYS 72 HB2 LYS 72 11.455 20.828 -5.333 504 HB3 LYS 72 HB3 LYS 72 10.039 21.575 -5.012 505 HG2 LYS 72 HG2 LYS 72 9.998 20.686 -2.840 506 HG3 LYS 72 HG3 LYS 72 11.302 19.754 -3.155 507 HD2 LYS 72 HD2 LYS 72 12.344 21.384 -2.076 508 HD3 LYS 72 HD3 LYS 72 12.375 22.049 -3.567 509 HE2 LYS 72 HE2 LYS 72 11.621 23.730 -2.232 510 HE3 LYS 72 HE3 LYS 72 10.266 23.157 -2.941 511 HZ1 LYS 72 HZ1 LYS 72 9.899 23.474 -0.616 512 HZ2 LYS 72 HZ2 LYS 72 11.120 22.469 -0.276 513 HZ3 LYS 72 HZ3 LYS 72 9.778 21.902 -0.979 514 H HIS 73 H HIS 73 7.728 20.108 -6.770 515 HA HIS 73 HA HIS 73 9.098 19.954 -9.338 516 HB2 HIS 73 HB2 HIS 73 6.390 19.180 -8.759 517 HB3 HIS 73 HB3 HIS 73 6.945 19.352 -10.285 518 HD1 HIS 73 HD1 HIS 73 7.476 17.211 -7.258 519 HD2 HIS 73 HD2 HIS 73 8.232 17.140 -11.286 520 HE1 HIS 73 HE1 HIS 73 8.337 14.953 -7.866 521 HE2 HIS 73 HE2 HIS 73 8.788 14.886 -10.289 522 H ILE 74 H ILE 74 8.676 21.661 -10.872 523 HA ILE 74 HA ILE 74 7.450 23.939 -9.643 524 HB ILE 74 HB ILE 74 8.974 23.905 -12.137 525 HG12 ILE 74 HG12 ILE 74 9.900 24.857 -9.570 526 HG13 ILE 74 HG13 ILE 74 10.298 23.392 -10.171 527 HG21 ILE 74 HG21 ILE 74 9.013 26.325 -11.976 528 HG22 ILE 74 HG22 ILE 74 8.094 26.258 -10.648 529 HG23 ILE 74 HG23 ILE 74 7.483 25.812 -12.077 530 HD11 ILE 74 HD11 ILE 74 12.101 24.932 -10.515 531 HD12 ILE 74 HD12 ILE 74 11.123 25.911 -11.353 532 HD13 ILE 74 HD13 ILE 74 11.517 24.460 -11.948 533 H MET 75 H MET 75 5.486 24.768 -10.248 534 HA MET 75 HA MET 75 4.310 23.794 -12.681 535 HB2 MET 75 HB2 MET 75 2.993 23.874 -10.107 536 HB3 MET 75 HB3 MET 75 2.176 23.632 -11.500 537 HG2 MET 75 HG2 MET 75 3.424 21.675 -11.854 538 HG3 MET 75 HG3 MET 75 4.154 21.906 -10.411 539 HE1 MET 75 HE1 MET 75 -0.197 20.731 -11.029 540 HE2 MET 75 HE2 MET 75 0.929 20.732 -12.190 541 HE3 MET 75 HE3 MET 75 0.405 22.130 -11.570 542 H THR 76 H THR 76 2.619 25.202 -13.566 543 HA THR 76 HA THR 76 2.921 27.930 -12.687 544 HB THR 76 HB THR 76 1.845 28.428 -14.893 545 HG1 THR 76 HG1 THR 76 1.744 25.781 -14.871 546 HG21 THR 76 HG21 THR 76 3.873 28.085 -16.125 547 HG22 THR 76 HG22 THR 76 4.402 27.051 -15.000 548 HG23 THR 76 HG23 THR 76 4.253 28.622 -14.647 549 H GLY 77 H GLY 77 0.791 29.299 -12.990 550 HA2 GLY 77 HA2 GLY 77 -1.169 28.189 -11.377 551 HA3 GLY 77 HA3 GLY 77 -1.302 29.581 -12.220 552 H GLY 78 H GLY 78 -3.622 28.645 -12.102 553 HA2 GLY 78 HA2 GLY 78 -5.142 28.234 -13.858 554 HA3 GLY 78 HA3 GLY 78 -4.058 27.260 -14.594 555 H GLU 79 H GLU 79 -6.197 25.976 -14.702 556 HA GLU 79 HA GLU 79 -6.823 24.610 -12.303 557 HB2 GLU 79 HB2 GLU 79 -8.068 24.958 -14.692 558 HB3 GLU 79 HB3 GLU 79 -7.895 23.345 -14.502 559 HG2 GLU 79 HG2 GLU 79 -9.245 25.053 -12.614 560 HG3 GLU 79 HG3 GLU 79 -10.011 24.106 -13.701 561 H HIS 80 H HIS 80 -6.245 22.493 -11.680 562 HA HIS 80 HA HIS 80 -4.691 20.981 -13.554 563 HB2 HIS 80 HB2 HIS 80 -3.759 21.317 -10.831 564 HB3 HIS 80 HB3 HIS 80 -2.950 20.551 -12.025 565 HD1 HIS 80 HD1 HIS 80 -3.205 23.724 -10.364 566 HD2 HIS 80 HD2 HIS 80 -1.987 22.435 -14.059 567 HE1 HIS 80 HE1 HIS 80 -1.840 25.517 -11.421 568 HE2 HIS 80 HE2 HIS 80 -1.128 24.778 -13.659 569 H THR 81 H THR 81 -4.491 18.648 -12.972 570 HA THR 81 HA THR 81 -6.483 17.846 -11.026 571 HB THR 81 HB THR 81 -5.941 16.266 -13.398 572 HG1 THR 81 HG1 THR 81 -7.515 17.222 -14.471 573 HG21 THR 81 HG21 THR 81 -8.032 15.220 -12.870 574 HG22 THR 81 HG22 THR 81 -8.230 16.212 -11.608 575 HG23 THR 81 HG23 THR 81 -7.057 15.098 -11.586 576 H PHE 82 H PHE 82 -5.638 16.526 -9.405 577 HA PHE 82 HA PHE 82 -2.986 15.470 -9.894 578 HB2 PHE 82 HB2 PHE 82 -4.172 16.386 -7.426 579 HB3 PHE 82 HB3 PHE 82 -2.802 15.497 -7.424 580 HD1 PHE 82 HD1 PHE 82 -0.695 16.527 -7.622 581 HD2 PHE 82 HD2 PHE 82 -4.122 18.663 -8.638 582 HE1 PHE 82 HE1 PHE 82 0.623 18.540 -7.824 583 HE2 PHE 82 HE2 PHE 82 -2.814 20.678 -8.833 584 HZ PHE 82 HZ PHE 82 -0.442 20.621 -8.415 585 H THR 83 H THR 83 -2.595 13.264 -9.550 586 HA THR 83 HA THR 83 -4.799 11.785 -8.452 587 HB THR 83 HB THR 83 -3.283 10.862 -10.780 588 HG1 THR 83 HG1 THR 83 -4.552 11.945 -11.973 589 HG21 THR 83 HG21 THR 83 -4.949 9.144 -10.970 590 HG22 THR 83 HG22 THR 83 -5.711 9.713 -9.662 591 HG23 THR 83 HG23 THR 83 -4.253 9.028 -9.515 592 H TRP 84 H TRP 84 -4.323 10.283 -6.924 593 HA TRP 84 HA TRP 84 -1.536 9.549 -6.570 594 HB2 TRP 84 HB2 TRP 84 -3.475 9.958 -4.480 595 HB3 TRP 84 HB3 TRP 84 -1.969 9.380 -4.223 596 HD1 TRP 84 HD1 TRP 84 -1.333 12.022 -6.452 597 HE1 TRP 84 HE1 TRP 84 -0.712 14.215 -5.417 598 HE3 TRP 84 HE3 TRP 84 -2.857 10.964 -1.813 599 HZ2 TRP 84 HZ2 TRP 84 -0.885 15.291 -2.816 600 HZ3 TRP 84 HZ3 TRP 84 -2.587 12.635 -0.084 601 HH2 TRP 84 HH2 TRP 84 -1.582 14.772 -0.593 602 H THR 85 H THR 85 -1.228 7.208 -5.973 603 HA THR 85 HA THR 85 -3.699 5.786 -5.787 604 HB THR 85 HB THR 85 -2.899 5.516 -8.108 605 HG1 THR 85 HG1 THR 85 -4.324 4.014 -7.349 606 HG21 THR 85 HG21 THR 85 -1.080 4.037 -8.501 607 HG22 THR 85 HG22 THR 85 -0.824 3.897 -6.911 608 HG23 THR 85 HG23 THR 85 -0.548 5.307 -7.653 609 H TYR 86 H TYR 86 -3.538 3.558 -4.909 610 HA TYR 86 HA TYR 86 -1.305 3.337 -3.069 611 HB2 TYR 86 HB2 TYR 86 -4.048 2.599 -2.634 612 HB3 TYR 86 HB3 TYR 86 -2.845 2.116 -1.641 613 HD1 TYR 86 HD1 TYR 86 -4.893 4.906 -2.565 614 HD2 TYR 86 HD2 TYR 86 -1.708 3.735 -0.154 615 HE1 TYR 86 HE1 TYR 86 -5.056 6.982 -1.329 616 HE2 TYR 86 HE2 TYR 86 -1.879 5.806 1.075 617 HH TYR 86 HH TYR 86 -3.541 8.474 0.060 618 H THR 87 H THR 87 -0.459 1.155 -2.725 619 HA THR 87 HA THR 87 -0.462 -0.200 -5.131 620 HB THR 87 HB THR 87 1.508 -0.276 -3.706 621 HG1 THR 87 HG1 THR 87 1.277 -2.860 -3.681 622 HG21 THR 87 HG21 THR 87 1.552 -1.644 -1.737 623 HG22 THR 87 HG22 THR 87 -0.008 -2.019 -1.940 624 HG23 THR 87 HG23 THR 87 0.416 -0.508 -1.553 625 H ALA 88 H ALA 88 -2.367 -0.581 -2.390 626 HA ALA 88 HA ALA 88 -3.864 -2.667 -3.712 627 HB1 ALA 88 HB1 ALA 88 -2.619 -3.862 -2.064 628 HB2 ALA 88 HB2 ALA 88 -4.171 -3.834 -1.609 629 HB3 ALA 88 HB3 ALA 88 -3.106 -2.836 -0.913 630 HA PRO 89 HA PRO 89 -6.976 0.168 -2.320 631 HB2 PRO 89 HB2 PRO 89 -9.177 -1.283 -2.166 632 HB3 PRO 89 HB3 PRO 89 -8.604 -0.871 -3.639 633 HG2 PRO 89 HG2 PRO 89 -8.219 -3.335 -2.241 634 HG3 PRO 89 HG3 PRO 89 -8.659 -3.130 -3.801 635 HD2 PRO 89 HD2 PRO 89 -6.178 -3.634 -3.214 636 HD3 PRO 89 HD3 PRO 89 -6.529 -2.634 -4.456 637 H HIS 90 H HIS 90 -7.707 0.939 -0.340 638 HA HIS 90 HA HIS 90 -7.373 -0.950 1.807 639 HB2 HIS 90 HB2 HIS 90 -5.480 0.735 1.438 640 HB3 HIS 90 HB3 HIS 90 -6.474 1.743 2.251 641 HD1 HIS 90 HD1 HIS 90 -7.090 1.083 4.807 642 HD2 HIS 90 HD2 HIS 90 -4.005 -0.940 3.023 643 HE1 HIS 90 HE1 HIS 90 -5.818 -0.138 6.566 644 HE2 HIS 90 HE2 HIS 90 -3.945 -1.349 5.514 645 H ASN 91 H ASN 91 -8.781 -0.923 3.518 646 HA ASN 91 HA ASN 91 -11.093 0.603 3.278 647 HB2 ASN 91 HB2 ASN 91 -10.072 -0.834 5.540 648 HB3 ASN 91 HB3 ASN 91 -11.531 -0.100 5.558 649 HD21 ASN 91 HD21 ASN 91 -11.723 -3.726 4.636 650 HD22 ASN 91 HD22 ASN 91 -10.873 -2.894 5.895 651 H THR 92 H THR 92 -11.767 2.491 4.323 652 HA THR 92 HA THR 92 -9.800 4.084 5.687 653 HB THR 92 HB THR 92 -10.924 4.981 3.132 654 HG1 THR 92 HG1 THR 92 -9.404 3.290 2.873 655 HG21 THR 92 HG21 THR 92 -9.375 6.775 3.235 656 HG22 THR 92 HG22 THR 92 -8.810 6.234 4.650 657 HG23 THR 92 HG23 THR 92 -10.314 6.818 4.551 658 H SER 93 H SER 93 -10.852 5.861 6.844 659 HA SER 93 HA SER 93 -13.726 5.687 6.750 660 HB2 SER 93 HB2 SER 93 -13.615 6.791 8.973 661 HB3 SER 93 HB3 SER 93 -12.928 5.310 8.952 662 HG SER 93 HG SER 93 -10.993 6.110 9.108 663 H GLN 94 H GLN 94 -11.065 7.870 6.521 664 HA GLN 94 HA GLN 94 -12.668 9.787 5.189 665 HB2 GLN 94 HB2 GLN 94 -13.015 10.463 7.469 666 HB3 GLN 94 HB3 GLN 94 -11.403 10.463 7.728 667 HG2 GLN 94 HG2 GLN 94 -11.195 12.345 6.266 668 HG3 GLN 94 HG3 GLN 94 -12.818 12.362 6.086 669 HE21 GLN 94 HE21 GLN 94 -11.491 13.340 9.779 670 HE22 GLN 94 HE22 GLN 94 -10.933 11.907 8.980 671 H TRP 95 H TRP 95 -11.450 11.032 3.685 672 HA TRP 95 HA TRP 95 -8.752 11.457 4.522 673 HB2 TRP 95 HB2 TRP 95 -7.791 11.103 2.416 674 HB3 TRP 95 HB3 TRP 95 -8.466 9.735 3.001 675 HD1 TRP 95 HD1 TRP 95 -10.636 8.816 1.703 676 HE1 TRP 95 HE1 TRP 95 -11.433 9.006 -0.663 677 HE3 TRP 95 HE3 TRP 95 -7.869 12.786 0.426 678 HZ2 TRP 95 HZ2 TRP 95 -10.839 10.714 -2.821 679 HZ3 TRP 95 HZ3 TRP 95 -8.028 13.643 -1.839 680 HH2 TRP 95 HH2 TRP 95 -9.505 12.598 -3.441 681 H HIS 96 H HIS 96 -7.901 13.475 4.151 682 HA HIS 96 HA HIS 96 -9.386 15.269 2.508 683 HB2 HIS 96 HB2 HIS 96 -9.747 16.887 4.247 684 HB3 HIS 96 HB3 HIS 96 -10.578 15.511 4.532 685 HD1 HIS 96 HD1 HIS 96 -10.809 15.617 7.058 686 HD2 HIS 96 HD2 HIS 96 -6.957 15.989 5.702 687 HE1 HIS 96 HE1 HIS 96 -9.271 15.575 9.014 688 HE2 HIS 96 HE2 HIS 96 -6.949 15.796 8.223 689 H TYR 97 H TYR 97 -8.303 17.393 2.164 690 HA TYR 97 HA TYR 97 -5.601 17.343 2.944 691 HB2 TYR 97 HB2 TYR 97 -4.689 17.466 0.739 692 HB3 TYR 97 HB3 TYR 97 -5.608 16.121 0.859 693 HD1 TYR 97 HD1 TYR 97 -7.790 15.976 -0.348 694 HD2 TYR 97 HD2 TYR 97 -5.227 19.221 -0.813 695 HE1 TYR 97 HE1 TYR 97 -8.978 16.635 -2.352 696 HE2 TYR 97 HE2 TYR 97 -6.406 19.863 -2.810 697 HH TYR 97 HH TYR 97 -7.830 18.813 -4.581 698 H TYR 98 H TYR 98 -4.319 19.147 2.698 699 HA TYR 98 HA TYR 98 -5.841 21.580 2.582 700 HB2 TYR 98 HB2 TYR 98 -3.485 21.254 4.236 701 HB3 TYR 98 HB3 TYR 98 -4.615 22.424 4.381 702 HD1 TYR 98 HD1 TYR 98 -4.026 18.906 5.042 703 HD2 TYR 98 HD2 TYR 98 -6.440 22.184 5.921 704 HE1 TYR 98 HE1 TYR 98 -5.050 17.671 6.837 705 HE2 TYR 98 HE2 TYR 98 -7.448 20.939 7.740 706 HH TYR 98 HH TYR 98 -7.004 19.049 9.216 707 H ILE 99 H ILE 99 -4.479 23.532 1.974 708 HA ILE 99 HA ILE 99 -1.952 22.821 0.816 709 HB ILE 99 HB ILE 99 -2.318 24.421 -1.033 710 HG12 ILE 99 HG12 ILE 99 -5.084 24.390 -0.272 711 HG13 ILE 99 HG13 ILE 99 -4.082 25.636 0.062 712 HG21 ILE 99 HG21 ILE 99 -3.645 22.900 -2.369 713 HG22 ILE 99 HG22 ILE 99 -4.128 22.134 -1.030 714 HG23 ILE 99 HG23 ILE 99 -2.579 22.063 -1.488 715 HD11 ILE 99 HD11 ILE 99 -5.395 26.142 -1.878 716 HD12 ILE 99 HD12 ILE 99 -4.827 24.825 -2.624 717 HD13 ILE 99 HD13 ILE 99 -3.835 26.058 -2.294 718 H THR 100 H THR 100 -0.340 24.598 0.860 719 HA THR 100 HA THR 100 -1.037 26.512 2.838 720 HB THR 100 HB THR 100 1.336 27.113 2.906 721 HG1 THR 100 HG1 THR 100 2.772 25.935 1.654 722 HG21 THR 100 HG21 THR 100 2.153 25.050 3.779 723 HG22 THR 100 HG22 THR 100 0.933 24.251 3.079 724 HG23 THR 100 HG23 THR 100 0.638 25.270 4.300 725 H LYS 101 H LYS 101 -1.053 28.808 2.499 726 HA LYS 101 HA LYS 101 -1.197 29.579 -0.233 727 HB2 LYS 101 HB2 LYS 101 -1.659 31.101 2.185 728 HB3 LYS 101 HB3 LYS 101 -1.837 31.755 0.699 729 HG2 LYS 101 HG2 LYS 101 -3.445 29.574 1.688 730 HG3 LYS 101 HG3 LYS 101 -3.942 31.130 1.661 731 HD2 LYS 101 HD2 LYS 101 -3.714 31.110 -0.749 732 HD3 LYS 101 HD3 LYS 101 -3.360 29.518 -0.669 733 HE2 LYS 101 HE2 LYS 101 -5.603 29.709 -1.235 734 HE3 LYS 101 HE3 LYS 101 -5.530 29.140 0.294 735 HZ1 LYS 101 HZ1 LYS 101 -7.180 30.831 0.130 736 HZ2 LYS 101 HZ2 LYS 101 -6.068 31.881 -0.397 737 HZ3 LYS 101 HZ3 LYS 101 -5.996 31.319 1.118 738 H LYS 102 H LYS 102 0.392 30.491 -1.421 739 HA LYS 102 HA LYS 102 2.809 31.291 -0.182 740 HB2 LYS 102 HB2 LYS 102 3.549 31.767 -2.418 741 HB3 LYS 102 HB3 LYS 102 2.887 30.276 -2.336 742 HG2 LYS 102 HG2 LYS 102 0.848 31.198 -3.227 743 HG3 LYS 102 HG3 LYS 102 1.627 32.618 -3.432 744 HD2 LYS 102 HD2 LYS 102 3.058 31.646 -5.002 745 HD3 LYS 102 HD3 LYS 102 2.387 30.180 -4.743 746 HE2 LYS 102 HE2 LYS 102 0.278 31.056 -5.482 747 HE3 LYS 102 HE3 LYS 102 1.014 32.473 -5.826 748 HZ1 LYS 102 HZ1 LYS 102 0.693 31.223 -7.782 749 HZ2 LYS 102 HZ2 LYS 102 1.546 29.999 -7.159 750 HZ3 LYS 102 HZ3 LYS 102 2.275 31.402 -7.500 751 H GLY 103 H GLY 103 3.746 33.503 -0.139 752 HA2 GLY 103 HA2 GLY 103 3.656 35.683 -0.830 753 HA3 GLY 103 HA3 GLY 103 2.153 35.467 -1.431 754 H TRP 104 H TRP 104 2.309 34.579 1.773 755 HA TRP 104 HA TRP 104 0.512 36.471 2.502 756 HB2 TRP 104 HB2 TRP 104 0.972 35.702 4.808 757 HB3 TRP 104 HB3 TRP 104 0.813 34.445 3.777 758 HD1 TRP 104 HD1 TRP 104 3.638 36.383 5.346 759 HE1 TRP 104 HE1 TRP 104 5.690 34.986 5.670 760 HE3 TRP 104 HE3 TRP 104 1.874 32.217 3.247 761 HZ2 TRP 104 HZ2 TRP 104 6.388 32.325 5.037 762 HZ3 TRP 104 HZ3 TRP 104 3.297 30.259 3.145 763 HH2 TRP 104 HH2 TRP 104 5.536 30.327 4.041 764 H ASP 105 H ASP 105 0.498 38.124 4.154 765 HA ASP 105 HA ASP 105 2.909 39.698 4.238 766 HB2 ASP 105 HB2 ASP 105 1.488 41.379 5.208 767 HB3 ASP 105 HB3 ASP 105 0.959 40.906 3.737 768 HA PRO 106 HA PRO 106 3.668 38.162 8.164 769 HB2 PRO 106 HB2 PRO 106 5.143 40.027 9.422 770 HB3 PRO 106 HB3 PRO 106 5.758 39.349 8.070 771 HG2 PRO 106 HG2 PRO 106 4.307 41.796 8.280 772 HG3 PRO 106 HG3 PRO 106 5.749 41.553 7.553 773 HD2 PRO 106 HD2 PRO 106 3.585 41.551 6.123 774 HD3 PRO 106 HD3 PRO 106 4.794 40.519 5.749 775 H ASP 107 H ASP 107 1.575 40.663 8.150 776 HA ASP 107 HA ASP 107 1.301 40.824 10.961 777 HB2 ASP 107 HB2 ASP 107 0.832 42.665 9.340 778 HB3 ASP 107 HB3 ASP 107 -0.600 41.924 9.081 779 H LYS 108 H LYS 108 0.450 38.508 8.952 780 HA LYS 108 HA LYS 108 -2.102 37.982 10.137 781 HB2 LYS 108 HB2 LYS 108 -0.750 36.900 7.843 782 HB3 LYS 108 HB3 LYS 108 -1.985 36.048 8.489 783 HG2 LYS 108 HG2 LYS 108 -3.449 37.814 8.104 784 HG3 LYS 108 HG3 LYS 108 -2.223 38.742 7.554 785 HD2 LYS 108 HD2 LYS 108 -1.970 37.385 5.677 786 HD3 LYS 108 HD3 LYS 108 -3.062 36.318 6.256 787 HE2 LYS 108 HE2 LYS 108 -4.038 37.751 4.590 788 HE3 LYS 108 HE3 LYS 108 -4.789 37.917 6.031 789 HZ1 LYS 108 HZ1 LYS 108 -4.374 40.051 5.075 790 HZ2 LYS 108 HZ2 LYS 108 -2.790 39.730 5.020 791 HZ3 LYS 108 HZ3 LYS 108 -3.533 39.895 6.447 792 HA PRO 109 HA PRO 109 -0.388 34.867 12.710 793 HB2 PRO 109 HB2 PRO 109 -2.492 33.482 13.453 794 HB3 PRO 109 HB3 PRO 109 -2.348 35.015 13.996 795 HG2 PRO 109 HG2 PRO 109 -3.921 34.081 11.797 796 HG3 PRO 109 HG3 PRO 109 -4.369 35.120 12.974 797 HD2 PRO 109 HD2 PRO 109 -3.583 35.984 10.620 798 HD3 PRO 109 HD3 PRO 109 -3.353 36.877 11.968 799 H LEU 110 H LEU 110 0.924 34.069 11.077 800 HA LEU 110 HA LEU 110 -0.025 32.694 8.968 801 HB2 LEU 110 HB2 LEU 110 2.599 32.376 10.198 802 HB3 LEU 110 HB3 LEU 110 2.291 32.007 8.637 803 HG LEU 110 HG LEU 110 2.413 34.671 9.722 804 HD11 LEU 110 HD11 LEU 110 4.365 34.868 8.304 805 HD12 LEU 110 HD12 LEU 110 4.174 33.334 7.830 806 HD13 LEU 110 HD13 LEU 110 4.576 33.663 9.361 807 HD21 LEU 110 HD21 LEU 110 2.065 35.501 7.539 808 HD22 LEU 110 HD22 LEU 110 0.774 34.663 8.037 809 HD23 LEU 110 HD23 LEU 110 1.818 33.998 6.996 810 H LYS 111 H LYS 111 0.960 31.287 11.957 811 HA LYS 111 HA LYS 111 0.921 28.693 11.041 812 HB2 LYS 111 HB2 LYS 111 0.972 28.016 13.306 813 HB3 LYS 111 HB3 LYS 111 1.978 29.283 13.082 814 HG2 LYS 111 HG2 LYS 111 0.129 30.678 13.966 815 HG3 LYS 111 HG3 LYS 111 -0.519 29.275 14.493 816 HD2 LYS 111 HD2 LYS 111 2.095 30.246 15.272 817 HD3 LYS 111 HD3 LYS 111 0.768 30.338 16.220 818 HE2 LYS 111 HE2 LYS 111 0.691 27.947 16.330 819 HE3 LYS 111 HE3 LYS 111 2.034 27.868 15.404 820 HZ1 LYS 111 HZ1 LYS 111 2.604 27.584 17.696 821 HZ2 LYS 111 HZ2 LYS 111 1.949 29.020 18.048 822 HZ3 LYS 111 HZ3 LYS 111 3.279 28.941 17.132 823 H ARG 112 H ARG 112 -1.704 30.676 11.904 824 HA ARG 112 HA ARG 112 -3.486 28.489 11.583 825 HB2 ARG 112 HB2 ARG 112 -3.944 31.229 12.321 826 HB3 ARG 112 HB3 ARG 112 -5.220 30.331 11.836 827 HG2 ARG 112 HG2 ARG 112 -4.669 28.783 13.627 828 HG3 ARG 112 HG3 ARG 112 -3.619 29.908 14.174 829 HD2 ARG 112 HD2 ARG 112 -5.373 31.440 14.514 830 HD3 ARG 112 HD3 ARG 112 -6.445 30.407 13.842 831 HE ARG 112 HE ARG 112 -5.262 29.172 16.032 832 HH11 ARG 112 HH11 ARG 112 -7.642 31.673 15.330 833 HH12 ARG 112 HH12 ARG 112 -8.464 31.432 16.836 834 HH21 ARG 112 HH21 ARG 112 -6.373 28.924 17.930 835 HH22 ARG 112 HH22 ARG 112 -7.757 29.904 18.280 836 H ALA 113 H ALA 113 -2.665 31.424 9.964 837 HA ALA 113 HA ALA 113 -4.800 31.238 8.206 838 HB1 ALA 113 HB1 ALA 113 -3.849 33.419 8.956 839 HB2 ALA 113 HB2 ALA 113 -3.926 33.393 7.341 840 HB3 ALA 113 HB3 ALA 113 -2.519 33.115 8.088 841 H ASP 114 H ASP 114 -1.516 30.361 7.789 842 HA ASP 114 HA ASP 114 -1.583 30.584 5.039 843 HB2 ASP 114 HB2 ASP 114 0.217 29.018 6.710 844 HB3 ASP 114 HB3 ASP 114 0.470 29.178 5.105 845 H PHE 115 H PHE 115 -2.551 28.113 7.142 846 HA PHE 115 HA PHE 115 -2.566 26.159 5.056 847 HB2 PHE 115 HB2 PHE 115 -3.000 25.862 7.918 848 HB3 PHE 115 HB3 PHE 115 -3.025 24.591 6.893 849 HD1 PHE 115 HD1 PHE 115 -0.832 27.078 8.340 850 HD2 PHE 115 HD2 PHE 115 -1.013 23.491 6.237 851 HE1 PHE 115 HE1 PHE 115 1.553 26.823 8.585 852 HE2 PHE 115 HE2 PHE 115 1.369 23.207 6.509 853 HZ PHE 115 HZ PHE 115 2.660 24.892 7.655 854 H GLU 116 H GLU 116 -4.329 25.947 3.797 855 HA GLU 116 HA GLU 116 -6.846 26.240 5.148 856 HB2 GLU 116 HB2 GLU 116 -6.238 27.037 2.434 857 HB3 GLU 116 HB3 GLU 116 -7.766 27.018 3.009 858 HG2 GLU 116 HG2 GLU 116 -7.158 28.687 4.603 859 HG3 GLU 116 HG3 GLU 116 -5.662 28.739 3.950 860 H LEU 117 H LEU 117 -8.404 24.713 4.970 861 HA LEU 117 HA LEU 117 -7.772 22.277 3.696 862 HB2 LEU 117 HB2 LEU 117 -9.126 22.341 5.655 863 HB3 LEU 117 HB3 LEU 117 -10.281 23.145 4.828 864 HG LEU 117 HG LEU 117 -10.450 21.124 3.427 865 HD11 LEU 117 HD11 LEU 117 -9.752 19.073 4.434 866 HD12 LEU 117 HD12 LEU 117 -9.051 19.897 5.635 867 HD13 LEU 117 HD13 LEU 117 -8.472 20.012 4.130 868 HD21 LEU 117 HD21 LEU 117 -11.972 20.081 4.988 869 HD22 LEU 117 HD22 LEU 117 -12.165 21.687 5.018 870 HD23 LEU 117 HD23 LEU 117 -11.331 20.950 6.191 871 H ILE 118 H ILE 118 -8.114 21.781 1.525 872 HA ILE 118 HA ILE 118 -9.980 23.504 0.151 873 HB ILE 118 HB ILE 118 -7.535 23.942 -0.290 874 HG12 ILE 118 HG12 ILE 118 -7.916 24.341 -2.682 875 HG13 ILE 118 HG13 ILE 118 -9.405 23.711 -2.455 876 HG21 ILE 118 HG21 ILE 118 -6.498 22.579 -1.954 877 HG22 ILE 118 HG22 ILE 118 -7.770 21.581 -1.932 878 HG23 ILE 118 HG23 ILE 118 -6.821 21.711 -0.628 879 HD11 ILE 118 HD11 ILE 118 -9.512 26.106 -2.384 880 HD12 ILE 118 HD12 ILE 118 -8.450 26.130 -1.164 881 HD13 ILE 118 HD13 ILE 118 -9.925 25.507 -0.940 882 H GLY 119 H GLY 119 -9.360 20.419 0.987 883 HA2 GLY 119 HA2 GLY 119 -11.520 19.565 -0.625 884 HA3 GLY 119 HA3 GLY 119 -10.107 18.854 -1.032 885 H ALA 120 H ALA 120 -12.689 17.892 0.226 886 HA ALA 120 HA ALA 120 -11.408 16.166 2.107 887 HB1 ALA 120 HB1 ALA 120 -12.189 17.915 3.565 888 HB2 ALA 120 HB2 ALA 120 -13.066 16.586 3.843 889 HB3 ALA 120 HB3 ALA 120 -13.680 17.788 2.952 890 H VAL 121 H VAL 121 -12.194 14.087 1.903 891 HA VAL 121 HA VAL 121 -14.818 13.842 0.809 892 HB VAL 121 HB VAL 121 -13.003 11.922 -0.301 893 HG11 VAL 121 HG11 VAL 121 -14.492 12.108 -2.199 894 HG12 VAL 121 HG12 VAL 121 -15.271 13.320 -1.467 895 HG13 VAL 121 HG13 VAL 121 -15.343 11.826 -0.854 896 HG21 VAL 121 HG21 VAL 121 -12.307 13.356 -2.133 897 HG22 VAL 121 HG22 VAL 121 -11.744 13.951 -0.739 898 HG23 VAL 121 HG23 VAL 121 -13.043 14.616 -1.437 899 HA PRO 122 HA PRO 122 -14.419 11.083 4.299 900 HB2 PRO 122 HB2 PRO 122 -16.971 10.672 4.868 901 HB3 PRO 122 HB3 PRO 122 -16.282 12.079 5.329 902 HG2 PRO 122 HG2 PRO 122 -17.854 11.590 2.995 903 HG3 PRO 122 HG3 PRO 122 -18.016 12.810 4.070 904 HD2 PRO 122 HD2 PRO 122 -16.727 13.233 1.855 905 HD3 PRO 122 HD3 PRO 122 -16.202 13.941 3.230 906 H HIS 123 H HIS 123 -14.412 8.835 4.507 907 HA HIS 123 HA HIS 123 -15.223 7.575 2.017 908 HB2 HIS 123 HB2 HIS 123 -12.878 7.457 2.657 909 HB3 HIS 123 HB3 HIS 123 -13.334 6.520 3.914 910 HD1 HIS 123 HD1 HIS 123 -14.334 4.099 3.377 911 HD2 HIS 123 HD2 HIS 123 -12.559 6.113 0.279 912 HE1 HIS 123 HE1 HIS 123 -13.873 2.480 1.542 913 HE2 HIS 123 HE2 HIS 123 -12.803 3.676 -0.337 914 H ASP 124 H ASP 124 -17.295 7.282 2.373 915 HA ASP 124 HA ASP 124 -18.076 5.593 4.582 916 HB2 ASP 124 HB2 ASP 124 -20.213 6.751 4.483 917 HB3 ASP 124 HB3 ASP 124 -18.995 7.783 4.825 918 H GLY 125 H GLY 125 -17.466 5.548 1.489 919 HA2 GLY 125 HA2 GLY 125 -18.096 3.503 0.338 920 HA3 GLY 125 HA3 GLY 125 -19.633 3.742 0.836 921 H SER 126 H SER 126 -19.184 6.700 0.333 922 HA SER 126 HA SER 126 -20.358 6.927 -2.100 923 HB2 SER 126 HB2 SER 126 -20.276 8.826 -0.675 924 HB3 SER 126 HB3 SER 126 -18.647 8.878 -0.775 925 HG SER 126 HG SER 126 -19.600 9.026 -3.187 926 HA PRO 127 HA PRO 127 -17.081 6.013 -4.731 927 HB2 PRO 127 HB2 PRO 127 -17.995 6.654 -7.152 928 HB3 PRO 127 HB3 PRO 127 -18.690 5.399 -6.372 929 HG2 PRO 127 HG2 PRO 127 -19.598 8.112 -6.455 930 HG3 PRO 127 HG3 PRO 127 -20.470 6.763 -6.750 931 HD2 PRO 127 HD2 PRO 127 -20.571 7.865 -4.395 932 HD3 PRO 127 HD3 PRO 127 -20.622 6.237 -4.522 933 H ALA 128 H ALA 128 -18.060 9.039 -4.292 934 HA ALA 128 HA ALA 128 -16.142 10.397 -5.744 935 HB1 ALA 128 HB1 ALA 128 -17.999 11.553 -4.738 936 HB2 ALA 128 HB2 ALA 128 -16.625 12.245 -4.242 937 HB3 ALA 128 HB3 ALA 128 -17.419 11.234 -3.263 938 H SER 129 H SER 129 -16.079 8.819 -2.694 939 HA SER 129 HA SER 129 -13.513 9.798 -2.021 940 HB2 SER 129 HB2 SER 129 -15.278 9.275 -0.352 941 HB3 SER 129 HB3 SER 129 -14.945 7.697 -0.609 942 HG SER 129 HG SER 129 -13.903 8.692 1.204 943 H ARG 130 H ARG 130 -14.604 7.331 -3.886 944 HA ARG 130 HA ARG 130 -12.396 5.579 -3.436 945 HB2 ARG 130 HB2 ARG 130 -14.442 5.424 -5.463 946 HB3 ARG 130 HB3 ARG 130 -13.346 4.249 -5.169 947 HG2 ARG 130 HG2 ARG 130 -14.317 3.795 -3.083 948 HG3 ARG 130 HG3 ARG 130 -15.329 5.068 -3.236 949 HD2 ARG 130 HD2 ARG 130 -16.282 3.924 -5.189 950 HD3 ARG 130 HD3 ARG 130 -15.432 2.606 -4.732 951 HE ARG 130 HE ARG 130 -17.615 3.776 -3.229 952 HH11 ARG 130 HH11 ARG 130 -18.792 2.428 -1.966 953 HH12 ARG 130 HH12 ARG 130 -18.338 0.768 -1.770 954 HH21 ARG 130 HH21 ARG 130 -15.578 0.953 -3.817 955 HH22 ARG 130 HH22 ARG 130 -16.552 -0.054 -2.797 956 H ASN 131 H ASN 131 -13.281 8.200 -5.361 957 HA ASN 131 HA ASN 131 -11.230 7.797 -7.275 958 HB2 ASN 131 HB2 ASN 131 -13.165 9.937 -6.979 959 HB3 ASN 131 HB3 ASN 131 -12.055 9.948 -8.177 960 HD21 ASN 131 HD21 ASN 131 -15.339 8.548 -9.283 961 HD22 ASN 131 HD22 ASN 131 -14.939 9.951 -8.348 962 H LEU 132 H LEU 132 -9.201 8.067 -6.576 963 HA LEU 132 HA LEU 132 -8.564 10.029 -4.712 964 HB2 LEU 132 HB2 LEU 132 -7.153 8.022 -6.068 965 HB3 LEU 132 HB3 LEU 132 -6.225 9.332 -5.771 966 HG LEU 132 HG LEU 132 -5.866 7.679 -4.151 967 HD11 LEU 132 HD11 LEU 132 -6.165 9.029 -2.165 968 HD12 LEU 132 HD12 LEU 132 -7.167 10.002 -2.980 969 HD13 LEU 132 HD13 LEU 132 -5.602 9.936 -3.379 970 HD21 LEU 132 HD21 LEU 132 -7.589 7.014 -2.623 971 HD22 LEU 132 HD22 LEU 132 -7.973 6.592 -4.136 972 HD23 LEU 132 HD23 LEU 132 -8.663 7.887 -3.459 973 H SER 133 H SER 133 -9.133 10.286 -7.925 974 HA SER 133 HA SER 133 -7.118 12.246 -8.432 975 HB2 SER 133 HB2 SER 133 -7.703 10.655 -10.185 976 HB3 SER 133 HB3 SER 133 -9.175 11.356 -10.283 977 HG SER 133 HG SER 133 -7.573 12.046 -11.821 978 H HIS 134 H HIS 134 -7.427 14.395 -8.104 979 HA HIS 134 HA HIS 134 -10.128 15.343 -8.131 980 HB2 HIS 134 HB2 HIS 134 -9.218 14.820 -5.809 981 HB3 HIS 134 HB3 HIS 134 -8.440 16.246 -5.978 982 HD1 HIS 134 HD1 HIS 134 -9.843 18.486 -5.894 983 HD2 HIS 134 HD2 HIS 134 -11.946 15.015 -5.313 984 HE1 HIS 134 HE1 HIS 134 -12.097 19.065 -5.013 985 HE2 HIS 134 HE2 HIS 134 -13.381 16.986 -4.653 986 H HIS 135 H HIS 135 -10.512 17.503 -8.616 987 HA HIS 135 HA HIS 135 -8.405 18.733 -10.022 988 HB2 HIS 135 HB2 HIS 135 -11.147 19.441 -9.596 989 HB3 HIS 135 HB3 HIS 135 -10.141 20.592 -10.172 990 HD1 HIS 135 HD1 HIS 135 -9.167 20.344 -12.587 991 HD2 HIS 135 HD2 HIS 135 -11.922 17.526 -11.476 992 HE1 HIS 135 HE1 HIS 135 -9.895 19.115 -14.619 993 HE2 HIS 135 HE2 HIS 135 -11.560 17.410 -13.977 994 H ILE 136 H ILE 136 -7.064 20.394 -9.439 995 HA ILE 136 HA ILE 136 -7.731 21.820 -7.045 996 HB ILE 136 HB ILE 136 -4.985 21.013 -7.614 997 HG12 ILE 136 HG12 ILE 136 -6.718 20.093 -5.499 998 HG13 ILE 136 HG13 ILE 136 -6.259 19.196 -6.783 999 HG21 ILE 136 HG21 ILE 136 -4.409 22.076 -5.502 1000 HG22 ILE 136 HG22 ILE 136 -5.941 22.558 -5.319 1001 HG23 ILE 136 HG23 ILE 136 -5.035 23.177 -6.507 1002 HD11 ILE 136 HD11 ILE 136 -5.008 18.542 -4.841 1003 HD12 ILE 136 HD12 ILE 136 -4.455 20.052 -4.671 1004 HD13 ILE 136 HD13 ILE 136 -4.000 19.163 -5.943 1005 H TYR 137 H TYR 137 -8.353 23.813 -7.926 1006 HA TYR 137 HA TYR 137 -6.958 24.902 -10.109 1007 HB2 TYR 137 HB2 TYR 137 -9.188 25.546 -9.901 1008 HB3 TYR 137 HB3 TYR 137 -8.942 26.088 -8.380 1009 HD1 TYR 137 HD1 TYR 137 -8.350 28.370 -7.981 1010 HD2 TYR 137 HD2 TYR 137 -8.074 26.827 -11.839 1011 HE1 TYR 137 HE1 TYR 137 -7.863 30.576 -8.834 1012 HE2 TYR 137 HE2 TYR 137 -7.581 29.039 -12.682 1013 HH TYR 137 HH TYR 137 -7.301 31.211 -12.247 1014 H ILE 138 H ILE 138 -5.336 26.487 -10.136 1015 HA ILE 138 HA ILE 138 -4.452 27.401 -7.555 1016 HB ILE 138 HB ILE 138 -2.752 26.680 -9.822 1017 HG12 ILE 138 HG12 ILE 138 -3.438 24.802 -8.547 1018 HG13 ILE 138 HG13 ILE 138 -1.820 25.007 -8.473 1019 HG21 ILE 138 HG21 ILE 138 -0.834 27.330 -8.548 1020 HG22 ILE 138 HG22 ILE 138 -1.798 27.884 -7.373 1021 HG23 ILE 138 HG23 ILE 138 -1.790 28.605 -8.820 1022 HD11 ILE 138 HD11 ILE 138 -2.665 24.394 -6.304 1023 HD12 ILE 138 HD12 ILE 138 -3.644 25.681 -6.305 1024 HD13 ILE 138 HD13 ILE 138 -2.042 25.884 -6.232 1025 HA PRO 139 HA PRO 139 -5.026 31.240 -9.701 1026 HB2 PRO 139 HB2 PRO 139 -4.522 32.985 -7.773 1027 HB3 PRO 139 HB3 PRO 139 -5.929 32.157 -7.721 1028 HG2 PRO 139 HG2 PRO 139 -3.506 31.570 -6.340 1029 HG3 PRO 139 HG3 PRO 139 -5.018 31.631 -5.726 1030 HD2 PRO 139 HD2 PRO 139 -3.965 29.339 -6.375 1031 HD3 PRO 139 HD3 PRO 139 -5.567 29.586 -6.568 1032 H GLU 140 H GLU 140 -3.783 32.979 -10.558 1033 HA GLU 140 HA GLU 140 -0.970 32.286 -10.493 1034 HB2 GLU 140 HB2 GLU 140 -2.375 32.218 -12.594 1035 HB3 GLU 140 HB3 GLU 140 -2.073 33.823 -12.625 1036 HG2 GLU 140 HG2 GLU 140 0.225 33.411 -12.717 1037 HG3 GLU 140 HG3 GLU 140 -0.043 31.803 -12.615 1038 H ASP 141 H ASP 141 -1.478 33.568 -8.386 1039 HA ASP 141 HA ASP 141 -1.484 36.337 -8.773 1040 HB2 ASP 141 HB2 ASP 141 -1.581 36.352 -6.271 1041 HB3 ASP 141 HB3 ASP 141 -2.734 35.395 -6.922 1042 H ARG 142 H ARG 142 0.923 34.103 -7.814 1043 HA ARG 142 HA ARG 142 2.916 36.119 -7.691 1044 HB2 ARG 142 HB2 ARG 142 2.246 34.552 -5.331 1045 HB3 ARG 142 HB3 ARG 142 3.676 35.331 -5.450 1046 HG2 ARG 142 HG2 ARG 142 1.130 36.655 -5.327 1047 HG3 ARG 142 HG3 ARG 142 2.150 36.498 -4.061 1048 HD2 ARG 142 HD2 ARG 142 3.790 37.773 -5.315 1049 HD3 ARG 142 HD3 ARG 142 2.640 38.049 -6.442 1050 HE ARG 142 HE ARG 142 1.731 38.845 -3.921 1051 HH11 ARG 142 HH11 ARG 142 1.571 40.989 -3.411 1052 HH12 ARG 142 HH12 ARG 142 2.373 42.189 -4.368 1053 HH21 ARG 142 HH21 ARG 142 3.772 39.942 -6.574 1054 HH22 ARG 142 HH22 ARG 142 3.600 41.608 -6.131 1055 H LEU 143 H LEU 143 5.165 35.139 -7.265 1056 HA LEU 143 HA LEU 143 5.290 32.411 -8.183 1057 HB2 LEU 143 HB2 LEU 143 7.442 34.247 -7.684 1058 HB3 LEU 143 HB3 LEU 143 7.653 32.721 -8.224 1059 HG LEU 143 HG LEU 143 6.235 33.646 -10.158 1060 HD11 LEU 143 HD11 LEU 143 6.935 35.890 -10.700 1061 HD12 LEU 143 HD12 LEU 143 7.725 35.986 -9.292 1062 HD13 LEU 143 HD13 LEU 143 6.111 35.888 -9.309 1063 HD21 LEU 143 HD21 LEU 143 8.319 33.911 -11.367 1064 HD22 LEU 143 HD22 LEU 143 8.385 32.591 -10.435 1065 HD23 LEU 143 HD23 LEU 143 9.124 33.951 -9.964 1066 H GLY 144 H GLY 144 5.992 30.719 -6.661 1067 HA2 GLY 144 HA2 GLY 144 7.367 31.075 -4.403 1068 HA3 GLY 144 HA3 GLY 144 5.849 31.456 -3.939 1069 H TYR 145 H TYR 145 7.540 29.352 -2.959 1070 HA TYR 145 HA TYR 145 6.441 26.979 -4.042 1071 HB2 TYR 145 HB2 TYR 145 7.895 25.861 -2.414 1072 HB3 TYR 145 HB3 TYR 145 8.692 26.807 -3.481 1073 HD1 TYR 145 HD1 TYR 145 10.048 28.644 -2.736 1074 HD2 TYR 145 HD2 TYR 145 7.540 26.694 -0.044 1075 HE1 TYR 145 HE1 TYR 145 11.074 29.841 -0.904 1076 HE2 TYR 145 HE2 TYR 145 8.544 27.925 1.777 1077 HH TYR 145 HH TYR 145 10.616 30.577 1.356 1078 H HIS 146 H HIS 146 5.143 25.433 -3.015 1079 HA HIS 146 HA HIS 146 4.025 26.221 -0.512 1080 HB2 HIS 146 HB2 HIS 146 2.043 26.880 -1.249 1081 HB3 HIS 146 HB3 HIS 146 2.748 26.985 -2.719 1082 HD1 HIS 146 HD1 HIS 146 2.717 24.484 -4.087 1083 HD2 HIS 146 HD2 HIS 146 -0.204 25.411 -1.369 1084 HE1 HIS 146 HE1 HIS 146 0.768 22.982 -4.471 1085 HE2 HIS 146 HE2 HIS 146 -1.002 23.523 -2.841 1086 H VAL 147 H VAL 147 2.812 24.606 0.605 1087 HA VAL 147 HA VAL 147 3.602 22.008 -0.303 1088 HB VAL 147 HB VAL 147 2.931 22.639 2.470 1089 HG11 VAL 147 HG11 VAL 147 4.243 20.722 3.032 1090 HG12 VAL 147 HG12 VAL 147 4.557 20.473 1.465 1091 HG13 VAL 147 HG13 VAL 147 3.049 20.307 2.024 1092 HG21 VAL 147 HG21 VAL 147 5.289 22.997 2.934 1093 HG22 VAL 147 HG22 VAL 147 4.776 24.093 1.862 1094 HG23 VAL 147 HG23 VAL 147 5.629 22.813 1.364 1095 H ILE 148 H ILE 148 2.213 20.276 -0.429 1096 HA ILE 148 HA ILE 148 -0.583 20.818 0.049 1097 HB ILE 148 HB ILE 148 0.541 18.643 -1.532 1098 HG12 ILE 148 HG12 ILE 148 -0.860 20.926 -2.577 1099 HG13 ILE 148 HG13 ILE 148 0.770 20.839 -2.534 1100 HG21 ILE 148 HG21 ILE 148 -1.744 18.158 -2.191 1101 HG22 ILE 148 HG22 ILE 148 -2.281 19.328 -1.213 1102 HG23 ILE 148 HG23 ILE 148 -1.597 18.003 -0.588 1103 HD11 ILE 148 HD11 ILE 148 -0.020 20.275 -4.732 1104 HD12 ILE 148 HD12 ILE 148 -0.910 19.073 -4.119 1105 HD13 ILE 148 HD13 ILE 148 0.704 18.987 -4.076 1106 H LEU 149 H LEU 149 -1.505 19.780 1.855 1107 HA LEU 149 HA LEU 149 0.099 17.736 3.132 1108 HB2 LEU 149 HB2 LEU 149 -1.656 19.644 4.399 1109 HB3 LEU 149 HB3 LEU 149 -0.933 18.424 5.208 1110 HG LEU 149 HG LEU 149 0.103 20.309 5.854 1111 HD11 LEU 149 HD11 LEU 149 2.381 19.979 5.157 1112 HD12 LEU 149 HD12 LEU 149 1.866 19.035 3.950 1113 HD13 LEU 149 HD13 LEU 149 1.667 18.565 5.484 1114 HD21 LEU 149 HD21 LEU 149 1.081 21.938 4.390 1115 HD22 LEU 149 HD22 LEU 149 -0.516 21.845 4.161 1116 HD23 LEU 149 HD23 LEU 149 0.493 21.140 3.113 1117 H ALA 150 H ALA 150 -1.027 15.735 3.603 1118 HA ALA 150 HA ALA 150 -3.882 15.881 3.455 1119 HB1 ALA 150 HB1 ALA 150 -3.217 15.213 1.242 1120 HB2 ALA 150 HB2 ALA 150 -4.023 14.001 1.948 1121 HB3 ALA 150 HB3 ALA 150 -2.409 13.954 1.857 1122 H VAL 151 H VAL 151 -5.069 14.253 4.522 1123 HA VAL 151 HA VAL 151 -3.479 12.478 6.149 1124 HB VAL 151 HB VAL 151 -5.828 13.879 7.130 1125 HG11 VAL 151 HG11 VAL 151 -5.392 12.852 9.267 1126 HG12 VAL 151 HG12 VAL 151 -4.167 12.018 8.620 1127 HG13 VAL 151 HG13 VAL 151 -5.686 11.716 8.154 1128 HG21 VAL 151 HG21 VAL 151 -4.318 15.041 8.627 1129 HG22 VAL 151 HG22 VAL 151 -3.918 15.351 7.091 1130 HG23 VAL 151 HG23 VAL 151 -3.061 14.282 7.950 1131 H TRP 152 H TRP 152 -4.146 10.371 6.162 1132 HA TRP 152 HA TRP 152 -6.644 9.701 4.828 1133 HB2 TRP 152 HB2 TRP 152 -4.734 9.286 3.428 1134 HB3 TRP 152 HB3 TRP 152 -4.089 8.351 4.601 1135 HD1 TRP 152 HD1 TRP 152 -5.211 5.930 4.951 1136 HE1 TRP 152 HE1 TRP 152 -6.406 4.357 3.414 1137 HE3 TRP 152 HE3 TRP 152 -6.327 9.263 1.398 1138 HZ2 TRP 152 HZ2 TRP 152 -7.690 4.625 0.917 1139 HZ3 TRP 152 HZ3 TRP 152 -7.608 8.537 -0.524 1140 HH2 TRP 152 HH2 TRP 152 -8.285 6.232 -0.743 1141 H ASP 153 H ASP 153 -7.914 9.238 6.608 1142 HA ASP 153 HA ASP 153 -6.739 7.878 8.786 1143 HB2 ASP 153 HB2 ASP 153 -9.429 8.892 8.407 1144 HB3 ASP 153 HB3 ASP 153 -9.019 8.088 9.767 1145 H VAL 154 H VAL 154 -6.552 5.706 8.945 1146 HA VAL 154 HA VAL 154 -8.139 4.056 7.281 1147 HB VAL 154 HB VAL 154 -6.149 3.293 9.256 1148 HG11 VAL 154 HG11 VAL 154 -6.140 1.106 8.296 1149 HG12 VAL 154 HG12 VAL 154 -7.356 1.527 7.316 1150 HG13 VAL 154 HG13 VAL 154 -7.595 1.445 8.914 1151 HG21 VAL 154 HG21 VAL 154 -4.679 2.926 7.356 1152 HG22 VAL 154 HG22 VAL 154 -5.162 4.469 7.385 1153 HG23 VAL 154 HG23 VAL 154 -5.847 3.426 6.356 1154 H ALA 155 H ALA 155 -9.966 2.887 7.821 1155 HA ALA 155 HA ALA 155 -11.138 3.482 10.291 1156 HB1 ALA 155 HB1 ALA 155 -12.511 3.115 8.302 1157 HB2 ALA 155 HB2 ALA 155 -12.989 2.093 9.460 1158 HB3 ALA 155 HB3 ALA 155 -12.043 1.568 8.258 1159 H ASP 156 H ASP 156 -9.574 0.736 8.974 1160 HA ASP 156 HA ASP 156 -10.533 -1.051 10.798 1161 HB2 ASP 156 HB2 ASP 156 -8.151 -1.311 9.080 1162 HB3 ASP 156 HB3 ASP 156 -8.854 -2.608 9.780 1163 H THR 157 H THR 157 -7.876 0.958 11.101 1164 HA THR 157 HA THR 157 -6.903 -0.584 13.303 1165 HB THR 157 HB THR 157 -4.558 -0.055 12.578 1166 HG1 THR 157 HG1 THR 157 -5.060 0.492 10.070 1167 HG21 THR 157 HG21 THR 157 -4.429 -1.616 10.768 1168 HG22 THR 157 HG22 THR 157 -6.029 -1.525 10.553 1169 HG23 THR 157 HG23 THR 157 -5.431 -2.206 11.892 1170 H GLU 158 H GLU 158 -5.449 0.623 14.826 1171 HA GLU 158 HA GLU 158 -6.362 3.269 15.126 1172 HB2 GLU 158 HB2 GLU 158 -5.021 1.424 16.749 1173 HB3 GLU 158 HB3 GLU 158 -4.421 2.928 16.956 1174 HG2 GLU 158 HG2 GLU 158 -6.211 2.377 18.482 1175 HG3 GLU 158 HG3 GLU 158 -6.479 3.737 17.619 1176 H ASN 159 H ASN 159 -4.412 2.339 12.964 1177 HA ASN 159 HA ASN 159 -2.553 4.531 13.250 1178 HB2 ASN 159 HB2 ASN 159 -2.337 2.084 11.751 1179 HB3 ASN 159 HB3 ASN 159 -1.383 3.355 11.373 1180 HD21 ASN 159 HD21 ASN 159 1.026 2.048 13.463 1181 HD22 ASN 159 HD22 ASN 159 0.580 2.470 11.843 1182 H ALA 160 H ALA 160 -2.123 5.806 11.283 1183 HA ALA 160 HA ALA 160 -4.176 5.780 9.263 1184 HB1 ALA 160 HB1 ALA 160 -5.026 7.375 10.821 1185 HB2 ALA 160 HB2 ALA 160 -4.507 8.175 9.516 1186 HB3 ALA 160 HB3 ALA 160 -3.603 8.143 10.856 1187 H PHE 161 H PHE 161 -3.410 7.350 7.436 1188 HA PHE 161 HA PHE 161 -0.517 7.407 7.417 1189 HB2 PHE 161 HB2 PHE 161 -2.169 7.152 5.058 1190 HB3 PHE 161 HB3 PHE 161 -0.538 7.070 5.084 1191 HD1 PHE 161 HD1 PHE 161 -3.028 5.089 4.394 1192 HD2 PHE 161 HD2 PHE 161 0.108 5.187 7.125 1193 HE1 PHE 161 HE1 PHE 161 -3.173 2.690 4.635 1194 HE2 PHE 161 HE2 PHE 161 -0.034 2.794 7.386 1195 HZ PHE 161 HZ PHE 161 -1.673 1.539 6.141 1196 H TYR 162 H TYR 162 0.486 9.268 6.294 1197 HA TYR 162 HA TYR 162 -1.360 11.388 5.662 1198 HB2 TYR 162 HB2 TYR 162 -0.130 13.039 6.759 1199 HB3 TYR 162 HB3 TYR 162 -0.684 11.932 7.824 1200 HD1 TYR 162 HD1 TYR 162 0.890 10.388 8.970 1201 HD2 TYR 162 HD2 TYR 162 2.244 13.409 6.445 1202 HE1 TYR 162 HE1 TYR 162 3.108 10.181 9.902 1203 HE2 TYR 162 HE2 TYR 162 4.462 13.192 7.383 1204 HH TYR 162 HH TYR 162 5.159 11.501 10.205 1205 H GLN 163 H GLN 163 -0.492 12.962 4.101 1206 HA GLN 163 HA GLN 163 1.869 11.969 2.778 1207 HB2 GLN 163 HB2 GLN 163 -0.547 12.743 1.396 1208 HB3 GLN 163 HB3 GLN 163 0.856 12.395 0.635 1209 HG2 GLN 163 HG2 GLN 163 -0.296 10.478 0.368 1210 HG3 GLN 163 HG3 GLN 163 0.604 10.137 1.687 1211 HE21 GLN 163 HE21 GLN 163 -2.145 9.104 3.466 1212 HE22 GLN 163 HE22 GLN 163 -0.483 8.866 3.041 1213 H VAL 164 H VAL 164 3.276 13.555 1.948 1214 HA VAL 164 HA VAL 164 2.325 16.259 2.048 1215 HB VAL 164 HB VAL 164 3.455 16.050 4.134 1216 HG11 VAL 164 HG11 VAL 164 5.754 15.400 4.320 1217 HG12 VAL 164 HG12 VAL 164 5.809 15.106 2.730 1218 HG13 VAL 164 HG13 VAL 164 4.886 14.189 3.691 1219 HG21 VAL 164 HG21 VAL 164 5.086 17.770 3.952 1220 HG22 VAL 164 HG22 VAL 164 3.762 18.151 3.107 1221 HG23 VAL 164 HG23 VAL 164 5.080 17.610 2.343 1222 H ILE 165 H ILE 165 2.802 17.440 0.268 1223 HA ILE 165 HA ILE 165 5.051 16.608 -1.274 1224 HB ILE 165 HB ILE 165 2.411 16.996 -2.522 1225 HG12 ILE 165 HG12 ILE 165 3.972 14.581 -2.472 1226 HG13 ILE 165 HG13 ILE 165 2.661 14.848 -1.536 1227 HG21 ILE 165 HG21 ILE 165 3.471 16.575 -4.668 1228 HG22 ILE 165 HG22 ILE 165 4.914 16.481 -3.945 1229 HG23 ILE 165 HG23 ILE 165 4.125 17.891 -3.993 1230 HD11 ILE 165 HD11 ILE 165 2.076 13.453 -3.381 1231 HD12 ILE 165 HD12 ILE 165 2.575 14.589 -4.418 1232 HD13 ILE 165 HD13 ILE 165 1.277 14.854 -3.492 1233 H ASP 166 H ASP 166 6.327 18.408 -1.802 1234 HA ASP 166 HA ASP 166 4.999 20.947 -1.725 1235 HB2 ASP 166 HB2 ASP 166 7.018 20.840 -0.497 1236 HB3 ASP 166 HB3 ASP 166 7.833 20.394 -1.841 1237 H VAL 167 H VAL 167 4.596 22.218 -3.505 1238 HA VAL 167 HA VAL 167 6.154 21.655 -5.815 1239 HB VAL 167 HB VAL 167 4.244 21.983 -7.342 1240 HG11 VAL 167 HG11 VAL 167 3.430 19.715 -7.156 1241 HG12 VAL 167 HG12 VAL 167 4.074 19.602 -5.678 1242 HG13 VAL 167 HG13 VAL 167 5.036 19.738 -6.971 1243 HG21 VAL 167 HG21 VAL 167 2.036 21.660 -6.515 1244 HG22 VAL 167 HG22 VAL 167 2.691 22.990 -5.869 1245 HG23 VAL 167 HG23 VAL 167 2.601 21.629 -5.000 1246 H ASP 168 H ASP 168 6.851 23.440 -6.931 1247 HA ASP 168 HA ASP 168 6.457 25.968 -5.700 1248 HB2 ASP 168 HB2 ASP 168 8.597 25.288 -6.567 1249 HB3 ASP 168 HB3 ASP 168 7.974 25.362 -8.075 1250 H LEU 169 H LEU 169 5.184 27.643 -6.443 1251 HA LEU 169 HA LEU 169 3.612 27.038 -8.788 1252 HB2 LEU 169 HB2 LEU 169 2.731 28.471 -6.451 1253 HB3 LEU 169 HB3 LEU 169 1.802 28.186 -7.763 1254 HG LEU 169 HG LEU 169 2.694 26.126 -5.961 1255 HD11 LEU 169 HD11 LEU 169 0.387 26.171 -5.182 1256 HD12 LEU 169 HD12 LEU 169 0.071 27.393 -6.193 1257 HD13 LEU 169 HD13 LEU 169 1.069 27.618 -4.940 1258 HD21 LEU 169 HD21 LEU 169 1.205 24.670 -7.086 1259 HD22 LEU 169 HD22 LEU 169 2.335 25.213 -8.108 1260 HD23 LEU 169 HD23 LEU 169 0.843 25.837 -8.146 1261 H VAL 170 H VAL 170 4.448 28.287 -10.406 1262 HA VAL 170 HA VAL 170 5.086 30.977 -9.672 1263 HB VAL 170 HB VAL 170 6.744 30.966 -11.497 1264 HG11 VAL 170 HG11 VAL 170 8.352 29.507 -10.426 1265 HG12 VAL 170 HG12 VAL 170 7.160 28.806 -9.588 1266 HG13 VAL 170 HG13 VAL 170 7.545 30.351 -9.307 1267 HG21 VAL 170 HG21 VAL 170 7.270 28.913 -12.621 1268 HG22 VAL 170 HG22 VAL 170 5.743 29.342 -12.933 1269 HG23 VAL 170 HG23 VAL 170 6.051 28.176 -11.856 1270 H ASN 171 H ASN 171 5.024 32.663 -11.423 1271 HA ASN 171 HA ASN 171 2.552 32.585 -12.767 1272 HB2 ASN 171 HB2 ASN 171 4.721 34.476 -12.947 1273 HB3 ASN 171 HB3 ASN 171 3.301 34.683 -13.728 1274 HD21 ASN 171 HD21 ASN 171 1.499 35.823 -11.006 1275 HD22 ASN 171 HD22 ASN 171 1.436 35.274 -12.648 1276 H LYS 172 H LYS 172 2.303 32.668 -15.173 1277 HA LYS 172 HA LYS 172 4.019 30.825 -16.423 1278 HB2 LYS 172 HB2 LYS 172 1.844 32.415 -17.468 1279 HB3 LYS 172 HB3 LYS 172 2.647 31.344 -18.405 1280 HG2 LYS 172 HG2 LYS 172 1.734 29.570 -17.368 1281 HG3 LYS 172 HG3 LYS 172 1.390 30.421 -16.018 1282 HD2 LYS 172 HD2 LYS 172 -0.605 29.995 -17.136 1283 HD3 LYS 172 HD3 LYS 172 -0.296 31.596 -17.231 1284 HE2 LYS 172 HE2 LYS 172 0.581 31.215 -19.454 1285 HE3 LYS 172 HE3 LYS 172 0.040 29.678 -19.346 1286 HZ1 LYS 172 HZ1 LYS 172 -1.583 31.040 -20.426 1287 HZ2 LYS 172 HZ2 LYS 172 -1.638 32.009 -19.133 1288 HZ3 LYS 172 HZ3 LYS 172 -2.173 30.487 -19.025 Start of MODEL 13 1 H1 HIS 1 H1 HIS 1 3.059 2.826 2.714 2 H2 HIS 1 H2 HIS 1 2.856 4.206 1.895 3 H3 HIS 1 H3 HIS 1 3.106 2.822 1.098 4 HA HIS 1 HA HIS 1 1.062 1.993 1.833 5 HB2 HIS 1 HB2 HIS 1 0.897 4.487 3.276 6 HB3 HIS 1 HB3 HIS 1 -0.478 3.683 2.916 7 HD1 HIS 1 HD1 HIS 1 2.465 3.561 5.167 8 HD2 HIS 1 HD2 HIS 1 -0.965 1.421 4.483 9 HE1 HIS 1 HE1 HIS 1 2.147 1.967 7.039 10 HE2 HIS 1 HE2 HIS 1 0.104 0.656 6.652 11 H GLY 2 H GLY 2 0.764 1.881 -0.455 12 HA2 GLY 2 HA2 GLY 2 -0.523 2.570 -2.247 13 HA3 GLY 2 HA3 GLY 2 -0.896 3.967 -1.488 14 H PHE 3 H PHE 3 -0.464 4.548 -3.984 15 HA PHE 3 HA PHE 3 1.993 5.891 -3.899 16 HB2 PHE 3 HB2 PHE 3 3.002 4.971 -5.861 17 HB3 PHE 3 HB3 PHE 3 2.721 3.768 -4.792 18 HD1 PHE 3 HD1 PHE 3 1.912 5.041 -8.003 19 HD2 PHE 3 HD2 PHE 3 0.959 2.098 -5.213 20 HE1 PHE 3 HE1 PHE 3 0.773 3.803 -9.713 21 HE2 PHE 3 HE2 PHE 3 -0.197 0.845 -6.919 22 HZ PHE 3 HZ PHE 3 -0.275 1.688 -9.184 23 H ILE 4 H ILE 4 2.478 7.306 -5.828 24 HA ILE 4 HA ILE 4 0.028 8.521 -6.626 25 HB ILE 4 HB ILE 4 2.764 9.539 -7.036 26 HG12 ILE 4 HG12 ILE 4 0.868 10.429 -5.076 27 HG13 ILE 4 HG13 ILE 4 2.097 9.409 -4.737 28 HG21 ILE 4 HG21 ILE 4 1.788 11.616 -7.653 29 HG22 ILE 4 HG22 ILE 4 0.308 10.979 -7.520 30 HG23 ILE 4 HG23 ILE 4 1.310 10.462 -8.680 31 HD11 ILE 4 HD11 ILE 4 2.677 11.641 -4.055 32 HD12 ILE 4 HD12 ILE 4 2.461 12.173 -5.566 33 HD13 ILE 4 HD13 ILE 4 3.678 11.164 -5.231 34 H GLU 5 H GLU 5 -0.945 8.134 -8.548 35 HA GLU 5 HA GLU 5 0.387 6.531 -10.462 36 HB2 GLU 5 HB2 GLU 5 -1.949 6.321 -10.065 37 HB3 GLU 5 HB3 GLU 5 -2.178 7.841 -10.619 38 HG2 GLU 5 HG2 GLU 5 -1.449 7.093 -12.774 39 HG3 GLU 5 HG3 GLU 5 -1.425 5.570 -12.185 40 H LYS 6 H LYS 6 -0.643 9.838 -10.263 41 HA LYS 6 HA LYS 6 1.212 10.500 -12.371 42 HB2 LYS 6 HB2 LYS 6 -0.996 10.358 -13.346 43 HB3 LYS 6 HB3 LYS 6 -1.476 11.558 -12.348 44 HG2 LYS 6 HG2 LYS 6 -0.012 13.062 -13.415 45 HG3 LYS 6 HG3 LYS 6 0.544 11.864 -14.376 46 HD2 LYS 6 HD2 LYS 6 -1.653 11.658 -15.314 47 HD3 LYS 6 HD3 LYS 6 -2.122 12.943 -14.421 48 HE2 LYS 6 HE2 LYS 6 -0.601 14.343 -15.587 49 HE3 LYS 6 HE3 LYS 6 -0.041 13.063 -16.433 50 HZ1 LYS 6 HZ1 LYS 6 -1.513 14.342 -17.766 51 HZ2 LYS 6 HZ2 LYS 6 -2.695 14.139 -16.682 52 HZ3 LYS 6 HZ3 LYS 6 -2.140 12.872 -17.519 53 HA PRO 7 HA PRO 7 2.987 11.702 -12.604 54 HB2 PRO 7 HB2 PRO 7 5.177 12.710 -11.471 55 HB3 PRO 7 HB3 PRO 7 4.159 13.729 -12.240 56 HG2 PRO 7 HG2 PRO 7 4.260 13.160 -9.428 57 HG3 PRO 7 HG3 PRO 7 4.195 14.628 -10.140 58 HD2 PRO 7 HD2 PRO 7 2.021 13.523 -9.223 59 HD3 PRO 7 HD3 PRO 7 1.963 14.452 -10.565 60 H GLY 8 H GLY 8 3.625 9.690 -12.832 61 HA2 GLY 8 HA2 GLY 8 3.903 8.146 -10.475 62 HA3 GLY 8 HA3 GLY 8 3.922 7.586 -12.009 63 H SER 9 H SER 9 6.168 9.521 -12.637 64 HA SER 9 HA SER 9 8.172 7.701 -11.745 65 HB2 SER 9 HB2 SER 9 8.265 8.374 -14.053 66 HB3 SER 9 HB3 SER 9 8.523 9.919 -13.592 67 HG SER 9 HG SER 9 10.213 7.768 -13.309 68 H ARG 10 H ARG 10 8.582 8.093 -9.567 69 HA ARG 10 HA ARG 10 9.316 10.722 -8.782 70 HB2 ARG 10 HB2 ARG 10 8.233 9.249 -7.218 71 HB3 ARG 10 HB3 ARG 10 9.559 8.297 -7.225 72 HG2 ARG 10 HG2 ARG 10 10.823 10.062 -6.218 73 HG3 ARG 10 HG3 ARG 10 9.486 10.999 -6.194 74 HD2 ARG 10 HD2 ARG 10 8.459 9.467 -4.685 75 HD3 ARG 10 HD3 ARG 10 9.825 8.571 -4.684 76 HE ARG 10 HE ARG 10 9.424 11.075 -3.350 77 HH11 ARG 10 HH11 ARG 10 11.738 8.574 -4.187 78 HH12 ARG 10 HH12 ARG 10 12.907 9.149 -3.045 79 HH21 ARG 10 HH21 ARG 10 10.974 11.782 -1.942 80 HH22 ARG 10 HH22 ARG 10 12.481 10.940 -1.791 81 H ALA 11 H ALA 11 10.858 7.844 -9.770 82 HA ALA 11 HA ALA 11 13.290 8.223 -8.634 83 HB1 ALA 11 HB1 ALA 11 12.600 6.127 -9.684 84 HB2 ALA 11 HB2 ALA 11 14.076 6.532 -10.203 85 HB3 ALA 11 HB3 ALA 11 12.787 6.802 -11.141 86 H ALA 12 H ALA 12 12.199 9.536 -11.631 87 HA ALA 12 HA ALA 12 14.646 10.328 -12.605 88 HB1 ALA 12 HB1 ALA 12 12.640 10.390 -13.961 89 HB2 ALA 12 HB2 ALA 12 13.373 11.829 -14.033 90 HB3 ALA 12 HB3 ALA 12 12.078 11.628 -13.086 91 H LEU 13 H LEU 13 12.627 11.800 -10.245 92 HA LEU 13 HA LEU 13 14.286 14.095 -10.171 93 HB2 LEU 13 HB2 LEU 13 11.863 13.521 -8.689 94 HB3 LEU 13 HB3 LEU 13 12.662 14.937 -8.537 95 HG LEU 13 HG LEU 13 12.174 14.980 -11.092 96 HD11 LEU 13 HD11 LEU 13 9.968 14.222 -11.505 97 HD12 LEU 13 HD12 LEU 13 9.890 13.602 -10.014 98 HD13 LEU 13 HD13 LEU 13 10.914 12.976 -11.097 99 HD21 LEU 13 HD21 LEU 13 10.381 16.493 -10.539 100 HD22 LEU 13 HD22 LEU 13 11.629 16.744 -9.542 101 HD23 LEU 13 HD23 LEU 13 10.344 15.904 -9.034 102 H CYS 14 H CYS 14 13.963 11.223 -8.512 103 HA CYS 14 HA CYS 14 15.032 11.995 -6.057 104 HB2 CYS 14 HB2 CYS 14 13.858 10.016 -6.265 105 HB3 CYS 14 HB3 CYS 14 14.899 9.473 -7.400 106 H SER 15 H SER 15 16.358 11.161 -9.083 107 HA SER 15 HA SER 15 18.815 10.362 -8.325 108 HB2 SER 15 HB2 SER 15 18.010 10.205 -10.626 109 HB3 SER 15 HB3 SER 15 18.224 11.815 -10.796 110 HG SER 15 HG SER 15 20.456 10.703 -9.985 111 H GLU 16 H GLU 16 20.782 11.096 -7.942 112 HA GLU 16 HA GLU 16 21.037 13.633 -6.877 113 HB2 GLU 16 HB2 GLU 16 23.127 11.713 -7.555 114 HB3 GLU 16 HB3 GLU 16 23.374 12.998 -6.577 115 HG2 GLU 16 HG2 GLU 16 23.162 11.268 -5.121 116 HG3 GLU 16 HG3 GLU 16 21.690 11.973 -5.082 117 H ALA 17 H ALA 17 21.139 12.586 -9.983 118 HA ALA 17 HA ALA 17 23.076 14.036 -11.174 119 HB1 ALA 17 HB1 ALA 17 21.713 12.355 -12.324 120 HB2 ALA 17 HB2 ALA 17 21.796 13.694 -13.226 121 HB3 ALA 17 HB3 ALA 17 20.471 13.390 -12.351 122 H PHE 18 H PHE 18 20.504 15.402 -9.630 123 HA PHE 18 HA PHE 18 20.216 17.733 -11.103 124 HB2 PHE 18 HB2 PHE 18 18.704 16.919 -9.345 125 HB3 PHE 18 HB3 PHE 18 19.808 17.402 -8.243 126 HD1 PHE 18 HD1 PHE 18 19.982 19.716 -7.565 127 HD2 PHE 18 HD2 PHE 18 17.390 18.575 -10.610 128 HE1 PHE 18 HE1 PHE 18 19.026 21.940 -7.567 129 HE2 PHE 18 HE2 PHE 18 16.382 20.759 -10.588 130 HZ PHE 18 HZ PHE 18 17.213 22.461 -9.090 131 H GLY 19 H GLY 19 22.782 16.663 -9.182 132 HA2 GLY 19 HA2 GLY 19 24.271 18.953 -9.703 133 HA3 GLY 19 HA3 GLY 19 23.765 18.991 -8.150 134 H PHE 20 H PHE 20 23.961 16.063 -7.997 135 HA PHE 20 HA PHE 20 25.339 14.547 -7.350 136 HB2 PHE 20 HB2 PHE 20 26.301 14.966 -9.653 137 HB3 PHE 20 HB3 PHE 20 27.597 15.550 -8.849 138 HD1 PHE 20 HD1 PHE 20 25.612 12.538 -9.211 139 HD2 PHE 20 HD2 PHE 20 29.307 14.089 -8.113 140 HE1 PHE 20 HE1 PHE 20 26.486 10.290 -9.018 141 HE2 PHE 20 HE2 PHE 20 30.195 11.858 -7.931 142 HZ PHE 20 HZ PHE 20 28.783 9.953 -8.382 143 H LEU 21 H LEU 21 26.436 17.627 -6.676 144 HA LEU 21 HA LEU 21 28.346 16.821 -4.782 145 HB2 LEU 21 HB2 LEU 21 27.037 19.378 -5.095 146 HB3 LEU 21 HB3 LEU 21 28.296 19.139 -4.082 147 HG LEU 21 HG LEU 21 28.533 18.918 -6.945 148 HD11 LEU 21 HD11 LEU 21 29.568 21.085 -6.869 149 HD12 LEU 21 HD12 LEU 21 29.260 21.180 -5.284 150 HD13 LEU 21 HD13 LEU 21 28.041 21.188 -6.347 151 HD21 LEU 21 HD21 LEU 21 30.889 18.958 -6.538 152 HD22 LEU 21 HD22 LEU 21 30.221 17.697 -5.777 153 HD23 LEU 21 HD23 LEU 21 30.621 19.025 -4.945 154 H ASN 22 H ASN 22 25.009 16.977 -4.807 155 HA ASN 22 HA ASN 22 24.961 16.103 -2.125 156 HB2 ASN 22 HB2 ASN 22 24.645 18.667 -2.224 157 HB3 ASN 22 HB3 ASN 22 23.089 18.235 -2.471 158 HD21 ASN 22 HD21 ASN 22 23.928 18.718 1.155 159 HD22 ASN 22 HD22 ASN 22 24.249 19.681 -0.248 160 H LEU 23 H LEU 23 22.762 15.350 -1.393 161 HA LEU 23 HA LEU 23 21.635 13.848 -3.455 162 HB2 LEU 23 HB2 LEU 23 21.239 14.076 -0.629 163 HB3 LEU 23 HB3 LEU 23 20.013 13.390 -1.460 164 HG LEU 23 HG LEU 23 22.542 12.266 -1.992 165 HD11 LEU 23 HD11 LEU 23 22.653 11.015 0.040 166 HD12 LEU 23 HD12 LEU 23 21.392 11.843 0.623 167 HD13 LEU 23 HD13 LEU 23 22.797 12.595 0.349 168 HD21 LEU 23 HD21 LEU 23 21.271 10.209 -1.917 169 HD22 LEU 23 HD22 LEU 23 20.526 11.275 -2.878 170 HD23 LEU 23 HD23 LEU 23 19.981 11.021 -1.377 171 H ASN 24 H ASN 24 19.407 13.683 -4.089 172 HA ASN 24 HA ASN 24 17.997 16.191 -3.801 173 HB2 ASN 24 HB2 ASN 24 19.122 15.694 -6.028 174 HB3 ASN 24 HB3 ASN 24 17.847 14.701 -6.266 175 HD21 ASN 24 HD21 ASN 24 15.899 17.168 -7.578 176 HD22 ASN 24 HD22 ASN 24 16.281 15.483 -7.458 177 H CYS 25 H CYS 25 17.850 13.392 -2.675 178 HA CYS 25 HA CYS 25 15.177 12.775 -3.478 179 HB2 CYS 25 HB2 CYS 25 17.116 11.228 -3.839 180 HB3 CYS 25 HB3 CYS 25 16.971 10.898 -2.246 181 H GLY 26 H GLY 26 17.100 13.091 -0.657 182 HA2 GLY 26 HA2 GLY 26 16.361 13.464 1.459 183 HA3 GLY 26 HA3 GLY 26 14.807 13.345 0.969 184 H SER 27 H SER 27 16.007 12.267 3.395 185 HA SER 27 HA SER 27 16.367 9.549 3.051 186 HB2 SER 27 HB2 SER 27 17.144 10.706 5.064 187 HB3 SER 27 HB3 SER 27 15.594 10.881 5.548 188 HG SER 27 HG SER 27 16.289 9.168 6.626 189 H VAL 28 H VAL 28 13.567 11.276 2.980 190 HA VAL 28 HA VAL 28 11.809 9.344 4.005 191 HB VAL 28 HB VAL 28 11.427 11.817 3.809 192 HG11 VAL 28 HG11 VAL 28 10.388 12.608 1.773 193 HG12 VAL 28 HG12 VAL 28 10.623 11.161 1.091 194 HG13 VAL 28 HG13 VAL 28 11.890 12.090 1.471 195 HG21 VAL 28 HG21 VAL 28 9.053 11.648 3.674 196 HG22 VAL 28 HG22 VAL 28 9.661 10.489 4.624 197 HG23 VAL 28 HG23 VAL 28 9.192 10.136 3.117 198 H MET 29 H MET 29 13.640 9.076 1.456 199 HA MET 29 HA MET 29 12.035 8.589 -0.600 200 HB2 MET 29 HB2 MET 29 13.985 7.353 -1.539 201 HB3 MET 29 HB3 MET 29 14.423 8.765 -0.846 202 HG2 MET 29 HG2 MET 29 15.972 7.515 0.027 203 HG3 MET 29 HG3 MET 29 14.817 7.301 1.162 204 HE1 MET 29 HE1 MET 29 16.196 3.731 1.309 205 HE2 MET 29 HE2 MET 29 15.640 4.963 2.197 206 HE3 MET 29 HE3 MET 29 17.000 5.134 1.338 207 H TYR 30 H TYR 30 12.344 6.330 1.901 208 HA TYR 30 HA TYR 30 11.755 4.116 0.282 209 HB2 TYR 30 HB2 TYR 30 12.925 3.801 2.330 210 HB3 TYR 30 HB3 TYR 30 11.662 4.404 3.171 211 HD1 TYR 30 HD1 TYR 30 12.493 1.579 1.014 212 HD2 TYR 30 HD2 TYR 30 10.138 2.923 4.174 213 HE1 TYR 30 HE1 TYR 30 11.563 -0.639 1.278 214 HE2 TYR 30 HE2 TYR 30 9.239 0.692 4.440 215 HH TYR 30 HH TYR 30 8.874 -1.384 3.046 216 H GLU 31 H GLU 31 9.794 5.993 2.497 217 HA GLU 31 HA GLU 31 7.559 5.233 0.929 218 HB2 GLU 31 HB2 GLU 31 6.140 4.711 2.813 219 HB3 GLU 31 HB3 GLU 31 7.317 3.615 2.534 220 HG2 GLU 31 HG2 GLU 31 8.531 4.426 4.383 221 HG3 GLU 31 HG3 GLU 31 7.388 5.561 4.650 222 HA PRO 32 HA PRO 32 7.344 9.560 1.948 223 HB2 PRO 32 HB2 PRO 32 7.156 10.586 -0.508 224 HB3 PRO 32 HB3 PRO 32 8.631 10.146 0.038 225 HG2 PRO 32 HG2 PRO 32 6.843 8.607 -1.565 226 HG3 PRO 32 HG3 PRO 32 8.418 8.926 -1.858 227 HD2 PRO 32 HD2 PRO 32 7.790 6.677 -0.741 228 HD3 PRO 32 HD3 PRO 32 9.132 7.457 -0.233 229 H GLN 33 H GLN 33 5.266 7.409 0.899 230 HA GLN 33 HA GLN 33 3.118 9.292 0.837 231 HB2 GLN 33 HB2 GLN 33 2.238 6.680 0.371 232 HB3 GLN 33 HB3 GLN 33 2.097 7.966 -0.625 233 HG2 GLN 33 HG2 GLN 33 3.236 6.459 -1.871 234 HG3 GLN 33 HG3 GLN 33 4.412 7.455 -1.329 235 HE21 GLN 33 HE21 GLN 33 5.965 4.301 -0.836 236 HE22 GLN 33 HE22 GLN 33 5.634 5.447 -2.092 237 H SER 34 H SER 34 4.753 7.776 3.085 238 HA SER 34 HA SER 34 2.488 7.366 4.763 239 HB2 SER 34 HB2 SER 34 3.337 5.192 3.923 240 HB3 SER 34 HB3 SER 34 4.755 5.506 4.670 241 HG SER 34 HG SER 34 3.163 5.723 6.554 242 H LEU 35 H LEU 35 2.916 9.394 5.761 243 HA LEU 35 HA LEU 35 5.020 9.157 7.756 244 HB2 LEU 35 HB2 LEU 35 3.665 11.467 6.800 245 HB3 LEU 35 HB3 LEU 35 4.461 11.489 8.226 246 HG LEU 35 HG LEU 35 6.496 11.017 7.028 247 HD11 LEU 35 HD11 LEU 35 6.638 11.335 4.673 248 HD12 LEU 35 HD12 LEU 35 5.028 11.460 4.587 249 HD13 LEU 35 HD13 LEU 35 5.709 10.059 5.021 250 HD21 LEU 35 HD21 LEU 35 6.721 13.320 6.202 251 HD22 LEU 35 HD22 LEU 35 5.939 13.318 7.618 252 HD23 LEU 35 HD23 LEU 35 5.112 13.478 6.238 253 H GLU 36 H GLU 36 4.263 8.751 9.957 254 HA GLU 36 HA GLU 36 1.419 8.664 10.071 255 HB2 GLU 36 HB2 GLU 36 3.336 6.929 11.436 256 HB3 GLU 36 HB3 GLU 36 1.755 6.883 11.844 257 HG2 GLU 36 HG2 GLU 36 1.307 6.229 9.543 258 HG3 GLU 36 HG3 GLU 36 2.918 6.019 9.377 259 H ALA 37 H ALA 37 0.191 9.440 11.764 260 HA ALA 37 HA ALA 37 1.572 10.123 14.221 261 HB1 ALA 37 HB1 ALA 37 1.119 12.226 13.228 262 HB2 ALA 37 HB2 ALA 37 0.133 12.047 14.497 263 HB3 ALA 37 HB3 ALA 37 -0.430 11.824 12.998 264 H LYS 38 H LYS 38 0.056 9.784 16.150 265 HA LYS 38 HA LYS 38 -1.752 7.691 15.514 266 HB2 LYS 38 HB2 LYS 38 -0.353 7.622 17.509 267 HB3 LYS 38 HB3 LYS 38 -1.295 8.791 18.152 268 HG2 LYS 38 HG2 LYS 38 -3.114 7.388 18.207 269 HG3 LYS 38 HG3 LYS 38 -2.319 6.246 17.352 270 HD2 LYS 38 HD2 LYS 38 -0.893 5.883 19.222 271 HD3 LYS 38 HD3 LYS 38 -1.773 6.964 20.073 272 HE2 LYS 38 HE2 LYS 38 -3.674 5.676 19.887 273 HE3 LYS 38 HE3 LYS 38 -2.957 4.685 18.805 274 HZ1 LYS 38 HZ1 LYS 38 -3.217 3.606 20.854 275 HZ2 LYS 38 HZ2 LYS 38 -2.354 4.757 21.592 276 HZ3 LYS 38 HZ3 LYS 38 -1.643 3.776 20.521 277 H LYS 39 H LYS 39 -4.033 7.623 15.736 278 HA LYS 39 HA LYS 39 -5.357 10.053 15.533 279 HB2 LYS 39 HB2 LYS 39 -6.367 7.402 16.042 280 HB3 LYS 39 HB3 LYS 39 -7.374 8.675 15.864 281 HG2 LYS 39 HG2 LYS 39 -6.761 8.921 13.633 282 HG3 LYS 39 HG3 LYS 39 -5.591 7.792 13.789 283 HD2 LYS 39 HD2 LYS 39 -7.220 6.137 14.217 284 HD3 LYS 39 HD3 LYS 39 -8.402 7.259 14.122 285 HE2 LYS 39 HE2 LYS 39 -8.017 7.537 11.842 286 HE3 LYS 39 HE3 LYS 39 -6.724 6.542 11.907 287 HZ1 LYS 39 HZ1 LYS 39 -8.614 5.372 11.077 288 HZ2 LYS 39 HZ2 LYS 39 -9.432 5.722 12.426 289 HZ3 LYS 39 HZ3 LYS 39 -8.152 4.737 12.490 290 H GLY 40 H GLY 40 -6.641 11.214 17.036 291 HA2 GLY 40 HA2 GLY 40 -7.412 10.431 19.530 292 HA3 GLY 40 HA3 GLY 40 -5.932 11.088 19.740 293 H PHE 41 H PHE 41 -7.715 12.686 20.897 294 HA PHE 41 HA PHE 41 -8.212 14.737 18.907 295 HB2 PHE 41 HB2 PHE 41 -9.860 15.648 20.330 296 HB3 PHE 41 HB3 PHE 41 -10.220 14.112 19.906 297 HD1 PHE 41 HD1 PHE 41 -10.215 12.305 21.561 298 HD2 PHE 41 HD2 PHE 41 -9.340 16.235 22.631 299 HE1 PHE 41 HE1 PHE 41 -10.460 11.717 23.887 300 HE2 PHE 41 HE2 PHE 41 -9.604 15.671 24.965 301 HZ PHE 41 HZ PHE 41 -10.178 13.406 25.595 302 HA PRO 42 HA PRO 42 -8.506 17.280 19.072 303 HB2 PRO 42 HB2 PRO 42 -6.776 19.140 18.199 304 HB3 PRO 42 HB3 PRO 42 -7.495 19.339 19.652 305 HG2 PRO 42 HG2 PRO 42 -4.921 18.233 19.121 306 HG3 PRO 42 HG3 PRO 42 -5.306 19.393 20.204 307 HD2 PRO 42 HD2 PRO 42 -5.072 16.961 21.026 308 HD3 PRO 42 HD3 PRO 42 -6.268 17.886 21.644 309 H HIS 43 H HIS 43 -8.959 17.279 16.929 310 HA HIS 43 HA HIS 43 -6.926 16.146 15.262 311 HB2 HIS 43 HB2 HIS 43 -8.452 14.358 16.049 312 HB3 HIS 43 HB3 HIS 43 -9.615 15.065 15.147 313 HD1 HIS 43 HD1 HIS 43 -6.173 13.642 14.567 314 HD2 HIS 43 HD2 HIS 43 -9.797 13.976 12.678 315 HE1 HIS 43 HE1 HIS 43 -6.060 12.405 12.400 316 HE2 HIS 43 HE2 HIS 43 -8.235 12.607 11.245 317 H SER 44 H SER 44 -10.194 17.366 15.264 318 HA SER 44 HA SER 44 -9.808 18.642 12.729 319 HB2 SER 44 HB2 SER 44 -11.971 17.681 13.320 320 HB3 SER 44 HB3 SER 44 -12.127 18.838 14.462 321 HG SER 44 HG SER 44 -12.392 19.021 11.788 322 H GLY 45 H GLY 45 -8.880 19.154 15.679 323 HA2 GLY 45 HA2 GLY 45 -9.378 21.973 15.871 324 HA3 GLY 45 HA3 GLY 45 -8.782 21.019 17.056 325 HA PRO 46 HA PRO 46 -5.189 23.085 15.261 326 HB2 PRO 46 HB2 PRO 46 -3.740 23.414 17.477 327 HB3 PRO 46 HB3 PRO 46 -4.922 24.490 17.141 328 HG2 PRO 46 HG2 PRO 46 -5.087 22.198 18.827 329 HG3 PRO 46 HG3 PRO 46 -5.515 23.733 19.186 330 HD2 PRO 46 HD2 PRO 46 -7.357 22.090 18.435 331 HD3 PRO 46 HD3 PRO 46 -7.413 23.624 17.876 332 H ALA 47 H ALA 47 -3.127 22.414 14.741 333 HA ALA 47 HA ALA 47 -3.010 19.611 14.816 334 HB1 ALA 47 HB1 ALA 47 -2.298 20.842 12.816 335 HB2 ALA 47 HB2 ALA 47 -1.080 19.905 13.318 336 HB3 ALA 47 HB3 ALA 47 -1.072 21.487 13.650 337 H ASP 48 H ASP 48 -2.506 18.600 16.633 338 HA ASP 48 HA ASP 48 0.050 19.249 17.869 339 HB2 ASP 48 HB2 ASP 48 -2.297 18.098 19.012 340 HB3 ASP 48 HB3 ASP 48 -0.838 17.837 19.698 341 H GLY 49 H GLY 49 1.391 17.252 18.374 342 HA2 GLY 49 HA2 GLY 49 1.975 15.090 17.885 343 HA3 GLY 49 HA3 GLY 49 0.589 14.869 17.051 344 H GLN 50 H GLN 50 1.003 17.187 15.353 345 HA GLN 50 HA GLN 50 2.230 15.881 13.301 346 HB2 GLN 50 HB2 GLN 50 1.167 18.480 13.687 347 HB3 GLN 50 HB3 GLN 50 2.279 18.429 12.492 348 HG2 GLN 50 HG2 GLN 50 0.175 18.200 11.529 349 HG3 GLN 50 HG3 GLN 50 0.956 16.773 11.382 350 HE21 GLN 50 HE21 GLN 50 -2.586 16.901 13.112 351 HE22 GLN 50 HE22 GLN 50 -1.860 18.218 12.252 352 H ILE 51 H ILE 51 3.757 17.753 15.658 353 HA ILE 51 HA ILE 51 6.042 18.361 14.189 354 HB ILE 51 HB ILE 51 5.805 18.143 17.095 355 HG12 ILE 51 HG12 ILE 51 5.736 20.554 15.504 356 HG13 ILE 51 HG13 ILE 51 4.387 19.817 16.056 357 HG21 ILE 51 HG21 ILE 51 7.844 19.449 17.238 358 HG22 ILE 51 HG22 ILE 51 7.974 19.437 15.626 359 HG23 ILE 51 HG23 ILE 51 8.145 18.063 16.461 360 HD11 ILE 51 HD11 ILE 51 4.921 21.685 17.437 361 HD12 ILE 51 HD12 ILE 51 6.376 21.053 17.755 362 HD13 ILE 51 HD13 ILE 51 5.040 20.324 18.302 363 H ALA 52 H ALA 52 5.158 15.681 16.232 364 HA ALA 52 HA ALA 52 7.634 14.420 16.038 365 HB1 ALA 52 HB1 ALA 52 6.088 13.942 17.900 366 HB2 ALA 52 HB2 ALA 52 6.498 12.549 17.187 367 HB3 ALA 52 HB3 ALA 52 5.067 13.230 16.867 368 H SER 53 H SER 53 4.810 14.263 14.137 369 HA SER 53 HA SER 53 5.705 11.984 12.732 370 HB2 SER 53 HB2 SER 53 3.585 12.261 11.493 371 HB3 SER 53 HB3 SER 53 3.291 12.404 13.093 372 HG SER 53 HG SER 53 3.942 14.734 12.071 373 H ALA 54 H ALA 54 6.784 14.891 12.601 374 HA ALA 54 HA ALA 54 7.680 16.229 11.107 375 HB1 ALA 54 HB1 ALA 54 9.094 14.314 10.552 376 HB2 ALA 54 HB2 ALA 54 8.921 15.255 9.247 377 HB3 ALA 54 HB3 ALA 54 8.062 13.891 9.381 378 H GLY 55 H GLY 55 4.778 15.790 10.942 379 HA2 GLY 55 HA2 GLY 55 4.039 16.253 8.284 380 HA3 GLY 55 HA3 GLY 55 3.097 16.488 9.597 381 H GLY 56 H GLY 56 5.453 18.155 10.619 382 HA2 GLY 56 HA2 GLY 56 4.537 20.653 9.618 383 HA3 GLY 56 HA3 GLY 56 5.626 20.427 10.814 384 H LEU 57 H LEU 57 6.212 18.764 7.952 385 HA LEU 57 HA LEU 57 8.662 19.861 7.628 386 HB2 LEU 57 HB2 LEU 57 7.138 17.950 6.247 387 HB3 LEU 57 HB3 LEU 57 8.102 18.757 5.204 388 HG LEU 57 HG LEU 57 9.172 17.471 7.542 389 HD11 LEU 57 HD11 LEU 57 9.768 15.595 6.163 390 HD12 LEU 57 HD12 LEU 57 8.976 16.258 4.919 391 HD13 LEU 57 HD13 LEU 57 8.160 15.756 6.222 392 HD21 LEU 57 HD21 LEU 57 11.263 17.575 6.387 393 HD22 LEU 57 HD22 LEU 57 10.647 19.059 6.566 394 HD23 LEU 57 HD23 LEU 57 10.541 18.307 5.139 395 H PHE 58 H PHE 58 5.887 21.321 6.657 396 HA PHE 58 HA PHE 58 6.753 22.662 4.432 397 HB2 PHE 58 HB2 PHE 58 5.010 24.242 4.873 398 HB3 PHE 58 HB3 PHE 58 4.465 22.745 5.230 399 HD1 PHE 58 HD1 PHE 58 4.121 22.056 7.560 400 HD2 PHE 58 HD2 PHE 58 5.253 25.934 6.567 401 HE1 PHE 58 HE1 PHE 58 3.579 22.784 9.793 402 HE2 PHE 58 HE2 PHE 58 4.696 26.669 8.789 403 HZ PHE 58 HZ PHE 58 3.909 25.083 10.424 404 H GLY 59 H GLY 59 7.781 23.075 7.638 405 HA2 GLY 59 HA2 GLY 59 8.775 25.700 7.279 406 HA3 GLY 59 HA3 GLY 59 9.071 24.722 8.553 407 H GLY 60 H GLY 60 9.819 22.665 6.400 408 HA2 GLY 60 HA2 GLY 60 12.575 23.012 6.669 409 HA3 GLY 60 HA3 GLY 60 11.823 21.818 5.846 410 H ILE 61 H ILE 61 10.629 24.460 4.444 411 HA ILE 61 HA ILE 61 11.986 24.091 2.121 412 HB ILE 61 HB ILE 61 10.660 26.585 2.867 413 HG12 ILE 61 HG12 ILE 61 9.434 24.463 1.343 414 HG13 ILE 61 HG13 ILE 61 9.243 24.591 2.960 415 HG21 ILE 61 HG21 ILE 61 10.405 27.016 0.483 416 HG22 ILE 61 HG22 ILE 61 11.231 25.666 0.151 417 HG23 ILE 61 HG23 ILE 61 11.975 26.916 0.858 418 HD11 ILE 61 HD11 ILE 61 7.348 25.554 1.836 419 HD12 ILE 61 HD12 ILE 61 8.321 26.581 1.052 420 HD13 ILE 61 HD13 ILE 61 8.132 26.708 2.653 421 H LEU 62 H LEU 62 12.700 26.146 4.779 422 HA LEU 62 HA LEU 62 14.569 27.740 3.523 423 HB2 LEU 62 HB2 LEU 62 14.141 27.162 6.312 424 HB3 LEU 62 HB3 LEU 62 15.365 28.150 5.873 425 HG LEU 62 HG LEU 62 13.719 29.641 4.949 426 HD11 LEU 62 HD11 LEU 62 11.424 29.512 5.654 427 HD12 LEU 62 HD12 LEU 62 11.709 28.064 6.315 428 HD13 LEU 62 HD13 LEU 62 11.804 28.254 4.712 429 HD21 LEU 62 HD21 LEU 62 13.128 30.564 7.138 430 HD22 LEU 62 HD22 LEU 62 14.674 30.091 7.124 431 HD23 LEU 62 HD23 LEU 62 13.551 29.163 7.825 432 H ASP 63 H ASP 63 14.813 24.611 4.790 433 HA ASP 63 HA ASP 63 17.694 24.624 4.669 434 HB2 ASP 63 HB2 ASP 63 16.560 23.808 6.703 435 HB3 ASP 63 HB3 ASP 63 16.100 22.510 5.824 436 H GLN 64 H GLN 64 15.623 24.344 2.453 437 HA GLN 64 HA GLN 64 15.771 21.689 1.637 438 HB2 GLN 64 HB2 GLN 64 14.053 23.475 1.099 439 HB3 GLN 64 HB3 GLN 64 14.988 23.722 -0.217 440 HG2 GLN 64 HG2 GLN 64 13.124 22.294 -0.693 441 HG3 GLN 64 HG3 GLN 64 14.550 21.555 -0.991 442 HE21 GLN 64 HE21 GLN 64 12.346 20.315 2.170 443 HE22 GLN 64 HE22 GLN 64 12.254 21.954 1.618 444 H GLN 65 H GLN 65 18.341 23.351 1.715 445 HA GLN 65 HA GLN 65 19.424 22.178 -0.717 446 HB2 GLN 65 HB2 GLN 65 20.270 24.670 0.426 447 HB3 GLN 65 HB3 GLN 65 21.062 23.914 -0.786 448 HG2 GLN 65 HG2 GLN 65 18.972 24.094 -2.058 449 HG3 GLN 65 HG3 GLN 65 18.484 25.147 -0.909 450 HE21 GLN 65 HE21 GLN 65 20.305 27.859 -2.061 451 HE22 GLN 65 HE22 GLN 65 19.344 27.219 -0.770 452 H SER 66 H SER 66 19.209 20.576 1.298 453 HA SER 66 HA SER 66 21.801 20.430 2.619 454 HB2 SER 66 HB2 SER 66 20.187 21.243 4.214 455 HB3 SER 66 HB3 SER 66 19.263 19.926 3.937 456 HG SER 66 HG SER 66 20.293 19.415 5.702 457 H GLU 67 H GLU 67 21.891 18.023 3.681 458 HA GLU 67 HA GLU 67 21.862 16.339 1.501 459 HB2 GLU 67 HB2 GLU 67 22.109 15.671 4.313 460 HB3 GLU 67 HB3 GLU 67 22.361 14.563 3.139 461 HG2 GLU 67 HG2 GLU 67 24.451 15.260 3.816 462 HG3 GLU 67 HG3 GLU 67 24.203 15.948 2.356 463 H ASN 68 H ASN 68 19.405 17.062 3.671 464 HA ASN 68 HA ASN 68 17.939 14.708 2.978 465 HB2 ASN 68 HB2 ASN 68 17.479 16.738 4.973 466 HB3 ASN 68 HB3 ASN 68 16.306 15.656 4.628 467 HD21 ASN 68 HD21 ASN 68 19.273 14.686 7.075 468 HD22 ASN 68 HD22 ASN 68 19.084 16.260 6.378 469 H ARG 69 H ARG 69 18.463 17.147 1.282 470 HA ARG 69 HA ARG 69 16.099 18.388 0.703 471 HB2 ARG 69 HB2 ARG 69 18.072 19.250 -0.227 472 HB3 ARG 69 HB3 ARG 69 18.426 17.822 -0.936 473 HG2 ARG 69 HG2 ARG 69 16.731 18.188 -2.525 474 HG3 ARG 69 HG3 ARG 69 16.372 19.614 -1.814 475 HD2 ARG 69 HD2 ARG 69 18.471 20.475 -2.361 476 HD3 ARG 69 HD3 ARG 69 18.963 19.022 -2.920 477 HE ARG 69 HE ARG 69 17.847 19.319 -4.892 478 HH11 ARG 69 HH11 ARG 69 17.100 21.974 -2.687 479 HH12 ARG 69 HH12 ARG 69 16.366 22.906 -3.949 480 HH21 ARG 69 HH21 ARG 69 16.907 20.558 -6.407 481 HH22 ARG 69 HH22 ARG 69 16.259 22.117 -6.016 482 H TRP 70 H TRP 70 14.229 17.880 -0.257 483 HA TRP 70 HA TRP 70 14.199 15.397 -1.663 484 HB2 TRP 70 HB2 TRP 70 11.853 15.247 -1.191 485 HB3 TRP 70 HB3 TRP 70 12.703 15.431 0.191 486 HD1 TRP 70 HD1 TRP 70 12.304 18.695 -1.290 487 HE1 TRP 70 HE1 TRP 70 10.531 20.099 -0.238 488 HE3 TRP 70 HE3 TRP 70 10.076 15.050 1.316 489 HZ2 TRP 70 HZ2 TRP 70 8.417 19.617 1.541 490 HZ3 TRP 70 HZ3 TRP 70 8.147 15.598 2.671 491 HH2 TRP 70 HH2 TRP 70 7.338 17.883 2.784 492 H PHE 71 H PHE 71 12.460 15.135 -3.384 493 HA PHE 71 HA PHE 71 13.117 16.852 -5.401 494 HB2 PHE 71 HB2 PHE 71 11.553 15.582 -6.708 495 HB3 PHE 71 HB3 PHE 71 12.340 14.556 -5.710 496 HD1 PHE 71 HD1 PHE 71 11.173 13.610 -3.703 497 HD2 PHE 71 HD2 PHE 71 9.174 15.887 -6.554 498 HE1 PHE 71 HE1 PHE 71 9.042 12.893 -2.787 499 HE2 PHE 71 HE2 PHE 71 7.045 15.168 -5.662 500 HZ PHE 71 HZ PHE 71 6.974 13.673 -3.779 501 H LYS 72 H LYS 72 11.990 18.399 -6.633 502 HA LYS 72 HA LYS 72 9.543 19.444 -5.457 503 HB2 LYS 72 HB2 LYS 72 11.429 20.887 -4.944 504 HB3 LYS 72 HB3 LYS 72 11.649 21.103 -6.548 505 HG2 LYS 72 HG2 LYS 72 9.517 22.187 -6.670 506 HG3 LYS 72 HG3 LYS 72 9.358 22.020 -5.053 507 HD2 LYS 72 HD2 LYS 72 10.061 24.180 -5.309 508 HD3 LYS 72 HD3 LYS 72 11.418 23.382 -4.871 509 HE2 LYS 72 HE2 LYS 72 12.271 23.452 -7.000 510 HE3 LYS 72 HE3 LYS 72 10.820 23.823 -7.650 511 HZ1 LYS 72 HZ1 LYS 72 12.244 25.740 -7.684 512 HZ2 LYS 72 HZ2 LYS 72 12.413 25.658 -6.078 513 HZ3 LYS 72 HZ3 LYS 72 10.976 26.025 -6.721 514 H HIS 73 H HIS 73 7.920 20.097 -6.963 515 HA HIS 73 HA HIS 73 8.649 19.625 -9.723 516 HB2 HIS 73 HB2 HIS 73 6.073 19.356 -8.470 517 HB3 HIS 73 HB3 HIS 73 6.236 19.375 -10.095 518 HD1 HIS 73 HD1 HIS 73 7.521 17.317 -11.259 519 HD2 HIS 73 HD2 HIS 73 6.574 16.916 -7.287 520 HE1 HIS 73 HE1 HIS 73 7.688 14.914 -10.642 521 HE2 HIS 73 HE2 HIS 73 7.158 14.648 -8.250 522 H ILE 74 H ILE 74 8.378 21.305 -11.235 523 HA ILE 74 HA ILE 74 7.461 23.802 -10.118 524 HB ILE 74 HB ILE 74 9.026 23.465 -12.566 525 HG12 ILE 74 HG12 ILE 74 10.052 24.428 -10.046 526 HG13 ILE 74 HG13 ILE 74 10.247 22.885 -10.544 527 HG21 ILE 74 HG21 ILE 74 9.376 25.866 -12.488 528 HG22 ILE 74 HG22 ILE 74 8.441 25.964 -11.173 529 HG23 ILE 74 HG23 ILE 74 7.794 25.550 -12.596 530 HD11 ILE 74 HD11 ILE 74 12.251 24.138 -10.965 531 HD12 ILE 74 HD12 ILE 74 11.422 25.184 -11.879 532 HD13 ILE 74 HD13 ILE 74 11.615 23.656 -12.372 533 H MET 75 H MET 75 5.579 24.740 -10.809 534 HA MET 75 HA MET 75 4.367 23.657 -13.164 535 HB2 MET 75 HB2 MET 75 2.973 23.981 -10.634 536 HB3 MET 75 HB3 MET 75 2.259 23.457 -12.006 537 HG2 MET 75 HG2 MET 75 4.235 22.055 -10.540 538 HG3 MET 75 HG3 MET 75 2.630 21.765 -10.454 539 HE1 MET 75 HE1 MET 75 1.751 20.166 -13.846 540 HE2 MET 75 HE2 MET 75 1.512 21.687 -13.352 541 HE3 MET 75 HE3 MET 75 1.199 20.453 -12.354 542 H THR 76 H THR 76 2.498 24.996 -13.956 543 HA THR 76 HA THR 76 2.691 27.776 -13.142 544 HB THR 76 HB THR 76 1.442 28.215 -15.243 545 HG1 THR 76 HG1 THR 76 1.308 25.601 -15.207 546 HG21 THR 76 HG21 THR 76 3.359 27.915 -16.661 547 HG22 THR 76 HG22 THR 76 4.005 26.879 -15.601 548 HG23 THR 76 HG23 THR 76 3.872 28.445 -15.222 549 H GLY 77 H GLY 77 0.174 28.732 -13.614 550 HA2 GLY 77 HA2 GLY 77 -1.385 27.421 -11.666 551 HA3 GLY 77 HA3 GLY 77 -1.803 28.761 -12.500 552 H GLY 78 H GLY 78 -3.970 27.891 -12.518 553 HA2 GLY 78 HA2 GLY 78 -5.535 27.052 -14.012 554 HA3 GLY 78 HA3 GLY 78 -4.386 26.201 -14.801 555 H GLU 79 H GLU 79 -6.574 24.696 -14.428 556 HA GLU 79 HA GLU 79 -6.368 23.462 -11.877 557 HB2 GLU 79 HB2 GLU 79 -8.260 22.280 -12.334 558 HB3 GLU 79 HB3 GLU 79 -8.502 23.741 -13.022 559 HG2 GLU 79 HG2 GLU 79 -9.163 22.616 -14.751 560 HG3 GLU 79 HG3 GLU 79 -7.575 22.370 -15.040 561 H HIS 80 H HIS 80 -5.604 21.446 -11.309 562 HA HIS 80 HA HIS 80 -4.176 20.068 -13.394 563 HB2 HIS 80 HB2 HIS 80 -3.127 20.424 -10.717 564 HB3 HIS 80 HB3 HIS 80 -2.347 19.661 -11.932 565 HD1 HIS 80 HD1 HIS 80 -1.024 21.999 -10.401 566 HD2 HIS 80 HD2 HIS 80 -3.027 22.355 -13.958 567 HE1 HIS 80 HE1 HIS 80 -0.307 24.104 -11.507 568 HE2 HIS 80 HE2 HIS 80 -1.505 24.347 -13.644 569 H THR 81 H THR 81 -4.347 17.839 -13.410 570 HA THR 81 HA THR 81 -6.167 16.717 -11.571 571 HB THR 81 HB THR 81 -4.671 15.312 -13.654 572 HG1 THR 81 HG1 THR 81 -5.758 16.411 -15.020 573 HG21 THR 81 HG21 THR 81 -6.444 13.715 -13.634 574 HG22 THR 81 HG22 THR 81 -7.200 14.544 -12.469 575 HG23 THR 81 HG23 THR 81 -5.798 13.802 -12.155 576 H PHE 82 H PHE 82 -5.651 15.630 -9.692 577 HA PHE 82 HA PHE 82 -2.929 14.658 -9.402 578 HB2 PHE 82 HB2 PHE 82 -4.784 15.459 -7.357 579 HB3 PHE 82 HB3 PHE 82 -3.366 14.720 -7.026 580 HD1 PHE 82 HD1 PHE 82 -1.276 15.940 -7.051 581 HD2 PHE 82 HD2 PHE 82 -4.821 17.777 -8.226 582 HE1 PHE 82 HE1 PHE 82 -0.178 18.096 -6.992 583 HE2 PHE 82 HE2 PHE 82 -3.721 19.920 -8.222 584 HZ PHE 82 HZ PHE 82 -1.398 20.087 -7.573 585 H THR 83 H THR 83 -2.716 12.399 -9.370 586 HA THR 83 HA THR 83 -5.123 10.949 -8.771 587 HB THR 83 HB THR 83 -3.303 10.093 -10.901 588 HG1 THR 83 HG1 THR 83 -5.048 10.678 -12.289 589 HG21 THR 83 HG21 THR 83 -5.035 8.495 -11.443 590 HG22 THR 83 HG22 THR 83 -5.954 9.057 -10.237 591 HG23 THR 83 HG23 THR 83 -4.589 8.254 -9.907 592 H TRP 84 H TRP 84 -4.914 9.635 -7.071 593 HA TRP 84 HA TRP 84 -2.334 8.413 -6.542 594 HB2 TRP 84 HB2 TRP 84 -4.203 9.124 -4.474 595 HB3 TRP 84 HB3 TRP 84 -2.659 8.635 -4.265 596 HD1 TRP 84 HD1 TRP 84 -1.133 10.605 -6.050 597 HE1 TRP 84 HE1 TRP 84 -0.925 13.071 -5.619 598 HE3 TRP 84 HE3 TRP 84 -5.120 11.039 -3.073 599 HZ2 TRP 84 HZ2 TRP 84 -2.419 14.941 -4.135 600 HZ3 TRP 84 HZ3 TRP 84 -5.672 13.211 -2.153 601 HH2 TRP 84 HH2 TRP 84 -4.304 15.147 -2.682 602 H THR 85 H THR 85 -2.440 6.176 -5.781 603 HA THR 85 HA THR 85 -5.058 5.045 -5.766 604 HB THR 85 HB THR 85 -4.504 4.755 -8.092 605 HG1 THR 85 HG1 THR 85 -5.639 3.078 -7.391 606 HG21 THR 85 HG21 THR 85 -2.553 3.588 -8.773 607 HG22 THR 85 HG22 THR 85 -2.089 3.415 -7.233 608 HG23 THR 85 HG23 THR 85 -2.107 4.882 -7.912 609 H TYR 86 H TYR 86 -5.150 2.803 -4.920 610 HA TYR 86 HA TYR 86 -2.876 2.280 -3.226 611 HB2 TYR 86 HB2 TYR 86 -5.646 2.060 -2.455 612 HB3 TYR 86 HB3 TYR 86 -4.416 1.522 -1.524 613 HD1 TYR 86 HD1 TYR 86 -6.179 4.452 -2.584 614 HD2 TYR 86 HD2 TYR 86 -2.923 3.127 -0.360 615 HE1 TYR 86 HE1 TYR 86 -5.989 6.635 -1.541 616 HE2 TYR 86 HE2 TYR 86 -2.749 5.304 0.693 617 HH TYR 86 HH TYR 86 -4.200 8.066 -0.418 618 H THR 87 H THR 87 -2.083 0.218 -3.197 619 HA THR 87 HA THR 87 -3.146 -1.485 -5.140 620 HB THR 87 HB THR 87 -0.730 -1.379 -4.778 621 HG1 THR 87 HG1 THR 87 -1.179 -3.985 -4.233 622 HG21 THR 87 HG21 THR 87 0.251 -2.491 -2.865 623 HG22 THR 87 HG22 THR 87 -1.221 -2.849 -2.301 624 HG23 THR 87 HG23 THR 87 -0.720 -1.312 -2.334 625 H ALA 88 H ALA 88 -4.004 -1.083 -2.034 626 HA ALA 88 HA ALA 88 -5.344 -3.632 -1.995 627 HB1 ALA 88 HB1 ALA 88 -3.462 -3.979 -0.537 628 HB2 ALA 88 HB2 ALA 88 -4.805 -3.944 0.363 629 HB3 ALA 88 HB3 ALA 88 -3.838 -2.649 0.302 630 HA PRO 89 HA PRO 89 -8.454 -0.784 -0.872 631 HB2 PRO 89 HB2 PRO 89 -10.436 -2.296 0.065 632 HB3 PRO 89 HB3 PRO 89 -10.095 -2.358 -1.531 633 HG2 PRO 89 HG2 PRO 89 -9.242 -4.151 0.509 634 HG3 PRO 89 HG3 PRO 89 -9.860 -4.520 -0.957 635 HD2 PRO 89 HD2 PRO 89 -7.267 -4.562 -0.562 636 HD3 PRO 89 HD3 PRO 89 -7.871 -4.135 -2.018 637 H HIS 90 H HIS 90 -8.940 0.581 0.692 638 HA HIS 90 HA HIS 90 -8.640 -0.395 3.389 639 HB2 HIS 90 HB2 HIS 90 -7.408 2.024 2.406 640 HB3 HIS 90 HB3 HIS 90 -7.484 1.643 3.992 641 HD1 HIS 90 HD1 HIS 90 -6.361 -0.864 4.565 642 HD2 HIS 90 HD2 HIS 90 -5.041 1.231 1.304 643 HE1 HIS 90 HE1 HIS 90 -4.174 -1.807 3.856 644 HE2 HIS 90 HE2 HIS 90 -3.363 -0.566 1.888 645 H ASN 91 H ASN 91 -10.208 0.349 4.857 646 HA ASN 91 HA ASN 91 -12.202 2.040 3.741 647 HB2 ASN 91 HB2 ASN 91 -12.724 0.283 5.300 648 HB3 ASN 91 HB3 ASN 91 -12.119 1.243 6.474 649 HD21 ASN 91 HD21 ASN 91 -15.566 2.056 6.809 650 HD22 ASN 91 HD22 ASN 91 -14.367 0.936 7.366 651 H THR 92 H THR 92 -12.741 4.157 4.620 652 HA THR 92 HA THR 92 -10.506 5.567 5.769 653 HB THR 92 HB THR 92 -11.778 6.275 3.241 654 HG1 THR 92 HG1 THR 92 -10.158 4.715 3.050 655 HG21 THR 92 HG21 THR 92 -10.384 8.168 3.131 656 HG22 THR 92 HG22 THR 92 -9.784 7.836 4.596 657 HG23 THR 92 HG23 THR 92 -11.331 8.276 4.437 658 H SER 93 H SER 93 -11.197 7.399 7.040 659 HA SER 93 HA SER 93 -14.062 7.607 7.257 660 HB2 SER 93 HB2 SER 93 -12.948 7.303 9.355 661 HB3 SER 93 HB3 SER 93 -12.040 8.633 9.084 662 HG SER 93 HG SER 93 -13.566 9.881 9.701 663 H GLN 94 H GLN 94 -11.219 9.577 6.795 664 HA GLN 94 HA GLN 94 -12.718 11.491 5.307 665 HB2 GLN 94 HB2 GLN 94 -12.888 12.202 7.656 666 HB3 GLN 94 HB3 GLN 94 -11.270 12.424 7.635 667 HG2 GLN 94 HG2 GLN 94 -11.544 14.136 6.007 668 HG3 GLN 94 HG3 GLN 94 -13.163 13.932 6.083 669 HE21 GLN 94 HE21 GLN 94 -13.689 15.817 8.954 670 HE22 GLN 94 HE22 GLN 94 -14.370 14.643 7.878 671 H TRP 95 H TRP 95 -11.483 12.518 3.728 672 HA TRP 95 HA TRP 95 -8.695 12.683 4.258 673 HB2 TRP 95 HB2 TRP 95 -8.051 11.909 2.072 674 HB3 TRP 95 HB3 TRP 95 -8.659 10.734 3.029 675 HD1 TRP 95 HD1 TRP 95 -11.304 10.065 2.411 676 HE1 TRP 95 HE1 TRP 95 -12.407 9.715 0.193 677 HE3 TRP 95 HE3 TRP 95 -8.031 12.659 -0.332 678 HZ2 TRP 95 HZ2 TRP 95 -11.765 10.392 -2.466 679 HZ3 TRP 95 HZ3 TRP 95 -8.326 12.744 -2.742 680 HH2 TRP 95 HH2 TRP 95 -10.189 11.599 -3.784 681 H HIS 96 H HIS 96 -7.672 14.507 3.556 682 HA HIS 96 HA HIS 96 -9.035 16.235 1.805 683 HB2 HIS 96 HB2 HIS 96 -9.281 18.038 3.435 684 HB3 HIS 96 HB3 HIS 96 -10.286 16.777 3.696 685 HD1 HIS 96 HD1 HIS 96 -10.574 17.530 6.207 686 HD2 HIS 96 HD2 HIS 96 -6.814 16.349 5.107 687 HE1 HIS 96 HE1 HIS 96 -9.233 17.146 8.263 688 HE2 HIS 96 HE2 HIS 96 -6.973 16.421 7.625 689 H TYR 97 H TYR 97 -7.997 18.366 1.413 690 HA TYR 97 HA TYR 97 -5.207 18.156 1.965 691 HB2 TYR 97 HB2 TYR 97 -5.462 19.342 -0.521 692 HB3 TYR 97 HB3 TYR 97 -4.718 17.925 -0.198 693 HD1 TYR 97 HD1 TYR 97 -7.876 19.360 -1.218 694 HD2 TYR 97 HD2 TYR 97 -5.774 15.800 -0.722 695 HE1 TYR 97 HE1 TYR 97 -9.591 18.171 -2.427 696 HE2 TYR 97 HE2 TYR 97 -7.491 14.621 -1.941 697 HH TYR 97 HH TYR 97 -10.402 16.208 -3.105 698 H TYR 98 H TYR 98 -3.964 19.976 2.197 699 HA TYR 98 HA TYR 98 -5.405 22.470 2.255 700 HB2 TYR 98 HB2 TYR 98 -3.230 21.754 4.027 701 HB3 TYR 98 HB3 TYR 98 -4.056 23.161 4.091 702 HD1 TYR 98 HD1 TYR 98 -4.294 19.637 4.818 703 HD2 TYR 98 HD2 TYR 98 -6.119 23.343 5.299 704 HE1 TYR 98 HE1 TYR 98 -5.799 18.692 6.460 705 HE2 TYR 98 HE2 TYR 98 -7.601 22.401 6.946 706 HH TYR 98 HH TYR 98 -8.525 19.817 7.398 707 H ILE 99 H ILE 99 -3.993 24.411 1.846 708 HA ILE 99 HA ILE 99 -1.462 23.721 0.667 709 HB ILE 99 HB ILE 99 -1.742 25.536 -0.955 710 HG12 ILE 99 HG12 ILE 99 -4.520 25.590 -0.244 711 HG13 ILE 99 HG13 ILE 99 -3.454 26.694 0.315 712 HG21 ILE 99 HG21 ILE 99 -3.213 24.290 -2.448 713 HG22 ILE 99 HG22 ILE 99 -3.741 23.412 -1.197 714 HG23 ILE 99 HG23 ILE 99 -2.209 23.269 -1.695 715 HD11 ILE 99 HD11 ILE 99 -4.643 27.587 -1.565 716 HD12 ILE 99 HD12 ILE 99 -4.130 26.363 -2.488 717 HD13 ILE 99 HD13 ILE 99 -3.075 27.456 -1.934 718 H THR 100 H THR 100 0.246 25.306 1.005 719 HA THR 100 HA THR 100 -0.158 26.868 3.317 720 HB THR 100 HB THR 100 2.175 27.583 2.972 721 HG1 THR 100 HG1 THR 100 3.300 26.684 1.256 722 HG21 THR 100 HG21 THR 100 3.161 25.456 3.328 723 HG22 THR 100 HG22 THR 100 1.820 24.724 2.799 724 HG23 THR 100 HG23 THR 100 1.796 25.550 4.189 725 H LYS 101 H LYS 101 -0.225 29.202 3.449 726 HA LYS 101 HA LYS 101 -1.178 30.402 1.031 727 HB2 LYS 101 HB2 LYS 101 -2.346 30.730 3.113 728 HB3 LYS 101 HB3 LYS 101 -1.053 31.554 3.675 729 HG2 LYS 101 HG2 LYS 101 -1.588 33.389 2.576 730 HG3 LYS 101 HG3 LYS 101 -2.197 32.566 1.304 731 HD2 LYS 101 HD2 LYS 101 -3.968 33.659 2.390 732 HD3 LYS 101 HD3 LYS 101 -4.143 32.050 2.606 733 HE2 LYS 101 HE2 LYS 101 -3.132 32.303 4.804 734 HE3 LYS 101 HE3 LYS 101 -3.165 33.921 4.583 735 HZ1 LYS 101 HZ1 LYS 101 -5.054 33.231 5.849 736 HZ2 LYS 101 HZ2 LYS 101 -5.508 32.242 4.653 737 HZ3 LYS 101 HZ3 LYS 101 -5.540 33.844 4.434 738 H LYS 102 H LYS 102 -0.035 31.591 -0.365 739 HA LYS 102 HA LYS 102 2.625 32.181 0.260 740 HB2 LYS 102 HB2 LYS 102 0.997 33.032 -1.960 741 HB3 LYS 102 HB3 LYS 102 2.555 33.502 -1.828 742 HG2 LYS 102 HG2 LYS 102 3.166 31.151 -1.931 743 HG3 LYS 102 HG3 LYS 102 1.612 30.837 -2.324 744 HD2 LYS 102 HD2 LYS 102 1.806 32.180 -4.278 745 HD3 LYS 102 HD3 LYS 102 3.334 32.588 -3.868 746 HE2 LYS 102 HE2 LYS 102 3.967 30.269 -4.150 747 HE3 LYS 102 HE3 LYS 102 2.462 29.966 -4.706 748 HZ1 LYS 102 HZ1 LYS 102 3.951 30.293 -6.518 749 HZ2 LYS 102 HZ2 LYS 102 4.326 31.763 -5.959 750 HZ3 LYS 102 HZ3 LYS 102 2.835 31.463 -6.510 751 H GLY 103 H GLY 103 3.416 33.961 1.429 752 HA2 GLY 103 HA2 GLY 103 3.447 36.182 1.944 753 HA3 GLY 103 HA3 GLY 103 2.163 36.447 0.969 754 H TRP 104 H TRP 104 2.204 34.262 3.695 755 HA TRP 104 HA TRP 104 -0.180 35.105 4.675 756 HB2 TRP 104 HB2 TRP 104 0.414 33.975 6.744 757 HB3 TRP 104 HB3 TRP 104 0.760 33.065 5.433 758 HD1 TRP 104 HD1 TRP 104 2.678 35.327 7.784 759 HE1 TRP 104 HE1 TRP 104 5.060 34.602 8.061 760 HE3 TRP 104 HE3 TRP 104 2.523 31.448 4.629 761 HZ2 TRP 104 HZ2 TRP 104 6.631 32.541 6.990 762 HZ3 TRP 104 HZ3 TRP 104 4.524 30.112 4.328 763 HH2 TRP 104 HH2 TRP 104 6.563 30.674 5.505 764 H ASP 105 H ASP 105 -0.887 36.393 6.472 765 HA ASP 105 HA ASP 105 0.533 38.797 6.630 766 HB2 ASP 105 HB2 ASP 105 -1.780 37.986 8.163 767 HB3 ASP 105 HB3 ASP 105 -1.253 39.527 8.037 768 HA PRO 106 HA PRO 106 2.732 37.687 10.268 769 HB2 PRO 106 HB2 PRO 106 3.818 40.009 11.029 770 HB3 PRO 106 HB3 PRO 106 4.358 39.332 9.644 771 HG2 PRO 106 HG2 PRO 106 2.414 41.381 9.944 772 HG3 PRO 106 HG3 PRO 106 3.694 41.351 8.930 773 HD2 PRO 106 HD2 PRO 106 1.310 40.676 8.064 774 HD3 PRO 106 HD3 PRO 106 2.639 39.948 7.456 775 H ASP 107 H ASP 107 0.301 39.997 10.355 776 HA ASP 107 HA ASP 107 0.129 40.236 13.110 777 HB2 ASP 107 HB2 ASP 107 -0.927 41.788 11.546 778 HB3 ASP 107 HB3 ASP 107 -1.950 40.604 11.077 779 H LYS 108 H LYS 108 -1.015 37.876 10.953 780 HA LYS 108 HA LYS 108 -2.988 36.879 12.781 781 HB2 LYS 108 HB2 LYS 108 -2.311 36.061 10.090 782 HB3 LYS 108 HB3 LYS 108 -3.499 35.349 10.957 783 HG2 LYS 108 HG2 LYS 108 -4.727 37.363 10.991 784 HG3 LYS 108 HG3 LYS 108 -3.514 38.143 10.224 785 HD2 LYS 108 HD2 LYS 108 -3.898 36.750 8.306 786 HD3 LYS 108 HD3 LYS 108 -5.188 36.107 9.074 787 HE2 LYS 108 HE2 LYS 108 -6.366 38.081 8.976 788 HE3 LYS 108 HE3 LYS 108 -5.022 38.955 8.664 789 HZ1 LYS 108 HZ1 LYS 108 -6.352 38.778 6.714 790 HZ2 LYS 108 HZ2 LYS 108 -6.268 37.165 6.787 791 HZ3 LYS 108 HZ3 LYS 108 -4.937 38.030 6.479 792 HA PRO 109 HA PRO 109 -0.206 33.989 14.404 793 HB2 PRO 109 HB2 PRO 109 -1.774 32.015 15.249 794 HB3 PRO 109 HB3 PRO 109 -1.709 33.422 16.077 795 HG2 PRO 109 HG2 PRO 109 -3.675 32.646 14.119 796 HG3 PRO 109 HG3 PRO 109 -3.950 33.288 15.595 797 HD2 PRO 109 HD2 PRO 109 -3.992 34.833 13.544 798 HD3 PRO 109 HD3 PRO 109 -3.316 35.380 14.926 799 H LEU 110 H LEU 110 1.234 32.985 13.309 800 HA LEU 110 HA LEU 110 0.696 32.361 10.740 801 HB2 LEU 110 HB2 LEU 110 2.871 32.809 11.961 802 HB3 LEU 110 HB3 LEU 110 2.939 31.189 12.152 803 HG LEU 110 HG LEU 110 2.965 32.387 9.555 804 HD11 LEU 110 HD11 LEU 110 5.417 32.158 9.687 805 HD12 LEU 110 HD12 LEU 110 5.273 31.629 11.208 806 HD13 LEU 110 HD13 LEU 110 4.905 33.161 10.847 807 HD21 LEU 110 HD21 LEU 110 3.940 30.384 8.784 808 HD22 LEU 110 HD22 LEU 110 2.488 30.101 9.437 809 HD23 LEU 110 HD23 LEU 110 3.830 29.750 10.268 810 H LYS 111 H LYS 111 1.211 29.889 13.205 811 HA LYS 111 HA LYS 111 0.828 27.922 11.290 812 HB2 LYS 111 HB2 LYS 111 0.952 26.319 13.037 813 HB3 LYS 111 HB3 LYS 111 2.072 27.479 13.299 814 HG2 LYS 111 HG2 LYS 111 0.902 28.345 15.067 815 HG3 LYS 111 HG3 LYS 111 -0.452 27.524 14.666 816 HD2 LYS 111 HD2 LYS 111 0.477 26.439 16.523 817 HD3 LYS 111 HD3 LYS 111 0.708 25.461 15.235 818 HE2 LYS 111 HE2 LYS 111 2.976 26.184 15.089 819 HE3 LYS 111 HE3 LYS 111 2.746 27.170 16.371 820 HZ1 LYS 111 HZ1 LYS 111 3.813 25.163 17.065 821 HZ2 LYS 111 HZ2 LYS 111 2.580 24.293 16.483 822 HZ3 LYS 111 HZ3 LYS 111 2.353 25.269 17.752 823 H ARG 112 H ARG 112 -1.500 29.817 12.553 824 HA ARG 112 HA ARG 112 -3.518 27.821 12.213 825 HB2 ARG 112 HB2 ARG 112 -3.632 30.465 13.269 826 HB3 ARG 112 HB3 ARG 112 -5.019 29.809 12.709 827 HG2 ARG 112 HG2 ARG 112 -5.136 29.370 14.920 828 HG3 ARG 112 HG3 ARG 112 -4.551 27.967 14.326 829 HD2 ARG 112 HD2 ARG 112 -2.421 28.442 15.062 830 HD3 ARG 112 HD3 ARG 112 -2.807 29.999 15.371 831 HE ARG 112 HE ARG 112 -3.389 27.736 17.035 832 HH11 ARG 112 HH11 ARG 112 -3.853 31.210 16.590 833 HH12 ARG 112 HH12 ARG 112 -4.315 31.438 18.243 834 HH21 ARG 112 HH21 ARG 112 -3.972 28.133 19.128 835 HH22 ARG 112 HH22 ARG 112 -4.381 29.734 19.648 836 H ALA 113 H ALA 113 -2.471 30.854 10.890 837 HA ALA 113 HA ALA 113 -4.556 30.941 9.046 838 HB1 ALA 113 HB1 ALA 113 -3.618 33.003 10.035 839 HB2 ALA 113 HB2 ALA 113 -3.577 33.119 8.423 840 HB3 ALA 113 HB3 ALA 113 -2.234 32.742 9.241 841 H ASP 114 H ASP 114 -1.512 29.581 8.842 842 HA ASP 114 HA ASP 114 -1.105 30.100 6.149 843 HB2 ASP 114 HB2 ASP 114 0.687 29.488 7.692 844 HB3 ASP 114 HB3 ASP 114 0.075 27.976 7.767 845 H PHE 115 H PHE 115 -2.717 27.472 7.718 846 HA PHE 115 HA PHE 115 -2.569 25.968 5.303 847 HB2 PHE 115 HB2 PHE 115 -3.864 25.106 7.752 848 HB3 PHE 115 HB3 PHE 115 -3.375 24.122 6.544 849 HD1 PHE 115 HD1 PHE 115 -2.695 24.586 9.669 850 HD2 PHE 115 HD2 PHE 115 -0.627 24.840 6.062 851 HE1 PHE 115 HE1 PHE 115 -0.622 24.262 10.851 852 HE2 PHE 115 HE2 PHE 115 1.464 24.517 7.240 853 HZ PHE 115 HZ PHE 115 1.461 24.229 9.639 854 H GLU 116 H GLU 116 -3.895 26.685 3.719 855 HA GLU 116 HA GLU 116 -6.607 27.127 4.475 856 HB2 GLU 116 HB2 GLU 116 -5.206 27.763 2.021 857 HB3 GLU 116 HB3 GLU 116 -6.822 27.966 2.143 858 HG2 GLU 116 HG2 GLU 116 -4.977 29.332 3.852 859 HG3 GLU 116 HG3 GLU 116 -5.507 29.976 2.448 860 H LEU 117 H LEU 117 -8.214 25.684 4.152 861 HA LEU 117 HA LEU 117 -7.583 23.205 3.056 862 HB2 LEU 117 HB2 LEU 117 -9.237 23.505 4.776 863 HB3 LEU 117 HB3 LEU 117 -10.209 24.236 3.685 864 HG LEU 117 HG LEU 117 -10.153 22.053 2.485 865 HD11 LEU 117 HD11 LEU 117 -9.772 20.151 3.869 866 HD12 LEU 117 HD12 LEU 117 -9.319 21.118 5.083 867 HD13 LEU 117 HD13 LEU 117 -8.420 21.028 3.742 868 HD21 LEU 117 HD21 LEU 117 -12.025 21.260 3.755 869 HD22 LEU 117 HD22 LEU 117 -12.139 22.859 3.540 870 HD23 LEU 117 HD23 LEU 117 -11.639 22.268 4.960 871 H ILE 118 H ILE 118 -7.438 22.696 0.895 872 HA ILE 118 HA ILE 118 -8.833 24.430 -0.931 873 HB ILE 118 HB ILE 118 -6.393 23.977 -1.163 874 HG12 ILE 118 HG12 ILE 118 -6.437 23.957 -3.574 875 HG13 ILE 118 HG13 ILE 118 -8.052 23.730 -3.491 876 HG21 ILE 118 HG21 ILE 118 -5.757 21.976 -2.352 877 HG22 ILE 118 HG22 ILE 118 -7.284 21.449 -2.283 878 HG23 ILE 118 HG23 ILE 118 -6.417 21.596 -0.926 879 HD11 ILE 118 HD11 ILE 118 -7.571 26.042 -3.896 880 HD12 ILE 118 HD12 ILE 118 -6.694 26.112 -2.540 881 HD13 ILE 118 HD13 ILE 118 -8.293 25.888 -2.457 882 H GLY 119 H GLY 119 -9.346 21.576 0.551 883 HA2 GLY 119 HA2 GLY 119 -11.720 21.087 -0.578 884 HA3 GLY 119 HA3 GLY 119 -10.692 20.254 -1.537 885 H ALA 120 H ALA 120 -12.758 19.031 -0.120 886 HA ALA 120 HA ALA 120 -11.245 17.230 1.483 887 HB1 ALA 120 HB1 ALA 120 -12.061 18.807 3.132 888 HB2 ALA 120 HB2 ALA 120 -12.817 17.395 3.356 889 HB3 ALA 120 HB3 ALA 120 -13.574 18.605 2.597 890 H VAL 121 H VAL 121 -12.076 15.142 1.556 891 HA VAL 121 HA VAL 121 -14.628 14.754 0.291 892 HB VAL 121 HB VAL 121 -12.348 13.048 -0.268 893 HG11 VAL 121 HG11 VAL 121 -13.760 11.890 -1.825 894 HG12 VAL 121 HG12 VAL 121 -15.012 12.809 -1.374 895 HG13 VAL 121 HG13 VAL 121 -14.355 11.768 -0.326 896 HG21 VAL 121 HG21 VAL 121 -12.442 13.918 -2.536 897 HG22 VAL 121 HG22 VAL 121 -12.164 15.126 -1.497 898 HG23 VAL 121 HG23 VAL 121 -13.646 14.909 -2.107 899 HA PRO 122 HA PRO 122 -14.652 12.381 4.051 900 HB2 PRO 122 HB2 PRO 122 -17.203 12.187 4.573 901 HB3 PRO 122 HB3 PRO 122 -16.503 13.651 4.757 902 HG2 PRO 122 HG2 PRO 122 -18.034 12.719 2.502 903 HG3 PRO 122 HG3 PRO 122 -18.167 14.159 3.260 904 HD2 PRO 122 HD2 PRO 122 -16.773 13.887 1.043 905 HD3 PRO 122 HD3 PRO 122 -16.408 15.033 2.148 906 H HIS 123 H HIS 123 -15.386 10.203 4.787 907 HA HIS 123 HA HIS 123 -16.447 8.668 2.631 908 HB2 HIS 123 HB2 HIS 123 -14.038 8.519 2.408 909 HB3 HIS 123 HB3 HIS 123 -13.975 7.843 3.893 910 HD1 HIS 123 HD1 HIS 123 -14.836 5.355 4.192 911 HD2 HIS 123 HD2 HIS 123 -14.672 6.784 0.356 912 HE1 HIS 123 HE1 HIS 123 -15.039 3.435 2.623 913 HE2 HIS 123 HE2 HIS 123 -15.013 4.281 0.306 914 H ASP 124 H ASP 124 -18.104 7.550 3.293 915 HA ASP 124 HA ASP 124 -18.342 6.907 6.070 916 HB2 ASP 124 HB2 ASP 124 -20.621 6.317 5.446 917 HB3 ASP 124 HB3 ASP 124 -20.257 7.815 4.907 918 H GLY 125 H GLY 125 -18.088 5.376 3.007 919 HA2 GLY 125 HA2 GLY 125 -16.959 3.039 3.579 920 HA3 GLY 125 HA3 GLY 125 -18.505 2.741 4.012 921 H SER 126 H SER 126 -19.545 4.654 2.057 922 HA SER 126 HA SER 126 -20.041 3.084 -0.069 923 HB2 SER 126 HB2 SER 126 -21.225 5.167 0.326 924 HB3 SER 126 HB3 SER 126 -19.892 6.012 -0.095 925 HG SER 126 HG SER 126 -20.096 5.208 -2.186 926 HA PRO 127 HA PRO 127 -16.429 2.983 -2.454 927 HB2 PRO 127 HB2 PRO 127 -17.291 1.852 -4.714 928 HB3 PRO 127 HB3 PRO 127 -17.375 0.970 -3.341 929 HG2 PRO 127 HG2 PRO 127 -19.420 2.531 -4.536 930 HG3 PRO 127 HG3 PRO 127 -19.504 0.976 -4.045 931 HD2 PRO 127 HD2 PRO 127 -20.385 2.872 -2.498 932 HD3 PRO 127 HD3 PRO 127 -19.666 1.558 -1.846 933 H ALA 128 H ALA 128 -18.071 5.485 -2.611 934 HA ALA 128 HA ALA 128 -17.738 6.539 -5.140 935 HB1 ALA 128 HB1 ALA 128 -19.029 7.659 -3.439 936 HB2 ALA 128 HB2 ALA 128 -17.951 8.692 -4.061 937 HB3 ALA 128 HB3 ALA 128 -17.675 8.001 -2.625 938 H SER 129 H SER 129 -15.478 5.967 -2.682 939 HA SER 129 HA SER 129 -13.461 7.596 -3.665 940 HB2 SER 129 HB2 SER 129 -12.038 6.258 -2.131 941 HB3 SER 129 HB3 SER 129 -13.363 6.873 -1.401 942 HG SER 129 HG SER 129 -14.406 4.910 -1.688 943 H ARG 130 H ARG 130 -14.681 4.978 -5.177 944 HA ARG 130 HA ARG 130 -12.422 3.676 -6.094 945 HB2 ARG 130 HB2 ARG 130 -14.664 2.902 -6.519 946 HB3 ARG 130 HB3 ARG 130 -14.842 4.099 -7.616 947 HG2 ARG 130 HG2 ARG 130 -12.987 3.050 -8.850 948 HG3 ARG 130 HG3 ARG 130 -13.186 1.763 -7.866 949 HD2 ARG 130 HD2 ARG 130 -15.431 1.523 -8.650 950 HD3 ARG 130 HD3 ARG 130 -15.207 2.791 -9.655 951 HE ARG 130 HE ARG 130 -13.286 0.809 -10.138 952 HH11 ARG 130 HH11 ARG 130 -16.638 1.626 -10.862 953 HH12 ARG 130 HH12 ARG 130 -16.654 0.646 -12.290 954 HH21 ARG 130 HH21 ARG 130 -13.380 -0.396 -11.968 955 HH22 ARG 130 HH22 ARG 130 -14.834 -0.482 -12.905 956 H ASN 131 H ASN 131 -13.998 6.596 -7.101 957 HA ASN 131 HA ASN 131 -11.995 7.099 -9.118 958 HB2 ASN 131 HB2 ASN 131 -14.345 8.613 -8.445 959 HB3 ASN 131 HB3 ASN 131 -13.305 9.034 -9.632 960 HD21 ASN 131 HD21 ASN 131 -16.320 6.993 -10.716 961 HD22 ASN 131 HD22 ASN 131 -16.198 8.185 -9.466 962 H LEU 132 H LEU 132 -10.202 7.179 -7.676 963 HA LEU 132 HA LEU 132 -10.249 8.916 -5.458 964 HB2 LEU 132 HB2 LEU 132 -8.887 6.796 -6.034 965 HB3 LEU 132 HB3 LEU 132 -7.792 7.913 -6.504 966 HG LEU 132 HG LEU 132 -7.258 6.970 -4.441 967 HD11 LEU 132 HD11 LEU 132 -6.789 8.953 -3.192 968 HD12 LEU 132 HD12 LEU 132 -7.777 9.791 -4.160 969 HD13 LEU 132 HD13 LEU 132 -6.417 9.148 -4.754 970 HD21 LEU 132 HD21 LEU 132 -8.587 7.443 -2.481 971 HD22 LEU 132 HD22 LEU 132 -9.426 6.561 -3.545 972 HD23 LEU 132 HD23 LEU 132 -9.699 8.150 -3.419 973 H SER 133 H SER 133 -9.557 9.386 -8.707 974 HA SER 133 HA SER 133 -7.564 11.309 -8.375 975 HB2 SER 133 HB2 SER 133 -7.830 10.120 -10.470 976 HB3 SER 133 HB3 SER 133 -9.235 10.913 -10.727 977 HG SER 133 HG SER 133 -6.723 11.742 -11.065 978 H HIS 134 H HIS 134 -7.619 13.556 -8.278 979 HA HIS 134 HA HIS 134 -10.246 14.729 -8.410 980 HB2 HIS 134 HB2 HIS 134 -9.341 14.281 -6.045 981 HB3 HIS 134 HB3 HIS 134 -8.523 15.669 -6.310 982 HD1 HIS 134 HD1 HIS 134 -9.851 17.938 -6.396 983 HD2 HIS 134 HD2 HIS 134 -12.055 14.578 -5.588 984 HE1 HIS 134 HE1 HIS 134 -12.107 18.645 -5.610 985 HE2 HIS 134 HE2 HIS 134 -13.445 16.638 -5.083 986 H HIS 135 H HIS 135 -10.401 16.783 -9.230 987 HA HIS 135 HA HIS 135 -7.976 17.868 -10.349 988 HB2 HIS 135 HB2 HIS 135 -10.734 18.562 -10.842 989 HB3 HIS 135 HB3 HIS 135 -9.479 19.312 -11.570 990 HD1 HIS 135 HD1 HIS 135 -8.831 18.482 -13.840 991 HD2 HIS 135 HD2 HIS 135 -10.789 15.671 -11.588 992 HE1 HIS 135 HE1 HIS 135 -9.184 16.462 -15.239 993 HE2 HIS 135 HE2 HIS 135 -10.344 14.739 -13.903 994 H ILE 136 H ILE 136 -7.077 19.820 -9.647 995 HA ILE 136 HA ILE 136 -8.540 21.265 -7.601 996 HB ILE 136 HB ILE 136 -5.701 20.635 -7.400 997 HG12 ILE 136 HG12 ILE 136 -7.122 18.826 -6.761 998 HG13 ILE 136 HG13 ILE 136 -6.135 19.330 -5.561 999 HG21 ILE 136 HG21 ILE 136 -5.680 21.863 -5.316 1000 HG22 ILE 136 HG22 ILE 136 -7.222 22.291 -5.549 1001 HG23 ILE 136 HG23 ILE 136 -6.070 22.848 -6.537 1002 HD11 ILE 136 HD11 ILE 136 -8.335 18.859 -4.665 1003 HD12 ILE 136 HD12 ILE 136 -8.992 19.936 -5.677 1004 HD13 ILE 136 HD13 ILE 136 -8.015 20.435 -4.489 1005 H TYR 137 H TYR 137 -8.686 23.468 -8.106 1006 HA TYR 137 HA TYR 137 -7.198 24.357 -10.324 1007 HB2 TYR 137 HB2 TYR 137 -9.425 25.191 -9.868 1008 HB3 TYR 137 HB3 TYR 137 -8.794 26.054 -8.633 1009 HD1 TYR 137 HD1 TYR 137 -7.318 28.016 -9.085 1010 HD2 TYR 137 HD2 TYR 137 -9.096 25.896 -12.202 1011 HE1 TYR 137 HE1 TYR 137 -6.709 29.754 -10.612 1012 HE2 TYR 137 HE2 TYR 137 -8.474 27.663 -13.742 1013 HH TYR 137 HH TYR 137 -7.090 29.524 -14.041 1014 H ILE 138 H ILE 138 -5.278 25.505 -10.351 1015 HA ILE 138 HA ILE 138 -4.222 26.229 -7.773 1016 HB ILE 138 HB ILE 138 -2.731 25.452 -10.159 1017 HG12 ILE 138 HG12 ILE 138 -3.710 23.578 -9.080 1018 HG13 ILE 138 HG13 ILE 138 -2.080 23.515 -8.987 1019 HG21 ILE 138 HG21 ILE 138 -0.743 25.636 -8.864 1020 HG22 ILE 138 HG22 ILE 138 -1.602 26.201 -7.616 1021 HG23 ILE 138 HG23 ILE 138 -1.480 27.072 -8.973 1022 HD11 ILE 138 HD11 ILE 138 -3.046 22.827 -6.892 1023 HD12 ILE 138 HD12 ILE 138 -3.809 24.247 -6.760 1024 HD13 ILE 138 HD13 ILE 138 -2.196 24.184 -6.667 1025 HA PRO 139 HA PRO 139 -4.457 30.250 -9.479 1026 HB2 PRO 139 HB2 PRO 139 -3.598 31.752 -7.474 1027 HB3 PRO 139 HB3 PRO 139 -5.044 31.011 -7.308 1028 HG2 PRO 139 HG2 PRO 139 -2.507 30.121 -6.343 1029 HG3 PRO 139 HG3 PRO 139 -3.908 30.224 -5.511 1030 HD2 PRO 139 HD2 PRO 139 -3.152 27.947 -6.525 1031 HD3 PRO 139 HD3 PRO 139 -4.739 28.323 -6.448 1032 H GLU 140 H GLU 140 -3.098 32.154 -9.979 1033 HA GLU 140 HA GLU 140 -0.294 31.401 -10.269 1034 HB2 GLU 140 HB2 GLU 140 -1.724 31.087 -12.290 1035 HB3 GLU 140 HB3 GLU 140 -1.678 32.716 -12.394 1036 HG2 GLU 140 HG2 GLU 140 0.595 32.703 -12.756 1037 HG3 GLU 140 HG3 GLU 140 0.698 31.114 -12.394 1038 H ASP 141 H ASP 141 -0.919 32.761 -8.155 1039 HA ASP 141 HA ASP 141 -1.324 35.472 -8.680 1040 HB2 ASP 141 HB2 ASP 141 -1.413 35.703 -6.244 1041 HB3 ASP 141 HB3 ASP 141 -2.233 34.355 -6.663 1042 H ARG 142 H ARG 142 1.395 33.638 -7.885 1043 HA ARG 142 HA ARG 142 3.139 35.882 -8.095 1044 HB2 ARG 142 HB2 ARG 142 2.980 34.279 -5.688 1045 HB3 ARG 142 HB3 ARG 142 4.325 35.138 -6.036 1046 HG2 ARG 142 HG2 ARG 142 3.150 37.149 -5.746 1047 HG3 ARG 142 HG3 ARG 142 1.761 36.328 -5.494 1048 HD2 ARG 142 HD2 ARG 142 2.691 35.322 -3.572 1049 HD3 ARG 142 HD3 ARG 142 4.100 36.105 -3.833 1050 HE ARG 142 HE ARG 142 3.252 38.064 -2.995 1051 HH11 ARG 142 HH11 ARG 142 0.726 35.626 -3.146 1052 HH12 ARG 142 HH12 ARG 142 -0.295 36.506 -2.059 1053 HH21 ARG 142 HH21 ARG 142 1.933 39.077 -1.575 1054 HH22 ARG 142 HH22 ARG 142 0.376 38.427 -1.184 1055 H LEU 143 H LEU 143 5.428 35.156 -8.310 1056 HA LEU 143 HA LEU 143 5.702 32.422 -9.143 1057 HB2 LEU 143 HB2 LEU 143 7.651 34.520 -9.070 1058 HB3 LEU 143 HB3 LEU 143 7.962 33.009 -9.606 1059 HG LEU 143 HG LEU 143 6.141 33.611 -11.273 1060 HD11 LEU 143 HD11 LEU 143 6.303 35.918 -11.967 1061 HD12 LEU 143 HD12 LEU 143 7.275 36.229 -10.713 1062 HD13 LEU 143 HD13 LEU 143 5.729 35.832 -10.458 1063 HD21 LEU 143 HD21 LEU 143 7.913 34.194 -12.815 1064 HD22 LEU 143 HD22 LEU 143 8.367 32.950 -11.888 1065 HD23 LEU 143 HD23 LEU 143 8.912 34.438 -11.567 1066 H GLY 144 H GLY 144 6.820 30.851 -7.786 1067 HA2 GLY 144 HA2 GLY 144 8.525 30.998 -5.909 1068 HA3 GLY 144 HA3 GLY 144 7.331 31.779 -5.112 1069 H TYR 145 H TYR 145 8.459 29.659 -3.947 1070 HA TYR 145 HA TYR 145 7.012 27.343 -4.596 1071 HB2 TYR 145 HB2 TYR 145 8.279 26.469 -2.549 1072 HB3 TYR 145 HB3 TYR 145 9.163 26.842 -3.871 1073 HD1 TYR 145 HD1 TYR 145 11.033 28.288 -3.637 1074 HD2 TYR 145 HD2 TYR 145 8.036 28.388 -0.751 1075 HE1 TYR 145 HE1 TYR 145 12.357 29.811 -2.304 1076 HE2 TYR 145 HE2 TYR 145 9.361 29.901 0.577 1077 HH TYR 145 HH TYR 145 12.585 30.431 0.179 1078 H HIS 146 H HIS 146 5.589 26.088 -3.394 1079 HA HIS 146 HA HIS 146 4.694 27.075 -0.856 1080 HB2 HIS 146 HB2 HIS 146 2.754 27.888 -1.365 1081 HB3 HIS 146 HB3 HIS 146 3.270 27.927 -2.913 1082 HD1 HIS 146 HD1 HIS 146 2.865 25.431 -4.211 1083 HD2 HIS 146 HD2 HIS 146 0.383 26.658 -1.203 1084 HE1 HIS 146 HE1 HIS 146 0.780 24.087 -4.314 1085 HE2 HIS 146 HE2 HIS 146 -0.733 24.817 -2.512 1086 H VAL 147 H VAL 147 3.350 25.360 0.268 1087 HA VAL 147 HA VAL 147 4.108 22.823 -0.821 1088 HB VAL 147 HB VAL 147 3.321 23.142 1.976 1089 HG11 VAL 147 HG11 VAL 147 4.805 21.300 2.366 1090 HG12 VAL 147 HG12 VAL 147 5.221 21.294 0.804 1091 HG13 VAL 147 HG13 VAL 147 3.717 20.894 1.241 1092 HG21 VAL 147 HG21 VAL 147 5.554 23.694 2.606 1093 HG22 VAL 147 HG22 VAL 147 4.955 24.842 1.638 1094 HG23 VAL 147 HG23 VAL 147 5.989 23.747 1.049 1095 H ILE 148 H ILE 148 2.730 21.032 -0.895 1096 HA ILE 148 HA ILE 148 -0.077 21.632 -0.501 1097 HB ILE 148 HB ILE 148 1.028 19.539 -2.159 1098 HG12 ILE 148 HG12 ILE 148 -0.379 21.898 -3.031 1099 HG13 ILE 148 HG13 ILE 148 1.249 21.771 -3.061 1100 HG21 ILE 148 HG21 ILE 148 -1.273 19.106 -2.826 1101 HG22 ILE 148 HG22 ILE 148 -1.789 20.230 -1.785 1102 HG23 ILE 148 HG23 ILE 148 -1.114 18.867 -1.234 1103 HD11 ILE 148 HD11 ILE 148 0.359 21.383 -5.270 1104 HD12 ILE 148 HD12 ILE 148 -0.538 20.160 -4.708 1105 HD13 ILE 148 HD13 ILE 148 1.074 20.034 -4.738 1106 H LEU 149 H LEU 149 -1.053 20.585 1.225 1107 HA LEU 149 HA LEU 149 0.444 18.470 2.522 1108 HB2 LEU 149 HB2 LEU 149 -1.318 20.424 3.759 1109 HB3 LEU 149 HB3 LEU 149 -0.525 19.262 4.588 1110 HG LEU 149 HG LEU 149 1.226 20.950 3.233 1111 HD11 LEU 149 HD11 LEU 149 0.859 22.886 4.633 1112 HD12 LEU 149 HD12 LEU 149 -0.434 22.168 5.287 1113 HD13 LEU 149 HD13 LEU 149 -0.452 22.604 3.730 1114 HD21 LEU 149 HD21 LEU 149 2.365 20.992 5.331 1115 HD22 LEU 149 HD22 LEU 149 2.012 19.469 4.917 1116 HD23 LEU 149 HD23 LEU 149 1.121 20.232 6.029 1117 H ALA 150 H ALA 150 -0.678 16.552 3.047 1118 HA ALA 150 HA ALA 150 -3.518 16.623 2.685 1119 HB1 ALA 150 HB1 ALA 150 -2.653 15.768 0.602 1120 HB2 ALA 150 HB2 ALA 150 -3.470 14.593 1.354 1121 HB3 ALA 150 HB3 ALA 150 -1.854 14.608 1.397 1122 H VAL 151 H VAL 151 -4.742 15.228 3.951 1123 HA VAL 151 HA VAL 151 -3.231 13.602 5.790 1124 HB VAL 151 HB VAL 151 -5.561 15.115 6.620 1125 HG11 VAL 151 HG11 VAL 151 -4.931 14.520 8.889 1126 HG12 VAL 151 HG12 VAL 151 -3.690 13.656 8.316 1127 HG13 VAL 151 HG13 VAL 151 -5.209 13.187 8.017 1128 HG21 VAL 151 HG21 VAL 151 -4.087 16.650 7.774 1129 HG22 VAL 151 HG22 VAL 151 -3.818 16.700 6.180 1130 HG23 VAL 151 HG23 VAL 151 -2.807 15.888 7.146 1131 H TRP 152 H TRP 152 -4.022 11.538 6.156 1132 HA TRP 152 HA TRP 152 -6.564 10.927 4.971 1133 HB2 TRP 152 HB2 TRP 152 -4.437 10.209 3.730 1134 HB3 TRP 152 HB3 TRP 152 -4.435 8.989 4.815 1135 HD1 TRP 152 HD1 TRP 152 -6.735 7.436 4.768 1136 HE1 TRP 152 HE1 TRP 152 -8.148 6.648 2.850 1137 HE3 TRP 152 HE3 TRP 152 -5.131 10.770 1.416 1138 HZ2 TRP 152 HZ2 TRP 152 -8.539 7.531 0.188 1139 HZ3 TRP 152 HZ3 TRP 152 -6.044 10.727 -0.819 1140 HH2 TRP 152 HH2 TRP 152 -7.771 9.135 -1.398 1141 H ASP 153 H ASP 153 -7.955 10.343 6.560 1142 HA ASP 153 HA ASP 153 -6.916 8.889 8.772 1143 HB2 ASP 153 HB2 ASP 153 -9.501 10.010 8.257 1144 HB3 ASP 153 HB3 ASP 153 -9.348 8.906 9.451 1145 H VAL 154 H VAL 154 -6.234 6.955 7.773 1146 HA VAL 154 HA VAL 154 -8.018 5.273 6.380 1147 HB VAL 154 HB VAL 154 -5.497 4.627 7.651 1148 HG11 VAL 154 HG11 VAL 154 -5.542 2.565 6.424 1149 HG12 VAL 154 HG12 VAL 154 -7.017 2.924 5.867 1150 HG13 VAL 154 HG13 VAL 154 -6.797 2.631 7.442 1151 HG21 VAL 154 HG21 VAL 154 -4.587 4.658 5.423 1152 HG22 VAL 154 HG22 VAL 154 -5.219 6.104 5.779 1153 HG23 VAL 154 HG23 VAL 154 -6.033 5.075 4.833 1154 H ALA 155 H ALA 155 -9.633 3.958 7.268 1155 HA ALA 155 HA ALA 155 -10.055 4.223 10.031 1156 HB1 ALA 155 HB1 ALA 155 -11.935 4.159 8.515 1157 HB2 ALA 155 HB2 ALA 155 -12.099 2.978 9.608 1158 HB3 ALA 155 HB3 ALA 155 -11.576 2.634 8.117 1159 H ASP 156 H ASP 156 -8.526 1.983 8.073 1160 HA ASP 156 HA ASP 156 -8.914 -0.278 9.573 1161 HB2 ASP 156 HB2 ASP 156 -6.666 0.223 7.760 1162 HB3 ASP 156 HB3 ASP 156 -7.142 -1.273 8.212 1163 H THR 157 H THR 157 -7.062 2.319 10.269 1164 HA THR 157 HA THR 157 -5.225 0.809 11.871 1165 HB THR 157 HB THR 157 -3.544 2.630 11.337 1166 HG1 THR 157 HG1 THR 157 -4.824 3.296 9.082 1167 HG21 THR 157 HG21 THR 157 -2.977 1.772 9.153 1168 HG22 THR 157 HG22 THR 157 -4.447 1.113 9.014 1169 HG23 THR 157 HG23 THR 157 -3.398 0.528 10.096 1170 H GLU 158 H GLU 158 -4.264 1.962 13.753 1171 HA GLU 158 HA GLU 158 -6.149 3.802 14.912 1172 HB2 GLU 158 HB2 GLU 158 -4.948 1.961 16.122 1173 HB3 GLU 158 HB3 GLU 158 -3.712 3.026 16.206 1174 HG2 GLU 158 HG2 GLU 158 -5.043 4.513 17.445 1175 HG3 GLU 158 HG3 GLU 158 -6.325 3.512 17.306 1176 H ASN 159 H ASN 159 -3.944 4.071 12.721 1177 HA ASN 159 HA ASN 159 -2.696 6.470 13.696 1178 HB2 ASN 159 HB2 ASN 159 -1.819 4.757 11.499 1179 HB3 ASN 159 HB3 ASN 159 -0.972 6.041 12.047 1180 HD21 ASN 159 HD21 ASN 159 0.863 4.232 14.283 1181 HD22 ASN 159 HD22 ASN 159 0.724 5.621 13.258 1182 H ALA 160 H ALA 160 -2.443 8.297 12.257 1183 HA ALA 160 HA ALA 160 -4.306 8.318 10.019 1184 HB1 ALA 160 HB1 ALA 160 -5.078 9.845 11.642 1185 HB2 ALA 160 HB2 ALA 160 -4.518 10.685 10.378 1186 HB3 ALA 160 HB3 ALA 160 -3.625 10.551 11.720 1187 H PHE 161 H PHE 161 -3.420 9.078 8.051 1188 HA PHE 161 HA PHE 161 -0.554 9.097 8.107 1189 HB2 PHE 161 HB2 PHE 161 -2.367 8.306 5.990 1190 HB3 PHE 161 HB3 PHE 161 -0.752 8.383 5.759 1191 HD1 PHE 161 HD1 PHE 161 -3.369 6.496 7.301 1192 HD2 PHE 161 HD2 PHE 161 0.735 6.721 6.669 1193 HE1 PHE 161 HE1 PHE 161 -3.115 4.246 8.152 1194 HE2 PHE 161 HE2 PHE 161 0.989 4.486 7.488 1195 HZ PHE 161 HZ PHE 161 -0.932 3.237 8.228 1196 H TYR 162 H TYR 162 0.712 10.532 6.994 1197 HA TYR 162 HA TYR 162 -0.677 12.842 5.990 1198 HB2 TYR 162 HB2 TYR 162 1.702 12.802 7.664 1199 HB3 TYR 162 HB3 TYR 162 1.202 14.164 6.913 1200 HD1 TYR 162 HD1 TYR 162 0.264 11.799 9.504 1201 HD2 TYR 162 HD2 TYR 162 -0.546 15.524 7.841 1202 HE1 TYR 162 HE1 TYR 162 -1.259 12.289 11.328 1203 HE2 TYR 162 HE2 TYR 162 -2.055 16.013 9.673 1204 HH TYR 162 HH TYR 162 -3.543 14.546 11.290 1205 H GLN 163 H GLN 163 0.132 13.880 4.197 1206 HA GLN 163 HA GLN 163 2.520 12.803 2.977 1207 HB2 GLN 163 HB2 GLN 163 0.040 13.106 1.559 1208 HB3 GLN 163 HB3 GLN 163 1.470 12.804 0.830 1209 HG2 GLN 163 HG2 GLN 163 1.585 10.714 1.932 1210 HG3 GLN 163 HG3 GLN 163 0.147 11.015 2.645 1211 HE21 GLN 163 HE21 GLN 163 -0.744 8.796 -0.002 1212 HE22 GLN 163 HE22 GLN 163 -0.011 8.762 1.567 1213 H VAL 164 H VAL 164 3.852 14.476 2.301 1214 HA VAL 164 HA VAL 164 2.686 17.073 1.896 1215 HB VAL 164 HB VAL 164 3.266 17.145 4.201 1216 HG11 VAL 164 HG11 VAL 164 5.460 16.645 5.030 1217 HG12 VAL 164 HG12 VAL 164 5.928 16.206 3.545 1218 HG13 VAL 164 HG13 VAL 164 4.815 15.336 4.333 1219 HG21 VAL 164 HG21 VAL 164 4.819 18.937 4.284 1220 HG22 VAL 164 HG22 VAL 164 3.740 19.168 3.102 1221 HG23 VAL 164 HG23 VAL 164 5.231 18.654 2.746 1222 H ILE 165 H ILE 165 3.496 18.161 0.168 1223 HA ILE 165 HA ILE 165 6.055 17.313 -0.758 1224 HB ILE 165 HB ILE 165 3.748 17.384 -2.577 1225 HG12 ILE 165 HG12 ILE 165 5.313 15.035 -1.925 1226 HG13 ILE 165 HG13 ILE 165 3.871 15.366 -1.233 1227 HG21 ILE 165 HG21 ILE 165 5.251 16.680 -4.366 1228 HG22 ILE 165 HG22 ILE 165 6.504 16.763 -3.346 1229 HG23 ILE 165 HG23 ILE 165 5.726 18.112 -3.783 1230 HD11 ILE 165 HD11 ILE 165 3.598 13.726 -2.947 1231 HD12 ILE 165 HD12 ILE 165 4.222 14.741 -4.040 1232 HD13 ILE 165 HD13 ILE 165 2.794 15.068 -3.355 1233 H ASP 166 H ASP 166 7.381 18.986 -1.401 1234 HA ASP 166 HA ASP 166 6.316 21.556 -1.568 1235 HB2 ASP 166 HB2 ASP 166 8.956 20.491 -2.033 1236 HB3 ASP 166 HB3 ASP 166 8.670 22.036 -2.479 1237 H VAL 167 H VAL 167 5.770 22.834 -3.318 1238 HA VAL 167 HA VAL 167 6.695 21.938 -5.845 1239 HB VAL 167 HB VAL 167 4.570 22.504 -6.954 1240 HG11 VAL 167 HG11 VAL 167 3.377 20.518 -6.317 1241 HG12 VAL 167 HG12 VAL 167 4.305 20.377 -5.000 1242 HG13 VAL 167 HG13 VAL 167 4.953 20.191 -6.470 1243 HG21 VAL 167 HG21 VAL 167 2.596 22.778 -5.627 1244 HG22 VAL 167 HG22 VAL 167 3.647 23.967 -5.313 1245 HG23 VAL 167 HG23 VAL 167 3.489 22.733 -4.280 1246 H ASP 168 H ASP 168 6.674 23.661 -7.550 1247 HA ASP 168 HA ASP 168 6.963 26.321 -6.383 1248 HB2 ASP 168 HB2 ASP 168 8.980 25.265 -7.264 1249 HB3 ASP 168 HB3 ASP 168 8.286 25.347 -8.740 1250 H LEU 169 H LEU 169 5.648 27.897 -7.204 1251 HA LEU 169 HA LEU 169 4.075 27.128 -9.515 1252 HB2 LEU 169 HB2 LEU 169 3.179 28.759 -7.331 1253 HB3 LEU 169 HB3 LEU 169 2.282 28.384 -8.644 1254 HG LEU 169 HG LEU 169 3.103 26.497 -6.629 1255 HD11 LEU 169 HD11 LEU 169 0.751 26.468 -6.019 1256 HD12 LEU 169 HD12 LEU 169 0.450 27.596 -7.138 1257 HD13 LEU 169 HD13 LEU 169 1.347 27.960 -5.843 1258 HD21 LEU 169 HD21 LEU 169 1.721 24.889 -7.749 1259 HD22 LEU 169 HD22 LEU 169 2.912 25.381 -8.728 1260 HD23 LEU 169 HD23 LEU 169 1.415 25.961 -8.921 1261 H VAL 170 H VAL 170 4.435 28.420 -11.284 1262 HA VAL 170 HA VAL 170 5.320 31.088 -10.716 1263 HB VAL 170 HB VAL 170 6.929 30.954 -12.575 1264 HG11 VAL 170 HG11 VAL 170 8.591 29.622 -11.440 1265 HG12 VAL 170 HG12 VAL 170 7.438 28.974 -10.509 1266 HG13 VAL 170 HG13 VAL 170 7.800 30.544 -10.373 1267 HG21 VAL 170 HG21 VAL 170 7.483 28.810 -13.516 1268 HG22 VAL 170 HG22 VAL 170 5.940 29.172 -13.833 1269 HG23 VAL 170 HG23 VAL 170 6.299 28.122 -12.656 1270 H ASN 171 H ASN 171 5.184 32.607 -12.657 1271 HA ASN 171 HA ASN 171 2.663 32.272 -13.835 1272 HB2 ASN 171 HB2 ASN 171 4.677 34.314 -14.181 1273 HB3 ASN 171 HB3 ASN 171 3.275 34.361 -15.016 1274 HD21 ASN 171 HD21 ASN 171 1.503 35.965 -12.562 1275 HD22 ASN 171 HD22 ASN 171 1.682 35.565 -14.237 1276 H LYS 172 H LYS 172 2.208 32.227 -16.167 1277 HA LYS 172 HA LYS 172 3.912 30.492 -17.544 1278 HB2 LYS 172 HB2 LYS 172 1.672 32.035 -18.546 1279 HB3 LYS 172 HB3 LYS 172 2.382 30.834 -19.394 1280 HG2 LYS 172 HG2 LYS 172 1.569 29.235 -17.980 1281 HG3 LYS 172 HG3 LYS 172 1.125 30.350 -16.872 1282 HD2 LYS 172 HD2 LYS 172 -0.448 31.208 -18.471 1283 HD3 LYS 172 HD3 LYS 172 -0.081 29.944 -19.438 1284 HE2 LYS 172 HE2 LYS 172 -0.900 28.435 -17.825 1285 HE3 LYS 172 HE3 LYS 172 -1.190 29.665 -16.791 1286 HZ1 LYS 172 HZ1 LYS 172 -3.204 29.013 -17.869 1287 HZ2 LYS 172 HZ2 LYS 172 -2.538 29.309 -19.313 1288 HZ3 LYS 172 HZ3 LYS 172 -2.825 30.528 -18.289 Start of MODEL 14 1 H1 HIS 1 H1 HIS 1 -1.400 7.178 3.633 2 H2 HIS 1 H2 HIS 1 -1.573 5.690 3.023 3 H3 HIS 1 H3 HIS 1 -2.282 6.949 2.296 4 HA HIS 1 HA HIS 1 -0.211 7.821 1.700 5 HB2 HIS 1 HB2 HIS 1 1.817 6.630 2.180 6 HB3 HIS 1 HB3 HIS 1 1.071 7.082 3.561 7 HD1 HIS 1 HD1 HIS 1 1.806 5.335 5.241 8 HD2 HIS 1 HD2 HIS 1 0.402 3.762 1.724 9 HE1 HIS 1 HE1 HIS 1 1.749 2.858 5.446 10 HE2 HIS 1 HE2 HIS 1 0.900 1.891 3.345 11 H GLY 2 H GLY 2 0.863 7.278 -0.323 12 HA2 GLY 2 HA2 GLY 2 0.485 4.829 -1.544 13 HA3 GLY 2 HA3 GLY 2 -0.784 5.772 -1.952 14 H PHE 3 H PHE 3 0.544 5.171 -4.114 15 HA PHE 3 HA PHE 3 2.721 6.895 -4.530 16 HB2 PHE 3 HB2 PHE 3 1.215 5.380 -6.497 17 HB3 PHE 3 HB3 PHE 3 2.647 6.100 -6.810 18 HD1 PHE 3 HD1 PHE 3 4.749 5.166 -5.906 19 HD2 PHE 3 HD2 PHE 3 1.097 3.232 -5.415 20 HE1 PHE 3 HE1 PHE 3 5.910 3.131 -5.340 21 HE2 PHE 3 HE2 PHE 3 2.244 1.192 -4.829 22 HZ PHE 3 HZ PHE 3 4.660 1.136 -4.807 23 H ILE 4 H ILE 4 2.707 8.992 -5.401 24 HA ILE 4 HA ILE 4 0.171 10.011 -6.299 25 HB ILE 4 HB ILE 4 2.623 11.501 -5.976 26 HG12 ILE 4 HG12 ILE 4 0.290 11.483 -4.275 27 HG13 ILE 4 HG13 ILE 4 1.679 10.704 -3.913 28 HG21 ILE 4 HG21 ILE 4 1.254 13.470 -6.338 29 HG22 ILE 4 HG22 ILE 4 -0.036 12.534 -6.611 30 HG23 ILE 4 HG23 ILE 4 1.202 12.529 -7.652 31 HD11 ILE 4 HD11 ILE 4 1.541 12.732 -2.703 32 HD12 ILE 4 HD12 ILE 4 1.418 13.567 -4.082 33 HD13 ILE 4 HD13 ILE 4 2.793 12.796 -3.723 34 H GLU 5 H GLU 5 -0.317 9.387 -8.362 35 HA GLU 5 HA GLU 5 1.747 8.596 -10.096 36 HB2 GLU 5 HB2 GLU 5 -0.483 7.554 -9.982 37 HB3 GLU 5 HB3 GLU 5 -1.082 8.884 -10.718 38 HG2 GLU 5 HG2 GLU 5 -0.887 7.254 -12.329 39 HG3 GLU 5 HG3 GLU 5 0.284 8.352 -12.627 40 H LYS 6 H LYS 6 -0.416 11.284 -9.927 41 HA LYS 6 HA LYS 6 1.125 12.763 -11.827 42 HB2 LYS 6 HB2 LYS 6 -0.436 11.429 -13.144 43 HB3 LYS 6 HB3 LYS 6 -1.664 12.172 -12.364 44 HG2 LYS 6 HG2 LYS 6 -1.270 14.150 -13.457 45 HG3 LYS 6 HG3 LYS 6 0.158 13.614 -14.041 46 HD2 LYS 6 HD2 LYS 6 -1.355 13.514 -15.796 47 HD3 LYS 6 HD3 LYS 6 -1.069 11.974 -15.333 48 HE2 LYS 6 HE2 LYS 6 -3.132 11.977 -14.114 49 HE3 LYS 6 HE3 LYS 6 -3.423 13.496 -14.637 50 HZ1 LYS 6 HZ1 LYS 6 -4.591 11.926 -15.996 51 HZ2 LYS 6 HZ2 LYS 6 -3.197 11.197 -16.367 52 HZ3 LYS 6 HZ3 LYS 6 -3.485 12.701 -16.885 53 HA PRO 7 HA PRO 7 1.247 14.904 -12.678 54 HB2 PRO 7 HB2 PRO 7 2.190 17.268 -11.899 55 HB3 PRO 7 HB3 PRO 7 0.691 17.196 -12.544 56 HG2 PRO 7 HG2 PRO 7 1.411 17.261 -9.791 57 HG3 PRO 7 HG3 PRO 7 0.244 18.119 -10.545 58 HD2 PRO 7 HD2 PRO 7 -0.345 15.958 -9.199 59 HD3 PRO 7 HD3 PRO 7 -1.213 16.383 -10.515 60 H GLY 8 H GLY 8 3.266 14.230 -13.060 61 HA2 GLY 8 HA2 GLY 8 5.291 14.711 -11.252 62 HA3 GLY 8 HA3 GLY 8 4.709 13.213 -10.958 63 H SER 9 H SER 9 7.272 13.507 -11.531 64 HA SER 9 HA SER 9 7.571 11.841 -13.809 65 HB2 SER 9 HB2 SER 9 7.759 13.841 -15.016 66 HB3 SER 9 HB3 SER 9 8.808 14.451 -13.923 67 HG SER 9 HG SER 9 10.309 12.922 -14.508 68 H ARG 10 H ARG 10 9.002 10.294 -12.953 69 HA ARG 10 HA ARG 10 10.475 11.066 -10.672 70 HB2 ARG 10 HB2 ARG 10 10.358 8.465 -11.941 71 HB3 ARG 10 HB3 ARG 10 11.119 8.730 -10.520 72 HG2 ARG 10 HG2 ARG 10 8.953 9.435 -9.626 73 HG3 ARG 10 HG3 ARG 10 8.284 8.849 -10.996 74 HD2 ARG 10 HD2 ARG 10 8.046 7.162 -9.440 75 HD3 ARG 10 HD3 ARG 10 9.278 6.679 -10.397 76 HE ARG 10 HE ARG 10 10.527 7.966 -8.384 77 HH11 ARG 10 HH11 ARG 10 11.286 7.014 -6.539 78 HH12 ARG 10 HH12 ARG 10 10.633 5.509 -5.984 79 HH21 ARG 10 HH21 ARG 10 8.357 5.192 -8.545 80 HH22 ARG 10 HH22 ARG 10 9.005 4.494 -7.098 81 H ALA 11 H ALA 11 11.233 10.248 -13.934 82 HA ALA 11 HA ALA 11 13.932 9.915 -13.600 83 HB1 ALA 11 HB1 ALA 11 12.764 9.260 -15.648 84 HB2 ALA 11 HB2 ALA 11 14.059 10.150 -16.032 85 HB3 ALA 11 HB3 ALA 11 12.586 10.818 -16.042 86 H ALA 12 H ALA 12 12.154 12.808 -14.044 87 HA ALA 12 HA ALA 12 14.264 14.467 -14.628 88 HB1 ALA 12 HB1 ALA 12 11.937 15.158 -14.896 89 HB2 ALA 12 HB2 ALA 12 12.723 16.274 -14.030 90 HB3 ALA 12 HB3 ALA 12 11.763 15.204 -13.289 91 H LEU 13 H LEU 13 13.227 13.222 -11.645 92 HA LEU 13 HA LEU 13 14.846 15.012 -10.139 93 HB2 LEU 13 HB2 LEU 13 13.241 12.764 -9.248 94 HB3 LEU 13 HB3 LEU 13 13.938 13.832 -8.228 95 HG LEU 13 HG LEU 13 11.851 14.623 -10.039 96 HD11 LEU 13 HD11 LEU 13 10.352 14.353 -8.155 97 HD12 LEU 13 HD12 LEU 13 11.572 13.772 -7.266 98 HD13 LEU 13 HD13 LEU 13 11.015 12.925 -8.526 99 HD21 LEU 13 HD21 LEU 13 11.629 16.510 -8.631 100 HD22 LEU 13 HD22 LEU 13 13.129 16.439 -9.231 101 HD23 LEU 13 HD23 LEU 13 12.846 15.981 -7.707 102 H CYS 14 H CYS 14 14.766 11.775 -11.161 103 HA CYS 14 HA CYS 14 16.667 10.719 -9.451 104 HB2 CYS 14 HB2 CYS 14 15.027 9.543 -10.765 105 HB3 CYS 14 HB3 CYS 14 15.965 9.814 -12.075 106 H SER 15 H SER 15 16.931 12.090 -12.625 107 HA SER 15 HA SER 15 19.545 11.403 -13.071 108 HB2 SER 15 HB2 SER 15 18.172 12.322 -14.825 109 HB3 SER 15 HB3 SER 15 18.208 13.780 -14.089 110 HG SER 15 HG SER 15 20.631 13.315 -14.335 111 H GLU 16 H GLU 16 21.523 12.157 -12.436 112 HA GLU 16 HA GLU 16 21.664 13.858 -10.266 113 HB2 GLU 16 HB2 GLU 16 23.766 13.010 -12.057 114 HB3 GLU 16 HB3 GLU 16 24.068 13.809 -10.665 115 HG2 GLU 16 HG2 GLU 16 23.090 12.003 -9.449 116 HG3 GLU 16 HG3 GLU 16 22.880 11.196 -10.854 117 H ALA 17 H ALA 17 21.364 14.557 -13.523 118 HA ALA 17 HA ALA 17 22.523 17.033 -13.646 119 HB1 ALA 17 HB1 ALA 17 21.686 15.885 -15.616 120 HB2 ALA 17 HB2 ALA 17 21.084 17.386 -15.583 121 HB3 ALA 17 HB3 ALA 17 20.167 16.136 -15.123 122 H PHE 18 H PHE 18 19.923 16.125 -11.795 123 HA PHE 18 HA PHE 18 18.628 18.632 -11.748 124 HB2 PHE 18 HB2 PHE 18 17.544 16.419 -11.361 125 HB3 PHE 18 HB3 PHE 18 18.210 16.451 -9.870 126 HD1 PHE 18 HD1 PHE 18 15.850 18.222 -11.970 127 HD2 PHE 18 HD2 PHE 18 17.080 17.488 -8.066 128 HE1 PHE 18 HE1 PHE 18 13.910 19.398 -11.145 129 HE2 PHE 18 HE2 PHE 18 15.143 18.664 -7.227 130 HZ PHE 18 HZ PHE 18 13.562 19.636 -8.770 131 H GLY 19 H GLY 19 21.462 17.663 -10.367 132 HA2 GLY 19 HA2 GLY 19 21.660 19.969 -8.885 133 HA3 GLY 19 HA3 GLY 19 21.246 18.770 -7.857 134 H PHE 20 H PHE 20 23.116 17.155 -9.789 135 HA PHE 20 HA PHE 20 25.088 16.357 -9.686 136 HB2 PHE 20 HB2 PHE 20 25.890 18.474 -10.470 137 HB3 PHE 20 HB3 PHE 20 26.079 18.987 -8.931 138 HD1 PHE 20 HD1 PHE 20 27.341 16.488 -11.241 139 HD2 PHE 20 HD2 PHE 20 28.162 18.766 -7.859 140 HE1 PHE 20 HE1 PHE 20 29.605 15.659 -11.243 141 HE2 PHE 20 HE2 PHE 20 30.433 17.944 -7.845 142 HZ PHE 20 HZ PHE 20 31.156 16.383 -9.539 143 H LEU 21 H LEU 21 24.678 18.087 -6.725 144 HA LEU 21 HA LEU 21 26.401 16.376 -5.281 145 HB2 LEU 21 HB2 LEU 21 24.434 18.246 -4.288 146 HB3 LEU 21 HB3 LEU 21 25.581 17.546 -3.361 147 HG LEU 21 HG LEU 21 26.169 19.415 -5.470 148 HD11 LEU 21 HD11 LEU 21 26.590 21.011 -3.696 149 HD12 LEU 21 HD12 LEU 21 26.117 19.917 -2.603 150 HD13 LEU 21 HD13 LEU 21 25.047 20.529 -3.650 151 HD21 LEU 21 HD21 LEU 21 28.388 19.488 -4.577 152 HD22 LEU 21 HD22 LEU 21 28.029 17.987 -5.058 153 HD23 LEU 21 HD23 LEU 21 27.992 18.363 -3.486 154 H ASN 22 H ASN 22 23.525 15.958 -6.646 155 HA ASN 22 HA ASN 22 22.156 14.558 -4.678 156 HB2 ASN 22 HB2 ASN 22 21.789 14.586 -7.565 157 HB3 ASN 22 HB3 ASN 22 20.762 13.780 -6.583 158 HD21 ASN 22 HD21 ASN 22 19.161 16.920 -7.375 159 HD22 ASN 22 HD22 ASN 22 19.660 15.497 -8.227 160 H LEU 23 H LEU 23 21.785 12.270 -4.474 161 HA LEU 23 HA LEU 23 23.839 10.566 -5.346 162 HB2 LEU 23 HB2 LEU 23 21.304 10.009 -4.145 163 HB3 LEU 23 HB3 LEU 23 22.286 8.798 -4.634 164 HG LEU 23 HG LEU 23 23.918 9.695 -3.020 165 HD11 LEU 23 HD11 LEU 23 23.080 10.917 -1.166 166 HD12 LEU 23 HD12 LEU 23 21.647 11.064 -1.901 167 HD13 LEU 23 HD13 LEU 23 22.952 11.789 -2.522 168 HD21 LEU 23 HD21 LEU 23 22.849 8.426 -1.224 169 HD22 LEU 23 HD22 LEU 23 22.675 7.640 -2.626 170 HD23 LEU 23 HD23 LEU 23 21.444 8.497 -2.021 171 H ASN 24 H ASN 24 23.399 8.667 -6.826 172 HA ASN 24 HA ASN 24 22.475 9.347 -9.228 173 HB2 ASN 24 HB2 ASN 24 22.939 6.802 -7.938 174 HB3 ASN 24 HB3 ASN 24 22.175 6.705 -9.378 175 HD21 ASN 24 HD21 ASN 24 26.109 7.442 -9.203 176 HD22 ASN 24 HD22 ASN 24 25.106 7.528 -7.793 177 H CYS 25 H CYS 25 20.365 8.762 -6.765 178 HA CYS 25 HA CYS 25 18.247 9.380 -8.449 179 HB2 CYS 25 HB2 CYS 25 18.530 6.877 -8.401 180 HB3 CYS 25 HB3 CYS 25 17.661 7.015 -7.025 181 H GLY 26 H GLY 26 19.580 8.992 -5.404 182 HA2 GLY 26 HA2 GLY 26 19.012 10.331 -3.591 183 HA3 GLY 26 HA3 GLY 26 17.503 10.548 -4.175 184 H SER 27 H SER 27 18.484 9.674 -1.466 185 HA SER 27 HA SER 27 17.801 6.960 -1.332 186 HB2 SER 27 HB2 SER 27 18.025 8.705 0.997 187 HB3 SER 27 HB3 SER 27 18.407 7.118 0.951 188 HG SER 27 HG SER 27 20.264 7.503 0.054 189 H VAL 28 H VAL 28 16.092 9.836 -0.815 190 HA VAL 28 HA VAL 28 14.053 8.871 0.748 191 HB VAL 28 HB VAL 28 14.587 11.293 0.307 192 HG11 VAL 28 HG11 VAL 28 13.575 12.367 -1.593 193 HG12 VAL 28 HG12 VAL 28 13.038 10.936 -2.121 194 HG13 VAL 28 HG13 VAL 28 14.625 11.240 -2.085 195 HG21 VAL 28 HG21 VAL 28 12.374 12.143 0.597 196 HG22 VAL 28 HG22 VAL 28 12.618 10.865 1.558 197 HG23 VAL 28 HG23 VAL 28 11.762 10.700 0.196 198 H MET 29 H MET 29 14.585 8.110 -2.400 199 HA MET 29 HA MET 29 11.984 7.835 -3.227 200 HB2 MET 29 HB2 MET 29 12.858 6.675 -5.103 201 HB3 MET 29 HB3 MET 29 13.974 7.795 -4.696 202 HG2 MET 29 HG2 MET 29 15.248 6.195 -3.640 203 HG3 MET 29 HG3 MET 29 14.107 5.063 -3.927 204 HE1 MET 29 HE1 MET 29 17.169 4.139 -6.250 205 HE2 MET 29 HE2 MET 29 16.295 3.604 -4.999 206 HE3 MET 29 HE3 MET 29 17.278 4.874 -4.813 207 H TYR 30 H TYR 30 13.384 6.089 -0.876 208 HA TYR 30 HA TYR 30 12.625 3.537 -1.640 209 HB2 TYR 30 HB2 TYR 30 14.411 3.752 -0.105 210 HB3 TYR 30 HB3 TYR 30 13.489 4.631 0.917 211 HD1 TYR 30 HD1 TYR 30 14.048 1.241 -0.266 212 HD2 TYR 30 HD2 TYR 30 12.239 3.580 2.665 213 HE1 TYR 30 HE1 TYR 30 13.460 -0.749 0.984 214 HE2 TYR 30 HE2 TYR 30 11.734 1.596 3.933 215 HH TYR 30 HH TYR 30 12.152 -0.628 4.206 216 H GLU 31 H GLU 31 11.056 5.788 0.563 217 HA GLU 31 HA GLU 31 8.749 4.216 0.207 218 HB2 GLU 31 HB2 GLU 31 8.257 4.093 2.619 219 HB3 GLU 31 HB3 GLU 31 9.689 3.381 2.288 220 HG2 GLU 31 HG2 GLU 31 10.845 5.254 3.120 221 HG3 GLU 31 HG3 GLU 31 9.434 6.035 3.380 222 HA PRO 32 HA PRO 32 7.392 8.460 0.758 223 HB2 PRO 32 HB2 PRO 32 6.966 9.385 -1.689 224 HB3 PRO 32 HB3 PRO 32 8.454 9.553 -1.038 225 HG2 PRO 32 HG2 PRO 32 7.553 7.517 -2.829 226 HG3 PRO 32 HG3 PRO 32 8.918 8.408 -2.937 227 HD2 PRO 32 HD2 PRO 32 9.006 6.011 -1.926 228 HD3 PRO 32 HD3 PRO 32 9.984 7.180 -1.338 229 H GLN 33 H GLN 33 6.481 5.873 -1.211 230 HA GLN 33 HA GLN 33 3.779 6.539 -1.163 231 HB2 GLN 33 HB2 GLN 33 3.362 4.450 -2.181 232 HB3 GLN 33 HB3 GLN 33 4.656 5.146 -2.896 233 HG2 GLN 33 HG2 GLN 33 5.025 3.126 -0.867 234 HG3 GLN 33 HG3 GLN 33 4.828 2.703 -2.432 235 HE21 GLN 33 HE21 GLN 33 8.427 2.852 -1.591 236 HE22 GLN 33 HE22 GLN 33 7.063 2.007 -0.939 237 H SER 34 H SER 34 5.839 5.049 1.045 238 HA SER 34 HA SER 34 3.597 4.325 2.660 239 HB2 SER 34 HB2 SER 34 4.689 2.298 1.651 240 HB3 SER 34 HB3 SER 34 5.972 2.618 2.609 241 HG SER 34 HG SER 34 4.221 2.601 4.311 242 H LEU 35 H LEU 35 3.940 6.401 3.639 243 HA LEU 35 HA LEU 35 6.063 6.276 5.570 244 HB2 LEU 35 HB2 LEU 35 4.420 8.513 4.798 245 HB3 LEU 35 HB3 LEU 35 5.501 8.601 6.019 246 HG LEU 35 HG LEU 35 6.265 8.085 3.287 247 HD11 LEU 35 HD11 LEU 35 6.967 10.375 3.231 248 HD12 LEU 35 HD12 LEU 35 6.381 10.592 4.723 249 HD13 LEU 35 HD13 LEU 35 5.374 10.292 3.494 250 HD21 LEU 35 HD21 LEU 35 8.487 8.558 4.002 251 HD22 LEU 35 HD22 LEU 35 7.897 7.302 4.832 252 HD23 LEU 35 HD23 LEU 35 7.966 8.764 5.519 253 H GLU 36 H GLU 36 5.692 6.205 7.796 254 HA GLU 36 HA GLU 36 2.945 5.761 8.548 255 HB2 GLU 36 HB2 GLU 36 5.386 4.986 9.898 256 HB3 GLU 36 HB3 GLU 36 3.903 4.698 10.518 257 HG2 GLU 36 HG2 GLU 36 4.910 3.538 8.084 258 HG3 GLU 36 HG3 GLU 36 4.766 2.744 9.504 259 H ALA 37 H ALA 37 1.909 6.964 10.174 260 HA ALA 37 HA ALA 37 3.528 8.930 11.473 261 HB1 ALA 37 HB1 ALA 37 2.499 10.112 9.658 262 HB2 ALA 37 HB2 ALA 37 1.952 10.698 11.062 263 HB3 ALA 37 HB3 ALA 37 1.035 9.686 10.196 264 H LYS 38 H LYS 38 2.370 10.071 13.314 265 HA LYS 38 HA LYS 38 1.499 8.166 15.071 266 HB2 LYS 38 HB2 LYS 38 1.156 11.059 15.270 267 HB3 LYS 38 HB3 LYS 38 1.023 10.061 16.555 268 HG2 LYS 38 HG2 LYS 38 3.352 9.530 16.316 269 HG3 LYS 38 HG3 LYS 38 3.449 10.656 15.137 270 HD2 LYS 38 HD2 LYS 38 2.706 12.312 16.704 271 HD3 LYS 38 HD3 LYS 38 2.713 11.175 17.876 272 HE2 LYS 38 HE2 LYS 38 5.080 10.926 17.574 273 HE3 LYS 38 HE3 LYS 38 5.044 12.136 16.478 274 HZ1 LYS 38 HZ1 LYS 38 5.700 12.982 18.607 275 HZ2 LYS 38 HZ2 LYS 38 4.323 12.439 19.256 276 HZ3 LYS 38 HZ3 LYS 38 4.287 13.637 18.171 277 H LYS 39 H LYS 39 -0.500 8.782 16.603 278 HA LYS 39 HA LYS 39 -2.717 7.942 15.338 279 HB2 LYS 39 HB2 LYS 39 -3.897 8.371 17.287 280 HB3 LYS 39 HB3 LYS 39 -2.377 7.993 17.747 281 HG2 LYS 39 HG2 LYS 39 -1.931 10.267 18.174 282 HG3 LYS 39 HG3 LYS 39 -3.440 10.660 17.691 283 HD2 LYS 39 HD2 LYS 39 -4.187 9.039 19.447 284 HD3 LYS 39 HD3 LYS 39 -2.679 9.215 20.049 285 HE2 LYS 39 HE2 LYS 39 -4.007 10.694 21.215 286 HE3 LYS 39 HE3 LYS 39 -3.121 11.602 20.187 287 HZ1 LYS 39 HZ1 LYS 39 -5.386 12.308 20.156 288 HZ2 LYS 39 HZ2 LYS 39 -5.854 10.822 19.723 289 HZ3 LYS 39 HZ3 LYS 39 -4.976 11.722 18.705 290 H GLY 40 H GLY 40 -4.560 8.698 14.429 291 HA2 GLY 40 HA2 GLY 40 -4.314 11.441 13.588 292 HA3 GLY 40 HA3 GLY 40 -5.060 10.265 12.735 293 H PHE 41 H PHE 41 -6.210 9.659 15.651 294 HA PHE 41 HA PHE 41 -8.642 10.908 15.053 295 HB2 PHE 41 HB2 PHE 41 -7.785 9.362 17.296 296 HB3 PHE 41 HB3 PHE 41 -9.220 10.137 17.370 297 HD1 PHE 41 HD1 PHE 41 -7.485 7.397 15.863 298 HD2 PHE 41 HD2 PHE 41 -11.111 9.435 15.992 299 HE1 PHE 41 HE1 PHE 41 -8.562 5.544 14.753 300 HE2 PHE 41 HE2 PHE 41 -12.194 7.594 14.873 301 HZ PHE 41 HZ PHE 41 -10.920 5.639 14.257 302 HA PRO 42 HA PRO 42 -10.389 12.282 15.545 303 HB2 PRO 42 HB2 PRO 42 -11.228 14.809 15.351 304 HB3 PRO 42 HB3 PRO 42 -11.297 14.078 16.809 305 HG2 PRO 42 HG2 PRO 42 -9.272 15.832 15.826 306 HG3 PRO 42 HG3 PRO 42 -10.008 15.870 17.284 307 HD2 PRO 42 HD2 PRO 42 -7.653 14.748 16.988 308 HD3 PRO 42 HD3 PRO 42 -8.705 14.207 18.113 309 H HIS 43 H HIS 43 -10.440 11.577 13.584 310 HA HIS 43 HA HIS 43 -8.704 12.497 11.691 311 HB2 HIS 43 HB2 HIS 43 -11.139 10.916 11.373 312 HB3 HIS 43 HB3 HIS 43 -10.096 11.111 10.131 313 HD1 HIS 43 HD1 HIS 43 -10.888 8.313 11.421 314 HD2 HIS 43 HD2 HIS 43 -7.440 10.434 12.054 315 HE1 HIS 43 HE1 HIS 43 -9.113 6.736 12.169 316 HE2 HIS 43 HE2 HIS 43 -7.035 7.995 12.583 317 H SER 44 H SER 44 -11.677 13.826 12.443 318 HA SER 44 HA SER 44 -12.229 14.990 9.978 319 HB2 SER 44 HB2 SER 44 -13.934 14.785 11.687 320 HB3 SER 44 HB3 SER 44 -13.127 15.852 12.623 321 HG SER 44 HG SER 44 -13.470 17.401 10.977 322 H GLY 45 H GLY 45 -10.136 15.866 12.509 323 HA2 GLY 45 HA2 GLY 45 -9.913 18.570 11.597 324 HA3 GLY 45 HA3 GLY 45 -9.337 17.981 13.007 325 HA PRO 46 HA PRO 46 -5.686 18.364 10.376 326 HB2 PRO 46 HB2 PRO 46 -4.140 19.786 11.972 327 HB3 PRO 46 HB3 PRO 46 -5.336 20.575 11.188 328 HG2 PRO 46 HG2 PRO 46 -5.371 19.557 13.847 329 HG3 PRO 46 HG3 PRO 46 -5.787 21.055 13.345 330 HD2 PRO 46 HD2 PRO 46 -7.630 19.231 13.727 331 HD3 PRO 46 HD3 PRO 46 -7.813 20.352 12.553 332 H ALA 47 H ALA 47 -3.280 17.854 10.962 333 HA ALA 47 HA ALA 47 -3.266 15.275 11.884 334 HB1 ALA 47 HB1 ALA 47 -1.491 16.187 10.500 335 HB2 ALA 47 HB2 ALA 47 -0.837 15.497 11.807 336 HB3 ALA 47 HB3 ALA 47 -0.992 17.105 11.734 337 H ASP 48 H ASP 48 -3.037 14.237 13.850 338 HA ASP 48 HA ASP 48 -2.868 16.031 16.088 339 HB2 ASP 48 HB2 ASP 48 -4.838 14.554 15.860 340 HB3 ASP 48 HB3 ASP 48 -3.851 13.325 16.288 341 H GLY 49 H GLY 49 -1.992 14.905 18.213 342 HA2 GLY 49 HA2 GLY 49 -0.273 13.843 19.205 343 HA3 GLY 49 HA3 GLY 49 0.047 13.033 17.824 344 H GLN 50 H GLN 50 0.108 16.221 17.094 345 HA GLN 50 HA GLN 50 2.845 16.512 17.702 346 HB2 GLN 50 HB2 GLN 50 3.450 16.820 15.333 347 HB3 GLN 50 HB3 GLN 50 2.905 15.309 15.628 348 HG2 GLN 50 HG2 GLN 50 0.707 16.156 14.830 349 HG3 GLN 50 HG3 GLN 50 1.561 17.399 14.202 350 HE21 GLN 50 HE21 GLN 50 1.474 13.878 12.382 351 HE22 GLN 50 HE22 GLN 50 0.581 14.233 13.822 352 H ILE 51 H ILE 51 0.040 18.092 16.514 353 HA ILE 51 HA ILE 51 1.254 20.573 16.171 354 HB ILE 51 HB ILE 51 -1.560 20.011 16.652 355 HG12 ILE 51 HG12 ILE 51 -0.681 19.071 14.624 356 HG13 ILE 51 HG13 ILE 51 -1.883 20.140 14.344 357 HG21 ILE 51 HG21 ILE 51 -2.082 22.226 15.835 358 HG22 ILE 51 HG22 ILE 51 -0.504 22.563 15.734 359 HG23 ILE 51 HG23 ILE 51 -1.189 22.324 17.179 360 HD11 ILE 51 HD11 ILE 51 -0.137 20.433 12.725 361 HD12 ILE 51 HD12 ILE 51 0.933 20.710 13.906 362 HD13 ILE 51 HD13 ILE 51 -0.257 21.769 13.628 363 H ALA 52 H ALA 52 -0.142 19.002 18.908 364 HA ALA 52 HA ALA 52 -0.141 21.154 20.628 365 HB1 ALA 52 HB1 ALA 52 -1.285 19.079 21.160 366 HB2 ALA 52 HB2 ALA 52 -0.318 19.481 22.392 367 HB3 ALA 52 HB3 ALA 52 0.139 18.336 21.347 368 H SER 53 H SER 53 2.401 19.124 19.617 369 HA SER 53 HA SER 53 4.230 20.178 21.547 370 HB2 SER 53 HB2 SER 53 4.813 18.243 19.436 371 HB3 SER 53 HB3 SER 53 5.724 18.481 20.770 372 HG SER 53 HG SER 53 3.160 17.803 21.241 373 H ALA 54 H ALA 54 3.008 21.328 18.934 374 HA ALA 54 HA ALA 54 3.549 22.585 17.248 375 HB1 ALA 54 HB1 ALA 54 4.351 24.107 18.983 376 HB2 ALA 54 HB2 ALA 54 5.169 24.363 17.612 377 HB3 ALA 54 HB3 ALA 54 5.844 23.510 18.809 378 H GLY 55 H GLY 55 4.949 19.922 17.428 379 HA2 GLY 55 HA2 GLY 55 7.225 20.247 15.782 380 HA3 GLY 55 HA3 GLY 55 6.552 18.828 16.230 381 H GLY 56 H GLY 56 3.896 19.560 15.329 382 HA2 GLY 56 HA2 GLY 56 4.126 18.762 12.651 383 HA3 GLY 56 HA3 GLY 56 2.748 19.223 13.398 384 H LEU 57 H LEU 57 4.284 21.761 14.136 385 HA LEU 57 HA LEU 57 3.527 23.146 11.769 386 HB2 LEU 57 HB2 LEU 57 4.281 24.212 14.357 387 HB3 LEU 57 HB3 LEU 57 3.771 25.152 13.123 388 HG LEU 57 HG LEU 57 2.079 23.215 14.396 389 HD11 LEU 57 HD11 LEU 57 1.091 25.094 15.582 390 HD12 LEU 57 HD12 LEU 57 2.188 26.083 14.923 391 HD13 LEU 57 HD13 LEU 57 2.651 24.952 15.983 392 HD21 LEU 57 HD21 LEU 57 0.276 24.355 13.332 393 HD22 LEU 57 HD22 LEU 57 1.308 23.778 12.228 394 HD23 LEU 57 HD23 LEU 57 1.326 25.349 12.608 395 H PHE 58 H PHE 58 6.255 23.272 13.964 396 HA PHE 58 HA PHE 58 7.752 24.647 12.005 397 HB2 PHE 58 HB2 PHE 58 8.537 23.888 14.693 398 HB3 PHE 58 HB3 PHE 58 9.399 24.909 13.754 399 HD1 PHE 58 HD1 PHE 58 7.182 24.851 16.343 400 HD2 PHE 58 HD2 PHE 58 7.981 26.996 12.868 401 HE1 PHE 58 HE1 PHE 58 5.913 26.717 17.207 402 HE2 PHE 58 HE2 PHE 58 6.690 28.854 13.707 403 HZ PHE 58 HZ PHE 58 5.656 28.719 15.880 404 H GLY 59 H GLY 59 7.356 21.462 12.700 405 HA2 GLY 59 HA2 GLY 59 9.940 20.524 12.328 406 HA3 GLY 59 HA3 GLY 59 8.575 19.644 12.151 407 H GLY 60 H GLY 60 7.593 21.527 10.040 408 HA2 GLY 60 HA2 GLY 60 8.578 20.170 7.837 409 HA3 GLY 60 HA3 GLY 60 7.724 21.562 7.782 410 H ILE 61 H ILE 61 9.632 23.079 9.346 411 HA ILE 61 HA ILE 61 11.264 23.963 7.303 412 HB ILE 61 HB ILE 61 11.631 24.483 10.162 413 HG12 ILE 61 HG12 ILE 61 9.454 25.122 9.529 414 HG13 ILE 61 HG13 ILE 61 10.335 26.445 9.905 415 HG21 ILE 61 HG21 ILE 61 12.816 26.491 9.538 416 HG22 ILE 61 HG22 ILE 61 12.668 26.097 7.977 417 HG23 ILE 61 HG23 ILE 61 13.580 25.189 8.957 418 HD11 ILE 61 HD11 ILE 61 8.984 26.888 7.966 419 HD12 ILE 61 HD12 ILE 61 9.674 25.653 7.184 420 HD13 ILE 61 HD13 ILE 61 10.546 26.962 7.556 421 H LEU 62 H LEU 62 11.781 21.788 9.920 422 HA LEU 62 HA LEU 62 14.529 21.481 9.473 423 HB2 LEU 62 HB2 LEU 62 12.647 20.088 11.128 424 HB3 LEU 62 HB3 LEU 62 14.143 19.457 10.947 425 HG LEU 62 HG LEU 62 15.030 21.468 11.917 426 HD11 LEU 62 HD11 LEU 62 13.626 22.924 13.190 427 HD12 LEU 62 HD12 LEU 62 12.317 22.165 12.619 428 HD13 LEU 62 HD13 LEU 62 13.262 23.011 11.616 429 HD21 LEU 62 HD21 LEU 62 14.439 20.796 14.198 430 HD22 LEU 62 HD22 LEU 62 14.721 19.489 13.290 431 HD23 LEU 62 HD23 LEU 62 13.201 19.937 13.611 432 H ASP 63 H ASP 63 11.693 19.830 8.435 433 HA ASP 63 HA ASP 63 12.948 17.593 7.390 434 HB2 ASP 63 HB2 ASP 63 10.550 17.784 7.811 435 HB3 ASP 63 HB3 ASP 63 10.435 18.698 6.463 436 H GLN 64 H GLN 64 12.350 20.709 6.092 437 HA GLN 64 HA GLN 64 12.987 20.085 3.463 438 HB2 GLN 64 HB2 GLN 64 12.860 22.612 4.851 439 HB3 GLN 64 HB3 GLN 64 13.262 22.564 3.269 440 HG2 GLN 64 HG2 GLN 64 11.156 21.692 2.715 441 HG3 GLN 64 HG3 GLN 64 10.754 21.576 4.294 442 HE21 GLN 64 HE21 GLN 64 9.392 24.647 2.521 443 HE22 GLN 64 HE22 GLN 64 9.575 23.019 1.958 444 H GLN 65 H GLN 65 14.971 20.107 6.039 445 HA GLN 65 HA GLN 65 17.303 20.345 4.348 446 HB2 GLN 65 HB2 GLN 65 18.520 21.301 6.196 447 HB3 GLN 65 HB3 GLN 65 17.374 22.286 5.578 448 HG2 GLN 65 HG2 GLN 65 15.949 21.567 7.433 449 HG3 GLN 65 HG3 GLN 65 17.295 20.915 8.090 450 HE21 GLN 65 HE21 GLN 65 16.486 24.708 8.670 451 HE22 GLN 65 HE22 GLN 65 15.376 23.523 8.067 452 H SER 66 H SER 66 15.940 18.038 4.720 453 HA SER 66 HA SER 66 17.704 16.482 6.415 454 HB2 SER 66 HB2 SER 66 15.485 16.561 7.378 455 HB3 SER 66 HB3 SER 66 14.867 15.965 5.989 456 HG SER 66 HG SER 66 15.880 14.672 8.028 457 H GLU 67 H GLU 67 17.886 14.125 5.701 458 HA GLU 67 HA GLU 67 18.340 13.895 2.957 459 HB2 GLU 67 HB2 GLU 67 19.420 12.480 4.537 460 HB3 GLU 67 HB3 GLU 67 17.986 11.795 4.914 461 HG2 GLU 67 HG2 GLU 67 19.182 10.298 3.576 462 HG3 GLU 67 HG3 GLU 67 17.902 10.835 2.716 463 H ASN 68 H ASN 68 15.609 13.502 4.925 464 HA ASN 68 HA ASN 68 14.118 12.137 2.947 465 HB2 ASN 68 HB2 ASN 68 13.312 13.067 5.586 466 HB3 ASN 68 HB3 ASN 68 12.318 12.193 4.628 467 HD21 ASN 68 HD21 ASN 68 14.065 10.093 7.161 468 HD22 ASN 68 HD22 ASN 68 13.231 11.606 7.276 469 H ARG 69 H ARG 69 15.014 15.062 2.832 470 HA ARG 69 HA ARG 69 12.851 16.728 2.787 471 HB2 ARG 69 HB2 ARG 69 14.957 17.656 2.539 472 HB3 ARG 69 HB3 ARG 69 15.268 16.749 1.217 473 HG2 ARG 69 HG2 ARG 69 13.467 18.149 0.145 474 HG3 ARG 69 HG3 ARG 69 13.792 19.193 1.358 475 HD2 ARG 69 HD2 ARG 69 15.782 18.227 -0.491 476 HD3 ARG 69 HD3 ARG 69 15.069 19.692 -0.609 477 HE ARG 69 HE ARG 69 16.067 20.128 1.656 478 HH11 ARG 69 HH11 ARG 69 18.092 20.512 2.388 479 HH12 ARG 69 HH12 ARG 69 19.469 19.806 1.610 480 HH21 ARG 69 HH21 ARG 69 17.652 18.152 -0.798 481 HH22 ARG 69 HH22 ARG 69 19.227 18.493 -0.162 482 H TRP 70 H TRP 70 11.223 17.312 1.398 483 HA TRP 70 HA TRP 70 10.578 15.274 -0.423 484 HB2 TRP 70 HB2 TRP 70 9.164 17.660 0.411 485 HB3 TRP 70 HB3 TRP 70 8.537 16.702 -0.753 486 HD1 TRP 70 HD1 TRP 70 9.105 16.735 2.894 487 HE1 TRP 70 HE1 TRP 70 7.856 14.925 4.083 488 HE3 TRP 70 HE3 TRP 70 7.543 14.291 -1.177 489 HZ2 TRP 70 HZ2 TRP 70 6.274 12.748 3.250 490 HZ3 TRP 70 HZ3 TRP 70 6.165 12.318 -0.902 491 HH2 TRP 70 HH2 TRP 70 5.529 11.572 1.303 492 H PHE 71 H PHE 71 10.303 15.290 -2.575 493 HA PHE 71 HA PHE 71 11.994 16.986 -3.962 494 HB2 PHE 71 HB2 PHE 71 11.062 15.752 -5.916 495 HB3 PHE 71 HB3 PHE 71 11.741 14.807 -4.770 496 HD1 PHE 71 HD1 PHE 71 10.468 13.140 -3.624 497 HD2 PHE 71 HD2 PHE 71 8.550 15.915 -6.058 498 HE1 PHE 71 HE1 PHE 71 8.411 11.898 -3.403 499 HE2 PHE 71 HE2 PHE 71 6.482 14.685 -5.842 500 HZ PHE 71 HZ PHE 71 6.410 12.672 -4.515 501 H LYS 72 H LYS 72 11.622 18.447 -5.690 502 HA LYS 72 HA LYS 72 9.036 19.685 -5.511 503 HB2 LYS 72 HB2 LYS 72 11.566 20.858 -6.318 504 HB3 LYS 72 HB3 LYS 72 10.159 21.681 -6.418 505 HG2 LYS 72 HG2 LYS 72 9.945 21.550 -4.054 506 HG3 LYS 72 HG3 LYS 72 11.392 20.795 -3.983 507 HD2 LYS 72 HD2 LYS 72 11.800 23.017 -3.468 508 HD3 LYS 72 HD3 LYS 72 12.379 22.786 -4.978 509 HE2 LYS 72 HE2 LYS 72 10.386 23.778 -5.876 510 HE3 LYS 72 HE3 LYS 72 9.848 24.045 -4.358 511 HZ1 LYS 72 HZ1 LYS 72 10.808 26.017 -5.243 512 HZ2 LYS 72 HZ2 LYS 72 12.208 25.243 -5.480 513 HZ3 LYS 72 HZ3 LYS 72 11.675 25.508 -3.977 514 H HIS 73 H HIS 73 7.730 20.008 -7.329 515 HA HIS 73 HA HIS 73 9.007 19.412 -9.852 516 HB2 HIS 73 HB2 HIS 73 6.310 18.805 -9.082 517 HB3 HIS 73 HB3 HIS 73 6.720 18.878 -10.661 518 HD1 HIS 73 HD1 HIS 73 6.953 16.714 -7.697 519 HD2 HIS 73 HD2 HIS 73 8.409 16.781 -11.528 520 HE1 HIS 73 HE1 HIS 73 7.980 14.499 -8.195 521 HE2 HIS 73 HE2 HIS 73 8.893 14.531 -10.489 522 H ILE 74 H ILE 74 9.042 20.924 -11.434 523 HA ILE 74 HA ILE 74 7.805 23.429 -10.824 524 HB ILE 74 HB ILE 74 9.637 22.856 -13.021 525 HG12 ILE 74 HG12 ILE 74 10.302 24.204 -10.560 526 HG13 ILE 74 HG13 ILE 74 10.634 22.627 -10.824 527 HG21 ILE 74 HG21 ILE 74 9.834 25.263 -13.269 528 HG22 ILE 74 HG22 ILE 74 8.743 25.480 -12.095 529 HG23 ILE 74 HG23 ILE 74 8.296 24.818 -13.501 530 HD11 ILE 74 HD11 ILE 74 12.601 23.946 -11.178 531 HD12 ILE 74 HD12 ILE 74 11.835 24.811 -12.309 532 HD13 ILE 74 HD13 ILE 74 12.164 23.250 -12.570 533 H MET 75 H MET 75 5.956 24.170 -11.851 534 HA MET 75 HA MET 75 5.104 22.972 -14.313 535 HB2 MET 75 HB2 MET 75 4.231 21.617 -12.410 536 HB3 MET 75 HB3 MET 75 3.226 22.877 -12.149 537 HG2 MET 75 HG2 MET 75 2.280 22.607 -14.228 538 HG3 MET 75 HG3 MET 75 3.347 21.424 -14.590 539 HE1 MET 75 HE1 MET 75 -0.017 19.455 -14.358 540 HE2 MET 75 HE2 MET 75 1.244 19.772 -15.320 541 HE3 MET 75 HE3 MET 75 0.190 20.943 -14.957 542 H THR 76 H THR 76 3.116 24.231 -15.184 543 HA THR 76 HA THR 76 3.295 26.955 -14.361 544 HB THR 76 HB THR 76 1.565 27.302 -16.095 545 HG1 THR 76 HG1 THR 76 0.516 25.619 -16.650 546 HG21 THR 76 HG21 THR 76 3.043 26.905 -17.942 547 HG22 THR 76 HG22 THR 76 3.950 25.927 -17.028 548 HG23 THR 76 HG23 THR 76 3.903 27.513 -16.715 549 H GLY 77 H GLY 77 1.138 28.129 -13.762 550 HA2 GLY 77 HA2 GLY 77 -0.234 26.656 -11.808 551 HA3 GLY 77 HA3 GLY 77 -0.586 28.175 -12.293 552 H GLY 78 H GLY 78 -2.877 27.622 -12.053 553 HA2 GLY 78 HA2 GLY 78 -4.711 27.387 -13.454 554 HA3 GLY 78 HA3 GLY 78 -3.838 26.497 -14.509 555 H GLU 79 H GLU 79 -5.797 25.114 -14.577 556 HA GLU 79 HA GLU 79 -6.391 23.719 -12.247 557 HB2 GLU 79 HB2 GLU 79 -7.932 24.048 -14.170 558 HB3 GLU 79 HB3 GLU 79 -7.174 22.777 -14.862 559 HG2 GLU 79 HG2 GLU 79 -7.800 21.708 -12.604 560 HG3 GLU 79 HG3 GLU 79 -9.025 22.781 -12.736 561 H HIS 80 H HIS 80 -5.544 21.891 -11.374 562 HA HIS 80 HA HIS 80 -3.851 20.304 -13.091 563 HB2 HIS 80 HB2 HIS 80 -3.443 20.856 -10.278 564 HB3 HIS 80 HB3 HIS 80 -2.546 19.773 -11.107 565 HD1 HIS 80 HD1 HIS 80 -0.792 21.718 -9.862 566 HD2 HIS 80 HD2 HIS 80 -2.639 22.492 -13.438 567 HE1 HIS 80 HE1 HIS 80 0.428 23.558 -11.007 568 HE2 HIS 80 HE2 HIS 80 -0.679 24.053 -13.150 569 H THR 81 H THR 81 -4.294 18.113 -13.202 570 HA THR 81 HA THR 81 -6.376 17.175 -11.454 571 HB THR 81 HB THR 81 -5.355 15.880 -13.838 572 HG1 THR 81 HG1 THR 81 -6.626 17.802 -14.122 573 HG21 THR 81 HG21 THR 81 -7.204 14.367 -13.599 574 HG22 THR 81 HG22 THR 81 -7.654 15.109 -12.234 575 HG23 THR 81 HG23 THR 81 -6.277 14.262 -12.278 576 H PHE 82 H PHE 82 -5.773 16.174 -9.620 577 HA PHE 82 HA PHE 82 -3.130 15.038 -9.476 578 HB2 PHE 82 HB2 PHE 82 -4.988 15.771 -7.399 579 HB3 PHE 82 HB3 PHE 82 -3.595 14.982 -7.077 580 HD1 PHE 82 HD1 PHE 82 -1.493 16.128 -6.988 581 HD2 PHE 82 HD2 PHE 82 -4.935 18.141 -8.186 582 HE1 PHE 82 HE1 PHE 82 -0.307 18.226 -6.851 583 HE2 PHE 82 HE2 PHE 82 -3.768 20.247 -8.021 584 HZ PHE 82 HZ PHE 82 -1.448 20.292 -7.371 585 H THR 83 H THR 83 -2.801 12.829 -9.287 586 HA THR 83 HA THR 83 -5.140 11.235 -8.845 587 HB THR 83 HB THR 83 -3.168 10.611 -10.920 588 HG1 THR 83 HG1 THR 83 -4.360 11.592 -12.292 589 HG21 THR 83 HG21 THR 83 -4.622 8.809 -11.558 590 HG22 THR 83 HG22 THR 83 -5.640 9.184 -10.359 591 HG23 THR 83 HG23 THR 83 -4.175 8.592 -10.019 592 H TRP 84 H TRP 84 -4.916 9.654 -7.347 593 HA TRP 84 HA TRP 84 -2.227 8.970 -6.541 594 HB2 TRP 84 HB2 TRP 84 -4.655 8.959 -4.972 595 HB3 TRP 84 HB3 TRP 84 -3.244 8.362 -4.408 596 HD1 TRP 84 HD1 TRP 84 -1.960 11.183 -5.893 597 HE1 TRP 84 HE1 TRP 84 -1.771 13.238 -4.468 598 HE3 TRP 84 HE3 TRP 84 -5.121 9.740 -2.297 599 HZ2 TRP 84 HZ2 TRP 84 -2.889 14.045 -2.008 600 HZ3 TRP 84 HZ3 TRP 84 -5.540 11.233 -0.435 601 HH2 TRP 84 HH2 TRP 84 -4.414 13.362 -0.299 602 H THR 85 H THR 85 -1.704 6.708 -6.190 603 HA THR 85 HA THR 85 -3.833 4.870 -6.685 604 HB THR 85 HB THR 85 -2.790 5.102 -8.876 605 HG1 THR 85 HG1 THR 85 -3.769 3.168 -8.461 606 HG21 THR 85 HG21 THR 85 -0.591 4.272 -9.236 607 HG22 THR 85 HG22 THR 85 -0.423 3.970 -7.656 608 HG23 THR 85 HG23 THR 85 -0.518 5.496 -8.182 609 H TYR 86 H TYR 86 -3.456 2.673 -5.873 610 HA TYR 86 HA TYR 86 -1.115 2.400 -4.198 611 HB2 TYR 86 HB2 TYR 86 -3.004 3.228 -2.871 612 HB3 TYR 86 HB3 TYR 86 -3.681 1.760 -3.104 613 HD1 TYR 86 HD1 TYR 86 -3.644 0.595 -1.054 614 HD2 TYR 86 HD2 TYR 86 -0.247 2.694 -2.223 615 HE1 TYR 86 HE1 TYR 86 -2.457 -0.257 0.869 616 HE2 TYR 86 HE2 TYR 86 0.933 1.853 -0.289 617 HH TYR 86 HH TYR 86 -0.617 0.149 2.272 618 H THR 87 H THR 87 -0.718 0.080 -3.596 619 HA THR 87 HA THR 87 -1.064 -1.386 -5.902 620 HB THR 87 HB THR 87 0.934 -1.753 -4.568 621 HG1 THR 87 HG1 THR 87 0.257 -4.210 -4.182 622 HG21 THR 87 HG21 THR 87 0.841 -2.853 -2.430 623 HG22 THR 87 HG22 THR 87 -0.772 -2.935 -2.522 624 HG23 THR 87 HG23 THR 87 -0.043 -1.501 -2.352 625 H ALA 88 H ALA 88 -2.860 -1.457 -2.998 626 HA ALA 88 HA ALA 88 -4.699 -3.290 -4.243 627 HB1 ALA 88 HB1 ALA 88 -3.425 -4.681 -2.739 628 HB2 ALA 88 HB2 ALA 88 -4.937 -4.560 -2.180 629 HB3 ALA 88 HB3 ALA 88 -3.755 -3.682 -1.511 630 HA PRO 89 HA PRO 89 -7.403 -0.312 -2.545 631 HB2 PRO 89 HB2 PRO 89 -9.760 -1.521 -2.373 632 HB3 PRO 89 HB3 PRO 89 -9.185 -1.117 -3.847 633 HG2 PRO 89 HG2 PRO 89 -9.036 -3.660 -2.551 634 HG3 PRO 89 HG3 PRO 89 -9.485 -3.349 -4.091 635 HD2 PRO 89 HD2 PRO 89 -7.060 -4.142 -3.573 636 HD3 PRO 89 HD3 PRO 89 -7.331 -3.083 -4.787 637 H HIS 90 H HIS 90 -7.575 0.531 -0.573 638 HA HIS 90 HA HIS 90 -7.887 -1.364 1.588 639 HB2 HIS 90 HB2 HIS 90 -5.551 -0.511 1.322 640 HB3 HIS 90 HB3 HIS 90 -6.130 0.900 1.905 641 HD1 HIS 90 HD1 HIS 90 -6.862 1.025 4.456 642 HD2 HIS 90 HD2 HIS 90 -5.096 -2.468 3.232 643 HE1 HIS 90 HE1 HIS 90 -6.280 -0.318 6.466 644 HE2 HIS 90 HE2 HIS 90 -5.213 -2.423 5.754 645 H ASN 91 H ASN 91 -8.962 -0.588 3.510 646 HA ASN 91 HA ASN 91 -10.826 1.401 3.025 647 HB2 ASN 91 HB2 ASN 91 -10.041 0.092 5.470 648 HB3 ASN 91 HB3 ASN 91 -11.175 1.267 5.500 649 HD21 ASN 91 HD21 ASN 91 -12.505 -2.248 5.118 650 HD22 ASN 91 HD22 ASN 91 -11.160 -1.669 6.044 651 H THR 92 H THR 92 -11.133 3.390 4.219 652 HA THR 92 HA THR 92 -8.845 4.742 5.325 653 HB THR 92 HB THR 92 -8.469 5.244 3.034 654 HG1 THR 92 HG1 THR 92 -7.861 6.983 4.021 655 HG21 THR 92 HG21 THR 92 -10.074 6.417 1.742 656 HG22 THR 92 HG22 THR 92 -11.143 6.322 2.951 657 HG23 THR 92 HG23 THR 92 -10.685 4.983 2.170 658 H SER 93 H SER 93 -9.799 6.742 6.443 659 HA SER 93 HA SER 93 -12.657 6.425 6.772 660 HB2 SER 93 HB2 SER 93 -12.289 7.658 8.899 661 HB3 SER 93 HB3 SER 93 -11.670 6.147 8.861 662 HG SER 93 HG SER 93 -9.703 6.861 8.797 663 H GLN 94 H GLN 94 -10.096 8.725 6.317 664 HA GLN 94 HA GLN 94 -11.799 10.400 4.804 665 HB2 GLN 94 HB2 GLN 94 -12.161 11.114 7.139 666 HB3 GLN 94 HB3 GLN 94 -10.594 11.572 7.169 667 HG2 GLN 94 HG2 GLN 94 -11.024 13.236 5.571 668 HG3 GLN 94 HG3 GLN 94 -12.578 12.748 5.453 669 HE21 GLN 94 HE21 GLN 94 -11.835 15.638 7.902 670 HE22 GLN 94 HE22 GLN 94 -10.946 15.204 6.480 671 H TRP 95 H TRP 95 -10.587 11.580 3.231 672 HA TRP 95 HA TRP 95 -7.812 11.953 3.939 673 HB2 TRP 95 HB2 TRP 95 -7.247 11.660 1.545 674 HB3 TRP 95 HB3 TRP 95 -7.326 10.362 2.534 675 HD1 TRP 95 HD1 TRP 95 -9.756 8.963 2.304 676 HE1 TRP 95 HE1 TRP 95 -11.028 8.275 0.259 677 HE3 TRP 95 HE3 TRP 95 -7.718 12.276 -0.845 678 HZ2 TRP 95 HZ2 TRP 95 -11.009 9.076 -2.437 679 HZ3 TRP 95 HZ3 TRP 95 -8.397 12.241 -3.175 680 HH2 TRP 95 HH2 TRP 95 -10.040 10.654 -3.945 681 H HIS 96 H HIS 96 -6.935 13.980 3.405 682 HA HIS 96 HA HIS 96 -8.748 15.716 2.130 683 HB2 HIS 96 HB2 HIS 96 -8.141 17.353 4.174 684 HB3 HIS 96 HB3 HIS 96 -9.580 16.602 3.987 685 HD1 HIS 96 HD1 HIS 96 -7.972 17.441 6.691 686 HD2 HIS 96 HD2 HIS 96 -8.729 13.690 5.227 687 HE1 HIS 96 HE1 HIS 96 -7.872 15.820 8.572 688 HE2 HIS 96 HE2 HIS 96 -8.302 13.557 7.712 689 H TYR 97 H TYR 97 -7.981 17.809 1.493 690 HA TYR 97 HA TYR 97 -5.145 17.774 1.044 691 HB2 TYR 97 HB2 TYR 97 -7.261 18.802 -0.660 692 HB3 TYR 97 HB3 TYR 97 -5.686 19.078 -0.988 693 HD1 TYR 97 HD1 TYR 97 -8.115 16.374 -0.770 694 HD2 TYR 97 HD2 TYR 97 -4.445 17.574 -2.329 695 HE1 TYR 97 HE1 TYR 97 -8.041 14.380 -2.146 696 HE2 TYR 97 HE2 TYR 97 -4.396 15.603 -3.725 697 HH TYR 97 HH TYR 97 -6.165 12.939 -3.306 698 H TYR 98 H TYR 98 -3.963 19.632 1.480 699 HA TYR 98 HA TYR 98 -5.419 22.040 2.069 700 HB2 TYR 98 HB2 TYR 98 -3.250 21.011 3.693 701 HB3 TYR 98 HB3 TYR 98 -3.947 22.469 3.929 702 HD1 TYR 98 HD1 TYR 98 -4.462 18.923 4.315 703 HD2 TYR 98 HD2 TYR 98 -6.007 22.689 5.158 704 HE1 TYR 98 HE1 TYR 98 -5.999 17.941 5.890 705 HE2 TYR 98 HE2 TYR 98 -7.531 21.707 6.746 706 HH TYR 98 HH TYR 98 -8.612 19.081 6.938 707 H ILE 99 H ILE 99 -3.979 24.014 1.849 708 HA ILE 99 HA ILE 99 -1.418 23.401 0.700 709 HB ILE 99 HB ILE 99 -1.427 25.212 -0.823 710 HG12 ILE 99 HG12 ILE 99 -2.867 26.691 0.312 711 HG13 ILE 99 HG13 ILE 99 -3.168 26.596 -1.290 712 HG21 ILE 99 HG21 ILE 99 -2.966 24.324 -2.458 713 HG22 ILE 99 HG22 ILE 99 -3.690 23.456 -1.302 714 HG23 ILE 99 HG23 ILE 99 -2.164 23.127 -1.725 715 HD11 ILE 99 HD11 ILE 99 -5.203 26.770 -0.085 716 HD12 ILE 99 HD12 ILE 99 -4.847 25.433 0.751 717 HD13 ILE 99 HD13 ILE 99 -5.146 25.339 -0.835 718 H THR 100 H THR 100 0.266 25.045 1.297 719 HA THR 100 HA THR 100 -0.384 26.156 3.814 720 HB THR 100 HB THR 100 1.989 26.798 3.915 721 HG1 THR 100 HG1 THR 100 3.324 26.280 2.266 722 HG21 THR 100 HG21 THR 100 2.851 24.556 4.005 723 HG22 THR 100 HG22 THR 100 1.578 24.016 3.167 724 HG23 THR 100 HG23 THR 100 1.378 24.568 4.674 725 H LYS 101 H LYS 101 -0.283 28.422 4.407 726 HA LYS 101 HA LYS 101 -0.932 30.071 2.182 727 HB2 LYS 101 HB2 LYS 101 -2.144 30.164 4.301 728 HB3 LYS 101 HB3 LYS 101 -0.821 30.857 4.962 729 HG2 LYS 101 HG2 LYS 101 -1.087 32.745 3.636 730 HG3 LYS 101 HG3 LYS 101 -2.311 32.040 2.817 731 HD2 LYS 101 HD2 LYS 101 -3.487 31.899 4.952 732 HD3 LYS 101 HD3 LYS 101 -2.338 32.892 5.553 733 HE2 LYS 101 HE2 LYS 101 -3.198 34.669 4.561 734 HE3 LYS 101 HE3 LYS 101 -3.576 33.838 3.207 735 HZ1 LYS 101 HZ1 LYS 101 -5.560 34.499 4.341 736 HZ2 LYS 101 HZ2 LYS 101 -5.074 33.709 5.665 737 HZ3 LYS 101 HZ3 LYS 101 -5.449 32.886 4.324 738 H LYS 102 H LYS 102 0.808 30.572 0.955 739 HA LYS 102 HA LYS 102 3.215 31.435 2.146 740 HB2 LYS 102 HB2 LYS 102 3.108 30.422 -0.044 741 HB3 LYS 102 HB3 LYS 102 2.414 31.793 -0.598 742 HG2 LYS 102 HG2 LYS 102 4.394 32.994 -0.114 743 HG3 LYS 102 HG3 LYS 102 5.089 31.627 0.447 744 HD2 LYS 102 HD2 LYS 102 4.765 30.662 -1.745 745 HD3 LYS 102 HD3 LYS 102 4.291 32.136 -2.264 746 HE2 LYS 102 HE2 LYS 102 6.428 33.022 -1.798 747 HE3 LYS 102 HE3 LYS 102 6.908 31.593 -1.170 748 HZ1 LYS 102 HZ1 LYS 102 7.724 31.828 -3.386 749 HZ2 LYS 102 HZ2 LYS 102 6.213 32.003 -3.934 750 HZ3 LYS 102 HZ3 LYS 102 6.688 30.588 -3.313 751 H GLY 103 H GLY 103 3.691 33.478 2.963 752 HA2 GLY 103 HA2 GLY 103 3.582 35.784 2.758 753 HA3 GLY 103 HA3 GLY 103 2.323 35.666 1.725 754 H TRP 104 H TRP 104 2.084 33.916 4.619 755 HA TRP 104 HA TRP 104 -0.214 35.063 5.444 756 HB2 TRP 104 HB2 TRP 104 0.481 34.173 7.712 757 HB3 TRP 104 HB3 TRP 104 0.293 33.097 6.498 758 HD1 TRP 104 HD1 TRP 104 3.378 35.125 7.383 759 HE1 TRP 104 HE1 TRP 104 5.426 33.699 7.588 760 HE3 TRP 104 HE3 TRP 104 1.141 30.709 6.661 761 HZ2 TRP 104 HZ2 TRP 104 5.929 30.933 7.470 762 HZ3 TRP 104 HZ3 TRP 104 2.482 28.694 6.732 763 HH2 TRP 104 HH2 TRP 104 4.857 28.818 7.151 764 H ASP 105 H ASP 105 -0.937 36.684 6.832 765 HA ASP 105 HA ASP 105 0.762 38.882 6.996 766 HB2 ASP 105 HB2 ASP 105 -1.741 38.575 8.434 767 HB3 ASP 105 HB3 ASP 105 -1.051 40.001 8.037 768 HA PRO 106 HA PRO 106 2.340 37.815 10.969 769 HB2 PRO 106 HB2 PRO 106 3.770 39.955 11.638 770 HB3 PRO 106 HB3 PRO 106 4.315 39.008 10.425 771 HG2 PRO 106 HG2 PRO 106 2.794 41.418 10.207 772 HG3 PRO 106 HG3 PRO 106 4.158 41.024 9.399 773 HD2 PRO 106 HD2 PRO 106 1.827 40.684 8.272 774 HD3 PRO 106 HD3 PRO 106 3.043 39.639 7.962 775 H ASP 107 H ASP 107 0.352 40.421 10.453 776 HA ASP 107 HA ASP 107 -0.196 41.155 13.083 777 HB2 ASP 107 HB2 ASP 107 -0.907 42.625 11.425 778 HB3 ASP 107 HB3 ASP 107 -1.600 41.424 10.562 779 H LYS 108 H LYS 108 -1.225 38.593 11.132 780 HA LYS 108 HA LYS 108 -3.412 37.897 12.903 781 HB2 LYS 108 HB2 LYS 108 -2.823 36.931 10.246 782 HB3 LYS 108 HB3 LYS 108 -4.158 36.537 11.100 783 HG2 LYS 108 HG2 LYS 108 -4.984 38.709 10.952 784 HG3 LYS 108 HG3 LYS 108 -3.573 39.260 10.342 785 HD2 LYS 108 HD2 LYS 108 -4.050 37.807 8.412 786 HD3 LYS 108 HD3 LYS 108 -5.575 37.744 8.995 787 HE2 LYS 108 HE2 LYS 108 -5.905 39.999 8.683 788 HE3 LYS 108 HE3 LYS 108 -4.302 40.296 8.577 789 HZ1 LYS 108 HZ1 LYS 108 -5.314 40.501 6.445 790 HZ2 LYS 108 HZ2 LYS 108 -5.850 38.978 6.539 791 HZ3 LYS 108 HZ3 LYS 108 -4.263 39.272 6.433 792 HA PRO 109 HA PRO 109 -1.056 34.788 14.608 793 HB2 PRO 109 HB2 PRO 109 -2.799 32.857 15.274 794 HB3 PRO 109 HB3 PRO 109 -2.786 34.259 16.112 795 HG2 PRO 109 HG2 PRO 109 -4.501 33.544 13.937 796 HG3 PRO 109 HG3 PRO 109 -4.929 34.201 15.370 797 HD2 PRO 109 HD2 PRO 109 -4.686 35.723 13.309 798 HD3 PRO 109 HD3 PRO 109 -4.196 36.272 14.767 799 H LEU 110 H LEU 110 0.446 34.096 13.383 800 HA LEU 110 HA LEU 110 0.096 32.743 11.049 801 HB2 LEU 110 HB2 LEU 110 2.137 33.798 11.927 802 HB3 LEU 110 HB3 LEU 110 2.373 32.445 12.811 803 HG LEU 110 HG LEU 110 2.451 32.368 9.960 804 HD11 LEU 110 HD11 LEU 110 4.895 32.642 10.201 805 HD12 LEU 110 HD12 LEU 110 4.701 32.836 11.795 806 HD13 LEU 110 HD13 LEU 110 4.142 33.955 10.770 807 HD21 LEU 110 HD21 LEU 110 3.772 30.414 10.190 808 HD22 LEU 110 HD22 LEU 110 2.329 30.213 10.891 809 HD23 LEU 110 HD23 LEU 110 3.635 30.501 11.799 810 H LYS 111 H LYS 111 0.475 31.361 14.210 811 HA LYS 111 HA LYS 111 0.623 28.768 13.257 812 HB2 LYS 111 HB2 LYS 111 -0.017 29.689 15.938 813 HB3 LYS 111 HB3 LYS 111 0.289 28.119 15.608 814 HG2 LYS 111 HG2 LYS 111 2.502 28.849 14.825 815 HG3 LYS 111 HG3 LYS 111 2.168 30.298 15.501 816 HD2 LYS 111 HD2 LYS 111 2.199 27.856 17.034 817 HD3 LYS 111 HD3 LYS 111 3.510 28.821 16.906 818 HE2 LYS 111 HE2 LYS 111 2.224 30.600 17.922 819 HE3 LYS 111 HE3 LYS 111 1.019 29.527 18.173 820 HZ1 LYS 111 HZ1 LYS 111 2.334 29.753 20.142 821 HZ2 LYS 111 HZ2 LYS 111 3.655 29.307 19.323 822 HZ3 LYS 111 HZ3 LYS 111 2.461 28.245 19.571 823 H ARG 112 H ARG 112 -2.053 30.667 13.366 824 HA ARG 112 HA ARG 112 -3.794 28.401 13.298 825 HB2 ARG 112 HB2 ARG 112 -4.350 31.224 13.369 826 HB3 ARG 112 HB3 ARG 112 -5.545 30.180 12.979 827 HG2 ARG 112 HG2 ARG 112 -5.232 29.139 15.136 828 HG3 ARG 112 HG3 ARG 112 -4.209 30.356 15.512 829 HD2 ARG 112 HD2 ARG 112 -5.992 31.926 15.126 830 HD3 ARG 112 HD3 ARG 112 -7.005 30.674 14.859 831 HE ARG 112 HE ARG 112 -5.913 30.307 17.357 832 HH11 ARG 112 HH11 ARG 112 -8.167 32.503 15.779 833 HH12 ARG 112 HH12 ARG 112 -8.984 32.870 17.261 834 HH21 ARG 112 HH21 ARG 112 -7.008 30.832 19.214 835 HH22 ARG 112 HH22 ARG 112 -8.339 31.940 19.171 836 H ALA 113 H ALA 113 -2.682 30.994 11.382 837 HA ALA 113 HA ALA 113 -4.325 30.334 9.188 838 HB1 ALA 113 HB1 ALA 113 -3.995 32.707 9.843 839 HB2 ALA 113 HB2 ALA 113 -3.553 32.514 8.299 840 HB3 ALA 113 HB3 ALA 113 -2.429 32.582 9.460 841 H ASP 114 H ASP 114 -1.742 28.838 9.937 842 HA ASP 114 HA ASP 114 -0.073 29.357 7.806 843 HB2 ASP 114 HB2 ASP 114 1.198 27.406 8.582 844 HB3 ASP 114 HB3 ASP 114 0.835 28.421 9.808 845 H PHE 115 H PHE 115 -2.596 27.036 8.097 846 HA PHE 115 HA PHE 115 -2.125 26.433 5.336 847 HB2 PHE 115 HB2 PHE 115 -2.913 24.180 5.633 848 HB3 PHE 115 HB3 PHE 115 -1.609 24.461 6.575 849 HD1 PHE 115 HD1 PHE 115 -1.730 24.259 8.953 850 HD2 PHE 115 HD2 PHE 115 -5.194 24.074 6.662 851 HE1 PHE 115 HE1 PHE 115 -2.962 23.523 10.886 852 HE2 PHE 115 HE2 PHE 115 -6.441 23.344 8.590 853 HZ PHE 115 HZ PHE 115 -5.324 23.066 10.709 854 H GLU 116 H GLU 116 -3.956 25.872 3.964 855 HA GLU 116 HA GLU 116 -6.527 26.594 5.083 856 HB2 GLU 116 HB2 GLU 116 -5.618 27.471 2.496 857 HB3 GLU 116 HB3 GLU 116 -7.137 27.687 3.055 858 HG2 GLU 116 HG2 GLU 116 -6.206 29.066 4.834 859 HG3 GLU 116 HG3 GLU 116 -4.757 28.961 4.089 860 H LEU 117 H LEU 117 -8.337 25.314 4.223 861 HA LEU 117 HA LEU 117 -7.444 22.835 3.129 862 HB2 LEU 117 HB2 LEU 117 -9.057 22.792 4.892 863 HB3 LEU 117 HB3 LEU 117 -10.110 23.618 3.956 864 HG LEU 117 HG LEU 117 -9.346 21.168 2.841 865 HD11 LEU 117 HD11 LEU 117 -10.633 19.788 4.326 866 HD12 LEU 117 HD12 LEU 117 -10.868 21.056 5.301 867 HD13 LEU 117 HD13 LEU 117 -9.383 20.444 5.114 868 HD21 LEU 117 HD21 LEU 117 -11.715 20.980 2.417 869 HD22 LEU 117 HD22 LEU 117 -11.182 22.429 1.938 870 HD23 LEU 117 HD23 LEU 117 -11.984 22.285 3.334 871 H ILE 118 H ILE 118 -7.700 22.054 1.067 872 HA ILE 118 HA ILE 118 -9.287 23.707 -0.695 873 HB ILE 118 HB ILE 118 -6.886 24.039 -1.052 874 HG12 ILE 118 HG12 ILE 118 -8.018 23.004 -3.459 875 HG13 ILE 118 HG13 ILE 118 -8.575 24.391 -2.801 876 HG21 ILE 118 HG21 ILE 118 -5.586 22.341 -2.108 877 HG22 ILE 118 HG22 ILE 118 -6.817 21.303 -1.967 878 HG23 ILE 118 HG23 ILE 118 -6.072 21.857 -0.643 879 HD11 ILE 118 HD11 ILE 118 -6.982 24.888 -4.527 880 HD12 ILE 118 HD12 ILE 118 -5.855 24.022 -3.755 881 HD13 ILE 118 HD13 ILE 118 -6.407 25.396 -3.103 882 H GLY 119 H GLY 119 -9.239 20.818 0.687 883 HA2 GLY 119 HA2 GLY 119 -11.428 19.979 -0.713 884 HA3 GLY 119 HA3 GLY 119 -10.157 19.216 -1.399 885 H ALA 120 H ALA 120 -12.348 17.935 -0.122 886 HA ALA 120 HA ALA 120 -10.840 16.323 1.678 887 HB1 ALA 120 HB1 ALA 120 -11.791 17.905 3.227 888 HB2 ALA 120 HB2 ALA 120 -12.483 16.464 3.472 889 HB3 ALA 120 HB3 ALA 120 -13.272 17.609 2.648 890 H VAL 121 H VAL 121 -11.448 14.167 1.570 891 HA VAL 121 HA VAL 121 -13.959 13.624 0.289 892 HB VAL 121 HB VAL 121 -11.540 12.147 -0.362 893 HG11 VAL 121 HG11 VAL 121 -12.892 10.955 -1.971 894 HG12 VAL 121 HG12 VAL 121 -14.200 11.763 -1.473 895 HG13 VAL 121 HG13 VAL 121 -13.469 10.718 -0.479 896 HG21 VAL 121 HG21 VAL 121 -11.715 13.109 -2.584 897 HG22 VAL 121 HG22 VAL 121 -11.536 14.288 -1.492 898 HG23 VAL 121 HG23 VAL 121 -12.996 13.975 -2.112 899 HA PRO 122 HA PRO 122 -13.686 11.127 3.976 900 HB2 PRO 122 HB2 PRO 122 -16.194 11.072 4.761 901 HB3 PRO 122 HB3 PRO 122 -15.389 12.484 4.923 902 HG2 PRO 122 HG2 PRO 122 -17.156 11.714 2.812 903 HG3 PRO 122 HG3 PRO 122 -17.155 13.116 3.649 904 HD2 PRO 122 HD2 PRO 122 -15.983 12.932 1.296 905 HD3 PRO 122 HD3 PRO 122 -15.439 13.974 2.429 906 H HIS 123 H HIS 123 -14.507 9.027 4.744 907 HA HIS 123 HA HIS 123 -15.673 7.473 2.586 908 HB2 HIS 123 HB2 HIS 123 -13.364 6.952 2.575 909 HB3 HIS 123 HB3 HIS 123 -13.377 6.727 4.192 910 HD1 HIS 123 HD1 HIS 123 -15.637 4.713 4.599 911 HD2 HIS 123 HD2 HIS 123 -12.783 4.457 1.667 912 HE1 HIS 123 HE1 HIS 123 -15.489 2.348 3.845 913 HE2 HIS 123 HE2 HIS 123 -13.767 2.168 2.086 914 H ASP 124 H ASP 124 -17.524 7.009 3.146 915 HA ASP 124 HA ASP 124 -18.037 5.359 5.404 916 HB2 ASP 124 HB2 ASP 124 -18.181 7.393 6.535 917 HB3 ASP 124 HB3 ASP 124 -19.220 7.968 5.414 918 H GLY 125 H GLY 125 -20.570 7.284 4.378 919 HA2 GLY 125 HA2 GLY 125 -21.515 5.391 2.447 920 HA3 GLY 125 HA3 GLY 125 -22.369 6.629 3.086 921 H SER 126 H SER 126 -19.250 6.683 1.569 922 HA SER 126 HA SER 126 -19.983 8.968 0.151 923 HB2 SER 126 HB2 SER 126 -17.709 8.739 0.903 924 HB3 SER 126 HB3 SER 126 -17.504 7.445 -0.072 925 HG SER 126 HG SER 126 -17.474 8.663 -1.814 926 HA PRO 127 HA PRO 127 -21.178 6.924 -3.566 927 HB2 PRO 127 HB2 PRO 127 -21.574 8.998 -5.176 928 HB3 PRO 127 HB3 PRO 127 -22.621 8.782 -3.940 929 HG2 PRO 127 HG2 PRO 127 -20.340 10.483 -4.010 930 HG3 PRO 127 HG3 PRO 127 -21.864 10.874 -3.574 931 HD2 PRO 127 HD2 PRO 127 -20.119 10.295 -1.744 932 HD3 PRO 127 HD3 PRO 127 -21.673 9.833 -1.548 933 H ALA 128 H ALA 128 -20.601 7.077 -6.021 934 HA ALA 128 HA ALA 128 -17.999 6.299 -6.152 935 HB1 ALA 128 HB1 ALA 128 -19.707 5.665 -7.804 936 HB2 ALA 128 HB2 ALA 128 -18.381 6.184 -8.570 937 HB3 ALA 128 HB3 ALA 128 -19.659 7.162 -8.414 938 H SER 129 H SER 129 -19.030 9.440 -6.111 939 HA SER 129 HA SER 129 -17.102 10.702 -7.574 940 HB2 SER 129 HB2 SER 129 -18.121 11.847 -5.097 941 HB3 SER 129 HB3 SER 129 -17.885 12.640 -6.505 942 HG SER 129 HG SER 129 -19.613 11.523 -7.398 943 H ARG 130 H ARG 130 -16.640 8.969 -4.816 944 HA ARG 130 HA ARG 130 -14.436 10.232 -3.770 945 HB2 ARG 130 HB2 ARG 130 -14.147 8.187 -2.496 946 HB3 ARG 130 HB3 ARG 130 -15.728 8.592 -2.545 947 HG2 ARG 130 HG2 ARG 130 -16.050 6.960 -4.286 948 HG3 ARG 130 HG3 ARG 130 -14.490 6.509 -4.111 949 HD2 ARG 130 HD2 ARG 130 -14.895 5.777 -1.922 950 HD3 ARG 130 HD3 ARG 130 -16.419 6.364 -1.971 951 HE ARG 130 HE ARG 130 -17.161 4.523 -3.071 952 HH11 ARG 130 HH11 ARG 130 -16.971 2.454 -3.809 953 HH12 ARG 130 HH12 ARG 130 -15.412 1.744 -4.064 954 HH21 ARG 130 HH21 ARG 130 -13.635 4.518 -3.054 955 HH22 ARG 130 HH22 ARG 130 -13.554 2.891 -3.645 956 H ASN 131 H ASN 131 -14.218 9.545 -6.675 957 HA ASN 131 HA ASN 131 -12.285 7.665 -7.014 958 HB2 ASN 131 HB2 ASN 131 -12.925 9.993 -8.612 959 HB3 ASN 131 HB3 ASN 131 -11.765 8.957 -9.110 960 HD21 ASN 131 HD21 ASN 131 -15.343 8.250 -10.289 961 HD22 ASN 131 HD22 ASN 131 -14.654 9.782 -9.869 962 H LEU 132 H LEU 132 -10.056 7.611 -7.173 963 HA LEU 132 HA LEU 132 -8.748 9.342 -5.454 964 HB2 LEU 132 HB2 LEU 132 -7.822 7.209 -7.131 965 HB3 LEU 132 HB3 LEU 132 -6.719 8.127 -6.350 966 HG LEU 132 HG LEU 132 -6.971 6.112 -5.260 967 HD11 LEU 132 HD11 LEU 132 -7.459 6.893 -3.014 968 HD12 LEU 132 HD12 LEU 132 -8.109 8.237 -3.635 969 HD13 LEU 132 HD13 LEU 132 -6.525 7.955 -3.799 970 HD21 LEU 132 HD21 LEU 132 -9.016 5.405 -4.209 971 HD22 LEU 132 HD22 LEU 132 -9.184 5.470 -5.816 972 HD23 LEU 132 HD23 LEU 132 -9.790 6.650 -4.892 973 H SER 133 H SER 133 -9.456 9.681 -8.654 974 HA SER 133 HA SER 133 -7.310 11.549 -9.114 975 HB2 SER 133 HB2 SER 133 -7.836 10.017 -10.910 976 HB3 SER 133 HB3 SER 133 -9.294 10.738 -11.052 977 HG SER 133 HG SER 133 -7.637 11.475 -12.497 978 H HIS 134 H HIS 134 -7.632 13.700 -8.713 979 HA HIS 134 HA HIS 134 -10.349 14.656 -8.658 980 HB2 HIS 134 HB2 HIS 134 -9.395 14.121 -6.391 981 HB3 HIS 134 HB3 HIS 134 -8.503 15.473 -6.594 982 HD1 HIS 134 HD1 HIS 134 -9.691 17.825 -6.447 983 HD2 HIS 134 HD2 HIS 134 -12.073 14.557 -5.777 984 HE1 HIS 134 HE1 HIS 134 -11.849 18.603 -5.481 985 HE2 HIS 134 HE2 HIS 134 -13.297 16.647 -5.061 986 H HIS 135 H HIS 135 -10.734 16.737 -9.351 987 HA HIS 135 HA HIS 135 -8.490 17.994 -10.624 988 HB2 HIS 135 HB2 HIS 135 -11.304 18.638 -10.765 989 HB3 HIS 135 HB3 HIS 135 -10.161 19.447 -11.605 990 HD1 HIS 135 HD1 HIS 135 -9.649 18.675 -13.945 991 HD2 HIS 135 HD2 HIS 135 -11.520 15.843 -11.649 992 HE1 HIS 135 HE1 HIS 135 -10.158 16.710 -15.377 993 HE2 HIS 135 HE2 HIS 135 -11.281 14.985 -14.014 994 H ILE 136 H ILE 136 -7.453 19.812 -9.839 995 HA ILE 136 HA ILE 136 -8.778 21.295 -7.738 996 HB ILE 136 HB ILE 136 -5.960 20.556 -7.723 997 HG12 ILE 136 HG12 ILE 136 -7.404 18.836 -6.904 998 HG13 ILE 136 HG13 ILE 136 -6.319 19.337 -5.792 999 HG21 ILE 136 HG21 ILE 136 -5.711 21.833 -5.682 1000 HG22 ILE 136 HG22 ILE 136 -7.240 22.343 -5.815 1001 HG23 ILE 136 HG23 ILE 136 -6.136 22.805 -6.903 1002 HD11 ILE 136 HD11 ILE 136 -8.462 18.998 -4.747 1003 HD12 ILE 136 HD12 ILE 136 -9.139 20.066 -5.754 1004 HD13 ILE 136 HD13 ILE 136 -8.064 20.562 -4.653 1005 H TYR 137 H TYR 137 -8.892 23.519 -8.307 1006 HA TYR 137 HA TYR 137 -7.210 24.327 -10.493 1007 HB2 TYR 137 HB2 TYR 137 -9.566 24.895 -10.547 1008 HB3 TYR 137 HB3 TYR 137 -9.292 25.924 -9.309 1009 HD1 TYR 137 HD1 TYR 137 -7.878 27.979 -9.678 1010 HD2 TYR 137 HD2 TYR 137 -9.022 25.506 -12.823 1011 HE1 TYR 137 HE1 TYR 137 -7.214 29.677 -11.262 1012 HE2 TYR 137 HE2 TYR 137 -8.370 27.215 -14.401 1013 HH TYR 137 HH TYR 137 -7.245 29.161 -14.716 1014 H ILE 138 H ILE 138 -5.404 25.629 -10.235 1015 HA ILE 138 HA ILE 138 -5.161 26.866 -7.654 1016 HB ILE 138 HB ILE 138 -2.889 25.834 -9.173 1017 HG12 ILE 138 HG12 ILE 138 -3.923 24.772 -6.702 1018 HG13 ILE 138 HG13 ILE 138 -4.238 24.111 -8.161 1019 HG21 ILE 138 HG21 ILE 138 -1.538 26.444 -7.249 1020 HG22 ILE 138 HG22 ILE 138 -2.842 27.066 -6.522 1021 HG23 ILE 138 HG23 ILE 138 -2.246 27.766 -7.852 1022 HD11 ILE 138 HD11 ILE 138 -2.509 22.870 -7.058 1023 HD12 ILE 138 HD12 ILE 138 -1.599 24.202 -6.954 1024 HD13 ILE 138 HD13 ILE 138 -1.911 23.547 -8.399 1025 HA PRO 139 HA PRO 139 -4.831 30.287 -10.518 1026 HB2 PRO 139 HB2 PRO 139 -5.315 32.306 -8.893 1027 HB3 PRO 139 HB3 PRO 139 -6.576 31.406 -9.412 1028 HG2 PRO 139 HG2 PRO 139 -5.180 31.195 -6.935 1029 HG3 PRO 139 HG3 PRO 139 -6.796 31.222 -7.175 1030 HD2 PRO 139 HD2 PRO 139 -5.553 28.950 -6.834 1031 HD3 PRO 139 HD3 PRO 139 -6.851 29.035 -7.822 1032 H GLU 140 H GLU 140 -3.137 31.729 -11.003 1033 HA GLU 140 HA GLU 140 -1.041 31.716 -9.052 1034 HB2 GLU 140 HB2 GLU 140 -0.731 29.818 -10.576 1035 HB3 GLU 140 HB3 GLU 140 -0.465 30.905 -11.765 1036 HG2 GLU 140 HG2 GLU 140 1.565 30.109 -10.963 1037 HG3 GLU 140 HG3 GLU 140 1.423 31.698 -10.613 1038 H ASP 141 H ASP 141 -1.115 33.800 -8.601 1039 HA ASP 141 HA ASP 141 -0.990 35.687 -10.741 1040 HB2 ASP 141 HB2 ASP 141 -1.494 37.332 -9.038 1041 HB3 ASP 141 HB3 ASP 141 -2.573 36.108 -8.963 1042 H ARG 142 H ARG 142 1.203 33.952 -9.386 1043 HA ARG 142 HA ARG 142 3.237 35.985 -9.267 1044 HB2 ARG 142 HB2 ARG 142 2.822 34.074 -7.115 1045 HB3 ARG 142 HB3 ARG 142 4.068 35.128 -7.170 1046 HG2 ARG 142 HG2 ARG 142 2.625 36.928 -6.905 1047 HG3 ARG 142 HG3 ARG 142 1.324 35.948 -7.021 1048 HD2 ARG 142 HD2 ARG 142 2.251 34.910 -4.934 1049 HD3 ARG 142 HD3 ARG 142 3.028 36.339 -4.784 1050 HE ARG 142 HE ARG 142 0.321 36.753 -5.395 1051 HH11 ARG 142 HH11 ARG 142 -1.092 37.509 -3.942 1052 HH12 ARG 142 HH12 ARG 142 -0.724 37.507 -2.249 1053 HH21 ARG 142 HH21 ARG 142 2.399 36.083 -2.630 1054 HH22 ARG 142 HH22 ARG 142 1.234 36.707 -1.511 1055 H LEU 143 H LEU 143 5.480 34.806 -8.851 1056 HA LEU 143 HA LEU 143 5.449 32.277 -10.280 1057 HB2 LEU 143 HB2 LEU 143 7.363 34.377 -10.524 1058 HB3 LEU 143 HB3 LEU 143 7.740 32.841 -10.929 1059 HG LEU 143 HG LEU 143 5.847 33.027 -12.526 1060 HD11 LEU 143 HD11 LEU 143 5.396 35.201 -13.396 1061 HD12 LEU 143 HD12 LEU 143 6.285 35.861 -12.218 1062 HD13 LEU 143 HD13 LEU 143 4.909 35.092 -11.858 1063 HD21 LEU 143 HD21 LEU 143 7.378 33.940 -14.203 1064 HD22 LEU 143 HD22 LEU 143 8.165 32.906 -13.240 1065 HD23 LEU 143 HD23 LEU 143 8.325 34.500 -13.017 1066 H GLY 144 H GLY 144 6.279 30.586 -8.971 1067 HA2 GLY 144 HA2 GLY 144 8.376 30.467 -7.493 1068 HA3 GLY 144 HA3 GLY 144 7.480 31.415 -6.510 1069 H TYR 145 H TYR 145 8.221 29.572 -5.104 1070 HA TYR 145 HA TYR 145 6.890 27.162 -5.557 1071 HB2 TYR 145 HB2 TYR 145 8.020 26.525 -3.407 1072 HB3 TYR 145 HB3 TYR 145 9.033 26.988 -4.600 1073 HD1 TYR 145 HD1 TYR 145 10.338 29.045 -4.425 1074 HD2 TYR 145 HD2 TYR 145 7.625 27.995 -1.446 1075 HE1 TYR 145 HE1 TYR 145 11.229 30.778 -2.997 1076 HE2 TYR 145 HE2 TYR 145 8.525 29.722 -0.019 1077 HH TYR 145 HH TYR 145 10.568 32.176 -1.088 1078 H HIS 146 H HIS 146 5.418 26.000 -4.412 1079 HA HIS 146 HA HIS 146 3.933 27.382 -2.341 1080 HB2 HIS 146 HB2 HIS 146 2.708 25.944 -4.518 1081 HB3 HIS 146 HB3 HIS 146 1.892 26.534 -3.232 1082 HD1 HIS 146 HD1 HIS 146 0.990 28.912 -3.325 1083 HD2 HIS 146 HD2 HIS 146 3.674 28.013 -6.290 1084 HE1 HIS 146 HE1 HIS 146 0.968 30.750 -5.004 1085 HE2 HIS 146 HE2 HIS 146 2.584 30.233 -6.788 1086 H VAL 147 H VAL 147 2.884 25.688 -0.841 1087 HA VAL 147 HA VAL 147 4.026 23.071 -1.278 1088 HB VAL 147 HB VAL 147 3.603 24.207 1.370 1089 HG11 VAL 147 HG11 VAL 147 4.770 22.286 2.223 1090 HG12 VAL 147 HG12 VAL 147 4.887 21.686 0.726 1091 HG13 VAL 147 HG13 VAL 147 3.439 21.820 1.433 1092 HG21 VAL 147 HG21 VAL 147 5.998 24.389 1.548 1093 HG22 VAL 147 HG22 VAL 147 5.463 25.300 0.325 1094 HG23 VAL 147 HG23 VAL 147 6.153 23.869 0.025 1095 H ILE 148 H ILE 148 2.650 21.356 -1.292 1096 HA ILE 148 HA ILE 148 -0.117 21.877 -0.623 1097 HB ILE 148 HB ILE 148 0.916 19.795 -2.381 1098 HG12 ILE 148 HG12 ILE 148 -0.555 22.133 -3.210 1099 HG13 ILE 148 HG13 ILE 148 1.075 22.050 -3.279 1100 HG21 ILE 148 HG21 ILE 148 -1.397 19.330 -2.943 1101 HG22 ILE 148 HG22 ILE 148 -1.887 20.439 -1.874 1102 HG23 ILE 148 HG23 ILE 148 -1.161 19.087 -1.362 1103 HD11 ILE 148 HD11 ILE 148 0.143 21.626 -5.440 1104 HD12 ILE 148 HD12 ILE 148 -0.704 20.383 -4.847 1105 HD13 ILE 148 HD13 ILE 148 0.909 20.302 -4.915 1106 H LEU 149 H LEU 149 -1.050 20.656 1.067 1107 HA LEU 149 HA LEU 149 0.649 18.609 2.246 1108 HB2 LEU 149 HB2 LEU 149 0.501 20.551 3.604 1109 HB3 LEU 149 HB3 LEU 149 -1.127 20.423 3.607 1110 HG LEU 149 HG LEU 149 0.331 18.298 4.773 1111 HD11 LEU 149 HD11 LEU 149 0.511 19.518 6.875 1112 HD12 LEU 149 HD12 LEU 149 -0.066 20.842 6.147 1113 HD13 LEU 149 HD13 LEU 149 1.384 20.257 5.731 1114 HD21 LEU 149 HD21 LEU 149 -1.521 18.196 6.291 1115 HD22 LEU 149 HD22 LEU 149 -2.044 18.113 4.763 1116 HD23 LEU 149 HD23 LEU 149 -2.174 19.498 5.587 1117 H ALA 150 H ALA 150 -0.208 16.606 2.677 1118 HA ALA 150 HA ALA 150 -3.019 16.346 2.153 1119 HB1 ALA 150 HB1 ALA 150 -1.817 15.517 0.223 1120 HB2 ALA 150 HB2 ALA 150 -2.589 14.287 0.933 1121 HB3 ALA 150 HB3 ALA 150 -1.001 14.486 1.164 1122 H VAL 151 H VAL 151 -4.221 14.887 3.299 1123 HA VAL 151 HA VAL 151 -2.839 13.536 5.434 1124 HB VAL 151 HB VAL 151 -5.452 14.835 5.651 1125 HG11 VAL 151 HG11 VAL 151 -5.506 14.153 7.948 1126 HG12 VAL 151 HG12 VAL 151 -4.124 13.339 7.745 1127 HG13 VAL 151 HG13 VAL 151 -5.466 12.855 6.985 1128 HG21 VAL 151 HG21 VAL 151 -4.423 16.324 7.230 1129 HG22 VAL 151 HG22 VAL 151 -3.681 16.437 5.798 1130 HG23 VAL 151 HG23 VAL 151 -2.999 15.595 6.997 1131 H TRP 152 H TRP 152 -3.294 11.342 5.627 1132 HA TRP 152 HA TRP 152 -5.676 10.386 4.308 1133 HB2 TRP 152 HB2 TRP 152 -3.799 9.790 2.970 1134 HB3 TRP 152 HB3 TRP 152 -3.132 9.022 4.248 1135 HD1 TRP 152 HD1 TRP 152 -4.539 6.761 5.087 1136 HE1 TRP 152 HE1 TRP 152 -5.773 4.990 3.821 1137 HE3 TRP 152 HE3 TRP 152 -5.178 9.356 0.859 1138 HZ2 TRP 152 HZ2 TRP 152 -6.872 4.815 1.230 1139 HZ3 TRP 152 HZ3 TRP 152 -6.379 8.325 -0.973 1140 HH2 TRP 152 HH2 TRP 152 -7.204 6.062 -0.780 1141 H ASP 153 H ASP 153 -6.968 10.047 6.058 1142 HA ASP 153 HA ASP 153 -5.885 8.799 8.358 1143 HB2 ASP 153 HB2 ASP 153 -8.587 9.679 7.827 1144 HB3 ASP 153 HB3 ASP 153 -8.105 9.096 9.275 1145 H VAL 154 H VAL 154 -6.055 6.660 8.916 1146 HA VAL 154 HA VAL 154 -7.351 4.973 7.023 1147 HB VAL 154 HB VAL 154 -6.116 3.814 9.327 1148 HG11 VAL 154 HG11 VAL 154 -5.309 2.201 7.724 1149 HG12 VAL 154 HG12 VAL 154 -5.936 3.081 6.521 1150 HG13 VAL 154 HG13 VAL 154 -6.912 2.359 7.590 1151 HG21 VAL 154 HG21 VAL 154 -3.880 4.129 8.443 1152 HG22 VAL 154 HG22 VAL 154 -4.540 5.565 8.786 1153 HG23 VAL 154 HG23 VAL 154 -4.478 5.048 7.255 1154 H ALA 155 H ALA 155 -8.891 3.226 7.742 1155 HA ALA 155 HA ALA 155 -10.548 4.206 9.890 1156 HB1 ALA 155 HB1 ALA 155 -11.710 3.803 7.810 1157 HB2 ALA 155 HB2 ALA 155 -12.279 2.781 8.927 1158 HB3 ALA 155 HB3 ALA 155 -11.222 2.261 7.819 1159 H ASP 156 H ASP 156 -8.498 1.723 8.946 1160 HA ASP 156 HA ASP 156 -9.503 -0.170 10.765 1161 HB2 ASP 156 HB2 ASP 156 -7.068 -0.584 9.226 1162 HB3 ASP 156 HB3 ASP 156 -8.189 -1.716 9.583 1163 H THR 157 H THR 157 -7.481 2.286 11.249 1164 HA THR 157 HA THR 157 -6.430 1.089 13.562 1165 HB THR 157 HB THR 157 -4.641 0.492 11.996 1166 HG1 THR 157 HG1 THR 157 -4.247 1.565 14.240 1167 HG21 THR 157 HG21 THR 157 -3.357 2.170 10.911 1168 HG22 THR 157 HG22 THR 157 -4.299 3.326 11.536 1169 HG23 THR 157 HG23 THR 157 -4.896 2.304 10.435 1170 H GLU 158 H GLU 158 -5.231 2.541 15.011 1171 HA GLU 158 HA GLU 158 -6.554 4.963 15.333 1172 HB2 GLU 158 HB2 GLU 158 -5.666 3.709 17.174 1173 HB3 GLU 158 HB3 GLU 158 -4.153 3.883 16.585 1174 HG2 GLU 158 HG2 GLU 158 -4.409 5.234 18.455 1175 HG3 GLU 158 HG3 GLU 158 -4.212 6.178 17.137 1176 H ASN 159 H ASN 159 -3.750 4.165 13.634 1177 HA ASN 159 HA ASN 159 -2.666 6.773 13.789 1178 HB2 ASN 159 HB2 ASN 159 -1.731 4.337 12.527 1179 HB3 ASN 159 HB3 ASN 159 -0.957 5.742 12.216 1180 HD21 ASN 159 HD21 ASN 159 0.890 4.030 14.849 1181 HD22 ASN 159 HD22 ASN 159 0.476 3.714 13.197 1182 H ALA 160 H ALA 160 -1.840 7.864 11.777 1183 HA ALA 160 HA ALA 160 -3.593 7.534 9.504 1184 HB1 ALA 160 HB1 ALA 160 -4.589 9.306 10.722 1185 HB2 ALA 160 HB2 ALA 160 -3.919 9.916 9.383 1186 HB3 ALA 160 HB3 ALA 160 -3.173 10.081 10.808 1187 H PHE 161 H PHE 161 -2.620 9.167 7.722 1188 HA PHE 161 HA PHE 161 0.262 9.076 7.939 1189 HB2 PHE 161 HB2 PHE 161 -1.145 8.648 5.461 1190 HB3 PHE 161 HB3 PHE 161 0.456 8.437 5.710 1191 HD1 PHE 161 HD1 PHE 161 -2.408 6.714 5.239 1192 HD2 PHE 161 HD2 PHE 161 0.929 6.652 7.712 1193 HE1 PHE 161 HE1 PHE 161 -2.759 4.363 5.646 1194 HE2 PHE 161 HE2 PHE 161 0.544 4.327 8.179 1195 HZ PHE 161 HZ PHE 161 -1.282 3.168 7.133 1196 H TYR 162 H TYR 162 1.380 10.927 7.278 1197 HA TYR 162 HA TYR 162 -0.237 13.036 6.126 1198 HB2 TYR 162 HB2 TYR 162 1.754 13.540 8.157 1199 HB3 TYR 162 HB3 TYR 162 0.705 14.634 7.549 1200 HD1 TYR 162 HD1 TYR 162 1.303 12.769 10.324 1201 HD2 TYR 162 HD2 TYR 162 -1.880 13.882 7.894 1202 HE1 TYR 162 HE1 TYR 162 -0.248 12.247 12.109 1203 HE2 TYR 162 HE2 TYR 162 -3.418 13.390 9.693 1204 HH TYR 162 HH TYR 162 -3.724 12.486 11.692 1205 H GLN 163 H GLN 163 0.755 14.149 4.414 1206 HA GLN 163 HA GLN 163 3.590 13.925 4.139 1207 HB2 GLN 163 HB2 GLN 163 3.449 13.102 1.872 1208 HB3 GLN 163 HB3 GLN 163 3.016 12.000 2.996 1209 HG2 GLN 163 HG2 GLN 163 0.694 12.553 2.474 1210 HG3 GLN 163 HG3 GLN 163 1.265 13.387 1.191 1211 HE21 GLN 163 HE21 GLN 163 2.489 10.423 -0.483 1212 HE22 GLN 163 HE22 GLN 163 3.043 12.008 -0.059 1213 H VAL 164 H VAL 164 4.551 15.445 2.626 1214 HA VAL 164 HA VAL 164 2.690 17.461 1.785 1215 HB VAL 164 HB VAL 164 4.353 19.210 2.269 1216 HG11 VAL 164 HG11 VAL 164 3.993 19.270 4.644 1217 HG12 VAL 164 HG12 VAL 164 3.520 17.724 4.614 1218 HG13 VAL 164 HG13 VAL 164 2.625 18.857 3.886 1219 HG21 VAL 164 HG21 VAL 164 6.223 18.705 3.675 1220 HG22 VAL 164 HG22 VAL 164 6.340 17.892 2.282 1221 HG23 VAL 164 HG23 VAL 164 5.847 17.133 3.622 1222 H ILE 165 H ILE 165 3.233 18.624 -0.187 1223 HA ILE 165 HA ILE 165 5.444 17.496 -1.613 1224 HB ILE 165 HB ILE 165 2.812 17.876 -2.830 1225 HG12 ILE 165 HG12 ILE 165 2.980 15.873 -1.548 1226 HG13 ILE 165 HG13 ILE 165 2.652 15.590 -3.123 1227 HG21 ILE 165 HG21 ILE 165 3.769 17.065 -4.918 1228 HG22 ILE 165 HG22 ILE 165 5.227 16.994 -4.224 1229 HG23 ILE 165 HG23 ILE 165 4.516 18.426 -4.465 1230 HD11 ILE 165 HD11 ILE 165 4.264 13.985 -2.325 1231 HD12 ILE 165 HD12 ILE 165 5.271 15.180 -1.911 1232 HD13 ILE 165 HD13 ILE 165 4.945 14.901 -3.470 1233 H ASP 166 H ASP 166 6.830 19.185 -1.935 1234 HA ASP 166 HA ASP 166 5.836 21.806 -2.161 1235 HB2 ASP 166 HB2 ASP 166 8.482 20.725 -2.297 1236 HB3 ASP 166 HB3 ASP 166 8.238 22.271 -2.765 1237 H VAL 167 H VAL 167 5.589 23.059 -4.048 1238 HA VAL 167 HA VAL 167 6.378 21.826 -6.524 1239 HB VAL 167 HB VAL 167 4.305 22.598 -7.590 1240 HG11 VAL 167 HG11 VAL 167 2.917 20.793 -6.788 1241 HG12 VAL 167 HG12 VAL 167 3.878 20.624 -5.498 1242 HG13 VAL 167 HG13 VAL 167 4.438 20.278 -6.975 1243 HG21 VAL 167 HG21 VAL 167 2.424 23.185 -6.211 1244 HG22 VAL 167 HG22 VAL 167 3.621 24.252 -6.000 1245 HG23 VAL 167 HG23 VAL 167 3.358 23.102 -4.894 1246 H ASP 168 H ASP 168 6.627 23.457 -8.312 1247 HA ASP 168 HA ASP 168 6.946 26.165 -7.281 1248 HB2 ASP 168 HB2 ASP 168 9.004 24.746 -7.961 1249 HB3 ASP 168 HB3 ASP 168 8.676 25.510 -9.366 1250 H LEU 169 H LEU 169 5.555 27.524 -8.249 1251 HA LEU 169 HA LEU 169 4.455 26.610 -10.744 1252 HB2 LEU 169 HB2 LEU 169 3.008 27.902 -8.605 1253 HB3 LEU 169 HB3 LEU 169 2.332 27.485 -10.032 1254 HG LEU 169 HG LEU 169 3.290 25.609 -8.076 1255 HD11 LEU 169 HD11 LEU 169 0.953 25.121 -7.698 1256 HD12 LEU 169 HD12 LEU 169 0.546 26.279 -8.751 1257 HD13 LEU 169 HD13 LEU 169 1.261 26.671 -7.355 1258 HD21 LEU 169 HD21 LEU 169 2.284 23.895 -9.418 1259 HD22 LEU 169 HD22 LEU 169 3.444 24.650 -10.254 1260 HD23 LEU 169 HD23 LEU 169 1.890 24.996 -10.535 1261 H VAL 170 H VAL 170 4.205 27.953 -12.424 1262 HA VAL 170 HA VAL 170 4.670 30.728 -11.904 1263 HB VAL 170 HB VAL 170 6.134 30.876 -13.872 1264 HG11 VAL 170 HG11 VAL 170 8.089 29.819 -12.910 1265 HG12 VAL 170 HG12 VAL 170 7.140 28.976 -11.908 1266 HG13 VAL 170 HG13 VAL 170 7.249 30.583 -11.758 1267 HG21 VAL 170 HG21 VAL 170 6.938 28.859 -14.933 1268 HG22 VAL 170 HG22 VAL 170 5.335 28.976 -15.109 1269 HG23 VAL 170 HG23 VAL 170 5.956 27.975 -14.002 1270 H ASN 171 H ASN 171 3.990 32.208 -13.736 1271 HA ASN 171 HA ASN 171 1.728 31.118 -15.112 1272 HB2 ASN 171 HB2 ASN 171 1.643 33.346 -14.166 1273 HB3 ASN 171 HB3 ASN 171 2.708 33.817 -15.311 1274 HD21 ASN 171 HD21 ASN 171 -0.232 34.917 -16.887 1275 HD22 ASN 171 HD22 ASN 171 1.052 35.412 -15.835 1276 H LYS 172 H LYS 172 1.603 31.184 -17.501 1277 HA LYS 172 HA LYS 172 4.042 30.650 -18.794 1278 HB2 LYS 172 HB2 LYS 172 2.731 30.439 -20.763 1279 HB3 LYS 172 HB3 LYS 172 2.019 29.635 -19.532 1280 HG2 LYS 172 HG2 LYS 172 0.183 30.674 -20.182 1281 HG3 LYS 172 HG3 LYS 172 0.796 31.954 -19.374 1282 HD2 LYS 172 HD2 LYS 172 1.880 32.065 -21.855 1283 HD3 LYS 172 HD3 LYS 172 0.291 31.760 -22.077 1284 HE2 LYS 172 HE2 LYS 172 0.048 33.952 -21.929 1285 HE3 LYS 172 HE3 LYS 172 0.197 33.721 -20.319 1286 HZ1 LYS 172 HZ1 LYS 172 1.702 35.412 -21.044 1287 HZ2 LYS 172 HZ2 LYS 172 2.388 34.374 -22.077 1288 HZ3 LYS 172 HZ3 LYS 172 2.535 34.145 -20.483 Start of MODEL 15 1 H1 HIS 1 H1 HIS 1 2.904 4.430 3.341 2 H2 HIS 1 H2 HIS 1 1.367 4.649 2.890 3 H3 HIS 1 H3 HIS 1 2.562 5.348 2.054 4 HA HIS 1 HA HIS 1 3.328 3.255 1.348 5 HB2 HIS 1 HB2 HIS 1 1.078 2.160 2.821 6 HB3 HIS 1 HB3 HIS 1 2.062 1.265 1.872 7 HD1 HIS 1 HD1 HIS 1 1.540 1.882 5.296 8 HD2 HIS 1 HD2 HIS 1 4.874 1.530 2.939 9 HE1 HIS 1 HE1 HIS 1 3.517 1.505 6.765 10 HE2 HIS 1 HE2 HIS 1 5.535 1.299 5.359 11 H GLY 2 H GLY 2 2.925 3.030 -0.822 12 HA2 GLY 2 HA2 GLY 2 1.030 2.715 -2.438 13 HA3 GLY 2 HA3 GLY 2 0.339 4.019 -1.738 14 H PHE 3 H PHE 3 0.682 4.886 -4.190 15 HA PHE 3 HA PHE 3 2.877 6.582 -3.843 16 HB2 PHE 3 HB2 PHE 3 4.055 6.144 -5.882 17 HB3 PHE 3 HB3 PHE 3 4.003 4.791 -4.969 18 HD1 PHE 3 HD1 PHE 3 2.759 6.306 -7.970 19 HD2 PHE 3 HD2 PHE 3 2.829 2.819 -5.698 20 HE1 PHE 3 HE1 PHE 3 1.913 5.071 -9.857 21 HE2 PHE 3 HE2 PHE 3 1.982 1.569 -7.577 22 HZ PHE 3 HZ PHE 3 1.543 2.691 -9.670 23 H ILE 4 H ILE 4 3.185 8.309 -5.431 24 HA ILE 4 HA ILE 4 0.614 9.305 -6.204 25 HB ILE 4 HB ILE 4 3.202 10.651 -6.059 26 HG12 ILE 4 HG12 ILE 4 1.128 11.530 -4.347 27 HG13 ILE 4 HG13 ILE 4 1.716 10.046 -4.003 28 HG21 ILE 4 HG21 ILE 4 2.074 12.750 -6.460 29 HG22 ILE 4 HG22 ILE 4 0.680 11.962 -6.686 30 HG23 ILE 4 HG23 ILE 4 1.896 11.772 -7.736 31 HD11 ILE 4 HD11 ILE 4 2.855 11.695 -2.709 32 HD12 ILE 4 HD12 ILE 4 3.317 12.456 -4.059 33 HD13 ILE 4 HD13 ILE 4 3.900 10.986 -3.719 34 H GLU 5 H GLU 5 -0.095 9.258 -8.295 35 HA GLU 5 HA GLU 5 1.656 8.297 -10.300 36 HB2 GLU 5 HB2 GLU 5 -0.654 7.671 -10.306 37 HB3 GLU 5 HB3 GLU 5 -1.088 9.236 -10.483 38 HG2 GLU 5 HG2 GLU 5 0.037 9.144 -12.661 39 HG3 GLU 5 HG3 GLU 5 0.054 7.522 -12.470 40 H LYS 6 H LYS 6 -0.046 11.250 -9.641 41 HA LYS 6 HA LYS 6 1.830 12.900 -10.974 42 HB2 LYS 6 HB2 LYS 6 0.440 13.666 -12.723 43 HB3 LYS 6 HB3 LYS 6 0.591 12.046 -12.863 44 HG2 LYS 6 HG2 LYS 6 -1.555 11.859 -11.766 45 HG3 LYS 6 HG3 LYS 6 -1.702 13.476 -11.945 46 HD2 LYS 6 HD2 LYS 6 -1.552 13.254 -14.283 47 HD3 LYS 6 HD3 LYS 6 -1.326 11.644 -14.132 48 HE2 LYS 6 HE2 LYS 6 -3.549 11.601 -13.043 49 HE3 LYS 6 HE3 LYS 6 -3.750 13.107 -13.642 50 HZ1 LYS 6 HZ1 LYS 6 -4.687 11.508 -15.122 51 HZ2 LYS 6 HZ2 LYS 6 -3.253 10.772 -15.249 52 HZ3 LYS 6 HZ3 LYS 6 -3.452 12.263 -15.842 53 HA PRO 7 HA PRO 7 1.160 15.417 -11.955 54 HB2 PRO 7 HB2 PRO 7 1.803 17.822 -10.940 55 HB3 PRO 7 HB3 PRO 7 0.246 17.531 -11.336 56 HG2 PRO 7 HG2 PRO 7 1.466 17.292 -8.778 57 HG3 PRO 7 HG3 PRO 7 0.080 18.068 -9.158 58 HD2 PRO 7 HD2 PRO 7 -0.030 15.671 -8.192 59 HD3 PRO 7 HD3 PRO 7 -1.093 16.118 -9.349 60 H GLY 8 H GLY 8 2.958 14.895 -12.783 61 HA2 GLY 8 HA2 GLY 8 5.222 14.786 -12.895 62 HA3 GLY 8 HA3 GLY 8 5.352 15.620 -11.497 63 H SER 9 H SER 9 7.228 13.826 -11.725 64 HA SER 9 HA SER 9 6.400 11.728 -9.933 65 HB2 SER 9 HB2 SER 9 6.403 10.628 -12.038 66 HB3 SER 9 HB3 SER 9 7.881 11.230 -12.388 67 HG SER 9 HG SER 9 7.228 9.081 -10.960 68 H ARG 10 H ARG 10 8.116 10.892 -8.558 69 HA ARG 10 HA ARG 10 10.122 12.803 -8.115 70 HB2 ARG 10 HB2 ARG 10 9.149 11.438 -6.341 71 HB3 ARG 10 HB3 ARG 10 10.047 10.190 -6.891 72 HG2 ARG 10 HG2 ARG 10 12.035 11.410 -6.381 73 HG3 ARG 10 HG3 ARG 10 11.125 12.637 -5.804 74 HD2 ARG 10 HD2 ARG 10 10.304 11.183 -4.096 75 HD3 ARG 10 HD3 ARG 10 11.297 10.009 -4.647 76 HE ARG 10 HE ARG 10 12.030 12.237 -3.048 77 HH11 ARG 10 HH11 ARG 10 14.127 12.399 -2.336 78 HH12 ARG 10 HH12 ARG 10 15.366 11.389 -3.003 79 HH21 ARG 10 HH21 ARG 10 13.301 9.752 -5.197 80 HH22 ARG 10 HH22 ARG 10 14.911 9.927 -4.583 81 H ALA 11 H ALA 11 9.876 10.044 -10.035 82 HA ALA 11 HA ALA 11 12.458 9.193 -10.128 83 HB1 ALA 11 HB1 ALA 11 10.641 7.984 -11.192 84 HB2 ALA 11 HB2 ALA 11 11.856 8.156 -12.245 85 HB3 ALA 11 HB3 ALA 11 10.558 9.115 -12.344 86 H ALA 12 H ALA 12 11.058 11.880 -11.757 87 HA ALA 12 HA ALA 12 13.106 12.344 -13.528 88 HB1 ALA 12 HB1 ALA 12 10.932 13.441 -13.716 89 HB2 ALA 12 HB2 ALA 12 12.097 14.560 -13.777 90 HB3 ALA 12 HB3 ALA 12 11.267 14.331 -12.409 91 H LEU 13 H LEU 13 12.862 13.147 -10.219 92 HA LEU 13 HA LEU 13 15.144 14.848 -10.328 93 HB2 LEU 13 HB2 LEU 13 13.554 14.053 -8.040 94 HB3 LEU 13 HB3 LEU 13 14.783 15.123 -7.938 95 HG LEU 13 HG LEU 13 13.276 16.355 -9.626 96 HD11 LEU 13 HD11 LEU 13 10.967 16.200 -8.931 97 HD12 LEU 13 HD12 LEU 13 11.351 14.993 -7.925 98 HD13 LEU 13 HD13 LEU 13 11.466 14.780 -9.524 99 HD21 LEU 13 HD21 LEU 13 12.568 17.724 -7.749 100 HD22 LEU 13 HD22 LEU 13 14.130 17.335 -7.596 101 HD23 LEU 13 HD23 LEU 13 13.012 16.548 -6.732 102 H CYS 14 H CYS 14 14.241 11.706 -9.386 103 HA CYS 14 HA CYS 14 16.469 11.121 -7.831 104 HB2 CYS 14 HB2 CYS 14 14.698 9.820 -7.421 105 HB3 CYS 14 HB3 CYS 14 14.361 9.643 -9.009 106 H SER 15 H SER 15 15.771 10.650 -11.174 107 HA SER 15 HA SER 15 17.804 8.891 -11.655 108 HB2 SER 15 HB2 SER 15 15.988 9.234 -13.242 109 HB3 SER 15 HB3 SER 15 16.582 10.713 -13.596 110 HG SER 15 HG SER 15 18.512 9.076 -13.989 111 H GLU 16 H GLU 16 19.891 8.936 -11.960 112 HA GLU 16 HA GLU 16 21.335 11.261 -11.683 113 HB2 GLU 16 HB2 GLU 16 22.041 8.585 -12.480 114 HB3 GLU 16 HB3 GLU 16 23.191 9.743 -12.526 115 HG2 GLU 16 HG2 GLU 16 23.398 8.587 -10.519 116 HG3 GLU 16 HG3 GLU 16 22.886 10.102 -10.190 117 H ALA 17 H ALA 17 19.818 10.025 -14.380 118 HA ALA 17 HA ALA 17 21.423 10.948 -16.388 119 HB1 ALA 17 HB1 ALA 17 19.501 9.518 -16.799 120 HB2 ALA 17 HB2 ALA 17 19.439 10.795 -17.789 121 HB3 ALA 17 HB3 ALA 17 18.510 10.751 -16.467 122 H PHE 18 H PHE 18 19.831 12.786 -14.149 123 HA PHE 18 HA PHE 18 19.351 15.042 -15.748 124 HB2 PHE 18 HB2 PHE 18 18.190 14.426 -13.620 125 HB3 PHE 18 HB3 PHE 18 19.502 15.012 -12.843 126 HD1 PHE 18 HD1 PHE 18 19.758 17.355 -12.430 127 HD2 PHE 18 HD2 PHE 18 16.703 15.980 -14.897 128 HE1 PHE 18 HE1 PHE 18 18.783 19.562 -12.441 129 HE2 PHE 18 HE2 PHE 18 15.720 18.186 -14.921 130 HZ PHE 18 HZ PHE 18 16.762 19.982 -13.690 131 H GLY 19 H GLY 19 22.197 13.824 -14.560 132 HA2 GLY 19 HA2 GLY 19 23.651 16.014 -15.408 133 HA3 GLY 19 HA3 GLY 19 23.524 16.102 -13.782 134 H PHE 20 H PHE 20 23.651 13.254 -13.409 135 HA PHE 20 HA PHE 20 25.106 11.713 -13.011 136 HB2 PHE 20 HB2 PHE 20 25.289 11.983 -15.604 137 HB3 PHE 20 HB3 PHE 20 26.858 12.234 -15.226 138 HD1 PHE 20 HD1 PHE 20 24.218 9.783 -15.050 139 HD2 PHE 20 HD2 PHE 20 28.320 10.409 -14.752 140 HE1 PHE 20 HE1 PHE 20 24.568 7.396 -14.984 141 HE2 PHE 20 HE2 PHE 20 28.690 8.025 -14.693 142 HZ PHE 20 HZ PHE 20 26.814 6.512 -14.809 143 H LEU 21 H LEU 21 26.066 14.632 -12.443 144 HA LEU 21 HA LEU 21 28.779 14.253 -11.976 145 HB2 LEU 21 HB2 LEU 21 27.017 16.221 -10.783 146 HB3 LEU 21 HB3 LEU 21 28.646 16.314 -10.716 147 HG LEU 21 HG LEU 21 27.122 16.580 -13.141 148 HD11 LEU 21 HD11 LEU 21 27.665 18.937 -12.985 149 HD12 LEU 21 HD12 LEU 21 28.398 18.671 -11.568 150 HD13 LEU 21 HD13 LEU 21 26.797 18.484 -11.698 151 HD21 LEU 21 HD21 LEU 21 29.163 17.296 -14.168 152 HD22 LEU 21 HD22 LEU 21 29.316 15.783 -13.619 153 HD23 LEU 21 HD23 LEU 21 29.962 17.013 -12.792 154 H ASN 22 H ASN 22 25.997 13.576 -10.189 155 HA ASN 22 HA ASN 22 27.412 12.190 -8.176 156 HB2 ASN 22 HB2 ASN 22 26.305 14.743 -7.588 157 HB3 ASN 22 HB3 ASN 22 25.976 13.582 -6.487 158 HD21 ASN 22 HD21 ASN 22 29.322 15.505 -6.185 159 HD22 ASN 22 HD22 ASN 22 27.909 16.035 -7.036 160 H LEU 23 H LEU 23 25.883 10.925 -6.783 161 HA LEU 23 HA LEU 23 23.539 10.221 -8.174 162 HB2 LEU 23 HB2 LEU 23 24.703 9.319 -5.730 163 HB3 LEU 23 HB3 LEU 23 23.154 8.913 -6.047 164 HG LEU 23 HG LEU 23 23.968 7.870 -8.088 165 HD11 LEU 23 HD11 LEU 23 26.260 7.218 -8.225 166 HD12 LEU 23 HD12 LEU 23 26.596 8.116 -6.923 167 HD13 LEU 23 HD13 LEU 23 26.119 8.828 -8.295 168 HD21 LEU 23 HD21 LEU 23 24.652 5.851 -6.901 169 HD22 LEU 23 HD22 LEU 23 23.386 6.530 -6.159 170 HD23 LEU 23 HD23 LEU 23 24.875 6.728 -5.560 171 H ASN 24 H ASN 24 21.356 10.755 -7.686 172 HA ASN 24 HA ASN 24 21.121 12.743 -5.631 173 HB2 ASN 24 HB2 ASN 24 21.098 13.600 -8.001 174 HB3 ASN 24 HB3 ASN 24 19.607 12.942 -8.106 175 HD21 ASN 24 HD21 ASN 24 18.113 15.844 -7.064 176 HD22 ASN 24 HD22 ASN 24 18.103 14.476 -8.127 177 H CYS 25 H CYS 25 20.020 9.826 -6.432 178 HA CYS 25 HA CYS 25 17.318 10.213 -6.093 179 HB2 CYS 25 HB2 CYS 25 18.516 8.279 -7.043 180 HB3 CYS 25 HB3 CYS 25 18.571 7.719 -5.510 181 H GLY 26 H GLY 26 19.658 9.188 -3.708 182 HA2 GLY 26 HA2 GLY 26 19.514 9.484 -1.467 183 HA3 GLY 26 HA3 GLY 26 18.092 10.269 -1.641 184 H SER 27 H SER 27 18.681 8.547 0.521 185 HA SER 27 HA SER 27 17.740 5.994 0.028 186 HB2 SER 27 HB2 SER 27 19.118 6.536 1.978 187 HB3 SER 27 HB3 SER 27 17.862 7.356 2.624 188 HG SER 27 HG SER 27 17.550 5.559 3.593 189 H VAL 28 H VAL 28 16.059 8.806 0.966 190 HA VAL 28 HA VAL 28 13.765 7.587 1.893 191 HB VAL 28 HB VAL 28 14.476 9.988 2.234 192 HG11 VAL 28 HG11 VAL 28 13.675 11.621 0.671 193 HG12 VAL 28 HG12 VAL 28 13.154 10.439 -0.302 194 HG13 VAL 28 HG13 VAL 28 14.738 10.633 -0.042 195 HG21 VAL 28 HG21 VAL 28 12.265 10.832 2.594 196 HG22 VAL 28 HG22 VAL 28 12.391 9.320 3.155 197 HG23 VAL 28 HG23 VAL 28 11.653 9.600 1.744 198 H MET 29 H MET 29 14.815 7.579 -1.175 199 HA MET 29 HA MET 29 12.606 8.094 -2.601 200 HB2 MET 29 HB2 MET 29 13.706 6.892 -4.411 201 HB3 MET 29 HB3 MET 29 14.828 7.716 -3.558 202 HG2 MET 29 HG2 MET 29 15.872 5.846 -3.728 203 HG3 MET 29 HG3 MET 29 15.064 5.570 -2.336 204 HE1 MET 29 HE1 MET 29 14.886 1.994 -3.712 205 HE2 MET 29 HE2 MET 29 15.159 2.882 -2.389 206 HE3 MET 29 HE3 MET 29 16.158 2.991 -3.655 207 H TYR 30 H TYR 30 12.918 5.309 -0.732 208 HA TYR 30 HA TYR 30 11.359 3.693 -2.402 209 HB2 TYR 30 HB2 TYR 30 12.847 2.663 -0.853 210 HB3 TYR 30 HB3 TYR 30 12.057 3.349 0.401 211 HD1 TYR 30 HD1 TYR 30 11.388 1.017 -2.337 212 HD2 TYR 30 HD2 TYR 30 10.506 2.042 1.598 213 HE1 TYR 30 HE1 TYR 30 9.956 -0.924 -2.144 214 HE2 TYR 30 HE2 TYR 30 9.075 0.109 1.782 215 HH TYR 30 HH TYR 30 7.688 -1.404 -0.032 216 H GLU 31 H GLU 31 10.612 5.599 0.424 217 HA GLU 31 HA GLU 31 8.011 5.711 -0.544 218 HB2 GLU 31 HB2 GLU 31 6.916 5.075 1.562 219 HB3 GLU 31 HB3 GLU 31 7.619 3.845 0.750 220 HG2 GLU 31 HG2 GLU 31 9.396 3.848 2.308 221 HG3 GLU 31 HG3 GLU 31 8.663 5.055 3.129 222 HA PRO 32 HA PRO 32 9.010 9.588 1.411 223 HB2 PRO 32 HB2 PRO 32 8.813 11.212 -0.682 224 HB3 PRO 32 HB3 PRO 32 10.185 10.342 -0.515 225 HG2 PRO 32 HG2 PRO 32 7.902 9.700 -2.110 226 HG3 PRO 32 HG3 PRO 32 9.468 9.714 -2.575 227 HD2 PRO 32 HD2 PRO 32 8.347 7.483 -1.896 228 HD3 PRO 32 HD3 PRO 32 9.916 7.747 -1.528 229 H GLN 33 H GLN 33 6.408 8.272 -0.047 230 HA GLN 33 HA GLN 33 4.721 10.394 0.794 231 HB2 GLN 33 HB2 GLN 33 2.942 8.972 -0.303 232 HB3 GLN 33 HB3 GLN 33 4.008 9.738 -1.274 233 HG2 GLN 33 HG2 GLN 33 3.614 7.529 -2.023 234 HG3 GLN 33 HG3 GLN 33 5.182 7.733 -1.615 235 HE21 GLN 33 HE21 GLN 33 5.194 4.847 0.202 236 HE22 GLN 33 HE22 GLN 33 5.966 5.870 -0.963 237 H SER 34 H SER 34 6.011 8.007 2.442 238 HA SER 34 HA SER 34 3.537 7.359 3.783 239 HB2 SER 34 HB2 SER 34 4.989 5.493 2.952 240 HB3 SER 34 HB3 SER 34 5.987 5.857 4.192 241 HG SER 34 HG SER 34 4.070 5.576 5.539 242 H LEU 35 H LEU 35 3.381 9.290 4.947 243 HA LEU 35 HA LEU 35 5.221 9.467 7.192 244 HB2 LEU 35 HB2 LEU 35 3.409 11.425 6.181 245 HB3 LEU 35 HB3 LEU 35 4.187 11.588 7.608 246 HG LEU 35 HG LEU 35 6.256 11.629 6.355 247 HD11 LEU 35 HD11 LEU 35 6.219 12.214 4.039 248 HD12 LEU 35 HD12 LEU 35 4.616 11.997 4.006 249 HD13 LEU 35 HD13 LEU 35 5.598 10.738 4.262 250 HD21 LEU 35 HD21 LEU 35 5.943 13.989 5.765 251 HD22 LEU 35 HD22 LEU 35 5.242 13.677 7.189 252 HD23 LEU 35 HD23 LEU 35 4.342 13.785 5.850 253 H GLU 36 H GLU 36 4.319 9.057 9.309 254 HA GLU 36 HA GLU 36 1.613 8.112 9.167 255 HB2 GLU 36 HB2 GLU 36 3.665 7.333 11.055 256 HB3 GLU 36 HB3 GLU 36 2.142 6.746 11.103 257 HG2 GLU 36 HG2 GLU 36 2.570 5.927 8.810 258 HG3 GLU 36 HG3 GLU 36 4.147 6.214 9.124 259 H ALA 37 H ALA 37 0.027 8.582 10.574 260 HA ALA 37 HA ALA 37 0.513 10.633 12.563 261 HB1 ALA 37 HB1 ALA 37 -0.352 11.791 10.713 262 HB2 ALA 37 HB2 ALA 37 -1.478 11.755 11.872 263 HB3 ALA 37 HB3 ALA 37 -1.590 10.757 10.605 264 H LYS 38 H LYS 38 -1.319 10.601 14.240 265 HA LYS 38 HA LYS 38 -2.423 7.919 14.372 266 HB2 LYS 38 HB2 LYS 38 -0.903 8.621 16.155 267 HB3 LYS 38 HB3 LYS 38 -2.041 9.699 16.613 268 HG2 LYS 38 HG2 LYS 38 -3.191 8.189 17.689 269 HG3 LYS 38 HG3 LYS 38 -2.999 7.078 16.507 270 HD2 LYS 38 HD2 LYS 38 -0.856 6.534 17.332 271 HD3 LYS 38 HD3 LYS 38 -0.983 7.692 18.476 272 HE2 LYS 38 HE2 LYS 38 -2.523 6.520 19.657 273 HE3 LYS 38 HE3 LYS 38 -2.921 5.590 18.375 274 HZ1 LYS 38 HZ1 LYS 38 -1.707 4.316 19.962 275 HZ2 LYS 38 HZ2 LYS 38 -0.466 5.347 19.859 276 HZ3 LYS 38 HZ3 LYS 38 -0.860 4.427 18.589 277 H LYS 39 H LYS 39 -4.609 7.552 15.049 278 HA LYS 39 HA LYS 39 -6.450 9.359 14.112 279 HB2 LYS 39 HB2 LYS 39 -6.651 7.088 15.844 280 HB3 LYS 39 HB3 LYS 39 -7.971 8.037 15.692 281 HG2 LYS 39 HG2 LYS 39 -8.128 7.543 13.429 282 HG3 LYS 39 HG3 LYS 39 -6.715 6.724 13.473 283 HD2 LYS 39 HD2 LYS 39 -7.648 5.074 14.834 284 HD3 LYS 39 HD3 LYS 39 -9.023 5.937 15.006 285 HE2 LYS 39 HE2 LYS 39 -9.662 5.521 12.845 286 HE3 LYS 39 HE3 LYS 39 -8.179 4.968 12.444 287 HZ1 LYS 39 HZ1 LYS 39 -9.685 3.150 12.706 288 HZ2 LYS 39 HZ2 LYS 39 -9.991 3.612 14.225 289 HZ3 LYS 39 HZ3 LYS 39 -8.523 3.065 13.828 290 H GLY 40 H GLY 40 -7.701 11.002 15.047 291 HA2 GLY 40 HA2 GLY 40 -8.090 11.444 17.687 292 HA3 GLY 40 HA3 GLY 40 -6.674 12.194 17.372 293 H PHE 41 H PHE 41 -10.075 12.250 16.873 294 HA PHE 41 HA PHE 41 -10.060 14.301 14.972 295 HB2 PHE 41 HB2 PHE 41 -12.454 14.528 15.984 296 HB3 PHE 41 HB3 PHE 41 -12.073 13.414 14.853 297 HD1 PHE 41 HD1 PHE 41 -12.195 11.084 15.321 298 HD2 PHE 41 HD2 PHE 41 -12.528 13.856 18.407 299 HE1 PHE 41 HE1 PHE 41 -12.857 9.319 16.825 300 HE2 PHE 41 HE2 PHE 41 -13.180 12.094 19.924 301 HZ PHE 41 HZ PHE 41 -13.362 9.826 19.131 302 HA PRO 42 HA PRO 42 -11.313 16.449 14.470 303 HB2 PRO 42 HB2 PRO 42 -10.401 18.941 14.101 304 HB3 PRO 42 HB3 PRO 42 -11.684 18.718 15.086 305 HG2 PRO 42 HG2 PRO 42 -8.941 18.942 15.824 306 HG3 PRO 42 HG3 PRO 42 -10.213 19.753 16.450 307 HD2 PRO 42 HD2 PRO 42 -9.319 17.657 17.682 308 HD3 PRO 42 HD3 PRO 42 -10.928 17.935 17.647 309 H HIS 43 H HIS 43 -10.641 16.476 12.325 310 HA HIS 43 HA HIS 43 -7.810 16.456 12.050 311 HB2 HIS 43 HB2 HIS 43 -9.324 14.139 11.849 312 HB3 HIS 43 HB3 HIS 43 -8.576 14.397 10.420 313 HD1 HIS 43 HD1 HIS 43 -7.084 15.036 13.803 314 HD2 HIS 43 HD2 HIS 43 -6.567 12.538 10.595 315 HE1 HIS 43 HE1 HIS 43 -5.029 13.686 14.170 316 HE2 HIS 43 HE2 HIS 43 -4.705 12.165 12.263 317 H SER 44 H SER 44 -10.814 16.650 10.290 318 HA SER 44 HA SER 44 -9.470 17.665 8.004 319 HB2 SER 44 HB2 SER 44 -11.610 16.535 7.750 320 HB3 SER 44 HB3 SER 44 -12.333 17.814 8.464 321 HG SER 44 HG SER 44 -11.650 17.519 5.960 322 H GLY 45 H GLY 45 -10.452 18.814 10.908 323 HA2 GLY 45 HA2 GLY 45 -10.705 21.569 10.193 324 HA3 GLY 45 HA3 GLY 45 -10.851 20.940 11.693 325 HA PRO 46 HA PRO 46 -6.706 22.746 11.679 326 HB2 PRO 46 HB2 PRO 46 -6.498 23.208 14.294 327 HB3 PRO 46 HB3 PRO 46 -7.277 24.293 13.354 328 HG2 PRO 46 HG2 PRO 46 -8.441 22.184 14.901 329 HG3 PRO 46 HG3 PRO 46 -8.874 23.758 14.885 330 HD2 PRO 46 HD2 PRO 46 -10.213 22.102 13.442 331 HD3 PRO 46 HD3 PRO 46 -9.874 23.574 12.823 332 H ALA 47 H ALA 47 -4.686 21.952 12.339 333 HA ALA 47 HA ALA 47 -4.718 19.201 12.402 334 HB1 ALA 47 HB1 ALA 47 -2.835 20.437 11.482 335 HB2 ALA 47 HB2 ALA 47 -2.286 19.385 12.581 336 HB3 ALA 47 HB3 ALA 47 -2.438 20.949 12.964 337 H ASP 48 H ASP 48 -4.998 17.756 13.940 338 HA ASP 48 HA ASP 48 -4.041 18.266 16.620 339 HB2 ASP 48 HB2 ASP 48 -6.485 18.813 16.382 340 HB3 ASP 48 HB3 ASP 48 -6.658 17.190 16.449 341 H GLY 49 H GLY 49 -4.335 15.950 17.809 342 HA2 GLY 49 HA2 GLY 49 -4.152 13.673 17.591 343 HA3 GLY 49 HA3 GLY 49 -4.191 13.785 15.962 344 H GLN 50 H GLN 50 -2.090 15.754 15.819 345 HA GLN 50 HA GLN 50 0.097 13.943 16.155 346 HB2 GLN 50 HB2 GLN 50 -0.146 16.264 14.441 347 HB3 GLN 50 HB3 GLN 50 1.265 15.454 14.584 348 HG2 GLN 50 HG2 GLN 50 0.350 14.643 12.649 349 HG3 GLN 50 HG3 GLN 50 0.041 13.476 13.749 350 HE21 GLN 50 HE21 GLN 50 -3.031 15.764 12.473 351 HE22 GLN 50 HE22 GLN 50 -1.422 16.398 12.554 352 H ILE 51 H ILE 51 -1.134 15.972 18.132 353 HA ILE 51 HA ILE 51 0.897 17.752 18.719 354 HB ILE 51 HB ILE 51 -1.102 16.722 20.581 355 HG12 ILE 51 HG12 ILE 51 -1.135 19.210 19.114 356 HG13 ILE 51 HG13 ILE 51 -2.001 17.894 18.683 357 HG21 ILE 51 HG21 ILE 51 -0.596 18.624 21.999 358 HG22 ILE 51 HG22 ILE 51 0.585 19.072 20.990 359 HG23 ILE 51 HG23 ILE 51 0.724 17.703 21.839 360 HD11 ILE 51 HD11 ILE 51 -3.417 19.476 19.795 361 HD12 ILE 51 HD12 ILE 51 -2.469 19.426 21.104 362 HD13 ILE 51 HD13 ILE 51 -3.327 18.123 20.677 363 H ALA 52 H ALA 52 0.247 14.516 19.770 364 HA ALA 52 HA ALA 52 2.299 14.332 21.604 365 HB1 ALA 52 HB1 ALA 52 0.440 12.747 21.553 366 HB2 ALA 52 HB2 ALA 52 1.836 11.930 21.539 367 HB3 ALA 52 HB3 ALA 52 1.003 12.132 20.168 368 H SER 53 H SER 53 2.368 14.098 18.234 369 HA SER 53 HA SER 53 5.000 12.958 18.261 370 HB2 SER 53 HB2 SER 53 4.650 12.631 15.858 371 HB3 SER 53 HB3 SER 53 3.456 11.925 16.721 372 HG SER 53 HG SER 53 3.265 14.453 15.655 373 H ALA 54 H ALA 54 4.299 15.715 19.002 374 HA ALA 54 HA ALA 54 5.026 17.758 18.673 375 HB1 ALA 54 HB1 ALA 54 7.200 16.726 19.145 376 HB2 ALA 54 HB2 ALA 54 7.412 18.022 18.201 377 HB3 ALA 54 HB3 ALA 54 7.451 16.539 17.559 378 H GLY 55 H GLY 55 3.230 17.289 16.785 379 HA2 GLY 55 HA2 GLY 55 4.007 17.689 14.197 380 HA3 GLY 55 HA3 GLY 55 2.530 18.043 14.797 381 H GLY 56 H GLY 56 4.175 20.035 16.582 382 HA2 GLY 56 HA2 GLY 56 3.746 22.299 15.014 383 HA3 GLY 56 HA3 GLY 56 4.557 22.254 16.430 384 H LEU 57 H LEU 57 6.153 20.074 14.863 385 HA LEU 57 HA LEU 57 8.343 21.571 14.236 386 HB2 LEU 57 HB2 LEU 57 7.547 18.884 13.564 387 HB3 LEU 57 HB3 LEU 57 8.920 19.457 12.889 388 HG LEU 57 HG LEU 57 8.584 19.276 15.734 389 HD11 LEU 57 HD11 LEU 57 9.859 17.219 15.633 390 HD12 LEU 57 HD12 LEU 57 9.853 17.298 14.018 391 HD13 LEU 57 HD13 LEU 57 8.471 17.049 14.819 392 HD21 LEU 57 HD21 LEU 57 10.975 19.467 15.812 393 HD22 LEU 57 HD22 LEU 57 10.338 20.761 15.082 394 HD23 LEU 57 HD23 LEU 57 11.022 19.590 14.201 395 H PHE 58 H PHE 58 5.567 21.403 12.454 396 HA PHE 58 HA PHE 58 6.519 21.477 9.919 397 HB2 PHE 58 HB2 PHE 58 4.408 22.258 9.271 398 HB3 PHE 58 HB3 PHE 58 4.138 21.391 10.629 399 HD1 PHE 58 HD1 PHE 58 3.290 22.438 12.634 400 HD2 PHE 58 HD2 PHE 58 4.280 24.729 9.306 401 HE1 PHE 58 HE1 PHE 58 2.237 24.359 13.645 402 HE2 PHE 58 HE2 PHE 58 3.252 26.652 10.312 403 HZ PHE 58 HZ PHE 58 2.222 26.474 12.479 404 H GLY 59 H GLY 59 6.799 23.970 12.226 405 HA2 GLY 59 HA2 GLY 59 7.135 26.113 10.480 406 HA3 GLY 59 HA3 GLY 59 7.739 26.028 11.995 407 H GLY 60 H GLY 60 9.177 23.555 11.382 408 HA2 GLY 60 HA2 GLY 60 11.599 24.637 10.549 409 HA3 GLY 60 HA3 GLY 60 11.288 23.055 10.807 410 H ILE 61 H ILE 61 9.039 23.482 8.695 411 HA ILE 61 HA ILE 61 10.413 22.339 6.616 412 HB ILE 61 HB ILE 61 7.833 23.726 6.492 413 HG12 ILE 61 HG12 ILE 61 8.240 20.874 6.559 414 HG13 ILE 61 HG13 ILE 61 7.976 21.748 7.913 415 HG21 ILE 61 HG21 ILE 61 7.394 22.593 4.384 416 HG22 ILE 61 HG22 ILE 61 8.879 21.954 4.412 417 HG23 ILE 61 HG23 ILE 61 8.688 23.549 4.227 418 HD11 ILE 61 HD11 ILE 61 5.920 20.699 7.205 419 HD12 ILE 61 HD12 ILE 61 6.021 21.440 5.771 420 HD13 ILE 61 HD13 ILE 61 5.760 22.305 7.112 421 H LEU 62 H LEU 62 9.801 25.628 7.348 422 HA LEU 62 HA LEU 62 10.455 26.712 4.900 423 HB2 LEU 62 HB2 LEU 62 10.452 27.810 7.560 424 HB3 LEU 62 HB3 LEU 62 10.946 28.743 6.314 425 HG LEU 62 HG LEU 62 8.739 28.541 5.384 426 HD11 LEU 62 HD11 LEU 62 6.900 27.868 6.754 427 HD12 LEU 62 HD12 LEU 62 7.929 27.375 7.900 428 HD13 LEU 62 HD13 LEU 62 7.886 26.617 6.472 429 HD21 LEU 62 HD21 LEU 62 7.801 30.187 6.940 430 HD22 LEU 62 HD22 LEU 62 9.362 30.508 6.668 431 HD23 LEU 62 HD23 LEU 62 8.915 29.768 8.035 432 H ASP 63 H ASP 63 12.358 25.909 7.641 433 HA ASP 63 HA ASP 63 14.749 27.024 6.567 434 HB2 ASP 63 HB2 ASP 63 14.054 27.034 8.990 435 HB3 ASP 63 HB3 ASP 63 14.546 25.477 9.018 436 H GLN 64 H GLN 64 13.212 24.292 6.037 437 HA GLN 64 HA GLN 64 15.279 22.447 6.313 438 HB2 GLN 64 HB2 GLN 64 12.772 22.058 6.367 439 HB3 GLN 64 HB3 GLN 64 12.913 21.895 4.749 440 HG2 GLN 64 HG2 GLN 64 12.835 19.777 5.913 441 HG3 GLN 64 HG3 GLN 64 14.169 19.945 4.987 442 HE21 GLN 64 HE21 GLN 64 14.813 20.402 8.956 443 HE22 GLN 64 HE22 GLN 64 13.499 21.211 8.169 444 H GLN 65 H GLN 65 15.893 24.623 4.466 445 HA GLN 65 HA GLN 65 15.924 23.528 1.911 446 HB2 GLN 65 HB2 GLN 65 17.481 25.756 2.908 447 HB3 GLN 65 HB3 GLN 65 17.295 25.420 1.321 448 HG2 GLN 65 HG2 GLN 65 14.884 25.765 1.684 449 HG3 GLN 65 HG3 GLN 65 15.297 26.423 3.121 450 HE21 GLN 65 HE21 GLN 65 15.030 28.847 0.174 451 HE22 GLN 65 HE22 GLN 65 14.095 27.433 0.530 452 H SER 66 H SER 66 16.799 21.420 2.374 453 HA SER 66 HA SER 66 19.648 21.231 2.063 454 HB2 SER 66 HB2 SER 66 19.514 21.227 4.427 455 HB3 SER 66 HB3 SER 66 18.313 20.121 4.392 456 HG SER 66 HG SER 66 19.651 18.551 4.028 457 H GLU 67 H GLU 67 20.179 18.808 1.742 458 HA GLU 67 HA GLU 67 18.539 17.787 -0.202 459 HB2 GLU 67 HB2 GLU 67 20.636 16.443 1.312 460 HB3 GLU 67 HB3 GLU 67 20.023 15.837 -0.075 461 HG2 GLU 67 HG2 GLU 67 21.945 16.754 -0.803 462 HG3 GLU 67 HG3 GLU 67 20.880 17.954 -1.109 463 H ASN 68 H ASN 68 18.319 17.523 3.106 464 HA ASN 68 HA ASN 68 17.004 15.068 3.230 465 HB2 ASN 68 HB2 ASN 68 17.109 17.240 5.167 466 HB3 ASN 68 HB3 ASN 68 16.462 15.786 5.531 467 HD21 ASN 68 HD21 ASN 68 20.262 16.361 6.123 468 HD22 ASN 68 HD22 ASN 68 19.062 17.596 5.939 469 H ARG 69 H ARG 69 15.971 17.966 2.104 470 HA ARG 69 HA ARG 69 13.317 17.965 3.016 471 HB2 ARG 69 HB2 ARG 69 14.644 19.856 2.068 472 HB3 ARG 69 HB3 ARG 69 14.205 19.273 0.608 473 HG2 ARG 69 HG2 ARG 69 12.033 19.889 0.894 474 HG3 ARG 69 HG3 ARG 69 12.206 20.048 2.510 475 HD2 ARG 69 HD2 ARG 69 12.636 22.182 2.244 476 HD3 ARG 69 HD3 ARG 69 13.945 21.801 1.345 477 HE ARG 69 HE ARG 69 12.836 22.257 -0.593 478 HH11 ARG 69 HH11 ARG 69 10.615 22.467 2.146 479 HH12 ARG 69 HH12 ARG 69 9.394 23.236 1.189 480 HH21 ARG 69 HH21 ARG 69 11.235 23.238 -1.717 481 HH22 ARG 69 HH22 ARG 69 9.740 23.663 -0.953 482 H TRP 70 H TRP 70 11.333 17.698 1.717 483 HA TRP 70 HA TRP 70 11.570 15.333 0.172 484 HB2 TRP 70 HB2 TRP 70 9.099 15.624 -0.019 485 HB3 TRP 70 HB3 TRP 70 9.692 15.287 1.465 486 HD1 TRP 70 HD1 TRP 70 8.798 18.448 -0.395 487 HE1 TRP 70 HE1 TRP 70 7.740 20.142 1.125 488 HE3 TRP 70 HE3 TRP 70 9.150 15.800 3.827 489 HZ2 TRP 70 HZ2 TRP 70 7.094 20.199 3.867 490 HZ3 TRP 70 HZ3 TRP 70 8.263 16.733 5.875 491 HH2 TRP 70 HH2 TRP 70 7.227 18.910 5.876 492 H PHE 71 H PHE 71 10.388 15.169 -1.961 493 HA PHE 71 HA PHE 71 11.724 16.872 -3.633 494 HB2 PHE 71 HB2 PHE 71 10.498 15.722 -5.418 495 HB3 PHE 71 HB3 PHE 71 11.180 14.682 -4.359 496 HD1 PHE 71 HD1 PHE 71 9.802 13.330 -2.843 497 HD2 PHE 71 HD2 PHE 71 8.068 15.959 -5.568 498 HE1 PHE 71 HE1 PHE 71 7.651 12.311 -2.452 499 HE2 PHE 71 HE2 PHE 71 5.922 14.916 -5.208 500 HZ PHE 71 HZ PHE 71 5.712 13.099 -3.641 501 H LYS 72 H LYS 72 11.223 18.444 -5.086 502 HA LYS 72 HA LYS 72 8.697 19.782 -4.617 503 HB2 LYS 72 HB2 LYS 72 10.604 21.085 -3.976 504 HB3 LYS 72 HB3 LYS 72 11.161 20.995 -5.509 505 HG2 LYS 72 HG2 LYS 72 9.415 22.328 -6.284 506 HG3 LYS 72 HG3 LYS 72 8.684 22.292 -4.824 507 HD2 LYS 72 HD2 LYS 72 9.679 24.368 -4.970 508 HD3 LYS 72 HD3 LYS 72 10.610 23.505 -3.942 509 HE2 LYS 72 HE2 LYS 72 12.232 23.174 -5.593 510 HE3 LYS 72 HE3 LYS 72 11.265 23.828 -6.735 511 HZ1 LYS 72 HZ1 LYS 72 12.924 25.398 -6.072 512 HZ2 LYS 72 HZ2 LYS 72 12.416 25.304 -4.539 513 HZ3 LYS 72 HZ3 LYS 72 11.459 25.952 -5.670 514 H HIS 73 H HIS 73 7.397 20.313 -6.412 515 HA HIS 73 HA HIS 73 8.476 19.432 -8.944 516 HB2 HIS 73 HB2 HIS 73 5.759 19.226 -8.003 517 HB3 HIS 73 HB3 HIS 73 6.105 19.082 -9.593 518 HD1 HIS 73 HD1 HIS 73 8.866 17.428 -8.553 519 HD2 HIS 73 HD2 HIS 73 4.889 16.491 -8.259 520 HE1 HIS 73 HE1 HIS 73 8.649 14.963 -8.296 521 HE2 HIS 73 HE2 HIS 73 6.261 14.380 -8.090 522 H ILE 74 H ILE 74 8.963 21.042 -10.288 523 HA ILE 74 HA ILE 74 7.850 23.605 -9.943 524 HB ILE 74 HB ILE 74 9.490 22.663 -12.150 525 HG12 ILE 74 HG12 ILE 74 10.376 24.214 -9.878 526 HG13 ILE 74 HG13 ILE 74 10.556 22.593 -9.959 527 HG21 ILE 74 HG21 ILE 74 9.880 25.000 -12.666 528 HG22 ILE 74 HG22 ILE 74 8.864 25.436 -11.486 529 HG23 ILE 74 HG23 ILE 74 8.302 24.669 -12.794 530 HD11 ILE 74 HD11 ILE 74 12.614 23.672 -10.531 531 HD12 ILE 74 HD12 ILE 74 11.880 24.465 -11.735 532 HD13 ILE 74 HD13 ILE 74 12.058 22.860 -11.815 533 H MET 75 H MET 75 6.102 24.511 -11.016 534 HA MET 75 HA MET 75 4.906 23.125 -13.216 535 HB2 MET 75 HB2 MET 75 3.885 22.987 -10.625 536 HB3 MET 75 HB3 MET 75 2.792 23.653 -11.640 537 HG2 MET 75 HG2 MET 75 4.028 21.152 -12.111 538 HG3 MET 75 HG3 MET 75 2.620 21.301 -11.296 539 HE1 MET 75 HE1 MET 75 1.308 19.896 -14.668 540 HE2 MET 75 HE2 MET 75 1.258 19.705 -13.063 541 HE3 MET 75 HE3 MET 75 2.636 19.442 -13.866 542 H THR 76 H THR 76 3.160 24.508 -14.214 543 HA THR 76 HA THR 76 3.552 27.306 -13.569 544 HB THR 76 HB THR 76 2.514 27.711 -15.757 545 HG1 THR 76 HG1 THR 76 2.312 25.068 -15.632 546 HG21 THR 76 HG21 THR 76 4.526 27.219 -16.978 547 HG22 THR 76 HG22 THR 76 5.007 26.212 -15.808 548 HG23 THR 76 HG23 THR 76 4.933 27.802 -15.526 549 H GLY 77 H GLY 77 1.376 28.627 -13.874 550 HA2 GLY 77 HA2 GLY 77 -0.452 27.512 -12.102 551 HA3 GLY 77 HA3 GLY 77 -0.653 28.900 -12.939 552 H GLY 78 H GLY 78 -2.928 27.846 -12.570 553 HA2 GLY 78 HA2 GLY 78 -4.605 27.375 -14.193 554 HA3 GLY 78 HA3 GLY 78 -3.568 26.398 -14.992 555 H GLU 79 H GLU 79 -5.953 25.258 -14.526 556 HA GLU 79 HA GLU 79 -6.074 24.015 -12.023 557 HB2 GLU 79 HB2 GLU 79 -8.025 23.267 -12.677 558 HB3 GLU 79 HB3 GLU 79 -7.810 24.285 -13.936 559 HG2 GLU 79 HG2 GLU 79 -8.502 22.367 -14.941 560 HG3 GLU 79 HG3 GLU 79 -6.881 22.309 -15.134 561 H HIS 80 H HIS 80 -5.490 21.946 -11.287 562 HA HIS 80 HA HIS 80 -3.918 20.412 -13.152 563 HB2 HIS 80 HB2 HIS 80 -3.090 20.924 -10.423 564 HB3 HIS 80 HB3 HIS 80 -2.280 19.954 -11.459 565 HD1 HIS 80 HD1 HIS 80 -1.468 22.820 -9.979 566 HD2 HIS 80 HD2 HIS 80 -1.987 21.970 -13.955 567 HE1 HIS 80 HE1 HIS 80 -0.299 24.555 -11.322 568 HE2 HIS 80 HE2 HIS 80 -0.597 24.063 -13.716 569 H THR 81 H THR 81 -3.717 18.105 -12.656 570 HA THR 81 HA THR 81 -5.934 17.219 -11.038 571 HB THR 81 HB THR 81 -4.828 15.806 -13.339 572 HG1 THR 81 HG1 THR 81 -5.936 17.125 -14.471 573 HG21 THR 81 HG21 THR 81 -6.764 14.397 -13.184 574 HG22 THR 81 HG22 THR 81 -7.282 15.225 -11.895 575 HG23 THR 81 HG23 THR 81 -5.950 14.315 -11.789 576 H PHE 82 H PHE 82 -5.533 15.963 -9.298 577 HA PHE 82 HA PHE 82 -2.854 14.930 -9.014 578 HB2 PHE 82 HB2 PHE 82 -4.805 15.654 -6.998 579 HB3 PHE 82 HB3 PHE 82 -3.409 14.898 -6.616 580 HD1 PHE 82 HD1 PHE 82 -1.545 16.167 -6.000 581 HD2 PHE 82 HD2 PHE 82 -4.575 17.969 -8.212 582 HE1 PHE 82 HE1 PHE 82 -0.419 18.294 -5.800 583 HE2 PHE 82 HE2 PHE 82 -3.445 20.094 -8.044 584 HZ PHE 82 HZ PHE 82 -1.360 20.256 -6.841 585 H THR 83 H THR 83 -2.514 12.726 -8.875 586 HA THR 83 HA THR 83 -4.804 11.113 -8.290 587 HB THR 83 HB THR 83 -3.034 10.490 -10.532 588 HG1 THR 83 HG1 THR 83 -4.340 11.467 -11.789 589 HG21 THR 83 HG21 THR 83 -4.542 8.686 -11.033 590 HG22 THR 83 HG22 THR 83 -5.446 9.063 -9.746 591 HG23 THR 83 HG23 THR 83 -3.955 8.470 -9.542 592 H TRP 84 H TRP 84 -4.411 9.553 -6.784 593 HA TRP 84 HA TRP 84 -1.662 8.705 -6.414 594 HB2 TRP 84 HB2 TRP 84 -3.548 8.786 -4.253 595 HB3 TRP 84 HB3 TRP 84 -1.930 8.594 -4.139 596 HD1 TRP 84 HD1 TRP 84 -0.953 11.067 -5.722 597 HE1 TRP 84 HE1 TRP 84 -1.232 13.430 -4.945 598 HE3 TRP 84 HE3 TRP 84 -4.666 10.214 -2.488 599 HZ2 TRP 84 HZ2 TRP 84 -2.960 14.720 -3.128 600 HZ3 TRP 84 HZ3 TRP 84 -5.573 12.072 -1.232 601 HH2 TRP 84 HH2 TRP 84 -4.734 14.311 -1.582 602 H THR 85 H THR 85 -1.419 6.385 -5.822 603 HA THR 85 HA THR 85 -3.858 4.910 -5.941 604 HB THR 85 HB THR 85 -3.002 4.835 -8.222 605 HG1 THR 85 HG1 THR 85 -4.304 3.175 -7.637 606 HG21 THR 85 HG21 THR 85 -1.055 3.560 -8.684 607 HG22 THR 85 HG22 THR 85 -0.810 3.324 -7.103 608 HG23 THR 85 HG23 THR 85 -0.653 4.805 -7.733 609 H TYR 86 H TYR 86 -3.638 2.617 -5.216 610 HA TYR 86 HA TYR 86 -1.457 2.350 -3.328 611 HB2 TYR 86 HB2 TYR 86 -4.212 1.628 -2.869 612 HB3 TYR 86 HB3 TYR 86 -3.001 1.263 -1.837 613 HD1 TYR 86 HD1 TYR 86 -5.256 3.829 -2.844 614 HD2 TYR 86 HD2 TYR 86 -1.858 3.091 -0.557 615 HE1 TYR 86 HE1 TYR 86 -5.553 5.946 -1.708 616 HE2 TYR 86 HE2 TYR 86 -2.138 5.219 0.542 617 HH TYR 86 HH TYR 86 -4.034 7.660 -0.488 618 H THR 87 H THR 87 -0.508 0.287 -3.149 619 HA THR 87 HA THR 87 -1.037 -1.359 -5.380 620 HB THR 87 HB THR 87 1.291 -0.971 -4.674 621 HG1 THR 87 HG1 THR 87 1.156 -3.630 -4.362 622 HG21 THR 87 HG21 THR 87 2.136 -2.072 -2.711 623 HG22 THR 87 HG22 THR 87 0.662 -2.647 -2.376 624 HG23 THR 87 HG23 THR 87 0.955 -1.061 -2.265 625 H ALA 88 H ALA 88 -2.463 -1.162 -2.572 626 HA ALA 88 HA ALA 88 -3.351 -3.916 -2.548 627 HB1 ALA 88 HB1 ALA 88 -1.713 -3.840 -0.800 628 HB2 ALA 88 HB2 ALA 88 -3.174 -3.956 -0.118 629 HB3 ALA 88 HB3 ALA 88 -2.414 -2.530 -0.163 630 HA PRO 89 HA PRO 89 -7.152 -1.717 -2.063 631 HB2 PRO 89 HB2 PRO 89 -8.623 -3.147 -0.379 632 HB3 PRO 89 HB3 PRO 89 -8.423 -3.664 -1.915 633 HG2 PRO 89 HG2 PRO 89 -6.954 -4.482 0.402 634 HG3 PRO 89 HG3 PRO 89 -7.643 -5.439 -0.728 635 HD2 PRO 89 HD2 PRO 89 -5.125 -4.941 -0.902 636 HD3 PRO 89 HD3 PRO 89 -6.010 -4.975 -2.274 637 H HIS 90 H HIS 90 -8.090 -0.103 -0.803 638 HA HIS 90 HA HIS 90 -6.651 0.279 1.651 639 HB2 HIS 90 HB2 HIS 90 -5.613 1.502 -0.227 640 HB3 HIS 90 HB3 HIS 90 -6.970 2.407 -0.303 641 HD1 HIS 90 HD1 HIS 90 -4.375 1.582 2.305 642 HD2 HIS 90 HD2 HIS 90 -6.702 4.714 1.061 643 HE1 HIS 90 HE1 HIS 90 -3.816 3.583 3.683 644 HE2 HIS 90 HE2 HIS 90 -5.198 5.483 2.937 645 H ASN 91 H ASN 91 -7.978 0.264 3.248 646 HA ASN 91 HA ASN 91 -10.610 1.094 3.149 647 HB2 ASN 91 HB2 ASN 91 -9.815 -0.303 4.881 648 HB3 ASN 91 HB3 ASN 91 -8.830 0.883 5.420 649 HD21 ASN 91 HD21 ASN 91 -12.509 0.591 6.796 650 HD22 ASN 91 HD22 ASN 91 -11.782 -0.566 5.732 651 H THR 92 H THR 92 -11.696 3.007 3.701 652 HA THR 92 HA THR 92 -10.007 5.296 4.075 653 HB THR 92 HB THR 92 -12.317 5.260 2.268 654 HG1 THR 92 HG1 THR 92 -9.667 4.883 1.754 655 HG21 THR 92 HG21 THR 92 -11.593 7.418 1.519 656 HG22 THR 92 HG22 THR 92 -10.355 7.381 2.559 657 HG23 THR 92 HG23 THR 92 -11.872 7.485 3.111 658 H SER 93 H SER 93 -10.632 6.638 5.735 659 HA SER 93 HA SER 93 -13.373 6.408 6.625 660 HB2 SER 93 HB2 SER 93 -11.670 6.119 8.335 661 HB3 SER 93 HB3 SER 93 -11.217 7.669 8.094 662 HG SER 93 HG SER 93 -13.798 7.568 8.521 663 H GLN 94 H GLN 94 -10.851 8.706 5.900 664 HA GLN 94 HA GLN 94 -12.629 10.516 4.624 665 HB2 GLN 94 HB2 GLN 94 -12.885 11.076 6.990 666 HB3 GLN 94 HB3 GLN 94 -11.295 11.445 7.020 667 HG2 GLN 94 HG2 GLN 94 -11.680 13.245 5.549 668 HG3 GLN 94 HG3 GLN 94 -13.269 12.872 5.504 669 HE21 GLN 94 HE21 GLN 94 -14.137 14.568 8.383 670 HE22 GLN 94 HE22 GLN 94 -14.664 13.670 6.998 671 H TRP 95 H TRP 95 -11.394 11.813 3.101 672 HA TRP 95 HA TRP 95 -8.597 12.005 3.741 673 HB2 TRP 95 HB2 TRP 95 -7.922 11.621 1.481 674 HB3 TRP 95 HB3 TRP 95 -8.454 10.293 2.268 675 HD1 TRP 95 HD1 TRP 95 -11.245 9.826 1.611 676 HE1 TRP 95 HE1 TRP 95 -12.267 9.604 -0.664 677 HE3 TRP 95 HE3 TRP 95 -7.663 12.225 -0.916 678 HZ2 TRP 95 HZ2 TRP 95 -11.500 10.379 -3.256 679 HZ3 TRP 95 HZ3 TRP 95 -7.849 12.406 -3.327 680 HH2 TRP 95 HH2 TRP 95 -9.765 11.486 -4.477 681 H HIS 96 H HIS 96 -7.610 13.934 3.302 682 HA HIS 96 HA HIS 96 -9.199 15.968 2.080 683 HB2 HIS 96 HB2 HIS 96 -8.898 17.336 4.205 684 HB3 HIS 96 HB3 HIS 96 -10.166 16.313 4.102 685 HD1 HIS 96 HD1 HIS 96 -7.517 17.216 6.299 686 HD2 HIS 96 HD2 HIS 96 -9.571 13.765 5.483 687 HE1 HIS 96 HE1 HIS 96 -7.166 15.615 8.175 688 HE2 HIS 96 HE2 HIS 96 -8.384 13.527 7.695 689 H TYR 97 H TYR 97 -8.029 18.056 1.839 690 HA TYR 97 HA TYR 97 -5.217 17.693 2.098 691 HB2 TYR 97 HB2 TYR 97 -5.428 18.782 -0.374 692 HB3 TYR 97 HB3 TYR 97 -4.930 17.261 -0.053 693 HD1 TYR 97 HD1 TYR 97 -6.389 15.342 -0.461 694 HD2 TYR 97 HD2 TYR 97 -7.761 19.213 -1.124 695 HE1 TYR 97 HE1 TYR 97 -8.300 14.470 -1.644 696 HE2 TYR 97 HE2 TYR 97 -9.659 18.328 -2.321 697 HH TYR 97 HH TYR 97 -9.991 15.729 -3.668 698 H TYR 98 H TYR 98 -3.867 19.557 1.822 699 HA TYR 98 HA TYR 98 -5.279 22.000 2.267 700 HB2 TYR 98 HB2 TYR 98 -3.006 21.125 3.878 701 HB3 TYR 98 HB3 TYR 98 -3.791 22.540 4.102 702 HD1 TYR 98 HD1 TYR 98 -4.090 18.973 4.540 703 HD2 TYR 98 HD2 TYR 98 -5.768 22.671 5.459 704 HE1 TYR 98 HE1 TYR 98 -5.550 17.917 6.137 705 HE2 TYR 98 HE2 TYR 98 -7.199 21.609 7.088 706 HH TYR 98 HH TYR 98 -8.182 18.949 7.236 707 H ILE 99 H ILE 99 -3.961 23.976 1.945 708 HA ILE 99 HA ILE 99 -1.407 23.454 0.714 709 HB ILE 99 HB ILE 99 -1.663 25.374 -0.724 710 HG12 ILE 99 HG12 ILE 99 -4.419 25.504 0.090 711 HG13 ILE 99 HG13 ILE 99 -3.278 26.527 0.656 712 HG21 ILE 99 HG21 ILE 99 -3.203 24.365 -2.303 713 HG22 ILE 99 HG22 ILE 99 -3.762 23.391 -1.140 714 HG23 ILE 99 HG23 ILE 99 -2.243 23.229 -1.670 715 HD11 ILE 99 HD11 ILE 99 -4.526 27.583 -1.093 716 HD12 ILE 99 HD12 ILE 99 -4.116 26.402 -2.119 717 HD13 ILE 99 HD13 ILE 99 -2.987 27.414 -1.558 718 H THR 100 H THR 100 0.290 25.024 1.323 719 HA THR 100 HA THR 100 -0.309 26.368 3.747 720 HB THR 100 HB THR 100 2.050 27.085 3.670 721 HG1 THR 100 HG1 THR 100 3.332 26.280 2.055 722 HG21 THR 100 HG21 THR 100 2.948 24.888 4.042 723 HG22 THR 100 HG22 THR 100 1.659 24.221 3.329 724 HG23 THR 100 HG23 THR 100 1.497 24.974 4.751 725 H LYS 101 H LYS 101 -0.492 28.712 4.010 726 HA LYS 101 HA LYS 101 -1.329 29.957 1.642 727 HB2 LYS 101 HB2 LYS 101 -2.296 30.516 3.776 728 HB3 LYS 101 HB3 LYS 101 -0.881 31.196 4.225 729 HG2 LYS 101 HG2 LYS 101 -1.929 33.064 3.635 730 HG3 LYS 101 HG3 LYS 101 -1.369 32.658 2.155 731 HD2 LYS 101 HD2 LYS 101 -3.546 33.099 1.742 732 HD3 LYS 101 HD3 LYS 101 -3.548 31.473 1.890 733 HE2 LYS 101 HE2 LYS 101 -4.234 31.708 4.174 734 HE3 LYS 101 HE3 LYS 101 -4.295 33.327 3.971 735 HZ1 LYS 101 HZ1 LYS 101 -6.474 32.405 3.833 736 HZ2 LYS 101 HZ2 LYS 101 -6.009 31.454 2.611 737 HZ3 LYS 101 HZ3 LYS 101 -6.069 33.057 2.410 738 H LYS 102 H LYS 102 -0.007 30.650 0.067 739 HA LYS 102 HA LYS 102 2.596 31.648 0.611 740 HB2 LYS 102 HB2 LYS 102 1.961 30.619 -1.467 741 HB3 LYS 102 HB3 LYS 102 1.062 31.942 -1.798 742 HG2 LYS 102 HG2 LYS 102 3.004 33.257 -1.922 743 HG3 LYS 102 HG3 LYS 102 3.922 31.966 -1.525 744 HD2 LYS 102 HD2 LYS 102 3.131 30.856 -3.519 745 HD3 LYS 102 HD3 LYS 102 2.355 32.232 -3.934 746 HE2 LYS 102 HE2 LYS 102 5.201 32.064 -3.613 747 HE3 LYS 102 HE3 LYS 102 4.453 31.956 -5.061 748 HZ1 LYS 102 HZ1 LYS 102 5.300 34.136 -4.740 749 HZ2 LYS 102 HZ2 LYS 102 4.426 34.292 -3.389 750 HZ3 LYS 102 HZ3 LYS 102 3.686 34.185 -4.822 751 H GLY 103 H GLY 103 3.010 33.703 1.494 752 HA2 GLY 103 HA2 GLY 103 2.667 35.993 1.416 753 HA3 GLY 103 HA3 GLY 103 1.239 35.787 0.651 754 H TRP 104 H TRP 104 1.601 33.928 3.454 755 HA TRP 104 HA TRP 104 -0.514 35.074 4.722 756 HB2 TRP 104 HB2 TRP 104 0.458 33.928 6.759 757 HB3 TRP 104 HB3 TRP 104 0.051 32.982 5.491 758 HD1 TRP 104 HD1 TRP 104 3.323 34.840 5.792 759 HE1 TRP 104 HE1 TRP 104 5.302 33.309 5.731 760 HE3 TRP 104 HE3 TRP 104 0.783 30.524 5.778 761 HZ2 TRP 104 HZ2 TRP 104 5.642 30.516 5.657 762 HZ3 TRP 104 HZ3 TRP 104 2.023 28.441 5.700 763 HH2 TRP 104 HH2 TRP 104 4.434 28.454 5.652 764 H ASP 105 H ASP 105 -0.837 36.378 6.599 765 HA ASP 105 HA ASP 105 0.963 38.540 6.676 766 HB2 ASP 105 HB2 ASP 105 -1.460 38.038 8.203 767 HB3 ASP 105 HB3 ASP 105 -0.650 39.452 8.302 768 HA PRO 106 HA PRO 106 2.929 36.752 10.193 769 HB2 PRO 106 HB2 PRO 106 5.038 38.358 10.516 770 HB3 PRO 106 HB3 PRO 106 5.027 37.350 9.231 771 HG2 PRO 106 HG2 PRO 106 4.253 40.094 9.299 772 HG3 PRO 106 HG3 PRO 106 5.260 39.367 8.239 773 HD2 PRO 106 HD2 PRO 106 2.757 39.750 7.604 774 HD3 PRO 106 HD3 PRO 106 3.534 38.414 7.077 775 H ASP 107 H ASP 107 1.658 39.815 10.125 776 HA ASP 107 HA ASP 107 2.027 40.355 12.881 777 HB2 ASP 107 HB2 ASP 107 1.764 42.068 11.123 778 HB3 ASP 107 HB3 ASP 107 0.179 41.676 11.073 779 H LYS 108 H LYS 108 0.133 38.263 11.339 780 HA LYS 108 HA LYS 108 -2.058 38.403 13.269 781 HB2 LYS 108 HB2 LYS 108 -2.113 37.312 10.610 782 HB3 LYS 108 HB3 LYS 108 -3.372 37.286 11.650 783 HG2 LYS 108 HG2 LYS 108 -3.480 39.653 11.601 784 HG3 LYS 108 HG3 LYS 108 -2.193 39.701 10.596 785 HD2 LYS 108 HD2 LYS 108 -3.568 38.449 9.001 786 HD3 LYS 108 HD3 LYS 108 -4.838 38.797 9.967 787 HE2 LYS 108 HE2 LYS 108 -4.626 41.071 9.582 788 HE3 LYS 108 HE3 LYS 108 -3.142 40.887 8.927 789 HZ1 LYS 108 HZ1 LYS 108 -4.737 41.315 7.229 790 HZ2 LYS 108 HZ2 LYS 108 -5.586 40.016 7.683 791 HZ3 LYS 108 HZ3 LYS 108 -4.116 39.834 7.034 792 HA PRO 109 HA PRO 109 -0.476 34.675 14.755 793 HB2 PRO 109 HB2 PRO 109 -2.565 33.160 15.442 794 HB3 PRO 109 HB3 PRO 109 -2.217 34.492 16.321 795 HG2 PRO 109 HG2 PRO 109 -4.127 34.256 14.202 796 HG3 PRO 109 HG3 PRO 109 -4.358 34.909 15.680 797 HD2 PRO 109 HD2 PRO 109 -3.857 36.472 13.690 798 HD3 PRO 109 HD3 PRO 109 -3.197 36.811 15.144 799 H LEU 110 H LEU 110 0.754 33.864 13.279 800 HA LEU 110 HA LEU 110 -0.114 32.955 10.908 801 HB2 LEU 110 HB2 LEU 110 2.265 33.306 11.931 802 HB3 LEU 110 HB3 LEU 110 2.234 31.673 11.940 803 HG LEU 110 HG LEU 110 1.784 31.839 9.508 804 HD11 LEU 110 HD11 LEU 110 2.520 33.881 8.472 805 HD12 LEU 110 HD12 LEU 110 2.774 34.535 9.929 806 HD13 LEU 110 HD13 LEU 110 1.269 34.185 9.450 807 HD21 LEU 110 HD21 LEU 110 4.119 32.000 8.999 808 HD22 LEU 110 HD22 LEU 110 3.905 31.094 10.321 809 HD23 LEU 110 HD23 LEU 110 4.401 32.627 10.462 810 H LYS 111 H LYS 111 0.209 31.097 13.778 811 HA LYS 111 HA LYS 111 -0.010 28.635 12.639 812 HB2 LYS 111 HB2 LYS 111 -0.662 27.858 14.838 813 HB3 LYS 111 HB3 LYS 111 0.617 28.872 14.903 814 HG2 LYS 111 HG2 LYS 111 -0.864 30.637 15.576 815 HG3 LYS 111 HG3 LYS 111 -2.093 29.561 15.601 816 HD2 LYS 111 HD2 LYS 111 -1.392 29.758 17.802 817 HD3 LYS 111 HD3 LYS 111 -0.832 28.312 17.289 818 HE2 LYS 111 HE2 LYS 111 1.336 29.275 16.947 819 HE3 LYS 111 HE3 LYS 111 0.775 30.718 17.469 820 HZ1 LYS 111 HZ1 LYS 111 1.975 29.631 19.203 821 HZ2 LYS 111 HZ2 LYS 111 0.978 28.361 19.114 822 HZ3 LYS 111 HZ3 LYS 111 0.423 29.789 19.631 823 H ARG 112 H ARG 112 -2.518 30.869 12.806 824 HA ARG 112 HA ARG 112 -4.470 28.892 12.296 825 HB2 ARG 112 HB2 ARG 112 -4.586 31.735 12.472 826 HB3 ARG 112 HB3 ARG 112 -5.780 31.019 11.618 827 HG2 ARG 112 HG2 ARG 112 -6.689 31.213 13.672 828 HG3 ARG 112 HG3 ARG 112 -6.163 29.667 13.663 829 HD2 ARG 112 HD2 ARG 112 -4.228 30.324 14.887 830 HD3 ARG 112 HD3 ARG 112 -4.766 31.866 14.904 831 HE ARG 112 HE ARG 112 -5.672 29.729 16.546 832 HH11 ARG 112 HH11 ARG 112 -6.424 32.993 15.438 833 HH12 ARG 112 HH12 ARG 112 -7.504 33.279 16.762 834 HH21 ARG 112 HH21 ARG 112 -7.059 30.179 18.199 835 HH22 ARG 112 HH22 ARG 112 -7.856 31.714 18.296 836 H ALA 113 H ALA 113 -2.705 31.227 10.476 837 HA ALA 113 HA ALA 113 -4.076 30.638 8.082 838 HB1 ALA 113 HB1 ALA 113 -3.451 32.968 8.617 839 HB2 ALA 113 HB2 ALA 113 -2.799 32.559 7.195 840 HB3 ALA 113 HB3 ALA 113 -1.889 32.561 8.531 841 H ASP 114 H ASP 114 -1.617 29.113 9.474 842 HA ASP 114 HA ASP 114 0.225 29.013 7.422 843 HB2 ASP 114 HB2 ASP 114 -0.188 27.384 9.767 844 HB3 ASP 114 HB3 ASP 114 0.906 26.864 8.672 845 H PHE 115 H PHE 115 -2.557 27.130 8.126 846 HA PHE 115 HA PHE 115 -2.176 25.730 5.651 847 HB2 PHE 115 HB2 PHE 115 -3.272 24.535 8.057 848 HB3 PHE 115 HB3 PHE 115 -3.145 23.748 6.631 849 HD1 PHE 115 HD1 PHE 115 -1.478 24.517 9.618 850 HD2 PHE 115 HD2 PHE 115 -0.826 23.315 5.688 851 HE1 PHE 115 HE1 PHE 115 0.758 23.817 10.207 852 HE2 PHE 115 HE2 PHE 115 1.408 22.617 6.265 853 HZ PHE 115 HZ PHE 115 2.201 22.866 8.524 854 H GLU 116 H GLU 116 -3.721 25.683 4.166 855 HA GLU 116 HA GLU 116 -6.327 26.668 4.962 856 HB2 GLU 116 HB2 GLU 116 -4.971 26.972 2.425 857 HB3 GLU 116 HB3 GLU 116 -6.515 27.445 2.668 858 HG2 GLU 116 HG2 GLU 116 -4.401 28.577 4.219 859 HG3 GLU 116 HG3 GLU 116 -4.767 29.188 2.749 860 H LEU 117 H LEU 117 -7.988 25.159 4.780 861 HA LEU 117 HA LEU 117 -7.467 22.668 3.617 862 HB2 LEU 117 HB2 LEU 117 -9.068 22.927 5.363 863 HB3 LEU 117 HB3 LEU 117 -10.032 23.769 4.348 864 HG LEU 117 HG LEU 117 -10.201 21.706 3.035 865 HD11 LEU 117 HD11 LEU 117 -9.804 19.645 4.176 866 HD12 LEU 117 HD12 LEU 117 -9.167 20.456 5.422 867 HD13 LEU 117 HD13 LEU 117 -8.421 20.462 3.988 868 HD21 LEU 117 HD21 LEU 117 -11.967 20.841 4.461 869 HD22 LEU 117 HD22 LEU 117 -12.037 22.456 4.413 870 HD23 LEU 117 HD23 LEU 117 -11.390 21.712 5.695 871 H ILE 118 H ILE 118 -7.435 22.136 1.464 872 HA ILE 118 HA ILE 118 -8.763 23.981 -0.316 873 HB ILE 118 HB ILE 118 -6.297 23.601 -0.528 874 HG12 ILE 118 HG12 ILE 118 -6.321 23.688 -2.952 875 HG13 ILE 118 HG13 ILE 118 -7.932 23.427 -2.889 876 HG21 ILE 118 HG21 ILE 118 -5.589 21.711 -1.826 877 HG22 ILE 118 HG22 ILE 118 -7.099 21.132 -1.808 878 HG23 ILE 118 HG23 ILE 118 -6.252 21.224 -0.434 879 HD11 ILE 118 HD11 ILE 118 -7.494 25.760 -3.198 880 HD12 ILE 118 HD12 ILE 118 -6.626 25.792 -1.834 881 HD13 ILE 118 HD13 ILE 118 -8.221 25.534 -1.772 882 H GLY 119 H GLY 119 -9.284 21.124 1.079 883 HA2 GLY 119 HA2 GLY 119 -11.659 20.693 -0.051 884 HA3 GLY 119 HA3 GLY 119 -10.657 19.886 -1.057 885 H ALA 120 H ALA 120 -12.724 18.648 0.315 886 HA ALA 120 HA ALA 120 -11.225 16.714 1.775 887 HB1 ALA 120 HB1 ALA 120 -11.969 18.187 3.546 888 HB2 ALA 120 HB2 ALA 120 -12.744 16.775 3.690 889 HB3 ALA 120 HB3 ALA 120 -13.498 18.049 3.039 890 H VAL 121 H VAL 121 -12.079 14.629 1.669 891 HA VAL 121 HA VAL 121 -14.644 14.354 0.404 892 HB VAL 121 HB VAL 121 -12.334 12.781 -0.406 893 HG11 VAL 121 HG11 VAL 121 -13.799 11.717 -2.013 894 HG12 VAL 121 HG12 VAL 121 -15.052 12.557 -1.430 895 HG13 VAL 121 HG13 VAL 121 -14.334 11.436 -0.513 896 HG21 VAL 121 HG21 VAL 121 -12.557 13.839 -2.562 897 HG22 VAL 121 HG22 VAL 121 -12.281 14.955 -1.426 898 HG23 VAL 121 HG23 VAL 121 -13.777 14.738 -1.998 899 HA PRO 122 HA PRO 122 -14.411 11.655 3.923 900 HB2 PRO 122 HB2 PRO 122 -16.892 11.661 4.793 901 HB3 PRO 122 HB3 PRO 122 -16.037 13.042 4.969 902 HG2 PRO 122 HG2 PRO 122 -17.888 12.387 2.894 903 HG3 PRO 122 HG3 PRO 122 -17.822 13.762 3.774 904 HD2 PRO 122 HD2 PRO 122 -16.718 13.619 1.379 905 HD3 PRO 122 HD3 PRO 122 -16.116 14.612 2.526 906 H HIS 123 H HIS 123 -15.294 9.559 4.659 907 HA HIS 123 HA HIS 123 -16.769 8.181 2.558 908 HB2 HIS 123 HB2 HIS 123 -14.571 7.419 2.338 909 HB3 HIS 123 HB3 HIS 123 -14.501 7.079 3.934 910 HD1 HIS 123 HD1 HIS 123 -16.096 5.063 4.822 911 HD2 HIS 123 HD2 HIS 123 -15.376 5.314 0.800 912 HE1 HIS 123 HE1 HIS 123 -16.756 2.909 3.769 913 HE2 HIS 123 HE2 HIS 123 -16.333 3.038 1.340 914 H ASP 124 H ASP 124 -18.675 8.518 3.702 915 HA ASP 124 HA ASP 124 -18.731 7.655 6.469 916 HB2 ASP 124 HB2 ASP 124 -20.632 9.368 5.119 917 HB3 ASP 124 HB3 ASP 124 -20.609 9.072 6.724 918 H GLY 125 H GLY 125 -18.723 5.901 4.253 919 HA2 GLY 125 HA2 GLY 125 -20.002 3.841 4.326 920 HA3 GLY 125 HA3 GLY 125 -21.370 4.727 4.434 921 H SER 126 H SER 126 -20.733 6.745 2.620 922 HA SER 126 HA SER 126 -21.455 5.678 0.204 923 HB2 SER 126 HB2 SER 126 -21.683 8.023 0.599 924 HB3 SER 126 HB3 SER 126 -20.060 8.192 0.680 925 HG SER 126 HG SER 126 -20.754 7.091 -1.604 926 HA PRO 127 HA PRO 127 -17.624 4.009 -1.145 927 HB2 PRO 127 HB2 PRO 127 -18.226 3.207 -3.604 928 HB3 PRO 127 HB3 PRO 127 -19.030 2.505 -2.368 929 HG2 PRO 127 HG2 PRO 127 -19.877 4.704 -3.966 930 HG3 PRO 127 HG3 PRO 127 -20.704 3.337 -3.632 931 HD2 PRO 127 HD2 PRO 127 -21.133 5.497 -2.227 932 HD3 PRO 127 HD3 PRO 127 -21.222 4.030 -1.514 933 H ALA 128 H ALA 128 -17.416 6.648 -1.003 934 HA ALA 128 HA ALA 128 -16.689 7.857 -3.335 935 HB1 ALA 128 HB1 ALA 128 -17.075 9.083 -1.259 936 HB2 ALA 128 HB2 ALA 128 -15.659 9.540 -1.894 937 HB3 ALA 128 HB3 ALA 128 -15.692 8.498 -0.658 938 H SER 129 H SER 129 -14.957 5.601 -1.553 939 HA SER 129 HA SER 129 -12.406 6.208 -2.311 940 HB2 SER 129 HB2 SER 129 -13.446 3.519 -1.777 941 HB3 SER 129 HB3 SER 129 -11.882 3.952 -1.587 942 HG SER 129 HG SER 129 -13.149 5.605 -0.149 943 H ARG 130 H ARG 130 -14.828 5.071 -4.286 944 HA ARG 130 HA ARG 130 -13.403 3.635 -6.143 945 HB2 ARG 130 HB2 ARG 130 -15.790 3.782 -6.232 946 HB3 ARG 130 HB3 ARG 130 -15.695 5.376 -6.572 947 HG2 ARG 130 HG2 ARG 130 -14.666 4.771 -8.696 948 HG3 ARG 130 HG3 ARG 130 -15.025 3.214 -8.357 949 HD2 ARG 130 HD2 ARG 130 -17.306 3.645 -8.461 950 HD3 ARG 130 HD3 ARG 130 -17.050 5.256 -8.536 951 HE ARG 130 HE ARG 130 -15.783 4.047 -10.697 952 HH11 ARG 130 HH11 ARG 130 -19.040 4.873 -9.644 953 HH12 ARG 130 HH12 ARG 130 -19.633 4.962 -11.269 954 HH21 ARG 130 HH21 ARG 130 -16.611 4.194 -12.741 955 HH22 ARG 130 HH22 ARG 130 -18.279 4.584 -12.993 956 H ASN 131 H ASN 131 -13.680 7.040 -5.674 957 HA ASN 131 HA ASN 131 -12.173 7.500 -8.085 958 HB2 ASN 131 HB2 ASN 131 -13.768 9.411 -6.585 959 HB3 ASN 131 HB3 ASN 131 -13.046 9.743 -8.012 960 HD21 ASN 131 HD21 ASN 131 -16.713 8.752 -8.222 961 HD22 ASN 131 HD22 ASN 131 -15.883 9.688 -7.024 962 H LEU 132 H LEU 132 -10.041 7.489 -7.720 963 HA LEU 132 HA LEU 132 -9.123 8.618 -5.285 964 HB2 LEU 132 HB2 LEU 132 -8.235 6.596 -6.893 965 HB3 LEU 132 HB3 LEU 132 -7.033 7.700 -6.866 966 HG LEU 132 HG LEU 132 -6.619 6.015 -5.292 967 HD11 LEU 132 HD11 LEU 132 -6.233 7.384 -3.348 968 HD12 LEU 132 HD12 LEU 132 -7.202 8.524 -3.962 969 HD13 LEU 132 HD13 LEU 132 -5.801 8.175 -4.691 970 HD21 LEU 132 HD21 LEU 132 -8.045 5.665 -3.390 971 HD22 LEU 132 HD22 LEU 132 -8.832 5.320 -4.760 972 HD23 LEU 132 HD23 LEU 132 -9.111 6.718 -3.997 973 H SER 133 H SER 133 -9.506 9.702 -8.366 974 HA SER 133 HA SER 133 -7.280 11.504 -8.205 975 HB2 SER 133 HB2 SER 133 -7.576 10.298 -10.302 976 HB3 SER 133 HB3 SER 133 -9.013 11.046 -10.508 977 HG SER 133 HG SER 133 -7.285 11.982 -11.669 978 H HIS 134 H HIS 134 -7.425 13.763 -8.157 979 HA HIS 134 HA HIS 134 -10.074 14.833 -8.223 980 HB2 HIS 134 HB2 HIS 134 -9.235 14.386 -5.869 981 HB3 HIS 134 HB3 HIS 134 -8.357 15.745 -6.092 982 HD1 HIS 134 HD1 HIS 134 -9.596 18.077 -6.139 983 HD2 HIS 134 HD2 HIS 134 -11.954 14.801 -5.427 984 HE1 HIS 134 HE1 HIS 134 -11.825 18.861 -5.358 985 HE2 HIS 134 HE2 HIS 134 -13.259 16.903 -4.913 986 H HIS 135 H HIS 135 -10.368 16.839 -9.079 987 HA HIS 135 HA HIS 135 -8.071 18.084 -10.221 988 HB2 HIS 135 HB2 HIS 135 -10.900 18.625 -10.421 989 HB3 HIS 135 HB3 HIS 135 -9.816 19.655 -11.078 990 HD1 HIS 135 HD1 HIS 135 -8.548 18.977 -13.240 991 HD2 HIS 135 HD2 HIS 135 -11.286 16.253 -11.877 992 HE1 HIS 135 HE1 HIS 135 -8.940 17.296 -15.028 993 HE2 HIS 135 HE2 HIS 135 -10.575 15.629 -14.223 994 H ILE 136 H ILE 136 -7.069 19.972 -9.537 995 HA ILE 136 HA ILE 136 -8.373 21.420 -7.418 996 HB ILE 136 HB ILE 136 -5.517 20.817 -7.437 997 HG12 ILE 136 HG12 ILE 136 -6.848 19.002 -6.643 998 HG13 ILE 136 HG13 ILE 136 -5.797 19.549 -5.520 999 HG21 ILE 136 HG21 ILE 136 -5.329 22.072 -5.367 1000 HG22 ILE 136 HG22 ILE 136 -6.887 22.490 -5.479 1001 HG23 ILE 136 HG23 ILE 136 -5.822 23.043 -6.562 1002 HD11 ILE 136 HD11 ILE 136 -7.919 19.060 -4.481 1003 HD12 ILE 136 HD12 ILE 136 -8.661 20.102 -5.471 1004 HD13 ILE 136 HD13 ILE 136 -7.620 20.644 -4.359 1005 H TYR 137 H TYR 137 -8.665 23.589 -8.030 1006 HA TYR 137 HA TYR 137 -7.291 24.541 -10.279 1007 HB2 TYR 137 HB2 TYR 137 -9.417 25.434 -9.925 1008 HB3 TYR 137 HB3 TYR 137 -9.011 25.940 -8.427 1009 HD1 TYR 137 HD1 TYR 137 -8.058 28.118 -8.077 1010 HD2 TYR 137 HD2 TYR 137 -8.370 26.603 -11.943 1011 HE1 TYR 137 HE1 TYR 137 -7.367 30.253 -8.972 1012 HE2 TYR 137 HE2 TYR 137 -7.671 28.742 -12.833 1013 HH TYR 137 HH TYR 137 -6.939 30.817 -12.415 1014 H ILE 138 H ILE 138 -5.415 25.769 -10.407 1015 HA ILE 138 HA ILE 138 -4.369 26.797 -7.914 1016 HB ILE 138 HB ILE 138 -2.800 25.609 -10.048 1017 HG12 ILE 138 HG12 ILE 138 -3.782 24.005 -8.569 1018 HG13 ILE 138 HG13 ILE 138 -2.150 23.963 -8.515 1019 HG21 ILE 138 HG21 ILE 138 -0.838 26.104 -8.792 1020 HG22 ILE 138 HG22 ILE 138 -1.730 26.912 -7.712 1021 HG23 ILE 138 HG23 ILE 138 -1.596 27.465 -9.226 1022 HD11 ILE 138 HD11 ILE 138 -3.047 23.737 -6.290 1023 HD12 ILE 138 HD12 ILE 138 -3.816 25.152 -6.439 1024 HD13 ILE 138 HD13 ILE 138 -2.200 25.111 -6.385 1025 HA PRO 139 HA PRO 139 -4.622 30.389 -10.451 1026 HB2 PRO 139 HB2 PRO 139 -3.698 32.288 -8.830 1027 HB3 PRO 139 HB3 PRO 139 -5.142 31.614 -8.473 1028 HG2 PRO 139 HG2 PRO 139 -2.587 30.912 -7.421 1029 HG3 PRO 139 HG3 PRO 139 -3.953 31.237 -6.587 1030 HD2 PRO 139 HD2 PRO 139 -3.311 28.767 -7.074 1031 HD3 PRO 139 HD3 PRO 139 -4.884 29.206 -7.096 1032 H GLU 140 H GLU 140 -3.320 32.193 -11.339 1033 HA GLU 140 HA GLU 140 -0.521 31.423 -11.544 1034 HB2 GLU 140 HB2 GLU 140 -1.906 30.792 -13.478 1035 HB3 GLU 140 HB3 GLU 140 -1.959 32.390 -13.809 1036 HG2 GLU 140 HG2 GLU 140 0.328 32.456 -14.150 1037 HG3 GLU 140 HG3 GLU 140 0.493 30.918 -13.626 1038 H ASP 141 H ASP 141 -1.350 33.142 -9.695 1039 HA ASP 141 HA ASP 141 -1.383 35.729 -10.814 1040 HB2 ASP 141 HB2 ASP 141 -2.009 36.469 -8.593 1041 HB3 ASP 141 HB3 ASP 141 -2.909 35.166 -8.993 1042 H ARG 142 H ARG 142 0.778 33.877 -8.881 1043 HA ARG 142 HA ARG 142 2.801 35.884 -9.103 1044 HB2 ARG 142 HB2 ARG 142 1.782 34.997 -6.534 1045 HB3 ARG 142 HB3 ARG 142 3.252 35.699 -6.655 1046 HG2 ARG 142 HG2 ARG 142 2.306 37.729 -7.277 1047 HG3 ARG 142 HG3 ARG 142 0.828 37.050 -7.427 1048 HD2 ARG 142 HD2 ARG 142 0.713 36.745 -5.093 1049 HD3 ARG 142 HD3 ARG 142 2.213 37.369 -4.925 1050 HE ARG 142 HE ARG 142 1.425 39.501 -5.157 1051 HH11 ARG 142 HH11 ARG 142 -0.169 41.017 -5.228 1052 HH12 ARG 142 HH12 ARG 142 -1.808 40.569 -5.564 1053 HH21 ARG 142 HH21 ARG 142 -1.161 37.213 -5.920 1054 HH22 ARG 142 HH22 ARG 142 -2.356 38.466 -5.947 1055 H LEU 143 H LEU 143 4.970 35.164 -8.534 1056 HA LEU 143 HA LEU 143 5.243 32.398 -9.168 1057 HB2 LEU 143 HB2 LEU 143 7.202 34.533 -9.092 1058 HB3 LEU 143 HB3 LEU 143 7.603 33.004 -9.501 1059 HG LEU 143 HG LEU 143 6.064 33.354 -11.416 1060 HD11 LEU 143 HD11 LEU 143 5.901 35.592 -12.238 1061 HD12 LEU 143 HD12 LEU 143 6.570 36.146 -10.874 1062 HD13 LEU 143 HD13 LEU 143 5.113 35.446 -10.834 1063 HD21 LEU 143 HD21 LEU 143 7.949 34.257 -12.699 1064 HD22 LEU 143 HD22 LEU 143 8.477 33.140 -11.655 1065 HD23 LEU 143 HD23 LEU 143 8.656 34.711 -11.317 1066 H GLY 144 H GLY 144 6.382 30.843 -7.885 1067 HA2 GLY 144 HA2 GLY 144 8.183 30.923 -6.120 1068 HA3 GLY 144 HA3 GLY 144 7.071 31.720 -5.229 1069 H TYR 145 H TYR 145 8.249 29.492 -4.182 1070 HA TYR 145 HA TYR 145 6.437 27.392 -4.715 1071 HB2 TYR 145 HB2 TYR 145 8.001 25.902 -3.664 1072 HB3 TYR 145 HB3 TYR 145 8.813 26.859 -4.708 1073 HD1 TYR 145 HD1 TYR 145 10.419 28.533 -3.899 1074 HD2 TYR 145 HD2 TYR 145 8.363 26.060 -1.257 1075 HE1 TYR 145 HE1 TYR 145 11.935 29.162 -2.125 1076 HE2 TYR 145 HE2 TYR 145 9.881 26.691 0.515 1077 HH TYR 145 HH TYR 145 11.399 28.437 1.162 1078 H HIS 146 H HIS 146 5.192 26.165 -3.342 1079 HA HIS 146 HA HIS 146 5.170 26.875 -0.572 1080 HB2 HIS 146 HB2 HIS 146 3.049 27.548 -0.333 1081 HB3 HIS 146 HB3 HIS 146 3.508 28.309 -1.703 1082 HD1 HIS 146 HD1 HIS 146 2.599 27.350 -4.034 1083 HD2 HIS 146 HD2 HIS 146 0.909 25.867 -0.611 1084 HE1 HIS 146 HE1 HIS 146 0.478 26.190 -4.633 1085 HE2 HIS 146 HE2 HIS 146 -0.544 25.267 -2.585 1086 H VAL 147 H VAL 147 3.775 25.235 0.716 1087 HA VAL 147 HA VAL 147 4.223 22.753 -0.580 1088 HB VAL 147 HB VAL 147 3.438 22.676 2.196 1089 HG11 VAL 147 HG11 VAL 147 5.205 21.045 2.384 1090 HG12 VAL 147 HG12 VAL 147 5.648 21.349 0.858 1091 HG13 VAL 147 HG13 VAL 147 4.219 20.657 1.162 1092 HG21 VAL 147 HG21 VAL 147 5.561 23.445 3.051 1093 HG22 VAL 147 HG22 VAL 147 4.824 24.641 2.250 1094 HG23 VAL 147 HG23 VAL 147 6.033 23.825 1.552 1095 H ILE 148 H ILE 148 2.753 20.996 -0.672 1096 HA ILE 148 HA ILE 148 -0.004 21.661 -0.098 1097 HB ILE 148 HB ILE 148 0.899 19.903 -2.245 1098 HG12 ILE 148 HG12 ILE 148 -0.357 22.484 -2.455 1099 HG13 ILE 148 HG13 ILE 148 1.213 22.181 -2.785 1100 HG21 ILE 148 HG21 ILE 148 -1.444 19.647 -2.833 1101 HG22 ILE 148 HG22 ILE 148 -1.871 20.542 -1.556 1102 HG23 ILE 148 HG23 ILE 148 -1.199 19.088 -1.336 1103 HD11 ILE 148 HD11 ILE 148 -0.030 22.368 -4.826 1104 HD12 ILE 148 HD12 ILE 148 -1.004 21.165 -4.360 1105 HD13 ILE 148 HD13 ILE 148 0.551 20.866 -4.688 1106 H LEU 149 H LEU 149 -1.035 20.235 1.336 1107 HA LEU 149 HA LEU 149 0.467 17.879 2.059 1108 HB2 LEU 149 HB2 LEU 149 -1.030 19.643 3.776 1109 HB3 LEU 149 HB3 LEU 149 -0.622 18.141 4.272 1110 HG LEU 149 HG LEU 149 1.701 18.859 4.047 1111 HD11 LEU 149 HD11 LEU 149 2.195 21.184 4.216 1112 HD12 LEU 149 HD12 LEU 149 0.631 21.536 4.001 1113 HD13 LEU 149 HD13 LEU 149 1.479 20.855 2.804 1114 HD21 LEU 149 HD21 LEU 149 1.615 19.892 6.273 1115 HD22 LEU 149 HD22 LEU 149 0.608 18.628 6.213 1116 HD23 LEU 149 HD23 LEU 149 0.027 20.132 6.086 1117 H ALA 150 H ALA 150 -0.734 15.937 2.472 1118 HA ALA 150 HA ALA 150 -3.585 16.130 2.108 1119 HB1 ALA 150 HB1 ALA 150 -2.756 15.385 -0.002 1120 HB2 ALA 150 HB2 ALA 150 -3.573 14.175 0.694 1121 HB3 ALA 150 HB3 ALA 150 -1.956 14.177 0.716 1122 H VAL 151 H VAL 151 -4.799 14.685 3.356 1123 HA VAL 151 HA VAL 151 -3.270 13.023 5.145 1124 HB VAL 151 HB VAL 151 -5.585 14.572 5.969 1125 HG11 VAL 151 HG11 VAL 151 -5.066 13.861 8.218 1126 HG12 VAL 151 HG12 VAL 151 -3.842 12.966 7.656 1127 HG13 VAL 151 HG13 VAL 151 -5.367 12.574 7.287 1128 HG21 VAL 151 HG21 VAL 151 -4.074 15.961 7.220 1129 HG22 VAL 151 HG22 VAL 151 -3.737 16.047 5.641 1130 HG23 VAL 151 HG23 VAL 151 -2.818 15.140 6.616 1131 H TRP 152 H TRP 152 -3.981 10.922 5.273 1132 HA TRP 152 HA TRP 152 -6.612 10.404 4.230 1133 HB2 TRP 152 HB2 TRP 152 -4.718 9.628 2.823 1134 HB3 TRP 152 HB3 TRP 152 -4.463 8.497 3.973 1135 HD1 TRP 152 HD1 TRP 152 -6.810 6.939 4.440 1136 HE1 TRP 152 HE1 TRP 152 -8.363 5.861 2.795 1137 HE3 TRP 152 HE3 TRP 152 -5.584 9.755 0.494 1138 HZ2 TRP 152 HZ2 TRP 152 -8.964 6.292 0.072 1139 HZ3 TRP 152 HZ3 TRP 152 -6.727 9.386 -1.604 1140 HH2 TRP 152 HH2 TRP 152 -8.413 7.674 -1.794 1141 H ASP 153 H ASP 153 -7.824 10.156 6.020 1142 HA ASP 153 HA ASP 153 -6.865 8.701 8.234 1143 HB2 ASP 153 HB2 ASP 153 -9.416 9.903 7.681 1144 HB3 ASP 153 HB3 ASP 153 -9.190 9.008 9.028 1145 H VAL 154 H VAL 154 -7.132 6.596 8.724 1146 HA VAL 154 HA VAL 154 -8.686 4.989 6.871 1147 HB VAL 154 HB VAL 154 -6.197 4.222 8.179 1148 HG11 VAL 154 HG11 VAL 154 -6.275 2.213 6.898 1149 HG12 VAL 154 HG12 VAL 154 -7.711 2.647 6.295 1150 HG13 VAL 154 HG13 VAL 154 -7.564 2.310 7.870 1151 HG21 VAL 154 HG21 VAL 154 -5.200 4.268 5.971 1152 HG22 VAL 154 HG22 VAL 154 -5.764 5.737 6.344 1153 HG23 VAL 154 HG23 VAL 154 -6.600 4.779 5.345 1154 H ALA 155 H ALA 155 -10.323 3.767 7.826 1155 HA ALA 155 HA ALA 155 -10.631 4.089 10.611 1156 HB1 ALA 155 HB1 ALA 155 -12.588 4.084 9.182 1157 HB2 ALA 155 HB2 ALA 155 -12.740 2.907 10.281 1158 HB3 ALA 155 HB3 ALA 155 -12.294 2.549 8.768 1159 H ASP 156 H ASP 156 -9.474 1.722 8.530 1160 HA ASP 156 HA ASP 156 -9.778 -0.500 10.113 1161 HB2 ASP 156 HB2 ASP 156 -8.955 0.002 7.601 1162 HB3 ASP 156 HB3 ASP 156 -7.562 -0.510 8.283 1163 H THR 157 H THR 157 -7.371 1.834 10.266 1164 HA THR 157 HA THR 157 -5.746 0.103 11.895 1165 HB THR 157 HB THR 157 -3.805 1.503 11.054 1166 HG1 THR 157 HG1 THR 157 -4.980 2.136 8.783 1167 HG21 THR 157 HG21 THR 157 -3.605 0.280 8.987 1168 HG22 THR 157 HG22 THR 157 -5.179 -0.090 9.036 1169 HG23 THR 157 HG23 THR 157 -4.165 -0.725 10.124 1170 H GLU 158 H GLU 158 -4.349 1.201 13.550 1171 HA GLU 158 HA GLU 158 -5.846 3.116 14.933 1172 HB2 GLU 158 HB2 GLU 158 -4.201 1.470 15.858 1173 HB3 GLU 158 HB3 GLU 158 -3.065 2.581 15.482 1174 HG2 GLU 158 HG2 GLU 158 -4.319 4.131 16.913 1175 HG3 GLU 158 HG3 GLU 158 -5.131 2.821 17.453 1176 H ASN 159 H ASN 159 -3.632 3.279 12.480 1177 HA ASN 159 HA ASN 159 -2.923 5.984 13.048 1178 HB2 ASN 159 HB2 ASN 159 -1.554 4.005 11.394 1179 HB3 ASN 159 HB3 ASN 159 -1.040 5.553 11.472 1180 HD21 ASN 159 HD21 ASN 159 0.908 5.118 14.248 1181 HD22 ASN 159 HD22 ASN 159 0.469 6.108 12.896 1182 H ALA 160 H ALA 160 -2.604 7.478 11.293 1183 HA ALA 160 HA ALA 160 -4.310 7.023 8.976 1184 HB1 ALA 160 HB1 ALA 160 -5.300 8.706 10.321 1185 HB2 ALA 160 HB2 ALA 160 -4.692 9.416 9.001 1186 HB3 ALA 160 HB3 ALA 160 -3.899 9.510 10.407 1187 H PHE 161 H PHE 161 -3.394 8.287 7.024 1188 HA PHE 161 HA PHE 161 -0.527 8.409 7.287 1189 HB2 PHE 161 HB2 PHE 161 -2.075 7.663 4.962 1190 HB3 PHE 161 HB3 PHE 161 -0.470 7.948 4.867 1191 HD1 PHE 161 HD1 PHE 161 -2.927 5.563 5.758 1192 HD2 PHE 161 HD2 PHE 161 1.138 6.429 6.002 1193 HE1 PHE 161 HE1 PHE 161 -2.487 3.274 6.388 1194 HE2 PHE 161 HE2 PHE 161 1.598 4.149 6.646 1195 HZ PHE 161 HZ PHE 161 -0.217 2.565 6.845 1196 H TYR 162 H TYR 162 0.670 10.089 6.518 1197 HA TYR 162 HA TYR 162 -0.828 12.344 5.499 1198 HB2 TYR 162 HB2 TYR 162 1.309 12.179 7.317 1199 HB3 TYR 162 HB3 TYR 162 1.507 13.344 6.190 1200 HD1 TYR 162 HD1 TYR 162 -1.012 12.265 8.620 1201 HD2 TYR 162 HD2 TYR 162 0.715 15.495 6.645 1202 HE1 TYR 162 HE1 TYR 162 -2.318 13.805 9.983 1203 HE2 TYR 162 HE2 TYR 162 -0.597 17.019 7.985 1204 HH TYR 162 HH TYR 162 -1.791 17.189 10.021 1205 H GLN 163 H GLN 163 -0.101 13.309 3.549 1206 HA GLN 163 HA GLN 163 2.280 12.183 2.328 1207 HB2 GLN 163 HB2 GLN 163 -0.138 12.736 0.875 1208 HB3 GLN 163 HB3 GLN 163 1.266 12.242 0.202 1209 HG2 GLN 163 HG2 GLN 163 1.030 10.193 1.499 1210 HG3 GLN 163 HG3 GLN 163 -0.488 10.685 1.850 1211 HE21 GLN 163 HE21 GLN 163 -0.230 8.407 -1.163 1212 HE22 GLN 163 HE22 GLN 163 0.603 8.362 0.355 1213 H VAL 164 H VAL 164 3.605 13.832 1.359 1214 HA VAL 164 HA VAL 164 2.471 16.475 1.341 1215 HB VAL 164 HB VAL 164 3.594 16.309 3.473 1216 HG11 VAL 164 HG11 VAL 164 5.953 15.965 3.625 1217 HG12 VAL 164 HG12 VAL 164 6.029 15.723 2.028 1218 HG13 VAL 164 HG13 VAL 164 5.242 14.670 2.970 1219 HG21 VAL 164 HG21 VAL 164 4.963 18.244 3.344 1220 HG22 VAL 164 HG22 VAL 164 3.592 18.463 2.515 1221 HG23 VAL 164 HG23 VAL 164 4.969 18.139 1.731 1222 H ILE 165 H ILE 165 3.023 17.785 -0.313 1223 HA ILE 165 HA ILE 165 5.224 16.937 -1.934 1224 HB ILE 165 HB ILE 165 2.633 17.644 -3.122 1225 HG12 ILE 165 HG12 ILE 165 3.854 15.053 -3.300 1226 HG13 ILE 165 HG13 ILE 165 2.709 15.414 -2.193 1227 HG21 ILE 165 HG21 ILE 165 3.666 17.184 -5.282 1228 HG22 ILE 165 HG22 ILE 165 5.077 16.889 -4.550 1229 HG23 ILE 165 HG23 ILE 165 4.462 18.384 -4.548 1230 HD11 ILE 165 HD11 ILE 165 1.713 14.266 -4.054 1231 HD12 ILE 165 HD12 ILE 165 2.249 15.409 -5.064 1232 HD13 ILE 165 HD13 ILE 165 1.116 15.767 -3.967 1233 H ASP 166 H ASP 166 6.603 18.724 -2.279 1234 HA ASP 166 HA ASP 166 5.490 21.324 -1.805 1235 HB2 ASP 166 HB2 ASP 166 7.712 20.599 -1.008 1236 HB3 ASP 166 HB3 ASP 166 8.214 20.865 -2.539 1237 H VAL 167 H VAL 167 5.208 22.950 -3.441 1238 HA VAL 167 HA VAL 167 5.935 22.070 -6.060 1239 HB VAL 167 HB VAL 167 3.855 23.009 -7.001 1240 HG11 VAL 167 HG11 VAL 167 2.450 21.132 -6.393 1241 HG12 VAL 167 HG12 VAL 167 3.433 20.798 -5.153 1242 HG13 VAL 167 HG13 VAL 167 3.960 20.624 -6.672 1243 HG21 VAL 167 HG21 VAL 167 2.004 23.450 -5.547 1244 HG22 VAL 167 HG22 VAL 167 3.219 24.470 -5.234 1245 HG23 VAL 167 HG23 VAL 167 2.952 23.208 -4.260 1246 H ASP 168 H ASP 168 6.694 23.588 -7.519 1247 HA ASP 168 HA ASP 168 6.979 26.280 -6.462 1248 HB2 ASP 168 HB2 ASP 168 8.950 24.870 -7.230 1249 HB3 ASP 168 HB3 ASP 168 8.528 25.478 -8.686 1250 H LEU 169 H LEU 169 5.642 27.791 -7.407 1251 HA LEU 169 HA LEU 169 4.468 26.993 -9.926 1252 HB2 LEU 169 HB2 LEU 169 3.201 28.293 -7.685 1253 HB3 LEU 169 HB3 LEU 169 2.479 28.195 -9.146 1254 HG LEU 169 HG LEU 169 3.280 25.789 -7.781 1255 HD11 LEU 169 HD11 LEU 169 1.103 25.669 -6.815 1256 HD12 LEU 169 HD12 LEU 169 0.751 27.129 -7.414 1257 HD13 LEU 169 HD13 LEU 169 1.880 26.977 -6.267 1258 HD21 LEU 169 HD21 LEU 169 1.604 24.766 -9.142 1259 HD22 LEU 169 HD22 LEU 169 2.672 25.534 -10.082 1260 HD23 LEU 169 HD23 LEU 169 1.230 26.203 -9.784 1261 H VAL 170 H VAL 170 4.651 28.314 -11.609 1262 HA VAL 170 HA VAL 170 5.148 31.057 -11.009 1263 HB VAL 170 HB VAL 170 6.935 31.201 -12.626 1264 HG11 VAL 170 HG11 VAL 170 8.658 30.031 -11.373 1265 HG12 VAL 170 HG12 VAL 170 7.517 29.185 -10.600 1266 HG13 VAL 170 HG13 VAL 170 7.644 30.779 -10.359 1267 HG21 VAL 170 HG21 VAL 170 7.876 29.197 -13.607 1268 HG22 VAL 170 HG22 VAL 170 6.341 29.383 -14.079 1269 HG23 VAL 170 HG23 VAL 170 6.707 28.314 -12.922 1270 H ASN 171 H ASN 171 5.036 32.485 -13.057 1271 HA ASN 171 HA ASN 171 2.673 31.834 -14.431 1272 HB2 ASN 171 HB2 ASN 171 4.484 34.067 -14.716 1273 HB3 ASN 171 HB3 ASN 171 3.140 33.935 -15.634 1274 HD21 ASN 171 HD21 ASN 171 1.124 35.518 -13.382 1275 HD22 ASN 171 HD22 ASN 171 1.486 35.121 -15.029 1276 H LYS 172 H LYS 172 2.437 31.671 -16.790 1277 HA LYS 172 HA LYS 172 4.492 30.094 -17.936 1278 HB2 LYS 172 HB2 LYS 172 1.979 31.026 -19.035 1279 HB3 LYS 172 HB3 LYS 172 2.964 30.004 -19.843 1280 HG2 LYS 172 HG2 LYS 172 2.499 28.284 -18.473 1281 HG3 LYS 172 HG3 LYS 172 1.981 29.265 -17.274 1282 HD2 LYS 172 HD2 LYS 172 0.058 29.793 -18.598 1283 HD3 LYS 172 HD3 LYS 172 0.559 28.703 -19.706 1284 HE2 LYS 172 HE2 LYS 172 -0.142 26.994 -18.497 1285 HE3 LYS 172 HE3 LYS 172 0.399 27.655 -17.105 1286 HZ1 LYS 172 HZ1 LYS 172 -1.954 27.473 -17.062 1287 HZ2 LYS 172 HZ2 LYS 172 -2.059 28.377 -18.399 1288 HZ3 LYS 172 HZ3 LYS 172 -1.523 29.031 -17.021 Start of MODEL 16 1 H1 HIS 1 H1 HIS 1 3.459 2.710 3.243 2 H2 HIS 1 H2 HIS 1 2.110 2.054 2.639 3 H3 HIS 1 H3 HIS 1 2.264 3.662 2.713 4 HA HIS 1 HA HIS 1 3.981 3.604 1.148 5 HB2 HIS 1 HB2 HIS 1 4.191 1.368 -0.092 6 HB3 HIS 1 HB3 HIS 1 5.088 1.631 1.248 7 HD1 HIS 1 HD1 HIS 1 4.863 0.057 3.218 8 HD2 HIS 1 HD2 HIS 1 1.931 -0.362 0.382 9 HE1 HIS 1 HE1 HIS 1 3.525 -1.976 3.754 10 HE2 HIS 1 HE2 HIS 1 1.740 -2.234 2.068 11 H GLY 2 H GLY 2 3.548 4.037 -1.044 12 HA2 GLY 2 HA2 GLY 2 1.367 2.972 -2.403 13 HA3 GLY 2 HA3 GLY 2 0.921 4.403 -1.754 14 H PHE 3 H PHE 3 0.882 4.632 -4.383 15 HA PHE 3 HA PHE 3 3.439 5.753 -5.045 16 HB2 PHE 3 HB2 PHE 3 1.688 4.395 -6.936 17 HB3 PHE 3 HB3 PHE 3 3.169 4.974 -7.306 18 HD1 PHE 3 HD1 PHE 3 5.147 3.942 -5.872 19 HD2 PHE 3 HD2 PHE 3 1.468 2.112 -6.542 20 HE1 PHE 3 HE1 PHE 3 6.128 1.798 -5.352 21 HE2 PHE 3 HE2 PHE 3 2.434 -0.040 -6.029 22 HZ PHE 3 HZ PHE 3 4.773 -0.199 -5.434 23 H ILE 4 H ILE 4 3.525 7.558 -6.510 24 HA ILE 4 HA ILE 4 1.040 9.015 -6.746 25 HB ILE 4 HB ILE 4 3.677 9.948 -7.417 26 HG12 ILE 4 HG12 ILE 4 2.128 10.687 -5.102 27 HG13 ILE 4 HG13 ILE 4 3.316 9.568 -5.048 28 HG21 ILE 4 HG21 ILE 4 2.641 12.137 -7.600 29 HG22 ILE 4 HG22 ILE 4 1.193 11.479 -7.310 30 HG23 ILE 4 HG23 ILE 4 1.981 11.127 -8.677 31 HD11 ILE 4 HD11 ILE 4 4.122 11.656 -4.209 32 HD12 ILE 4 HD12 ILE 4 3.755 12.378 -5.609 33 HD13 ILE 4 HD13 ILE 4 4.931 11.270 -5.555 34 H GLU 5 H GLU 5 -0.133 8.681 -8.629 35 HA GLU 5 HA GLU 5 0.972 6.979 -10.595 36 HB2 GLU 5 HB2 GLU 5 -1.346 6.941 -9.729 37 HB3 GLU 5 HB3 GLU 5 -1.626 8.260 -10.651 38 HG2 GLU 5 HG2 GLU 5 -2.504 6.274 -11.642 39 HG3 GLU 5 HG3 GLU 5 -1.403 6.996 -12.607 40 H LYS 6 H LYS 6 1.541 9.976 -10.233 41 HA LYS 6 HA LYS 6 2.525 11.491 -11.547 42 HB2 LYS 6 HB2 LYS 6 1.879 10.092 -13.982 43 HB3 LYS 6 HB3 LYS 6 2.983 11.285 -13.826 44 HG2 LYS 6 HG2 LYS 6 4.530 9.905 -12.934 45 HG3 LYS 6 HG3 LYS 6 3.411 8.832 -12.418 46 HD2 LYS 6 HD2 LYS 6 2.972 8.324 -14.776 47 HD3 LYS 6 HD3 LYS 6 4.301 9.203 -15.136 48 HE2 LYS 6 HE2 LYS 6 5.669 7.698 -13.963 49 HE3 LYS 6 HE3 LYS 6 4.363 6.866 -13.445 50 HZ1 LYS 6 HZ1 LYS 6 5.390 5.725 -15.262 51 HZ2 LYS 6 HZ2 LYS 6 5.199 7.027 -16.201 52 HZ3 LYS 6 HZ3 LYS 6 3.906 6.203 -15.688 53 HA PRO 7 HA PRO 7 2.841 13.400 -13.173 54 HB2 PRO 7 HB2 PRO 7 2.285 15.998 -12.918 55 HB3 PRO 7 HB3 PRO 7 1.867 15.242 -14.305 56 HG2 PRO 7 HG2 PRO 7 0.227 15.760 -12.039 57 HG3 PRO 7 HG3 PRO 7 -0.110 16.058 -13.609 58 HD2 PRO 7 HD2 PRO 7 -1.036 13.910 -12.491 59 HD3 PRO 7 HD3 PRO 7 -0.550 13.859 -14.050 60 H GLY 8 H GLY 8 4.539 14.072 -11.921 61 HA2 GLY 8 HA2 GLY 8 5.277 15.163 -10.017 62 HA3 GLY 8 HA3 GLY 8 3.826 14.957 -9.299 63 H SER 9 H SER 9 5.188 12.109 -10.586 64 HA SER 9 HA SER 9 5.354 10.983 -8.078 65 HB2 SER 9 HB2 SER 9 5.108 9.557 -9.989 66 HB3 SER 9 HB3 SER 9 6.595 9.976 -10.518 67 HG SER 9 HG SER 9 6.706 9.039 -8.053 68 H ARG 10 H ARG 10 6.895 10.818 -6.493 69 HA ARG 10 HA ARG 10 9.224 12.283 -6.948 70 HB2 ARG 10 HB2 ARG 10 9.641 12.303 -4.722 71 HB3 ARG 10 HB3 ARG 10 8.013 12.189 -4.778 72 HG2 ARG 10 HG2 ARG 10 8.069 9.976 -4.089 73 HG3 ARG 10 HG3 ARG 10 9.690 9.900 -4.278 74 HD2 ARG 10 HD2 ARG 10 8.409 11.609 -2.298 75 HD3 ARG 10 HD3 ARG 10 9.062 10.158 -1.930 76 HE ARG 10 HE ARG 10 11.083 11.560 -3.093 77 HH11 ARG 10 HH11 ARG 10 12.610 12.727 -1.991 78 HH12 ARG 10 HH12 ARG 10 12.324 13.236 -0.360 79 HH21 ARG 10 HH21 ARG 10 9.177 11.884 -0.139 80 HH22 ARG 10 HH22 ARG 10 10.430 12.771 0.662 81 H ALA 11 H ALA 11 8.548 9.102 -7.441 82 HA ALA 11 HA ALA 11 10.864 7.911 -6.618 83 HB1 ALA 11 HB1 ALA 11 8.922 6.634 -7.341 84 HB2 ALA 11 HB2 ALA 11 10.238 6.081 -8.100 85 HB3 ALA 11 HB3 ALA 11 9.210 7.060 -8.874 86 H ALA 12 H ALA 12 10.264 9.567 -9.609 87 HA ALA 12 HA ALA 12 12.680 8.819 -10.786 88 HB1 ALA 12 HB1 ALA 12 10.846 9.649 -12.126 89 HB2 ALA 12 HB2 ALA 12 12.164 10.534 -12.429 90 HB3 ALA 12 HB3 ALA 12 11.008 11.112 -11.458 91 H LEU 13 H LEU 13 11.870 11.148 -8.501 92 HA LEU 13 HA LEU 13 14.251 12.675 -8.860 93 HB2 LEU 13 HB2 LEU 13 11.909 13.062 -7.249 94 HB3 LEU 13 HB3 LEU 13 13.248 13.934 -6.910 95 HG LEU 13 HG LEU 13 13.119 14.902 -9.086 96 HD11 LEU 13 HD11 LEU 13 11.130 14.747 -10.411 97 HD12 LEU 13 HD12 LEU 13 10.552 13.614 -9.413 98 HD13 LEU 13 HD13 LEU 13 11.862 13.309 -10.310 99 HD21 LEU 13 HD21 LEU 13 11.238 16.372 -8.534 100 HD22 LEU 13 HD22 LEU 13 12.125 16.082 -7.214 101 HD23 LEU 13 HD23 LEU 13 10.732 15.292 -7.442 102 H CYS 14 H CYS 14 13.468 9.934 -7.355 103 HA CYS 14 HA CYS 14 15.044 10.255 -4.983 104 HB2 CYS 14 HB2 CYS 14 13.148 9.022 -4.781 105 HB3 CYS 14 HB3 CYS 14 13.517 8.133 -6.101 106 H SER 15 H SER 15 15.485 9.468 -8.167 107 HA SER 15 HA SER 15 17.324 7.487 -8.048 108 HB2 SER 15 HB2 SER 15 16.243 8.948 -10.047 109 HB3 SER 15 HB3 SER 15 17.839 9.260 -10.205 110 HG SER 15 HG SER 15 17.361 6.670 -9.891 111 H GLU 16 H GLU 16 19.597 7.418 -8.653 112 HA GLU 16 HA GLU 16 21.206 8.836 -7.011 113 HB2 GLU 16 HB2 GLU 16 23.025 7.889 -8.237 114 HB3 GLU 16 HB3 GLU 16 21.832 6.778 -8.131 115 HG2 GLU 16 HG2 GLU 16 22.429 8.345 -10.489 116 HG3 GLU 16 HG3 GLU 16 22.740 6.751 -10.319 117 H ALA 17 H ALA 17 19.957 9.891 -9.935 118 HA ALA 17 HA ALA 17 21.694 11.852 -10.647 119 HB1 ALA 17 HB1 ALA 17 19.754 11.229 -11.981 120 HB2 ALA 17 HB2 ALA 17 19.786 12.836 -11.805 121 HB3 ALA 17 HB3 ALA 17 18.782 11.944 -10.904 122 H PHE 18 H PHE 18 19.987 11.721 -7.820 123 HA PHE 18 HA PHE 18 19.658 14.445 -7.297 124 HB2 PHE 18 HB2 PHE 18 18.409 12.742 -6.140 125 HB3 PHE 18 HB3 PHE 18 19.789 12.163 -5.486 126 HD1 PHE 18 HD1 PHE 18 17.687 15.126 -5.455 127 HD2 PHE 18 HD2 PHE 18 20.460 12.851 -3.344 128 HE1 PHE 18 HE1 PHE 18 17.325 16.506 -3.504 129 HE2 PHE 18 HE2 PHE 18 20.101 14.213 -1.384 130 HZ PHE 18 HZ PHE 18 18.538 16.050 -1.463 131 H GLY 19 H GLY 19 22.425 12.553 -7.370 132 HA2 GLY 19 HA2 GLY 19 24.232 14.400 -7.198 133 HA3 GLY 19 HA3 GLY 19 23.859 14.298 -5.611 134 H PHE 20 H PHE 20 23.567 11.288 -6.673 135 HA PHE 20 HA PHE 20 24.768 9.485 -6.405 136 HB2 PHE 20 HB2 PHE 20 26.046 10.801 -8.268 137 HB3 PHE 20 HB3 PHE 20 27.281 10.561 -7.226 138 HD1 PHE 20 HD1 PHE 20 24.985 8.902 -9.421 139 HD2 PHE 20 HD2 PHE 20 28.288 8.374 -6.951 140 HE1 PHE 20 HE1 PHE 20 25.281 6.675 -10.304 141 HE2 PHE 20 HE2 PHE 20 28.602 6.150 -7.830 142 HZ PHE 20 HZ PHE 20 27.087 5.291 -9.501 143 H LEU 21 H LEU 21 24.805 11.322 -4.125 144 HA LEU 21 HA LEU 21 27.188 10.621 -2.761 145 HB2 LEU 21 HB2 LEU 21 24.801 11.892 -1.726 146 HB3 LEU 21 HB3 LEU 21 26.208 11.790 -0.903 147 HG LEU 21 HG LEU 21 25.845 13.380 -3.275 148 HD11 LEU 21 HD11 LEU 21 25.907 15.273 -1.768 149 HD12 LEU 21 HD12 LEU 21 25.998 14.265 -0.507 150 HD13 LEU 21 HD13 LEU 21 24.653 14.319 -1.403 151 HD21 LEU 21 HD21 LEU 21 27.999 14.306 -2.802 152 HD22 LEU 21 HD22 LEU 21 28.122 12.715 -3.060 153 HD23 LEU 21 HD23 LEU 21 28.167 13.295 -1.552 154 H ASN 22 H ASN 22 24.482 9.077 -3.525 155 HA ASN 22 HA ASN 22 24.502 7.334 -1.244 156 HB2 ASN 22 HB2 ASN 22 22.386 9.032 -2.067 157 HB3 ASN 22 HB3 ASN 22 21.894 7.492 -1.840 158 HD21 ASN 22 HD21 ASN 22 22.492 9.870 1.246 159 HD22 ASN 22 HD22 ASN 22 22.660 10.387 -0.398 160 H LEU 23 H LEU 23 22.722 5.518 -1.727 161 HA LEU 23 HA LEU 23 23.622 4.100 -3.961 162 HB2 LEU 23 HB2 LEU 23 21.433 3.587 -2.164 163 HB3 LEU 23 HB3 LEU 23 21.807 2.562 -3.379 164 HG LEU 23 HG LEU 23 23.946 2.230 -2.246 165 HD11 LEU 23 HD11 LEU 23 24.058 2.637 0.100 166 HD12 LEU 23 HD12 LEU 23 22.652 3.433 0.036 167 HD13 LEU 23 HD13 LEU 23 23.955 4.032 -0.711 168 HD21 LEU 23 HD21 LEU 23 22.914 0.578 -0.752 169 HD22 LEU 23 HD22 LEU 23 22.155 0.576 -2.180 170 HD23 LEU 23 HD23 LEU 23 21.495 1.335 -0.914 171 H ASN 24 H ASN 24 21.961 3.189 -5.579 172 HA ASN 24 HA ASN 24 21.033 5.040 -7.165 173 HB2 ASN 24 HB2 ASN 24 19.805 2.398 -6.791 174 HB3 ASN 24 HB3 ASN 24 19.540 3.278 -8.142 175 HD21 ASN 24 HD21 ASN 24 21.946 0.989 -9.357 176 HD22 ASN 24 HD22 ASN 24 20.243 1.220 -9.141 177 H CYS 25 H CYS 25 19.244 4.133 -4.419 178 HA CYS 25 HA CYS 25 17.575 6.376 -4.889 179 HB2 CYS 25 HB2 CYS 25 16.618 3.990 -5.385 180 HB3 CYS 25 HB3 CYS 25 16.055 4.294 -3.882 181 H GLY 26 H GLY 26 19.261 4.396 -2.826 182 HA2 GLY 26 HA2 GLY 26 19.779 4.841 -0.644 183 HA3 GLY 26 HA3 GLY 26 18.638 6.007 -0.573 184 H SER 27 H SER 27 18.910 4.462 1.619 185 HA SER 27 HA SER 27 17.436 2.122 1.536 186 HB2 SER 27 HB2 SER 27 19.043 2.660 3.313 187 HB3 SER 27 HB3 SER 27 17.978 3.743 3.912 188 HG SER 27 HG SER 27 17.339 2.196 5.080 189 H VAL 28 H VAL 28 16.467 5.331 2.010 190 HA VAL 28 HA VAL 28 14.027 4.834 3.212 191 HB VAL 28 HB VAL 28 15.285 7.023 3.162 192 HG11 VAL 28 HG11 VAL 28 14.887 8.521 1.326 193 HG12 VAL 28 HG12 VAL 28 14.062 7.363 0.555 194 HG13 VAL 28 HG13 VAL 28 15.650 7.192 0.810 195 HG21 VAL 28 HG21 VAL 28 13.373 8.441 3.341 196 HG22 VAL 28 HG22 VAL 28 13.132 7.060 4.146 197 HG23 VAL 28 HG23 VAL 28 12.447 7.282 2.698 198 H MET 29 H MET 29 14.850 4.124 0.154 199 HA MET 29 HA MET 29 12.735 5.019 -1.238 200 HB2 MET 29 HB2 MET 29 13.481 3.562 -2.997 201 HB3 MET 29 HB3 MET 29 14.809 4.032 -2.170 202 HG2 MET 29 HG2 MET 29 14.809 2.012 -1.008 203 HG3 MET 29 HG3 MET 29 13.469 1.542 -1.815 204 HE1 MET 29 HE1 MET 29 14.644 0.893 -5.419 205 HE2 MET 29 HE2 MET 29 13.827 2.153 -4.820 206 HE3 MET 29 HE3 MET 29 13.437 0.649 -4.371 207 H TYR 30 H TYR 30 12.316 2.664 0.993 208 HA TYR 30 HA TYR 30 10.508 1.064 -0.394 209 HB2 TYR 30 HB2 TYR 30 11.537 0.264 1.579 210 HB3 TYR 30 HB3 TYR 30 10.804 1.427 2.460 211 HD1 TYR 30 HD1 TYR 30 10.057 -1.562 0.513 212 HD2 TYR 30 HD2 TYR 30 8.707 1.009 3.493 213 HE1 TYR 30 HE1 TYR 30 8.205 -3.050 0.968 214 HE2 TYR 30 HE2 TYR 30 6.855 -0.483 3.940 215 HH TYR 30 HH TYR 30 5.507 -2.209 2.803 216 H GLU 31 H GLU 31 10.081 3.842 1.691 217 HA GLU 31 HA GLU 31 7.789 4.499 0.255 218 HB2 GLU 31 HB2 GLU 31 6.275 4.660 2.173 219 HB3 GLU 31 HB3 GLU 31 6.640 3.133 1.721 220 HG2 GLU 31 HG2 GLU 31 8.297 3.232 3.591 221 HG3 GLU 31 HG3 GLU 31 7.379 4.473 4.124 222 HA PRO 32 HA PRO 32 9.914 8.073 1.955 223 HB2 PRO 32 HB2 PRO 32 10.797 9.267 -0.256 224 HB3 PRO 32 HB3 PRO 32 11.652 8.010 0.341 225 HG2 PRO 32 HG2 PRO 32 9.703 7.961 -1.739 226 HG3 PRO 32 HG3 PRO 32 11.201 7.311 -1.759 227 HD2 PRO 32 HD2 PRO 32 9.149 5.812 -1.217 228 HD3 PRO 32 HD3 PRO 32 10.574 5.538 -0.467 229 H GLN 33 H GLN 33 7.341 7.639 0.006 230 HA GLN 33 HA GLN 33 6.560 10.371 0.221 231 HB2 GLN 33 HB2 GLN 33 4.926 9.944 -1.389 232 HB3 GLN 33 HB3 GLN 33 6.261 9.148 -1.888 233 HG2 GLN 33 HG2 GLN 33 3.944 7.918 -0.692 234 HG3 GLN 33 HG3 GLN 33 4.376 7.799 -2.263 235 HE21 GLN 33 HE21 GLN 33 5.535 5.041 0.187 236 HE22 GLN 33 HE22 GLN 33 4.133 6.051 0.307 237 H SER 34 H SER 34 6.459 8.032 2.329 238 HA SER 34 HA SER 34 3.799 8.631 3.208 239 HB2 SER 34 HB2 SER 34 4.394 6.212 2.464 240 HB3 SER 34 HB3 SER 34 5.048 6.098 3.956 241 HG SER 34 HG SER 34 2.449 6.185 3.222 242 H LEU 35 H LEU 35 3.468 9.502 5.175 243 HA LEU 35 HA LEU 35 5.565 9.168 7.138 244 HB2 LEU 35 HB2 LEU 35 3.704 11.327 6.951 245 HB3 LEU 35 HB3 LEU 35 4.767 11.140 8.176 246 HG LEU 35 HG LEU 35 5.569 11.611 5.460 247 HD11 LEU 35 HD11 LEU 35 6.022 13.893 6.158 248 HD12 LEU 35 HD12 LEU 35 5.414 13.562 7.620 249 HD13 LEU 35 HD13 LEU 35 4.447 13.566 6.323 250 HD21 LEU 35 HD21 LEU 35 7.742 12.065 6.357 251 HD22 LEU 35 HD22 LEU 35 7.296 10.549 6.700 252 HD23 LEU 35 HD23 LEU 35 7.211 11.694 7.838 253 H GLU 36 H GLU 36 4.978 8.272 9.168 254 HA GLU 36 HA GLU 36 2.276 7.268 9.219 255 HB2 GLU 36 HB2 GLU 36 4.525 6.122 10.646 256 HB3 GLU 36 HB3 GLU 36 3.104 5.374 10.347 257 HG2 GLU 36 HG2 GLU 36 5.095 5.955 8.329 258 HG3 GLU 36 HG3 GLU 36 4.841 4.476 8.973 259 H ALA 37 H ALA 37 0.928 7.466 11.014 260 HA ALA 37 HA ALA 37 2.049 8.721 13.360 261 HB1 ALA 37 HB1 ALA 37 1.007 10.488 12.111 262 HB2 ALA 37 HB2 ALA 37 0.172 10.243 13.475 263 HB3 ALA 37 HB3 ALA 37 -0.382 9.660 12.072 264 H LYS 38 H LYS 38 0.743 8.383 15.387 265 HA LYS 38 HA LYS 38 -1.092 6.182 15.068 266 HB2 LYS 38 HB2 LYS 38 1.165 5.616 16.015 267 HB3 LYS 38 HB3 LYS 38 0.626 6.329 17.382 268 HG2 LYS 38 HG2 LYS 38 -1.103 4.691 17.533 269 HG3 LYS 38 HG3 LYS 38 -0.512 3.962 16.196 270 HD2 LYS 38 HD2 LYS 38 1.453 3.425 17.314 271 HD3 LYS 38 HD3 LYS 38 0.957 4.248 18.635 272 HE2 LYS 38 HE2 LYS 38 -0.922 2.701 18.779 273 HE3 LYS 38 HE3 LYS 38 -0.201 1.814 17.613 274 HZ1 LYS 38 HZ1 LYS 38 0.334 0.938 19.752 275 HZ2 LYS 38 HZ2 LYS 38 0.961 2.362 20.189 276 HZ3 LYS 38 HZ3 LYS 38 1.675 1.484 19.034 277 H LYS 39 H LYS 39 -2.658 5.763 16.737 278 HA LYS 39 HA LYS 39 -3.699 8.195 17.834 279 HB2 LYS 39 HB2 LYS 39 -4.919 5.566 17.616 280 HB3 LYS 39 HB3 LYS 39 -5.720 6.896 18.122 281 HG2 LYS 39 HG2 LYS 39 -5.635 7.822 15.979 282 HG3 LYS 39 HG3 LYS 39 -4.682 6.605 15.452 283 HD2 LYS 39 HD2 LYS 39 -6.472 5.069 15.879 284 HD3 LYS 39 HD3 LYS 39 -7.423 6.332 16.291 285 HE2 LYS 39 HE2 LYS 39 -7.307 7.177 14.091 286 HE3 LYS 39 HE3 LYS 39 -6.272 5.987 13.665 287 HZ1 LYS 39 HZ1 LYS 39 -8.470 5.455 12.939 288 HZ2 LYS 39 HZ2 LYS 39 -9.007 5.554 14.461 289 HZ3 LYS 39 HZ3 LYS 39 -7.982 4.376 14.040 290 H GLY 40 H GLY 40 -4.812 8.027 20.049 291 HA2 GLY 40 HA2 GLY 40 -4.912 6.966 22.120 292 HA3 GLY 40 HA3 GLY 40 -3.595 6.068 21.763 293 H PHE 41 H PHE 41 -4.721 8.674 23.485 294 HA PHE 41 HA PHE 41 -2.526 10.326 23.422 295 HB2 PHE 41 HB2 PHE 41 -4.529 10.013 25.477 296 HB3 PHE 41 HB3 PHE 41 -3.400 11.190 25.559 297 HD1 PHE 41 HD1 PHE 41 -6.580 10.429 24.411 298 HD2 PHE 41 HD2 PHE 41 -3.298 12.857 23.581 299 HE1 PHE 41 HE1 PHE 41 -7.984 11.853 23.062 300 HE2 PHE 41 HE2 PHE 41 -4.690 14.289 22.225 301 HZ PHE 41 HZ PHE 41 -7.039 13.789 21.967 302 HA PRO 42 HA PRO 42 -1.103 11.713 24.865 303 HB2 PRO 42 HB2 PRO 42 1.545 11.924 25.160 304 HB3 PRO 42 HB3 PRO 42 0.625 11.787 26.502 305 HG2 PRO 42 HG2 PRO 42 1.993 9.702 25.111 306 HG3 PRO 42 HG3 PRO 42 2.034 10.025 26.711 307 HD2 PRO 42 HD2 PRO 42 0.430 8.186 25.815 308 HD3 PRO 42 HD3 PRO 42 -0.043 9.128 27.062 309 H HIS 43 H HIS 43 0.232 9.134 23.226 310 HA HIS 43 HA HIS 43 -0.321 10.234 20.797 311 HB2 HIS 43 HB2 HIS 43 2.042 10.231 19.880 312 HB3 HIS 43 HB3 HIS 43 1.482 11.572 20.626 313 HD1 HIS 43 HD1 HIS 43 4.008 8.914 20.932 314 HD2 HIS 43 HD2 HIS 43 2.697 12.136 23.092 315 HE1 HIS 43 HE1 HIS 43 5.640 9.358 22.753 316 HE2 HIS 43 HE2 HIS 43 4.874 11.300 24.066 317 H SER 44 H SER 44 1.522 7.991 22.592 318 HA SER 44 HA SER 44 1.843 5.837 22.450 319 HB2 SER 44 HB2 SER 44 -0.564 5.685 21.911 320 HB3 SER 44 HB3 SER 44 -0.140 5.518 20.343 321 HG SER 44 HG SER 44 0.292 3.771 22.407 322 H GLY 45 H GLY 45 1.815 7.181 19.280 323 HA2 GLY 45 HA2 GLY 45 3.944 5.468 18.395 324 HA3 GLY 45 HA3 GLY 45 3.138 6.555 17.479 325 HA PRO 46 HA PRO 46 6.933 8.872 18.521 326 HB2 PRO 46 HB2 PRO 46 7.132 10.234 16.277 327 HB3 PRO 46 HB3 PRO 46 7.623 8.677 16.275 328 HG2 PRO 46 HG2 PRO 46 5.104 9.707 15.435 329 HG3 PRO 46 HG3 PRO 46 6.093 8.699 14.616 330 HD2 PRO 46 HD2 PRO 46 4.098 7.723 15.959 331 HD3 PRO 46 HD3 PRO 46 5.506 6.898 15.898 332 H ALA 47 H ALA 47 7.068 11.590 17.911 333 HA ALA 47 HA ALA 47 5.015 12.545 19.583 334 HB1 ALA 47 HB1 ALA 47 7.142 13.658 19.554 335 HB2 ALA 47 HB2 ALA 47 5.987 14.728 19.186 336 HB3 ALA 47 HB3 ALA 47 6.909 14.100 18.016 337 H ASP 48 H ASP 48 3.045 12.010 18.673 338 HA ASP 48 HA ASP 48 2.496 12.822 16.020 339 HB2 ASP 48 HB2 ASP 48 0.937 11.278 17.935 340 HB3 ASP 48 HB3 ASP 48 0.360 11.611 16.444 341 H GLY 49 H GLY 49 0.463 13.893 15.380 342 HA2 GLY 49 HA2 GLY 49 -1.160 15.420 15.736 343 HA3 GLY 49 HA3 GLY 49 -0.930 15.322 17.350 344 H GLN 50 H GLN 50 2.011 16.040 16.333 345 HA GLN 50 HA GLN 50 1.789 18.637 17.277 346 HB2 GLN 50 HB2 GLN 50 4.061 17.438 15.936 347 HB3 GLN 50 HB3 GLN 50 4.144 18.809 16.819 348 HG2 GLN 50 HG2 GLN 50 3.643 16.164 17.837 349 HG3 GLN 50 HG3 GLN 50 4.957 17.083 18.147 350 HE21 GLN 50 HE21 GLN 50 2.005 17.174 20.682 351 HE22 GLN 50 HE22 GLN 50 2.399 15.901 19.577 352 H ILE 51 H ILE 51 1.657 17.387 14.121 353 HA ILE 51 HA ILE 51 2.083 19.791 12.794 354 HB ILE 51 HB ILE 51 0.579 17.486 11.820 355 HG12 ILE 51 HG12 ILE 51 3.338 18.113 11.255 356 HG13 ILE 51 HG13 ILE 51 2.889 17.031 12.392 357 HG21 ILE 51 HG21 ILE 51 0.921 18.359 9.583 358 HG22 ILE 51 HG22 ILE 51 1.646 19.667 10.198 359 HG23 ILE 51 HG23 ILE 51 0.069 19.420 10.457 360 HD11 ILE 51 HD11 ILE 51 3.548 15.885 10.390 361 HD12 ILE 51 HD12 ILE 51 2.424 16.685 9.546 362 HD13 ILE 51 HD13 ILE 51 1.979 15.613 10.672 363 H ALA 52 H ALA 52 -0.733 18.225 14.086 364 HA ALA 52 HA ALA 52 -2.576 20.046 13.083 365 HB1 ALA 52 HB1 ALA 52 -3.246 17.813 13.787 366 HB2 ALA 52 HB2 ALA 52 -4.165 18.907 14.543 367 HB3 ALA 52 HB3 ALA 52 -2.939 18.203 15.326 368 H SER 53 H SER 53 -0.765 19.971 16.001 369 HA SER 53 HA SER 53 -2.127 22.170 17.146 370 HB2 SER 53 HB2 SER 53 -0.459 22.021 18.895 371 HB3 SER 53 HB3 SER 53 -1.037 20.529 18.567 372 HG SER 53 HG SER 53 0.788 19.908 17.825 373 H ALA 54 H ALA 54 -0.206 21.941 14.651 374 HA ALA 54 HA ALA 54 1.095 23.252 13.494 375 HB1 ALA 54 HB1 ALA 54 -0.724 24.854 13.654 376 HB2 ALA 54 HB2 ALA 54 0.682 25.638 13.505 377 HB3 ALA 54 HB3 ALA 54 -0.026 25.517 14.953 378 H GLY 55 H GLY 55 2.066 22.298 16.145 379 HA2 GLY 55 HA2 GLY 55 4.176 24.151 16.680 380 HA3 GLY 55 HA3 GLY 55 3.870 22.774 17.503 381 H GLY 56 H GLY 56 3.678 21.136 15.139 382 HA2 GLY 56 HA2 GLY 56 6.410 20.489 14.934 383 HA3 GLY 56 HA3 GLY 56 5.169 19.694 14.229 384 H LEU 57 H LEU 57 4.660 22.689 13.251 385 HA LEU 57 HA LEU 57 5.480 22.202 10.670 386 HB2 LEU 57 HB2 LEU 57 4.813 24.756 11.851 387 HB3 LEU 57 HB3 LEU 57 4.909 24.510 10.239 388 HG LEU 57 HG LEU 57 2.917 23.290 11.918 389 HD11 LEU 57 HD11 LEU 57 1.409 24.904 10.933 390 HD12 LEU 57 HD12 LEU 57 2.647 25.566 10.130 391 HD13 LEU 57 HD13 LEU 57 2.582 25.667 11.743 392 HD21 LEU 57 HD21 LEU 57 1.812 22.650 9.905 393 HD22 LEU 57 HD22 LEU 57 3.280 21.975 9.973 394 HD23 LEU 57 HD23 LEU 57 3.026 23.266 9.032 395 H PHE 58 H PHE 58 7.133 23.574 13.288 396 HA PHE 58 HA PHE 58 9.089 24.908 11.873 397 HB2 PHE 58 HB2 PHE 58 9.046 23.904 14.577 398 HB3 PHE 58 HB3 PHE 58 10.360 24.694 14.016 399 HD1 PHE 58 HD1 PHE 58 6.869 25.115 14.814 400 HD2 PHE 58 HD2 PHE 58 10.415 27.082 13.876 401 HE1 PHE 58 HE1 PHE 58 5.823 27.222 15.324 402 HE2 PHE 58 HE2 PHE 58 9.384 29.201 14.404 403 HZ PHE 58 HZ PHE 58 7.083 29.272 15.138 404 H GLY 59 H GLY 59 8.670 21.591 12.405 405 HA2 GLY 59 HA2 GLY 59 11.312 20.791 11.964 406 HA3 GLY 59 HA3 GLY 59 9.988 19.861 11.740 407 H GLY 60 H GLY 60 8.791 21.808 9.889 408 HA2 GLY 60 HA2 GLY 60 9.898 20.849 7.508 409 HA3 GLY 60 HA3 GLY 60 8.739 21.994 7.637 410 H ILE 61 H ILE 61 10.624 23.544 9.436 411 HA ILE 61 HA ILE 61 11.772 25.099 7.417 412 HB ILE 61 HB ILE 61 12.354 25.238 10.267 413 HG12 ILE 61 HG12 ILE 61 10.065 25.621 9.886 414 HG13 ILE 61 HG13 ILE 61 10.784 27.000 10.386 415 HG21 ILE 61 HG21 ILE 61 13.204 27.454 9.858 416 HG22 ILE 61 HG22 ILE 61 12.963 27.259 8.271 417 HG23 ILE 61 HG23 ILE 61 14.073 26.366 9.036 418 HD11 ILE 61 HD11 ILE 61 9.213 27.486 8.633 419 HD12 ILE 61 HD12 ILE 61 9.994 26.484 7.633 420 HD13 ILE 61 HD13 ILE 61 10.706 27.849 8.127 421 H LEU 62 H LEU 62 12.948 22.776 9.701 422 HA LEU 62 HA LEU 62 15.611 22.874 8.959 423 HB2 LEU 62 HB2 LEU 62 14.058 20.963 10.416 424 HB3 LEU 62 HB3 LEU 62 15.581 20.550 9.994 425 HG LEU 62 HG LEU 62 16.374 22.394 11.316 426 HD11 LEU 62 HD11 LEU 62 14.958 23.406 12.947 427 HD12 LEU 62 HD12 LEU 62 13.679 22.642 12.317 428 HD13 LEU 62 HD13 LEU 62 14.454 23.769 11.454 429 HD21 LEU 62 HD21 LEU 62 16.045 21.213 13.429 430 HD22 LEU 62 HD22 LEU 62 16.354 20.154 12.246 431 HD23 LEU 62 HD23 LEU 62 14.836 20.373 12.760 432 H ASP 63 H ASP 63 12.904 21.117 7.789 433 HA ASP 63 HA ASP 63 14.244 19.216 6.368 434 HB2 ASP 63 HB2 ASP 63 11.848 19.166 6.776 435 HB3 ASP 63 HB3 ASP 63 11.661 20.302 5.617 436 H GLN 64 H GLN 64 13.802 22.493 5.607 437 HA GLN 64 HA GLN 64 14.166 22.247 2.872 438 HB2 GLN 64 HB2 GLN 64 14.625 24.559 4.552 439 HB3 GLN 64 HB3 GLN 64 14.626 24.641 2.921 440 HG2 GLN 64 HG2 GLN 64 12.346 23.950 2.911 441 HG3 GLN 64 HG3 GLN 64 12.357 23.950 4.544 442 HE21 GLN 64 HE21 GLN 64 11.493 27.241 4.866 443 HE22 GLN 64 HE22 GLN 64 11.637 25.675 5.591 444 H GLN 65 H GLN 65 16.325 21.696 5.268 445 HA GLN 65 HA GLN 65 18.512 21.795 3.389 446 HB2 GLN 65 HB2 GLN 65 18.728 22.517 6.171 447 HB3 GLN 65 HB3 GLN 65 20.015 22.351 5.179 448 HG2 GLN 65 HG2 GLN 65 19.131 24.155 3.831 449 HG3 GLN 65 HG3 GLN 65 17.968 24.372 4.958 450 HE21 GLN 65 HE21 GLN 65 20.350 26.944 5.704 451 HE22 GLN 65 HE22 GLN 65 19.136 26.578 4.525 452 H SER 66 H SER 66 16.838 19.623 3.708 453 HA SER 66 HA SER 66 18.370 17.785 5.336 454 HB2 SER 66 HB2 SER 66 16.080 17.953 6.056 455 HB3 SER 66 HB3 SER 66 15.567 17.593 4.548 456 HG SER 66 HG SER 66 16.252 15.969 6.511 457 H GLU 67 H GLU 67 18.735 15.591 4.556 458 HA GLU 67 HA GLU 67 19.199 15.440 1.783 459 HB2 GLU 67 HB2 GLU 67 20.432 14.202 3.476 460 HB3 GLU 67 HB3 GLU 67 19.122 13.244 3.655 461 HG2 GLU 67 HG2 GLU 67 19.377 12.452 1.467 462 HG3 GLU 67 HG3 GLU 67 20.653 13.446 1.242 463 H ASN 68 H ASN 68 16.683 14.567 3.909 464 HA ASN 68 HA ASN 68 15.192 13.191 1.880 465 HB2 ASN 68 HB2 ASN 68 14.818 13.392 4.739 466 HB3 ASN 68 HB3 ASN 68 13.673 12.713 3.794 467 HD21 ASN 68 HD21 ASN 68 16.852 10.628 4.921 468 HD22 ASN 68 HD22 ASN 68 16.568 12.264 5.413 469 H ARG 69 H ARG 69 15.691 16.081 2.004 470 HA ARG 69 HA ARG 69 13.532 17.572 2.702 471 HB2 ARG 69 HB2 ARG 69 15.517 18.602 2.035 472 HB3 ARG 69 HB3 ARG 69 15.457 17.888 0.568 473 HG2 ARG 69 HG2 ARG 69 13.750 19.357 -0.089 474 HG3 ARG 69 HG3 ARG 69 13.772 20.057 1.387 475 HD2 ARG 69 HD2 ARG 69 16.153 20.526 0.979 476 HD3 ARG 69 HD3 ARG 69 15.878 20.109 -0.576 477 HE ARG 69 HE ARG 69 14.056 22.063 0.070 478 HH11 ARG 69 HH11 ARG 69 14.361 24.197 -0.442 479 HH12 ARG 69 HH12 ARG 69 15.926 24.782 -0.899 480 HH21 ARG 69 HH21 ARG 69 17.517 21.749 -0.521 481 HH22 ARG 69 HH22 ARG 69 17.684 23.421 -0.944 482 H TRP 70 H TRP 70 11.698 18.508 1.718 483 HA TRP 70 HA TRP 70 10.340 16.544 0.330 484 HB2 TRP 70 HB2 TRP 70 8.525 18.130 0.166 485 HB3 TRP 70 HB3 TRP 70 9.085 17.955 1.690 486 HD1 TRP 70 HD1 TRP 70 9.969 20.421 -1.049 487 HE1 TRP 70 HE1 TRP 70 10.041 22.778 -0.213 488 HE3 TRP 70 HE3 TRP 70 8.765 19.424 3.697 489 HZ2 TRP 70 HZ2 TRP 70 9.640 23.997 2.293 490 HZ3 TRP 70 HZ3 TRP 70 8.615 21.260 5.271 491 HH2 TRP 70 HH2 TRP 70 9.074 23.522 4.564 492 H PHE 71 H PHE 71 9.698 16.269 -1.739 493 HA PHE 71 HA PHE 71 11.538 17.355 -3.590 494 HB2 PHE 71 HB2 PHE 71 10.648 15.715 -5.079 495 HB3 PHE 71 HB3 PHE 71 11.000 15.028 -3.639 496 HD1 PHE 71 HD1 PHE 71 9.120 14.448 -2.050 497 HD2 PHE 71 HD2 PHE 71 8.450 15.719 -5.947 498 HE1 PHE 71 HE1 PHE 71 6.844 13.664 -1.907 499 HE2 PHE 71 HE2 PHE 71 6.184 14.904 -5.832 500 HZ PHE 71 HZ PHE 71 5.377 13.878 -3.809 501 H LYS 72 H LYS 72 11.177 18.689 -5.344 502 HA LYS 72 HA LYS 72 8.637 20.014 -5.227 503 HB2 LYS 72 HB2 LYS 72 11.111 21.055 -6.342 504 HB3 LYS 72 HB3 LYS 72 9.745 21.933 -6.165 505 HG2 LYS 72 HG2 LYS 72 10.017 21.771 -3.768 506 HG3 LYS 72 HG3 LYS 72 11.451 21.032 -4.019 507 HD2 LYS 72 HD2 LYS 72 11.972 23.252 -3.638 508 HD3 LYS 72 HD3 LYS 72 12.143 23.039 -5.249 509 HE2 LYS 72 HE2 LYS 72 9.887 23.951 -5.510 510 HE3 LYS 72 HE3 LYS 72 9.937 24.351 -3.927 511 HZ1 LYS 72 HZ1 LYS 72 10.461 26.223 -5.260 512 HZ2 LYS 72 HZ2 LYS 72 11.695 25.420 -5.930 513 HZ3 LYS 72 HZ3 LYS 72 11.744 25.817 -4.363 514 H HIS 73 H HIS 73 7.259 20.172 -7.008 515 HA HIS 73 HA HIS 73 8.498 19.591 -9.554 516 HB2 HIS 73 HB2 HIS 73 5.879 18.770 -8.714 517 HB3 HIS 73 HB3 HIS 73 6.261 18.837 -10.300 518 HD1 HIS 73 HD1 HIS 73 6.616 16.746 -7.325 519 HD2 HIS 73 HD2 HIS 73 8.210 16.904 -11.096 520 HE1 HIS 73 HE1 HIS 73 7.789 14.598 -7.783 521 HE2 HIS 73 HE2 HIS 73 8.767 14.677 -10.043 522 H ILE 74 H ILE 74 8.291 21.082 -11.192 523 HA ILE 74 HA ILE 74 7.005 23.507 -10.532 524 HB ILE 74 HB ILE 74 8.277 22.788 -13.066 525 HG12 ILE 74 HG12 ILE 74 9.429 24.396 -10.961 526 HG13 ILE 74 HG13 ILE 74 9.767 22.808 -11.142 527 HG21 ILE 74 HG21 ILE 74 8.312 25.151 -13.572 528 HG22 ILE 74 HG22 ILE 74 7.516 25.464 -12.200 529 HG23 ILE 74 HG23 ILE 74 6.783 24.655 -13.393 530 HD11 ILE 74 HD11 ILE 74 11.537 24.130 -12.061 531 HD12 ILE 74 HD12 ILE 74 10.495 24.855 -13.064 532 HD13 ILE 74 HD13 ILE 74 10.830 23.283 -13.243 533 H MET 75 H MET 75 5.004 24.282 -11.236 534 HA MET 75 HA MET 75 3.628 22.748 -13.246 535 HB2 MET 75 HB2 MET 75 2.906 22.321 -10.817 536 HB3 MET 75 HB3 MET 75 2.013 23.662 -11.088 537 HG2 MET 75 HG2 MET 75 0.622 22.000 -11.515 538 HG3 MET 75 HG3 MET 75 1.091 22.537 -12.984 539 HE1 MET 75 HE1 MET 75 0.794 18.810 -13.896 540 HE2 MET 75 HE2 MET 75 0.464 20.314 -14.389 541 HE3 MET 75 HE3 MET 75 -0.241 19.728 -13.058 542 H THR 76 H THR 76 1.981 24.009 -14.388 543 HA THR 76 HA THR 76 2.407 26.846 -14.183 544 HB THR 76 HB THR 76 1.243 26.888 -16.381 545 HG1 THR 76 HG1 THR 76 0.080 25.144 -16.542 546 HG21 THR 76 HG21 THR 76 3.102 25.986 -17.617 547 HG22 THR 76 HG22 THR 76 3.608 25.189 -16.305 548 HG23 THR 76 HG23 THR 76 3.680 26.804 -16.348 549 H GLY 77 H GLY 77 0.208 28.120 -14.878 550 HA2 GLY 77 HA2 GLY 77 -1.719 27.524 -12.940 551 HA3 GLY 77 HA3 GLY 77 -1.866 28.632 -14.131 552 H GLY 78 H GLY 78 -4.181 27.616 -13.714 553 HA2 GLY 78 HA2 GLY 78 -5.726 26.725 -15.203 554 HA3 GLY 78 HA3 GLY 78 -4.576 25.796 -15.897 555 H GLU 79 H GLU 79 -6.674 24.356 -15.648 556 HA GLU 79 HA GLU 79 -6.803 23.146 -13.058 557 HB2 GLU 79 HB2 GLU 79 -8.811 22.601 -13.648 558 HB3 GLU 79 HB3 GLU 79 -8.558 23.380 -15.061 559 HG2 GLU 79 HG2 GLU 79 -9.402 21.302 -15.627 560 HG3 GLU 79 HG3 GLU 79 -7.811 21.242 -15.992 561 H HIS 80 H HIS 80 -6.011 21.132 -12.424 562 HA HIS 80 HA HIS 80 -4.704 19.631 -14.479 563 HB2 HIS 80 HB2 HIS 80 -3.359 20.063 -11.953 564 HB3 HIS 80 HB3 HIS 80 -2.705 19.381 -13.285 565 HD1 HIS 80 HD1 HIS 80 -2.881 22.476 -11.513 566 HD2 HIS 80 HD2 HIS 80 -2.322 21.385 -15.423 567 HE1 HIS 80 HE1 HIS 80 -1.951 24.415 -12.751 568 HE2 HIS 80 HE2 HIS 80 -1.635 23.795 -15.114 569 H THR 81 H THR 81 -4.257 17.379 -13.950 570 HA THR 81 HA THR 81 -6.097 16.401 -11.954 571 HB THR 81 HB THR 81 -5.043 14.952 -14.267 572 HG1 THR 81 HG1 THR 81 -6.448 15.985 -15.362 573 HG21 THR 81 HG21 THR 81 -6.718 13.317 -13.807 574 HG22 THR 81 HG22 THR 81 -7.217 14.163 -12.522 575 HG23 THR 81 HG23 THR 81 -5.761 13.460 -12.511 576 H PHE 82 H PHE 82 -5.260 15.390 -10.140 577 HA PHE 82 HA PHE 82 -2.566 14.334 -10.383 578 HB2 PHE 82 HB2 PHE 82 -3.653 15.659 -8.065 579 HB3 PHE 82 HB3 PHE 82 -2.199 14.917 -8.086 580 HD1 PHE 82 HD1 PHE 82 -0.344 15.861 -9.495 581 HD2 PHE 82 HD2 PHE 82 -3.905 17.908 -8.832 582 HE1 PHE 82 HE1 PHE 82 0.696 17.897 -10.260 583 HE2 PHE 82 HE2 PHE 82 -2.863 19.962 -9.548 584 HZ PHE 82 HZ PHE 82 -0.563 19.957 -10.285 585 H THR 83 H THR 83 -2.230 12.237 -9.562 586 HA THR 83 HA THR 83 -4.526 11.013 -8.362 587 HB THR 83 HB THR 83 -3.118 9.802 -10.643 588 HG1 THR 83 HG1 THR 83 -4.286 10.957 -11.873 589 HG21 THR 83 HG21 THR 83 -4.883 8.185 -10.713 590 HG22 THR 83 HG22 THR 83 -5.594 8.880 -9.438 591 HG23 THR 83 HG23 THR 83 -4.177 8.122 -9.260 592 H TRP 84 H TRP 84 -4.196 9.357 -6.903 593 HA TRP 84 HA TRP 84 -1.442 8.553 -6.463 594 HB2 TRP 84 HB2 TRP 84 -3.457 9.231 -4.581 595 HB3 TRP 84 HB3 TRP 84 -2.443 8.022 -4.162 596 HD1 TRP 84 HD1 TRP 84 -2.057 11.604 -5.263 597 HE1 TRP 84 HE1 TRP 84 -0.158 12.740 -4.081 598 HE3 TRP 84 HE3 TRP 84 -0.470 7.628 -2.684 599 HZ2 TRP 84 HZ2 TRP 84 1.769 11.912 -2.190 600 HZ3 TRP 84 HZ3 TRP 84 1.417 7.874 -1.190 601 HH2 TRP 84 HH2 TRP 84 2.515 10.012 -0.947 602 H THR 85 H THR 85 -1.117 6.271 -6.014 603 HA THR 85 HA THR 85 -3.450 4.653 -6.373 604 HB THR 85 HB THR 85 -1.749 3.147 -7.721 605 HG1 THR 85 HG1 THR 85 -0.031 4.151 -8.200 606 HG21 THR 85 HG21 THR 85 -2.660 4.046 -9.745 607 HG22 THR 85 HG22 THR 85 -3.150 5.372 -8.959 608 HG23 THR 85 HG23 THR 85 -3.848 3.946 -8.652 609 H TYR 86 H TYR 86 -3.300 2.444 -5.584 610 HA TYR 86 HA TYR 86 -1.074 1.941 -3.801 611 HB2 TYR 86 HB2 TYR 86 -3.829 1.734 -2.990 612 HB3 TYR 86 HB3 TYR 86 -2.572 1.197 -2.097 613 HD1 TYR 86 HD1 TYR 86 -4.302 4.170 -3.175 614 HD2 TYR 86 HD2 TYR 86 -1.154 2.761 -0.844 615 HE1 TYR 86 HE1 TYR 86 -4.059 6.359 -2.169 616 HE2 TYR 86 HE2 TYR 86 -0.937 4.945 0.175 617 HH TYR 86 HH TYR 86 -2.295 7.731 -1.023 618 H THR 87 H THR 87 -0.580 -0.334 -3.647 619 HA THR 87 HA THR 87 -1.532 -1.731 -5.860 620 HB THR 87 HB THR 87 0.773 -2.049 -5.090 621 HG1 THR 87 HG1 THR 87 0.034 -4.581 -4.877 622 HG21 THR 87 HG21 THR 87 1.213 -3.418 -3.160 623 HG22 THR 87 HG22 THR 87 -0.372 -3.564 -2.879 624 HG23 THR 87 HG23 THR 87 0.354 -2.131 -2.693 625 H ALA 88 H ALA 88 -2.682 -1.495 -2.778 626 HA ALA 88 HA ALA 88 -4.541 -3.643 -3.243 627 HB1 ALA 88 HB1 ALA 88 -2.929 -4.608 -1.742 628 HB2 ALA 88 HB2 ALA 88 -4.321 -4.408 -0.943 629 HB3 ALA 88 HB3 ALA 88 -3.105 -3.365 -0.722 630 HA PRO 89 HA PRO 89 -7.166 -0.438 -1.793 631 HB2 PRO 89 HB2 PRO 89 -9.388 -1.687 -1.079 632 HB3 PRO 89 HB3 PRO 89 -9.016 -1.610 -2.668 633 HG2 PRO 89 HG2 PRO 89 -8.509 -3.771 -0.862 634 HG3 PRO 89 HG3 PRO 89 -9.185 -3.852 -2.347 635 HD2 PRO 89 HD2 PRO 89 -6.658 -4.379 -2.045 636 HD3 PRO 89 HD3 PRO 89 -7.174 -3.628 -3.401 637 H HIS 90 H HIS 90 -7.796 0.669 0.070 638 HA HIS 90 HA HIS 90 -7.214 -0.761 2.512 639 HB2 HIS 90 HB2 HIS 90 -5.427 0.853 1.738 640 HB3 HIS 90 HB3 HIS 90 -6.449 2.006 2.279 641 HD1 HIS 90 HD1 HIS 90 -7.007 2.024 4.933 642 HD2 HIS 90 HD2 HIS 90 -3.864 -0.285 3.673 643 HE1 HIS 90 HE1 HIS 90 -5.640 1.399 6.916 644 HE2 HIS 90 HE2 HIS 90 -3.732 0.019 6.178 645 H ASN 91 H ASN 91 -8.604 -0.459 4.239 646 HA ASN 91 HA ASN 91 -11.024 0.802 3.839 647 HB2 ASN 91 HB2 ASN 91 -9.719 0.090 6.297 648 HB3 ASN 91 HB3 ASN 91 -11.201 0.776 6.295 649 HD21 ASN 91 HD21 ASN 91 -12.448 -2.442 6.462 650 HD22 ASN 91 HD22 ASN 91 -12.162 -0.972 7.331 651 H THR 92 H THR 92 -11.791 2.923 4.489 652 HA THR 92 HA THR 92 -9.838 4.783 5.400 653 HB THR 92 HB THR 92 -11.125 5.206 2.790 654 HG1 THR 92 HG1 THR 92 -9.512 3.680 2.593 655 HG21 THR 92 HG21 THR 92 -9.754 7.128 2.575 656 HG22 THR 92 HG22 THR 92 -9.112 6.858 4.035 657 HG23 THR 92 HG23 THR 92 -10.667 7.282 3.901 658 H SER 93 H SER 93 -10.803 6.556 6.510 659 HA SER 93 HA SER 93 -13.680 6.543 6.489 660 HB2 SER 93 HB2 SER 93 -13.486 7.909 8.514 661 HB3 SER 93 HB3 SER 93 -12.814 6.430 8.677 662 HG SER 93 HG SER 93 -10.847 7.228 8.602 663 H GLN 94 H GLN 94 -10.934 8.638 6.005 664 HA GLN 94 HA GLN 94 -12.333 10.081 4.085 665 HB2 GLN 94 HB2 GLN 94 -12.210 12.281 5.072 666 HB3 GLN 94 HB3 GLN 94 -13.134 11.303 5.998 667 HG2 GLN 94 HG2 GLN 94 -11.406 11.070 7.546 668 HG3 GLN 94 HG3 GLN 94 -10.399 11.934 6.594 669 HE21 GLN 94 HE21 GLN 94 -11.446 14.221 9.194 670 HE22 GLN 94 HE22 GLN 94 -10.531 12.754 9.092 671 H TRP 95 H TRP 95 -10.990 11.786 2.954 672 HA TRP 95 HA TRP 95 -8.280 11.856 3.882 673 HB2 TRP 95 HB2 TRP 95 -7.355 11.762 1.666 674 HB3 TRP 95 HB3 TRP 95 -7.975 10.346 2.194 675 HD1 TRP 95 HD1 TRP 95 -9.271 13.138 -0.003 676 HE1 TRP 95 HE1 TRP 95 -10.574 12.260 -1.960 677 HE3 TRP 95 HE3 TRP 95 -8.857 8.291 1.103 678 HZ2 TRP 95 HZ2 TRP 95 -11.337 9.695 -2.829 679 HZ3 TRP 95 HZ3 TRP 95 -9.916 6.659 -0.345 680 HH2 TRP 95 HH2 TRP 95 -11.149 7.373 -2.294 681 H HIS 96 H HIS 96 -7.227 13.867 3.658 682 HA HIS 96 HA HIS 96 -8.662 15.939 2.326 683 HB2 HIS 96 HB2 HIS 96 -8.625 17.325 4.412 684 HB3 HIS 96 HB3 HIS 96 -9.811 16.211 4.277 685 HD1 HIS 96 HD1 HIS 96 -7.379 17.385 6.591 686 HD2 HIS 96 HD2 HIS 96 -9.126 13.769 5.787 687 HE1 HIS 96 HE1 HIS 96 -7.062 15.895 8.562 688 HE2 HIS 96 HE2 HIS 96 -8.087 13.700 8.084 689 H TYR 97 H TYR 97 -7.532 18.003 2.161 690 HA TYR 97 HA TYR 97 -4.730 17.658 2.535 691 HB2 TYR 97 HB2 TYR 97 -5.146 18.805 0.023 692 HB3 TYR 97 HB3 TYR 97 -4.255 17.480 0.368 693 HD1 TYR 97 HD1 TYR 97 -7.481 18.593 -0.749 694 HD2 TYR 97 HD2 TYR 97 -5.198 15.216 0.100 695 HE1 TYR 97 HE1 TYR 97 -9.121 17.201 -1.860 696 HE2 TYR 97 HE2 TYR 97 -6.840 13.830 -1.019 697 HH TYR 97 HH TYR 97 -9.827 15.128 -2.327 698 H TYR 98 H TYR 98 -3.406 19.479 2.517 699 HA TYR 98 HA TYR 98 -4.783 21.989 2.807 700 HB2 TYR 98 HB2 TYR 98 -2.622 21.100 4.529 701 HB3 TYR 98 HB3 TYR 98 -3.430 22.509 4.696 702 HD1 TYR 98 HD1 TYR 98 -3.710 18.943 5.170 703 HD2 TYR 98 HD2 TYR 98 -5.502 22.623 5.922 704 HE1 TYR 98 HE1 TYR 98 -5.235 17.883 6.708 705 HE2 TYR 98 HE2 TYR 98 -7.004 21.565 7.490 706 HH TYR 98 HH TYR 98 -7.953 18.899 7.664 707 H ILE 99 H ILE 99 -3.260 23.885 2.527 708 HA ILE 99 HA ILE 99 -0.783 23.158 1.240 709 HB ILE 99 HB ILE 99 -1.030 25.050 -0.286 710 HG12 ILE 99 HG12 ILE 99 -3.786 25.178 0.514 711 HG13 ILE 99 HG13 ILE 99 -2.663 26.224 1.071 712 HG21 ILE 99 HG21 ILE 99 -2.563 23.927 -1.794 713 HG22 ILE 99 HG22 ILE 99 -3.097 23.012 -0.573 714 HG23 ILE 99 HG23 ILE 99 -1.580 22.844 -1.106 715 HD11 ILE 99 HD11 ILE 99 -3.894 27.224 -0.717 716 HD12 ILE 99 HD12 ILE 99 -3.459 26.022 -1.708 717 HD13 ILE 99 HD13 ILE 99 -2.346 27.058 -1.156 718 H THR 100 H THR 100 1.025 24.577 1.758 719 HA THR 100 HA THR 100 0.536 26.125 4.075 720 HB THR 100 HB THR 100 2.933 26.634 4.022 721 HG1 THR 100 HG1 THR 100 4.219 25.627 2.547 722 HG21 THR 100 HG21 THR 100 3.630 24.398 4.576 723 HG22 THR 100 HG22 THR 100 2.306 23.796 3.870 724 HG23 THR 100 HG23 THR 100 2.175 24.662 5.229 725 H LYS 101 H LYS 101 -0.136 28.247 4.026 726 HA LYS 101 HA LYS 101 0.237 29.646 1.543 727 HB2 LYS 101 HB2 LYS 101 -1.987 29.519 2.536 728 HB3 LYS 101 HB3 LYS 101 -1.442 30.495 3.727 729 HG2 LYS 101 HG2 LYS 101 -1.034 31.568 1.188 730 HG3 LYS 101 HG3 LYS 101 -2.614 31.342 1.531 731 HD2 LYS 101 HD2 LYS 101 -2.378 32.670 3.488 732 HD3 LYS 101 HD3 LYS 101 -0.799 32.899 3.141 733 HE2 LYS 101 HE2 LYS 101 -1.433 33.999 1.112 734 HE3 LYS 101 HE3 LYS 101 -3.002 33.823 1.529 735 HZ1 LYS 101 HZ1 LYS 101 -2.254 36.008 2.063 736 HZ2 LYS 101 HZ2 LYS 101 -1.093 35.393 3.005 737 HZ3 LYS 101 HZ3 LYS 101 -2.647 35.219 3.419 738 H LYS 102 H LYS 102 2.249 30.519 1.481 739 HA LYS 102 HA LYS 102 3.331 31.883 3.716 740 HB2 LYS 102 HB2 LYS 102 5.049 32.561 2.269 741 HB3 LYS 102 HB3 LYS 102 4.789 30.953 2.153 742 HG2 LYS 102 HG2 LYS 102 3.529 31.393 0.121 743 HG3 LYS 102 HG3 LYS 102 4.048 32.939 0.207 744 HD2 LYS 102 HD2 LYS 102 6.304 32.166 0.089 745 HD3 LYS 102 HD3 LYS 102 5.757 30.634 -0.059 746 HE2 LYS 102 HE2 LYS 102 4.657 31.284 -2.105 747 HE3 LYS 102 HE3 LYS 102 5.363 32.750 -1.976 748 HZ1 LYS 102 HZ1 LYS 102 6.619 31.366 -3.442 749 HZ2 LYS 102 HZ2 LYS 102 6.805 30.272 -2.266 750 HZ3 LYS 102 HZ3 LYS 102 7.504 31.725 -2.137 751 H GLY 103 H GLY 103 3.571 34.252 3.949 752 HA2 GLY 103 HA2 GLY 103 3.027 36.373 3.161 753 HA3 GLY 103 HA3 GLY 103 1.960 35.739 2.100 754 H TRP 104 H TRP 104 1.760 34.706 5.344 755 HA TRP 104 HA TRP 104 -0.802 35.704 5.678 756 HB2 TRP 104 HB2 TRP 104 -0.492 35.082 8.030 757 HB3 TRP 104 HB3 TRP 104 -0.121 33.873 6.997 758 HD1 TRP 104 HD1 TRP 104 1.649 36.403 9.107 759 HE1 TRP 104 HE1 TRP 104 3.997 35.720 9.650 760 HE3 TRP 104 HE3 TRP 104 1.716 32.217 6.380 761 HZ2 TRP 104 HZ2 TRP 104 5.644 33.548 8.916 762 HZ3 TRP 104 HZ3 TRP 104 3.717 30.859 6.367 763 HH2 TRP 104 HH2 TRP 104 5.660 31.528 7.637 764 H ASP 105 H ASP 105 -1.555 37.260 7.325 765 HA ASP 105 HA ASP 105 0.042 39.638 7.354 766 HB2 ASP 105 HB2 ASP 105 -2.625 39.205 8.404 767 HB3 ASP 105 HB3 ASP 105 -1.941 40.668 8.160 768 HA PRO 106 HA PRO 106 1.291 38.866 11.474 769 HB2 PRO 106 HB2 PRO 106 1.666 41.259 12.586 770 HB3 PRO 106 HB3 PRO 106 2.682 40.782 11.399 771 HG2 PRO 106 HG2 PRO 106 0.370 42.436 11.151 772 HG3 PRO 106 HG3 PRO 106 1.868 42.724 10.570 773 HD2 PRO 106 HD2 PRO 106 0.062 41.713 8.990 774 HD3 PRO 106 HD3 PRO 106 1.612 41.221 8.847 775 H ASP 107 H ASP 107 -1.510 40.515 10.899 776 HA ASP 107 HA ASP 107 -2.595 40.518 13.454 777 HB2 ASP 107 HB2 ASP 107 -3.525 41.814 11.650 778 HB3 ASP 107 HB3 ASP 107 -3.879 40.445 10.833 779 H LYS 108 H LYS 108 -2.043 38.016 11.289 780 HA LYS 108 HA LYS 108 -4.182 36.396 12.315 781 HB2 LYS 108 HB2 LYS 108 -2.430 36.045 10.042 782 HB3 LYS 108 HB3 LYS 108 -3.488 34.885 10.492 783 HG2 LYS 108 HG2 LYS 108 -5.295 36.266 10.026 784 HG3 LYS 108 HG3 LYS 108 -4.310 37.544 9.775 785 HD2 LYS 108 HD2 LYS 108 -3.461 36.515 7.831 786 HD3 LYS 108 HD3 LYS 108 -4.433 35.227 8.084 787 HE2 LYS 108 HE2 LYS 108 -6.342 36.490 7.712 788 HE3 LYS 108 HE3 LYS 108 -5.496 37.886 7.761 789 HZ1 LYS 108 HZ1 LYS 108 -6.057 37.350 5.528 790 HZ2 LYS 108 HZ2 LYS 108 -5.288 35.934 5.663 791 HZ3 LYS 108 HZ3 LYS 108 -4.451 37.316 5.711 792 HA PRO 109 HA PRO 109 -1.591 34.226 14.991 793 HB2 PRO 109 HB2 PRO 109 -2.658 31.772 15.044 794 HB3 PRO 109 HB3 PRO 109 -3.394 33.001 15.827 795 HG2 PRO 109 HG2 PRO 109 -3.992 32.008 13.195 796 HG3 PRO 109 HG3 PRO 109 -5.050 32.327 14.397 797 HD2 PRO 109 HD2 PRO 109 -4.733 34.065 12.559 798 HD3 PRO 109 HD3 PRO 109 -4.876 34.581 14.102 799 H LEU 110 H LEU 110 0.405 33.762 14.746 800 HA LEU 110 HA LEU 110 1.310 33.429 12.237 801 HB2 LEU 110 HB2 LEU 110 2.634 34.263 14.090 802 HB3 LEU 110 HB3 LEU 110 2.659 32.767 14.745 803 HG LEU 110 HG LEU 110 4.115 32.071 12.956 804 HD11 LEU 110 HD11 LEU 110 5.161 33.698 11.603 805 HD12 LEU 110 HD12 LEU 110 4.213 34.846 12.234 806 HD13 LEU 110 HD13 LEU 110 3.569 33.674 11.325 807 HD21 LEU 110 HD21 LEU 110 6.069 33.174 13.883 808 HD22 LEU 110 HD22 LEU 110 5.068 32.753 15.081 809 HD23 LEU 110 HD23 LEU 110 5.117 34.286 14.570 810 H LYS 111 H LYS 111 1.155 30.819 14.549 811 HA LYS 111 HA LYS 111 2.279 29.063 12.657 812 HB2 LYS 111 HB2 LYS 111 0.994 28.356 15.162 813 HB3 LYS 111 HB3 LYS 111 1.997 27.373 14.328 814 HG2 LYS 111 HG2 LYS 111 3.782 28.882 14.779 815 HG3 LYS 111 HG3 LYS 111 2.764 29.765 15.702 816 HD2 LYS 111 HD2 LYS 111 2.417 27.793 17.066 817 HD3 LYS 111 HD3 LYS 111 3.607 27.062 16.219 818 HE2 LYS 111 HE2 LYS 111 5.075 28.858 16.890 819 HE3 LYS 111 HE3 LYS 111 3.888 29.384 17.881 820 HZ1 LYS 111 HZ1 LYS 111 5.444 28.062 19.100 821 HZ2 LYS 111 HZ2 LYS 111 5.175 26.814 18.107 822 HZ3 LYS 111 HZ3 LYS 111 4.000 27.335 19.089 823 H ARG 112 H ARG 112 -0.865 29.788 13.759 824 HA ARG 112 HA ARG 112 -2.024 27.464 12.693 825 HB2 ARG 112 HB2 ARG 112 -2.831 28.873 14.615 826 HB3 ARG 112 HB3 ARG 112 -3.546 29.790 13.468 827 HG2 ARG 112 HG2 ARG 112 -4.898 27.967 12.830 828 HG3 ARG 112 HG3 ARG 112 -4.160 27.018 13.935 829 HD2 ARG 112 HD2 ARG 112 -4.973 28.550 15.657 830 HD3 ARG 112 HD3 ARG 112 -5.874 29.271 14.500 831 HE ARG 112 HE ARG 112 -6.492 26.589 14.454 832 HH11 ARG 112 HH11 ARG 112 -7.001 29.362 16.569 833 HH12 ARG 112 HH12 ARG 112 -8.424 28.670 17.274 834 HH21 ARG 112 HH21 ARG 112 -8.306 25.765 15.421 835 HH22 ARG 112 HH22 ARG 112 -9.148 26.669 16.635 836 H ALA 113 H ALA 113 -1.662 30.650 11.527 837 HA ALA 113 HA ALA 113 -3.431 30.225 9.360 838 HB1 ALA 113 HB1 ALA 113 -3.268 32.447 10.324 839 HB2 ALA 113 HB2 ALA 113 -2.877 32.523 8.757 840 HB3 ALA 113 HB3 ALA 113 -1.715 32.532 9.881 841 H ASP 114 H ASP 114 -0.523 29.062 9.887 842 HA ASP 114 HA ASP 114 0.877 29.794 7.610 843 HB2 ASP 114 HB2 ASP 114 1.983 28.833 9.506 844 HB3 ASP 114 HB3 ASP 114 1.212 27.417 9.246 845 H PHE 115 H PHE 115 -1.430 27.302 8.186 846 HA PHE 115 HA PHE 115 -1.248 26.638 5.409 847 HB2 PHE 115 HB2 PHE 115 -1.765 24.329 5.892 848 HB3 PHE 115 HB3 PHE 115 -0.362 24.787 6.592 849 HD1 PHE 115 HD1 PHE 115 -0.183 25.024 9.025 850 HD2 PHE 115 HD2 PHE 115 -3.696 23.721 7.216 851 HE1 PHE 115 HE1 PHE 115 -0.998 24.264 11.168 852 HE2 PHE 115 HE2 PHE 115 -4.517 22.948 9.347 853 HZ PHE 115 HZ PHE 115 -3.163 23.206 11.328 854 H GLU 116 H GLU 116 -3.058 26.008 4.215 855 HA GLU 116 HA GLU 116 -5.579 26.748 5.428 856 HB2 GLU 116 HB2 GLU 116 -4.674 27.466 2.779 857 HB3 GLU 116 HB3 GLU 116 -6.204 27.715 3.296 858 HG2 GLU 116 HG2 GLU 116 -5.429 29.285 4.894 859 HG3 GLU 116 HG3 GLU 116 -3.886 29.008 4.437 860 H LEU 117 H LEU 117 -7.427 25.461 4.785 861 HA LEU 117 HA LEU 117 -6.751 22.912 3.769 862 HB2 LEU 117 HB2 LEU 117 -8.456 23.145 5.418 863 HB3 LEU 117 HB3 LEU 117 -9.358 24.014 4.370 864 HG LEU 117 HG LEU 117 -9.418 21.912 3.030 865 HD11 LEU 117 HD11 LEU 117 -9.276 19.894 4.303 866 HD12 LEU 117 HD12 LEU 117 -8.776 20.736 5.590 867 HD13 LEU 117 HD13 LEU 117 -7.842 20.641 4.273 868 HD21 LEU 117 HD21 LEU 117 -11.397 21.198 4.226 869 HD22 LEU 117 HD22 LEU 117 -11.377 22.810 4.102 870 HD23 LEU 117 HD23 LEU 117 -10.955 22.101 5.492 871 H ILE 118 H ILE 118 -6.685 22.268 1.626 872 HA ILE 118 HA ILE 118 -7.949 24.040 -0.244 873 HB ILE 118 HB ILE 118 -5.561 23.444 -0.605 874 HG12 ILE 118 HG12 ILE 118 -7.195 22.830 -2.894 875 HG13 ILE 118 HG13 ILE 118 -6.989 24.359 -2.358 876 HG21 ILE 118 HG21 ILE 118 -5.042 21.331 -1.591 877 HG22 ILE 118 HG22 ILE 118 -6.576 20.856 -1.405 878 HG23 ILE 118 HG23 ILE 118 -5.649 21.119 -0.107 879 HD11 ILE 118 HD11 ILE 118 -5.540 23.942 -4.214 880 HD12 ILE 118 HD12 ILE 118 -4.856 22.709 -3.422 881 HD13 ILE 118 HD13 ILE 118 -4.652 24.223 -2.892 882 H GLY 119 H GLY 119 -8.497 21.112 1.231 883 HA2 GLY 119 HA2 GLY 119 -10.985 20.828 0.239 884 HA3 GLY 119 HA3 GLY 119 -10.061 19.962 -0.793 885 H ALA 120 H ALA 120 -12.145 18.876 0.655 886 HA ALA 120 HA ALA 120 -10.734 16.846 2.111 887 HB1 ALA 120 HB1 ALA 120 -11.393 18.333 3.874 888 HB2 ALA 120 HB2 ALA 120 -12.276 16.984 3.988 889 HB3 ALA 120 HB3 ALA 120 -12.921 18.320 3.345 890 H VAL 121 H VAL 121 -11.647 14.806 1.737 891 HA VAL 121 HA VAL 121 -14.280 14.805 0.605 892 HB VAL 121 HB VAL 121 -12.120 13.219 -0.532 893 HG11 VAL 121 HG11 VAL 121 -13.718 12.429 -2.152 894 HG12 VAL 121 HG12 VAL 121 -14.890 13.248 -1.397 895 HG13 VAL 121 HG13 VAL 121 -14.174 11.997 -0.662 896 HG21 VAL 121 HG21 VAL 121 -12.384 14.523 -2.544 897 HG22 VAL 121 HG22 VAL 121 -11.972 15.484 -1.310 898 HG23 VAL 121 HG23 VAL 121 -13.508 15.428 -1.813 899 HA PRO 122 HA PRO 122 -14.092 11.620 3.651 900 HB2 PRO 122 HB2 PRO 122 -16.602 11.205 4.234 901 HB3 PRO 122 HB3 PRO 122 -15.947 12.628 4.694 902 HG2 PRO 122 HG2 PRO 122 -17.528 12.108 2.364 903 HG3 PRO 122 HG3 PRO 122 -17.707 13.329 3.434 904 HD2 PRO 122 HD2 PRO 122 -16.396 13.679 1.174 905 HD3 PRO 122 HD3 PRO 122 -16.015 14.537 2.510 906 H HIS 123 H HIS 123 -14.696 9.354 3.964 907 HA HIS 123 HA HIS 123 -15.431 8.165 1.428 908 HB2 HIS 123 HB2 HIS 123 -13.084 7.901 1.742 909 HB3 HIS 123 HB3 HIS 123 -13.347 7.226 3.206 910 HD1 HIS 123 HD1 HIS 123 -14.649 4.827 3.206 911 HD2 HIS 123 HD2 HIS 123 -12.882 6.080 -0.272 912 HE1 HIS 123 HE1 HIS 123 -14.421 2.868 1.690 913 HE2 HIS 123 HE2 HIS 123 -13.339 3.596 -0.411 914 H ASP 124 H ASP 124 -17.434 7.858 1.840 915 HA ASP 124 HA ASP 124 -18.250 5.632 3.429 916 HB2 ASP 124 HB2 ASP 124 -18.202 7.215 5.166 917 HB3 ASP 124 HB3 ASP 124 -19.145 8.219 4.288 918 H GLY 125 H GLY 125 -20.416 8.175 3.025 919 HA2 GLY 125 HA2 GLY 125 -21.250 7.380 0.389 920 HA3 GLY 125 HA3 GLY 125 -22.029 8.434 1.364 921 H SER 126 H SER 126 -20.748 8.564 -1.460 922 HA SER 126 HA SER 126 -19.809 11.196 -1.230 923 HB2 SER 126 HB2 SER 126 -17.731 10.224 -0.585 924 HB3 SER 126 HB3 SER 126 -17.824 9.121 -1.786 925 HG SER 126 HG SER 126 -17.110 10.476 -3.198 926 HA PRO 127 HA PRO 127 -20.829 10.875 -5.558 927 HB2 PRO 127 HB2 PRO 127 -20.143 13.265 -6.426 928 HB3 PRO 127 HB3 PRO 127 -21.405 13.180 -5.392 929 HG2 PRO 127 HG2 PRO 127 -18.693 13.765 -4.787 930 HG3 PRO 127 HG3 PRO 127 -20.022 14.604 -4.343 931 HD2 PRO 127 HD2 PRO 127 -18.941 12.890 -2.694 932 HD3 PRO 127 HD3 PRO 127 -20.559 13.109 -2.704 933 H ALA 128 H ALA 128 -19.419 11.859 -7.678 934 HA ALA 128 HA ALA 128 -17.459 10.019 -7.971 935 HB1 ALA 128 HB1 ALA 128 -18.512 11.210 -9.843 936 HB2 ALA 128 HB2 ALA 128 -16.906 11.227 -10.029 937 HB3 ALA 128 HB3 ALA 128 -17.669 12.536 -9.464 938 H SER 129 H SER 129 -17.129 12.829 -6.230 939 HA SER 129 HA SER 129 -14.453 13.299 -6.454 940 HB2 SER 129 HB2 SER 129 -16.000 13.601 -3.984 941 HB3 SER 129 HB3 SER 129 -14.708 14.512 -4.392 942 HG SER 129 HG SER 129 -15.893 15.771 -5.505 943 H ARG 130 H ARG 130 -15.922 10.618 -5.118 944 HA ARG 130 HA ARG 130 -14.021 9.896 -3.252 945 HB2 ARG 130 HB2 ARG 130 -16.342 8.897 -3.789 946 HB3 ARG 130 HB3 ARG 130 -15.463 7.835 -4.665 947 HG2 ARG 130 HG2 ARG 130 -14.237 7.443 -2.512 948 HG3 ARG 130 HG3 ARG 130 -15.562 8.103 -1.822 949 HD2 ARG 130 HD2 ARG 130 -15.593 5.746 -3.488 950 HD3 ARG 130 HD3 ARG 130 -15.752 5.734 -1.862 951 HE ARG 130 HE ARG 130 -17.764 7.315 -2.931 952 HH11 ARG 130 HH11 ARG 130 -19.843 6.584 -3.087 953 HH12 ARG 130 HH12 ARG 130 -20.194 4.889 -3.008 954 HH21 ARG 130 HH21 ARG 130 -16.916 3.905 -2.634 955 HH22 ARG 130 HH22 ARG 130 -18.568 3.398 -2.756 956 H ASN 131 H ASN 131 -13.701 10.013 -6.527 957 HA ASN 131 HA ASN 131 -12.166 7.767 -6.976 958 HB2 ASN 131 HB2 ASN 131 -12.297 10.265 -8.427 959 HB3 ASN 131 HB3 ASN 131 -11.353 9.041 -8.954 960 HD21 ASN 131 HD21 ASN 131 -14.629 8.985 -10.682 961 HD22 ASN 131 HD22 ASN 131 -13.460 10.233 -10.405 962 H LEU 132 H LEU 132 -9.916 7.402 -7.106 963 HA LEU 132 HA LEU 132 -8.403 8.863 -5.278 964 HB2 LEU 132 HB2 LEU 132 -8.055 6.518 -6.714 965 HB3 LEU 132 HB3 LEU 132 -6.663 7.373 -6.697 966 HG LEU 132 HG LEU 132 -6.643 5.773 -5.001 967 HD11 LEU 132 HD11 LEU 132 -6.096 7.176 -3.115 968 HD12 LEU 132 HD12 LEU 132 -6.798 8.432 -3.853 969 HD13 LEU 132 HD13 LEU 132 -5.458 7.776 -4.474 970 HD21 LEU 132 HD21 LEU 132 -8.196 5.847 -3.151 971 HD22 LEU 132 HD22 LEU 132 -8.977 5.552 -4.536 972 HD23 LEU 132 HD23 LEU 132 -9.010 7.034 -3.889 973 H SER 133 H SER 133 -9.154 9.431 -8.401 974 HA SER 133 HA SER 133 -6.834 11.054 -8.946 975 HB2 SER 133 HB2 SER 133 -7.633 9.647 -10.738 976 HB3 SER 133 HB3 SER 133 -9.039 10.479 -10.735 977 HG SER 133 HG SER 133 -7.361 11.079 -12.278 978 H HIS 134 H HIS 134 -6.895 13.198 -8.412 979 HA HIS 134 HA HIS 134 -9.504 14.371 -8.035 980 HB2 HIS 134 HB2 HIS 134 -8.389 13.844 -5.922 981 HB3 HIS 134 HB3 HIS 134 -7.214 14.902 -6.331 982 HD1 HIS 134 HD1 HIS 134 -7.696 17.479 -6.159 983 HD2 HIS 134 HD2 HIS 134 -10.727 14.999 -4.955 984 HE1 HIS 134 HE1 HIS 134 -9.405 18.839 -4.970 985 HE2 HIS 134 HE2 HIS 134 -11.240 17.365 -4.229 986 H HIS 135 H HIS 135 -9.933 16.297 -8.948 987 HA HIS 135 HA HIS 135 -7.850 17.451 -10.511 988 HB2 HIS 135 HB2 HIS 135 -10.687 17.972 -10.350 989 HB3 HIS 135 HB3 HIS 135 -9.718 18.917 -11.265 990 HD1 HIS 135 HD1 HIS 135 -8.850 18.042 -13.536 991 HD2 HIS 135 HD2 HIS 135 -11.176 15.406 -11.432 992 HE1 HIS 135 HE1 HIS 135 -9.410 16.128 -15.018 993 HE2 HIS 135 HE2 HIS 135 -10.801 14.518 -13.768 994 H ILE 136 H ILE 136 -6.789 19.380 -10.198 995 HA ILE 136 HA ILE 136 -7.728 20.996 -8.017 996 HB ILE 136 HB ILE 136 -4.896 20.364 -8.401 997 HG12 ILE 136 HG12 ILE 136 -6.584 19.647 -6.172 998 HG13 ILE 136 HG13 ILE 136 -6.111 18.603 -7.335 999 HG21 ILE 136 HG21 ILE 136 -4.448 21.745 -6.452 1000 HG22 ILE 136 HG22 ILE 136 -6.014 22.142 -6.365 1001 HG23 ILE 136 HG23 ILE 136 -5.119 22.649 -7.613 1002 HD11 ILE 136 HD11 ILE 136 -4.800 18.269 -5.356 1003 HD12 ILE 136 HD12 ILE 136 -4.309 19.810 -5.403 1004 HD13 ILE 136 HD13 ILE 136 -3.840 18.776 -6.555 1005 H TYR 137 H TYR 137 -8.105 23.097 -8.655 1006 HA TYR 137 HA TYR 137 -6.965 23.943 -11.128 1007 HB2 TYR 137 HB2 TYR 137 -9.259 24.441 -10.785 1008 HB3 TYR 137 HB3 TYR 137 -8.887 25.307 -9.451 1009 HD1 TYR 137 HD1 TYR 137 -8.169 27.616 -9.620 1010 HD2 TYR 137 HD2 TYR 137 -8.654 25.325 -13.059 1011 HE1 TYR 137 HE1 TYR 137 -7.902 29.594 -10.978 1012 HE2 TYR 137 HE2 TYR 137 -8.380 27.308 -14.416 1013 HH TYR 137 HH TYR 137 -7.888 29.502 -14.486 1014 H ILE 138 H ILE 138 -5.484 25.592 -11.421 1015 HA ILE 138 HA ILE 138 -4.359 26.720 -9.016 1016 HB ILE 138 HB ILE 138 -2.899 25.964 -11.434 1017 HG12 ILE 138 HG12 ILE 138 -3.407 24.058 -10.146 1018 HG13 ILE 138 HG13 ILE 138 -1.796 24.324 -10.142 1019 HG21 ILE 138 HG21 ILE 138 -0.881 26.647 -10.344 1020 HG22 ILE 138 HG22 ILE 138 -1.739 27.184 -9.083 1021 HG23 ILE 138 HG23 ILE 138 -1.879 27.906 -10.523 1022 HD11 ILE 138 HD11 ILE 138 -2.518 23.651 -7.961 1023 HD12 ILE 138 HD12 ILE 138 -3.543 24.900 -7.897 1024 HD13 ILE 138 HD13 ILE 138 -1.948 25.163 -7.893 1025 HA PRO 139 HA PRO 139 -5.438 30.350 -11.272 1026 HB2 PRO 139 HB2 PRO 139 -4.716 32.280 -9.618 1027 HB3 PRO 139 HB3 PRO 139 -5.973 31.333 -9.179 1028 HG2 PRO 139 HG2 PRO 139 -3.235 31.061 -8.403 1029 HG3 PRO 139 HG3 PRO 139 -4.547 31.082 -7.429 1030 HD2 PRO 139 HD2 PRO 139 -3.513 28.802 -8.161 1031 HD3 PRO 139 HD3 PRO 139 -5.131 28.936 -7.977 1032 H GLU 140 H GLU 140 -4.531 32.309 -12.255 1033 HA GLU 140 HA GLU 140 -1.794 31.720 -13.001 1034 HB2 GLU 140 HB2 GLU 140 -3.768 31.625 -14.616 1035 HB3 GLU 140 HB3 GLU 140 -3.577 33.246 -14.664 1036 HG2 GLU 140 HG2 GLU 140 -1.418 32.983 -15.563 1037 HG3 GLU 140 HG3 GLU 140 -1.566 31.359 -15.474 1038 H ASP 141 H ASP 141 -2.980 33.547 -10.869 1039 HA ASP 141 HA ASP 141 -2.271 36.073 -11.837 1040 HB2 ASP 141 HB2 ASP 141 -3.078 36.913 -9.718 1041 HB3 ASP 141 HB3 ASP 141 -4.104 35.744 -10.218 1042 H ARG 142 H ARG 142 -0.462 33.746 -10.279 1043 HA ARG 142 HA ARG 142 1.664 35.540 -9.853 1044 HB2 ARG 142 HB2 ARG 142 1.859 35.168 -7.474 1045 HB3 ARG 142 HB3 ARG 142 0.402 35.824 -7.809 1046 HG2 ARG 142 HG2 ARG 142 -0.513 33.559 -7.705 1047 HG3 ARG 142 HG3 ARG 142 0.925 33.091 -7.088 1048 HD2 ARG 142 HD2 ARG 142 0.638 34.619 -5.277 1049 HD3 ARG 142 HD3 ARG 142 -0.807 35.069 -5.890 1050 HE ARG 142 HE ARG 142 -0.229 32.625 -4.507 1051 HH11 ARG 142 HH11 ARG 142 -2.692 34.492 -6.218 1052 HH12 ARG 142 HH12 ARG 142 -3.975 33.521 -5.575 1053 HH21 ARG 142 HH21 ARG 142 -1.938 31.477 -3.723 1054 HH22 ARG 142 HH22 ARG 142 -3.559 31.859 -4.199 1055 H LEU 143 H LEU 143 3.635 34.550 -8.795 1056 HA LEU 143 HA LEU 143 3.843 31.783 -9.572 1057 HB2 LEU 143 HB2 LEU 143 5.991 32.179 -10.472 1058 HB3 LEU 143 HB3 LEU 143 4.861 33.062 -11.253 1059 HG LEU 143 HG LEU 143 5.920 34.720 -9.412 1060 HD11 LEU 143 HD11 LEU 143 8.266 34.633 -9.901 1061 HD12 LEU 143 HD12 LEU 143 8.035 33.313 -10.806 1062 HD13 LEU 143 HD13 LEU 143 7.799 33.249 -9.208 1063 HD21 LEU 143 HD21 LEU 143 6.650 35.937 -11.356 1064 HD22 LEU 143 HD22 LEU 143 5.146 35.392 -11.589 1065 HD23 LEU 143 HD23 LEU 143 6.397 34.632 -12.276 1066 H GLY 144 H GLY 144 5.097 30.398 -8.270 1067 HA2 GLY 144 HA2 GLY 144 7.055 30.795 -6.651 1068 HA3 GLY 144 HA3 GLY 144 5.896 31.523 -5.761 1069 H TYR 145 H TYR 145 7.543 29.334 -4.970 1070 HA TYR 145 HA TYR 145 5.858 27.103 -5.165 1071 HB2 TYR 145 HB2 TYR 145 7.672 25.861 -4.109 1072 HB3 TYR 145 HB3 TYR 145 8.240 26.753 -5.354 1073 HD1 TYR 145 HD1 TYR 145 9.642 28.761 -4.931 1074 HD2 TYR 145 HD2 TYR 145 8.375 26.282 -1.835 1075 HE1 TYR 145 HE1 TYR 145 11.238 29.797 -3.438 1076 HE2 TYR 145 HE2 TYR 145 9.979 27.312 -0.353 1077 HH TYR 145 HH TYR 145 11.234 29.367 -0.074 1078 H HIS 146 H HIS 146 4.910 25.816 -3.640 1079 HA HIS 146 HA HIS 146 5.165 26.583 -0.913 1080 HB2 HIS 146 HB2 HIS 146 2.925 26.821 -0.434 1081 HB3 HIS 146 HB3 HIS 146 3.244 27.809 -1.695 1082 HD1 HIS 146 HD1 HIS 146 1.485 24.641 -0.854 1083 HD2 HIS 146 HD2 HIS 146 1.869 27.213 -4.022 1084 HE1 HIS 146 HE1 HIS 146 -0.157 23.992 -2.604 1085 HE2 HIS 146 HE2 HIS 146 0.037 25.543 -4.509 1086 H VAL 147 H VAL 147 4.186 24.897 0.567 1087 HA VAL 147 HA VAL 147 4.545 22.348 -0.659 1088 HB VAL 147 HB VAL 147 4.176 22.534 2.200 1089 HG11 VAL 147 HG11 VAL 147 5.829 20.785 2.258 1090 HG12 VAL 147 HG12 VAL 147 6.020 20.909 0.657 1091 HG13 VAL 147 HG13 VAL 147 4.622 20.371 1.266 1092 HG21 VAL 147 HG21 VAL 147 6.464 23.191 2.586 1093 HG22 VAL 147 HG22 VAL 147 5.682 24.366 1.796 1094 HG23 VAL 147 HG23 VAL 147 6.683 23.381 0.995 1095 H ILE 148 H ILE 148 3.061 20.623 -0.498 1096 HA ILE 148 HA ILE 148 0.371 21.353 0.237 1097 HB ILE 148 HB ILE 148 1.156 19.197 -1.576 1098 HG12 ILE 148 HG12 ILE 148 -0.155 21.647 -2.312 1099 HG13 ILE 148 HG13 ILE 148 1.434 21.357 -2.551 1100 HG21 ILE 148 HG21 ILE 148 -1.223 18.879 -2.006 1101 HG22 ILE 148 HG22 ILE 148 -1.578 20.021 -0.918 1102 HG23 ILE 148 HG23 ILE 148 -0.918 18.624 -0.439 1103 HD11 ILE 148 HD11 ILE 148 0.223 21.011 -4.602 1104 HD12 ILE 148 HD12 ILE 148 -0.702 19.897 -3.883 1105 HD13 ILE 148 HD13 ILE 148 0.872 19.611 -4.120 1106 H LEU 149 H LEU 149 -0.485 20.194 2.002 1107 HA LEU 149 HA LEU 149 1.048 17.922 2.978 1108 HB2 LEU 149 HB2 LEU 149 -0.548 19.746 4.545 1109 HB3 LEU 149 HB3 LEU 149 0.318 18.502 5.153 1110 HG LEU 149 HG LEU 149 1.540 20.806 3.945 1111 HD11 LEU 149 HD11 LEU 149 2.003 21.552 6.201 1112 HD12 LEU 149 HD12 LEU 149 1.166 20.299 6.787 1113 HD13 LEU 149 HD13 LEU 149 0.406 21.468 5.968 1114 HD21 LEU 149 HD21 LEU 149 3.563 20.028 4.946 1115 HD22 LEU 149 HD22 LEU 149 2.982 18.919 3.924 1116 HD23 LEU 149 HD23 LEU 149 2.787 18.730 5.518 1117 H ALA 150 H ALA 150 -0.202 15.970 3.339 1118 HA ALA 150 HA ALA 150 -3.043 16.332 3.175 1119 HB1 ALA 150 HB1 ALA 150 -2.397 15.739 0.943 1120 HB2 ALA 150 HB2 ALA 150 -3.304 14.559 1.574 1121 HB3 ALA 150 HB3 ALA 150 -1.698 14.388 1.494 1122 H VAL 151 H VAL 151 -4.356 14.704 4.067 1123 HA VAL 151 HA VAL 151 -2.956 12.957 5.864 1124 HB VAL 151 HB VAL 151 -5.315 14.528 6.575 1125 HG11 VAL 151 HG11 VAL 151 -5.121 13.649 8.805 1126 HG12 VAL 151 HG12 VAL 151 -3.895 12.708 8.331 1127 HG13 VAL 151 HG13 VAL 151 -5.382 12.450 7.751 1128 HG21 VAL 151 HG21 VAL 151 -3.893 15.741 8.106 1129 HG22 VAL 151 HG22 VAL 151 -3.359 15.920 6.590 1130 HG23 VAL 151 HG23 VAL 151 -2.615 14.893 7.593 1131 H TRP 152 H TRP 152 -3.659 10.882 5.946 1132 HA TRP 152 HA TRP 152 -6.148 10.241 4.602 1133 HB2 TRP 152 HB2 TRP 152 -4.099 9.444 3.533 1134 HB3 TRP 152 HB3 TRP 152 -3.858 8.500 4.844 1135 HD1 TRP 152 HD1 TRP 152 -5.962 6.665 5.251 1136 HE1 TRP 152 HE1 TRP 152 -7.149 5.190 3.610 1137 HE3 TRP 152 HE3 TRP 152 -4.779 9.240 1.130 1138 HZ2 TRP 152 HZ2 TRP 152 -7.453 5.194 0.811 1139 HZ3 TRP 152 HZ3 TRP 152 -5.574 8.444 -1.014 1140 HH2 TRP 152 HH2 TRP 152 -6.888 6.421 -1.159 1141 H ASP 153 H ASP 153 -7.720 9.715 6.047 1142 HA ASP 153 HA ASP 153 -6.833 8.690 8.564 1143 HB2 ASP 153 HB2 ASP 153 -9.313 10.013 7.887 1144 HB3 ASP 153 HB3 ASP 153 -9.095 9.323 9.351 1145 H VAL 154 H VAL 154 -7.339 6.738 9.371 1146 HA VAL 154 HA VAL 154 -9.296 5.161 7.925 1147 HB VAL 154 HB VAL 154 -6.825 4.118 9.045 1148 HG11 VAL 154 HG11 VAL 154 -7.444 2.018 8.060 1149 HG12 VAL 154 HG12 VAL 154 -8.841 2.658 7.556 1150 HG13 VAL 154 HG13 VAL 154 -8.561 2.472 9.138 1151 HG21 VAL 154 HG21 VAL 154 -6.117 3.774 6.771 1152 HG22 VAL 154 HG22 VAL 154 -6.374 5.348 7.036 1153 HG23 VAL 154 HG23 VAL 154 -7.474 4.472 6.238 1154 H ALA 155 H ALA 155 -10.906 4.252 9.241 1155 HA ALA 155 HA ALA 155 -10.827 5.047 11.933 1156 HB1 ALA 155 HB1 ALA 155 -12.942 5.003 10.728 1157 HB2 ALA 155 HB2 ALA 155 -13.068 4.064 12.039 1158 HB3 ALA 155 HB3 ALA 155 -12.835 3.396 10.585 1159 H ASP 156 H ASP 156 -10.534 2.082 10.255 1160 HA ASP 156 HA ASP 156 -10.747 0.513 12.542 1161 HB2 ASP 156 HB2 ASP 156 -9.788 -0.602 10.023 1162 HB3 ASP 156 HB3 ASP 156 -10.917 -1.265 10.999 1163 H THR 157 H THR 157 -8.212 2.164 12.036 1164 HA THR 157 HA THR 157 -6.472 0.062 12.896 1165 HB THR 157 HB THR 157 -4.606 1.214 11.632 1166 HG1 THR 157 HG1 THR 157 -5.874 2.366 9.781 1167 HG21 THR 157 HG21 THR 157 -5.193 0.269 9.501 1168 HG22 THR 157 HG22 THR 157 -6.740 0.155 9.960 1169 HG23 THR 157 HG23 THR 157 -5.618 -0.776 10.660 1170 H GLU 158 H GLU 158 -4.661 0.638 14.264 1171 HA GLU 158 HA GLU 158 -5.231 2.784 15.963 1172 HB2 GLU 158 HB2 GLU 158 -3.028 0.919 15.797 1173 HB3 GLU 158 HB3 GLU 158 -2.938 2.153 16.863 1174 HG2 GLU 158 HG2 GLU 158 -4.981 0.138 16.898 1175 HG3 GLU 158 HG3 GLU 158 -3.692 0.160 17.901 1176 H ASN 159 H ASN 159 -3.869 2.737 13.022 1177 HA ASN 159 HA ASN 159 -2.209 5.014 13.568 1178 HB2 ASN 159 HB2 ASN 159 -1.862 2.945 11.565 1179 HB3 ASN 159 HB3 ASN 159 -0.978 4.318 11.517 1180 HD21 ASN 159 HD21 ASN 159 1.334 3.391 13.896 1181 HD22 ASN 159 HD22 ASN 159 0.772 4.623 12.816 1182 H ALA 160 H ALA 160 -1.853 6.587 11.865 1183 HA ALA 160 HA ALA 160 -3.974 6.839 9.901 1184 HB1 ALA 160 HB1 ALA 160 -4.723 8.250 11.634 1185 HB2 ALA 160 HB2 ALA 160 -4.198 9.180 10.420 1186 HB3 ALA 160 HB3 ALA 160 -3.275 8.964 11.730 1187 H PHE 161 H PHE 161 -3.131 8.476 8.155 1188 HA PHE 161 HA PHE 161 -0.252 8.343 8.109 1189 HB2 PHE 161 HB2 PHE 161 -1.885 7.736 5.781 1190 HB3 PHE 161 HB3 PHE 161 -0.278 7.473 5.905 1191 HD1 PHE 161 HD1 PHE 161 -3.474 6.080 6.482 1192 HD2 PHE 161 HD2 PHE 161 0.566 5.610 7.348 1193 HE1 PHE 161 HE1 PHE 161 -3.911 3.841 7.274 1194 HE2 PHE 161 HE2 PHE 161 0.143 3.369 8.127 1195 HZ PHE 161 HZ PHE 161 -2.096 2.484 8.105 1196 H TYR 162 H TYR 162 0.943 9.829 6.856 1197 HA TYR 162 HA TYR 162 -0.639 11.996 5.833 1198 HB2 TYR 162 HB2 TYR 162 1.909 12.489 7.102 1199 HB3 TYR 162 HB3 TYR 162 0.836 13.626 6.631 1200 HD1 TYR 162 HD1 TYR 162 2.243 12.762 9.397 1201 HD2 TYR 162 HD2 TYR 162 -1.639 12.799 7.910 1202 HE1 TYR 162 HE1 TYR 162 1.387 12.939 11.642 1203 HE2 TYR 162 HE2 TYR 162 -2.497 12.934 10.166 1204 HH TYR 162 HH TYR 162 -2.063 13.074 12.345 1205 H GLN 163 H GLN 163 0.370 13.191 3.995 1206 HA GLN 163 HA GLN 163 2.895 12.169 3.124 1207 HB2 GLN 163 HB2 GLN 163 2.152 11.999 0.819 1208 HB3 GLN 163 HB3 GLN 163 1.645 10.808 1.816 1209 HG2 GLN 163 HG2 GLN 163 -0.081 13.002 1.247 1210 HG3 GLN 163 HG3 GLN 163 0.027 11.757 0.195 1211 HE21 GLN 163 HE21 GLN 163 -1.447 9.389 2.497 1212 HE22 GLN 163 HE22 GLN 163 -0.026 9.510 1.514 1213 H VAL 164 H VAL 164 4.036 13.600 1.592 1214 HA VAL 164 HA VAL 164 3.029 16.284 1.653 1215 HB VAL 164 HB VAL 164 4.476 16.169 3.577 1216 HG11 VAL 164 HG11 VAL 164 6.787 15.506 3.426 1217 HG12 VAL 164 HG12 VAL 164 6.594 15.172 1.855 1218 HG13 VAL 164 HG13 VAL 164 5.830 14.285 2.971 1219 HG21 VAL 164 HG21 VAL 164 6.072 17.884 3.117 1220 HG22 VAL 164 HG22 VAL 164 4.640 18.253 2.463 1221 HG23 VAL 164 HG23 VAL 164 5.833 17.685 1.530 1222 H ILE 165 H ILE 165 3.446 17.605 -0.056 1223 HA ILE 165 HA ILE 165 5.292 16.671 -2.049 1224 HB ILE 165 HB ILE 165 2.531 17.448 -2.748 1225 HG12 ILE 165 HG12 ILE 165 3.607 14.792 -2.951 1226 HG13 ILE 165 HG13 ILE 165 2.589 15.278 -1.769 1227 HG21 ILE 165 HG21 ILE 165 3.080 16.880 -5.039 1228 HG22 ILE 165 HG22 ILE 165 4.598 16.538 -4.598 1229 HG23 ILE 165 HG23 ILE 165 4.056 18.060 -4.522 1230 HD11 ILE 165 HD11 ILE 165 1.382 14.041 -3.429 1231 HD12 ILE 165 HD12 ILE 165 1.853 15.085 -4.571 1232 HD13 ILE 165 HD13 ILE 165 0.846 15.566 -3.401 1233 H ASP 166 H ASP 166 6.509 18.538 -2.909 1234 HA ASP 166 HA ASP 166 5.279 21.092 -2.312 1235 HB2 ASP 166 HB2 ASP 166 7.459 20.908 -1.437 1236 HB3 ASP 166 HB3 ASP 166 8.048 20.613 -2.931 1237 H VAL 167 H VAL 167 4.798 22.606 -3.889 1238 HA VAL 167 HA VAL 167 5.411 21.805 -6.561 1239 HB VAL 167 HB VAL 167 3.208 22.695 -7.287 1240 HG11 VAL 167 HG11 VAL 167 2.014 20.664 -6.727 1241 HG12 VAL 167 HG12 VAL 167 3.126 20.321 -5.604 1242 HG13 VAL 167 HG13 VAL 167 3.528 20.311 -7.171 1243 HG21 VAL 167 HG21 VAL 167 1.461 22.865 -5.630 1244 HG22 VAL 167 HG22 VAL 167 2.620 23.951 -5.325 1245 HG23 VAL 167 HG23 VAL 167 2.540 22.588 -4.458 1246 H ASP 168 H ASP 168 6.233 23.320 -7.909 1247 HA ASP 168 HA ASP 168 6.400 26.024 -6.892 1248 HB2 ASP 168 HB2 ASP 168 8.379 24.668 -7.737 1249 HB3 ASP 168 HB3 ASP 168 7.906 25.292 -9.170 1250 H LEU 169 H LEU 169 4.452 26.941 -7.399 1251 HA LEU 169 HA LEU 169 3.270 26.346 -9.927 1252 HB2 LEU 169 HB2 LEU 169 2.281 28.045 -7.814 1253 HB3 LEU 169 HB3 LEU 169 1.398 27.545 -9.094 1254 HG LEU 169 HG LEU 169 2.325 25.802 -7.002 1255 HD11 LEU 169 HD11 LEU 169 0.004 25.793 -6.302 1256 HD12 LEU 169 HD12 LEU 169 -0.349 26.854 -7.470 1257 HD13 LEU 169 HD13 LEU 169 0.592 27.298 -6.233 1258 HD21 LEU 169 HD21 LEU 169 0.943 24.126 -7.949 1259 HD22 LEU 169 HD22 LEU 169 2.082 24.578 -9.004 1260 HD23 LEU 169 HD23 LEU 169 0.566 25.114 -9.172 1261 H VAL 170 H VAL 170 4.131 27.487 -11.687 1262 HA VAL 170 HA VAL 170 4.325 30.252 -11.203 1263 HB VAL 170 HB VAL 170 6.540 30.462 -12.225 1264 HG11 VAL 170 HG11 VAL 170 7.903 29.296 -10.618 1265 HG12 VAL 170 HG12 VAL 170 6.627 28.403 -10.184 1266 HG13 VAL 170 HG13 VAL 170 6.642 29.992 -9.884 1267 HG21 VAL 170 HG21 VAL 170 7.756 28.520 -12.982 1268 HG22 VAL 170 HG22 VAL 170 6.396 28.697 -13.839 1269 HG23 VAL 170 HG23 VAL 170 6.472 27.591 -12.662 1270 H ASN 171 H ASN 171 4.514 31.746 -12.975 1271 HA ASN 171 HA ASN 171 3.292 30.768 -15.371 1272 HB2 ASN 171 HB2 ASN 171 3.700 33.467 -14.410 1273 HB3 ASN 171 HB3 ASN 171 3.118 33.175 -15.907 1274 HD21 ASN 171 HD21 ASN 171 0.329 33.888 -13.670 1275 HD22 ASN 171 HD22 ASN 171 1.788 34.715 -14.102 1276 H LYS 172 H LYS 172 4.158 31.526 -17.469 1277 HA LYS 172 HA LYS 172 5.687 32.182 -18.909 1278 HB2 LYS 172 HB2 LYS 172 6.256 34.009 -17.409 1279 HB3 LYS 172 HB3 LYS 172 7.431 33.077 -16.762 1280 HG2 LYS 172 HG2 LYS 172 8.410 34.640 -18.166 1281 HG3 LYS 172 HG3 LYS 172 8.601 33.159 -18.828 1282 HD2 LYS 172 HD2 LYS 172 6.425 33.901 -20.040 1283 HD3 LYS 172 HD3 LYS 172 7.138 35.356 -19.834 1284 HE2 LYS 172 HE2 LYS 172 7.868 34.582 -21.895 1285 HE3 LYS 172 HE3 LYS 172 9.136 34.407 -20.880 1286 HZ1 LYS 172 HZ1 LYS 172 8.865 32.438 -22.195 1287 HZ2 LYS 172 HZ2 LYS 172 7.356 32.263 -21.641 1288 HZ3 LYS 172 HZ3 LYS 172 8.611 32.090 -20.637 Start of MODEL 17 1 H1 HIS 1 H1 HIS 1 1.161 5.149 3.617 2 H2 HIS 1 H2 HIS 1 1.948 4.663 2.291 3 H3 HIS 1 H3 HIS 1 0.489 4.057 2.632 4 HA HIS 1 HA HIS 1 -0.498 6.102 2.278 5 HB2 HIS 1 HB2 HIS 1 0.611 8.052 1.849 6 HB3 HIS 1 HB3 HIS 1 1.577 7.336 2.954 7 HD1 HIS 1 HD1 HIS 1 1.699 8.949 -0.210 8 HD2 HIS 1 HD2 HIS 1 3.858 5.991 1.629 9 HE1 HIS 1 HE1 HIS 1 3.848 8.656 -1.433 10 HE2 HIS 1 HE2 HIS 1 5.162 6.879 -0.340 11 H GLY 2 H GLY 2 1.343 3.908 0.615 12 HA2 GLY 2 HA2 GLY 2 0.694 3.031 -1.410 13 HA3 GLY 2 HA3 GLY 2 -0.341 4.271 -1.653 14 H PHE 3 H PHE 3 0.383 4.323 -3.883 15 HA PHE 3 HA PHE 3 3.034 5.392 -4.159 16 HB2 PHE 3 HB2 PHE 3 1.427 4.208 -6.270 17 HB3 PHE 3 HB3 PHE 3 3.024 4.533 -6.373 18 HD1 PHE 3 HD1 PHE 3 4.467 3.286 -4.473 19 HD2 PHE 3 HD2 PHE 3 0.832 1.983 -6.021 20 HE1 PHE 3 HE1 PHE 3 4.956 1.048 -3.718 21 HE2 PHE 3 HE2 PHE 3 1.321 -0.261 -5.304 22 HZ PHE 3 HZ PHE 3 3.380 -0.733 -4.138 23 H ILE 4 H ILE 4 3.454 7.376 -4.998 24 HA ILE 4 HA ILE 4 1.196 8.932 -5.809 25 HB ILE 4 HB ILE 4 3.941 9.802 -5.314 26 HG12 ILE 4 HG12 ILE 4 1.589 10.433 -3.775 27 HG13 ILE 4 HG13 ILE 4 2.607 9.220 -3.376 28 HG21 ILE 4 HG21 ILE 4 3.200 12.075 -5.655 29 HG22 ILE 4 HG22 ILE 4 1.731 11.545 -6.074 30 HG23 ILE 4 HG23 ILE 4 3.004 11.230 -7.020 31 HD11 ILE 4 HD11 ILE 4 3.070 11.148 -2.031 32 HD12 ILE 4 HD12 ILE 4 3.342 12.028 -3.360 33 HD13 ILE 4 HD13 ILE 4 4.349 10.826 -2.966 34 H GLU 5 H GLU 5 0.591 8.819 -7.925 35 HA GLU 5 HA GLU 5 2.579 8.177 -9.881 36 HB2 GLU 5 HB2 GLU 5 0.410 7.110 -9.954 37 HB3 GLU 5 HB3 GLU 5 -0.264 8.565 -10.269 38 HG2 GLU 5 HG2 GLU 5 1.189 8.551 -12.286 39 HG3 GLU 5 HG3 GLU 5 1.295 6.944 -12.016 40 H LYS 6 H LYS 6 0.312 10.680 -9.095 41 HA LYS 6 HA LYS 6 1.827 12.581 -10.640 42 HB2 LYS 6 HB2 LYS 6 -1.067 12.625 -10.643 43 HB3 LYS 6 HB3 LYS 6 -0.099 13.600 -11.527 44 HG2 LYS 6 HG2 LYS 6 -0.363 10.787 -12.015 45 HG3 LYS 6 HG3 LYS 6 -1.215 11.923 -12.821 46 HD2 LYS 6 HD2 LYS 6 0.763 12.746 -13.800 47 HD3 LYS 6 HD3 LYS 6 1.651 11.672 -12.948 48 HE2 LYS 6 HE2 LYS 6 0.402 9.893 -14.060 49 HE3 LYS 6 HE3 LYS 6 -0.254 11.036 -15.024 50 HZ1 LYS 6 HZ1 LYS 6 1.540 9.970 -16.124 51 HZ2 LYS 6 HZ2 LYS 6 2.544 10.397 -14.931 52 HZ3 LYS 6 HZ3 LYS 6 1.895 11.529 -15.887 53 HA PRO 7 HA PRO 7 1.835 15.011 -10.797 54 HB2 PRO 7 HB2 PRO 7 2.798 17.196 -9.641 55 HB3 PRO 7 HB3 PRO 7 1.186 17.093 -9.885 56 HG2 PRO 7 HG2 PRO 7 2.632 16.564 -7.487 57 HG3 PRO 7 HG3 PRO 7 1.243 17.406 -7.657 58 HD2 PRO 7 HD2 PRO 7 1.244 14.887 -6.889 59 HD3 PRO 7 HD3 PRO 7 -0.020 15.534 -7.695 60 H GLY 8 H GLY 8 3.395 13.740 -11.532 61 HA2 GLY 8 HA2 GLY 8 5.548 13.065 -11.713 62 HA3 GLY 8 HA3 GLY 8 6.005 14.270 -10.710 63 H SER 9 H SER 9 7.628 12.618 -10.011 64 HA SER 9 HA SER 9 6.522 11.123 -7.821 65 HB2 SER 9 HB2 SER 9 6.759 9.466 -9.523 66 HB3 SER 9 HB3 SER 9 8.301 9.930 -9.798 67 HG SER 9 HG SER 9 8.135 9.332 -7.295 68 H ARG 10 H ARG 10 8.004 10.637 -6.086 69 HA ARG 10 HA ARG 10 9.991 12.580 -5.843 70 HB2 ARG 10 HB2 ARG 10 10.390 11.720 -3.658 71 HB3 ARG 10 HB3 ARG 10 8.783 11.873 -3.910 72 HG2 ARG 10 HG2 ARG 10 8.565 9.552 -4.174 73 HG3 ARG 10 HG3 ARG 10 10.182 9.358 -4.058 74 HD2 ARG 10 HD2 ARG 10 8.703 10.517 -1.872 75 HD3 ARG 10 HD3 ARG 10 8.865 8.896 -1.989 76 HE ARG 10 HE ARG 10 11.002 10.767 -1.462 77 HH11 ARG 10 HH11 ARG 10 12.789 9.966 -0.433 78 HH12 ARG 10 HH12 ARG 10 12.940 8.270 -0.114 79 HH21 ARG 10 HH21 ARG 10 9.942 7.402 -1.517 80 HH22 ARG 10 HH22 ARG 10 11.374 6.856 -0.711 81 H ALA 11 H ALA 11 9.988 9.469 -7.048 82 HA ALA 11 HA ALA 11 12.425 8.553 -6.276 83 HB1 ALA 11 HB1 ALA 11 10.780 7.163 -7.432 84 HB2 ALA 11 HB2 ALA 11 12.224 6.987 -8.138 85 HB3 ALA 11 HB3 ALA 11 11.103 7.936 -8.815 86 H ALA 12 H ALA 12 11.752 10.715 -8.874 87 HA ALA 12 HA ALA 12 14.215 10.549 -10.090 88 HB1 ALA 12 HB1 ALA 12 12.301 11.629 -11.154 89 HB2 ALA 12 HB2 ALA 12 13.569 12.631 -11.201 90 HB3 ALA 12 HB3 ALA 12 12.405 12.852 -10.102 91 H LEU 13 H LEU 13 13.273 12.276 -7.301 92 HA LEU 13 HA LEU 13 15.638 13.844 -7.314 93 HB2 LEU 13 HB2 LEU 13 13.468 13.773 -5.401 94 HB3 LEU 13 HB3 LEU 13 14.740 14.784 -5.237 95 HG LEU 13 HG LEU 13 13.919 15.676 -7.451 96 HD11 LEU 13 HD11 LEU 13 11.532 15.664 -7.666 97 HD12 LEU 13 HD12 LEU 13 11.422 14.636 -6.423 98 HD13 LEU 13 HD13 LEU 13 12.116 14.163 -7.804 99 HD21 LEU 13 HD21 LEU 13 12.658 17.343 -6.179 100 HD22 LEU 13 HD22 LEU 13 14.031 16.982 -5.405 101 HD23 LEU 13 HD23 LEU 13 12.632 16.340 -4.910 102 H CYS 14 H CYS 14 14.743 10.863 -6.270 103 HA CYS 14 HA CYS 14 16.246 10.823 -3.904 104 HB2 CYS 14 HB2 CYS 14 14.373 9.439 -4.130 105 HB3 CYS 14 HB3 CYS 14 15.061 8.685 -5.405 106 H SER 15 H SER 15 16.684 9.603 -7.119 107 HA SER 15 HA SER 15 19.041 8.250 -6.525 108 HB2 SER 15 HB2 SER 15 19.197 8.160 -9.045 109 HB3 SER 15 HB3 SER 15 17.805 7.556 -8.441 110 HG SER 15 HG SER 15 17.473 8.982 -10.166 111 H GLU 16 H GLU 16 21.121 8.849 -6.366 112 HA GLU 16 HA GLU 16 21.913 11.470 -6.651 113 HB2 GLU 16 HB2 GLU 16 23.528 9.068 -6.700 114 HB3 GLU 16 HB3 GLU 16 24.181 10.560 -6.585 115 HG2 GLU 16 HG2 GLU 16 23.290 10.861 -4.484 116 HG3 GLU 16 HG3 GLU 16 22.402 9.496 -4.612 117 H ALA 17 H ALA 17 21.595 8.962 -8.883 118 HA ALA 17 HA ALA 17 23.187 9.779 -10.918 119 HB1 ALA 17 HB1 ALA 17 22.006 7.633 -10.897 120 HB2 ALA 17 HB2 ALA 17 21.769 8.360 -12.322 121 HB3 ALA 17 HB3 ALA 17 20.613 8.400 -11.192 122 H PHE 18 H PHE 18 20.585 11.468 -9.791 123 HA PHE 18 HA PHE 18 19.777 12.615 -12.228 124 HB2 PHE 18 HB2 PHE 18 18.379 12.357 -10.191 125 HB3 PHE 18 HB3 PHE 18 19.199 13.624 -9.564 126 HD1 PHE 18 HD1 PHE 18 18.565 15.867 -10.052 127 HD2 PHE 18 HD2 PHE 18 16.888 12.711 -12.180 128 HE1 PHE 18 HE1 PHE 18 16.978 17.389 -11.044 129 HE2 PHE 18 HE2 PHE 18 15.299 14.223 -13.186 130 HZ PHE 18 HZ PHE 18 15.349 16.569 -12.624 131 H GLY 19 H GLY 19 22.410 13.188 -10.240 132 HA2 GLY 19 HA2 GLY 19 23.398 15.168 -11.832 133 HA3 GLY 19 HA3 GLY 19 22.639 15.935 -10.607 134 H PHE 20 H PHE 20 23.589 13.565 -8.922 135 HA PHE 20 HA PHE 20 25.164 13.180 -7.523 136 HB2 PHE 20 HB2 PHE 20 26.400 12.744 -9.692 137 HB3 PHE 20 HB3 PHE 20 27.276 14.067 -9.303 138 HD1 PHE 20 HD1 PHE 20 26.342 10.848 -7.897 139 HD2 PHE 20 HD2 PHE 20 29.265 13.801 -8.090 140 HE1 PHE 20 HE1 PHE 20 27.801 9.478 -6.552 141 HE2 PHE 20 HE2 PHE 20 30.740 12.437 -6.750 142 HZ PHE 20 HZ PHE 20 30.005 10.271 -5.974 143 H LEU 21 H LEU 21 24.805 16.322 -8.218 144 HA LEU 21 HA LEU 21 26.741 17.435 -6.570 145 HB2 LEU 21 HB2 LEU 21 24.156 18.499 -7.294 146 HB3 LEU 21 HB3 LEU 21 25.315 19.389 -6.566 147 HG LEU 21 HG LEU 21 25.584 18.298 -9.217 148 HD11 LEU 21 HD11 LEU 21 25.207 20.558 -9.994 149 HD12 LEU 21 HD12 LEU 21 24.948 21.037 -8.472 150 HD13 LEU 21 HD13 LEU 21 23.908 20.028 -9.190 151 HD21 LEU 21 HD21 LEU 21 27.505 19.708 -9.427 152 HD22 LEU 21 HD22 LEU 21 27.715 18.657 -8.216 153 HD23 LEU 21 HD23 LEU 21 27.325 20.193 -7.895 154 H ASN 22 H ASN 22 23.531 16.323 -6.010 155 HA ASN 22 HA ASN 22 23.994 15.732 -3.309 156 HB2 ASN 22 HB2 ASN 22 23.423 18.215 -3.374 157 HB3 ASN 22 HB3 ASN 22 21.893 17.652 -3.468 158 HD21 ASN 22 HD21 ASN 22 23.011 18.260 0.067 159 HD22 ASN 22 HD22 ASN 22 23.165 19.208 -1.374 160 H LEU 23 H LEU 23 21.715 14.992 -2.345 161 HA LEU 23 HA LEU 23 19.919 14.151 -4.427 162 HB2 LEU 23 HB2 LEU 23 19.740 12.004 -3.708 163 HB3 LEU 23 HB3 LEU 23 21.347 12.295 -3.757 164 HG LEU 23 HG LEU 23 19.861 12.297 -1.307 165 HD11 LEU 23 HD11 LEU 23 20.726 10.047 -0.952 166 HD12 LEU 23 HD12 LEU 23 21.393 10.081 -2.424 167 HD13 LEU 23 HD13 LEU 23 19.784 10.079 -2.265 168 HD21 LEU 23 HD21 LEU 23 21.958 12.057 -0.199 169 HD22 LEU 23 HD22 LEU 23 21.918 13.430 -1.052 170 HD23 LEU 23 HD23 LEU 23 22.723 12.148 -1.620 171 H ASN 24 H ASN 24 17.673 13.797 -3.637 172 HA ASN 24 HA ASN 24 17.212 14.981 -1.024 173 HB2 ASN 24 HB2 ASN 24 16.659 16.464 -2.946 174 HB3 ASN 24 HB3 ASN 24 15.376 15.479 -3.173 175 HD21 ASN 24 HD21 ASN 24 13.871 16.440 -0.002 176 HD22 ASN 24 HD22 ASN 24 14.392 14.965 -0.744 177 H CYS 25 H CYS 25 17.535 12.372 -1.039 178 HA CYS 25 HA CYS 25 14.984 11.186 -1.459 179 HB2 CYS 25 HB2 CYS 25 17.171 10.120 -1.939 180 HB3 CYS 25 HB3 CYS 25 17.161 9.736 -0.351 181 H GLY 26 H GLY 26 17.208 11.649 1.185 182 HA2 GLY 26 HA2 GLY 26 16.775 11.916 3.380 183 HA3 GLY 26 HA3 GLY 26 15.182 12.070 3.054 184 H SER 27 H SER 27 15.357 10.942 5.308 185 HA SER 27 HA SER 27 15.868 8.225 5.357 186 HB2 SER 27 HB2 SER 27 15.675 9.623 7.365 187 HB3 SER 27 HB3 SER 27 14.054 9.616 7.164 188 HG SER 27 HG SER 27 14.783 8.097 8.669 189 H VAL 28 H VAL 28 13.356 9.913 4.036 190 HA VAL 28 HA VAL 28 11.306 8.096 4.154 191 HB VAL 28 HB VAL 28 11.623 9.843 1.850 192 HG11 VAL 28 HG11 VAL 28 9.228 10.094 1.993 193 HG12 VAL 28 HG12 VAL 28 9.204 9.145 3.302 194 HG13 VAL 28 HG13 VAL 28 9.613 8.529 1.864 195 HG21 VAL 28 HG21 VAL 28 10.784 11.723 3.131 196 HG22 VAL 28 HG22 VAL 28 12.195 11.226 3.746 197 HG23 VAL 28 HG23 VAL 28 10.808 10.822 4.474 198 H MET 29 H MET 29 14.229 7.775 2.585 199 HA MET 29 HA MET 29 13.523 6.104 0.532 200 HB2 MET 29 HB2 MET 29 15.769 5.353 0.528 201 HB3 MET 29 HB3 MET 29 15.761 6.956 0.840 202 HG2 MET 29 HG2 MET 29 16.037 6.492 3.120 203 HG3 MET 29 HG3 MET 29 16.099 4.897 2.774 204 HE1 MET 29 HE1 MET 29 19.439 4.363 0.980 205 HE2 MET 29 HE2 MET 29 17.935 4.377 0.387 206 HE3 MET 29 HE3 MET 29 18.248 3.618 1.781 207 H TYR 30 H TYR 30 13.642 5.523 3.890 208 HA TYR 30 HA TYR 30 13.536 2.698 3.701 209 HB2 TYR 30 HB2 TYR 30 14.554 3.749 5.599 210 HB3 TYR 30 HB3 TYR 30 13.119 4.418 5.999 211 HD1 TYR 30 HD1 TYR 30 14.710 1.157 5.654 212 HD2 TYR 30 HD2 TYR 30 11.694 3.319 7.541 213 HE1 TYR 30 HE1 TYR 30 14.212 -0.750 7.059 214 HE2 TYR 30 HE2 TYR 30 11.195 1.410 8.931 215 HH TYR 30 HH TYR 30 12.312 -0.616 9.814 216 H GLU 31 H GLU 31 11.351 5.289 3.938 217 HA GLU 31 HA GLU 31 9.141 3.454 4.033 218 HB2 GLU 31 HB2 GLU 31 9.246 6.188 4.998 219 HB3 GLU 31 HB3 GLU 31 7.852 5.337 4.957 220 HG2 GLU 31 HG2 GLU 31 8.860 3.749 6.473 221 HG3 GLU 31 HG3 GLU 31 10.137 4.759 6.605 222 HA PRO 32 HA PRO 32 8.861 5.841 0.237 223 HB2 PRO 32 HB2 PRO 32 8.974 4.013 -1.702 224 HB3 PRO 32 HB3 PRO 32 10.370 4.573 -1.065 225 HG2 PRO 32 HG2 PRO 32 8.992 2.163 -0.404 226 HG3 PRO 32 HG3 PRO 32 10.588 2.358 -0.688 227 HD2 PRO 32 HD2 PRO 32 9.678 2.271 1.754 228 HD3 PRO 32 HD3 PRO 32 10.973 3.195 1.385 229 H GLN 33 H GLN 33 7.278 2.816 0.757 230 HA GLN 33 HA GLN 33 4.897 4.050 -0.218 231 HB2 GLN 33 HB2 GLN 33 3.974 1.880 -0.560 232 HB3 GLN 33 HB3 GLN 33 5.416 2.002 -1.317 233 HG2 GLN 33 HG2 GLN 33 6.431 0.734 0.393 234 HG3 GLN 33 HG3 GLN 33 5.000 0.629 1.173 235 HE21 GLN 33 HE21 GLN 33 4.311 -2.382 -0.331 236 HE22 GLN 33 HE22 GLN 33 4.432 -1.468 1.135 237 H SER 34 H SER 34 6.153 2.590 2.640 238 HA SER 34 HA SER 34 3.590 2.919 3.928 239 HB2 SER 34 HB2 SER 34 5.957 1.579 4.990 240 HB3 SER 34 HB3 SER 34 4.468 1.501 5.656 241 HG SER 34 HG SER 34 4.598 -0.319 4.567 242 H LEU 35 H LEU 35 3.785 5.220 3.824 243 HA LEU 35 HA LEU 35 5.638 6.368 5.740 244 HB2 LEU 35 HB2 LEU 35 5.762 7.173 3.500 245 HB3 LEU 35 HB3 LEU 35 4.205 7.652 3.608 246 HG LEU 35 HG LEU 35 4.834 9.358 5.129 247 HD11 LEU 35 HD11 LEU 35 7.083 9.844 5.604 248 HD12 LEU 35 HD12 LEU 35 7.553 8.511 4.818 249 HD13 LEU 35 HD13 LEU 35 6.691 8.385 6.180 250 HD21 LEU 35 HD21 LEU 35 6.038 10.677 3.455 251 HD22 LEU 35 HD22 LEU 35 4.887 9.809 2.721 252 HD23 LEU 35 HD23 LEU 35 6.427 9.319 2.669 253 H GLU 36 H GLU 36 4.794 6.609 7.730 254 HA GLU 36 HA GLU 36 2.034 7.368 7.857 255 HB2 GLU 36 HB2 GLU 36 3.286 5.232 9.384 256 HB3 GLU 36 HB3 GLU 36 1.809 5.805 9.782 257 HG2 GLU 36 HG2 GLU 36 0.973 5.102 7.693 258 HG3 GLU 36 HG3 GLU 36 2.450 4.528 7.296 259 H ALA 37 H ALA 37 1.350 8.872 9.357 260 HA ALA 37 HA ALA 37 3.169 9.423 11.482 261 HB1 ALA 37 HB1 ALA 37 3.713 11.070 9.766 262 HB2 ALA 37 HB2 ALA 37 3.132 11.829 11.070 263 HB3 ALA 37 HB3 ALA 37 2.183 11.594 9.782 264 H LYS 38 H LYS 38 2.003 8.848 13.220 265 HA LYS 38 HA LYS 38 0.005 10.536 14.177 266 HB2 LYS 38 HB2 LYS 38 -1.001 8.642 12.550 267 HB3 LYS 38 HB3 LYS 38 -1.366 8.153 14.065 268 HG2 LYS 38 HG2 LYS 38 -2.470 10.303 14.392 269 HG3 LYS 38 HG3 LYS 38 -2.269 10.576 12.795 270 HD2 LYS 38 HD2 LYS 38 -3.399 8.330 12.538 271 HD3 LYS 38 HD3 LYS 38 -3.951 8.623 14.047 272 HE2 LYS 38 HE2 LYS 38 -4.430 10.536 11.980 273 HE3 LYS 38 HE3 LYS 38 -5.412 9.239 12.125 274 HZ1 LYS 38 HZ1 LYS 38 -6.331 11.087 13.234 275 HZ2 LYS 38 HZ2 LYS 38 -5.010 11.208 14.159 276 HZ3 LYS 38 HZ3 LYS 38 -5.982 9.924 14.303 277 H LYS 39 H LYS 39 -1.233 8.892 16.003 278 HA LYS 39 HA LYS 39 0.658 8.341 17.886 279 HB2 LYS 39 HB2 LYS 39 -1.998 7.170 17.650 280 HB3 LYS 39 HB3 LYS 39 -1.145 7.188 19.043 281 HG2 LYS 39 HG2 LYS 39 -1.363 9.529 19.164 282 HG3 LYS 39 HG3 LYS 39 -2.178 9.537 17.749 283 HD2 LYS 39 HD2 LYS 39 -3.883 8.193 18.754 284 HD3 LYS 39 HD3 LYS 39 -3.083 8.275 20.176 285 HE2 LYS 39 HE2 LYS 39 -3.414 10.624 20.233 286 HE3 LYS 39 HE3 LYS 39 -4.196 10.554 18.801 287 HZ1 LYS 39 HZ1 LYS 39 -5.769 10.649 20.587 288 HZ2 LYS 39 HZ2 LYS 39 -5.135 9.307 21.229 289 HZ3 LYS 39 HZ3 LYS 39 -5.909 9.237 19.811 290 H GLY 40 H GLY 40 1.547 6.412 18.786 291 HA2 GLY 40 HA2 GLY 40 0.914 3.884 17.928 292 HA3 GLY 40 HA3 GLY 40 2.170 4.378 17.008 293 H PHE 41 H PHE 41 1.854 2.358 19.280 294 HA PHE 41 HA PHE 41 4.019 3.362 20.895 295 HB2 PHE 41 HB2 PHE 41 2.021 1.403 21.604 296 HB3 PHE 41 HB3 PHE 41 3.305 1.726 22.560 297 HD1 PHE 41 HD1 PHE 41 3.514 3.950 23.664 298 HD2 PHE 41 HD2 PHE 41 0.080 2.821 21.600 299 HE1 PHE 41 HE1 PHE 41 2.303 5.759 24.706 300 HE2 PHE 41 HE2 PHE 41 -1.144 4.625 22.639 301 HZ PHE 41 HZ PHE 41 -0.032 6.099 24.191 302 HA PRO 42 HA PRO 42 6.121 3.091 21.592 303 HB2 PRO 42 HB2 PRO 42 8.614 2.810 20.755 304 HB3 PRO 42 HB3 PRO 42 8.030 1.718 21.820 305 HG2 PRO 42 HG2 PRO 42 8.190 1.471 18.981 306 HG3 PRO 42 HG3 PRO 42 8.666 0.386 20.105 307 HD2 PRO 42 HD2 PRO 42 6.348 0.133 18.944 308 HD3 PRO 42 HD3 PRO 42 6.533 -0.308 20.506 309 H HIS 43 H HIS 43 6.800 5.228 21.156 310 HA HIS 43 HA HIS 43 6.170 5.869 18.442 311 HB2 HIS 43 HB2 HIS 43 5.092 7.000 20.432 312 HB3 HIS 43 HB3 HIS 43 6.451 7.906 20.468 313 HD1 HIS 43 HD1 HIS 43 6.525 10.014 19.053 314 HD2 HIS 43 HD2 HIS 43 3.610 7.349 17.946 315 HE1 HIS 43 HE1 HIS 43 5.105 11.064 17.296 316 HE2 HIS 43 HE2 HIS 43 3.342 9.479 16.625 317 H SER 44 H SER 44 8.613 6.445 20.759 318 HA SER 44 HA SER 44 10.645 7.160 20.658 319 HB2 SER 44 HB2 SER 44 10.895 5.413 18.883 320 HB3 SER 44 HB3 SER 44 10.915 6.639 17.804 321 HG SER 44 HG SER 44 12.672 6.571 19.910 322 H GLY 45 H GLY 45 9.251 8.499 17.730 323 HA2 GLY 45 HA2 GLY 45 10.734 10.875 17.921 324 HA3 GLY 45 HA3 GLY 45 9.467 10.606 16.927 325 HA PRO 46 HA PRO 46 8.217 13.351 20.422 326 HB2 PRO 46 HB2 PRO 46 8.200 15.755 19.298 327 HB3 PRO 46 HB3 PRO 46 9.646 15.140 19.741 328 HG2 PRO 46 HG2 PRO 46 8.434 15.042 17.164 329 HG3 PRO 46 HG3 PRO 46 9.938 15.558 17.538 330 HD2 PRO 46 HD2 PRO 46 9.589 13.114 16.707 331 HD3 PRO 46 HD3 PRO 46 10.717 13.422 17.848 332 H ALA 47 H ALA 47 6.434 15.269 20.344 333 HA ALA 47 HA ALA 47 4.128 13.928 19.989 334 HB1 ALA 47 HB1 ALA 47 4.303 16.012 21.261 335 HB2 ALA 47 HB2 ALA 47 3.042 16.109 20.254 336 HB3 ALA 47 HB3 ALA 47 4.433 16.842 19.879 337 H ASP 48 H ASP 48 2.447 13.731 18.544 338 HA ASP 48 HA ASP 48 3.148 13.564 15.939 339 HB2 ASP 48 HB2 ASP 48 0.469 13.811 17.060 340 HB3 ASP 48 HB3 ASP 48 0.708 13.379 15.503 341 H GLY 49 H GLY 49 3.716 14.994 14.469 342 HA2 GLY 49 HA2 GLY 49 3.712 16.911 13.315 343 HA3 GLY 49 HA3 GLY 49 2.107 17.012 13.598 344 H GLN 50 H GLN 50 4.102 17.055 16.308 345 HA GLN 50 HA GLN 50 4.311 18.557 17.897 346 HB2 GLN 50 HB2 GLN 50 5.200 19.877 15.621 347 HB3 GLN 50 HB3 GLN 50 4.646 20.974 16.696 348 HG2 GLN 50 HG2 GLN 50 6.976 20.626 16.925 349 HG3 GLN 50 HG3 GLN 50 6.174 20.238 18.293 350 HE21 GLN 50 HE21 GLN 50 7.809 17.246 18.515 351 HE22 GLN 50 HE22 GLN 50 7.279 18.701 19.291 352 H ILE 51 H ILE 51 1.585 18.257 16.644 353 HA ILE 51 HA ILE 51 0.266 20.649 17.004 354 HB ILE 51 HB ILE 51 -0.896 17.947 17.019 355 HG12 ILE 51 HG12 ILE 51 -0.863 19.738 14.762 356 HG13 ILE 51 HG13 ILE 51 0.291 18.604 14.985 357 HG21 ILE 51 HG21 ILE 51 -3.042 18.954 16.507 358 HG22 ILE 51 HG22 ILE 51 -2.386 20.427 16.622 359 HG23 ILE 51 HG23 ILE 51 -2.515 19.494 17.936 360 HD11 ILE 51 HD11 ILE 51 -1.334 17.817 13.408 361 HD12 ILE 51 HD12 ILE 51 -2.508 18.002 14.503 362 HD13 ILE 51 HD13 ILE 51 -1.366 16.879 14.725 363 H ALA 52 H ALA 52 0.848 17.984 19.116 364 HA ALA 52 HA ALA 52 -0.898 18.743 21.086 365 HB1 ALA 52 HB1 ALA 52 0.084 16.512 21.001 366 HB2 ALA 52 HB2 ALA 52 0.270 17.124 22.486 367 HB3 ALA 52 HB3 ALA 52 1.511 17.125 21.450 368 H SER 53 H SER 53 2.253 19.927 20.469 369 HA SER 53 HA SER 53 2.313 21.235 23.009 370 HB2 SER 53 HB2 SER 53 4.559 21.911 22.436 371 HB3 SER 53 HB3 SER 53 4.395 20.304 22.199 372 HG SER 53 HG SER 53 5.454 21.394 20.504 373 H ALA 54 H ALA 54 1.454 21.826 19.867 374 HA ALA 54 HA ALA 54 0.838 23.535 18.718 375 HB1 ALA 54 HB1 ALA 54 -0.875 23.694 20.502 376 HB2 ALA 54 HB2 ALA 54 -0.664 25.141 19.812 377 HB3 ALA 54 HB3 ALA 54 0.023 24.818 21.240 378 H GLY 55 H GLY 55 3.510 24.021 20.330 379 HA2 GLY 55 HA2 GLY 55 3.899 26.693 19.289 380 HA3 GLY 55 HA3 GLY 55 4.671 26.111 20.606 381 H GLY 56 H GLY 56 4.998 23.479 19.227 382 HA2 GLY 56 HA2 GLY 56 7.511 24.074 18.096 383 HA3 GLY 56 HA3 GLY 56 6.845 22.591 18.245 384 H LEU 57 H LEU 57 4.643 24.458 16.756 385 HA LEU 57 HA LEU 57 4.840 23.139 14.351 386 HB2 LEU 57 HB2 LEU 57 3.397 25.575 14.967 387 HB3 LEU 57 HB3 LEU 57 3.149 24.723 13.595 388 HG LEU 57 HG LEU 57 2.575 23.681 16.216 389 HD11 LEU 57 HD11 LEU 57 0.244 24.082 15.723 390 HD12 LEU 57 HD12 LEU 57 0.661 24.792 14.331 391 HD13 LEU 57 HD13 LEU 57 1.053 25.482 15.740 392 HD21 LEU 57 HD21 LEU 57 1.370 21.961 15.062 393 HD22 LEU 57 HD22 LEU 57 2.925 21.948 14.621 394 HD23 LEU 57 HD23 LEU 57 1.813 22.599 13.644 395 H PHE 58 H PHE 58 6.400 25.951 15.405 396 HA PHE 58 HA PHE 58 7.050 27.028 12.968 397 HB2 PHE 58 HB2 PHE 58 8.546 27.160 15.455 398 HB3 PHE 58 HB3 PHE 58 8.900 28.109 14.174 399 HD1 PHE 58 HD1 PHE 58 7.362 28.178 17.179 400 HD2 PHE 58 HD2 PHE 58 6.730 29.453 13.271 401 HE1 PHE 58 HE1 PHE 58 5.828 29.854 17.986 402 HE2 PHE 58 HE2 PHE 58 5.193 31.138 14.062 403 HZ PHE 58 HZ PHE 58 4.739 31.342 16.424 404 H GLY 59 H GLY 59 8.068 24.132 14.261 405 HA2 GLY 59 HA2 GLY 59 10.612 23.907 13.221 406 HA3 GLY 59 HA3 GLY 59 9.617 22.660 13.570 407 H GLY 60 H GLY 60 7.686 23.982 11.530 408 HA2 GLY 60 HA2 GLY 60 8.344 22.402 9.359 409 HA3 GLY 60 HA3 GLY 60 7.271 23.633 9.340 410 H ILE 61 H ILE 61 9.443 25.510 10.206 411 HA ILE 61 HA ILE 61 10.289 26.326 7.703 412 HB ILE 61 HB ILE 61 11.400 27.094 10.296 413 HG12 ILE 61 HG12 ILE 61 9.115 27.662 10.150 414 HG13 ILE 61 HG13 ILE 61 10.029 29.014 10.207 415 HG21 ILE 61 HG21 ILE 61 12.354 29.043 9.226 416 HG22 ILE 61 HG22 ILE 61 11.839 28.509 7.789 417 HG23 ILE 61 HG23 ILE 61 12.983 27.695 8.591 418 HD11 ILE 61 HD11 ILE 61 8.247 29.300 8.622 419 HD12 ILE 61 HD12 ILE 61 8.760 28.012 7.789 420 HD13 ILE 61 HD13 ILE 61 9.665 29.351 7.846 421 H LEU 62 H LEU 62 11.785 24.455 10.202 422 HA LEU 62 HA LEU 62 14.248 24.267 8.905 423 HB2 LEU 62 HB2 LEU 62 13.172 22.909 11.202 424 HB3 LEU 62 HB3 LEU 62 14.626 22.457 10.613 425 HG LEU 62 HG LEU 62 15.398 24.704 11.094 426 HD11 LEU 62 HD11 LEU 62 14.233 26.024 12.712 427 HD12 LEU 62 HD12 LEU 62 12.985 24.997 12.656 428 HD13 LEU 62 HD13 LEU 62 13.360 25.885 11.358 429 HD21 LEU 62 HD21 LEU 62 15.728 24.177 13.465 430 HD22 LEU 62 HD22 LEU 62 15.940 22.849 12.568 431 HD23 LEU 62 HD23 LEU 62 14.553 23.069 13.369 432 H ASP 63 H ASP 63 11.408 22.333 8.982 433 HA ASP 63 HA ASP 63 12.396 19.986 7.960 434 HB2 ASP 63 HB2 ASP 63 10.172 20.043 8.729 435 HB3 ASP 63 HB3 ASP 63 9.767 21.159 7.608 436 H GLN 64 H GLN 64 11.084 22.725 6.238 437 HA GLN 64 HA GLN 64 11.638 21.568 3.767 438 HB2 GLN 64 HB2 GLN 64 10.822 23.593 2.808 439 HB3 GLN 64 HB3 GLN 64 9.835 23.125 4.022 440 HG2 GLN 64 HG2 GLN 64 10.831 24.736 5.439 441 HG3 GLN 64 HG3 GLN 64 11.789 25.217 4.207 442 HE21 GLN 64 HE21 GLN 64 8.274 26.867 4.644 443 HE22 GLN 64 HE22 GLN 64 9.141 25.983 5.856 444 H GLN 65 H GLN 65 13.751 22.652 5.832 445 HA GLN 65 HA GLN 65 15.583 23.611 3.806 446 HB2 GLN 65 HB2 GLN 65 14.857 25.176 5.637 447 HB3 GLN 65 HB3 GLN 65 15.876 24.314 6.578 448 HG2 GLN 65 HG2 GLN 65 17.707 24.990 5.299 449 HG3 GLN 65 HG3 GLN 65 16.727 25.728 4.221 450 HE21 GLN 65 HE21 GLN 65 17.772 28.624 5.910 451 HE22 GLN 65 HE22 GLN 65 18.126 27.599 4.559 452 H SER 66 H SER 66 14.888 20.927 4.856 453 HA SER 66 HA SER 66 17.435 20.144 5.954 454 HB2 SER 66 HB2 SER 66 15.403 19.606 7.265 455 HB3 SER 66 HB3 SER 66 14.965 18.588 6.065 456 HG SER 66 HG SER 66 15.936 17.203 7.256 457 H GLU 67 H GLU 67 18.032 17.750 5.451 458 HA GLU 67 HA GLU 67 18.045 17.322 2.643 459 HB2 GLU 67 HB2 GLU 67 19.494 16.425 4.747 460 HB3 GLU 67 HB3 GLU 67 18.813 15.096 4.087 461 HG2 GLU 67 HG2 GLU 67 19.862 15.480 2.072 462 HG3 GLU 67 HG3 GLU 67 20.393 16.941 2.574 463 H ASN 68 H ASN 68 16.105 16.599 5.264 464 HA ASN 68 HA ASN 68 14.722 14.439 3.988 465 HB2 ASN 68 HB2 ASN 68 14.440 15.539 6.654 466 HB3 ASN 68 HB3 ASN 68 13.486 14.330 6.110 467 HD21 ASN 68 HD21 ASN 68 17.056 13.544 7.606 468 HD22 ASN 68 HD22 ASN 68 16.358 15.129 7.579 469 H ARG 69 H ARG 69 14.735 17.393 3.364 470 HA ARG 69 HA ARG 69 12.209 18.492 3.675 471 HB2 ARG 69 HB2 ARG 69 13.876 19.865 2.955 472 HB3 ARG 69 HB3 ARG 69 14.337 18.821 1.787 473 HG2 ARG 69 HG2 ARG 69 12.203 19.493 0.679 474 HG3 ARG 69 HG3 ARG 69 12.289 20.791 1.667 475 HD2 ARG 69 HD2 ARG 69 14.050 20.106 -0.487 476 HD3 ARG 69 HD3 ARG 69 13.419 21.571 -0.137 477 HE ARG 69 HE ARG 69 15.483 20.435 1.540 478 HH11 ARG 69 HH11 ARG 69 14.422 23.135 -0.470 479 HH12 ARG 69 HH12 ARG 69 15.775 24.111 -0.003 480 HH21 ARG 69 HH21 ARG 69 17.170 21.723 2.060 481 HH22 ARG 69 HH22 ARG 69 17.308 23.321 1.408 482 H TRP 70 H TRP 70 10.309 18.500 2.441 483 HA TRP 70 HA TRP 70 9.899 16.009 1.154 484 HB2 TRP 70 HB2 TRP 70 8.113 18.225 1.631 485 HB3 TRP 70 HB3 TRP 70 7.618 16.844 0.912 486 HD1 TRP 70 HD1 TRP 70 8.973 17.920 4.243 487 HE1 TRP 70 HE1 TRP 70 8.228 16.429 6.104 488 HE3 TRP 70 HE3 TRP 70 6.530 14.596 1.419 489 HZ2 TRP 70 HZ2 TRP 70 6.674 14.074 6.250 490 HZ3 TRP 70 HZ3 TRP 70 5.406 12.748 2.497 491 HH2 TRP 70 HH2 TRP 70 5.475 12.508 4.904 492 H PHE 71 H PHE 71 9.470 15.584 -0.999 493 HA PHE 71 HA PHE 71 11.036 17.060 -2.658 494 HB2 PHE 71 HB2 PHE 71 10.323 15.601 -4.404 495 HB3 PHE 71 HB3 PHE 71 10.478 14.727 -3.033 496 HD1 PHE 71 HD1 PHE 71 8.439 13.941 -1.811 497 HD2 PHE 71 HD2 PHE 71 8.204 15.840 -5.508 498 HE1 PHE 71 HE1 PHE 71 6.173 13.143 -2.074 499 HE2 PHE 71 HE2 PHE 71 5.943 15.051 -5.780 500 HZ PHE 71 HZ PHE 71 4.925 13.696 -4.066 501 H LYS 72 H LYS 72 10.823 18.454 -4.372 502 HA LYS 72 HA LYS 72 8.242 19.719 -4.527 503 HB2 LYS 72 HB2 LYS 72 10.760 21.162 -4.602 504 HB3 LYS 72 HB3 LYS 72 9.284 21.861 -4.633 505 HG2 LYS 72 HG2 LYS 72 8.962 20.881 -2.382 506 HG3 LYS 72 HG3 LYS 72 10.576 20.632 -2.385 507 HD2 LYS 72 HD2 LYS 72 10.955 22.955 -2.589 508 HD3 LYS 72 HD3 LYS 72 9.345 23.225 -2.651 509 HE2 LYS 72 HE2 LYS 72 9.242 22.194 -0.390 510 HE3 LYS 72 HE3 LYS 72 10.866 22.359 -0.351 511 HZ1 LYS 72 HZ1 LYS 72 9.831 24.200 0.751 512 HZ2 LYS 72 HZ2 LYS 72 9.013 24.562 -0.596 513 HZ3 LYS 72 HZ3 LYS 72 10.621 24.726 -0.558 514 H HIS 73 H HIS 73 7.526 20.533 -6.534 515 HA HIS 73 HA HIS 73 9.323 20.000 -8.735 516 HB2 HIS 73 HB2 HIS 73 6.461 19.605 -8.828 517 HB3 HIS 73 HB3 HIS 73 7.453 19.410 -10.111 518 HD1 HIS 73 HD1 HIS 73 9.706 17.719 -8.750 519 HD2 HIS 73 HD2 HIS 73 5.680 17.010 -8.477 520 HE1 HIS 73 HE1 HIS 73 9.358 15.318 -8.178 521 HE2 HIS 73 HE2 HIS 73 6.938 14.876 -8.000 522 H ILE 74 H ILE 74 9.334 21.540 -10.500 523 HA ILE 74 HA ILE 74 7.972 24.010 -9.910 524 HB ILE 74 HB ILE 74 10.289 24.165 -10.607 525 HG12 ILE 74 HG12 ILE 74 8.608 25.530 -12.492 526 HG13 ILE 74 HG13 ILE 74 8.680 25.980 -10.924 527 HG21 ILE 74 HG21 ILE 74 10.893 23.774 -12.902 528 HG22 ILE 74 HG22 ILE 74 9.404 23.222 -13.209 529 HG23 ILE 74 HG23 ILE 74 10.385 22.398 -12.222 530 HD11 ILE 74 HD11 ILE 74 10.095 27.383 -12.241 531 HD12 ILE 74 HD12 ILE 74 10.925 26.093 -12.751 532 HD13 ILE 74 HD13 ILE 74 10.996 26.538 -11.198 533 H MET 75 H MET 75 6.290 24.851 -11.246 534 HA MET 75 HA MET 75 5.418 23.270 -13.444 535 HB2 MET 75 HB2 MET 75 4.442 22.478 -11.196 536 HB3 MET 75 HB3 MET 75 3.412 23.722 -11.439 537 HG2 MET 75 HG2 MET 75 2.392 22.750 -13.087 538 HG3 MET 75 HG3 MET 75 3.701 21.870 -13.511 539 HE1 MET 75 HE1 MET 75 1.292 20.831 -9.781 540 HE2 MET 75 HE2 MET 75 0.981 22.147 -10.668 541 HE3 MET 75 HE3 MET 75 2.378 22.026 -9.863 542 H THR 76 H THR 76 3.548 24.244 -14.625 543 HA THR 76 HA THR 76 3.450 27.113 -14.288 544 HB THR 76 HB THR 76 2.340 27.080 -16.481 545 HG1 THR 76 HG1 THR 76 1.519 25.177 -16.799 546 HG21 THR 76 HG21 THR 76 4.342 26.631 -17.724 547 HG22 THR 76 HG22 THR 76 4.974 25.849 -16.457 548 HG23 THR 76 HG23 THR 76 4.742 27.448 -16.387 549 H GLY 77 H GLY 77 1.058 27.993 -14.692 550 HA2 GLY 77 HA2 GLY 77 -0.609 26.797 -12.814 551 HA3 GLY 77 HA3 GLY 77 -1.012 28.023 -13.814 552 H GLY 78 H GLY 78 -3.162 26.871 -13.619 553 HA2 GLY 78 HA2 GLY 78 -4.564 25.965 -15.293 554 HA3 GLY 78 HA3 GLY 78 -3.348 25.010 -15.820 555 H GLU 79 H GLU 79 -5.318 23.437 -15.695 556 HA GLU 79 HA GLU 79 -5.897 22.582 -13.095 557 HB2 GLU 79 HB2 GLU 79 -7.393 22.216 -15.003 558 HB3 GLU 79 HB3 GLU 79 -6.417 20.981 -15.437 559 HG2 GLU 79 HG2 GLU 79 -6.862 20.066 -13.176 560 HG3 GLU 79 HG3 GLU 79 -8.095 21.135 -13.112 561 H HIS 80 H HIS 80 -4.967 20.997 -11.827 562 HA HIS 80 HA HIS 80 -2.968 19.334 -13.106 563 HB2 HIS 80 HB2 HIS 80 -2.630 20.536 -10.512 564 HB3 HIS 80 HB3 HIS 80 -1.536 19.584 -11.264 565 HD1 HIS 80 HD1 HIS 80 -1.922 22.944 -10.496 566 HD2 HIS 80 HD2 HIS 80 -0.937 20.979 -13.956 567 HE1 HIS 80 HE1 HIS 80 -0.803 24.547 -12.029 568 HE2 HIS 80 HE2 HIS 80 -0.227 23.395 -14.128 569 H THR 81 H THR 81 -2.640 17.242 -12.185 570 HA THR 81 HA THR 81 -5.007 16.404 -10.784 571 HB THR 81 HB THR 81 -3.543 14.828 -12.776 572 HG1 THR 81 HG1 THR 81 -4.659 15.898 -14.146 573 HG21 THR 81 HG21 THR 81 -5.329 13.245 -12.644 574 HG22 THR 81 HG22 THR 81 -6.058 14.135 -11.508 575 HG23 THR 81 HG23 THR 81 -4.659 13.393 -11.180 576 H PHE 82 H PHE 82 -4.865 15.229 -8.974 577 HA PHE 82 HA PHE 82 -2.218 14.377 -8.148 578 HB2 PHE 82 HB2 PHE 82 -4.510 14.963 -6.500 579 HB3 PHE 82 HB3 PHE 82 -3.058 14.484 -5.927 580 HD1 PHE 82 HD1 PHE 82 -1.250 16.040 -5.639 581 HD2 PHE 82 HD2 PHE 82 -4.792 17.241 -7.463 582 HE1 PHE 82 HE1 PHE 82 -0.512 18.335 -5.551 583 HE2 PHE 82 HE2 PHE 82 -4.066 19.536 -7.384 584 HZ PHE 82 HZ PHE 82 -1.913 20.086 -6.449 585 H THR 83 H THR 83 -1.903 12.259 -8.599 586 HA THR 83 HA THR 83 -4.195 10.536 -8.336 587 HB THR 83 HB THR 83 -2.028 10.120 -10.254 588 HG1 THR 83 HG1 THR 83 -3.845 10.448 -11.752 589 HG21 THR 83 HG21 THR 83 -3.372 8.334 -11.127 590 HG22 THR 83 HG22 THR 83 -4.502 8.610 -10.003 591 HG23 THR 83 HG23 THR 83 -3.057 8.025 -9.571 592 H TRP 84 H TRP 84 -4.011 9.394 -6.525 593 HA TRP 84 HA TRP 84 -1.410 8.264 -5.853 594 HB2 TRP 84 HB2 TRP 84 -3.366 9.114 -3.932 595 HB3 TRP 84 HB3 TRP 84 -1.876 8.533 -3.599 596 HD1 TRP 84 HD1 TRP 84 -0.379 10.424 -5.742 597 HE1 TRP 84 HE1 TRP 84 0.031 12.858 -5.335 598 HE3 TRP 84 HE3 TRP 84 -3.821 11.038 -2.167 599 HZ2 TRP 84 HZ2 TRP 84 -1.064 14.781 -3.598 600 HZ3 TRP 84 HZ3 TRP 84 -4.090 13.234 -1.175 601 HH2 TRP 84 HH2 TRP 84 -2.725 15.090 -1.913 602 H THR 85 H THR 85 -1.473 6.023 -5.299 603 HA THR 85 HA THR 85 -4.032 4.787 -5.405 604 HB THR 85 HB THR 85 -3.308 4.863 -7.764 605 HG1 THR 85 HG1 THR 85 -4.720 3.287 -7.358 606 HG21 THR 85 HG21 THR 85 -1.495 3.482 -8.471 607 HG22 THR 85 HG22 THR 85 -1.190 3.062 -6.939 608 HG23 THR 85 HG23 THR 85 -0.932 4.582 -7.428 609 H TYR 86 H TYR 86 -4.013 2.411 -4.936 610 HA TYR 86 HA TYR 86 -1.754 1.718 -3.240 611 HB2 TYR 86 HB2 TYR 86 -3.996 2.314 -2.190 612 HB3 TYR 86 HB3 TYR 86 -4.348 0.765 -2.572 613 HD1 TYR 86 HD1 TYR 86 -3.438 -1.085 -1.277 614 HD2 TYR 86 HD2 TYR 86 -2.234 2.820 -0.494 615 HE1 TYR 86 HE1 TYR 86 -2.413 -1.811 0.780 616 HE2 TYR 86 HE2 TYR 86 -1.224 2.088 1.580 617 HH TYR 86 HH TYR 86 -1.877 -0.458 3.185 618 H THR 87 H THR 87 -1.218 -0.594 -3.211 619 HA THR 87 HA THR 87 -1.668 -1.662 -5.727 620 HB THR 87 HB THR 87 0.452 -2.081 -4.520 621 HG1 THR 87 HG1 THR 87 -0.054 -4.615 -4.823 622 HG21 THR 87 HG21 THR 87 0.530 -3.718 -2.767 623 HG22 THR 87 HG22 THR 87 -1.072 -3.923 -2.862 624 HG23 THR 87 HG23 THR 87 -0.466 -2.525 -2.318 625 H ALA 88 H ALA 88 -3.401 -2.006 -2.945 626 HA ALA 88 HA ALA 88 -4.999 -4.125 -4.074 627 HB1 ALA 88 HB1 ALA 88 -3.585 -5.258 -2.488 628 HB2 ALA 88 HB2 ALA 88 -5.094 -5.247 -1.909 629 HB3 ALA 88 HB3 ALA 88 -3.999 -4.205 -1.333 630 HA PRO 89 HA PRO 89 -8.042 -1.384 -2.469 631 HB2 PRO 89 HB2 PRO 89 -10.088 -2.888 -1.705 632 HB3 PRO 89 HB3 PRO 89 -9.826 -2.649 -3.299 633 HG2 PRO 89 HG2 PRO 89 -9.027 -4.894 -1.718 634 HG3 PRO 89 HG3 PRO 89 -9.762 -4.912 -3.176 635 HD2 PRO 89 HD2 PRO 89 -7.189 -5.232 -3.032 636 HD3 PRO 89 HD3 PRO 89 -7.827 -4.401 -4.284 637 H HIS 90 H HIS 90 -8.288 -0.299 -0.594 638 HA HIS 90 HA HIS 90 -7.651 -1.773 1.824 639 HB2 HIS 90 HB2 HIS 90 -5.815 -0.300 0.875 640 HB3 HIS 90 HB3 HIS 90 -6.692 0.914 1.525 641 HD1 HIS 90 HD1 HIS 90 -7.074 0.827 4.237 642 HD2 HIS 90 HD2 HIS 90 -4.116 -1.512 2.623 643 HE1 HIS 90 HE1 HIS 90 -5.581 0.054 6.070 644 HE2 HIS 90 HE2 HIS 90 -3.786 -1.343 5.122 645 H ASN 91 H ASN 91 -8.837 -1.121 3.718 646 HA ASN 91 HA ASN 91 -11.181 0.291 3.222 647 HB2 ASN 91 HB2 ASN 91 -9.965 -0.338 5.755 648 HB3 ASN 91 HB3 ASN 91 -11.445 0.341 5.631 649 HD21 ASN 91 HD21 ASN 91 -11.454 -3.426 5.904 650 HD22 ASN 91 HD22 ASN 91 -10.475 -2.245 6.708 651 H THR 92 H THR 92 -11.773 2.452 3.742 652 HA THR 92 HA THR 92 -9.636 4.197 4.515 653 HB THR 92 HB THR 92 -10.311 5.823 2.770 654 HG1 THR 92 HG1 THR 92 -11.521 4.629 1.014 655 HG21 THR 92 HG21 THR 92 -9.331 4.709 0.884 656 HG22 THR 92 HG22 THR 92 -9.516 3.278 1.613 657 HG23 THR 92 HG23 THR 92 -8.463 4.354 2.201 658 H SER 93 H SER 93 -10.394 6.072 5.734 659 HA SER 93 HA SER 93 -13.242 6.010 6.238 660 HB2 SER 93 HB2 SER 93 -12.432 7.408 8.269 661 HB3 SER 93 HB3 SER 93 -12.335 5.779 8.328 662 HG SER 93 HG SER 93 -10.396 6.691 8.918 663 H GLN 94 H GLN 94 -10.564 8.245 5.889 664 HA GLN 94 HA GLN 94 -12.164 10.032 4.393 665 HB2 GLN 94 HB2 GLN 94 -12.702 10.654 6.694 666 HB3 GLN 94 HB3 GLN 94 -11.115 10.923 6.966 667 HG2 GLN 94 HG2 GLN 94 -11.187 12.768 5.451 668 HG3 GLN 94 HG3 GLN 94 -12.786 12.513 5.236 669 HE21 GLN 94 HE21 GLN 94 -13.537 13.547 8.647 670 HE22 GLN 94 HE22 GLN 94 -13.799 12.132 7.683 671 H TRP 95 H TRP 95 -10.911 11.422 3.030 672 HA TRP 95 HA TRP 95 -8.190 11.778 3.945 673 HB2 TRP 95 HB2 TRP 95 -7.348 11.687 1.734 674 HB3 TRP 95 HB3 TRP 95 -7.923 10.248 2.249 675 HD1 TRP 95 HD1 TRP 95 -8.649 12.879 -0.217 676 HE1 TRP 95 HE1 TRP 95 -10.240 12.126 -1.994 677 HE3 TRP 95 HE3 TRP 95 -9.873 8.506 1.868 678 HZ2 TRP 95 HZ2 TRP 95 -11.882 9.864 -2.345 679 HZ3 TRP 95 HZ3 TRP 95 -11.496 7.090 0.751 680 HH2 TRP 95 HH2 TRP 95 -12.488 7.781 -1.340 681 H HIS 96 H HIS 96 -7.356 13.881 3.635 682 HA HIS 96 HA HIS 96 -9.082 15.786 2.393 683 HB2 HIS 96 HB2 HIS 96 -9.077 17.198 4.415 684 HB3 HIS 96 HB3 HIS 96 -10.041 15.883 4.498 685 HD1 HIS 96 HD1 HIS 96 -10.072 15.160 6.897 686 HD2 HIS 96 HD2 HIS 96 -6.328 16.040 5.491 687 HE1 HIS 96 HE1 HIS 96 -8.419 14.638 8.680 688 HE2 HIS 96 HE2 HIS 96 -6.154 15.172 7.859 689 H TYR 97 H TYR 97 -8.130 17.944 2.153 690 HA TYR 97 HA TYR 97 -5.308 17.884 2.482 691 HB2 TYR 97 HB2 TYR 97 -5.528 19.076 0.086 692 HB3 TYR 97 HB3 TYR 97 -4.976 17.557 0.324 693 HD1 TYR 97 HD1 TYR 97 -8.017 19.395 -0.435 694 HD2 TYR 97 HD2 TYR 97 -6.155 15.675 -0.566 695 HE1 TYR 97 HE1 TYR 97 -9.816 18.540 -1.798 696 HE2 TYR 97 HE2 TYR 97 -7.961 14.825 -1.934 697 HH TYR 97 HH TYR 97 -9.723 16.047 -3.673 698 H TYR 98 H TYR 98 -4.167 19.823 2.504 699 HA TYR 98 HA TYR 98 -5.800 22.151 2.985 700 HB2 TYR 98 HB2 TYR 98 -3.451 21.470 4.544 701 HB3 TYR 98 HB3 TYR 98 -4.460 22.719 4.848 702 HD1 TYR 98 HD1 TYR 98 -4.112 19.148 5.120 703 HD2 TYR 98 HD2 TYR 98 -6.485 22.409 6.137 704 HE1 TYR 98 HE1 TYR 98 -5.356 17.766 6.652 705 HE2 TYR 98 HE2 TYR 98 -7.726 21.022 7.679 706 HH TYR 98 HH TYR 98 -7.528 18.971 8.956 707 H ILE 99 H ILE 99 -4.495 24.220 2.763 708 HA ILE 99 HA ILE 99 -2.083 23.795 1.276 709 HB ILE 99 HB ILE 99 -2.577 25.806 -0.076 710 HG12 ILE 99 HG12 ILE 99 -5.235 25.673 1.009 711 HG13 ILE 99 HG13 ILE 99 -4.127 26.765 1.506 712 HG21 ILE 99 HG21 ILE 99 -4.150 24.724 -1.547 713 HG22 ILE 99 HG22 ILE 99 -4.521 23.665 -0.382 714 HG23 ILE 99 HG23 ILE 99 -3.046 23.655 -1.045 715 HD11 ILE 99 HD11 ILE 99 -5.627 27.779 -0.059 716 HD12 ILE 99 HD12 ILE 99 -5.231 26.677 -1.174 717 HD13 ILE 99 HD13 ILE 99 -4.135 27.758 -0.681 718 H THR 100 H THR 100 -0.457 25.521 1.472 719 HA THR 100 HA THR 100 -0.845 27.092 3.859 720 HB THR 100 HB THR 100 1.708 26.406 2.633 721 HG1 THR 100 HG1 THR 100 1.095 25.484 5.094 722 HG21 THR 100 HG21 THR 100 2.723 27.349 4.578 723 HG22 THR 100 HG22 THR 100 1.271 27.757 5.161 724 HG23 THR 100 HG23 THR 100 1.848 28.492 3.842 725 H LYS 101 H LYS 101 -1.443 29.203 3.382 726 HA LYS 101 HA LYS 101 -0.626 30.257 0.846 727 HB2 LYS 101 HB2 LYS 101 -1.954 32.227 1.685 728 HB3 LYS 101 HB3 LYS 101 -2.744 30.895 1.165 729 HG2 LYS 101 HG2 LYS 101 -3.045 30.204 3.443 730 HG3 LYS 101 HG3 LYS 101 -2.297 31.567 3.943 731 HD2 LYS 101 HD2 LYS 101 -4.563 31.953 4.164 732 HD3 LYS 101 HD3 LYS 101 -4.075 32.832 2.876 733 HE2 LYS 101 HE2 LYS 101 -5.019 31.313 1.384 734 HE3 LYS 101 HE3 LYS 101 -5.279 30.223 2.572 735 HZ1 LYS 101 HZ1 LYS 101 -7.309 31.303 1.995 736 HZ2 LYS 101 HZ2 LYS 101 -6.657 32.741 2.346 737 HZ3 LYS 101 HZ3 LYS 101 -6.915 31.661 3.522 738 H LYS 102 H LYS 102 1.418 31.042 0.669 739 HA LYS 102 HA LYS 102 2.725 32.138 2.921 740 HB2 LYS 102 HB2 LYS 102 4.549 32.538 1.523 741 HB3 LYS 102 HB3 LYS 102 3.967 31.045 1.209 742 HG2 LYS 102 HG2 LYS 102 2.946 31.867 -0.783 743 HG3 LYS 102 HG3 LYS 102 3.539 33.356 -0.471 744 HD2 LYS 102 HD2 LYS 102 5.773 32.363 -0.539 745 HD3 LYS 102 HD3 LYS 102 5.074 31.005 -1.116 746 HE2 LYS 102 HE2 LYS 102 4.934 33.548 -2.475 747 HE3 LYS 102 HE3 LYS 102 6.011 32.384 -2.866 748 HZ1 LYS 102 HZ1 LYS 102 4.177 32.332 -4.351 749 HZ2 LYS 102 HZ2 LYS 102 3.162 32.111 -3.112 750 HZ3 LYS 102 HZ3 LYS 102 4.228 30.959 -3.499 751 H GLY 103 H GLY 103 3.381 34.398 3.253 752 HA2 GLY 103 HA2 GLY 103 3.283 36.600 2.405 753 HA3 GLY 103 HA3 GLY 103 1.942 36.227 1.551 754 H TRP 104 H TRP 104 1.681 35.070 4.653 755 HA TRP 104 HA TRP 104 -0.365 36.750 5.348 756 HB2 TRP 104 HB2 TRP 104 -0.043 35.869 7.618 757 HB3 TRP 104 HB3 TRP 104 -0.118 34.695 6.485 758 HD1 TRP 104 HD1 TRP 104 2.417 36.377 8.651 759 HE1 TRP 104 HE1 TRP 104 4.526 35.048 8.901 760 HE3 TRP 104 HE3 TRP 104 1.217 32.726 5.464 761 HZ2 TRP 104 HZ2 TRP 104 5.529 32.696 7.704 762 HZ3 TRP 104 HZ3 TRP 104 2.805 30.935 5.079 763 HH2 TRP 104 HH2 TRP 104 4.944 30.937 6.194 764 H ASP 105 H ASP 105 -0.562 38.483 6.914 765 HA ASP 105 HA ASP 105 1.521 40.327 6.907 766 HB2 ASP 105 HB2 ASP 105 -0.724 40.239 8.731 767 HB3 ASP 105 HB3 ASP 105 0.186 41.563 8.437 768 HA PRO 106 HA PRO 106 3.812 38.619 10.162 769 HB2 PRO 106 HB2 PRO 106 5.265 40.654 11.135 770 HB3 PRO 106 HB3 PRO 106 5.600 40.094 9.638 771 HG2 PRO 106 HG2 PRO 106 3.943 42.323 10.330 772 HG3 PRO 106 HG3 PRO 106 5.151 42.285 9.231 773 HD2 PRO 106 HD2 PRO 106 2.708 42.012 8.425 774 HD3 PRO 106 HD3 PRO 106 3.882 41.129 7.710 775 H ASP 107 H ASP 107 1.726 41.118 10.931 776 HA ASP 107 HA ASP 107 1.798 40.829 13.696 777 HB2 ASP 107 HB2 ASP 107 0.797 42.750 12.682 778 HB3 ASP 107 HB3 ASP 107 -0.312 41.807 11.941 779 H LYS 108 H LYS 108 0.419 38.951 11.266 780 HA LYS 108 HA LYS 108 -1.589 37.839 13.009 781 HB2 LYS 108 HB2 LYS 108 -1.213 37.516 10.168 782 HB3 LYS 108 HB3 LYS 108 -2.430 36.814 11.001 783 HG2 LYS 108 HG2 LYS 108 -3.345 38.917 11.517 784 HG3 LYS 108 HG3 LYS 108 -2.078 39.671 10.814 785 HD2 LYS 108 HD2 LYS 108 -2.759 38.743 8.711 786 HD3 LYS 108 HD3 LYS 108 -4.085 38.138 9.449 787 HE2 LYS 108 HE2 LYS 108 -4.906 40.268 9.897 788 HE3 LYS 108 HE3 LYS 108 -3.490 40.964 9.473 789 HZ1 LYS 108 HZ1 LYS 108 -5.096 41.270 7.759 790 HZ2 LYS 108 HZ2 LYS 108 -5.281 39.669 7.630 791 HZ3 LYS 108 HZ3 LYS 108 -3.879 40.357 7.211 792 HA PRO 109 HA PRO 109 1.085 34.683 13.903 793 HB2 PRO 109 HB2 PRO 109 -0.530 32.723 14.831 794 HB3 PRO 109 HB3 PRO 109 -0.233 34.040 15.750 795 HG2 PRO 109 HG2 PRO 109 -2.470 33.584 14.030 796 HG3 PRO 109 HG3 PRO 109 -2.491 34.120 15.572 797 HD2 PRO 109 HD2 PRO 109 -2.696 35.822 13.670 798 HD3 PRO 109 HD3 PRO 109 -1.788 36.206 14.973 799 H LEU 110 H LEU 110 2.332 33.577 12.826 800 HA LEU 110 HA LEU 110 1.783 32.619 10.341 801 HB2 LEU 110 HB2 LEU 110 3.975 32.986 11.202 802 HB3 LEU 110 HB3 LEU 110 3.769 31.776 12.280 803 HG LEU 110 HG LEU 110 3.971 31.149 9.517 804 HD11 LEU 110 HD11 LEU 110 6.410 30.999 9.837 805 HD12 LEU 110 HD12 LEU 110 6.236 31.565 11.342 806 HD13 LEU 110 HD13 LEU 110 5.926 32.524 10.077 807 HD21 LEU 110 HD21 LEU 110 4.873 29.077 10.279 808 HD22 LEU 110 HD22 LEU 110 3.409 29.321 10.922 809 HD23 LEU 110 HD23 LEU 110 4.736 29.573 11.812 810 H LYS 111 H LYS 111 1.513 30.955 13.332 811 HA LYS 111 HA LYS 111 1.212 28.448 12.229 812 HB2 LYS 111 HB2 LYS 111 0.315 29.381 14.833 813 HB3 LYS 111 HB3 LYS 111 0.470 27.801 14.453 814 HG2 LYS 111 HG2 LYS 111 2.843 28.142 14.175 815 HG3 LYS 111 HG3 LYS 111 2.652 29.686 14.673 816 HD2 LYS 111 HD2 LYS 111 2.046 27.419 16.342 817 HD3 LYS 111 HD3 LYS 111 3.471 28.214 16.405 818 HE2 LYS 111 HE2 LYS 111 2.282 30.208 17.052 819 HE3 LYS 111 HE3 LYS 111 0.902 29.335 17.095 820 HZ1 LYS 111 HZ1 LYS 111 1.806 29.540 19.281 821 HZ2 LYS 111 HZ2 LYS 111 3.183 28.851 18.788 822 HZ3 LYS 111 HZ3 LYS 111 1.816 27.987 18.829 823 H ARG 112 H ARG 112 -1.061 30.921 12.351 824 HA ARG 112 HA ARG 112 -3.261 29.181 12.038 825 HB2 ARG 112 HB2 ARG 112 -2.992 31.941 12.317 826 HB3 ARG 112 HB3 ARG 112 -4.100 31.588 11.170 827 HG2 ARG 112 HG2 ARG 112 -5.286 31.833 13.115 828 HG3 ARG 112 HG3 ARG 112 -5.233 30.224 12.840 829 HD2 ARG 112 HD2 ARG 112 -3.510 29.981 14.448 830 HD3 ARG 112 HD3 ARG 112 -3.483 31.597 14.687 831 HE ARG 112 HE ARG 112 -5.372 29.749 15.751 832 HH11 ARG 112 HH11 ARG 112 -4.699 33.174 15.227 833 HH12 ARG 112 HH12 ARG 112 -5.829 33.665 16.445 834 HH21 ARG 112 HH21 ARG 112 -6.784 30.467 17.291 835 HH22 ARG 112 HH22 ARG 112 -6.985 32.161 17.589 836 H ALA 113 H ALA 113 -1.277 31.114 9.980 837 HA ALA 113 HA ALA 113 -2.824 30.690 7.684 838 HB1 ALA 113 HB1 ALA 113 -1.465 32.706 7.948 839 HB2 ALA 113 HB2 ALA 113 -1.061 31.969 6.566 840 HB3 ALA 113 HB3 ALA 113 -0.122 31.808 7.873 841 H ASP 114 H ASP 114 -0.582 28.820 9.195 842 HA ASP 114 HA ASP 114 0.692 27.704 7.020 843 HB2 ASP 114 HB2 ASP 114 0.711 27.347 9.766 844 HB3 ASP 114 HB3 ASP 114 0.614 25.862 9.092 845 H PHE 115 H PHE 115 -2.265 26.920 8.576 846 HA PHE 115 HA PHE 115 -2.650 24.824 6.653 847 HB2 PHE 115 HB2 PHE 115 -3.742 24.731 9.351 848 HB3 PHE 115 HB3 PHE 115 -3.745 23.488 8.291 849 HD1 PHE 115 HD1 PHE 115 -2.081 24.857 10.995 850 HD2 PHE 115 HD2 PHE 115 -1.413 22.552 7.596 851 HE1 PHE 115 HE1 PHE 115 0.002 24.086 11.939 852 HE2 PHE 115 HE2 PHE 115 0.674 21.773 8.528 853 HZ PHE 115 HZ PHE 115 1.386 22.545 10.701 854 H GLU 116 H GLU 116 -4.081 25.418 5.150 855 HA GLU 116 HA GLU 116 -6.602 26.481 6.127 856 HB2 GLU 116 HB2 GLU 116 -5.064 27.387 3.884 857 HB3 GLU 116 HB3 GLU 116 -6.681 27.612 3.891 858 HG2 GLU 116 HG2 GLU 116 -5.307 28.537 6.173 859 HG3 GLU 116 HG3 GLU 116 -5.055 29.384 4.800 860 H LEU 117 H LEU 117 -8.297 25.120 5.717 861 HA LEU 117 HA LEU 117 -7.811 22.820 4.230 862 HB2 LEU 117 HB2 LEU 117 -9.391 22.889 6.039 863 HB3 LEU 117 HB3 LEU 117 -10.365 23.844 5.140 864 HG LEU 117 HG LEU 117 -10.602 21.938 3.617 865 HD11 LEU 117 HD11 LEU 117 -10.159 19.758 4.510 866 HD12 LEU 117 HD12 LEU 117 -9.486 20.427 5.819 867 HD13 LEU 117 HD13 LEU 117 -8.782 20.594 4.373 868 HD21 LEU 117 HD21 LEU 117 -12.317 20.925 4.980 869 HD22 LEU 117 HD22 LEU 117 -12.378 22.535 5.118 870 HD23 LEU 117 HD23 LEU 117 -11.702 21.648 6.289 871 H ILE 118 H ILE 118 -7.891 22.409 2.079 872 HA ILE 118 HA ILE 118 -9.386 24.297 0.475 873 HB ILE 118 HB ILE 118 -6.959 23.992 -0.016 874 HG12 ILE 118 HG12 ILE 118 -8.834 24.815 -1.570 875 HG13 ILE 118 HG13 ILE 118 -7.252 24.838 -1.974 876 HG21 ILE 118 HG21 ILE 118 -6.287 22.128 -1.320 877 HG22 ILE 118 HG22 ILE 118 -7.748 21.459 -1.133 878 HG23 ILE 118 HG23 ILE 118 -6.778 21.653 0.146 879 HD11 ILE 118 HD11 ILE 118 -8.551 23.980 -3.810 880 HD12 ILE 118 HD12 ILE 118 -9.129 22.798 -2.870 881 HD13 ILE 118 HD13 ILE 118 -7.562 22.820 -3.270 882 H GLY 119 H GLY 119 -9.427 21.156 1.629 883 HA2 GLY 119 HA2 GLY 119 -11.986 20.730 0.818 884 HA3 GLY 119 HA3 GLY 119 -11.057 20.029 -0.327 885 H ALA 120 H ALA 120 -12.958 18.740 1.343 886 HA ALA 120 HA ALA 120 -11.216 16.787 2.552 887 HB1 ALA 120 HB1 ALA 120 -12.008 18.097 4.404 888 HB2 ALA 120 HB2 ALA 120 -12.679 16.628 4.486 889 HB3 ALA 120 HB3 ALA 120 -13.539 17.879 3.929 890 H VAL 121 H VAL 121 -11.838 14.665 2.158 891 HA VAL 121 HA VAL 121 -14.377 14.336 0.857 892 HB VAL 121 HB VAL 121 -11.939 13.072 -0.129 893 HG11 VAL 121 HG11 VAL 121 -13.245 12.325 -2.004 894 HG12 VAL 121 HG12 VAL 121 -14.567 12.983 -1.346 895 HG13 VAL 121 HG13 VAL 121 -13.847 11.726 -0.627 896 HG21 VAL 121 HG21 VAL 121 -12.088 14.540 -2.064 897 HG22 VAL 121 HG22 VAL 121 -11.913 15.423 -0.720 898 HG23 VAL 121 HG23 VAL 121 -13.369 15.277 -1.408 899 HA PRO 122 HA PRO 122 -13.996 11.119 3.960 900 HB2 PRO 122 HB2 PRO 122 -16.431 11.153 4.972 901 HB3 PRO 122 HB3 PRO 122 -15.377 12.303 5.456 902 HG2 PRO 122 HG2 PRO 122 -17.408 12.507 3.481 903 HG3 PRO 122 HG3 PRO 122 -17.058 13.563 4.677 904 HD2 PRO 122 HD2 PRO 122 -16.177 13.952 2.228 905 HD3 PRO 122 HD3 PRO 122 -15.323 14.475 3.518 906 H HIS 123 H HIS 123 -14.719 8.953 4.064 907 HA HIS 123 HA HIS 123 -16.064 8.233 1.596 908 HB2 HIS 123 HB2 HIS 123 -13.885 7.385 1.593 909 HB3 HIS 123 HB3 HIS 123 -14.064 6.791 3.104 910 HD1 HIS 123 HD1 HIS 123 -15.768 6.212 -0.222 911 HD2 HIS 123 HD2 HIS 123 -14.430 4.138 3.048 912 HE1 HIS 123 HE1 HIS 123 -16.214 3.787 -0.583 913 HE2 HIS 123 HE2 HIS 123 -15.416 2.522 1.381 914 H ASP 124 H ASP 124 -18.120 8.210 2.120 915 HA ASP 124 HA ASP 124 -18.983 6.447 4.270 916 HB2 ASP 124 HB2 ASP 124 -20.693 8.572 3.448 917 HB3 ASP 124 HB3 ASP 124 -20.516 7.942 4.944 918 H GLY 125 H GLY 125 -18.500 6.698 1.212 919 HA2 GLY 125 HA2 GLY 125 -20.197 4.832 0.169 920 HA3 GLY 125 HA3 GLY 125 -20.927 6.269 -0.091 921 H SER 126 H SER 126 -20.180 5.353 -2.481 922 HA SER 126 HA SER 126 -17.806 6.813 -2.938 923 HB2 SER 126 HB2 SER 126 -17.213 4.385 -2.701 924 HB3 SER 126 HB3 SER 126 -18.001 4.132 -4.109 925 HG SER 126 HG SER 126 -15.577 5.176 -3.676 926 HA PRO 127 HA PRO 127 -20.270 7.675 -6.594 927 HB2 PRO 127 HB2 PRO 127 -20.607 10.266 -6.323 928 HB3 PRO 127 HB3 PRO 127 -21.652 9.279 -5.548 929 HG2 PRO 127 HG2 PRO 127 -19.330 10.548 -4.472 930 HG3 PRO 127 HG3 PRO 127 -20.836 10.529 -3.842 931 HD2 PRO 127 HD2 PRO 127 -19.041 8.841 -2.985 932 HD3 PRO 127 HD3 PRO 127 -20.609 8.393 -3.066 933 H ALA 128 H ALA 128 -19.495 9.272 -8.382 934 HA ALA 128 HA ALA 128 -16.827 8.871 -8.729 935 HB1 ALA 128 HB1 ALA 128 -18.328 9.451 -10.559 936 HB2 ALA 128 HB2 ALA 128 -17.017 10.395 -10.620 937 HB3 ALA 128 HB3 ALA 128 -18.402 10.972 -10.016 938 H SER 129 H SER 129 -18.314 11.457 -7.074 939 HA SER 129 HA SER 129 -16.223 13.226 -6.937 940 HB2 SER 129 HB2 SER 129 -18.416 13.821 -6.137 941 HB3 SER 129 HB3 SER 129 -18.315 12.698 -4.955 942 HG SER 129 HG SER 129 -17.128 15.140 -5.108 943 H ARG 130 H ARG 130 -16.581 10.257 -5.394 944 HA ARG 130 HA ARG 130 -14.560 10.804 -3.462 945 HB2 ARG 130 HB2 ARG 130 -16.707 8.971 -3.593 946 HB3 ARG 130 HB3 ARG 130 -15.356 8.304 -2.961 947 HG2 ARG 130 HG2 ARG 130 -16.706 9.065 -1.219 948 HG3 ARG 130 HG3 ARG 130 -15.349 9.973 -1.266 949 HD2 ARG 130 HD2 ARG 130 -16.516 11.769 -2.236 950 HD3 ARG 130 HD3 ARG 130 -17.858 10.855 -2.413 951 HE ARG 130 HE ARG 130 -17.233 10.885 0.269 952 HH11 ARG 130 HH11 ARG 130 -18.411 13.174 -2.140 953 HH12 ARG 130 HH12 ARG 130 -19.250 14.113 -0.951 954 HH21 ARG 130 HH21 ARG 130 -18.353 12.101 1.706 955 HH22 ARG 130 HH22 ARG 130 -19.217 13.512 1.194 956 H ASN 131 H ASN 131 -14.364 9.939 -6.500 957 HA ASN 131 HA ASN 131 -12.720 7.737 -6.552 958 HB2 ASN 131 HB2 ASN 131 -12.680 10.046 -8.276 959 HB3 ASN 131 HB3 ASN 131 -11.726 8.750 -8.556 960 HD21 ASN 131 HD21 ASN 131 -14.657 8.404 -10.684 961 HD22 ASN 131 HD22 ASN 131 -13.375 9.556 -10.510 962 H LEU 132 H LEU 132 -10.401 7.459 -6.164 963 HA LEU 132 HA LEU 132 -9.423 9.167 -4.229 964 HB2 LEU 132 HB2 LEU 132 -8.743 6.775 -5.024 965 HB3 LEU 132 HB3 LEU 132 -7.489 7.630 -5.627 966 HG LEU 132 HG LEU 132 -6.888 6.609 -3.631 967 HD11 LEU 132 HD11 LEU 132 -6.000 8.482 -2.416 968 HD12 LEU 132 HD12 LEU 132 -6.958 9.475 -3.260 969 HD13 LEU 132 HD13 LEU 132 -5.774 8.665 -4.007 970 HD21 LEU 132 HD21 LEU 132 -7.915 7.213 -1.519 971 HD22 LEU 132 HD22 LEU 132 -8.992 6.505 -2.494 972 HD23 LEU 132 HD23 LEU 132 -9.000 8.111 -2.314 973 H SER 133 H SER 133 -8.898 9.149 -7.632 974 HA SER 133 HA SER 133 -6.812 11.070 -7.466 975 HB2 SER 133 HB2 SER 133 -6.662 9.469 -9.236 976 HB3 SER 133 HB3 SER 133 -8.102 9.960 -9.831 977 HG SER 133 HG SER 133 -6.457 10.842 -11.022 978 H HIS 134 H HIS 134 -7.043 13.224 -7.460 979 HA HIS 134 HA HIS 134 -9.606 14.247 -8.289 980 HB2 HIS 134 HB2 HIS 134 -8.091 14.936 -5.947 981 HB3 HIS 134 HB3 HIS 134 -9.134 16.033 -6.560 982 HD1 HIS 134 HD1 HIS 134 -9.055 12.746 -4.820 983 HD2 HIS 134 HD2 HIS 134 -11.817 15.504 -6.074 984 HE1 HIS 134 HE1 HIS 134 -11.275 12.136 -3.875 985 HE2 HIS 134 HE2 HIS 134 -12.959 13.766 -4.643 986 H HIS 135 H HIS 135 -9.787 16.253 -9.247 987 HA HIS 135 HA HIS 135 -7.325 17.168 -10.475 988 HB2 HIS 135 HB2 HIS 135 -10.033 17.309 -11.463 989 HB3 HIS 135 HB3 HIS 135 -8.811 18.131 -12.170 990 HD1 HIS 135 HD1 HIS 135 -8.333 17.074 -14.376 991 HD2 HIS 135 HD2 HIS 135 -8.933 14.357 -11.368 992 HE1 HIS 135 HE1 HIS 135 -7.955 14.793 -15.287 993 HE2 HIS 135 HE2 HIS 135 -8.311 13.137 -13.494 994 H ILE 136 H ILE 136 -6.681 19.281 -9.998 995 HA ILE 136 HA ILE 136 -8.668 20.968 -8.783 996 HB ILE 136 HB ILE 136 -5.918 20.810 -7.805 997 HG12 ILE 136 HG12 ILE 136 -7.197 18.913 -7.118 998 HG13 ILE 136 HG13 ILE 136 -6.631 19.789 -5.861 999 HG21 ILE 136 HG21 ILE 136 -6.585 22.351 -6.053 1000 HG22 ILE 136 HG22 ILE 136 -8.058 22.459 -6.710 1001 HG23 ILE 136 HG23 ILE 136 -6.774 23.040 -7.503 1002 HD11 ILE 136 HD11 ILE 136 -8.889 19.080 -5.411 1003 HD12 ILE 136 HD12 ILE 136 -9.406 19.827 -6.749 1004 HD13 ILE 136 HD13 ILE 136 -8.846 20.694 -5.505 1005 H TYR 137 H TYR 137 -8.822 22.969 -9.849 1006 HA TYR 137 HA TYR 137 -6.828 23.620 -11.734 1007 HB2 TYR 137 HB2 TYR 137 -9.084 24.255 -12.146 1008 HB3 TYR 137 HB3 TYR 137 -9.021 25.285 -10.881 1009 HD1 TYR 137 HD1 TYR 137 -7.835 27.436 -11.059 1010 HD2 TYR 137 HD2 TYR 137 -7.937 24.788 -14.270 1011 HE1 TYR 137 HE1 TYR 137 -6.938 29.148 -12.502 1012 HE2 TYR 137 HE2 TYR 137 -7.051 26.513 -15.713 1013 HH TYR 137 HH TYR 137 -6.269 28.601 -15.909 1014 H ILE 138 H ILE 138 -5.026 24.939 -11.444 1015 HA ILE 138 HA ILE 138 -4.927 26.347 -8.932 1016 HB ILE 138 HB ILE 138 -2.626 25.271 -10.339 1017 HG12 ILE 138 HG12 ILE 138 -3.892 23.549 -9.283 1018 HG13 ILE 138 HG13 ILE 138 -2.392 23.674 -8.649 1019 HG21 ILE 138 HG21 ILE 138 -1.310 25.973 -8.430 1020 HG22 ILE 138 HG22 ILE 138 -2.626 26.640 -7.769 1021 HG23 ILE 138 HG23 ILE 138 -2.004 27.255 -9.130 1022 HD11 ILE 138 HD11 ILE 138 -3.992 23.307 -6.895 1023 HD12 ILE 138 HD12 ILE 138 -4.799 24.638 -7.331 1024 HD13 ILE 138 HD13 ILE 138 -3.314 24.762 -6.704 1025 HA PRO 139 HA PRO 139 -4.572 29.652 -11.825 1026 HB2 PRO 139 HB2 PRO 139 -4.578 31.778 -10.228 1027 HB3 PRO 139 HB3 PRO 139 -5.970 30.939 -10.394 1028 HG2 PRO 139 HG2 PRO 139 -4.025 30.694 -8.328 1029 HG3 PRO 139 HG3 PRO 139 -5.639 30.876 -8.163 1030 HD2 PRO 139 HD2 PRO 139 -4.594 28.498 -8.027 1031 HD3 PRO 139 HD3 PRO 139 -6.057 28.696 -8.725 1032 H GLU 140 H GLU 140 -3.176 31.297 -12.565 1033 HA GLU 140 HA GLU 140 -0.432 30.873 -11.668 1034 HB2 GLU 140 HB2 GLU 140 -1.246 30.402 -14.013 1035 HB3 GLU 140 HB3 GLU 140 -1.095 32.018 -14.193 1036 HG2 GLU 140 HG2 GLU 140 1.177 31.919 -13.907 1037 HG3 GLU 140 HG3 GLU 140 1.106 30.368 -13.400 1038 H ASP 141 H ASP 141 -2.395 32.521 -10.390 1039 HA ASP 141 HA ASP 141 -2.174 35.121 -11.289 1040 HB2 ASP 141 HB2 ASP 141 -3.556 35.708 -9.448 1041 HB3 ASP 141 HB3 ASP 141 -4.067 34.252 -9.985 1042 H ARG 142 H ARG 142 -0.177 33.389 -9.235 1043 HA ARG 142 HA ARG 142 1.594 35.579 -9.137 1044 HB2 ARG 142 HB2 ARG 142 1.914 35.632 -6.781 1045 HB3 ARG 142 HB3 ARG 142 0.398 36.087 -7.184 1046 HG2 ARG 142 HG2 ARG 142 -0.187 33.702 -6.653 1047 HG3 ARG 142 HG3 ARG 142 1.213 33.724 -5.811 1048 HD2 ARG 142 HD2 ARG 142 -0.481 34.321 -4.303 1049 HD3 ARG 142 HD3 ARG 142 0.354 35.688 -4.619 1050 HE ARG 142 HE ARG 142 -2.153 35.042 -5.929 1051 HH11 ARG 142 HH11 ARG 142 -3.505 36.677 -6.368 1052 HH12 ARG 142 HH12 ARG 142 -3.160 38.292 -5.844 1053 HH21 ARG 142 HH21 ARG 142 -0.144 37.503 -4.381 1054 HH22 ARG 142 HH22 ARG 142 -1.287 38.755 -4.736 1055 H LEU 143 H LEU 143 3.740 35.083 -8.609 1056 HA LEU 143 HA LEU 143 4.326 32.411 -9.388 1057 HB2 LEU 143 HB2 LEU 143 5.939 34.794 -9.189 1058 HB3 LEU 143 HB3 LEU 143 6.635 33.349 -9.499 1059 HG LEU 143 HG LEU 143 5.271 33.301 -11.535 1060 HD11 LEU 143 HD11 LEU 143 4.558 35.368 -12.479 1061 HD12 LEU 143 HD12 LEU 143 4.915 36.127 -11.097 1062 HD13 LEU 143 HD13 LEU 143 3.723 35.035 -11.135 1063 HD21 LEU 143 HD21 LEU 143 6.922 34.661 -12.724 1064 HD22 LEU 143 HD22 LEU 143 7.653 33.756 -11.601 1065 HD23 LEU 143 HD23 LEU 143 7.371 35.323 -11.319 1066 H GLY 144 H GLY 144 5.844 31.034 -8.264 1067 HA2 GLY 144 HA2 GLY 144 7.380 30.977 -6.389 1068 HA3 GLY 144 HA3 GLY 144 6.282 31.810 -5.512 1069 H TYR 145 H TYR 145 6.877 29.880 -4.070 1070 HA TYR 145 HA TYR 145 5.713 27.469 -4.917 1071 HB2 TYR 145 HB2 TYR 145 6.586 26.586 -2.848 1072 HB3 TYR 145 HB3 TYR 145 7.734 27.434 -3.641 1073 HD1 TYR 145 HD1 TYR 145 8.629 29.523 -2.713 1074 HD2 TYR 145 HD2 TYR 145 5.640 27.410 -0.733 1075 HE1 TYR 145 HE1 TYR 145 8.989 30.864 -0.731 1076 HE2 TYR 145 HE2 TYR 145 6.001 28.755 1.244 1077 HH TYR 145 HH TYR 145 7.773 31.604 1.287 1078 H HIS 146 H HIS 146 4.038 26.274 -4.149 1079 HA HIS 146 HA HIS 146 2.212 27.601 -2.328 1080 HB2 HIS 146 HB2 HIS 146 1.337 26.157 -4.668 1081 HB3 HIS 146 HB3 HIS 146 0.357 26.895 -3.590 1082 HD1 HIS 146 HD1 HIS 146 -0.514 29.182 -4.220 1083 HD2 HIS 146 HD2 HIS 146 2.949 28.140 -6.150 1084 HE1 HIS 146 HE1 HIS 146 0.009 30.932 -5.917 1085 HE2 HIS 146 HE2 HIS 146 2.102 30.333 -7.077 1086 H VAL 147 H VAL 147 2.068 26.182 -0.516 1087 HA VAL 147 HA VAL 147 3.025 23.534 -0.965 1088 HB VAL 147 HB VAL 147 2.354 24.657 1.649 1089 HG11 VAL 147 HG11 VAL 147 3.876 23.039 2.552 1090 HG12 VAL 147 HG12 VAL 147 4.162 22.475 1.064 1091 HG13 VAL 147 HG13 VAL 147 2.698 22.301 1.727 1092 HG21 VAL 147 HG21 VAL 147 4.644 25.344 1.926 1093 HG22 VAL 147 HG22 VAL 147 3.976 26.130 0.680 1094 HG23 VAL 147 HG23 VAL 147 4.970 24.883 0.411 1095 H ILE 148 H ILE 148 1.828 21.637 -0.703 1096 HA ILE 148 HA ILE 148 -0.923 22.001 0.051 1097 HB ILE 148 HB ILE 148 -0.065 20.217 -2.102 1098 HG12 ILE 148 HG12 ILE 148 -1.583 22.647 -2.424 1099 HG13 ILE 148 HG13 ILE 148 0.024 22.557 -2.703 1100 HG21 ILE 148 HG21 ILE 148 -2.425 19.801 -2.487 1101 HG22 ILE 148 HG22 ILE 148 -2.804 20.742 -1.227 1102 HG23 ILE 148 HG23 ILE 148 -2.031 19.342 -0.987 1103 HD11 ILE 148 HD11 ILE 148 -1.169 22.465 -4.759 1104 HD12 ILE 148 HD12 ILE 148 -1.976 21.159 -4.252 1105 HD13 ILE 148 HD13 ILE 148 -0.385 21.070 -4.528 1106 H LEU 149 H LEU 149 -1.463 20.809 1.817 1107 HA LEU 149 HA LEU 149 0.262 18.606 2.527 1108 HB2 LEU 149 HB2 LEU 149 -1.619 19.995 4.224 1109 HB3 LEU 149 HB3 LEU 149 -0.510 18.911 4.738 1110 HG LEU 149 HG LEU 149 0.999 20.802 3.681 1111 HD11 LEU 149 HD11 LEU 149 0.215 22.893 4.572 1112 HD12 LEU 149 HD12 LEU 149 -1.149 22.177 5.065 1113 HD13 LEU 149 HD13 LEU 149 -0.839 22.327 3.484 1114 HD21 LEU 149 HD21 LEU 149 1.588 21.313 5.950 1115 HD22 LEU 149 HD22 LEU 149 1.452 19.713 5.757 1116 HD23 LEU 149 HD23 LEU 149 0.262 20.546 6.469 1117 H ALA 150 H ALA 150 -0.622 16.462 2.851 1118 HA ALA 150 HA ALA 150 -3.462 16.292 2.659 1119 HB1 ALA 150 HB1 ALA 150 -2.699 16.029 0.371 1120 HB2 ALA 150 HB2 ALA 150 -3.388 14.654 0.870 1121 HB3 ALA 150 HB3 ALA 150 -1.776 14.780 0.822 1122 H VAL 151 H VAL 151 -4.454 14.796 3.873 1123 HA VAL 151 HA VAL 151 -2.752 12.774 4.984 1124 HB VAL 151 HB VAL 151 -4.862 13.822 6.663 1125 HG11 VAL 151 HG11 VAL 151 -3.452 13.082 8.469 1126 HG12 VAL 151 HG12 VAL 151 -2.325 12.623 7.404 1127 HG13 VAL 151 HG13 VAL 151 -3.749 11.858 7.456 1128 HG21 VAL 151 HG21 VAL 151 -3.393 15.475 7.631 1129 HG22 VAL 151 HG22 VAL 151 -3.640 15.803 6.067 1130 HG23 VAL 151 HG23 VAL 151 -2.257 15.111 6.539 1131 H TRP 152 H TRP 152 -3.558 10.717 5.102 1132 HA TRP 152 HA TRP 152 -6.310 10.290 4.252 1133 HB2 TRP 152 HB2 TRP 152 -5.070 9.596 2.488 1134 HB3 TRP 152 HB3 TRP 152 -3.915 8.953 3.447 1135 HD1 TRP 152 HD1 TRP 152 -7.208 7.715 4.372 1136 HE1 TRP 152 HE1 TRP 152 -7.608 5.343 3.704 1137 HE3 TRP 152 HE3 TRP 152 -3.298 7.275 1.280 1138 HZ2 TRP 152 HZ2 TRP 152 -6.284 3.510 2.024 1139 HZ3 TRP 152 HZ3 TRP 152 -2.944 5.161 0.143 1140 HH2 TRP 152 HH2 TRP 152 -4.432 3.296 0.535 1141 H ASP 153 H ASP 153 -7.463 9.726 5.915 1142 HA ASP 153 HA ASP 153 -6.318 8.481 8.190 1143 HB2 ASP 153 HB2 ASP 153 -8.047 10.248 8.254 1144 HB3 ASP 153 HB3 ASP 153 -9.114 9.094 7.810 1145 H VAL 154 H VAL 154 -6.483 6.392 8.843 1146 HA VAL 154 HA VAL 154 -7.826 4.614 7.003 1147 HB VAL 154 HB VAL 154 -5.374 4.073 8.493 1148 HG11 VAL 154 HG11 VAL 154 -5.200 2.039 7.272 1149 HG12 VAL 154 HG12 VAL 154 -6.620 2.337 6.560 1150 HG13 VAL 154 HG13 VAL 154 -6.557 2.052 8.150 1151 HG21 VAL 154 HG21 VAL 154 -4.239 4.157 6.359 1152 HG22 VAL 154 HG22 VAL 154 -4.948 5.580 6.657 1153 HG23 VAL 154 HG23 VAL 154 -5.632 4.535 5.630 1154 H ALA 155 H ALA 155 -9.497 3.443 7.848 1155 HA ALA 155 HA ALA 155 -10.019 3.712 10.570 1156 HB1 ALA 155 HB1 ALA 155 -11.822 3.543 8.923 1157 HB2 ALA 155 HB2 ALA 155 -12.041 2.422 10.068 1158 HB3 ALA 155 HB3 ALA 155 -11.414 2.004 8.637 1159 H ASP 156 H ASP 156 -8.123 1.549 8.995 1160 HA ASP 156 HA ASP 156 -8.664 -0.659 10.633 1161 HB2 ASP 156 HB2 ASP 156 -6.388 -0.312 8.830 1162 HB3 ASP 156 HB3 ASP 156 -6.925 -1.759 9.365 1163 H THR 157 H THR 157 -6.832 2.039 11.100 1164 HA THR 157 HA THR 157 -5.304 0.781 13.115 1165 HB THR 157 HB THR 157 -3.220 2.051 12.274 1166 HG1 THR 157 HG1 THR 157 -4.177 2.224 9.788 1167 HG21 THR 157 HG21 THR 157 -2.667 0.528 10.524 1168 HG22 THR 157 HG22 THR 157 -4.214 0.072 10.405 1169 HG23 THR 157 HG23 THR 157 -3.362 -0.296 11.730 1170 H GLU 158 H GLU 158 -4.220 2.206 14.712 1171 HA GLU 158 HA GLU 158 -5.539 4.657 15.074 1172 HB2 GLU 158 HB2 GLU 158 -3.328 3.456 16.505 1173 HB3 GLU 158 HB3 GLU 158 -3.911 4.919 16.940 1174 HG2 GLU 158 HG2 GLU 158 -4.882 3.462 18.387 1175 HG3 GLU 158 HG3 GLU 158 -6.056 3.807 17.305 1176 H ASN 159 H ASN 159 -3.372 3.881 12.940 1177 HA ASN 159 HA ASN 159 -1.814 6.303 13.087 1178 HB2 ASN 159 HB2 ASN 159 -0.786 3.957 12.928 1179 HB3 ASN 159 HB3 ASN 159 -0.997 4.215 11.329 1180 HD21 ASN 159 HD21 ASN 159 2.379 5.310 12.536 1181 HD22 ASN 159 HD22 ASN 159 1.463 3.861 12.780 1182 H ALA 160 H ALA 160 -1.130 7.120 10.778 1183 HA ALA 160 HA ALA 160 -3.265 6.808 8.918 1184 HB1 ALA 160 HB1 ALA 160 -3.993 8.712 10.229 1185 HB2 ALA 160 HB2 ALA 160 -3.646 9.210 8.730 1186 HB3 ALA 160 HB3 ALA 160 -2.593 9.464 9.931 1187 H PHE 161 H PHE 161 -2.862 7.783 6.803 1188 HA PHE 161 HA PHE 161 -0.063 7.636 6.212 1189 HB2 PHE 161 HB2 PHE 161 -2.399 7.608 4.517 1190 HB3 PHE 161 HB3 PHE 161 -0.885 7.591 3.905 1191 HD1 PHE 161 HD1 PHE 161 -3.305 5.533 3.869 1192 HD2 PHE 161 HD2 PHE 161 0.428 5.636 5.683 1193 HE1 PHE 161 HE1 PHE 161 -3.271 3.123 3.913 1194 HE2 PHE 161 HE2 PHE 161 0.464 3.223 5.746 1195 HZ PHE 161 HZ PHE 161 -1.387 1.964 4.861 1196 H TYR 162 H TYR 162 1.177 9.383 5.635 1197 HA TYR 162 HA TYR 162 -0.255 11.834 5.237 1198 HB2 TYR 162 HB2 TYR 162 0.462 11.814 7.526 1199 HB3 TYR 162 HB3 TYR 162 1.984 11.440 7.066 1200 HD1 TYR 162 HD1 TYR 162 3.565 13.160 6.467 1201 HD2 TYR 162 HD2 TYR 162 -0.428 14.114 7.130 1202 HE1 TYR 162 HE1 TYR 162 4.109 15.510 6.378 1203 HE2 TYR 162 HE2 TYR 162 0.117 16.459 7.044 1204 HH TYR 162 HH TYR 162 3.421 17.612 6.672 1205 H GLN 163 H GLN 163 0.454 13.271 3.735 1206 HA GLN 163 HA GLN 163 3.217 13.214 3.100 1207 HB2 GLN 163 HB2 GLN 163 2.809 13.253 0.696 1208 HB3 GLN 163 HB3 GLN 163 2.537 11.807 1.403 1209 HG2 GLN 163 HG2 GLN 163 0.274 13.474 1.100 1210 HG3 GLN 163 HG3 GLN 163 0.878 12.828 -0.273 1211 HE21 GLN 163 HE21 GLN 163 -1.461 10.663 2.046 1212 HE22 GLN 163 HE22 GLN 163 -1.207 12.368 2.225 1213 H VAL 164 H VAL 164 4.025 15.232 2.200 1214 HA VAL 164 HA VAL 164 2.028 17.286 1.754 1215 HB VAL 164 HB VAL 164 2.695 17.917 3.866 1216 HG11 VAL 164 HG11 VAL 164 4.946 18.156 4.549 1217 HG12 VAL 164 HG12 VAL 164 5.448 17.598 3.117 1218 HG13 VAL 164 HG13 VAL 164 4.642 16.626 4.126 1219 HG21 VAL 164 HG21 VAL 164 3.743 20.043 3.501 1220 HG22 VAL 164 HG22 VAL 164 2.606 19.788 2.380 1221 HG23 VAL 164 HG23 VAL 164 4.167 19.585 2.010 1222 H ILE 165 H ILE 165 2.448 18.475 -0.096 1223 HA ILE 165 HA ILE 165 4.931 17.894 -1.432 1224 HB ILE 165 HB ILE 165 2.352 17.902 -2.820 1225 HG12 ILE 165 HG12 ILE 165 4.018 15.591 -2.392 1226 HG13 ILE 165 HG13 ILE 165 2.692 15.917 -1.496 1227 HG21 ILE 165 HG21 ILE 165 3.595 17.251 -4.807 1228 HG22 ILE 165 HG22 ILE 165 4.980 17.344 -3.977 1229 HG23 ILE 165 HG23 ILE 165 4.126 18.684 -4.279 1230 HD11 ILE 165 HD11 ILE 165 2.165 14.266 -3.163 1231 HD12 ILE 165 HD12 ILE 165 2.620 15.284 -4.335 1232 HD13 ILE 165 HD13 ILE 165 1.307 15.606 -3.448 1233 H ASP 166 H ASP 166 5.935 19.780 -2.174 1234 HA ASP 166 HA ASP 166 4.276 22.165 -2.213 1235 HB2 ASP 166 HB2 ASP 166 6.040 22.252 -0.620 1236 HB3 ASP 166 HB3 ASP 166 7.124 22.033 -1.822 1237 H VAL 167 H VAL 167 4.174 23.425 -4.057 1238 HA VAL 167 HA VAL 167 5.777 22.512 -6.235 1239 HB VAL 167 HB VAL 167 3.643 23.092 -7.625 1240 HG11 VAL 167 HG11 VAL 167 3.181 20.715 -7.737 1241 HG12 VAL 167 HG12 VAL 167 4.078 20.480 -6.412 1242 HG13 VAL 167 HG13 VAL 167 4.777 20.970 -7.785 1243 HG21 VAL 167 HG21 VAL 167 1.650 22.308 -6.515 1244 HG22 VAL 167 HG22 VAL 167 2.250 23.592 -5.735 1245 HG23 VAL 167 HG23 VAL 167 2.487 22.104 -5.147 1246 H ASP 168 H ASP 168 6.867 24.009 -7.295 1247 HA ASP 168 HA ASP 168 6.419 26.749 -6.650 1248 HB2 ASP 168 HB2 ASP 168 8.648 25.864 -6.796 1249 HB3 ASP 168 HB3 ASP 168 8.428 25.661 -8.401 1250 H LEU 169 H LEU 169 4.629 27.604 -7.659 1251 HA LEU 169 HA LEU 169 4.227 26.846 -10.408 1252 HB2 LEU 169 HB2 LEU 169 2.347 27.882 -8.503 1253 HB3 LEU 169 HB3 LEU 169 1.978 27.715 -10.086 1254 HG LEU 169 HG LEU 169 2.921 25.310 -9.100 1255 HD11 LEU 169 HD11 LEU 169 1.192 24.804 -7.551 1256 HD12 LEU 169 HD12 LEU 169 0.646 26.323 -7.648 1257 HD13 LEU 169 HD13 LEU 169 2.094 26.024 -6.992 1258 HD21 LEU 169 HD21 LEU 169 0.869 24.504 -10.027 1259 HD22 LEU 169 HD22 LEU 169 1.582 25.513 -11.070 1260 HD23 LEU 169 HD23 LEU 169 0.333 26.022 -10.178 1261 H VAL 170 H VAL 170 4.844 28.214 -11.952 1262 HA VAL 170 HA VAL 170 4.733 30.978 -11.318 1263 HB VAL 170 HB VAL 170 6.964 31.372 -12.230 1264 HG11 VAL 170 HG11 VAL 170 8.293 30.388 -10.475 1265 HG12 VAL 170 HG12 VAL 170 7.068 29.400 -10.103 1266 HG13 VAL 170 HG13 VAL 170 6.922 30.994 -9.869 1267 HG21 VAL 170 HG21 VAL 170 8.407 29.513 -12.807 1268 HG22 VAL 170 HG22 VAL 170 7.108 29.529 -13.771 1269 HG23 VAL 170 HG23 VAL 170 7.188 28.485 -12.539 1270 H ASN 171 H ASN 171 4.914 32.479 -13.191 1271 HA ASN 171 HA ASN 171 3.764 31.384 -15.579 1272 HB2 ASN 171 HB2 ASN 171 2.975 33.485 -14.748 1273 HB3 ASN 171 HB3 ASN 171 4.464 34.120 -14.967 1274 HD21 ASN 171 HD21 ASN 171 3.124 35.438 -17.895 1275 HD22 ASN 171 HD22 ASN 171 3.567 35.779 -16.255 1276 H LYS 172 H LYS 172 4.850 31.565 -17.673 1277 HA LYS 172 HA LYS 172 7.630 31.234 -17.575 1278 HB2 LYS 172 HB2 LYS 172 7.486 31.060 -19.950 1279 HB3 LYS 172 HB3 LYS 172 6.301 30.176 -19.256 1280 HG2 LYS 172 HG2 LYS 172 4.960 31.176 -20.682 1281 HG3 LYS 172 HG3 LYS 172 5.065 32.465 -19.685 1282 HD2 LYS 172 HD2 LYS 172 7.208 32.593 -21.354 1283 HD3 LYS 172 HD3 LYS 172 5.898 32.313 -22.289 1284 HE2 LYS 172 HE2 LYS 172 5.607 34.497 -22.230 1285 HE3 LYS 172 HE3 LYS 172 5.041 34.258 -20.717 1286 HZ1 LYS 172 HZ1 LYS 172 6.748 35.914 -20.698 1287 HZ2 LYS 172 HZ2 LYS 172 7.789 34.861 -21.348 1288 HZ3 LYS 172 HZ3 LYS 172 7.228 34.624 -19.850 Start of MODEL 18 1 H1 HIS 1 H1 HIS 1 3.132 2.769 2.142 2 H2 HIS 1 H2 HIS 1 1.736 2.077 1.710 3 H3 HIS 1 H3 HIS 1 2.058 3.597 1.262 4 HA HIS 1 HA HIS 1 3.786 2.866 -0.105 5 HB2 HIS 1 HB2 HIS 1 3.859 0.354 -0.491 6 HB3 HIS 1 HB3 HIS 1 4.690 0.981 0.768 7 HD1 HIS 1 HD1 HIS 1 3.850 0.517 3.220 8 HD2 HIS 1 HD2 HIS 1 1.752 -1.328 0.214 9 HE1 HIS 1 HE1 HIS 1 2.401 -1.233 4.227 10 HE2 HIS 1 HE2 HIS 1 1.126 -2.355 2.437 11 H GLY 2 H GLY 2 3.313 2.942 -2.261 12 HA2 GLY 2 HA2 GLY 2 1.199 1.683 -3.492 13 HA3 GLY 2 HA3 GLY 2 0.630 3.121 -2.966 14 H PHE 3 H PHE 3 0.530 3.290 -5.534 15 HA PHE 3 HA PHE 3 3.083 4.264 -6.402 16 HB2 PHE 3 HB2 PHE 3 0.925 3.199 -8.032 17 HB3 PHE 3 HB3 PHE 3 2.295 3.810 -8.678 18 HD1 PHE 3 HD1 PHE 3 4.506 2.648 -8.118 19 HD2 PHE 3 HD2 PHE 3 0.777 0.908 -7.501 20 HE1 PHE 3 HE1 PHE 3 5.548 0.469 -8.016 21 HE2 PHE 3 HE2 PHE 3 1.804 -1.275 -7.398 22 HZ PHE 3 HZ PHE 3 4.192 -1.498 -7.653 23 H ILE 4 H ILE 4 3.312 6.262 -7.471 24 HA ILE 4 HA ILE 4 0.959 7.942 -7.442 25 HB ILE 4 HB ILE 4 3.678 8.790 -7.918 26 HG12 ILE 4 HG12 ILE 4 2.069 9.260 -5.578 27 HG13 ILE 4 HG13 ILE 4 3.196 8.081 -5.657 28 HG21 ILE 4 HG21 ILE 4 2.778 11.037 -7.846 29 HG22 ILE 4 HG22 ILE 4 1.283 10.443 -7.690 30 HG23 ILE 4 HG23 ILE 4 2.100 10.224 -9.068 31 HD11 ILE 4 HD11 ILE 4 4.075 9.973 -4.477 32 HD12 ILE 4 HD12 ILE 4 3.804 10.918 -5.760 33 HD13 ILE 4 HD13 ILE 4 4.920 9.750 -5.838 34 H GLU 5 H GLU 5 -0.270 7.782 -9.298 35 HA GLU 5 HA GLU 5 0.856 6.477 -11.510 36 HB2 GLU 5 HB2 GLU 5 -1.556 6.455 -10.604 37 HB3 GLU 5 HB3 GLU 5 -1.759 7.645 -11.704 38 HG2 GLU 5 HG2 GLU 5 -2.420 5.580 -12.625 39 HG3 GLU 5 HG3 GLU 5 -1.123 6.156 -13.433 40 H LYS 6 H LYS 6 1.204 9.435 -10.656 41 HA LYS 6 HA LYS 6 2.098 11.203 -11.652 42 HB2 LYS 6 HB2 LYS 6 2.003 9.875 -14.216 43 HB3 LYS 6 HB3 LYS 6 2.857 11.231 -13.903 44 HG2 LYS 6 HG2 LYS 6 4.500 10.115 -12.866 45 HG3 LYS 6 HG3 LYS 6 3.507 8.915 -12.374 46 HD2 LYS 6 HD2 LYS 6 4.284 9.177 -15.134 47 HD3 LYS 6 HD3 LYS 6 5.161 8.284 -14.084 48 HE2 LYS 6 HE2 LYS 6 3.211 6.907 -13.684 49 HE3 LYS 6 HE3 LYS 6 2.405 7.761 -14.818 50 HZ1 LYS 6 HZ1 LYS 6 3.151 5.714 -15.715 51 HZ2 LYS 6 HZ2 LYS 6 4.681 6.094 -15.353 52 HZ3 LYS 6 HZ3 LYS 6 3.882 6.940 -16.476 53 HA PRO 7 HA PRO 7 2.517 13.270 -13.019 54 HB2 PRO 7 HB2 PRO 7 1.731 15.780 -12.541 55 HB3 PRO 7 HB3 PRO 7 1.560 15.184 -14.052 56 HG2 PRO 7 HG2 PRO 7 -0.384 15.296 -11.992 57 HG3 PRO 7 HG3 PRO 7 -0.530 15.796 -13.540 58 HD2 PRO 7 HD2 PRO 7 -1.444 13.458 -12.882 59 HD3 PRO 7 HD3 PRO 7 -0.719 13.644 -14.334 60 H GLY 8 H GLY 8 3.963 13.943 -11.500 61 HA2 GLY 8 HA2 GLY 8 4.245 14.895 -9.347 62 HA3 GLY 8 HA3 GLY 8 2.867 14.177 -8.845 63 H SER 9 H SER 9 4.896 12.073 -10.565 64 HA SER 9 HA SER 9 5.272 10.519 -8.325 65 HB2 SER 9 HB2 SER 9 5.394 9.460 -10.454 66 HB3 SER 9 HB3 SER 9 6.708 10.343 -10.854 67 HG SER 9 HG SER 9 6.562 8.087 -9.459 68 H ARG 10 H ARG 10 6.688 10.588 -6.645 69 HA ARG 10 HA ARG 10 8.794 12.425 -6.793 70 HB2 ARG 10 HB2 ARG 10 9.237 12.000 -4.542 71 HB3 ARG 10 HB3 ARG 10 7.617 12.080 -4.732 72 HG2 ARG 10 HG2 ARG 10 7.466 9.749 -4.526 73 HG3 ARG 10 HG3 ARG 10 9.088 9.649 -4.373 74 HD2 ARG 10 HD2 ARG 10 7.470 11.199 -2.533 75 HD3 ARG 10 HD3 ARG 10 7.888 9.652 -2.218 76 HE ARG 10 HE ARG 10 10.270 10.804 -2.629 77 HH11 ARG 10 HH11 ARG 10 11.559 11.679 -1.053 78 HH12 ARG 10 HH12 ARG 10 10.866 12.338 0.392 79 HH21 ARG 10 HH21 ARG 10 7.611 11.618 -0.468 80 HH22 ARG 10 HH22 ARG 10 8.670 12.304 0.719 81 H ALA 11 H ALA 11 8.536 9.197 -7.522 82 HA ALA 11 HA ALA 11 11.055 8.328 -6.893 83 HB1 ALA 11 HB1 ALA 11 9.294 6.788 -7.546 84 HB2 ALA 11 HB2 ALA 11 10.608 6.499 -8.443 85 HB3 ALA 11 HB3 ALA 11 9.372 7.334 -9.066 86 H ALA 12 H ALA 12 9.992 10.247 -9.510 87 HA ALA 12 HA ALA 12 12.167 9.945 -11.168 88 HB1 ALA 12 HB1 ALA 12 10.143 11.086 -11.885 89 HB2 ALA 12 HB2 ALA 12 11.417 12.037 -12.183 90 HB3 ALA 12 HB3 ALA 12 10.480 12.319 -10.896 91 H LEU 13 H LEU 13 11.765 11.846 -8.343 92 HA LEU 13 HA LEU 13 14.237 13.180 -8.736 93 HB2 LEU 13 HB2 LEU 13 12.212 13.495 -6.715 94 HB3 LEU 13 HB3 LEU 13 13.657 14.236 -6.543 95 HG LEU 13 HG LEU 13 13.028 15.172 -8.838 96 HD11 LEU 13 HD11 LEU 13 10.680 15.690 -8.968 97 HD12 LEU 13 HD12 LEU 13 10.408 14.799 -7.646 98 HD13 LEU 13 HD13 LEU 13 10.901 14.089 -9.013 99 HD21 LEU 13 HD21 LEU 13 12.266 17.163 -7.692 100 HD22 LEU 13 HD22 LEU 13 13.552 16.540 -6.934 101 HD23 LEU 13 HD23 LEU 13 12.068 16.302 -6.337 102 H CYS 14 H CYS 14 13.381 10.285 -7.567 103 HA CYS 14 HA CYS 14 15.118 10.162 -5.333 104 HB2 CYS 14 HB2 CYS 14 13.083 8.802 -5.923 105 HB3 CYS 14 HB3 CYS 14 14.188 7.833 -6.634 106 H SER 15 H SER 15 15.550 10.210 -8.528 107 HA SER 15 HA SER 15 17.463 8.358 -9.098 108 HB2 SER 15 HB2 SER 15 16.531 9.600 -10.883 109 HB3 SER 15 HB3 SER 15 16.956 11.018 -10.192 110 HG SER 15 HG SER 15 19.174 10.098 -10.574 111 H GLU 16 H GLU 16 19.740 8.543 -9.525 112 HA GLU 16 HA GLU 16 21.175 9.353 -7.394 113 HB2 GLU 16 HB2 GLU 16 23.108 8.899 -8.730 114 HB3 GLU 16 HB3 GLU 16 21.961 7.776 -9.033 115 HG2 GLU 16 HG2 GLU 16 22.467 10.009 -10.790 116 HG3 GLU 16 HG3 GLU 16 23.123 8.531 -11.019 117 H ALA 17 H ALA 17 20.034 11.356 -9.841 118 HA ALA 17 HA ALA 17 21.804 13.415 -9.666 119 HB1 ALA 17 HB1 ALA 17 19.979 13.365 -11.282 120 HB2 ALA 17 HB2 ALA 17 19.963 14.789 -10.516 121 HB3 ALA 17 HB3 ALA 17 18.914 13.632 -10.095 122 H PHE 18 H PHE 18 19.666 12.353 -7.278 123 HA PHE 18 HA PHE 18 19.561 14.805 -5.900 124 HB2 PHE 18 HB2 PHE 18 17.926 12.771 -5.913 125 HB3 PHE 18 HB3 PHE 18 18.775 12.378 -4.574 126 HD1 PHE 18 HD1 PHE 18 16.523 14.844 -5.942 127 HD2 PHE 18 HD2 PHE 18 18.383 13.499 -2.469 128 HE1 PHE 18 HE1 PHE 18 15.058 16.245 -4.622 129 HE2 PHE 18 HE2 PHE 18 16.935 14.901 -1.141 130 HZ PHE 18 HZ PHE 18 15.255 16.264 -2.217 131 H GLY 19 H GLY 19 22.026 12.684 -6.096 132 HA2 GLY 19 HA2 GLY 19 23.380 13.781 -3.964 133 HA3 GLY 19 HA3 GLY 19 22.740 12.368 -3.450 134 H PHE 20 H PHE 20 23.140 10.986 -5.917 135 HA PHE 20 HA PHE 20 24.566 9.763 -6.911 136 HB2 PHE 20 HB2 PHE 20 25.503 12.133 -7.432 137 HB3 PHE 20 HB3 PHE 20 26.827 11.560 -6.666 138 HD1 PHE 20 HD1 PHE 20 24.816 11.234 -9.604 139 HD2 PHE 20 HD2 PHE 20 28.306 9.971 -7.727 140 HE1 PHE 20 HE1 PHE 20 25.552 10.226 -11.671 141 HE2 PHE 20 HE2 PHE 20 29.055 8.957 -9.781 142 HZ PHE 20 HZ PHE 20 27.685 9.089 -11.764 143 H LEU 21 H LEU 21 25.828 10.605 -3.902 144 HA LEU 21 HA LEU 21 27.821 8.618 -3.922 145 HB2 LEU 21 HB2 LEU 21 26.731 10.095 -1.676 146 HB3 LEU 21 HB3 LEU 21 28.093 9.199 -1.589 147 HG LEU 21 HG LEU 21 27.892 11.581 -3.189 148 HD11 LEU 21 HD11 LEU 21 29.133 12.663 -1.404 149 HD12 LEU 21 HD12 LEU 21 29.066 11.302 -0.534 150 HD13 LEU 21 HD13 LEU 21 27.714 12.133 -0.839 151 HD21 LEU 21 HD21 LEU 21 30.266 11.485 -3.325 152 HD22 LEU 21 HD22 LEU 21 29.615 10.151 -3.965 153 HD23 LEU 21 HD23 LEU 21 30.267 10.103 -2.486 154 H ASN 22 H ASN 22 24.666 8.327 -3.860 155 HA ASN 22 HA ASN 22 24.627 6.121 -1.999 156 HB2 ASN 22 HB2 ASN 22 22.615 8.149 -2.485 157 HB3 ASN 22 HB3 ASN 22 22.202 6.750 -1.751 158 HD21 ASN 22 HD21 ASN 22 23.312 9.642 0.527 159 HD22 ASN 22 HD22 ASN 22 22.592 9.762 -1.043 160 H LEU 23 H LEU 23 22.453 4.768 -2.406 161 HA LEU 23 HA LEU 23 22.738 3.610 -4.947 162 HB2 LEU 23 HB2 LEU 23 20.890 3.155 -2.814 163 HB3 LEU 23 HB3 LEU 23 20.654 2.426 -4.257 164 HG LEU 23 HG LEU 23 22.750 1.291 -3.942 165 HD11 LEU 23 HD11 LEU 23 23.725 1.146 -1.780 166 HD12 LEU 23 HD12 LEU 23 22.711 2.284 -1.240 167 HD13 LEU 23 HD13 LEU 23 23.827 2.655 -2.351 168 HD21 LEU 23 HD21 LEU 23 21.788 -0.314 -2.364 169 HD22 LEU 23 HD22 LEU 23 20.654 0.182 -3.404 170 HD23 LEU 23 HD23 LEU 23 20.704 0.797 -1.910 171 H ASN 24 H ASN 24 20.900 3.471 -6.546 172 HA ASN 24 HA ASN 24 20.160 5.994 -7.212 173 HB2 ASN 24 HB2 ASN 24 19.077 3.488 -8.325 174 HB3 ASN 24 HB3 ASN 24 18.980 4.912 -9.119 175 HD21 ASN 24 HD21 ASN 24 21.638 3.158 -10.777 176 HD22 ASN 24 HD22 ASN 24 19.908 3.185 -10.693 177 H CYS 25 H CYS 25 18.735 4.708 -4.833 178 HA CYS 25 HA CYS 25 16.746 6.552 -4.676 179 HB2 CYS 25 HB2 CYS 25 15.627 5.103 -6.182 180 HB3 CYS 25 HB3 CYS 25 15.582 3.992 -4.986 181 H GLY 26 H GLY 26 18.115 3.537 -3.761 182 HA2 GLY 26 HA2 GLY 26 18.804 2.917 -1.683 183 HA3 GLY 26 HA3 GLY 26 18.131 4.253 -1.028 184 H SER 27 H SER 27 17.877 2.285 0.605 185 HA SER 27 HA SER 27 15.811 0.547 0.006 186 HB2 SER 27 HB2 SER 27 17.507 0.035 1.693 187 HB3 SER 27 HB3 SER 27 16.825 1.141 2.681 188 HG SER 27 HG SER 27 14.900 -0.128 2.559 189 H VAL 28 H VAL 28 15.676 3.711 0.958 190 HA VAL 28 HA VAL 28 13.338 3.632 2.475 191 HB VAL 28 HB VAL 28 15.035 5.515 2.411 192 HG11 VAL 28 HG11 VAL 28 14.690 7.264 0.811 193 HG12 VAL 28 HG12 VAL 28 13.548 6.380 0.083 194 HG13 VAL 28 HG13 VAL 28 15.088 5.888 0.060 195 HG21 VAL 28 HG21 VAL 28 13.481 7.229 3.015 196 HG22 VAL 28 HG22 VAL 28 13.079 5.831 3.722 197 HG23 VAL 28 HG23 VAL 28 12.265 6.343 2.422 198 H MET 29 H MET 29 13.784 3.154 -0.725 199 HA MET 29 HA MET 29 11.718 4.500 -1.801 200 HB2 MET 29 HB2 MET 29 12.094 3.149 -3.768 201 HB3 MET 29 HB3 MET 29 13.542 3.364 -3.042 202 HG2 MET 29 HG2 MET 29 13.376 1.254 -2.090 203 HG3 MET 29 HG3 MET 29 11.930 1.040 -2.818 204 HE1 MET 29 HE1 MET 29 12.716 0.720 -6.569 205 HE2 MET 29 HE2 MET 29 12.089 1.964 -5.748 206 HE3 MET 29 HE3 MET 29 11.590 0.457 -5.438 207 H TYR 30 H TYR 30 11.160 2.001 0.214 208 HA TYR 30 HA TYR 30 9.072 0.752 -1.142 209 HB2 TYR 30 HB2 TYR 30 10.195 -0.314 0.668 210 HB3 TYR 30 HB3 TYR 30 9.654 0.832 1.698 211 HD1 TYR 30 HD1 TYR 30 8.312 -1.738 -0.530 212 HD2 TYR 30 HD2 TYR 30 7.780 0.351 3.025 213 HE1 TYR 30 HE1 TYR 30 6.392 -3.110 -0.005 214 HE2 TYR 30 HE2 TYR 30 5.876 -1.034 3.553 215 HH TYR 30 HH TYR 30 4.116 -2.445 2.180 216 H GLU 31 H GLU 31 9.117 3.305 1.237 217 HA GLU 31 HA GLU 31 6.838 4.397 0.080 218 HB2 GLU 31 HB2 GLU 31 5.477 4.472 2.113 219 HB3 GLU 31 HB3 GLU 31 5.604 2.997 1.424 220 HG2 GLU 31 HG2 GLU 31 7.356 2.574 3.145 221 HG3 GLU 31 HG3 GLU 31 6.709 3.861 3.916 222 HA PRO 32 HA PRO 32 9.537 7.367 2.111 223 HB2 PRO 32 HB2 PRO 32 10.360 8.815 0.023 224 HB3 PRO 32 HB3 PRO 32 11.110 7.399 0.339 225 HG2 PRO 32 HG2 PRO 32 8.996 7.871 -1.521 226 HG3 PRO 32 HG3 PRO 32 10.403 7.085 -1.788 227 HD2 PRO 32 HD2 PRO 32 8.262 5.731 -1.274 228 HD3 PRO 32 HD3 PRO 32 9.699 5.216 -0.692 229 H GLN 33 H GLN 33 6.763 7.602 0.365 230 HA GLN 33 HA GLN 33 6.384 10.290 1.193 231 HB2 GLN 33 HB2 GLN 33 4.482 10.344 -0.236 232 HB3 GLN 33 HB3 GLN 33 5.722 9.675 -1.062 233 HG2 GLN 33 HG2 GLN 33 3.990 7.823 0.202 234 HG3 GLN 33 HG3 GLN 33 3.343 8.633 -1.059 235 HE21 GLN 33 HE21 GLN 33 4.508 6.296 -3.272 236 HE22 GLN 33 HE22 GLN 33 3.191 7.277 -2.720 237 H SER 34 H SER 34 6.059 7.569 2.790 238 HA SER 34 HA SER 34 3.458 8.165 3.851 239 HB2 SER 34 HB2 SER 34 4.096 5.807 3.166 240 HB3 SER 34 HB3 SER 34 4.870 5.748 4.603 241 HG SER 34 HG SER 34 2.205 5.793 4.087 242 H LEU 35 H LEU 35 3.659 9.833 5.260 243 HA LEU 35 HA LEU 35 5.569 9.580 7.389 244 HB2 LEU 35 HB2 LEU 35 3.587 11.625 7.009 245 HB3 LEU 35 HB3 LEU 35 4.791 11.674 8.111 246 HG LEU 35 HG LEU 35 5.258 11.775 5.275 247 HD11 LEU 35 HD11 LEU 35 5.623 14.152 5.588 248 HD12 LEU 35 HD12 LEU 35 5.206 14.009 7.144 249 HD13 LEU 35 HD13 LEU 35 4.103 13.772 5.986 250 HD21 LEU 35 HD21 LEU 35 7.475 12.462 5.839 251 HD22 LEU 35 HD22 LEU 35 7.171 10.995 6.448 252 HD23 LEU 35 HD23 LEU 35 7.133 12.294 7.410 253 H GLU 36 H GLU 36 5.038 8.303 9.153 254 HA GLU 36 HA GLU 36 2.350 7.455 9.342 255 HB2 GLU 36 HB2 GLU 36 4.679 6.712 10.913 256 HB3 GLU 36 HB3 GLU 36 3.221 6.011 11.139 257 HG2 GLU 36 HG2 GLU 36 4.766 5.809 8.720 258 HG3 GLU 36 HG3 GLU 36 4.633 4.625 9.837 259 H ALA 37 H ALA 37 0.839 7.844 10.923 260 HA ALA 37 HA ALA 37 1.617 9.523 13.144 261 HB1 ALA 37 HB1 ALA 37 0.573 10.989 11.578 262 HB2 ALA 37 HB2 ALA 37 -0.408 10.815 12.852 263 HB3 ALA 37 HB3 ALA 37 -0.711 10.011 11.482 264 H LYS 38 H LYS 38 0.163 9.242 15.059 265 HA LYS 38 HA LYS 38 -1.472 6.896 14.794 266 HB2 LYS 38 HB2 LYS 38 0.607 6.463 16.047 267 HB3 LYS 38 HB3 LYS 38 0.014 7.430 17.222 268 HG2 LYS 38 HG2 LYS 38 -1.902 5.882 17.322 269 HG3 LYS 38 HG3 LYS 38 -0.997 4.862 16.423 270 HD2 LYS 38 HD2 LYS 38 0.551 4.651 18.111 271 HD3 LYS 38 HD3 LYS 38 -0.175 5.824 18.984 272 HE2 LYS 38 HE2 LYS 38 -1.470 3.322 18.317 273 HE3 LYS 38 HE3 LYS 38 -0.765 3.599 19.764 274 HZ1 LYS 38 HZ1 LYS 38 -3.114 3.957 19.918 275 HZ2 LYS 38 HZ2 LYS 38 -3.031 5.074 18.752 276 HZ3 LYS 38 HZ3 LYS 38 -2.332 5.347 20.185 277 H LYS 39 H LYS 39 -3.443 6.771 15.810 278 HA LYS 39 HA LYS 39 -4.609 9.144 16.628 279 HB2 LYS 39 HB2 LYS 39 -5.536 6.415 17.013 280 HB3 LYS 39 HB3 LYS 39 -6.498 7.719 17.213 281 HG2 LYS 39 HG2 LYS 39 -6.485 8.151 14.930 282 HG3 LYS 39 HG3 LYS 39 -5.358 6.996 14.675 283 HD2 LYS 39 HD2 LYS 39 -6.914 5.354 15.447 284 HD3 LYS 39 HD3 LYS 39 -8.042 6.525 15.597 285 HE2 LYS 39 HE2 LYS 39 -8.045 6.882 13.295 286 HE3 LYS 39 HE3 LYS 39 -6.803 5.841 13.098 287 HZ1 LYS 39 HZ1 LYS 39 -8.854 4.779 12.544 288 HZ2 LYS 39 HZ2 LYS 39 -9.423 5.088 14.026 289 HZ3 LYS 39 HZ3 LYS 39 -8.193 4.057 13.831 290 H GLY 40 H GLY 40 -5.436 9.785 18.714 291 HA2 GLY 40 HA2 GLY 40 -5.846 9.393 20.923 292 HA3 GLY 40 HA3 GLY 40 -4.934 8.039 20.893 293 H PHE 41 H PHE 41 -5.058 9.934 22.963 294 HA PHE 41 HA PHE 41 -2.572 11.337 22.834 295 HB2 PHE 41 HB2 PHE 41 -4.656 11.326 24.834 296 HB3 PHE 41 HB3 PHE 41 -3.290 12.204 25.009 297 HD1 PHE 41 HD1 PHE 41 -2.765 13.896 23.092 298 HD2 PHE 41 HD2 PHE 41 -6.543 12.325 23.861 299 HE1 PHE 41 HE1 PHE 41 -3.761 15.724 21.872 300 HE2 PHE 41 HE2 PHE 41 -7.557 14.139 22.631 301 HZ PHE 41 HZ PHE 41 -6.167 15.844 21.638 302 HA PRO 42 HA PRO 42 -1.012 12.224 24.634 303 HB2 PRO 42 HB2 PRO 42 1.588 11.797 25.012 304 HB3 PRO 42 HB3 PRO 42 0.580 11.692 26.293 305 HG2 PRO 42 HG2 PRO 42 1.572 9.560 24.676 306 HG3 PRO 42 HG3 PRO 42 1.552 9.651 26.306 307 HD2 PRO 42 HD2 PRO 42 -0.315 8.334 25.072 308 HD3 PRO 42 HD3 PRO 42 -0.682 9.180 26.420 309 H HIS 43 H HIS 43 0.112 9.631 22.842 310 HA HIS 43 HA HIS 43 -0.337 10.523 20.393 311 HB2 HIS 43 HB2 HIS 43 1.784 11.102 19.389 312 HB3 HIS 43 HB3 HIS 43 1.146 12.266 20.340 313 HD1 HIS 43 HD1 HIS 43 4.112 10.211 19.893 314 HD2 HIS 43 HD2 HIS 43 2.559 12.639 22.802 315 HE1 HIS 43 HE1 HIS 43 5.894 10.679 21.562 316 HE2 HIS 43 HE2 HIS 43 4.988 12.154 23.319 317 H SER 44 H SER 44 2.178 9.127 22.299 318 HA SER 44 HA SER 44 3.193 7.221 22.361 319 HB2 SER 44 HB2 SER 44 0.992 5.942 20.946 320 HB3 SER 44 HB3 SER 44 2.018 5.177 21.961 321 HG SER 44 HG SER 44 -0.194 6.435 22.545 322 H GLY 45 H GLY 45 2.117 7.640 19.095 323 HA2 GLY 45 HA2 GLY 45 4.427 6.422 17.976 324 HA3 GLY 45 HA3 GLY 45 3.259 7.221 17.161 325 HA PRO 46 HA PRO 46 6.664 10.205 17.300 326 HB2 PRO 46 HB2 PRO 46 6.209 11.471 15.014 327 HB3 PRO 46 HB3 PRO 46 6.971 10.028 14.963 328 HG2 PRO 46 HG2 PRO 46 4.204 10.552 14.579 329 HG3 PRO 46 HG3 PRO 46 5.199 9.677 13.624 330 HD2 PRO 46 HD2 PRO 46 3.675 8.458 15.335 331 HD3 PRO 46 HD3 PRO 46 5.179 7.886 15.052 332 H ALA 47 H ALA 47 6.587 12.750 17.031 333 HA ALA 47 HA ALA 47 4.487 13.566 18.715 334 HB1 ALA 47 HB1 ALA 47 6.604 14.690 18.836 335 HB2 ALA 47 HB2 ALA 47 5.459 15.779 18.493 336 HB3 ALA 47 HB3 ALA 47 6.428 15.228 17.321 337 H ASP 48 H ASP 48 2.452 13.418 17.903 338 HA ASP 48 HA ASP 48 2.030 14.205 15.201 339 HB2 ASP 48 HB2 ASP 48 0.418 12.690 17.077 340 HB3 ASP 48 HB3 ASP 48 -0.234 13.181 15.663 341 H GLY 49 H GLY 49 0.018 15.335 14.544 342 HA2 GLY 49 HA2 GLY 49 -1.455 17.034 14.852 343 HA3 GLY 49 HA3 GLY 49 -1.157 17.036 16.458 344 H GLN 50 H GLN 50 1.766 17.296 15.153 345 HA GLN 50 HA GLN 50 1.962 19.958 15.926 346 HB2 GLN 50 HB2 GLN 50 3.949 18.361 14.550 347 HB3 GLN 50 HB3 GLN 50 4.279 19.772 15.303 348 HG2 GLN 50 HG2 GLN 50 3.520 17.309 16.575 349 HG3 GLN 50 HG3 GLN 50 4.964 18.060 16.710 350 HE21 GLN 50 HE21 GLN 50 2.295 18.737 19.445 351 HE22 GLN 50 HE22 GLN 50 2.449 17.333 18.443 352 H ILE 51 H ILE 51 1.232 18.576 12.971 353 HA ILE 51 HA ILE 51 1.939 20.738 11.353 354 HB ILE 51 HB ILE 51 -0.038 18.645 10.848 355 HG12 ILE 51 HG12 ILE 51 2.606 18.860 9.713 356 HG13 ILE 51 HG13 ILE 51 2.303 17.972 11.049 357 HG21 ILE 51 HG21 ILE 51 -0.038 19.305 8.530 358 HG22 ILE 51 HG22 ILE 51 0.939 20.547 8.874 359 HG23 ILE 51 HG23 ILE 51 -0.574 20.526 9.445 360 HD11 ILE 51 HD11 ILE 51 2.411 16.551 9.131 361 HD12 ILE 51 HD12 ILE 51 1.218 17.385 8.427 362 HD13 ILE 51 HD13 ILE 51 0.918 16.505 9.750 363 H ALA 52 H ALA 52 -0.917 19.850 13.132 364 HA ALA 52 HA ALA 52 -2.503 21.902 12.139 365 HB1 ALA 52 HB1 ALA 52 -3.486 19.910 13.140 366 HB2 ALA 52 HB2 ALA 52 -4.093 21.223 13.862 367 HB3 ALA 52 HB3 ALA 52 -2.934 20.363 14.590 368 H SER 53 H SER 53 -0.357 21.745 14.791 369 HA SER 53 HA SER 53 -1.199 24.252 15.839 370 HB2 SER 53 HB2 SER 53 0.531 23.847 17.511 371 HB3 SER 53 HB3 SER 53 -0.382 22.503 17.341 372 HG SER 53 HG SER 53 1.181 21.454 16.442 373 H ALA 54 H ALA 54 0.475 23.409 13.307 374 HA ALA 54 HA ALA 54 2.105 24.146 12.082 375 HB1 ALA 54 HB1 ALA 54 0.788 26.185 11.979 376 HB2 ALA 54 HB2 ALA 54 2.354 26.535 11.783 377 HB3 ALA 54 HB3 ALA 54 1.640 26.795 13.210 378 H GLY 55 H GLY 55 2.794 23.373 14.908 379 HA2 GLY 55 HA2 GLY 55 5.206 24.741 15.418 380 HA3 GLY 55 HA3 GLY 55 4.678 23.400 16.185 381 H GLY 56 H GLY 56 4.293 21.853 13.805 382 HA2 GLY 56 HA2 GLY 56 6.964 20.940 13.516 383 HA3 GLY 56 HA3 GLY 56 5.632 20.251 12.868 384 H LEU 57 H LEU 57 4.970 23.041 11.798 385 HA LEU 57 HA LEU 57 6.013 22.522 9.275 386 HB2 LEU 57 HB2 LEU 57 4.556 24.833 10.203 387 HB3 LEU 57 HB3 LEU 57 4.939 24.615 8.630 388 HG LEU 57 HG LEU 57 3.199 22.876 10.124 389 HD11 LEU 57 HD11 LEU 57 1.394 23.811 8.841 390 HD12 LEU 57 HD12 LEU 57 2.426 24.846 8.150 391 HD13 LEU 57 HD13 LEU 57 2.107 24.957 9.732 392 HD21 LEU 57 HD21 LEU 57 2.665 21.853 7.993 393 HD22 LEU 57 HD22 LEU 57 4.243 21.690 8.305 394 HD23 LEU 57 HD23 LEU 57 3.738 22.817 7.262 395 H PHE 58 H PHE 58 7.110 24.481 11.839 396 HA PHE 58 HA PHE 58 8.892 26.013 10.388 397 HB2 PHE 58 HB2 PHE 58 9.108 25.178 13.158 398 HB3 PHE 58 HB3 PHE 58 10.022 26.367 12.511 399 HD1 PHE 58 HD1 PHE 58 7.294 25.830 14.443 400 HD2 PHE 58 HD2 PHE 58 8.586 28.302 11.360 401 HE1 PHE 58 HE1 PHE 58 5.602 27.440 15.032 402 HE2 PHE 58 HE2 PHE 58 6.893 29.920 11.930 403 HZ PHE 58 HZ PHE 58 5.386 29.485 13.767 404 H GLY 59 H GLY 59 9.059 22.762 11.439 405 HA2 GLY 59 HA2 GLY 59 11.828 22.442 11.138 406 HA3 GLY 59 HA3 GLY 59 10.727 21.236 11.185 407 H GLY 60 H GLY 60 9.198 22.454 8.984 408 HA2 GLY 60 HA2 GLY 60 10.413 21.131 6.859 409 HA3 GLY 60 HA3 GLY 60 9.117 22.120 6.755 410 H ILE 61 H ILE 61 10.860 24.262 8.049 411 HA ILE 61 HA ILE 61 11.720 25.453 5.694 412 HB ILE 61 HB ILE 61 12.492 26.199 8.401 413 HG12 ILE 61 HG12 ILE 61 10.154 26.284 8.167 414 HG13 ILE 61 HG13 ILE 61 10.755 27.791 8.357 415 HG21 ILE 61 HG21 ILE 61 13.071 28.377 7.501 416 HG22 ILE 61 HG22 ILE 61 12.731 27.854 6.009 417 HG23 ILE 61 HG23 ILE 61 13.989 27.235 6.816 418 HD11 ILE 61 HD11 ILE 61 9.015 27.808 6.701 419 HD12 ILE 61 HD12 ILE 61 9.822 26.720 5.818 420 HD13 ILE 61 HD13 ILE 61 10.417 28.212 6.006 421 H LEU 62 H LEU 62 13.309 23.725 8.238 422 HA LEU 62 HA LEU 62 15.874 23.979 7.152 423 HB2 LEU 62 HB2 LEU 62 14.778 22.596 9.386 424 HB3 LEU 62 HB3 LEU 62 16.225 22.056 8.856 425 HG LEU 62 HG LEU 62 17.127 24.246 9.258 426 HD11 LEU 62 HD11 LEU 62 15.947 25.814 10.620 427 HD12 LEU 62 HD12 LEU 62 14.628 24.880 10.559 428 HD13 LEU 62 HD13 LEU 62 15.177 25.593 9.215 429 HD21 LEU 62 HD21 LEU 62 17.237 23.952 11.679 430 HD22 LEU 62 HD22 LEU 62 17.398 22.523 10.940 431 HD23 LEU 62 HD23 LEU 62 15.982 22.935 11.603 432 H ASP 63 H ASP 63 13.352 21.734 6.789 433 HA ASP 63 HA ASP 63 14.765 19.587 5.857 434 HB2 ASP 63 HB2 ASP 63 12.413 19.466 6.370 435 HB3 ASP 63 HB3 ASP 63 12.084 20.356 5.041 436 H GLN 64 H GLN 64 14.096 22.528 4.348 437 HA GLN 64 HA GLN 64 14.348 21.658 1.733 438 HB2 GLN 64 HB2 GLN 64 14.743 24.320 2.801 439 HB3 GLN 64 HB3 GLN 64 14.644 24.016 1.200 440 HG2 GLN 64 HG2 GLN 64 12.419 23.216 1.513 441 HG3 GLN 64 HG3 GLN 64 12.523 23.594 3.098 442 HE21 GLN 64 HE21 GLN 64 11.410 26.792 2.714 443 HE22 GLN 64 HE22 GLN 64 11.679 25.435 3.755 444 H GLN 65 H GLN 65 16.643 21.677 4.028 445 HA GLN 65 HA GLN 65 18.730 21.515 2.042 446 HB2 GLN 65 HB2 GLN 65 19.035 22.773 4.619 447 HB3 GLN 65 HB3 GLN 65 20.282 22.472 3.609 448 HG2 GLN 65 HG2 GLN 65 19.263 23.943 1.997 449 HG3 GLN 65 HG3 GLN 65 18.126 24.316 3.109 450 HE21 GLN 65 HE21 GLN 65 19.937 26.788 4.649 451 HE22 GLN 65 HE22 GLN 65 18.421 25.968 4.477 452 H SER 66 H SER 66 17.508 19.265 2.498 453 HA SER 66 HA SER 66 19.117 17.830 4.414 454 HB2 SER 66 HB2 SER 66 17.016 18.193 5.516 455 HB3 SER 66 HB3 SER 66 16.210 17.623 4.215 456 HG SER 66 HG SER 66 17.055 16.305 6.269 457 H GLU 67 H GLU 67 19.342 15.508 4.029 458 HA GLU 67 HA GLU 67 19.348 14.856 1.309 459 HB2 GLU 67 HB2 GLU 67 19.646 13.132 3.610 460 HB3 GLU 67 HB3 GLU 67 19.928 12.632 2.081 461 HG2 GLU 67 HG2 GLU 67 21.707 14.223 1.927 462 HG3 GLU 67 HG3 GLU 67 21.456 14.617 3.492 463 H ASN 68 H ASN 68 17.114 14.594 3.828 464 HA ASN 68 HA ASN 68 15.392 12.819 2.379 465 HB2 ASN 68 HB2 ASN 68 15.223 13.790 5.109 466 HB3 ASN 68 HB3 ASN 68 14.093 12.802 4.465 467 HD21 ASN 68 HD21 ASN 68 17.388 11.311 6.046 468 HD22 ASN 68 HD22 ASN 68 16.973 12.992 6.093 469 H ARG 69 H ARG 69 15.935 15.674 1.764 470 HA ARG 69 HA ARG 69 13.841 17.283 2.389 471 HB2 ARG 69 HB2 ARG 69 15.761 18.150 1.330 472 HB3 ARG 69 HB3 ARG 69 15.470 17.260 -0.008 473 HG2 ARG 69 HG2 ARG 69 13.635 18.631 -0.531 474 HG3 ARG 69 HG3 ARG 69 13.903 19.513 0.817 475 HD2 ARG 69 HD2 ARG 69 16.127 19.996 -0.114 476 HD3 ARG 69 HD3 ARG 69 15.563 19.391 -1.523 477 HE ARG 69 HE ARG 69 13.757 21.298 -0.721 478 HH11 ARG 69 HH11 ARG 69 13.783 23.398 -1.447 479 HH12 ARG 69 HH12 ARG 69 15.182 24.037 -2.243 480 HH21 ARG 69 HH21 ARG 69 17.058 21.163 -1.928 481 HH22 ARG 69 HH22 ARG 69 17.007 22.793 -2.511 482 H TRP 70 H TRP 70 11.831 17.870 1.611 483 HA TRP 70 HA TRP 70 10.481 15.796 0.344 484 HB2 TRP 70 HB2 TRP 70 8.603 17.346 0.279 485 HB3 TRP 70 HB3 TRP 70 9.228 17.102 1.768 486 HD1 TRP 70 HD1 TRP 70 10.461 19.687 -0.703 487 HE1 TRP 70 HE1 TRP 70 10.325 22.018 0.199 488 HE3 TRP 70 HE3 TRP 70 8.234 18.552 3.633 489 HZ2 TRP 70 HZ2 TRP 70 9.354 23.165 2.575 490 HZ3 TRP 70 HZ3 TRP 70 7.705 20.345 5.174 491 HH2 TRP 70 HH2 TRP 70 8.257 22.632 4.631 492 H PHE 71 H PHE 71 9.567 15.587 -1.739 493 HA PHE 71 HA PHE 71 11.365 16.609 -3.620 494 HB2 PHE 71 HB2 PHE 71 10.419 15.121 -5.137 495 HB3 PHE 71 HB3 PHE 71 10.408 14.355 -3.695 496 HD1 PHE 71 HD1 PHE 71 8.174 14.415 -2.345 497 HD2 PHE 71 HD2 PHE 71 8.476 15.284 -6.405 498 HE1 PHE 71 HE1 PHE 71 5.810 13.991 -2.606 499 HE2 PHE 71 HE2 PHE 71 6.123 14.848 -6.680 500 HZ PHE 71 HZ PHE 71 4.793 14.179 -4.787 501 H LYS 72 H LYS 72 11.281 18.239 -5.043 502 HA LYS 72 HA LYS 72 8.957 19.863 -4.933 503 HB2 LYS 72 HB2 LYS 72 11.498 20.376 -6.258 504 HB3 LYS 72 HB3 LYS 72 10.300 21.484 -6.186 505 HG2 LYS 72 HG2 LYS 72 10.568 21.530 -3.800 506 HG3 LYS 72 HG3 LYS 72 11.864 20.550 -3.969 507 HD2 LYS 72 HD2 LYS 72 12.693 22.711 -3.768 508 HD3 LYS 72 HD3 LYS 72 12.904 22.270 -5.326 509 HE2 LYS 72 HE2 LYS 72 12.120 24.484 -5.348 510 HE3 LYS 72 HE3 LYS 72 10.895 23.548 -5.887 511 HZ1 LYS 72 HZ1 LYS 72 10.079 25.179 -4.392 512 HZ2 LYS 72 HZ2 LYS 72 11.063 24.633 -3.231 513 HZ3 LYS 72 HZ3 LYS 72 9.851 23.706 -3.765 514 H HIS 73 H HIS 73 7.573 20.414 -6.659 515 HA HIS 73 HA HIS 73 8.415 19.440 -9.233 516 HB2 HIS 73 HB2 HIS 73 6.022 18.777 -7.962 517 HB3 HIS 73 HB3 HIS 73 5.784 19.337 -9.478 518 HD1 HIS 73 HD1 HIS 73 7.904 16.730 -7.787 519 HD2 HIS 73 HD2 HIS 73 6.034 17.397 -11.368 520 HE1 HIS 73 HE1 HIS 73 8.205 14.718 -9.220 521 HE2 HIS 73 HE2 HIS 73 7.103 15.105 -11.394 522 H ILE 74 H ILE 74 8.899 21.169 -10.487 523 HA ILE 74 HA ILE 74 7.642 23.655 -10.097 524 HB ILE 74 HB ILE 74 9.222 22.843 -12.390 525 HG12 ILE 74 HG12 ILE 74 10.129 24.375 -10.114 526 HG13 ILE 74 HG13 ILE 74 10.403 22.772 -10.264 527 HG21 ILE 74 HG21 ILE 74 9.460 25.215 -12.852 528 HG22 ILE 74 HG22 ILE 74 8.487 25.560 -11.608 529 HG23 ILE 74 HG23 ILE 74 7.897 24.804 -12.910 530 HD11 ILE 74 HD11 ILE 74 12.360 23.997 -10.892 531 HD12 ILE 74 HD12 ILE 74 11.521 24.784 -12.029 532 HD13 ILE 74 HD13 ILE 74 11.792 23.196 -12.177 533 H MET 75 H MET 75 5.758 24.454 -11.125 534 HA MET 75 HA MET 75 4.620 22.922 -13.242 535 HB2 MET 75 HB2 MET 75 3.856 21.933 -11.108 536 HB3 MET 75 HB3 MET 75 3.035 23.323 -10.857 537 HG2 MET 75 HG2 MET 75 1.547 21.819 -11.599 538 HG3 MET 75 HG3 MET 75 1.789 22.899 -12.799 539 HE1 MET 75 HE1 MET 75 1.344 19.990 -15.198 540 HE2 MET 75 HE2 MET 75 1.097 21.574 -14.985 541 HE3 MET 75 HE3 MET 75 0.397 20.506 -13.993 542 H THR 76 H THR 76 2.940 24.038 -14.412 543 HA THR 76 HA THR 76 2.949 26.875 -14.024 544 HB THR 76 HB THR 76 1.707 26.885 -16.155 545 HG1 THR 76 HG1 THR 76 0.677 25.077 -16.385 546 HG21 THR 76 HG21 THR 76 3.545 26.190 -17.521 547 HG22 THR 76 HG22 THR 76 4.193 25.390 -16.274 548 HG23 THR 76 HG23 THR 76 4.125 27.006 -16.251 549 H GLY 77 H GLY 77 0.525 27.820 -14.636 550 HA2 GLY 77 HA2 GLY 77 -1.134 26.887 -12.552 551 HA3 GLY 77 HA3 GLY 77 -1.474 28.100 -13.591 552 H GLY 78 H GLY 78 -3.682 27.148 -13.456 553 HA2 GLY 78 HA2 GLY 78 -5.158 26.201 -14.997 554 HA3 GLY 78 HA3 GLY 78 -3.998 25.182 -15.531 555 H GLU 79 H GLU 79 -6.180 23.862 -15.237 556 HA GLU 79 HA GLU 79 -6.506 22.882 -12.587 557 HB2 GLU 79 HB2 GLU 79 -8.468 22.592 -13.501 558 HB3 GLU 79 HB3 GLU 79 -7.851 22.564 -15.013 559 HG2 GLU 79 HG2 GLU 79 -9.000 20.547 -14.535 560 HG3 GLU 79 HG3 GLU 79 -7.420 20.254 -14.822 561 H HIS 80 H HIS 80 -5.558 21.153 -11.620 562 HA HIS 80 HA HIS 80 -3.926 19.494 -13.315 563 HB2 HIS 80 HB2 HIS 80 -3.200 20.315 -10.639 564 HB3 HIS 80 HB3 HIS 80 -2.254 19.436 -11.638 565 HD1 HIS 80 HD1 HIS 80 -1.839 22.417 -10.287 566 HD2 HIS 80 HD2 HIS 80 -2.348 21.394 -14.216 567 HE1 HIS 80 HE1 HIS 80 -0.986 24.271 -11.705 568 HE2 HIS 80 HE2 HIS 80 -1.273 23.671 -14.075 569 H THR 81 H THR 81 -4.463 17.453 -13.362 570 HA THR 81 HA THR 81 -6.062 16.390 -11.252 571 HB THR 81 HB THR 81 -5.231 15.134 -13.766 572 HG1 THR 81 HG1 THR 81 -6.623 17.017 -13.888 573 HG21 THR 81 HG21 THR 81 -6.955 13.547 -13.395 574 HG22 THR 81 HG22 THR 81 -7.328 14.251 -11.988 575 HG23 THR 81 HG23 THR 81 -5.914 13.486 -12.159 576 H PHE 82 H PHE 82 -5.210 15.185 -9.570 577 HA PHE 82 HA PHE 82 -2.583 14.066 -10.032 578 HB2 PHE 82 HB2 PHE 82 -3.632 15.064 -7.532 579 HB3 PHE 82 HB3 PHE 82 -2.184 14.321 -7.667 580 HD1 PHE 82 HD1 PHE 82 -0.384 15.423 -9.086 581 HD2 PHE 82 HD2 PHE 82 -3.830 17.404 -7.862 582 HE1 PHE 82 HE1 PHE 82 0.680 17.545 -9.543 583 HE2 PHE 82 HE2 PHE 82 -2.773 19.529 -8.289 584 HZ PHE 82 HZ PHE 82 -0.513 19.602 -9.139 585 H THR 83 H THR 83 -2.377 11.891 -9.923 586 HA THR 83 HA THR 83 -4.545 10.500 -8.658 587 HB THR 83 HB THR 83 -3.198 9.578 -11.111 588 HG1 THR 83 HG1 THR 83 -4.440 11.422 -11.501 589 HG21 THR 83 HG21 THR 83 -4.965 7.969 -11.292 590 HG22 THR 83 HG22 THR 83 -5.638 8.526 -9.931 591 HG23 THR 83 HG23 THR 83 -4.219 7.753 -9.873 592 H TRP 84 H TRP 84 -4.107 9.023 -7.151 593 HA TRP 84 HA TRP 84 -1.435 7.863 -7.093 594 HB2 TRP 84 HB2 TRP 84 -3.055 8.642 -4.869 595 HB3 TRP 84 HB3 TRP 84 -1.822 7.583 -4.705 596 HD1 TRP 84 HD1 TRP 84 -1.388 10.689 -6.744 597 HE1 TRP 84 HE1 TRP 84 0.312 12.252 -5.775 598 HE3 TRP 84 HE3 TRP 84 -0.642 8.219 -2.457 599 HZ2 TRP 84 HZ2 TRP 84 1.814 12.309 -3.392 600 HZ3 TRP 84 HZ3 TRP 84 0.946 9.107 -0.854 601 HH2 TRP 84 HH2 TRP 84 2.167 11.137 -1.339 602 H THR 85 H THR 85 -1.470 5.539 -6.690 603 HA THR 85 HA THR 85 -4.078 4.362 -6.672 604 HB THR 85 HB THR 85 -3.186 2.669 -8.348 605 HG1 THR 85 HG1 THR 85 -1.013 3.729 -7.864 606 HG21 THR 85 HG21 THR 85 -3.604 4.054 -10.250 607 HG22 THR 85 HG22 THR 85 -3.445 5.384 -9.343 608 HG23 THR 85 HG23 THR 85 -4.706 4.396 -9.117 609 H TYR 86 H TYR 86 -4.093 2.029 -6.039 610 HA TYR 86 HA TYR 86 -1.733 1.297 -4.542 611 HB2 TYR 86 HB2 TYR 86 -4.424 1.055 -3.530 612 HB3 TYR 86 HB3 TYR 86 -3.102 0.484 -2.760 613 HD1 TYR 86 HD1 TYR 86 -4.941 3.474 -3.537 614 HD2 TYR 86 HD2 TYR 86 -1.550 2.022 -1.607 615 HE1 TYR 86 HE1 TYR 86 -4.623 5.620 -2.472 616 HE2 TYR 86 HE2 TYR 86 -1.246 4.169 -0.537 617 HH TYR 86 HH TYR 86 -2.667 6.967 -1.466 618 H THR 87 H THR 87 -1.118 -0.855 -4.662 619 HA THR 87 HA THR 87 -2.349 -2.227 -6.771 620 HB THR 87 HB THR 87 0.078 -2.314 -6.534 621 HG1 THR 87 HG1 THR 87 -0.515 -4.927 -6.224 622 HG21 THR 87 HG21 THR 87 1.080 -3.637 -4.792 623 HG22 THR 87 HG22 THR 87 -0.380 -3.962 -4.177 624 HG23 THR 87 HG23 THR 87 0.209 -2.457 -4.112 625 H ALA 88 H ALA 88 -2.968 -2.180 -3.573 626 HA ALA 88 HA ALA 88 -4.528 -4.606 -3.729 627 HB1 ALA 88 HB1 ALA 88 -2.586 -5.289 -2.515 628 HB2 ALA 88 HB2 ALA 88 -3.840 -5.253 -1.495 629 HB3 ALA 88 HB3 ALA 88 -2.759 -4.050 -1.491 630 HA PRO 89 HA PRO 89 -7.263 -1.718 -1.947 631 HB2 PRO 89 HB2 PRO 89 -9.156 -3.168 -0.767 632 HB3 PRO 89 HB3 PRO 89 -9.086 -3.151 -2.399 633 HG2 PRO 89 HG2 PRO 89 -8.013 -5.113 -0.626 634 HG3 PRO 89 HG3 PRO 89 -8.910 -5.362 -1.968 635 HD2 PRO 89 HD2 PRO 89 -6.316 -5.576 -2.078 636 HD3 PRO 89 HD3 PRO 89 -7.139 -4.987 -3.360 637 H HIS 90 H HIS 90 -7.448 -0.431 -0.211 638 HA HIS 90 HA HIS 90 -6.635 -1.597 2.317 639 HB2 HIS 90 HB2 HIS 90 -4.889 -0.184 1.270 640 HB3 HIS 90 HB3 HIS 90 -5.850 1.078 1.662 641 HD1 HIS 90 HD1 HIS 90 -6.322 1.495 4.308 642 HD2 HIS 90 HD2 HIS 90 -3.268 -1.050 3.304 643 HE1 HIS 90 HE1 HIS 90 -4.919 1.109 6.324 644 HE2 HIS 90 HE2 HIS 90 -3.065 -0.409 5.742 645 H ASN 91 H ASN 91 -7.910 -1.019 4.088 646 HA ASN 91 HA ASN 91 -10.356 0.209 3.506 647 HB2 ASN 91 HB2 ASN 91 -9.227 -0.442 6.077 648 HB3 ASN 91 HB3 ASN 91 -10.761 0.081 5.878 649 HD21 ASN 91 HD21 ASN 91 -11.264 -3.446 6.160 650 HD22 ASN 91 HD22 ASN 91 -11.024 -2.039 7.141 651 H THR 92 H THR 92 -11.144 2.316 4.204 652 HA THR 92 HA THR 92 -9.163 4.151 5.096 653 HB THR 92 HB THR 92 -10.540 4.651 2.549 654 HG1 THR 92 HG1 THR 92 -9.007 3.069 2.247 655 HG21 THR 92 HG21 THR 92 -9.084 6.522 2.294 656 HG22 THR 92 HG22 THR 92 -8.385 6.196 3.715 657 HG23 THR 92 HG23 THR 92 -9.922 6.698 3.666 658 H SER 93 H SER 93 -10.020 5.924 6.232 659 HA SER 93 HA SER 93 -12.854 5.933 6.543 660 HB2 SER 93 HB2 SER 93 -11.582 6.138 8.563 661 HB3 SER 93 HB3 SER 93 -10.816 7.456 7.975 662 HG SER 93 HG SER 93 -12.315 8.645 8.680 663 H GLN 94 H GLN 94 -10.305 8.159 5.647 664 HA GLN 94 HA GLN 94 -11.924 9.458 3.796 665 HB2 GLN 94 HB2 GLN 94 -11.873 11.681 4.831 666 HB3 GLN 94 HB3 GLN 94 -12.768 10.630 5.703 667 HG2 GLN 94 HG2 GLN 94 -11.052 10.400 7.263 668 HG3 GLN 94 HG3 GLN 94 -10.065 11.336 6.359 669 HE21 GLN 94 HE21 GLN 94 -12.253 13.019 9.112 670 HE22 GLN 94 HE22 GLN 94 -11.844 11.339 9.018 671 H TRP 95 H TRP 95 -10.790 11.304 2.631 672 HA TRP 95 HA TRP 95 -8.048 11.563 3.435 673 HB2 TRP 95 HB2 TRP 95 -7.278 11.640 1.139 674 HB3 TRP 95 HB3 TRP 95 -7.675 10.158 1.700 675 HD1 TRP 95 HD1 TRP 95 -9.261 12.764 -0.514 676 HE1 TRP 95 HE1 TRP 95 -10.647 11.729 -2.331 677 HE3 TRP 95 HE3 TRP 95 -8.725 8.015 0.929 678 HZ2 TRP 95 HZ2 TRP 95 -11.418 9.098 -2.969 679 HZ3 TRP 95 HZ3 TRP 95 -9.827 6.267 -0.342 680 HH2 TRP 95 HH2 TRP 95 -11.172 6.824 -2.272 681 H HIS 96 H HIS 96 -7.157 13.641 3.273 682 HA HIS 96 HA HIS 96 -8.809 15.642 2.113 683 HB2 HIS 96 HB2 HIS 96 -8.699 16.974 4.262 684 HB3 HIS 96 HB3 HIS 96 -9.867 15.843 4.103 685 HD1 HIS 96 HD1 HIS 96 -7.504 16.984 6.465 686 HD2 HIS 96 HD2 HIS 96 -8.990 13.310 5.417 687 HE1 HIS 96 HE1 HIS 96 -7.086 15.388 8.332 688 HE2 HIS 96 HE2 HIS 96 -7.958 13.172 7.709 689 H TYR 97 H TYR 97 -7.872 17.843 2.086 690 HA TYR 97 HA TYR 97 -5.024 17.607 1.827 691 HB2 TYR 97 HB2 TYR 97 -6.741 18.722 -0.246 692 HB3 TYR 97 HB3 TYR 97 -5.134 18.476 -0.398 693 HD1 TYR 97 HD1 TYR 97 -8.333 16.784 -0.374 694 HD2 TYR 97 HD2 TYR 97 -4.258 16.336 -1.101 695 HE1 TYR 97 HE1 TYR 97 -8.743 14.611 -1.357 696 HE2 TYR 97 HE2 TYR 97 -4.676 14.169 -2.080 697 HH TYR 97 HH TYR 97 -7.011 12.320 -1.648 698 H TYR 98 H TYR 98 -3.778 19.490 2.050 699 HA TYR 98 HA TYR 98 -5.239 21.910 2.571 700 HB2 TYR 98 HB2 TYR 98 -3.046 21.024 4.256 701 HB3 TYR 98 HB3 TYR 98 -3.893 22.403 4.480 702 HD1 TYR 98 HD1 TYR 98 -4.107 18.808 4.784 703 HD2 TYR 98 HD2 TYR 98 -5.916 22.428 5.767 704 HE1 TYR 98 HE1 TYR 98 -5.573 17.663 6.310 705 HE2 TYR 98 HE2 TYR 98 -7.360 21.274 7.317 706 HH TYR 98 HH TYR 98 -8.266 18.563 7.369 707 H ILE 99 H ILE 99 -3.790 23.904 2.424 708 HA ILE 99 HA ILE 99 -1.251 23.339 1.197 709 HB ILE 99 HB ILE 99 -1.478 25.295 -0.254 710 HG12 ILE 99 HG12 ILE 99 -4.296 25.276 0.303 711 HG13 ILE 99 HG13 ILE 99 -3.281 26.297 1.074 712 HG21 ILE 99 HG21 ILE 99 -2.882 24.192 -1.909 713 HG22 ILE 99 HG22 ILE 99 -3.445 23.196 -0.767 714 HG23 ILE 99 HG23 ILE 99 -1.895 23.113 -1.219 715 HD11 ILE 99 HD11 ILE 99 -4.344 27.423 -0.750 716 HD12 ILE 99 HD12 ILE 99 -3.757 26.330 -1.786 717 HD13 ILE 99 HD13 ILE 99 -2.753 27.341 -1.023 718 H THR 100 H THR 100 0.471 24.901 1.747 719 HA THR 100 HA THR 100 -0.145 26.362 4.096 720 HB THR 100 HB THR 100 2.245 27.062 3.984 721 HG1 THR 100 HG1 THR 100 3.541 25.877 2.622 722 HG21 THR 100 HG21 THR 100 2.995 24.914 4.776 723 HG22 THR 100 HG22 THR 100 1.688 24.207 4.139 724 HG23 THR 100 HG23 THR 100 1.532 25.210 5.398 725 H LYS 101 H LYS 101 -0.191 28.610 4.341 726 HA LYS 101 HA LYS 101 -0.905 29.966 1.955 727 HB2 LYS 101 HB2 LYS 101 -2.208 30.070 4.053 728 HB3 LYS 101 HB3 LYS 101 -0.973 30.909 4.716 729 HG2 LYS 101 HG2 LYS 101 -1.400 32.710 3.274 730 HG3 LYS 101 HG3 LYS 101 -2.606 31.869 2.562 731 HD2 LYS 101 HD2 LYS 101 -3.648 31.745 4.769 732 HD3 LYS 101 HD3 LYS 101 -2.555 32.858 5.253 733 HE2 LYS 101 HE2 LYS 101 -3.489 34.493 4.010 734 HE3 LYS 101 HE3 LYS 101 -4.179 33.435 2.975 735 HZ1 LYS 101 HZ1 LYS 101 -5.831 34.407 4.372 736 HZ2 LYS 101 HZ2 LYS 101 -5.054 33.866 5.682 737 HZ3 LYS 101 HZ3 LYS 101 -5.738 32.819 4.658 738 H LYS 102 H LYS 102 0.419 31.151 0.724 739 HA LYS 102 HA LYS 102 2.644 32.445 1.969 740 HB2 LYS 102 HB2 LYS 102 3.256 33.175 -0.154 741 HB3 LYS 102 HB3 LYS 102 2.921 31.578 -0.207 742 HG2 LYS 102 HG2 LYS 102 0.724 32.203 -1.110 743 HG3 LYS 102 HG3 LYS 102 1.332 33.707 -1.303 744 HD2 LYS 102 HD2 LYS 102 2.463 31.363 -2.567 745 HD3 LYS 102 HD3 LYS 102 1.456 32.396 -3.333 746 HE2 LYS 102 HE2 LYS 102 3.092 34.142 -3.060 747 HE3 LYS 102 HE3 LYS 102 4.106 33.055 -2.384 748 HZ1 LYS 102 HZ1 LYS 102 4.643 33.354 -4.683 749 HZ2 LYS 102 HZ2 LYS 102 3.145 32.911 -5.101 750 HZ3 LYS 102 HZ3 LYS 102 4.149 31.835 -4.432 751 H GLY 103 H GLY 103 2.871 34.780 2.260 752 HA2 GLY 103 HA2 GLY 103 2.082 36.911 1.963 753 HA3 GLY 103 HA3 GLY 103 0.682 36.344 1.340 754 H TRP 104 H TRP 104 1.351 34.987 4.351 755 HA TRP 104 HA TRP 104 -0.826 36.171 5.536 756 HB2 TRP 104 HB2 TRP 104 0.155 35.315 7.648 757 HB3 TRP 104 HB3 TRP 104 -0.124 34.198 6.489 758 HD1 TRP 104 HD1 TRP 104 2.953 36.345 6.968 759 HE1 TRP 104 HE1 TRP 104 5.050 34.980 7.016 760 HE3 TRP 104 HE3 TRP 104 0.780 31.850 6.666 761 HZ2 TRP 104 HZ2 TRP 104 5.616 32.224 6.965 762 HZ3 TRP 104 HZ3 TRP 104 2.183 29.877 6.663 763 HH2 TRP 104 HH2 TRP 104 4.580 30.075 6.823 764 H ASP 105 H ASP 105 -1.030 37.673 7.341 765 HA ASP 105 HA ASP 105 1.002 39.728 7.209 766 HB2 ASP 105 HB2 ASP 105 -0.728 41.307 7.624 767 HB3 ASP 105 HB3 ASP 105 -1.161 40.382 6.349 768 HA PRO 106 HA PRO 106 1.670 39.141 11.375 769 HB2 PRO 106 HB2 PRO 106 2.764 41.438 12.235 770 HB3 PRO 106 HB3 PRO 106 3.560 40.602 11.080 771 HG2 PRO 106 HG2 PRO 106 1.745 42.769 10.718 772 HG3 PRO 106 HG3 PRO 106 3.249 42.615 10.101 773 HD2 PRO 106 HD2 PRO 106 1.194 41.964 8.649 774 HD3 PRO 106 HD3 PRO 106 2.573 41.097 8.528 775 H ASP 107 H ASP 107 -0.756 41.220 10.697 776 HA ASP 107 HA ASP 107 -1.352 42.036 13.327 777 HB2 ASP 107 HB2 ASP 107 -2.123 43.201 11.326 778 HB3 ASP 107 HB3 ASP 107 -3.171 41.974 11.071 779 H LYS 108 H LYS 108 -1.528 39.143 11.855 780 HA LYS 108 HA LYS 108 -3.664 38.183 13.563 781 HB2 LYS 108 HB2 LYS 108 -3.060 37.302 10.869 782 HB3 LYS 108 HB3 LYS 108 -4.207 36.617 11.807 783 HG2 LYS 108 HG2 LYS 108 -5.491 38.562 11.753 784 HG3 LYS 108 HG3 LYS 108 -4.303 39.370 10.976 785 HD2 LYS 108 HD2 LYS 108 -4.611 37.861 9.113 786 HD3 LYS 108 HD3 LYS 108 -5.927 37.272 9.882 787 HE2 LYS 108 HE2 LYS 108 -6.606 38.935 8.313 788 HE3 LYS 108 HE3 LYS 108 -6.919 39.460 9.827 789 HZ1 LYS 108 HZ1 LYS 108 -5.896 41.185 8.560 790 HZ2 LYS 108 HZ2 LYS 108 -4.617 40.236 8.281 791 HZ3 LYS 108 HZ3 LYS 108 -4.926 40.756 9.781 792 HA PRO 109 HA PRO 109 -0.662 35.386 14.981 793 HB2 PRO 109 HB2 PRO 109 -2.072 33.275 15.778 794 HB3 PRO 109 HB3 PRO 109 -2.095 34.645 16.667 795 HG2 PRO 109 HG2 PRO 109 -4.020 33.795 14.725 796 HG3 PRO 109 HG3 PRO 109 -4.307 34.368 16.227 797 HD2 PRO 109 HD2 PRO 109 -4.521 35.945 14.205 798 HD3 PRO 109 HD3 PRO 109 -3.911 36.516 15.608 799 H LEU 110 H LEU 110 0.754 34.729 13.626 800 HA LEU 110 HA LEU 110 0.132 33.827 11.153 801 HB2 LEU 110 HB2 LEU 110 2.272 34.725 11.900 802 HB3 LEU 110 HB3 LEU 110 2.585 33.287 12.608 803 HG LEU 110 HG LEU 110 2.335 33.429 9.778 804 HD11 LEU 110 HD11 LEU 110 4.758 33.861 9.690 805 HD12 LEU 110 HD12 LEU 110 4.783 33.974 11.303 806 HD13 LEU 110 HD13 LEU 110 4.010 35.091 10.426 807 HD21 LEU 110 HD21 LEU 110 3.804 31.548 9.741 808 HD22 LEU 110 HD22 LEU 110 2.487 31.219 10.620 809 HD23 LEU 110 HD23 LEU 110 3.883 31.570 11.356 810 H LYS 111 H LYS 111 0.880 31.836 13.889 811 HA LYS 111 HA LYS 111 0.997 29.510 12.450 812 HB2 LYS 111 HB2 LYS 111 0.364 29.833 15.259 813 HB3 LYS 111 HB3 LYS 111 0.706 28.377 14.603 814 HG2 LYS 111 HG2 LYS 111 2.865 29.452 13.914 815 HG3 LYS 111 HG3 LYS 111 2.508 30.556 15.063 816 HD2 LYS 111 HD2 LYS 111 2.780 27.740 15.586 817 HD3 LYS 111 HD3 LYS 111 3.957 28.834 15.879 818 HE2 LYS 111 HE2 LYS 111 2.508 29.908 17.460 819 HE3 LYS 111 HE3 LYS 111 1.412 28.722 17.219 820 HZ1 LYS 111 HZ1 LYS 111 2.717 28.247 19.150 821 HZ2 LYS 111 HZ2 LYS 111 4.066 28.294 18.259 822 HZ3 LYS 111 HZ3 LYS 111 2.981 27.120 18.020 823 H ARG 112 H ARG 112 -1.815 31.128 13.538 824 HA ARG 112 HA ARG 112 -3.493 28.916 13.158 825 HB2 ARG 112 HB2 ARG 112 -4.051 31.720 13.443 826 HB3 ARG 112 HB3 ARG 112 -5.269 30.697 13.073 827 HG2 ARG 112 HG2 ARG 112 -4.713 29.489 15.115 828 HG3 ARG 112 HG3 ARG 112 -3.750 30.750 15.502 829 HD2 ARG 112 HD2 ARG 112 -5.662 32.204 15.396 830 HD3 ARG 112 HD3 ARG 112 -6.607 30.905 15.101 831 HE ARG 112 HE ARG 112 -5.279 30.433 17.474 832 HH11 ARG 112 HH11 ARG 112 -7.844 32.528 16.258 833 HH12 ARG 112 HH12 ARG 112 -8.564 32.698 17.824 834 HH21 ARG 112 HH21 ARG 112 -6.263 30.712 19.445 835 HH22 ARG 112 HH22 ARG 112 -7.685 31.689 19.594 836 H ALA 113 H ALA 113 -2.559 31.629 11.296 837 HA ALA 113 HA ALA 113 -4.194 30.965 9.101 838 HB1 ALA 113 HB1 ALA 113 -3.800 33.322 9.683 839 HB2 ALA 113 HB2 ALA 113 -3.331 33.070 8.156 840 HB3 ALA 113 HB3 ALA 113 -2.230 33.142 9.339 841 H ASP 114 H ASP 114 -1.662 29.403 9.947 842 HA ASP 114 HA ASP 114 0.172 29.847 7.903 843 HB2 ASP 114 HB2 ASP 114 0.554 28.811 10.176 844 HB3 ASP 114 HB3 ASP 114 0.031 27.414 9.511 845 H PHE 115 H PHE 115 -2.267 27.403 8.247 846 HA PHE 115 HA PHE 115 -1.918 26.859 5.461 847 HB2 PHE 115 HB2 PHE 115 -2.175 24.505 5.763 848 HB3 PHE 115 HB3 PHE 115 -0.915 25.022 6.664 849 HD1 PHE 115 HD1 PHE 115 -1.090 25.136 9.123 850 HD2 PHE 115 HD2 PHE 115 -4.135 23.571 6.763 851 HE1 PHE 115 HE1 PHE 115 -2.119 24.197 11.082 852 HE2 PHE 115 HE2 PHE 115 -5.157 22.597 8.712 853 HZ PHE 115 HZ PHE 115 -4.158 22.925 10.884 854 H GLU 116 H GLU 116 -3.748 25.960 4.290 855 HA GLU 116 HA GLU 116 -6.275 26.493 5.588 856 HB2 GLU 116 HB2 GLU 116 -5.517 27.487 2.976 857 HB3 GLU 116 HB3 GLU 116 -7.025 27.623 3.589 858 HG2 GLU 116 HG2 GLU 116 -6.198 29.025 5.319 859 HG3 GLU 116 HG3 GLU 116 -4.687 28.884 4.713 860 H LEU 117 H LEU 117 -8.065 25.188 4.907 861 HA LEU 117 HA LEU 117 -7.279 22.715 3.791 862 HB2 LEU 117 HB2 LEU 117 -8.961 22.776 5.474 863 HB3 LEU 117 HB3 LEU 117 -9.926 23.658 4.494 864 HG LEU 117 HG LEU 117 -9.948 21.634 3.052 865 HD11 LEU 117 HD11 LEU 117 -9.677 19.550 4.191 866 HD12 LEU 117 HD12 LEU 117 -9.159 20.333 5.507 867 HD13 LEU 117 HD13 LEU 117 -8.276 20.356 4.153 868 HD21 LEU 117 HD21 LEU 117 -11.843 20.758 4.284 869 HD22 LEU 117 HD22 LEU 117 -11.900 22.373 4.255 870 HD23 LEU 117 HD23 LEU 117 -11.385 21.606 5.582 871 H ILE 118 H ILE 118 -7.308 22.063 1.660 872 HA ILE 118 HA ILE 118 -8.691 23.834 -0.143 873 HB ILE 118 HB ILE 118 -6.231 23.548 -0.441 874 HG12 ILE 118 HG12 ILE 118 -7.685 23.000 -2.852 875 HG13 ILE 118 HG13 ILE 118 -7.751 24.464 -2.132 876 HG21 ILE 118 HG21 ILE 118 -5.462 21.615 -1.617 877 HG22 ILE 118 HG22 ILE 118 -6.937 20.961 -1.524 878 HG23 ILE 118 HG23 ILE 118 -6.069 21.190 -0.180 879 HD11 ILE 118 HD11 ILE 118 -6.173 24.500 -3.911 880 HD12 ILE 118 HD12 ILE 118 -5.344 23.296 -3.221 881 HD13 ILE 118 HD13 ILE 118 -5.409 24.746 -2.507 882 H GLY 119 H GLY 119 -9.120 20.941 1.265 883 HA2 GLY 119 HA2 GLY 119 -11.467 20.409 0.109 884 HA3 GLY 119 HA3 GLY 119 -10.420 19.653 -0.890 885 H ALA 120 H ALA 120 -12.508 18.408 0.561 886 HA ALA 120 HA ALA 120 -10.937 16.458 1.947 887 HB1 ALA 120 HB1 ALA 120 -11.655 17.882 3.750 888 HB2 ALA 120 HB2 ALA 120 -12.424 16.466 3.878 889 HB3 ALA 120 HB3 ALA 120 -13.192 17.751 3.268 890 H VAL 121 H VAL 121 -11.675 14.373 1.556 891 HA VAL 121 HA VAL 121 -14.322 14.142 0.492 892 HB VAL 121 HB VAL 121 -12.027 12.789 -0.681 893 HG11 VAL 121 HG11 VAL 121 -13.539 11.800 -2.273 894 HG12 VAL 121 HG12 VAL 121 -14.791 12.468 -1.498 895 HG13 VAL 121 HG13 VAL 121 -13.911 11.321 -0.774 896 HG21 VAL 121 HG21 VAL 121 -12.503 14.046 -2.695 897 HG22 VAL 121 HG22 VAL 121 -12.188 15.057 -1.473 898 HG23 VAL 121 HG23 VAL 121 -13.716 14.801 -1.938 899 HA PRO 122 HA PRO 122 -13.822 10.968 3.556 900 HB2 PRO 122 HB2 PRO 122 -16.308 10.492 4.245 901 HB3 PRO 122 HB3 PRO 122 -15.631 11.893 4.742 902 HG2 PRO 122 HG2 PRO 122 -17.321 11.484 2.465 903 HG3 PRO 122 HG3 PRO 122 -17.455 12.645 3.606 904 HD2 PRO 122 HD2 PRO 122 -16.278 13.151 1.326 905 HD3 PRO 122 HD3 PRO 122 -15.788 13.896 2.694 906 H HIS 123 H HIS 123 -14.184 8.702 3.803 907 HA HIS 123 HA HIS 123 -15.062 7.524 1.301 908 HB2 HIS 123 HB2 HIS 123 -12.696 7.372 1.433 909 HB3 HIS 123 HB3 HIS 123 -12.802 6.694 2.915 910 HD1 HIS 123 HD1 HIS 123 -13.748 4.191 3.078 911 HD2 HIS 123 HD2 HIS 123 -12.735 5.579 -0.643 912 HE1 HIS 123 HE1 HIS 123 -13.580 2.249 1.532 913 HE2 HIS 123 HE2 HIS 123 -12.962 3.061 -0.718 914 H ASP 124 H ASP 124 -17.042 7.190 1.923 915 HA ASP 124 HA ASP 124 -17.733 4.811 3.266 916 HB2 ASP 124 HB2 ASP 124 -17.302 6.029 5.248 917 HB3 ASP 124 HB3 ASP 124 -18.395 7.149 4.783 918 H GLY 125 H GLY 125 -19.679 7.544 3.716 919 HA2 GLY 125 HA2 GLY 125 -20.991 7.357 1.150 920 HA3 GLY 125 HA3 GLY 125 -21.539 8.194 2.441 921 H SER 126 H SER 126 -20.895 9.086 -0.363 922 HA SER 126 HA SER 126 -19.473 11.429 0.298 923 HB2 SER 126 HB2 SER 126 -17.839 9.412 -0.294 924 HB3 SER 126 HB3 SER 126 -18.014 10.113 -1.758 925 HG SER 126 HG SER 126 -16.254 10.806 -0.345 926 HA PRO 127 HA PRO 127 -21.590 12.538 -3.432 927 HB2 PRO 127 HB2 PRO 127 -20.443 14.800 -4.151 928 HB3 PRO 127 HB3 PRO 127 -21.293 14.792 -2.756 929 HG2 PRO 127 HG2 PRO 127 -18.478 14.463 -3.079 930 HG3 PRO 127 HG3 PRO 127 -19.251 15.495 -2.077 931 HD2 PRO 127 HD2 PRO 127 -18.381 13.226 -1.172 932 HD3 PRO 127 HD3 PRO 127 -19.779 13.847 -0.598 933 H ALA 128 H ALA 128 -20.821 13.521 -5.806 934 HA ALA 128 HA ALA 128 -19.626 11.384 -7.022 935 HB1 ALA 128 HB1 ALA 128 -20.954 13.029 -8.227 936 HB2 ALA 128 HB2 ALA 128 -19.553 12.797 -9.000 937 HB3 ALA 128 HB3 ALA 128 -19.758 14.106 -8.073 938 H SER 129 H SER 129 -18.132 13.877 -5.379 939 HA SER 129 HA SER 129 -15.640 13.741 -6.521 940 HB2 SER 129 HB2 SER 129 -16.058 14.467 -3.719 941 HB3 SER 129 HB3 SER 129 -15.019 15.190 -4.750 942 HG SER 129 HG SER 129 -16.497 16.594 -5.026 943 H ARG 130 H ARG 130 -16.995 11.270 -5.091 944 HA ARG 130 HA ARG 130 -15.189 10.321 -3.282 945 HB2 ARG 130 HB2 ARG 130 -17.502 9.462 -3.951 946 HB3 ARG 130 HB3 ARG 130 -16.695 8.539 -5.031 947 HG2 ARG 130 HG2 ARG 130 -15.614 7.402 -3.237 948 HG3 ARG 130 HG3 ARG 130 -16.450 8.310 -2.167 949 HD2 ARG 130 HD2 ARG 130 -17.617 6.399 -3.991 950 HD3 ARG 130 HD3 ARG 130 -17.499 6.205 -2.374 951 HE ARG 130 HE ARG 130 -19.025 8.474 -3.048 952 HH11 ARG 130 HH11 ARG 130 -19.250 5.000 -2.518 953 HH12 ARG 130 HH12 ARG 130 -20.958 5.071 -2.238 954 HH21 ARG 130 HH21 ARG 130 -21.212 8.472 -2.697 955 HH22 ARG 130 HH22 ARG 130 -22.046 6.997 -2.338 956 H ASN 131 H ASN 131 -14.640 10.576 -6.522 957 HA ASN 131 HA ASN 131 -13.128 8.365 -7.002 958 HB2 ASN 131 HB2 ASN 131 -13.218 10.971 -8.199 959 HB3 ASN 131 HB3 ASN 131 -12.003 9.986 -8.671 960 HD21 ASN 131 HD21 ASN 131 -15.488 9.647 -10.393 961 HD22 ASN 131 HD22 ASN 131 -14.934 11.016 -9.489 962 H LEU 132 H LEU 132 -10.983 7.786 -7.018 963 HA LEU 132 HA LEU 132 -9.517 8.764 -4.864 964 HB2 LEU 132 HB2 LEU 132 -9.455 6.482 -5.668 965 HB3 LEU 132 HB3 LEU 132 -8.655 6.999 -6.995 966 HG LEU 132 HG LEU 132 -6.719 7.347 -5.757 967 HD11 LEU 132 HD11 LEU 132 -6.572 6.899 -3.424 968 HD12 LEU 132 HD12 LEU 132 -8.163 6.613 -3.372 969 HD13 LEU 132 HD13 LEU 132 -7.618 8.100 -3.701 970 HD21 LEU 132 HD21 LEU 132 -6.272 5.053 -5.094 971 HD22 LEU 132 HD22 LEU 132 -7.079 5.069 -6.495 972 HD23 LEU 132 HD23 LEU 132 -7.858 4.739 -5.116 973 H SER 133 H SER 133 -9.634 9.745 -8.056 974 HA SER 133 HA SER 133 -7.053 10.993 -7.972 975 HB2 SER 133 HB2 SER 133 -7.697 9.957 -10.042 976 HB3 SER 133 HB3 SER 133 -8.976 10.967 -10.150 977 HG SER 133 HG SER 133 -6.367 11.444 -10.634 978 H HIS 134 H HIS 134 -6.750 13.056 -7.316 979 HA HIS 134 HA HIS 134 -9.127 14.616 -6.871 980 HB2 HIS 134 HB2 HIS 134 -7.803 14.146 -4.913 981 HB3 HIS 134 HB3 HIS 134 -6.527 14.897 -5.602 982 HD1 HIS 134 HD1 HIS 134 -6.134 16.807 -3.962 983 HD2 HIS 134 HD2 HIS 134 -9.990 16.525 -5.323 984 HE1 HIS 134 HE1 HIS 134 -7.393 18.813 -3.196 985 HE2 HIS 134 HE2 HIS 134 -9.712 18.678 -4.025 986 H HIS 135 H HIS 135 -9.526 16.539 -7.771 987 HA HIS 135 HA HIS 135 -7.588 17.526 -9.646 988 HB2 HIS 135 HB2 HIS 135 -10.419 18.096 -9.348 989 HB3 HIS 135 HB3 HIS 135 -9.499 18.782 -10.510 990 HD1 HIS 135 HD1 HIS 135 -8.765 17.358 -12.569 991 HD2 HIS 135 HD2 HIS 135 -11.242 15.475 -9.905 992 HE1 HIS 135 HE1 HIS 135 -9.606 15.269 -13.621 993 HE2 HIS 135 HE2 HIS 135 -11.089 14.103 -12.028 994 H ILE 136 H ILE 136 -6.516 19.464 -9.402 995 HA ILE 136 HA ILE 136 -7.570 21.244 -7.423 996 HB ILE 136 HB ILE 136 -4.700 20.697 -7.670 997 HG12 ILE 136 HG12 ILE 136 -6.370 20.083 -5.406 998 HG13 ILE 136 HG13 ILE 136 -5.883 18.974 -6.502 999 HG21 ILE 136 HG21 ILE 136 -4.377 22.253 -5.816 1000 HG22 ILE 136 HG22 ILE 136 -5.961 22.574 -5.804 1001 HG23 ILE 136 HG23 ILE 136 -5.053 23.031 -7.062 1002 HD11 ILE 136 HD11 ILE 136 -4.526 18.817 -4.522 1003 HD12 ILE 136 HD12 ILE 136 -4.084 20.364 -4.685 1004 HD13 ILE 136 HD13 ILE 136 -3.602 19.266 -5.770 1005 H TYR 137 H TYR 137 -8.085 23.211 -8.429 1006 HA TYR 137 HA TYR 137 -6.678 23.883 -10.791 1007 HB2 TYR 137 HB2 TYR 137 -8.965 24.452 -10.744 1008 HB3 TYR 137 HB3 TYR 137 -8.739 25.376 -9.417 1009 HD1 TYR 137 HD1 TYR 137 -8.003 27.680 -9.615 1010 HD2 TYR 137 HD2 TYR 137 -8.048 25.216 -12.966 1011 HE1 TYR 137 HE1 TYR 137 -7.505 29.578 -11.016 1012 HE2 TYR 137 HE2 TYR 137 -7.552 27.127 -14.369 1013 HH TYR 137 HH TYR 137 -7.108 29.304 -14.506 1014 H ILE 138 H ILE 138 -5.074 25.413 -11.067 1015 HA ILE 138 HA ILE 138 -4.344 26.921 -8.728 1016 HB ILE 138 HB ILE 138 -2.527 25.773 -10.716 1017 HG12 ILE 138 HG12 ILE 138 -3.196 24.179 -9.126 1018 HG13 ILE 138 HG13 ILE 138 -1.602 24.495 -8.968 1019 HG21 ILE 138 HG21 ILE 138 -0.680 26.760 -9.560 1020 HG22 ILE 138 HG22 ILE 138 -1.704 27.531 -8.573 1021 HG23 ILE 138 HG23 ILE 138 -1.658 27.907 -10.145 1022 HD11 ILE 138 HD11 ILE 138 -2.612 24.292 -6.804 1023 HD12 ILE 138 HD12 ILE 138 -3.643 25.487 -7.155 1024 HD13 ILE 138 HD13 ILE 138 -2.064 25.801 -6.999 1025 HA PRO 139 HA PRO 139 -4.851 30.132 -11.749 1026 HB2 PRO 139 HB2 PRO 139 -4.486 32.316 -10.298 1027 HB3 PRO 139 HB3 PRO 139 -5.877 31.484 -10.103 1028 HG2 PRO 139 HG2 PRO 139 -3.517 31.338 -8.505 1029 HG3 PRO 139 HG3 PRO 139 -5.060 31.490 -7.994 1030 HD2 PRO 139 HD2 PRO 139 -3.898 29.151 -8.017 1031 HD3 PRO 139 HD3 PRO 139 -5.501 29.279 -8.302 1032 H GLU 140 H GLU 140 -3.544 31.456 -13.064 1033 HA GLU 140 HA GLU 140 -0.731 31.127 -12.454 1034 HB2 GLU 140 HB2 GLU 140 -1.689 30.153 -14.539 1035 HB3 GLU 140 HB3 GLU 140 -1.639 31.682 -15.109 1036 HG2 GLU 140 HG2 GLU 140 0.648 31.761 -14.925 1037 HG3 GLU 140 HG3 GLU 140 0.684 30.367 -14.076 1038 H ASP 141 H ASP 141 -1.725 32.997 -11.008 1039 HA ASP 141 HA ASP 141 -1.359 35.486 -12.372 1040 HB2 ASP 141 HB2 ASP 141 -2.570 36.495 -10.565 1041 HB3 ASP 141 HB3 ASP 141 -3.420 35.204 -11.093 1042 H ARG 142 H ARG 142 0.409 33.435 -10.606 1043 HA ARG 142 HA ARG 142 2.281 35.351 -9.798 1044 HB2 ARG 142 HB2 ARG 142 2.113 34.939 -7.411 1045 HB3 ARG 142 HB3 ARG 142 0.698 35.531 -7.971 1046 HG2 ARG 142 HG2 ARG 142 0.094 33.059 -8.142 1047 HG3 ARG 142 HG3 ARG 142 1.243 32.911 -6.991 1048 HD2 ARG 142 HD2 ARG 142 0.070 34.316 -5.556 1049 HD3 ARG 142 HD3 ARG 142 -1.006 34.683 -6.728 1050 HE ARG 142 HE ARG 142 -0.824 31.987 -5.677 1051 HH11 ARG 142 HH11 ARG 142 -2.861 34.761 -6.478 1052 HH12 ARG 142 HH12 ARG 142 -4.309 33.915 -6.045 1053 HH21 ARG 142 HH21 ARG 142 -2.725 31.019 -5.119 1054 HH22 ARG 142 HH22 ARG 142 -4.233 31.853 -5.296 1055 H LEU 143 H LEU 143 4.252 34.565 -8.871 1056 HA LEU 143 HA LEU 143 4.595 31.754 -9.330 1057 HB2 LEU 143 HB2 LEU 143 6.815 32.123 -9.969 1058 HB3 LEU 143 HB3 LEU 143 5.816 33.026 -10.893 1059 HG LEU 143 HG LEU 143 7.322 34.202 -8.767 1060 HD11 LEU 143 HD11 LEU 143 8.978 34.768 -10.482 1061 HD12 LEU 143 HD12 LEU 143 8.126 33.929 -11.570 1062 HD13 LEU 143 HD13 LEU 143 8.860 33.161 -10.350 1063 HD21 LEU 143 HD21 LEU 143 7.022 36.254 -9.938 1064 HD22 LEU 143 HD22 LEU 143 5.587 35.611 -9.561 1065 HD23 LEU 143 HD23 LEU 143 6.156 35.492 -11.071 1066 H GLY 144 H GLY 144 6.037 30.524 -7.926 1067 HA2 GLY 144 HA2 GLY 144 7.591 30.970 -6.016 1068 HA3 GLY 144 HA3 GLY 144 6.335 31.758 -5.332 1069 H TYR 145 H TYR 145 7.929 29.383 -4.499 1070 HA TYR 145 HA TYR 145 6.067 27.313 -4.760 1071 HB2 TYR 145 HB2 TYR 145 7.810 25.883 -3.819 1072 HB3 TYR 145 HB3 TYR 145 8.457 26.839 -4.974 1073 HD1 TYR 145 HD1 TYR 145 9.933 28.759 -4.334 1074 HD2 TYR 145 HD2 TYR 145 8.543 26.012 -1.531 1075 HE1 TYR 145 HE1 TYR 145 11.581 29.542 -2.739 1076 HE2 TYR 145 HE2 TYR 145 10.199 26.782 0.039 1077 HH TYR 145 HH TYR 145 11.577 28.735 0.538 1078 H HIS 146 H HIS 146 5.018 26.019 -3.339 1079 HA HIS 146 HA HIS 146 5.293 26.566 -0.541 1080 HB2 HIS 146 HB2 HIS 146 3.085 26.961 -0.077 1081 HB3 HIS 146 HB3 HIS 146 3.485 27.993 -1.279 1082 HD1 HIS 146 HD1 HIS 146 1.298 25.155 -0.485 1083 HD2 HIS 146 HD2 HIS 146 2.278 27.401 -3.768 1084 HE1 HIS 146 HE1 HIS 146 -0.322 24.644 -2.301 1085 HE2 HIS 146 HE2 HIS 146 0.229 26.010 -4.279 1086 H VAL 147 H VAL 147 4.120 24.747 0.753 1087 HA VAL 147 HA VAL 147 4.216 22.411 -0.861 1088 HB VAL 147 HB VAL 147 4.204 21.123 1.241 1089 HG11 VAL 147 HG11 VAL 147 6.438 21.713 1.901 1090 HG12 VAL 147 HG12 VAL 147 6.317 23.095 1.071 1091 HG13 VAL 147 HG13 VAL 147 6.320 21.680 0.289 1092 HG21 VAL 147 HG21 VAL 147 4.470 22.276 3.328 1093 HG22 VAL 147 HG22 VAL 147 3.047 22.655 2.661 1094 HG23 VAL 147 HG23 VAL 147 4.283 23.694 2.575 1095 H ILE 148 H ILE 148 2.663 20.804 -0.995 1096 HA ILE 148 HA ILE 148 -0.008 21.550 -0.204 1097 HB ILE 148 HB ILE 148 0.769 19.527 -2.148 1098 HG12 ILE 148 HG12 ILE 148 -0.555 22.025 -2.669 1099 HG13 ILE 148 HG13 ILE 148 1.040 21.778 -2.918 1100 HG21 ILE 148 HG21 ILE 148 -1.606 19.247 -2.592 1101 HG22 ILE 148 HG22 ILE 148 -1.957 20.300 -1.416 1102 HG23 ILE 148 HG23 ILE 148 -1.297 18.869 -1.051 1103 HD11 ILE 148 HD11 ILE 148 -0.148 21.612 -5.007 1104 HD12 ILE 148 HD12 ILE 148 -1.065 20.424 -4.405 1105 HD13 ILE 148 HD13 ILE 148 0.515 20.180 -4.651 1106 H LEU 149 H LEU 149 -0.906 20.349 1.490 1107 HA LEU 149 HA LEU 149 0.642 18.116 2.506 1108 HB2 LEU 149 HB2 LEU 149 -1.270 19.737 3.929 1109 HB3 LEU 149 HB3 LEU 149 -0.314 18.595 4.600 1110 HG LEU 149 HG LEU 149 0.758 21.025 3.486 1111 HD11 LEU 149 HD11 LEU 149 0.888 21.872 5.731 1112 HD12 LEU 149 HD12 LEU 149 0.119 20.557 6.274 1113 HD13 LEU 149 HD13 LEU 149 -0.656 21.613 5.325 1114 HD21 LEU 149 HD21 LEU 149 2.727 20.476 4.733 1115 HD22 LEU 149 HD22 LEU 149 2.381 19.287 3.693 1116 HD23 LEU 149 HD23 LEU 149 2.023 19.121 5.262 1117 H ALA 150 H ALA 150 -0.446 16.090 2.842 1118 HA ALA 150 HA ALA 150 -3.282 16.098 2.363 1119 HB1 ALA 150 HB1 ALA 150 -2.379 15.603 0.200 1120 HB2 ALA 150 HB2 ALA 150 -3.152 14.299 0.765 1121 HB3 ALA 150 HB3 ALA 150 -1.537 14.368 0.817 1122 H VAL 151 H VAL 151 -4.431 14.372 3.293 1123 HA VAL 151 HA VAL 151 -2.897 12.816 5.151 1124 HB VAL 151 HB VAL 151 -5.490 13.923 5.899 1125 HG11 VAL 151 HG11 VAL 151 -4.823 13.463 8.165 1126 HG12 VAL 151 HG12 VAL 151 -3.410 12.882 7.635 1127 HG13 VAL 151 HG13 VAL 151 -4.785 12.104 7.290 1128 HG21 VAL 151 HG21 VAL 151 -4.386 15.702 7.085 1129 HG22 VAL 151 HG22 VAL 151 -4.069 15.809 5.503 1130 HG23 VAL 151 HG23 VAL 151 -2.959 15.203 6.511 1131 H TRP 152 H TRP 152 -3.528 10.684 5.458 1132 HA TRP 152 HA TRP 152 -5.927 9.796 4.098 1133 HB2 TRP 152 HB2 TRP 152 -3.926 9.185 2.893 1134 HB3 TRP 152 HB3 TRP 152 -3.422 8.356 4.208 1135 HD1 TRP 152 HD1 TRP 152 -4.970 6.145 4.827 1136 HE1 TRP 152 HE1 TRP 152 -6.099 4.447 3.370 1137 HE3 TRP 152 HE3 TRP 152 -5.070 8.892 0.657 1138 HZ2 TRP 152 HZ2 TRP 152 -6.865 4.375 0.654 1139 HZ3 TRP 152 HZ3 TRP 152 -6.049 7.949 -1.341 1140 HH2 TRP 152 HH2 TRP 152 -6.938 5.702 -1.326 1141 H ASP 153 H ASP 153 -7.336 9.432 5.781 1142 HA ASP 153 HA ASP 153 -6.257 8.302 8.161 1143 HB2 ASP 153 HB2 ASP 153 -8.905 9.363 7.658 1144 HB3 ASP 153 HB3 ASP 153 -8.471 8.754 9.110 1145 H VAL 154 H VAL 154 -6.692 6.269 8.995 1146 HA VAL 154 HA VAL 154 -8.490 4.621 7.423 1147 HB VAL 154 HB VAL 154 -6.158 3.720 8.900 1148 HG11 VAL 154 HG11 VAL 154 -6.571 1.533 7.971 1149 HG12 VAL 154 HG12 VAL 154 -7.922 2.082 7.271 1150 HG13 VAL 154 HG13 VAL 154 -7.825 1.994 8.883 1151 HG21 VAL 154 HG21 VAL 154 -5.173 3.248 6.740 1152 HG22 VAL 154 HG22 VAL 154 -5.504 4.826 6.863 1153 HG23 VAL 154 HG23 VAL 154 -6.480 3.859 6.010 1154 H ALA 155 H ALA 155 -10.253 3.696 8.534 1155 HA ALA 155 HA ALA 155 -10.600 4.593 11.177 1156 HB1 ALA 155 HB1 ALA 155 -12.517 4.382 9.690 1157 HB2 ALA 155 HB2 ALA 155 -12.781 3.487 11.010 1158 HB3 ALA 155 HB3 ALA 155 -12.308 2.780 9.635 1159 H ASP 156 H ASP 156 -9.893 1.629 9.681 1160 HA ASP 156 HA ASP 156 -10.387 0.039 11.869 1161 HB2 ASP 156 HB2 ASP 156 -8.809 -0.697 9.492 1162 HB3 ASP 156 HB3 ASP 156 -9.689 -1.756 10.371 1163 H THR 157 H THR 157 -7.698 1.813 11.337 1164 HA THR 157 HA THR 157 -6.147 0.021 12.948 1165 HB THR 157 HB THR 157 -4.110 0.887 11.770 1166 HG1 THR 157 HG1 THR 157 -5.151 1.699 9.576 1167 HG21 THR 157 HG21 THR 157 -4.414 -0.419 9.776 1168 HG22 THR 157 HG22 THR 157 -6.014 -0.431 10.009 1169 HG23 THR 157 HG23 THR 157 -5.043 -1.232 11.024 1170 H GLU 158 H GLU 158 -4.465 0.985 14.324 1171 HA GLU 158 HA GLU 158 -5.387 3.362 15.475 1172 HB2 GLU 158 HB2 GLU 158 -3.101 1.669 15.981 1173 HB3 GLU 158 HB3 GLU 158 -3.243 3.076 16.797 1174 HG2 GLU 158 HG2 GLU 158 -5.233 1.012 16.894 1175 HG3 GLU 158 HG3 GLU 158 -4.059 1.170 18.018 1176 H ASN 159 H ASN 159 -3.529 2.830 12.848 1177 HA ASN 159 HA ASN 159 -2.055 5.256 13.175 1178 HB2 ASN 159 HB2 ASN 159 -1.619 2.977 11.442 1179 HB3 ASN 159 HB3 ASN 159 -0.888 4.390 11.071 1180 HD21 ASN 159 HD21 ASN 159 1.874 3.423 12.870 1181 HD22 ASN 159 HD22 ASN 159 1.225 3.987 11.366 1182 H ALA 160 H ALA 160 -1.824 6.760 11.444 1183 HA ALA 160 HA ALA 160 -3.810 6.720 9.330 1184 HB1 ALA 160 HB1 ALA 160 -4.855 8.082 10.929 1185 HB2 ALA 160 HB2 ALA 160 -4.316 9.035 9.738 1186 HB3 ALA 160 HB3 ALA 160 -3.505 8.949 11.134 1187 H PHE 161 H PHE 161 -2.957 8.318 7.573 1188 HA PHE 161 HA PHE 161 -0.111 8.540 7.877 1189 HB2 PHE 161 HB2 PHE 161 -1.303 8.030 5.280 1190 HB3 PHE 161 HB3 PHE 161 0.247 7.743 5.704 1191 HD1 PHE 161 HD1 PHE 161 -2.648 6.171 4.946 1192 HD2 PHE 161 HD2 PHE 161 0.458 5.937 7.702 1193 HE1 PHE 161 HE1 PHE 161 -3.223 3.868 5.381 1194 HE2 PHE 161 HE2 PHE 161 -0.118 3.640 8.163 1195 HZ PHE 161 HZ PHE 161 -1.962 2.597 7.007 1196 H TYR 162 H TYR 162 1.050 10.211 6.907 1197 HA TYR 162 HA TYR 162 -0.575 12.306 5.759 1198 HB2 TYR 162 HB2 TYR 162 1.610 12.565 7.600 1199 HB3 TYR 162 HB3 TYR 162 1.243 13.808 6.607 1200 HD1 TYR 162 HD1 TYR 162 -0.178 11.779 9.270 1201 HD2 TYR 162 HD2 TYR 162 -0.430 15.372 7.196 1202 HE1 TYR 162 HE1 TYR 162 -1.812 12.588 10.861 1203 HE2 TYR 162 HE2 TYR 162 -2.041 16.185 8.798 1204 HH TYR 162 HH TYR 162 -3.819 15.058 10.412 1205 H GLN 163 H GLN 163 0.430 13.500 3.998 1206 HA GLN 163 HA GLN 163 2.971 12.541 3.094 1207 HB2 GLN 163 HB2 GLN 163 1.995 12.464 0.775 1208 HB3 GLN 163 HB3 GLN 163 1.897 11.148 1.738 1209 HG2 GLN 163 HG2 GLN 163 -0.297 12.972 1.627 1210 HG3 GLN 163 HG3 GLN 163 -0.128 11.847 0.455 1211 HE21 GLN 163 HE21 GLN 163 -0.525 9.316 3.283 1212 HE22 GLN 163 HE22 GLN 163 0.927 9.909 2.547 1213 H VAL 164 H VAL 164 4.027 14.048 1.593 1214 HA VAL 164 HA VAL 164 2.774 16.622 1.475 1215 HB VAL 164 HB VAL 164 4.195 16.744 3.425 1216 HG11 VAL 164 HG11 VAL 164 6.580 16.397 3.302 1217 HG12 VAL 164 HG12 VAL 164 6.439 15.972 1.748 1218 HG13 VAL 164 HG13 VAL 164 5.796 15.041 2.903 1219 HG21 VAL 164 HG21 VAL 164 5.566 18.649 2.893 1220 HG22 VAL 164 HG22 VAL 164 4.102 18.803 2.224 1221 HG23 VAL 164 HG23 VAL 164 5.363 18.355 1.316 1222 H ILE 165 H ILE 165 3.203 17.909 -0.282 1223 HA ILE 165 HA ILE 165 5.139 16.904 -2.145 1224 HB ILE 165 HB ILE 165 2.491 17.866 -2.983 1225 HG12 ILE 165 HG12 ILE 165 3.434 15.156 -3.162 1226 HG13 ILE 165 HG13 ILE 165 2.396 15.681 -2.016 1227 HG21 ILE 165 HG21 ILE 165 3.149 17.301 -5.236 1228 HG22 ILE 165 HG22 ILE 165 4.615 16.869 -4.709 1229 HG23 ILE 165 HG23 ILE 165 4.155 18.417 -4.639 1230 HD11 ILE 165 HD11 ILE 165 1.192 14.545 -3.750 1231 HD12 ILE 165 HD12 ILE 165 1.773 15.579 -4.850 1232 HD13 ILE 165 HD13 ILE 165 0.745 16.099 -3.715 1233 H ASP 166 H ASP 166 6.652 18.573 -2.557 1234 HA ASP 166 HA ASP 166 5.842 21.279 -2.046 1235 HB2 ASP 166 HB2 ASP 166 7.999 20.687 -1.356 1236 HB3 ASP 166 HB3 ASP 166 8.394 20.245 -2.878 1237 H VAL 167 H VAL 167 5.103 22.691 -3.608 1238 HA VAL 167 HA VAL 167 5.671 21.927 -6.316 1239 HB VAL 167 HB VAL 167 3.498 22.886 -6.991 1240 HG11 VAL 167 HG11 VAL 167 2.247 20.893 -6.424 1241 HG12 VAL 167 HG12 VAL 167 3.363 20.509 -5.319 1242 HG13 VAL 167 HG13 VAL 167 3.743 20.495 -6.890 1243 HG21 VAL 167 HG21 VAL 167 1.774 23.097 -5.321 1244 HG22 VAL 167 HG22 VAL 167 2.968 24.146 -5.023 1245 HG23 VAL 167 HG23 VAL 167 2.855 22.783 -4.160 1246 H ASP 168 H ASP 168 6.606 23.430 -7.602 1247 HA ASP 168 HA ASP 168 6.772 26.129 -6.538 1248 HB2 ASP 168 HB2 ASP 168 8.800 24.844 -7.214 1249 HB3 ASP 168 HB3 ASP 168 8.384 25.321 -8.719 1250 H LEU 169 H LEU 169 4.840 27.012 -7.125 1251 HA LEU 169 HA LEU 169 3.779 26.426 -9.722 1252 HB2 LEU 169 HB2 LEU 169 2.640 28.013 -7.614 1253 HB3 LEU 169 HB3 LEU 169 1.853 27.555 -8.970 1254 HG LEU 169 HG LEU 169 2.789 25.680 -6.999 1255 HD11 LEU 169 HD11 LEU 169 0.498 25.548 -6.246 1256 HD12 LEU 169 HD12 LEU 169 0.093 26.721 -7.282 1257 HD13 LEU 169 HD13 LEU 169 1.069 27.046 -6.034 1258 HD21 LEU 169 HD21 LEU 169 1.390 24.078 -8.077 1259 HD22 LEU 169 HD22 LEU 169 2.505 24.636 -9.106 1260 HD23 LEU 169 HD23 LEU 169 0.984 25.175 -9.193 1261 H VAL 170 H VAL 170 4.199 27.707 -11.470 1262 HA VAL 170 HA VAL 170 4.897 30.395 -10.871 1263 HB VAL 170 HB VAL 170 6.810 30.358 -12.350 1264 HG11 VAL 170 HG11 VAL 170 8.313 28.979 -11.042 1265 HG12 VAL 170 HG12 VAL 170 7.043 28.250 -10.356 1266 HG13 VAL 170 HG13 VAL 170 7.330 29.815 -10.068 1267 HG21 VAL 170 HG21 VAL 170 7.580 28.287 -13.339 1268 HG22 VAL 170 HG22 VAL 170 6.109 28.662 -13.896 1269 HG23 VAL 170 HG23 VAL 170 6.277 27.527 -12.756 1270 H ASN 171 H ASN 171 5.048 31.869 -12.821 1271 HA ASN 171 HA ASN 171 2.873 31.259 -14.565 1272 HB2 ASN 171 HB2 ASN 171 4.389 33.715 -14.277 1273 HB3 ASN 171 HB3 ASN 171 3.154 33.560 -15.335 1274 HD21 ASN 171 HD21 ASN 171 1.773 35.303 -12.491 1275 HD22 ASN 171 HD22 ASN 171 2.891 35.607 -13.777 1276 H LYS 172 H LYS 172 3.091 30.898 -16.774 1277 HA LYS 172 HA LYS 172 4.080 30.306 -18.604 1278 HB2 LYS 172 HB2 LYS 172 4.588 32.646 -18.781 1279 HB3 LYS 172 HB3 LYS 172 6.015 32.402 -18.025 1280 HG2 LYS 172 HG2 LYS 172 6.376 32.734 -20.333 1281 HG3 LYS 172 HG3 LYS 172 6.816 31.216 -19.923 1282 HD2 LYS 172 HD2 LYS 172 4.733 30.412 -20.765 1283 HD3 LYS 172 HD3 LYS 172 4.356 31.931 -21.231 1284 HE2 LYS 172 HE2 LYS 172 6.177 31.950 -22.724 1285 HE3 LYS 172 HE3 LYS 172 6.623 30.461 -22.224 1286 HZ1 LYS 172 HZ1 LYS 172 5.419 30.311 -24.260 1287 HZ2 LYS 172 HZ2 LYS 172 4.154 31.049 -23.575 1288 HZ3 LYS 172 HZ3 LYS 172 4.596 29.574 -23.079 Start of MODEL 19 1 H1 HIS 1 H1 HIS 1 -0.153 4.894 3.847 2 H2 HIS 1 H2 HIS 1 1.012 4.890 2.725 3 H3 HIS 1 H3 HIS 1 -0.256 3.896 2.579 4 HA HIS 1 HA HIS 1 -1.675 5.667 2.267 5 HB2 HIS 1 HB2 HIS 1 -0.874 7.940 2.083 6 HB3 HIS 1 HB3 HIS 1 -0.626 7.333 3.579 7 HD1 HIS 1 HD1 HIS 1 1.268 8.994 4.179 8 HD2 HIS 1 HD2 HIS 1 1.980 6.670 0.877 9 HE1 HIS 1 HE1 HIS 1 3.655 9.256 3.522 10 HE2 HIS 1 HE2 HIS 1 4.110 7.842 1.556 11 H GLY 2 H GLY 2 -0.246 3.749 0.645 12 HA2 GLY 2 HA2 GLY 2 -0.186 3.421 -1.571 13 HA3 GLY 2 HA3 GLY 2 -1.182 4.705 -1.729 14 H PHE 3 H PHE 3 -0.432 5.232 -3.732 15 HA PHE 3 HA PHE 3 2.210 6.324 -3.780 16 HB2 PHE 3 HB2 PHE 3 0.953 4.756 -5.896 17 HB3 PHE 3 HB3 PHE 3 2.398 5.491 -6.093 18 HD1 PHE 3 HD1 PHE 3 4.428 4.501 -5.284 19 HD2 PHE 3 HD2 PHE 3 0.746 2.765 -4.407 20 HE1 PHE 3 HE1 PHE 3 5.557 2.552 -4.423 21 HE2 PHE 3 HE2 PHE 3 1.869 0.813 -3.542 22 HZ PHE 3 HZ PHE 3 4.275 0.701 -3.559 23 H ILE 4 H ILE 4 2.668 8.106 -5.138 24 HA ILE 4 HA ILE 4 0.366 9.583 -6.013 25 HB ILE 4 HB ILE 4 3.151 10.404 -6.033 26 HG12 ILE 4 HG12 ILE 4 1.067 11.426 -4.333 27 HG13 ILE 4 HG13 ILE 4 2.083 10.241 -3.853 28 HG21 ILE 4 HG21 ILE 4 2.363 12.601 -6.676 29 HG22 ILE 4 HG22 ILE 4 0.850 12.037 -6.772 30 HG23 ILE 4 HG23 ILE 4 1.971 11.526 -7.819 31 HD11 ILE 4 HD11 ILE 4 2.819 12.352 -2.979 32 HD12 ILE 4 HD12 ILE 4 2.926 12.951 -4.477 33 HD13 ILE 4 HD13 ILE 4 3.932 11.777 -4.002 34 H GLU 5 H GLU 5 -0.362 9.177 -8.102 35 HA GLU 5 HA GLU 5 1.367 7.720 -9.841 36 HB2 GLU 5 HB2 GLU 5 -0.952 7.087 -9.564 37 HB3 GLU 5 HB3 GLU 5 -1.391 8.499 -10.257 38 HG2 GLU 5 HG2 GLU 5 -0.139 7.678 -12.230 39 HG3 GLU 5 HG3 GLU 5 -0.258 6.212 -11.519 40 H LYS 6 H LYS 6 -0.381 10.712 -9.769 41 HA LYS 6 HA LYS 6 1.372 11.827 -11.775 42 HB2 LYS 6 HB2 LYS 6 -1.469 12.358 -11.816 43 HB3 LYS 6 HB3 LYS 6 -0.384 12.884 -12.917 44 HG2 LYS 6 HG2 LYS 6 -1.120 10.114 -12.646 45 HG3 LYS 6 HG3 LYS 6 -1.811 11.118 -13.733 46 HD2 LYS 6 HD2 LYS 6 0.221 11.319 -14.895 47 HD3 LYS 6 HD3 LYS 6 0.985 10.419 -13.766 48 HE2 LYS 6 HE2 LYS 6 -0.510 8.584 -14.326 49 HE3 LYS 6 HE3 LYS 6 -1.075 9.487 -15.563 50 HZ1 LYS 6 HZ1 LYS 6 0.508 7.928 -16.346 51 HZ2 LYS 6 HZ2 LYS 6 1.624 8.536 -15.346 52 HZ3 LYS 6 HZ3 LYS 6 1.064 9.430 -16.571 53 HA PRO 7 HA PRO 7 1.720 14.177 -12.541 54 HB2 PRO 7 HB2 PRO 7 3.146 16.356 -11.877 55 HB3 PRO 7 HB3 PRO 7 1.532 16.513 -12.070 56 HG2 PRO 7 HG2 PRO 7 2.977 16.169 -9.643 57 HG3 PRO 7 HG3 PRO 7 1.786 17.240 -9.959 58 HD2 PRO 7 HD2 PRO 7 1.281 15.006 -8.702 59 HD3 PRO 7 HD3 PRO 7 0.160 15.692 -9.671 60 H GLY 8 H GLY 8 3.031 12.631 -13.154 61 HA2 GLY 8 HA2 GLY 8 5.077 11.746 -13.455 62 HA3 GLY 8 HA3 GLY 8 5.739 13.038 -12.706 63 H SER 9 H SER 9 7.264 11.107 -12.233 64 HA SER 9 HA SER 9 6.340 9.491 -10.119 65 HB2 SER 9 HB2 SER 9 7.942 8.538 -11.646 66 HB3 SER 9 HB3 SER 9 9.033 9.684 -11.243 67 HG SER 9 HG SER 9 8.869 8.807 -9.074 68 H ARG 10 H ARG 10 6.594 9.721 -7.928 69 HA ARG 10 HA ARG 10 7.906 12.026 -6.995 70 HB2 ARG 10 HB2 ARG 10 7.247 11.334 -4.817 71 HB3 ARG 10 HB3 ARG 10 5.988 11.138 -5.838 72 HG2 ARG 10 HG2 ARG 10 6.501 8.790 -5.949 73 HG3 ARG 10 HG3 ARG 10 7.664 9.024 -4.827 74 HD2 ARG 10 HD2 ARG 10 6.025 9.675 -3.249 75 HD3 ARG 10 HD3 ARG 10 4.855 9.476 -4.371 76 HE ARG 10 HE ARG 10 6.308 7.105 -4.065 77 HH11 ARG 10 HH11 ARG 10 3.752 8.941 -2.478 78 HH12 ARG 10 HH12 ARG 10 3.100 7.528 -1.718 79 HH21 ARG 10 HH21 ARG 10 5.382 5.356 -3.102 80 HH22 ARG 10 HH22 ARG 10 4.006 5.539 -2.066 81 H ALA 11 H ALA 11 8.837 8.831 -7.563 82 HA ALA 11 HA ALA 11 10.820 8.710 -5.609 83 HB1 ALA 11 HB1 ALA 11 9.760 6.684 -6.493 84 HB2 ALA 11 HB2 ALA 11 11.366 6.551 -6.630 85 HB3 ALA 11 HB3 ALA 11 10.473 6.939 -7.922 86 H ALA 12 H ALA 12 10.879 9.633 -8.902 87 HA ALA 12 HA ALA 12 13.591 9.409 -9.299 88 HB1 ALA 12 HB1 ALA 12 12.041 9.751 -11.140 89 HB2 ALA 12 HB2 ALA 12 13.219 10.855 -11.229 90 HB3 ALA 12 HB3 ALA 12 11.770 11.264 -10.638 91 H LEU 13 H LEU 13 11.767 11.825 -7.757 92 HA LEU 13 HA LEU 13 13.921 13.676 -7.720 93 HB2 LEU 13 HB2 LEU 13 11.170 13.823 -6.872 94 HB3 LEU 13 HB3 LEU 13 12.200 15.015 -6.441 95 HG LEU 13 HG LEU 13 12.441 15.586 -8.730 96 HD11 LEU 13 HD11 LEU 13 10.929 14.808 -10.391 97 HD12 LEU 13 HD12 LEU 13 10.343 13.716 -9.352 98 HD13 LEU 13 HD13 LEU 13 11.873 13.605 -9.865 99 HD21 LEU 13 HD21 LEU 13 10.226 16.631 -8.870 100 HD22 LEU 13 HD22 LEU 13 10.798 16.739 -7.361 101 HD23 LEU 13 HD23 LEU 13 9.693 15.617 -7.728 102 H CYS 14 H CYS 14 13.151 11.129 -5.929 103 HA CYS 14 HA CYS 14 13.536 12.244 -3.345 104 HB2 CYS 14 HB2 CYS 14 12.032 10.456 -3.851 105 HB3 CYS 14 HB3 CYS 14 13.322 9.515 -4.196 106 H SER 15 H SER 15 15.400 10.523 -5.622 107 HA SER 15 HA SER 15 17.387 9.712 -3.856 108 HB2 SER 15 HB2 SER 15 17.036 8.576 -5.983 109 HB3 SER 15 HB3 SER 15 17.516 9.918 -6.780 110 HG SER 15 HG SER 15 18.978 7.954 -5.944 111 H GLU 16 H GLU 16 19.598 10.268 -3.658 112 HA GLU 16 HA GLU 16 20.198 12.923 -3.517 113 HB2 GLU 16 HB2 GLU 16 22.033 10.696 -3.885 114 HB3 GLU 16 HB3 GLU 16 22.522 12.172 -3.387 115 HG2 GLU 16 HG2 GLU 16 21.578 11.910 -1.345 116 HG3 GLU 16 HG3 GLU 16 20.670 10.647 -1.843 117 H ALA 17 H ALA 17 20.445 10.751 -6.137 118 HA ALA 17 HA ALA 17 22.140 12.141 -7.743 119 HB1 ALA 17 HB1 ALA 17 21.404 9.862 -8.231 120 HB2 ALA 17 HB2 ALA 17 21.211 10.776 -9.551 121 HB3 ALA 17 HB3 ALA 17 19.937 10.420 -8.621 122 H PHE 18 H PHE 18 18.833 12.802 -7.131 123 HA PHE 18 HA PHE 18 18.592 14.464 -9.403 124 HB2 PHE 18 HB2 PHE 18 16.741 13.177 -8.289 125 HB3 PHE 18 HB3 PHE 18 16.684 14.414 -7.225 126 HD1 PHE 18 HD1 PHE 18 15.727 16.573 -7.848 127 HD2 PHE 18 HD2 PHE 18 15.929 13.441 -10.579 128 HE1 PHE 18 HE1 PHE 18 14.285 17.795 -9.345 129 HE2 PHE 18 HE2 PHE 18 14.461 14.641 -12.074 130 HZ PHE 18 HZ PHE 18 13.653 16.832 -11.465 131 H GLY 19 H GLY 19 19.791 14.905 -6.340 132 HA2 GLY 19 HA2 GLY 19 19.433 17.776 -6.503 133 HA3 GLY 19 HA3 GLY 19 19.703 16.962 -5.113 134 H PHE 20 H PHE 20 21.542 15.446 -7.111 135 HA PHE 20 HA PHE 20 23.646 15.251 -7.446 136 HB2 PHE 20 HB2 PHE 20 23.374 17.292 -8.775 137 HB3 PHE 20 HB3 PHE 20 23.978 18.139 -7.515 138 HD1 PHE 20 HD1 PHE 20 24.878 15.589 -9.920 139 HD2 PHE 20 HD2 PHE 20 26.307 18.478 -7.291 140 HE1 PHE 20 HE1 PHE 20 27.111 15.240 -10.765 141 HE2 PHE 20 HE2 PHE 20 28.546 18.138 -8.124 142 HZ PHE 20 HZ PHE 20 28.956 16.503 -9.850 143 H LEU 21 H LEU 21 23.369 17.674 -4.984 144 HA LEU 21 HA LEU 21 25.709 16.608 -3.748 145 HB2 LEU 21 HB2 LEU 21 24.307 19.087 -3.163 146 HB3 LEU 21 HB3 LEU 21 25.701 18.655 -2.430 147 HG LEU 21 HG LEU 21 25.518 19.291 -5.228 148 HD11 LEU 21 HD11 LEU 21 26.557 21.395 -4.642 149 HD12 LEU 21 HD12 LEU 21 26.486 20.992 -3.078 150 HD13 LEU 21 HD13 LEU 21 25.123 21.262 -3.905 151 HD21 LEU 21 HD21 LEU 21 27.912 19.348 -5.195 152 HD22 LEU 21 HD22 LEU 21 27.383 17.878 -4.777 153 HD23 LEU 21 HD23 LEU 21 27.906 18.902 -3.640 154 H ASN 22 H ASN 22 22.375 16.683 -3.363 155 HA ASN 22 HA ASN 22 22.537 15.386 -0.850 156 HB2 ASN 22 HB2 ASN 22 21.307 17.999 -1.142 157 HB3 ASN 22 HB3 ASN 22 20.762 17.005 0.033 158 HD21 ASN 22 HD21 ASN 22 23.974 19.212 0.628 159 HD22 ASN 22 HD22 ASN 22 23.012 19.295 -0.809 160 H LEU 23 H LEU 23 20.521 14.388 -0.103 161 HA LEU 23 HA LEU 23 18.781 13.722 -2.215 162 HB2 LEU 23 HB2 LEU 23 17.812 12.193 -0.834 163 HB3 LEU 23 HB3 LEU 23 19.390 12.192 -0.414 164 HG LEU 23 HG LEU 23 17.352 13.460 1.158 165 HD11 LEU 23 HD11 LEU 23 17.562 11.494 2.594 166 HD12 LEU 23 HD12 LEU 23 18.617 10.853 1.550 167 HD13 LEU 23 HD13 LEU 23 17.070 11.043 1.121 168 HD21 LEU 23 HD21 LEU 23 18.931 13.556 2.917 169 HD22 LEU 23 HD22 LEU 23 19.447 14.409 1.644 170 HD23 LEU 23 HD23 LEU 23 20.068 12.946 1.942 171 H ASN 24 H ASN 24 16.427 14.034 -2.230 172 HA ASN 24 HA ASN 24 15.593 16.348 -0.666 173 HB2 ASN 24 HB2 ASN 24 15.834 16.719 -3.097 174 HB3 ASN 24 HB3 ASN 24 14.487 15.809 -3.252 175 HD21 ASN 24 HD21 ASN 24 12.576 18.289 -1.333 176 HD22 ASN 24 HD22 ASN 24 13.035 16.640 -1.072 177 H CYS 25 H CYS 25 15.337 14.255 0.738 178 HA CYS 25 HA CYS 25 12.624 13.559 0.647 179 HB2 CYS 25 HB2 CYS 25 14.499 11.930 -0.462 180 HB3 CYS 25 HB3 CYS 25 13.975 11.171 0.886 181 H GLY 26 H GLY 26 15.656 13.167 2.251 182 HA2 GLY 26 HA2 GLY 26 16.070 12.779 4.440 183 HA3 GLY 26 HA3 GLY 26 14.534 13.211 4.790 184 H SER 27 H SER 27 14.397 11.616 6.412 185 HA SER 27 HA SER 27 14.847 8.974 5.927 186 HB2 SER 27 HB2 SER 27 14.567 9.925 8.178 187 HB3 SER 27 HB3 SER 27 12.960 10.028 7.907 188 HG SER 27 HG SER 27 13.576 8.219 9.135 189 H VAL 28 H VAL 28 12.313 10.726 4.720 190 HA VAL 28 HA VAL 28 10.287 8.866 4.767 191 HB VAL 28 HB VAL 28 10.662 10.902 2.705 192 HG11 VAL 28 HG11 VAL 28 8.268 10.897 2.436 193 HG12 VAL 28 HG12 VAL 28 8.143 9.715 3.532 194 HG13 VAL 28 HG13 VAL 28 8.866 9.429 2.114 195 HG21 VAL 28 HG21 VAL 28 9.374 12.399 4.123 196 HG22 VAL 28 HG22 VAL 28 10.720 11.939 4.891 197 HG23 VAL 28 HG23 VAL 28 9.303 11.255 5.264 198 H MET 29 H MET 29 13.105 8.966 2.925 199 HA MET 29 HA MET 29 12.292 7.453 0.805 200 HB2 MET 29 HB2 MET 29 14.613 7.174 0.312 201 HB3 MET 29 HB3 MET 29 14.419 8.673 0.931 202 HG2 MET 29 HG2 MET 29 15.152 7.896 3.011 203 HG3 MET 29 HG3 MET 29 15.370 6.409 2.371 204 HE1 MET 29 HE1 MET 29 19.037 7.718 2.898 205 HE2 MET 29 HE2 MET 29 18.020 6.525 3.295 206 HE3 MET 29 HE3 MET 29 17.774 8.020 3.862 207 H TYR 30 H TYR 30 12.512 6.368 3.912 208 HA TYR 30 HA TYR 30 13.427 3.758 3.343 209 HB2 TYR 30 HB2 TYR 30 13.833 4.264 5.518 210 HB3 TYR 30 HB3 TYR 30 12.429 5.083 5.677 211 HD1 TYR 30 HD1 TYR 30 13.780 1.710 5.588 212 HD2 TYR 30 HD2 TYR 30 10.522 4.055 6.684 213 HE1 TYR 30 HE1 TYR 30 12.761 -0.198 6.672 214 HE2 TYR 30 HE2 TYR 30 9.529 2.152 7.790 215 HH TYR 30 HH TYR 30 10.340 -0.069 8.847 216 H GLU 31 H GLU 31 10.353 5.286 3.804 217 HA GLU 31 HA GLU 31 9.100 3.140 2.400 218 HB2 GLU 31 HB2 GLU 31 8.522 3.649 5.110 219 HB3 GLU 31 HB3 GLU 31 7.202 3.476 4.164 220 HG2 GLU 31 HG2 GLU 31 8.882 1.392 3.636 221 HG3 GLU 31 HG3 GLU 31 8.697 1.492 5.256 222 HA PRO 32 HA PRO 32 7.662 7.258 1.279 223 HB2 PRO 32 HB2 PRO 32 7.696 7.063 -1.378 224 HB3 PRO 32 HB3 PRO 32 9.079 7.427 -0.590 225 HG2 PRO 32 HG2 PRO 32 8.218 4.852 -1.496 226 HG3 PRO 32 HG3 PRO 32 9.677 5.550 -1.724 227 HD2 PRO 32 HD2 PRO 32 9.385 3.842 0.201 228 HD3 PRO 32 HD3 PRO 32 10.332 5.151 0.439 229 H GLN 33 H GLN 33 6.581 4.156 0.599 230 HA GLN 33 HA GLN 33 4.043 5.090 -0.160 231 HB2 GLN 33 HB2 GLN 33 3.403 2.804 -0.385 232 HB3 GLN 33 HB3 GLN 33 4.878 3.000 -1.059 233 HG2 GLN 33 HG2 GLN 33 5.897 2.052 0.804 234 HG3 GLN 33 HG3 GLN 33 4.459 1.951 1.573 235 HE21 GLN 33 HE21 GLN 33 5.076 -1.411 0.537 236 HE22 GLN 33 HE22 GLN 33 5.668 -0.273 1.701 237 H SER 34 H SER 34 5.512 4.293 2.807 238 HA SER 34 HA SER 34 2.990 4.655 4.079 239 HB2 SER 34 HB2 SER 34 3.684 2.241 4.136 240 HB3 SER 34 HB3 SER 34 4.895 2.691 5.135 241 HG SER 34 HG SER 34 2.195 2.787 5.618 242 H LEU 35 H LEU 35 3.375 6.821 4.685 243 HA LEU 35 HA LEU 35 5.186 6.938 6.932 244 HB2 LEU 35 HB2 LEU 35 5.583 8.657 5.381 245 HB3 LEU 35 HB3 LEU 35 4.055 9.197 5.581 246 HG LEU 35 HG LEU 35 4.581 9.715 7.872 247 HD11 LEU 35 HD11 LEU 35 6.865 9.736 8.604 248 HD12 LEU 35 HD12 LEU 35 7.326 9.063 7.208 249 HD13 LEU 35 HD13 LEU 35 6.413 8.225 8.247 250 HD21 LEU 35 HD21 LEU 35 5.884 11.671 7.379 251 HD22 LEU 35 HD22 LEU 35 4.751 11.455 6.246 252 HD23 LEU 35 HD23 LEU 35 6.284 11.041 5.944 253 H GLU 36 H GLU 36 4.247 6.528 8.871 254 HA GLU 36 HA GLU 36 1.481 7.272 9.166 255 HB2 GLU 36 HB2 GLU 36 2.942 5.122 10.446 256 HB3 GLU 36 HB3 GLU 36 1.419 5.517 10.887 257 HG2 GLU 36 HG2 GLU 36 0.720 4.984 8.650 258 HG3 GLU 36 HG3 GLU 36 2.225 4.412 8.375 259 H ALA 37 H ALA 37 0.777 8.476 10.941 260 HA ALA 37 HA ALA 37 2.732 8.975 12.998 261 HB1 ALA 37 HB1 ALA 37 2.788 10.919 11.575 262 HB2 ALA 37 HB2 ALA 37 2.179 11.337 13.014 263 HB3 ALA 37 HB3 ALA 37 1.193 11.112 11.752 264 H LYS 38 H LYS 38 1.818 7.879 14.717 265 HA LYS 38 HA LYS 38 -0.488 8.931 15.842 266 HB2 LYS 38 HB2 LYS 38 -0.979 6.915 14.034 267 HB3 LYS 38 HB3 LYS 38 -1.314 6.300 15.509 268 HG2 LYS 38 HG2 LYS 38 -2.557 8.691 14.540 269 HG3 LYS 38 HG3 LYS 38 -3.218 7.213 14.328 270 HD2 LYS 38 HD2 LYS 38 -3.141 6.983 16.775 271 HD3 LYS 38 HD3 LYS 38 -2.823 8.584 16.822 272 HE2 LYS 38 HE2 LYS 38 -5.213 7.419 15.689 273 HE3 LYS 38 HE3 LYS 38 -5.155 8.211 17.116 274 HZ1 LYS 38 HZ1 LYS 38 -6.016 9.633 15.427 275 HZ2 LYS 38 HZ2 LYS 38 -4.667 9.435 14.557 276 HZ3 LYS 38 HZ3 LYS 38 -4.610 10.220 15.969 277 H LYS 39 H LYS 39 0.696 5.724 15.808 278 HA LYS 39 HA LYS 39 1.138 5.757 18.687 279 HB2 LYS 39 HB2 LYS 39 0.495 3.492 17.030 280 HB3 LYS 39 HB3 LYS 39 0.784 3.410 18.636 281 HG2 LYS 39 HG2 LYS 39 -1.190 4.506 19.133 282 HG3 LYS 39 HG3 LYS 39 -1.411 4.944 17.575 283 HD2 LYS 39 HD2 LYS 39 -1.734 2.653 17.001 284 HD3 LYS 39 HD3 LYS 39 -1.579 2.253 18.577 285 HE2 LYS 39 HE2 LYS 39 -3.561 3.320 19.130 286 HE3 LYS 39 HE3 LYS 39 -3.642 4.054 17.673 287 HZ1 LYS 39 HZ1 LYS 39 -5.190 2.256 17.768 288 HZ2 LYS 39 HZ2 LYS 39 -3.988 1.223 18.087 289 HZ3 LYS 39 HZ3 LYS 39 -4.068 1.950 16.645 290 H GLY 40 H GLY 40 2.732 3.450 18.824 291 HA2 GLY 40 HA2 GLY 40 4.766 2.691 17.846 292 HA3 GLY 40 HA3 GLY 40 5.015 4.167 17.194 293 H PHE 41 H PHE 41 4.276 3.060 20.422 294 HA PHE 41 HA PHE 41 6.308 4.756 21.482 295 HB2 PHE 41 HB2 PHE 41 4.332 3.114 22.789 296 HB3 PHE 41 HB3 PHE 41 5.457 3.940 23.638 297 HD1 PHE 41 HD1 PHE 41 2.525 4.327 21.587 298 HD2 PHE 41 HD2 PHE 41 5.257 6.303 24.025 299 HE1 PHE 41 HE1 PHE 41 1.100 6.275 21.588 300 HE2 PHE 41 HE2 PHE 41 3.841 8.258 24.038 301 HZ PHE 41 HZ PHE 41 1.758 8.245 22.820 302 HA PRO 42 HA PRO 42 8.062 4.976 22.950 303 HB2 PRO 42 HB2 PRO 42 10.706 4.750 23.048 304 HB3 PRO 42 HB3 PRO 42 9.821 4.027 24.214 305 HG2 PRO 42 HG2 PRO 42 10.920 2.842 21.867 306 HG3 PRO 42 HG3 PRO 42 10.969 2.269 23.395 307 HD2 PRO 42 HD2 PRO 42 9.188 1.385 21.689 308 HD3 PRO 42 HD3 PRO 42 8.846 1.465 23.284 309 H HIS 43 H HIS 43 8.035 6.777 21.804 310 HA HIS 43 HA HIS 43 8.454 6.539 19.068 311 HB2 HIS 43 HB2 HIS 43 8.031 8.899 20.679 312 HB3 HIS 43 HB3 HIS 43 8.163 8.995 19.054 313 HD1 HIS 43 HD1 HIS 43 6.179 8.226 17.555 314 HD2 HIS 43 HD2 HIS 43 5.573 7.876 21.594 315 HE1 HIS 43 HE1 HIS 43 3.773 7.743 17.956 316 HE2 HIS 43 HE2 HIS 43 3.387 7.518 20.381 317 H SER 44 H SER 44 10.357 7.768 21.613 318 HA SER 44 HA SER 44 12.435 8.289 21.813 319 HB2 SER 44 HB2 SER 44 13.105 6.867 19.341 320 HB3 SER 44 HB3 SER 44 14.100 7.028 20.627 321 HG SER 44 HG SER 44 12.511 5.830 21.825 322 H GLY 45 H GLY 45 11.532 9.067 18.591 323 HA2 GLY 45 HA2 GLY 45 13.408 11.201 18.436 324 HA3 GLY 45 HA3 GLY 45 12.329 10.770 17.288 325 HA PRO 46 HA PRO 46 10.753 14.545 19.151 326 HB2 PRO 46 HB2 PRO 46 9.717 15.696 16.957 327 HB3 PRO 46 HB3 PRO 46 11.322 15.817 17.232 328 HG2 PRO 46 HG2 PRO 46 9.979 13.905 15.593 329 HG3 PRO 46 HG3 PRO 46 11.259 14.838 15.191 330 HD2 PRO 46 HD2 PRO 46 11.687 12.409 15.950 331 HD3 PRO 46 HD3 PRO 46 12.713 13.577 16.452 332 H ALA 47 H ALA 47 8.727 15.521 19.544 333 HA ALA 47 HA ALA 47 6.886 13.555 20.051 334 HB1 ALA 47 HB1 ALA 47 7.014 15.632 21.353 335 HB2 ALA 47 HB2 ALA 47 5.488 15.409 20.866 336 HB3 ALA 47 HB3 ALA 47 6.440 16.459 20.088 337 H ASP 48 H ASP 48 5.456 12.494 18.847 338 HA ASP 48 HA ASP 48 4.698 13.282 16.317 339 HB2 ASP 48 HB2 ASP 48 3.915 11.259 18.077 340 HB3 ASP 48 HB3 ASP 48 2.657 11.777 17.173 341 H GLY 49 H GLY 49 3.081 14.643 15.526 342 HA2 GLY 49 HA2 GLY 49 1.427 16.169 15.680 343 HA3 GLY 49 HA3 GLY 49 0.904 15.443 17.046 344 H GLN 50 H GLN 50 4.033 16.337 17.385 345 HA GLN 50 HA GLN 50 5.013 17.756 18.702 346 HB2 GLN 50 HB2 GLN 50 3.908 19.307 16.905 347 HB3 GLN 50 HB3 GLN 50 3.300 19.992 18.258 348 HG2 GLN 50 HG2 GLN 50 5.151 21.196 17.871 349 HG3 GLN 50 HG3 GLN 50 5.643 20.131 19.008 350 HE21 GLN 50 HE21 GLN 50 8.217 18.858 17.116 351 HE22 GLN 50 HE22 GLN 50 7.501 19.062 18.680 352 H ILE 51 H ILE 51 2.766 16.314 19.870 353 HA ILE 51 HA ILE 51 1.225 17.874 21.409 354 HB ILE 51 HB ILE 51 2.085 15.110 21.965 355 HG12 ILE 51 HG12 ILE 51 -0.475 15.864 20.872 356 HG13 ILE 51 HG13 ILE 51 0.809 15.590 19.901 357 HG21 ILE 51 HG21 ILE 51 0.183 14.811 23.441 358 HG22 ILE 51 HG22 ILE 51 -0.205 16.371 23.266 359 HG23 ILE 51 HG23 ILE 51 1.158 15.958 24.031 360 HD11 ILE 51 HD11 ILE 51 -0.588 13.644 19.976 361 HD12 ILE 51 HD12 ILE 51 -0.419 13.567 21.583 362 HD13 ILE 51 HD13 ILE 51 0.853 13.295 20.622 363 H ALA 52 H ALA 52 4.383 16.817 22.304 364 HA ALA 52 HA ALA 52 4.171 17.385 24.951 365 HB1 ALA 52 HB1 ALA 52 6.085 16.186 23.982 366 HB2 ALA 52 HB2 ALA 52 6.626 17.354 24.961 367 HB3 ALA 52 HB3 ALA 52 6.632 17.574 23.359 368 H SER 53 H SER 53 5.141 19.618 22.445 369 HA SER 53 HA SER 53 5.016 21.673 24.425 370 HB2 SER 53 HB2 SER 53 6.804 21.813 22.095 371 HB3 SER 53 HB3 SER 53 6.921 22.768 23.415 372 HG SER 53 HG SER 53 7.135 20.087 23.786 373 H ALA 54 H ALA 54 3.790 20.849 21.496 374 HA ALA 54 HA ALA 54 2.795 21.894 19.867 375 HB1 ALA 54 HB1 ALA 54 1.072 22.113 21.607 376 HB2 ALA 54 HB2 ALA 54 0.898 23.291 20.514 377 HB3 ALA 54 HB3 ALA 54 1.606 23.604 21.934 378 H GLY 55 H GLY 55 5.376 23.167 20.546 379 HA2 GLY 55 HA2 GLY 55 4.951 25.760 19.341 380 HA3 GLY 55 HA3 GLY 55 6.222 25.375 20.291 381 H GLY 56 H GLY 56 6.551 22.785 18.899 382 HA2 GLY 56 HA2 GLY 56 8.417 23.608 17.012 383 HA3 GLY 56 HA3 GLY 56 7.907 22.074 17.244 384 H LEU 57 H LEU 57 5.171 23.551 16.683 385 HA LEU 57 HA LEU 57 4.828 22.546 14.161 386 HB2 LEU 57 HB2 LEU 57 3.283 24.586 15.533 387 HB3 LEU 57 HB3 LEU 57 2.740 23.825 14.193 388 HG LEU 57 HG LEU 57 3.230 22.440 16.663 389 HD11 LEU 57 HD11 LEU 57 0.845 22.503 17.027 390 HD12 LEU 57 HD12 LEU 57 0.669 23.425 15.710 391 HD13 LEU 57 HD13 LEU 57 1.441 24.006 17.007 392 HD21 LEU 57 HD21 LEU 57 1.930 20.676 15.696 393 HD22 LEU 57 HD22 LEU 57 3.224 20.985 14.776 394 HD23 LEU 57 HD23 LEU 57 1.769 21.535 14.336 395 H PHE 58 H PHE 58 6.100 25.554 15.090 396 HA PHE 58 HA PHE 58 5.698 26.845 12.659 397 HB2 PHE 58 HB2 PHE 58 7.552 27.387 14.811 398 HB3 PHE 58 HB3 PHE 58 7.505 28.351 13.493 399 HD1 PHE 58 HD1 PHE 58 6.051 27.739 16.629 400 HD2 PHE 58 HD2 PHE 58 5.370 29.607 12.977 401 HE1 PHE 58 HE1 PHE 58 4.299 29.056 17.639 402 HE2 PHE 58 HE2 PHE 58 3.622 30.938 13.974 403 HZ PHE 58 HZ PHE 58 3.080 30.663 16.309 404 H GLY 59 H GLY 59 7.715 24.342 13.437 405 HA2 GLY 59 HA2 GLY 59 9.976 24.929 11.978 406 HA3 GLY 59 HA3 GLY 59 9.484 23.432 12.406 407 H GLY 60 H GLY 60 6.933 24.034 10.762 408 HA2 GLY 60 HA2 GLY 60 7.737 22.749 8.449 409 HA3 GLY 60 HA3 GLY 60 6.328 23.552 8.638 410 H ILE 61 H ILE 61 7.735 26.068 9.246 411 HA ILE 61 HA ILE 61 7.923 27.053 6.661 412 HB ILE 61 HB ILE 61 8.860 28.309 9.131 413 HG12 ILE 61 HG12 ILE 61 6.558 27.868 9.264 414 HG13 ILE 61 HG13 ILE 61 6.796 29.481 9.178 415 HG21 ILE 61 HG21 ILE 61 8.774 30.440 7.994 416 HG22 ILE 61 HG22 ILE 61 8.385 29.692 6.614 417 HG23 ILE 61 HG23 ILE 61 9.845 29.467 7.272 418 HD11 ILE 61 HD11 ILE 61 4.907 28.860 7.805 419 HD12 ILE 61 HD12 ILE 61 5.843 27.858 6.947 420 HD13 ILE 61 HD13 ILE 61 6.078 29.456 6.862 421 H LEU 62 H LEU 62 10.255 25.844 8.871 422 HA LEU 62 HA LEU 62 12.466 26.793 7.442 423 HB2 LEU 62 HB2 LEU 62 12.215 24.976 9.657 424 HB3 LEU 62 HB3 LEU 62 13.676 25.171 8.953 425 HG LEU 62 HG LEU 62 13.595 27.485 9.604 426 HD11 LEU 62 HD11 LEU 62 12.114 28.206 11.332 427 HD12 LEU 62 HD12 LEU 62 11.312 26.805 11.235 428 HD13 LEU 62 HD13 LEU 62 11.289 27.838 9.991 429 HD21 LEU 62 HD21 LEU 62 14.199 26.977 11.927 430 HD22 LEU 62 HD22 LEU 62 14.835 25.870 10.935 431 HD23 LEU 62 HD23 LEU 62 13.499 25.527 11.779 432 H ASP 63 H ASP 63 10.476 24.122 7.115 433 HA ASP 63 HA ASP 63 12.258 22.263 6.206 434 HB2 ASP 63 HB2 ASP 63 9.920 21.806 6.791 435 HB3 ASP 63 HB3 ASP 63 9.495 22.398 5.329 436 H GLN 64 H GLN 64 11.044 24.966 4.611 437 HA GLN 64 HA GLN 64 11.218 24.189 2.026 438 HB2 GLN 64 HB2 GLN 64 11.335 26.486 1.454 439 HB3 GLN 64 HB3 GLN 64 10.359 26.336 2.754 440 HG2 GLN 64 HG2 GLN 64 12.167 27.051 4.151 441 HG3 GLN 64 HG3 GLN 64 13.078 27.280 2.815 442 HE21 GLN 64 HE21 GLN 64 10.692 30.149 4.084 443 HE22 GLN 64 HE22 GLN 64 11.066 28.713 4.977 444 H GLN 65 H GLN 65 13.807 24.677 4.149 445 HA GLN 65 HA GLN 65 15.636 24.017 2.038 446 HB2 GLN 65 HB2 GLN 65 15.706 26.439 2.531 447 HB3 GLN 65 HB3 GLN 65 16.394 26.028 3.954 448 HG2 GLN 65 HG2 GLN 65 18.279 25.192 2.872 449 HG3 GLN 65 HG3 GLN 65 17.571 25.361 1.411 450 HE21 GLN 65 HE21 GLN 65 19.530 28.213 1.084 451 HE22 GLN 65 HE22 GLN 65 19.359 26.549 0.632 452 H SER 66 H SER 66 14.680 22.080 3.537 453 HA SER 66 HA SER 66 16.745 21.610 5.488 454 HB2 SER 66 HB2 SER 66 14.487 21.784 6.460 455 HB3 SER 66 HB3 SER 66 14.089 20.425 5.646 456 HG SER 66 HG SER 66 15.459 20.694 7.908 457 H GLU 67 H GLU 67 17.343 19.334 5.927 458 HA GLU 67 HA GLU 67 17.925 17.944 3.599 459 HB2 GLU 67 HB2 GLU 67 19.153 17.778 5.696 460 HB3 GLU 67 HB3 GLU 67 17.901 16.938 6.325 461 HG2 GLU 67 HG2 GLU 67 18.353 15.228 4.670 462 HG3 GLU 67 HG3 GLU 67 19.731 16.032 4.322 463 H ASN 68 H ASN 68 15.337 17.758 5.824 464 HA ASN 68 HA ASN 68 14.335 15.389 4.618 465 HB2 ASN 68 HB2 ASN 68 12.809 15.280 6.471 466 HB3 ASN 68 HB3 ASN 68 14.316 15.545 7.041 467 HD21 ASN 68 HD21 ASN 68 11.423 18.185 7.693 468 HD22 ASN 68 HD22 ASN 68 11.179 16.714 6.812 469 H ARG 69 H ARG 69 14.228 18.187 3.480 470 HA ARG 69 HA ARG 69 11.571 18.884 3.122 471 HB2 ARG 69 HB2 ARG 69 13.416 20.264 2.464 472 HB3 ARG 69 HB3 ARG 69 13.716 19.240 1.228 473 HG2 ARG 69 HG2 ARG 69 11.252 19.927 0.682 474 HG3 ARG 69 HG3 ARG 69 11.803 21.305 1.364 475 HD2 ARG 69 HD2 ARG 69 13.272 20.041 -0.737 476 HD3 ARG 69 HD3 ARG 69 12.070 21.093 -1.078 477 HE ARG 69 HE ARG 69 13.449 22.653 0.435 478 HH11 ARG 69 HH11 ARG 69 15.218 23.853 0.002 479 HH12 ARG 69 HH12 ARG 69 16.397 23.324 -1.152 480 HH21 ARG 69 HH21 ARG 69 14.737 20.430 -1.990 481 HH22 ARG 69 HH22 ARG 69 16.132 21.421 -2.260 482 H TRP 70 H TRP 70 10.043 18.352 1.436 483 HA TRP 70 HA TRP 70 10.489 15.709 0.426 484 HB2 TRP 70 HB2 TRP 70 8.073 17.282 0.585 485 HB3 TRP 70 HB3 TRP 70 8.106 15.835 -0.172 486 HD1 TRP 70 HD1 TRP 70 9.329 16.776 3.278 487 HE1 TRP 70 HE1 TRP 70 8.422 15.249 5.039 488 HE3 TRP 70 HE3 TRP 70 6.582 13.887 0.252 489 HZ2 TRP 70 HZ2 TRP 70 6.612 13.094 5.044 490 HZ3 TRP 70 HZ3 TRP 70 5.266 12.095 1.222 491 HH2 TRP 70 HH2 TRP 70 5.277 11.727 3.609 492 H PHE 71 H PHE 71 9.943 15.187 -1.797 493 HA PHE 71 HA PHE 71 11.394 16.557 -3.538 494 HB2 PHE 71 HB2 PHE 71 9.691 15.416 -5.200 495 HB3 PHE 71 HB3 PHE 71 10.796 14.530 -4.387 496 HD1 PHE 71 HD1 PHE 71 10.136 12.942 -2.703 497 HD2 PHE 71 HD2 PHE 71 7.312 15.480 -4.413 498 HE1 PHE 71 HE1 PHE 71 8.373 11.690 -1.635 499 HE2 PHE 71 HE2 PHE 71 5.540 14.234 -3.352 500 HZ PHE 71 HZ PHE 71 6.068 12.344 -1.944 501 H LYS 72 H LYS 72 11.455 18.414 -4.600 502 HA LYS 72 HA LYS 72 9.224 20.103 -4.493 503 HB2 LYS 72 HB2 LYS 72 11.820 20.351 -5.751 504 HB3 LYS 72 HB3 LYS 72 10.696 21.504 -6.025 505 HG2 LYS 72 HG2 LYS 72 11.589 20.928 -3.376 506 HG3 LYS 72 HG3 LYS 72 12.383 21.995 -4.324 507 HD2 LYS 72 HD2 LYS 72 10.292 23.226 -4.536 508 HD3 LYS 72 HD3 LYS 72 9.665 22.241 -3.395 509 HE2 LYS 72 HE2 LYS 72 11.474 22.993 -1.915 510 HE3 LYS 72 HE3 LYS 72 11.806 24.139 -3.030 511 HZ1 LYS 72 HZ1 LYS 72 10.423 25.030 -1.330 512 HZ2 LYS 72 HZ2 LYS 72 9.302 23.905 -1.636 513 HZ3 LYS 72 HZ3 LYS 72 9.631 25.040 -2.740 514 H HIS 73 H HIS 73 7.433 19.690 -5.772 515 HA HIS 73 HA HIS 73 8.017 18.931 -8.469 516 HB2 HIS 73 HB2 HIS 73 6.020 18.111 -6.756 517 HB3 HIS 73 HB3 HIS 73 5.339 18.680 -8.127 518 HD1 HIS 73 HD1 HIS 73 6.354 17.585 -10.464 519 HD2 HIS 73 HD2 HIS 73 6.776 15.499 -6.961 520 HE1 HIS 73 HE1 HIS 73 6.963 15.234 -11.009 521 HE2 HIS 73 HE2 HIS 73 7.203 13.954 -8.914 522 H ILE 74 H ILE 74 8.328 20.545 -9.805 523 HA ILE 74 HA ILE 74 7.032 22.979 -9.583 524 HB ILE 74 HB ILE 74 9.123 22.655 -10.828 525 HG12 ILE 74 HG12 ILE 74 7.192 23.963 -12.494 526 HG13 ILE 74 HG13 ILE 74 7.778 24.643 -11.130 527 HG21 ILE 74 HG21 ILE 74 9.068 21.788 -13.080 528 HG22 ILE 74 HG22 ILE 74 7.495 21.451 -12.920 529 HG23 ILE 74 HG23 ILE 74 8.587 20.649 -12.038 530 HD11 ILE 74 HD11 ILE 74 8.950 25.504 -13.040 531 HD12 ILE 74 HD12 ILE 74 9.399 24.007 -13.455 532 HD13 ILE 74 HD13 ILE 74 9.980 24.680 -12.105 533 H MET 75 H MET 75 5.215 23.896 -10.549 534 HA MET 75 HA MET 75 3.662 22.260 -12.311 535 HB2 MET 75 HB2 MET 75 2.949 22.062 -9.862 536 HB3 MET 75 HB3 MET 75 2.184 23.468 -10.185 537 HG2 MET 75 HG2 MET 75 0.652 21.873 -10.436 538 HG3 MET 75 HG3 MET 75 1.043 22.383 -11.938 539 HE1 MET 75 HE1 MET 75 0.361 18.638 -12.667 540 HE2 MET 75 HE2 MET 75 0.027 20.147 -13.142 541 HE3 MET 75 HE3 MET 75 -0.482 19.622 -11.700 542 H THR 76 H THR 76 2.208 23.492 -13.638 543 HA THR 76 HA THR 76 2.695 26.328 -13.597 544 HB THR 76 HB THR 76 1.661 26.271 -15.841 545 HG1 THR 76 HG1 THR 76 0.478 24.513 -15.919 546 HG21 THR 76 HG21 THR 76 3.580 25.295 -16.910 547 HG22 THR 76 HG22 THR 76 3.996 24.561 -15.531 548 HG23 THR 76 HG23 THR 76 4.086 26.171 -15.649 549 H GLY 77 H GLY 77 0.628 27.685 -14.288 550 HA2 GLY 77 HA2 GLY 77 -1.321 27.235 -12.372 551 HA3 GLY 77 HA3 GLY 77 -1.414 28.315 -13.594 552 H GLY 78 H GLY 78 -3.754 27.470 -12.955 553 HA2 GLY 78 HA2 GLY 78 -5.474 26.682 -14.330 554 HA3 GLY 78 HA3 GLY 78 -4.453 25.643 -15.068 555 H GLU 79 H GLU 79 -6.726 24.465 -14.501 556 HA GLU 79 HA GLU 79 -6.518 23.316 -11.887 557 HB2 GLU 79 HB2 GLU 79 -8.673 23.990 -12.897 558 HB3 GLU 79 HB3 GLU 79 -8.551 22.643 -13.814 559 HG2 GLU 79 HG2 GLU 79 -8.383 22.256 -11.016 560 HG3 GLU 79 HG3 GLU 79 -9.856 22.660 -11.597 561 H HIS 80 H HIS 80 -5.729 21.309 -11.385 562 HA HIS 80 HA HIS 80 -5.395 19.518 -13.598 563 HB2 HIS 80 HB2 HIS 80 -3.304 19.594 -11.625 564 HB3 HIS 80 HB3 HIS 80 -3.189 19.075 -13.169 565 HD1 HIS 80 HD1 HIS 80 -2.453 21.882 -11.063 566 HD2 HIS 80 HD2 HIS 80 -3.121 21.318 -15.065 567 HE1 HIS 80 HE1 HIS 80 -1.637 23.876 -12.289 568 HE2 HIS 80 HE2 HIS 80 -2.047 23.574 -14.696 569 H THR 81 H THR 81 -5.780 17.343 -13.223 570 HA THR 81 HA THR 81 -6.781 16.702 -10.651 571 HB THR 81 HB THR 81 -6.436 14.874 -12.891 572 HG1 THR 81 HG1 THR 81 -7.870 16.110 -13.764 573 HG21 THR 81 HG21 THR 81 -8.113 13.549 -11.811 574 HG22 THR 81 HG22 THR 81 -8.213 14.624 -10.607 575 HG23 THR 81 HG23 THR 81 -6.872 13.739 -10.792 576 H PHE 82 H PHE 82 -5.463 16.140 -8.973 577 HA PHE 82 HA PHE 82 -2.839 15.100 -9.545 578 HB2 PHE 82 HB2 PHE 82 -4.029 16.042 -7.118 579 HB3 PHE 82 HB3 PHE 82 -2.592 15.265 -7.113 580 HD1 PHE 82 HD1 PHE 82 -0.602 16.491 -7.344 581 HD2 PHE 82 HD2 PHE 82 -4.189 18.194 -8.585 582 HE1 PHE 82 HE1 PHE 82 0.550 18.561 -7.814 583 HE2 PHE 82 HE2 PHE 82 -3.043 20.263 -9.075 584 HZ PHE 82 HZ PHE 82 -0.672 20.452 -8.684 585 H THR 83 H THR 83 -2.704 12.935 -9.890 586 HA THR 83 HA THR 83 -4.838 11.348 -8.920 587 HB THR 83 HB THR 83 -2.701 10.435 -10.693 588 HG1 THR 83 HG1 THR 83 -4.326 10.833 -12.349 589 HG21 THR 83 HG21 THR 83 -4.261 8.767 -11.399 590 HG22 THR 83 HG22 THR 83 -5.377 9.358 -10.389 591 HG23 THR 83 HG23 THR 83 -4.054 8.638 -9.801 592 H TRP 84 H TRP 84 -4.805 10.237 -7.098 593 HA TRP 84 HA TRP 84 -2.238 9.278 -6.101 594 HB2 TRP 84 HB2 TRP 84 -4.461 10.165 -4.505 595 HB3 TRP 84 HB3 TRP 84 -3.061 9.570 -3.910 596 HD1 TRP 84 HD1 TRP 84 -1.466 11.541 -6.125 597 HE1 TRP 84 HE1 TRP 84 -1.002 13.929 -5.526 598 HE3 TRP 84 HE3 TRP 84 -4.761 11.891 -2.376 599 HZ2 TRP 84 HZ2 TRP 84 -2.024 15.718 -3.603 600 HZ3 TRP 84 HZ3 TRP 84 -4.932 13.985 -1.156 601 HH2 TRP 84 HH2 TRP 84 -3.580 15.884 -1.795 602 H THR 85 H THR 85 -2.251 7.037 -5.478 603 HA THR 85 HA THR 85 -4.765 5.742 -5.630 604 HB THR 85 HB THR 85 -3.910 5.701 -7.962 605 HG1 THR 85 HG1 THR 85 -5.324 4.123 -7.491 606 HG21 THR 85 HG21 THR 85 -2.029 4.316 -8.485 607 HG22 THR 85 HG22 THR 85 -1.814 3.981 -6.918 608 HG23 THR 85 HG23 THR 85 -1.547 5.478 -7.469 609 H TYR 86 H TYR 86 -4.819 3.452 -4.992 610 HA TYR 86 HA TYR 86 -2.594 2.750 -3.248 611 HB2 TYR 86 HB2 TYR 86 -5.255 2.737 -2.737 612 HB3 TYR 86 HB3 TYR 86 -4.752 1.184 -2.742 613 HD1 TYR 86 HD1 TYR 86 -5.499 3.543 -0.545 614 HD2 TYR 86 HD2 TYR 86 -2.256 1.084 -1.419 615 HE1 TYR 86 HE1 TYR 86 -4.699 3.780 1.728 616 HE2 TYR 86 HE2 TYR 86 -1.445 1.359 0.845 617 HH TYR 86 HH TYR 86 -3.274 2.791 3.352 618 H THR 87 H THR 87 -1.532 0.740 -3.764 619 HA THR 87 HA THR 87 -2.032 -0.088 -6.369 620 HB THR 87 HB THR 87 0.254 -0.117 -5.431 621 HG1 THR 87 HG1 THR 87 0.080 -2.675 -6.165 622 HG21 THR 87 HG21 THR 87 0.926 -1.925 -4.013 623 HG22 THR 87 HG22 THR 87 -0.584 -2.502 -4.000 624 HG23 THR 87 HG23 THR 87 -0.250 -1.097 -3.274 625 H ALA 88 H ALA 88 -3.287 -1.154 -3.507 626 HA ALA 88 HA ALA 88 -4.631 -3.357 -4.823 627 HB1 ALA 88 HB1 ALA 88 -2.936 -4.447 -3.562 628 HB2 ALA 88 HB2 ALA 88 -4.359 -4.731 -2.848 629 HB3 ALA 88 HB3 ALA 88 -3.352 -3.625 -2.233 630 HA PRO 89 HA PRO 89 -7.842 -1.169 -2.816 631 HB2 PRO 89 HB2 PRO 89 -9.739 -2.960 -2.277 632 HB3 PRO 89 HB3 PRO 89 -9.504 -2.477 -3.820 633 HG2 PRO 89 HG2 PRO 89 -8.477 -4.826 -2.552 634 HG3 PRO 89 HG3 PRO 89 -9.216 -4.720 -4.004 635 HD2 PRO 89 HD2 PRO 89 -6.630 -4.798 -3.905 636 HD3 PRO 89 HD3 PRO 89 -7.354 -3.842 -5.013 637 H HIS 90 H HIS 90 -7.946 -0.242 -0.943 638 HA HIS 90 HA HIS 90 -7.389 -1.865 1.397 639 HB2 HIS 90 HB2 HIS 90 -5.492 -0.432 0.491 640 HB3 HIS 90 HB3 HIS 90 -6.306 0.786 1.214 641 HD1 HIS 90 HD1 HIS 90 -6.453 0.814 3.874 642 HD2 HIS 90 HD2 HIS 90 -4.032 -2.037 2.196 643 HE1 HIS 90 HE1 HIS 90 -5.008 -0.153 5.653 644 HE2 HIS 90 HE2 HIS 90 -3.562 -1.887 4.672 645 H ASN 91 H ASN 91 -8.441 -1.147 3.387 646 HA ASN 91 HA ASN 91 -10.741 0.389 3.078 647 HB2 ASN 91 HB2 ASN 91 -10.594 -0.961 4.958 648 HB3 ASN 91 HB3 ASN 91 -9.243 -0.197 5.464 649 HD21 ASN 91 HD21 ASN 91 -12.813 1.105 6.566 650 HD22 ASN 91 HD22 ASN 91 -12.565 -0.321 5.615 651 H THR 92 H THR 92 -11.114 2.607 3.302 652 HA THR 92 HA THR 92 -8.941 4.295 4.137 653 HB THR 92 HB THR 92 -9.443 5.851 2.310 654 HG1 THR 92 HG1 THR 92 -10.326 4.543 0.449 655 HG21 THR 92 HG21 THR 92 -8.133 4.681 0.655 656 HG22 THR 92 HG22 THR 92 -8.391 3.281 1.421 657 HG23 THR 92 HG23 THR 92 -7.475 4.422 2.109 658 H SER 93 H SER 93 -9.828 6.262 5.166 659 HA SER 93 HA SER 93 -12.678 6.096 5.531 660 HB2 SER 93 HB2 SER 93 -11.715 5.589 7.626 661 HB3 SER 93 HB3 SER 93 -10.613 6.785 7.475 662 HG SER 93 HG SER 93 -11.923 8.193 8.225 663 H GLN 94 H GLN 94 -10.050 8.420 5.444 664 HA GLN 94 HA GLN 94 -11.777 10.332 4.311 665 HB2 GLN 94 HB2 GLN 94 -11.923 10.370 6.903 666 HB3 GLN 94 HB3 GLN 94 -10.539 11.228 6.774 667 HG2 GLN 94 HG2 GLN 94 -11.790 12.829 5.450 668 HG3 GLN 94 HG3 GLN 94 -13.141 12.031 5.903 669 HE21 GLN 94 HE21 GLN 94 -13.282 13.281 9.146 670 HE22 GLN 94 HE22 GLN 94 -13.885 12.081 8.052 671 H TRP 95 H TRP 95 -10.753 12.179 3.326 672 HA TRP 95 HA TRP 95 -8.021 12.530 4.071 673 HB2 TRP 95 HB2 TRP 95 -7.721 13.118 1.535 674 HB3 TRP 95 HB3 TRP 95 -7.329 11.658 2.154 675 HD1 TRP 95 HD1 TRP 95 -10.217 13.218 0.349 676 HE1 TRP 95 HE1 TRP 95 -11.508 11.535 -0.992 677 HE3 TRP 95 HE3 TRP 95 -7.640 9.198 1.776 678 HZ2 TRP 95 HZ2 TRP 95 -11.359 8.740 -1.309 679 HZ3 TRP 95 HZ3 TRP 95 -8.257 7.041 0.898 680 HH2 TRP 95 HH2 TRP 95 -10.130 6.819 -0.607 681 H HIS 96 H HIS 96 -7.485 14.642 4.474 682 HA HIS 96 HA HIS 96 -9.031 16.680 3.118 683 HB2 HIS 96 HB2 HIS 96 -9.113 17.989 5.159 684 HB3 HIS 96 HB3 HIS 96 -10.131 16.712 5.103 685 HD1 HIS 96 HD1 HIS 96 -7.432 18.159 7.071 686 HD2 HIS 96 HD2 HIS 96 -9.353 14.550 6.802 687 HE1 HIS 96 HE1 HIS 96 -6.925 16.835 9.118 688 HE2 HIS 96 HE2 HIS 96 -8.058 14.650 8.966 689 H TYR 97 H TYR 97 -7.898 18.595 2.668 690 HA TYR 97 HA TYR 97 -5.095 18.435 3.096 691 HB2 TYR 97 HB2 TYR 97 -4.845 18.646 0.563 692 HB3 TYR 97 HB3 TYR 97 -5.037 17.161 1.214 693 HD1 TYR 97 HD1 TYR 97 -7.224 15.942 0.959 694 HD2 TYR 97 HD2 TYR 97 -6.519 19.590 -0.905 695 HE1 TYR 97 HE1 TYR 97 -9.178 15.613 -0.431 696 HE2 TYR 97 HE2 TYR 97 -8.458 19.253 -2.297 697 HH TYR 97 HH TYR 97 -9.808 17.208 -3.184 698 H TYR 98 H TYR 98 -3.828 20.219 2.443 699 HA TYR 98 HA TYR 98 -5.327 22.657 2.425 700 HB2 TYR 98 HB2 TYR 98 -3.136 22.181 4.283 701 HB3 TYR 98 HB3 TYR 98 -4.119 23.485 4.301 702 HD1 TYR 98 HD1 TYR 98 -4.027 19.946 5.079 703 HD2 TYR 98 HD2 TYR 98 -6.109 23.508 5.621 704 HE1 TYR 98 HE1 TYR 98 -5.397 18.890 6.761 705 HE2 TYR 98 HE2 TYR 98 -7.454 22.458 7.323 706 HH TYR 98 HH TYR 98 -8.203 19.868 7.790 707 H ILE 99 H ILE 99 -3.845 24.625 2.058 708 HA ILE 99 HA ILE 99 -1.304 23.823 1.036 709 HB ILE 99 HB ILE 99 -1.425 25.559 -0.734 710 HG12 ILE 99 HG12 ILE 99 -4.223 25.736 -0.104 711 HG13 ILE 99 HG13 ILE 99 -3.134 26.870 0.337 712 HG21 ILE 99 HG21 ILE 99 -2.821 24.266 -2.228 713 HG22 ILE 99 HG22 ILE 99 -3.444 23.471 -0.965 714 HG23 ILE 99 HG23 ILE 99 -1.888 23.274 -1.357 715 HD11 ILE 99 HD11 ILE 99 -4.312 27.586 -1.620 716 HD12 ILE 99 HD12 ILE 99 -3.825 26.264 -2.414 717 HD13 ILE 99 HD13 ILE 99 -2.747 27.388 -1.977 718 H THR 100 H THR 100 0.472 25.268 1.334 719 HA THR 100 HA THR 100 0.066 27.118 3.444 720 HB THR 100 HB THR 100 2.579 26.420 2.078 721 HG1 THR 100 HG1 THR 100 2.067 25.476 4.568 722 HG21 THR 100 HG21 THR 100 3.733 27.322 3.956 723 HG22 THR 100 HG22 THR 100 2.330 27.742 4.642 724 HG23 THR 100 HG23 THR 100 2.825 28.485 3.294 725 H LYS 101 H LYS 101 -0.527 29.287 3.021 726 HA LYS 101 HA LYS 101 0.235 30.298 0.473 727 HB2 LYS 101 HB2 LYS 101 -1.018 32.302 1.077 728 HB3 LYS 101 HB3 LYS 101 -1.913 30.936 1.084 729 HG2 LYS 101 HG2 LYS 101 -2.205 30.986 3.313 730 HG3 LYS 101 HG3 LYS 101 -0.846 31.855 3.568 731 HD2 LYS 101 HD2 LYS 101 -2.674 33.232 4.022 732 HD3 LYS 101 HD3 LYS 101 -1.959 33.783 2.661 733 HE2 LYS 101 HE2 LYS 101 -3.818 33.543 1.539 734 HE3 LYS 101 HE3 LYS 101 -3.927 31.976 1.984 735 HZ1 LYS 101 HZ1 LYS 101 -5.838 33.171 2.729 736 HZ2 LYS 101 HZ2 LYS 101 -4.893 34.184 3.562 737 HZ3 LYS 101 HZ3 LYS 101 -5.001 32.632 4.003 738 H LYS 102 H LYS 102 2.164 31.389 0.030 739 HA LYS 102 HA LYS 102 3.606 32.531 2.180 740 HB2 LYS 102 HB2 LYS 102 5.148 33.326 0.662 741 HB3 LYS 102 HB3 LYS 102 4.764 31.792 0.251 742 HG2 LYS 102 HG2 LYS 102 3.503 32.548 -1.573 743 HG3 LYS 102 HG3 LYS 102 3.718 34.102 -1.121 744 HD2 LYS 102 HD2 LYS 102 6.095 33.824 -1.479 745 HD3 LYS 102 HD3 LYS 102 5.799 32.325 -2.055 746 HE2 LYS 102 HE2 LYS 102 4.612 33.215 -3.880 747 HE3 LYS 102 HE3 LYS 102 4.754 34.725 -3.274 748 HZ1 LYS 102 HZ1 LYS 102 6.327 34.397 -5.026 749 HZ2 LYS 102 HZ2 LYS 102 6.969 33.143 -4.232 750 HZ3 LYS 102 HZ3 LYS 102 7.109 34.638 -3.632 751 H GLY 103 H GLY 103 3.806 34.891 2.676 752 HA2 GLY 103 HA2 GLY 103 3.382 37.061 1.990 753 HA3 GLY 103 HA3 GLY 103 2.208 36.546 0.979 754 H TRP 104 H TRP 104 1.676 35.352 4.064 755 HA TRP 104 HA TRP 104 -0.613 36.828 4.384 756 HB2 TRP 104 HB2 TRP 104 -0.628 35.986 6.674 757 HB3 TRP 104 HB3 TRP 104 -0.323 34.801 5.592 758 HD1 TRP 104 HD1 TRP 104 1.563 36.901 8.055 759 HE1 TRP 104 HE1 TRP 104 3.693 35.831 8.813 760 HE3 TRP 104 HE3 TRP 104 1.323 32.901 5.084 761 HZ2 TRP 104 HZ2 TRP 104 5.105 33.505 8.073 762 HZ3 TRP 104 HZ3 TRP 104 3.103 31.260 5.179 763 HH2 TRP 104 HH2 TRP 104 4.988 31.587 6.650 764 H ASP 105 H ASP 105 -1.240 38.550 5.831 765 HA ASP 105 HA ASP 105 0.651 40.572 6.205 766 HB2 ASP 105 HB2 ASP 105 -1.916 40.332 7.519 767 HB3 ASP 105 HB3 ASP 105 -1.076 41.721 7.343 768 HA PRO 106 HA PRO 106 2.284 39.113 9.940 769 HB2 PRO 106 HB2 PRO 106 3.051 41.290 11.323 770 HB3 PRO 106 HB3 PRO 106 3.870 40.880 9.970 771 HG2 PRO 106 HG2 PRO 106 1.735 42.772 10.204 772 HG3 PRO 106 HG3 PRO 106 3.186 42.995 9.490 773 HD2 PRO 106 HD2 PRO 106 1.157 42.389 8.012 774 HD3 PRO 106 HD3 PRO 106 2.606 41.722 7.663 775 H ASP 107 H ASP 107 -0.335 41.170 10.203 776 HA ASP 107 HA ASP 107 -0.913 40.684 12.885 777 HB2 ASP 107 HB2 ASP 107 -1.903 42.512 11.683 778 HB3 ASP 107 HB3 ASP 107 -2.665 41.462 10.692 779 H LYS 108 H LYS 108 -1.180 38.719 10.186 780 HA LYS 108 HA LYS 108 -3.419 37.263 11.253 781 HB2 LYS 108 HB2 LYS 108 -2.184 37.037 8.653 782 HB3 LYS 108 HB3 LYS 108 -3.527 36.223 9.102 783 HG2 LYS 108 HG2 LYS 108 -4.623 38.347 9.447 784 HG3 LYS 108 HG3 LYS 108 -3.303 39.081 8.826 785 HD2 LYS 108 HD2 LYS 108 -3.707 37.882 6.772 786 HD3 LYS 108 HD3 LYS 108 -5.125 37.384 7.411 787 HE2 LYS 108 HE2 LYS 108 -4.392 40.128 6.858 788 HE3 LYS 108 HE3 LYS 108 -5.571 39.288 6.102 789 HZ1 LYS 108 HZ1 LYS 108 -6.515 40.814 7.641 790 HZ2 LYS 108 HZ2 LYS 108 -5.684 40.132 8.849 791 HZ3 LYS 108 HZ3 LYS 108 -6.851 39.300 8.100 792 HA PRO 109 HA PRO 109 -0.701 34.494 12.989 793 HB2 PRO 109 HB2 PRO 109 -2.330 32.445 13.656 794 HB3 PRO 109 HB3 PRO 109 -2.339 33.820 14.537 795 HG2 PRO 109 HG2 PRO 109 -4.108 33.100 12.410 796 HG3 PRO 109 HG3 PRO 109 -4.502 33.710 13.873 797 HD2 PRO 109 HD2 PRO 109 -4.406 35.286 11.859 798 HD3 PRO 109 HD3 PRO 109 -3.842 35.812 13.298 799 H LEU 110 H LEU 110 0.838 33.412 12.303 800 HA LEU 110 HA LEU 110 0.888 32.454 9.767 801 HB2 LEU 110 HB2 LEU 110 2.819 32.986 11.103 802 HB3 LEU 110 HB3 LEU 110 2.534 31.672 12.029 803 HG LEU 110 HG LEU 110 3.325 31.343 9.310 804 HD11 LEU 110 HD11 LEU 110 5.644 31.302 10.120 805 HD12 LEU 110 HD12 LEU 110 5.122 31.688 11.601 806 HD13 LEU 110 HD13 LEU 110 4.996 32.758 10.395 807 HD21 LEU 110 HD21 LEU 110 4.201 29.239 10.023 808 HD22 LEU 110 HD22 LEU 110 2.622 29.330 10.361 809 HD23 LEU 110 HD23 LEU 110 3.714 29.539 11.535 810 H LYS 111 H LYS 111 0.219 30.569 12.622 811 HA LYS 111 HA LYS 111 0.366 28.187 11.192 812 HB2 LYS 111 HB2 LYS 111 -0.788 28.645 13.801 813 HB3 LYS 111 HB3 LYS 111 -0.592 27.148 13.178 814 HG2 LYS 111 HG2 LYS 111 1.821 27.727 12.995 815 HG3 LYS 111 HG3 LYS 111 1.482 28.976 13.991 816 HD2 LYS 111 HD2 LYS 111 0.983 26.255 14.770 817 HD3 LYS 111 HD3 LYS 111 2.412 26.984 15.073 818 HE2 LYS 111 HE2 LYS 111 1.195 28.648 16.364 819 HE3 LYS 111 HE3 LYS 111 -0.139 27.723 16.191 820 HZ1 LYS 111 HZ1 LYS 111 0.901 27.270 18.293 821 HZ2 LYS 111 HZ2 LYS 111 2.271 26.861 17.538 822 HZ3 LYS 111 HZ3 LYS 111 0.950 25.946 17.367 823 H ARG 112 H ARG 112 -2.189 30.403 11.407 824 HA ARG 112 HA ARG 112 -4.112 28.612 10.409 825 HB2 ARG 112 HB2 ARG 112 -4.120 31.334 10.951 826 HB3 ARG 112 HB3 ARG 112 -4.933 31.011 9.571 827 HG2 ARG 112 HG2 ARG 112 -6.582 30.911 11.080 828 HG3 ARG 112 HG3 ARG 112 -6.157 29.337 10.977 829 HD2 ARG 112 HD2 ARG 112 -4.905 29.512 12.964 830 HD3 ARG 112 HD3 ARG 112 -5.214 31.114 13.045 831 HE ARG 112 HE ARG 112 -7.561 29.521 13.036 832 HH11 ARG 112 HH11 ARG 112 -8.850 29.501 14.832 833 HH12 ARG 112 HH12 ARG 112 -8.276 30.132 16.339 834 HH21 ARG 112 HH21 ARG 112 -5.180 31.042 15.141 835 HH22 ARG 112 HH22 ARG 112 -6.235 30.989 16.513 836 H ALA 113 H ALA 113 -1.980 30.972 9.033 837 HA ALA 113 HA ALA 113 -2.829 30.738 6.411 838 HB1 ALA 113 HB1 ALA 113 -1.574 32.666 7.228 839 HB2 ALA 113 HB2 ALA 113 -0.845 32.073 5.911 840 HB3 ALA 113 HB3 ALA 113 -0.256 31.742 7.380 841 H ASP 114 H ASP 114 -0.651 28.895 8.209 842 HA ASP 114 HA ASP 114 0.671 27.674 6.084 843 HB2 ASP 114 HB2 ASP 114 1.465 27.692 8.393 844 HB3 ASP 114 HB3 ASP 114 0.305 26.601 8.755 845 H PHE 115 H PHE 115 -2.305 27.051 7.689 846 HA PHE 115 HA PHE 115 -2.723 24.838 5.887 847 HB2 PHE 115 HB2 PHE 115 -3.747 25.187 8.585 848 HB3 PHE 115 HB3 PHE 115 -4.357 24.041 7.595 849 HD1 PHE 115 HD1 PHE 115 -1.313 25.007 9.311 850 HD2 PHE 115 HD2 PHE 115 -3.363 21.905 7.449 851 HE1 PHE 115 HE1 PHE 115 0.366 23.451 10.071 852 HE2 PHE 115 HE2 PHE 115 -1.707 20.331 8.225 853 HZ PHE 115 HZ PHE 115 0.169 21.107 9.535 854 H GLU 116 H GLU 116 -3.578 26.129 4.231 855 HA GLU 116 HA GLU 116 -6.116 27.399 4.780 856 HB2 GLU 116 HB2 GLU 116 -4.581 27.379 2.347 857 HB3 GLU 116 HB3 GLU 116 -5.984 28.192 2.542 858 HG2 GLU 116 HG2 GLU 116 -3.811 28.831 4.257 859 HG3 GLU 116 HG3 GLU 116 -3.791 29.414 2.732 860 H LEU 117 H LEU 117 -7.829 25.916 4.782 861 HA LEU 117 HA LEU 117 -7.514 23.409 3.684 862 HB2 LEU 117 HB2 LEU 117 -9.118 23.895 5.398 863 HB3 LEU 117 HB3 LEU 117 -10.027 24.693 4.300 864 HG LEU 117 HG LEU 117 -10.263 22.547 3.133 865 HD11 LEU 117 HD11 LEU 117 -9.919 20.551 4.417 866 HD12 LEU 117 HD12 LEU 117 -9.278 21.427 5.616 867 HD13 LEU 117 HD13 LEU 117 -8.514 21.320 4.195 868 HD21 LEU 117 HD21 LEU 117 -12.062 21.830 4.577 869 HD22 LEU 117 HD22 LEU 117 -12.082 23.439 4.423 870 HD23 LEU 117 HD23 LEU 117 -11.480 22.763 5.762 871 H ILE 118 H ILE 118 -7.420 22.751 1.630 872 HA ILE 118 HA ILE 118 -8.744 24.390 -0.384 873 HB ILE 118 HB ILE 118 -6.180 24.005 -0.321 874 HG12 ILE 118 HG12 ILE 118 -7.281 25.420 -1.857 875 HG13 ILE 118 HG13 ILE 118 -5.983 24.656 -2.489 876 HG21 ILE 118 HG21 ILE 118 -5.455 22.262 -1.726 877 HG22 ILE 118 HG22 ILE 118 -6.969 21.702 -1.824 878 HG23 ILE 118 HG23 ILE 118 -6.189 21.680 -0.408 879 HD11 ILE 118 HD11 ILE 118 -7.740 24.752 -4.104 880 HD12 ILE 118 HD12 ILE 118 -8.732 23.963 -3.100 881 HD13 ILE 118 HD13 ILE 118 -7.447 23.208 -3.725 882 H GLY 119 H GLY 119 -9.046 21.641 1.339 883 HA2 GLY 119 HA2 GLY 119 -11.386 20.972 0.200 884 HA3 GLY 119 HA3 GLY 119 -10.296 20.067 -0.613 885 H ALA 120 H ALA 120 -12.509 19.224 1.016 886 HA ALA 120 HA ALA 120 -11.066 17.400 2.716 887 HB1 ALA 120 HB1 ALA 120 -11.815 19.056 4.264 888 HB2 ALA 120 HB2 ALA 120 -12.664 17.702 4.513 889 HB3 ALA 120 HB3 ALA 120 -13.326 18.935 3.702 890 H VAL 121 H VAL 121 -11.685 15.354 2.134 891 HA VAL 121 HA VAL 121 -14.347 15.043 1.115 892 HB VAL 121 HB VAL 121 -12.007 13.965 -0.273 893 HG11 VAL 121 HG11 VAL 121 -13.502 13.119 -1.936 894 HG12 VAL 121 HG12 VAL 121 -14.766 13.634 -1.069 895 HG13 VAL 121 HG13 VAL 121 -13.826 12.447 -0.501 896 HG21 VAL 121 HG21 VAL 121 -12.586 15.435 -2.100 897 HG22 VAL 121 HG22 VAL 121 -12.289 16.306 -0.771 898 HG23 VAL 121 HG23 VAL 121 -13.813 16.034 -1.235 899 HA PRO 122 HA PRO 122 -13.688 11.587 3.781 900 HB2 PRO 122 HB2 PRO 122 -16.143 10.766 4.225 901 HB3 PRO 122 HB3 PRO 122 -15.696 12.185 4.901 902 HG2 PRO 122 HG2 PRO 122 -17.150 11.786 2.477 903 HG3 PRO 122 HG3 PRO 122 -17.503 12.815 3.695 904 HD2 PRO 122 HD2 PRO 122 -16.238 13.648 1.540 905 HD3 PRO 122 HD3 PRO 122 -15.981 14.353 2.991 906 H HIS 123 H HIS 123 -14.081 9.171 3.694 907 HA HIS 123 HA HIS 123 -15.062 8.412 1.054 908 HB2 HIS 123 HB2 HIS 123 -12.651 8.087 1.341 909 HB3 HIS 123 HB3 HIS 123 -13.040 6.900 2.394 910 HD1 HIS 123 HD1 HIS 123 -13.505 7.774 -1.225 911 HD2 HIS 123 HD2 HIS 123 -13.521 4.486 1.222 912 HE1 HIS 123 HE1 HIS 123 -13.704 5.736 -2.639 913 HE2 HIS 123 HE2 HIS 123 -13.712 3.743 -1.185 914 H ASP 124 H ASP 124 -17.095 8.213 1.789 915 HA ASP 124 HA ASP 124 -17.656 6.402 3.967 916 HB2 ASP 124 HB2 ASP 124 -19.886 7.426 3.871 917 HB3 ASP 124 HB3 ASP 124 -18.706 8.480 4.276 918 H GLY 125 H GLY 125 -17.771 6.912 0.686 919 HA2 GLY 125 HA2 GLY 125 -18.653 4.253 0.147 920 HA3 GLY 125 HA3 GLY 125 -19.620 5.420 -0.462 921 H SER 126 H SER 126 -18.491 4.163 -2.510 922 HA SER 126 HA SER 126 -16.239 5.809 -3.056 923 HB2 SER 126 HB2 SER 126 -15.882 3.277 -2.910 924 HB3 SER 126 HB3 SER 126 -16.523 3.234 -4.412 925 HG SER 126 HG SER 126 -14.110 4.148 -3.599 926 HA PRO 127 HA PRO 127 -18.711 6.515 -6.755 927 HB2 PRO 127 HB2 PRO 127 -20.048 8.746 -6.355 928 HB3 PRO 127 HB3 PRO 127 -20.754 7.345 -5.900 929 HG2 PRO 127 HG2 PRO 127 -19.309 9.175 -4.286 930 HG3 PRO 127 HG3 PRO 127 -20.777 8.522 -3.995 931 HD2 PRO 127 HD2 PRO 127 -18.646 7.489 -2.901 932 HD3 PRO 127 HD3 PRO 127 -19.888 6.525 -3.345 933 H ALA 128 H ALA 128 -18.317 8.412 -8.250 934 HA ALA 128 HA ALA 128 -15.672 8.954 -8.096 935 HB1 ALA 128 HB1 ALA 128 -16.974 9.107 -10.173 936 HB2 ALA 128 HB2 ALA 128 -16.058 10.430 -10.016 937 HB3 ALA 128 HB3 ALA 128 -17.633 10.488 -9.651 938 H SER 129 H SER 129 -18.159 10.806 -6.683 939 HA SER 129 HA SER 129 -16.677 13.135 -6.340 940 HB2 SER 129 HB2 SER 129 -18.481 13.678 -4.711 941 HB3 SER 129 HB3 SER 129 -19.067 13.209 -6.162 942 HG SER 129 HG SER 129 -20.157 12.124 -4.596 943 H ARG 130 H ARG 130 -16.592 10.217 -4.711 944 HA ARG 130 HA ARG 130 -15.300 11.344 -2.417 945 HB2 ARG 130 HB2 ARG 130 -16.316 8.656 -2.756 946 HB3 ARG 130 HB3 ARG 130 -15.658 9.204 -1.366 947 HG2 ARG 130 HG2 ARG 130 -18.125 10.161 -2.509 948 HG3 ARG 130 HG3 ARG 130 -18.015 9.197 -1.195 949 HD2 ARG 130 HD2 ARG 130 -16.808 11.022 -0.097 950 HD3 ARG 130 HD3 ARG 130 -17.247 11.966 -1.355 951 HE ARG 130 HE ARG 130 -19.053 10.806 0.574 952 HH11 ARG 130 HH11 ARG 130 -20.955 11.807 0.912 953 HH12 ARG 130 HH12 ARG 130 -21.412 13.194 -0.020 954 HH21 ARG 130 HH21 ARG 130 -18.539 13.232 -1.930 955 HH22 ARG 130 HH22 ARG 130 -20.062 13.993 -1.611 956 H ASN 131 H ASN 131 -14.159 10.742 -5.160 957 HA ASN 131 HA ASN 131 -12.481 8.652 -4.908 958 HB2 ASN 131 HB2 ASN 131 -12.650 10.888 -6.690 959 HB3 ASN 131 HB3 ASN 131 -11.170 10.196 -6.690 960 HD21 ASN 131 HD21 ASN 131 -13.306 8.758 -9.353 961 HD22 ASN 131 HD22 ASN 131 -12.979 10.391 -8.877 962 H LEU 132 H LEU 132 -10.201 8.352 -4.956 963 HA LEU 132 HA LEU 132 -8.898 9.696 -2.897 964 HB2 LEU 132 HB2 LEU 132 -8.534 7.382 -4.197 965 HB3 LEU 132 HB3 LEU 132 -7.215 8.240 -4.634 966 HG LEU 132 HG LEU 132 -7.866 7.375 -1.983 967 HD11 LEU 132 HD11 LEU 132 -5.821 6.088 -2.206 968 HD12 LEU 132 HD12 LEU 132 -5.633 6.660 -3.707 969 HD13 LEU 132 HD13 LEU 132 -6.868 5.674 -3.366 970 HD21 LEU 132 HD21 LEU 132 -5.848 8.382 -1.205 971 HD22 LEU 132 HD22 LEU 132 -6.866 9.510 -1.757 972 HD23 LEU 132 HD23 LEU 132 -5.610 9.042 -2.662 973 H SER 133 H SER 133 -9.115 10.216 -6.203 974 HA SER 133 HA SER 133 -6.712 11.813 -6.339 975 HB2 SER 133 HB2 SER 133 -8.452 10.896 -8.479 976 HB3 SER 133 HB3 SER 133 -7.075 11.737 -8.727 977 HG SER 133 HG SER 133 -7.404 9.146 -8.123 978 H HIS 134 H HIS 134 -6.754 14.049 -6.840 979 HA HIS 134 HA HIS 134 -9.380 15.168 -6.543 980 HB2 HIS 134 HB2 HIS 134 -7.065 16.067 -5.012 981 HB3 HIS 134 HB3 HIS 134 -8.578 16.653 -4.821 982 HD1 HIS 134 HD1 HIS 134 -6.381 14.671 -3.037 983 HD2 HIS 134 HD2 HIS 134 -10.310 14.195 -4.102 984 HE1 HIS 134 HE1 HIS 134 -7.398 12.936 -1.569 985 HE2 HIS 134 HE2 HIS 134 -9.758 12.618 -2.210 986 H HIS 135 H HIS 135 -9.992 16.905 -7.593 987 HA HIS 135 HA HIS 135 -8.232 18.028 -9.511 988 HB2 HIS 135 HB2 HIS 135 -10.952 18.633 -8.764 989 HB3 HIS 135 HB3 HIS 135 -10.173 19.505 -9.904 990 HD1 HIS 135 HD1 HIS 135 -10.235 18.716 -12.295 991 HD2 HIS 135 HD2 HIS 135 -11.387 15.872 -9.580 992 HE1 HIS 135 HE1 HIS 135 -11.036 16.719 -13.538 993 HE2 HIS 135 HE2 HIS 135 -11.745 14.993 -11.923 994 H ILE 136 H ILE 136 -6.861 19.757 -9.166 995 HA ILE 136 HA ILE 136 -7.489 21.456 -6.933 996 HB ILE 136 HB ILE 136 -4.778 20.541 -7.535 997 HG12 ILE 136 HG12 ILE 136 -6.054 18.862 -6.426 998 HG13 ILE 136 HG13 ILE 136 -4.738 19.319 -5.574 999 HG21 ILE 136 HG21 ILE 136 -4.029 21.791 -5.592 1000 HG22 ILE 136 HG22 ILE 136 -5.528 22.359 -5.381 1001 HG23 ILE 136 HG23 ILE 136 -4.676 22.792 -6.684 1002 HD11 ILE 136 HD11 ILE 136 -6.607 19.023 -4.095 1003 HD12 ILE 136 HD12 ILE 136 -7.456 20.122 -4.923 1004 HD13 ILE 136 HD13 ILE 136 -6.153 20.575 -4.078 1005 H TYR 137 H TYR 137 -7.636 23.601 -7.571 1006 HA TYR 137 HA TYR 137 -6.556 24.299 -10.094 1007 HB2 TYR 137 HB2 TYR 137 -8.637 25.253 -9.548 1008 HB3 TYR 137 HB3 TYR 137 -7.990 25.972 -8.232 1009 HD1 TYR 137 HD1 TYR 137 -6.951 28.132 -8.400 1010 HD2 TYR 137 HD2 TYR 137 -7.881 26.021 -11.866 1011 HE1 TYR 137 HE1 TYR 137 -6.341 30.049 -9.735 1012 HE2 TYR 137 HE2 TYR 137 -7.256 27.942 -13.199 1013 HH TYR 137 HH TYR 137 -6.266 29.981 -13.235 1014 H ILE 138 H ILE 138 -4.688 25.374 -10.501 1015 HA ILE 138 HA ILE 138 -3.131 26.224 -8.225 1016 HB ILE 138 HB ILE 138 -2.232 25.449 -10.881 1017 HG12 ILE 138 HG12 ILE 138 -2.827 23.563 -9.610 1018 HG13 ILE 138 HG13 ILE 138 -1.207 23.583 -9.815 1019 HG21 ILE 138 HG21 ILE 138 0.015 25.728 -10.145 1020 HG22 ILE 138 HG22 ILE 138 -0.515 26.320 -8.737 1021 HG23 ILE 138 HG23 ILE 138 -0.776 27.138 -10.108 1022 HD11 ILE 138 HD11 ILE 138 -1.737 22.905 -7.574 1023 HD12 ILE 138 HD12 ILE 138 -2.538 24.288 -7.328 1024 HD13 ILE 138 HD13 ILE 138 -0.934 24.308 -7.532 1025 HA PRO 139 HA PRO 139 -3.962 30.208 -9.893 1026 HB2 PRO 139 HB2 PRO 139 -2.336 31.755 -8.464 1027 HB3 PRO 139 HB3 PRO 139 -3.679 31.150 -7.759 1028 HG2 PRO 139 HG2 PRO 139 -1.028 30.094 -7.643 1029 HG3 PRO 139 HG3 PRO 139 -2.044 30.375 -6.395 1030 HD2 PRO 139 HD2 PRO 139 -1.872 27.982 -7.348 1031 HD3 PRO 139 HD3 PRO 139 -3.336 28.543 -6.891 1032 H GLU 140 H GLU 140 -3.274 31.587 -11.429 1033 HA GLU 140 HA GLU 140 -0.808 30.698 -12.675 1034 HB2 GLU 140 HB2 GLU 140 -3.028 30.287 -13.738 1035 HB3 GLU 140 HB3 GLU 140 -3.078 31.897 -14.009 1036 HG2 GLU 140 HG2 GLU 140 -1.333 31.766 -15.507 1037 HG3 GLU 140 HG3 GLU 140 -1.055 30.204 -15.121 1038 H ASP 141 H ASP 141 -2.222 33.217 -11.169 1039 HA ASP 141 HA ASP 141 -0.918 35.245 -12.632 1040 HB2 ASP 141 HB2 ASP 141 -2.192 36.751 -11.247 1041 HB3 ASP 141 HB3 ASP 141 -3.184 35.523 -11.666 1042 H ARG 142 H ARG 142 0.365 33.285 -10.534 1043 HA ARG 142 HA ARG 142 2.219 35.202 -9.575 1044 HB2 ARG 142 HB2 ARG 142 1.891 34.682 -7.245 1045 HB3 ARG 142 HB3 ARG 142 0.539 35.334 -7.887 1046 HG2 ARG 142 HG2 ARG 142 -0.273 33.012 -8.133 1047 HG3 ARG 142 HG3 ARG 142 0.950 32.591 -7.136 1048 HD2 ARG 142 HD2 ARG 142 -0.930 32.868 -5.786 1049 HD3 ARG 142 HD3 ARG 142 0.026 34.162 -5.502 1050 HE ARG 142 HE ARG 142 -1.769 34.774 -7.539 1051 HH11 ARG 142 HH11 ARG 142 -3.461 36.124 -7.186 1052 HH12 ARG 142 HH12 ARG 142 -4.034 36.430 -5.580 1053 HH21 ARG 142 HH21 ARG 142 -1.711 34.425 -4.034 1054 HH22 ARG 142 HH22 ARG 142 -3.064 35.486 -3.826 1055 H LEU 143 H LEU 143 4.154 34.464 -8.677 1056 HA LEU 143 HA LEU 143 4.689 31.724 -9.399 1057 HB2 LEU 143 HB2 LEU 143 6.346 34.070 -9.602 1058 HB3 LEU 143 HB3 LEU 143 7.044 32.594 -9.594 1059 HG LEU 143 HG LEU 143 5.726 32.139 -11.618 1060 HD11 LEU 143 HD11 LEU 143 5.076 33.987 -12.970 1061 HD12 LEU 143 HD12 LEU 143 5.418 35.000 -11.757 1062 HD13 LEU 143 HD13 LEU 143 4.205 33.942 -11.608 1063 HD21 LEU 143 HD21 LEU 143 7.429 33.200 -13.007 1064 HD22 LEU 143 HD22 LEU 143 8.113 32.532 -11.703 1065 HD23 LEU 143 HD23 LEU 143 7.859 34.128 -11.754 1066 H GLY 144 H GLY 144 5.734 30.346 -7.904 1067 HA2 GLY 144 HA2 GLY 144 7.523 30.807 -6.112 1068 HA3 GLY 144 HA3 GLY 144 6.255 31.469 -5.324 1069 H TYR 145 H TYR 145 7.715 29.547 -4.128 1070 HA TYR 145 HA TYR 145 6.420 27.091 -4.583 1071 HB2 TYR 145 HB2 TYR 145 8.021 26.318 -2.788 1072 HB3 TYR 145 HB3 TYR 145 8.657 26.752 -4.228 1073 HD1 TYR 145 HD1 TYR 145 10.208 28.569 -4.406 1074 HD2 TYR 145 HD2 TYR 145 8.185 27.908 -0.827 1075 HE1 TYR 145 HE1 TYR 145 11.612 30.200 -3.307 1076 HE2 TYR 145 HE2 TYR 145 9.590 29.544 0.262 1077 HH TYR 145 HH TYR 145 12.368 30.578 -0.671 1078 H HIS 146 H HIS 146 5.329 25.762 -3.223 1079 HA HIS 146 HA HIS 146 4.233 26.899 -0.810 1080 HB2 HIS 146 HB2 HIS 146 2.568 25.918 -2.965 1081 HB3 HIS 146 HB3 HIS 146 2.005 26.398 -1.509 1082 HD1 HIS 146 HD1 HIS 146 1.695 28.920 -1.027 1083 HD2 HIS 146 HD2 HIS 146 3.259 28.023 -4.702 1084 HE1 HIS 146 HE1 HIS 146 1.664 30.981 -2.427 1085 HE2 HIS 146 HE2 HIS 146 2.617 30.461 -4.645 1086 H VAL 147 H VAL 147 3.279 25.125 0.574 1087 HA VAL 147 HA VAL 147 4.083 22.525 -0.410 1088 HB VAL 147 HB VAL 147 3.735 23.165 2.395 1089 HG11 VAL 147 HG11 VAL 147 4.823 21.052 2.806 1090 HG12 VAL 147 HG12 VAL 147 4.911 20.783 1.213 1091 HG13 VAL 147 HG13 VAL 147 3.471 20.818 1.949 1092 HG21 VAL 147 HG21 VAL 147 6.153 23.188 2.560 1093 HG22 VAL 147 HG22 VAL 147 5.664 24.350 1.548 1094 HG23 VAL 147 HG23 VAL 147 6.267 22.969 0.962 1095 H ILE 148 H ILE 148 2.503 20.970 -0.712 1096 HA ILE 148 HA ILE 148 -0.191 21.696 -0.030 1097 HB ILE 148 HB ILE 148 0.672 19.401 -1.588 1098 HG12 ILE 148 HG12 ILE 148 -0.573 21.790 -2.599 1099 HG13 ILE 148 HG13 ILE 148 1.037 21.529 -2.667 1100 HG21 ILE 148 HG21 ILE 148 -1.680 19.095 -2.122 1101 HG22 ILE 148 HG22 ILE 148 -2.067 20.329 -1.150 1102 HG23 ILE 148 HG23 ILE 148 -1.466 18.964 -0.524 1103 HD11 ILE 148 HD11 ILE 148 0.037 21.023 -4.792 1104 HD12 ILE 148 HD12 ILE 148 -0.930 19.932 -4.092 1105 HD13 ILE 148 HD13 ILE 148 0.665 19.673 -4.160 1106 H LEU 149 H LEU 149 -0.974 20.965 1.951 1107 HA LEU 149 HA LEU 149 0.525 18.869 3.264 1108 HB2 LEU 149 HB2 LEU 149 -1.273 20.791 4.460 1109 HB3 LEU 149 HB3 LEU 149 -0.301 19.772 5.288 1110 HG LEU 149 HG LEU 149 0.730 21.923 3.674 1111 HD11 LEU 149 HD11 LEU 149 1.062 23.131 5.718 1112 HD12 LEU 149 HD12 LEU 149 0.323 21.949 6.538 1113 HD13 LEU 149 HD13 LEU 149 -0.514 22.852 5.489 1114 HD21 LEU 149 HD21 LEU 149 2.775 21.570 4.844 1115 HD22 LEU 149 HD22 LEU 149 2.343 20.224 4.060 1116 HD23 LEU 149 HD23 LEU 149 2.107 20.342 5.656 1117 H ALA 150 H ALA 150 -0.523 16.899 3.898 1118 HA ALA 150 HA ALA 150 -3.363 16.936 3.706 1119 HB1 ALA 150 HB1 ALA 150 -2.642 16.244 1.475 1120 HB2 ALA 150 HB2 ALA 150 -3.446 15.030 2.179 1121 HB3 ALA 150 HB3 ALA 150 -1.830 15.005 2.123 1122 H VAL 151 H VAL 151 -4.545 15.428 4.821 1123 HA VAL 151 HA VAL 151 -3.010 13.650 6.519 1124 HB VAL 151 HB VAL 151 -5.400 15.054 7.377 1125 HG11 VAL 151 HG11 VAL 151 -4.943 14.158 9.563 1126 HG12 VAL 151 HG12 VAL 151 -3.675 13.347 8.971 1127 HG13 VAL 151 HG13 VAL 151 -5.174 12.954 8.508 1128 HG21 VAL 151 HG21 VAL 151 -3.959 16.364 8.804 1129 HG22 VAL 151 HG22 VAL 151 -3.561 16.598 7.254 1130 HG23 VAL 151 HG23 VAL 151 -2.664 15.623 8.181 1131 H TRP 152 H TRP 152 -3.769 11.526 6.623 1132 HA TRP 152 HA TRP 152 -6.172 10.938 5.113 1133 HB2 TRP 152 HB2 TRP 152 -4.221 10.636 3.747 1134 HB3 TRP 152 HB3 TRP 152 -3.634 9.581 4.847 1135 HD1 TRP 152 HD1 TRP 152 -6.738 8.206 4.787 1136 HE1 TRP 152 HE1 TRP 152 -7.163 6.425 3.081 1137 HE3 TRP 152 HE3 TRP 152 -2.927 9.325 1.759 1138 HZ2 TRP 152 HZ2 TRP 152 -5.877 5.616 0.706 1139 HZ3 TRP 152 HZ3 TRP 152 -2.594 8.007 -0.241 1140 HH2 TRP 152 HH2 TRP 152 -4.041 6.143 -0.731 1141 H ASP 153 H ASP 153 -7.600 9.963 6.269 1142 HA ASP 153 HA ASP 153 -6.805 8.504 8.587 1143 HB2 ASP 153 HB2 ASP 153 -8.610 10.154 8.658 1144 HB3 ASP 153 HB3 ASP 153 -9.506 9.123 7.764 1145 H VAL 154 H VAL 154 -6.908 6.323 8.842 1146 HA VAL 154 HA VAL 154 -8.215 4.738 6.794 1147 HB VAL 154 HB VAL 154 -5.490 4.292 7.707 1148 HG11 VAL 154 HG11 VAL 154 -5.427 2.393 6.300 1149 HG12 VAL 154 HG12 VAL 154 -6.990 2.600 5.939 1150 HG13 VAL 154 HG13 VAL 154 -6.553 2.209 7.446 1151 HG21 VAL 154 HG21 VAL 154 -4.873 4.639 5.387 1152 HG22 VAL 154 HG22 VAL 154 -5.619 5.960 5.947 1153 HG23 VAL 154 HG23 VAL 154 -6.422 4.914 5.011 1154 H ALA 155 H ALA 155 -9.354 2.937 7.696 1155 HA ALA 155 HA ALA 155 -9.275 2.983 10.546 1156 HB1 ALA 155 HB1 ALA 155 -11.448 3.516 9.502 1157 HB2 ALA 155 HB2 ALA 155 -11.613 2.227 10.464 1158 HB3 ALA 155 HB3 ALA 155 -11.492 2.031 8.864 1159 H ASP 156 H ASP 156 -8.302 0.910 8.192 1160 HA ASP 156 HA ASP 156 -8.630 -1.384 9.892 1161 HB2 ASP 156 HB2 ASP 156 -8.165 -2.778 8.046 1162 HB3 ASP 156 HB3 ASP 156 -9.314 -1.703 7.608 1163 H THR 157 H THR 157 -6.666 0.870 10.049 1164 HA THR 157 HA THR 157 -4.380 -0.797 10.562 1165 HB THR 157 HB THR 157 -2.933 1.161 9.990 1166 HG1 THR 157 HG1 THR 157 -3.752 2.892 9.180 1167 HG21 THR 157 HG21 THR 157 -2.988 0.739 7.626 1168 HG22 THR 157 HG22 THR 157 -4.441 0.045 7.767 1169 HG23 THR 157 HG23 THR 157 -3.138 -0.671 8.404 1170 H GLU 158 H GLU 158 -3.124 -0.133 12.457 1171 HA GLU 158 HA GLU 158 -4.707 1.028 14.402 1172 HB2 GLU 158 HB2 GLU 158 -1.894 0.320 14.373 1173 HB3 GLU 158 HB3 GLU 158 -2.559 0.961 15.719 1174 HG2 GLU 158 HG2 GLU 158 -2.519 -1.285 16.087 1175 HG3 GLU 158 HG3 GLU 158 -4.076 -0.942 15.733 1176 H ASN 159 H ASN 159 -2.741 2.367 12.103 1177 HA ASN 159 HA ASN 159 -2.463 4.823 13.563 1178 HB2 ASN 159 HB2 ASN 159 -0.664 3.663 11.601 1179 HB3 ASN 159 HB3 ASN 159 -0.463 5.188 12.149 1180 HD21 ASN 159 HD21 ASN 159 1.520 2.531 13.994 1181 HD22 ASN 159 HD22 ASN 159 1.079 2.587 12.320 1182 H ALA 160 H ALA 160 -2.072 6.801 12.127 1183 HA ALA 160 HA ALA 160 -3.837 6.716 9.815 1184 HB1 ALA 160 HB1 ALA 160 -4.879 8.017 11.507 1185 HB2 ALA 160 HB2 ALA 160 -4.423 9.003 10.309 1186 HB3 ALA 160 HB3 ALA 160 -3.550 8.923 11.668 1187 H PHE 161 H PHE 161 -3.176 8.373 8.112 1188 HA PHE 161 HA PHE 161 -0.324 8.342 8.076 1189 HB2 PHE 161 HB2 PHE 161 -2.189 8.157 5.844 1190 HB3 PHE 161 HB3 PHE 161 -0.574 8.222 5.609 1191 HD1 PHE 161 HD1 PHE 161 -3.205 6.125 6.930 1192 HD2 PHE 161 HD2 PHE 161 0.774 6.259 5.725 1193 HE1 PHE 161 HE1 PHE 161 -3.086 3.719 7.069 1194 HE2 PHE 161 HE2 PHE 161 0.884 3.853 5.816 1195 HZ PHE 161 HZ PHE 161 -1.043 2.583 6.498 1196 H TYR 162 H TYR 162 0.981 9.944 7.287 1197 HA TYR 162 HA TYR 162 -0.359 12.418 6.623 1198 HB2 TYR 162 HB2 TYR 162 1.846 12.001 8.380 1199 HB3 TYR 162 HB3 TYR 162 1.796 13.407 7.550 1200 HD1 TYR 162 HD1 TYR 162 -0.328 11.414 9.772 1201 HD2 TYR 162 HD2 TYR 162 0.663 15.246 8.487 1202 HE1 TYR 162 HE1 TYR 162 -1.844 12.356 11.400 1203 HE2 TYR 162 HE2 TYR 162 -0.825 16.184 10.143 1204 HH TYR 162 HH TYR 162 -3.173 15.022 11.428 1205 H GLN 163 H GLN 163 0.330 13.532 4.823 1206 HA GLN 163 HA GLN 163 2.765 12.744 3.562 1207 HB2 GLN 163 HB2 GLN 163 1.612 12.488 1.399 1208 HB3 GLN 163 HB3 GLN 163 1.510 11.230 2.436 1209 HG2 GLN 163 HG2 GLN 163 -0.619 13.151 2.192 1210 HG3 GLN 163 HG3 GLN 163 -0.569 11.804 1.270 1211 HE21 GLN 163 HE21 GLN 163 -2.327 11.625 4.740 1212 HE22 GLN 163 HE22 GLN 163 -2.025 13.052 3.806 1213 H VAL 164 H VAL 164 3.704 14.465 2.380 1214 HA VAL 164 HA VAL 164 2.001 16.740 1.968 1215 HB VAL 164 HB VAL 164 3.664 18.306 2.698 1216 HG11 VAL 164 HG11 VAL 164 3.465 17.927 5.089 1217 HG12 VAL 164 HG12 VAL 164 3.003 16.402 4.810 1218 HG13 VAL 164 HG13 VAL 164 2.047 17.629 4.371 1219 HG21 VAL 164 HG21 VAL 164 5.603 17.598 3.876 1220 HG22 VAL 164 HG22 VAL 164 5.634 17.053 2.354 1221 HG23 VAL 164 HG23 VAL 164 5.235 16.055 3.562 1222 H ILE 165 H ILE 165 2.618 18.083 0.109 1223 HA ILE 165 HA ILE 165 4.680 16.860 -1.484 1224 HB ILE 165 HB ILE 165 2.224 17.882 -2.673 1225 HG12 ILE 165 HG12 ILE 165 2.984 15.110 -2.517 1226 HG13 ILE 165 HG13 ILE 165 1.890 15.798 -1.518 1227 HG21 ILE 165 HG21 ILE 165 3.103 16.996 -4.773 1228 HG22 ILE 165 HG22 ILE 165 4.452 16.528 -4.014 1229 HG23 ILE 165 HG23 ILE 165 4.125 18.102 -4.184 1230 HD11 ILE 165 HD11 ILE 165 0.761 14.592 -3.260 1231 HD12 ILE 165 HD12 ILE 165 1.506 15.487 -4.381 1232 HD13 ILE 165 HD13 ILE 165 0.423 16.167 -3.392 1233 H ASP 166 H ASP 166 6.336 18.352 -1.485 1234 HA ASP 166 HA ASP 166 5.792 21.129 -1.261 1235 HB2 ASP 166 HB2 ASP 166 7.803 19.990 -0.433 1236 HB3 ASP 166 HB3 ASP 166 8.330 20.010 -1.979 1237 H VAL 167 H VAL 167 5.500 22.608 -2.951 1238 HA VAL 167 HA VAL 167 6.090 21.621 -5.551 1239 HB VAL 167 HB VAL 167 3.912 22.537 -6.402 1240 HG11 VAL 167 HG11 VAL 167 2.577 20.662 -5.704 1241 HG12 VAL 167 HG12 VAL 167 3.639 20.339 -4.528 1242 HG13 VAL 167 HG13 VAL 167 4.071 20.169 -6.077 1243 HG21 VAL 167 HG21 VAL 167 2.156 22.955 -4.818 1244 HG22 VAL 167 HG22 VAL 167 3.374 23.992 -4.579 1245 HG23 VAL 167 HG23 VAL 167 3.192 22.719 -3.599 1246 H ASP 168 H ASP 168 6.262 23.225 -7.285 1247 HA ASP 168 HA ASP 168 6.702 25.899 -6.240 1248 HB2 ASP 168 HB2 ASP 168 8.765 24.839 -6.858 1249 HB3 ASP 168 HB3 ASP 168 8.232 24.813 -8.401 1250 H LEU 169 H LEU 169 5.019 27.124 -6.910 1251 HA LEU 169 HA LEU 169 3.639 26.274 -9.305 1252 HB2 LEU 169 HB2 LEU 169 2.708 28.132 -7.308 1253 HB3 LEU 169 HB3 LEU 169 1.792 27.420 -8.458 1254 HG LEU 169 HG LEU 169 2.948 26.069 -6.196 1255 HD11 LEU 169 HD11 LEU 169 0.669 25.809 -5.413 1256 HD12 LEU 169 HD12 LEU 169 0.141 26.669 -6.676 1257 HD13 LEU 169 HD13 LEU 169 1.044 27.377 -5.536 1258 HD21 LEU 169 HD21 LEU 169 1.758 24.106 -6.877 1259 HD22 LEU 169 HD22 LEU 169 2.838 24.538 -8.000 1260 HD23 LEU 169 HD23 LEU 169 1.270 24.868 -8.217 1261 H VAL 170 H VAL 170 4.493 27.213 -11.109 1262 HA VAL 170 HA VAL 170 4.844 30.013 -11.018 1263 HB VAL 170 HB VAL 170 7.147 29.886 -11.963 1264 HG11 VAL 170 HG11 VAL 170 8.326 29.271 -9.968 1265 HG12 VAL 170 HG12 VAL 170 6.982 28.591 -9.380 1266 HG13 VAL 170 HG13 VAL 170 7.048 30.192 -9.602 1267 HG21 VAL 170 HG21 VAL 170 8.313 27.775 -11.942 1268 HG22 VAL 170 HG22 VAL 170 7.031 27.690 -12.924 1269 HG23 VAL 170 HG23 VAL 170 6.964 27.033 -11.448 1270 H ASN 171 H ASN 171 5.516 30.973 -13.257 1271 HA ASN 171 HA ASN 171 4.027 29.710 -15.288 1272 HB2 ASN 171 HB2 ASN 171 4.274 32.101 -15.221 1273 HB3 ASN 171 HB3 ASN 171 5.859 31.929 -15.577 1274 HD21 ASN 171 HD21 ASN 171 4.966 32.594 -18.861 1275 HD22 ASN 171 HD22 ASN 171 5.743 33.199 -17.436 1276 H LYS 172 H LYS 172 4.863 28.752 -17.258 1277 HA LYS 172 HA LYS 172 7.263 27.343 -16.934 1278 HB2 LYS 172 HB2 LYS 172 6.804 26.428 -19.065 1279 HB3 LYS 172 HB3 LYS 172 5.409 26.483 -18.217 1280 HG2 LYS 172 HG2 LYS 172 4.518 27.474 -19.956 1281 HG3 LYS 172 HG3 LYS 172 5.401 28.790 -19.561 1282 HD2 LYS 172 HD2 LYS 172 7.116 27.290 -20.954 1283 HD3 LYS 172 HD3 LYS 172 5.710 27.111 -21.765 1284 HE2 LYS 172 HE2 LYS 172 6.691 28.923 -22.767 1285 HE3 LYS 172 HE3 LYS 172 5.586 29.588 -21.764 1286 HZ1 LYS 172 HZ1 LYS 172 7.656 30.735 -21.576 1287 HZ2 LYS 172 HZ2 LYS 172 8.395 29.357 -21.164 1288 HZ3 LYS 172 HZ3 LYS 172 7.302 30.015 -20.172 Start of MODEL 20 1 H1 HIS 1 H1 HIS 1 0.582 5.155 2.248 2 H2 HIS 1 H2 HIS 1 1.321 4.530 0.953 3 H3 HIS 1 H3 HIS 1 0.100 3.732 1.651 4 HA HIS 1 HA HIS 1 -1.392 5.373 1.026 5 HB2 HIS 1 HB2 HIS 1 -0.645 7.157 -0.528 6 HB3 HIS 1 HB3 HIS 1 -0.135 7.333 1.013 7 HD1 HIS 1 HD1 HIS 1 1.934 8.759 0.498 8 HD2 HIS 1 HD2 HIS 1 1.833 5.140 -1.413 9 HE1 HIS 1 HE1 HIS 1 4.166 8.334 -0.514 10 HE2 HIS 1 HE2 HIS 1 4.128 6.154 -1.665 11 H GLY 2 H GLY 2 0.206 2.929 -0.192 12 HA2 GLY 2 HA2 GLY 2 -0.353 1.661 -2.011 13 HA3 GLY 2 HA3 GLY 2 -1.498 2.746 -2.435 14 H PHE 3 H PHE 3 -0.904 2.501 -4.683 15 HA PHE 3 HA PHE 3 1.727 3.394 -5.346 16 HB2 PHE 3 HB2 PHE 3 -0.330 2.459 -7.162 17 HB3 PHE 3 HB3 PHE 3 1.264 2.558 -7.507 18 HD1 PHE 3 HD1 PHE 3 2.847 1.051 -6.072 19 HD2 PHE 3 HD2 PHE 3 -1.243 0.403 -6.507 20 HE1 PHE 3 HE1 PHE 3 3.135 -1.228 -5.335 21 HE2 PHE 3 HE2 PHE 3 -0.966 -1.882 -5.775 22 HZ PHE 3 HZ PHE 3 1.227 -2.698 -5.185 23 H ILE 4 H ILE 4 2.281 5.360 -6.169 24 HA ILE 4 HA ILE 4 0.165 7.245 -6.487 25 HB ILE 4 HB ILE 4 3.031 7.724 -6.677 26 HG12 ILE 4 HG12 ILE 4 1.255 8.491 -4.540 27 HG13 ILE 4 HG13 ILE 4 2.217 7.173 -4.473 28 HG21 ILE 4 HG21 ILE 4 2.502 10.091 -6.729 29 HG22 ILE 4 HG22 ILE 4 0.922 9.746 -6.752 30 HG23 ILE 4 HG23 ILE 4 1.852 9.364 -8.018 31 HD11 ILE 4 HD11 ILE 4 3.212 8.974 -3.245 32 HD12 ILE 4 HD12 ILE 4 3.203 9.902 -4.570 33 HD13 ILE 4 HD13 ILE 4 4.155 8.597 -4.503 34 H GLU 5 H GLU 5 -0.903 7.300 -8.398 35 HA GLU 5 HA GLU 5 0.392 6.267 -10.716 36 HB2 GLU 5 HB2 GLU 5 -1.890 5.649 -10.134 37 HB3 GLU 5 HB3 GLU 5 -2.343 7.197 -10.391 38 HG2 GLU 5 HG2 GLU 5 -1.532 6.787 -12.711 39 HG3 GLU 5 HG3 GLU 5 -1.707 5.212 -12.316 40 H LYS 6 H LYS 6 -1.071 9.230 -9.665 41 HA LYS 6 HA LYS 6 0.307 10.694 -11.736 42 HB2 LYS 6 HB2 LYS 6 -2.489 11.196 -11.138 43 HB3 LYS 6 HB3 LYS 6 -1.618 11.981 -12.275 44 HG2 LYS 6 HG2 LYS 6 -2.353 9.213 -12.479 45 HG3 LYS 6 HG3 LYS 6 -3.185 10.424 -13.192 46 HD2 LYS 6 HD2 LYS 6 -1.383 10.885 -14.616 47 HD3 LYS 6 HD3 LYS 6 -0.447 9.797 -13.837 48 HE2 LYS 6 HE2 LYS 6 -2.108 8.100 -14.494 49 HE3 LYS 6 HE3 LYS 6 -2.734 9.228 -15.495 50 HZ1 LYS 6 HZ1 LYS 6 -1.287 7.795 -16.682 51 HZ2 LYS 6 HZ2 LYS 6 -0.069 8.181 -15.691 52 HZ3 LYS 6 HZ3 LYS 6 -0.689 9.298 -16.682 53 HA PRO 7 HA PRO 7 0.305 13.162 -12.218 54 HB2 PRO 7 HB2 PRO 7 1.514 15.460 -11.654 55 HB3 PRO 7 HB3 PRO 7 -0.092 15.351 -11.377 56 HG2 PRO 7 HG2 PRO 7 2.031 15.096 -9.509 57 HG3 PRO 7 HG3 PRO 7 0.620 15.898 -9.329 58 HD2 PRO 7 HD2 PRO 7 1.006 13.462 -8.353 59 HD3 PRO 7 HD3 PRO 7 -0.482 14.035 -8.709 60 H GLY 8 H GLY 8 1.636 12.141 -13.475 61 HA2 GLY 8 HA2 GLY 8 3.652 11.382 -14.181 62 HA3 GLY 8 HA3 GLY 8 4.352 12.637 -13.405 63 H SER 9 H SER 9 6.184 11.401 -12.725 64 HA SER 9 HA SER 9 5.490 9.759 -10.480 65 HB2 SER 9 HB2 SER 9 6.232 8.247 -12.188 66 HB3 SER 9 HB3 SER 9 7.634 9.074 -12.325 67 HG SER 9 HG SER 9 7.597 8.529 -9.891 68 H ARG 10 H ARG 10 6.065 10.846 -8.699 69 HA ARG 10 HA ARG 10 8.135 12.662 -8.663 70 HB2 ARG 10 HB2 ARG 10 7.949 12.568 -6.226 71 HB3 ARG 10 HB3 ARG 10 6.565 12.932 -7.013 72 HG2 ARG 10 HG2 ARG 10 5.808 11.494 -5.476 73 HG3 ARG 10 HG3 ARG 10 6.061 10.483 -6.734 74 HD2 ARG 10 HD2 ARG 10 8.379 10.360 -5.469 75 HD3 ARG 10 HD3 ARG 10 7.319 10.478 -4.232 76 HE ARG 10 HE ARG 10 6.842 8.498 -6.273 77 HH11 ARG 10 HH11 ARG 10 7.655 9.093 -2.885 78 HH12 ARG 10 HH12 ARG 10 7.345 7.445 -2.450 79 HH21 ARG 10 HH21 ARG 10 6.430 6.468 -5.628 80 HH22 ARG 10 HH22 ARG 10 6.661 5.984 -3.982 81 H ALA 11 H ALA 11 8.204 9.322 -8.493 82 HA ALA 11 HA ALA 11 10.492 8.951 -7.023 83 HB1 ALA 11 HB1 ALA 11 9.005 7.113 -7.572 84 HB2 ALA 11 HB2 ALA 11 10.517 6.715 -7.987 85 HB3 ALA 11 HB3 ALA 11 9.467 7.195 -9.120 86 H ALA 12 H ALA 12 10.138 10.004 -10.253 87 HA ALA 12 HA ALA 12 12.630 9.350 -11.199 88 HB1 ALA 12 HB1 ALA 12 10.913 10.215 -12.661 89 HB2 ALA 12 HB2 ALA 12 12.259 11.089 -12.857 90 HB3 ALA 12 HB3 ALA 12 11.040 11.670 -11.969 91 H LEU 13 H LEU 13 11.575 12.201 -9.492 92 HA LEU 13 HA LEU 13 14.069 13.429 -9.507 93 HB2 LEU 13 HB2 LEU 13 11.745 13.951 -7.865 94 HB3 LEU 13 HB3 LEU 13 13.076 14.892 -7.775 95 HG LEU 13 HG LEU 13 12.599 15.387 -10.167 96 HD11 LEU 13 HD11 LEU 13 10.292 15.331 -10.795 97 HD12 LEU 13 HD12 LEU 13 9.934 14.534 -9.434 98 HD13 LEU 13 HD13 LEU 13 10.849 13.830 -10.567 99 HD21 LEU 13 HD21 LEU 13 11.211 17.253 -9.425 100 HD22 LEU 13 HD22 LEU 13 12.425 17.020 -8.383 101 HD23 LEU 13 HD23 LEU 13 10.941 16.486 -8.027 102 H CYS 14 H CYS 14 12.774 10.999 -7.698 103 HA CYS 14 HA CYS 14 14.237 11.459 -5.315 104 HB2 CYS 14 HB2 CYS 14 12.052 10.427 -5.525 105 HB3 CYS 14 HB3 CYS 14 12.823 9.110 -6.107 106 H SER 15 H SER 15 14.742 9.930 -8.249 107 HA SER 15 HA SER 15 16.772 8.214 -7.215 108 HB2 SER 15 HB2 SER 15 16.708 7.132 -9.363 109 HB3 SER 15 HB3 SER 15 15.162 7.355 -8.885 110 HG SER 15 HG SER 15 15.694 7.938 -11.075 111 H GLU 16 H GLU 16 18.921 8.044 -8.162 112 HA GLU 16 HA GLU 16 20.090 10.527 -8.518 113 HB2 GLU 16 HB2 GLU 16 21.184 7.902 -9.075 114 HB3 GLU 16 HB3 GLU 16 22.100 9.253 -9.032 115 HG2 GLU 16 HG2 GLU 16 21.643 9.515 -6.756 116 HG3 GLU 16 HG3 GLU 16 20.669 8.205 -6.787 117 H ALA 17 H ALA 17 18.514 8.544 -10.689 118 HA ALA 17 HA ALA 17 19.834 9.166 -13.011 119 HB1 ALA 17 HB1 ALA 17 18.174 7.391 -12.888 120 HB2 ALA 17 HB2 ALA 17 17.818 8.366 -14.128 121 HB3 ALA 17 HB3 ALA 17 17.001 8.495 -12.738 122 H PHE 18 H PHE 18 18.039 11.211 -11.098 123 HA PHE 18 HA PHE 18 17.236 12.899 -13.197 124 HB2 PHE 18 HB2 PHE 18 16.258 12.573 -10.796 125 HB3 PHE 18 HB3 PHE 18 17.166 13.901 -10.512 126 HD1 PHE 18 HD1 PHE 18 16.378 16.071 -11.095 127 HD2 PHE 18 HD2 PHE 18 14.421 12.689 -12.519 128 HE1 PHE 18 HE1 PHE 18 14.613 17.468 -11.963 129 HE2 PHE 18 HE2 PHE 18 12.648 14.069 -13.394 130 HZ PHE 18 HZ PHE 18 12.752 16.473 -13.136 131 H GLY 19 H GLY 19 20.207 12.481 -12.046 132 HA2 GLY 19 HA2 GLY 19 21.286 14.642 -13.246 133 HA3 GLY 19 HA3 GLY 19 20.990 15.155 -11.724 134 H PHE 20 H PHE 20 21.611 12.595 -10.542 135 HA PHE 20 HA PHE 20 23.281 11.597 -9.641 136 HB2 PHE 20 HB2 PHE 20 23.836 11.395 -12.294 137 HB3 PHE 20 HB3 PHE 20 25.291 11.662 -11.602 138 HD1 PHE 20 HD1 PHE 20 22.820 9.249 -12.236 139 HD2 PHE 20 HD2 PHE 20 26.140 10.044 -9.861 140 HE1 PHE 20 HE1 PHE 20 22.949 6.910 -11.651 141 HE2 PHE 20 HE2 PHE 20 26.283 7.712 -9.266 142 HZ PHE 20 HZ PHE 20 24.684 6.141 -10.155 143 H LEU 21 H LEU 21 23.610 14.694 -9.900 144 HA LEU 21 HA LEU 21 26.300 14.950 -9.108 145 HB2 LEU 21 HB2 LEU 21 24.175 16.911 -8.963 146 HB3 LEU 21 HB3 LEU 21 25.751 17.271 -8.732 147 HG LEU 21 HG LEU 21 24.662 16.425 -11.256 148 HD11 LEU 21 HD11 LEU 21 24.906 18.745 -11.916 149 HD12 LEU 21 HD12 LEU 21 25.396 19.117 -10.421 150 HD13 LEU 21 HD13 LEU 21 23.875 18.632 -10.676 151 HD21 LEU 21 HD21 LEU 21 26.760 17.065 -12.202 152 HD22 LEU 21 HD22 LEU 21 26.972 15.885 -11.116 153 HD23 LEU 21 HD23 LEU 21 27.325 17.415 -10.728 154 H ASN 22 H ASN 22 23.293 14.625 -7.588 155 HA ASN 22 HA ASN 22 24.328 14.136 -5.027 156 HB2 ASN 22 HB2 ASN 22 24.477 16.502 -4.867 157 HB3 ASN 22 HB3 ASN 22 22.937 16.660 -5.388 158 HD21 ASN 22 HD21 ASN 22 23.636 15.563 -1.573 159 HD22 ASN 22 HD22 ASN 22 24.828 15.315 -2.806 160 H LEU 23 H LEU 23 22.591 13.284 -3.625 161 HA LEU 23 HA LEU 23 19.948 13.429 -4.751 162 HB2 LEU 23 HB2 LEU 23 19.405 11.255 -4.436 163 HB3 LEU 23 HB3 LEU 23 20.828 11.247 -5.239 164 HG LEU 23 HG LEU 23 20.771 10.780 -2.422 165 HD11 LEU 23 HD11 LEU 23 20.634 8.401 -2.876 166 HD12 LEU 23 HD12 LEU 23 20.438 8.717 -4.450 167 HD13 LEU 23 HD13 LEU 23 19.292 9.142 -3.391 168 HD21 LEU 23 HD21 LEU 23 22.817 9.607 -2.786 169 HD22 LEU 23 HD22 LEU 23 22.942 11.134 -3.302 170 HD23 LEU 23 HD23 LEU 23 22.730 9.936 -4.367 171 H ASN 24 H ASN 24 18.300 13.667 -3.161 172 HA ASN 24 HA ASN 24 18.970 13.426 -0.406 173 HB2 ASN 24 HB2 ASN 24 19.780 15.666 -1.128 174 HB3 ASN 24 HB3 ASN 24 18.200 16.076 -1.199 175 HD21 ASN 24 HD21 ASN 24 17.730 15.832 2.370 176 HD22 ASN 24 HD22 ASN 24 16.948 15.302 0.918 177 H CYS 25 H CYS 25 17.230 11.827 -1.281 178 HA CYS 25 HA CYS 25 14.675 13.084 -1.506 179 HB2 CYS 25 HB2 CYS 25 15.441 11.299 -2.959 180 HB3 CYS 25 HB3 CYS 25 15.234 10.287 -1.695 181 H GLY 26 H GLY 26 16.507 11.848 0.920 182 HA2 GLY 26 HA2 GLY 26 15.962 11.373 3.070 183 HA3 GLY 26 HA3 GLY 26 14.431 11.872 2.795 184 H SER 27 H SER 27 13.760 10.105 4.190 185 HA SER 27 HA SER 27 14.252 7.490 3.485 186 HB2 SER 27 HB2 SER 27 13.440 8.155 5.699 187 HB3 SER 27 HB3 SER 27 11.971 8.446 5.047 188 HG SER 27 HG SER 27 11.481 6.480 5.240 189 H VAL 28 H VAL 28 12.277 9.658 1.961 190 HA VAL 28 HA VAL 28 10.177 8.103 1.205 191 HB VAL 28 HB VAL 28 11.320 10.279 -0.403 192 HG11 VAL 28 HG11 VAL 28 9.112 10.656 -1.264 193 HG12 VAL 28 HG12 VAL 28 8.559 9.398 -0.412 194 HG13 VAL 28 HG13 VAL 28 9.601 9.157 -1.625 195 HG21 VAL 28 HG21 VAL 28 9.888 11.798 0.839 196 HG22 VAL 28 HG22 VAL 28 10.910 11.063 1.853 197 HG23 VAL 28 HG23 VAL 28 9.373 10.569 1.754 198 H MET 29 H MET 29 13.361 7.965 0.009 199 HA MET 29 HA MET 29 12.741 6.591 -2.332 200 HB2 MET 29 HB2 MET 29 15.061 6.125 -2.515 201 HB3 MET 29 HB3 MET 29 14.874 7.664 -2.002 202 HG2 MET 29 HG2 MET 29 15.283 6.916 0.204 203 HG3 MET 29 HG3 MET 29 15.606 5.433 -0.401 204 HE1 MET 29 HE1 MET 29 19.184 6.649 0.529 205 HE2 MET 29 HE2 MET 29 18.126 5.441 0.716 206 HE3 MET 29 HE3 MET 29 17.824 6.887 1.372 207 H TYR 30 H TYR 30 13.098 5.542 0.873 208 HA TYR 30 HA TYR 30 13.085 2.765 0.202 209 HB2 TYR 30 HB2 TYR 30 14.464 3.188 1.967 210 HB3 TYR 30 HB3 TYR 30 13.368 4.159 2.690 211 HD1 TYR 30 HD1 TYR 30 14.115 0.666 2.013 212 HD2 TYR 30 HD2 TYR 30 11.857 3.300 4.324 213 HE1 TYR 30 HE1 TYR 30 13.315 -1.179 3.362 214 HE2 TYR 30 HE2 TYR 30 11.059 1.448 5.648 215 HH TYR 30 HH TYR 30 11.530 -0.765 6.260 216 H GLU 31 H GLU 31 11.007 5.263 0.826 217 HA GLU 31 HA GLU 31 8.817 3.542 1.561 218 HB2 GLU 31 HB2 GLU 31 9.394 6.298 2.230 219 HB3 GLU 31 HB3 GLU 31 7.878 5.722 2.422 220 HG2 GLU 31 HG2 GLU 31 8.727 4.116 3.971 221 HG3 GLU 31 HG3 GLU 31 10.203 4.801 3.830 222 HA PRO 32 HA PRO 32 7.752 5.544 -2.273 223 HB2 PRO 32 HB2 PRO 32 7.584 3.595 -4.091 224 HB3 PRO 32 HB3 PRO 32 9.052 4.226 -3.756 225 HG2 PRO 32 HG2 PRO 32 7.896 1.843 -2.721 226 HG3 PRO 32 HG3 PRO 32 9.408 2.058 -3.300 227 HD2 PRO 32 HD2 PRO 32 8.932 2.109 -0.728 228 HD3 PRO 32 HD3 PRO 32 10.136 3.002 -1.378 229 H GLN 33 H GLN 33 6.394 2.531 -1.242 230 HA GLN 33 HA GLN 33 3.857 3.510 -2.105 231 HB2 GLN 33 HB2 GLN 33 3.101 1.214 -2.069 232 HB3 GLN 33 HB3 GLN 33 4.378 1.428 -3.064 233 HG2 GLN 33 HG2 GLN 33 5.787 0.536 -1.320 234 HG3 GLN 33 HG3 GLN 33 4.432 0.168 -0.487 235 HE21 GLN 33 HE21 GLN 33 4.402 -2.981 -1.891 236 HE22 GLN 33 HE22 GLN 33 4.390 -2.022 -0.449 237 H SER 34 H SER 34 5.451 2.653 0.755 238 HA SER 34 HA SER 34 3.059 3.313 2.273 239 HB2 SER 34 HB2 SER 34 4.565 1.104 2.640 240 HB3 SER 34 HB3 SER 34 5.032 2.101 3.846 241 HG SER 34 HG SER 34 2.412 1.502 3.315 242 H LEU 35 H LEU 35 3.211 5.448 2.807 243 HA LEU 35 HA LEU 35 5.766 6.387 3.788 244 HB2 LEU 35 HB2 LEU 35 5.464 7.190 1.605 245 HB3 LEU 35 HB3 LEU 35 4.078 7.911 2.080 246 HG LEU 35 HG LEU 35 5.308 9.445 3.379 247 HD11 LEU 35 HD11 LEU 35 7.646 9.592 3.331 248 HD12 LEU 35 HD12 LEU 35 7.728 8.209 2.496 249 HD13 LEU 35 HD13 LEU 35 7.176 8.204 4.016 250 HD21 LEU 35 HD21 LEU 35 6.322 10.585 1.442 251 HD22 LEU 35 HD22 LEU 35 4.910 9.934 0.999 252 HD23 LEU 35 HD23 LEU 35 6.296 9.192 0.621 253 H GLU 36 H GLU 36 5.336 6.590 5.994 254 HA GLU 36 HA GLU 36 2.804 7.777 6.631 255 HB2 GLU 36 HB2 GLU 36 3.948 5.383 7.795 256 HB3 GLU 36 HB3 GLU 36 2.801 6.208 8.615 257 HG2 GLU 36 HG2 GLU 36 1.595 4.572 7.616 258 HG3 GLU 36 HG3 GLU 36 1.375 5.833 6.602 259 H ALA 37 H ALA 37 2.649 9.274 8.267 260 HA ALA 37 HA ALA 37 4.918 9.480 10.060 261 HB1 ALA 37 HB1 ALA 37 5.234 11.265 8.509 262 HB2 ALA 37 HB2 ALA 37 4.835 11.893 9.944 263 HB3 ALA 37 HB3 ALA 37 3.728 11.792 8.770 264 H LYS 38 H LYS 38 3.993 8.714 11.886 265 HA LYS 38 HA LYS 38 1.818 9.972 13.160 266 HB2 LYS 38 HB2 LYS 38 1.151 7.952 11.393 267 HB3 LYS 38 HB3 LYS 38 0.717 7.548 12.915 268 HG2 LYS 38 HG2 LYS 38 -0.171 9.984 11.671 269 HG3 LYS 38 HG3 LYS 38 -1.038 8.603 11.599 270 HD2 LYS 38 HD2 LYS 38 -0.675 8.863 14.186 271 HD3 LYS 38 HD3 LYS 38 -0.828 10.419 13.714 272 HE2 LYS 38 HE2 LYS 38 -2.782 8.334 13.238 273 HE3 LYS 38 HE3 LYS 38 -2.974 9.578 14.278 274 HZ1 LYS 38 HZ1 LYS 38 -4.221 9.957 12.313 275 HZ2 LYS 38 HZ2 LYS 38 -2.877 9.850 11.420 276 HZ3 LYS 38 HZ3 LYS 38 -3.067 11.082 12.450 277 H LYS 39 H LYS 39 1.070 7.943 14.889 278 HA LYS 39 HA LYS 39 3.442 7.583 16.281 279 HB2 LYS 39 HB2 LYS 39 0.781 6.527 16.853 280 HB3 LYS 39 HB3 LYS 39 2.003 6.427 17.932 281 HG2 LYS 39 HG2 LYS 39 2.042 8.786 18.080 282 HG3 LYS 39 HG3 LYS 39 0.785 8.860 17.040 283 HD2 LYS 39 HD2 LYS 39 -0.557 7.667 18.599 284 HD3 LYS 39 HD3 LYS 39 0.698 7.640 19.644 285 HE2 LYS 39 HE2 LYS 39 0.654 10.015 19.760 286 HE3 LYS 39 HE3 LYS 39 -0.598 10.044 18.712 287 HZ1 LYS 39 HZ1 LYS 39 -1.391 10.290 20.937 288 HZ2 LYS 39 HZ2 LYS 39 -0.711 8.881 21.346 289 HZ3 LYS 39 HZ3 LYS 39 -1.951 8.910 20.308 290 H GLY 40 H GLY 40 4.956 6.081 16.058 291 HA2 GLY 40 HA2 GLY 40 4.051 3.341 15.668 292 HA3 GLY 40 HA3 GLY 40 5.566 3.857 15.346 293 H PHE 41 H PHE 41 4.922 1.754 17.278 294 HA PHE 41 HA PHE 41 5.715 3.118 19.695 295 HB2 PHE 41 HB2 PHE 41 4.314 0.606 19.474 296 HB3 PHE 41 HB3 PHE 41 4.796 1.243 20.898 297 HD1 PHE 41 HD1 PHE 41 2.206 1.187 18.542 298 HD2 PHE 41 HD2 PHE 41 3.817 3.489 21.611 299 HE1 PHE 41 HE1 PHE 41 0.149 2.439 18.672 300 HE2 PHE 41 HE2 PHE 41 1.765 4.750 21.754 301 HZ PHE 41 HZ PHE 41 -0.075 4.228 20.277 302 HA PRO 42 HA PRO 42 7.230 3.355 21.379 303 HB2 PRO 42 HB2 PRO 42 9.788 3.912 21.763 304 HB3 PRO 42 HB3 PRO 42 9.175 2.570 22.463 305 HG2 PRO 42 HG2 PRO 42 10.617 2.753 20.010 306 HG3 PRO 42 HG3 PRO 42 10.875 1.717 21.245 307 HD2 PRO 42 HD2 PRO 42 9.507 0.945 19.172 308 HD3 PRO 42 HD3 PRO 42 9.107 0.398 20.658 309 H HIS 43 H HIS 43 7.291 5.653 21.276 310 HA HIS 43 HA HIS 43 7.099 6.316 18.610 311 HB2 HIS 43 HB2 HIS 43 5.791 7.383 20.423 312 HB3 HIS 43 HB3 HIS 43 7.097 8.323 20.707 313 HD1 HIS 43 HD1 HIS 43 7.704 10.226 18.960 314 HD2 HIS 43 HD2 HIS 43 4.261 8.126 18.238 315 HE1 HIS 43 HE1 HIS 43 6.451 11.355 17.132 316 HE2 HIS 43 HE2 HIS 43 4.368 10.121 16.696 317 H SER 44 H SER 44 9.437 7.300 20.927 318 HA SER 44 HA SER 44 11.347 8.264 20.764 319 HB2 SER 44 HB2 SER 44 11.939 6.373 19.305 320 HB3 SER 44 HB3 SER 44 11.611 7.305 18.004 321 HG SER 44 HG SER 44 13.858 7.044 18.950 322 H GLY 45 H GLY 45 10.139 9.065 17.559 323 HA2 GLY 45 HA2 GLY 45 11.522 11.474 17.470 324 HA3 GLY 45 HA3 GLY 45 10.358 10.990 16.432 325 HA PRO 46 HA PRO 46 8.928 14.627 18.843 326 HB2 PRO 46 HB2 PRO 46 8.638 16.390 16.849 327 HB3 PRO 46 HB3 PRO 46 10.132 16.156 17.467 328 HG2 PRO 46 HG2 PRO 46 8.989 14.918 15.169 329 HG3 PRO 46 HG3 PRO 46 10.428 15.683 15.277 330 HD2 PRO 46 HD2 PRO 46 10.373 13.105 15.476 331 HD3 PRO 46 HD3 PRO 46 11.390 13.945 16.440 332 H ALA 47 H ALA 47 6.960 15.991 18.740 333 HA ALA 47 HA ALA 47 4.849 14.299 18.616 334 HB1 ALA 47 HB1 ALA 47 4.813 16.413 19.842 335 HB2 ALA 47 HB2 ALA 47 3.483 16.306 18.929 336 HB3 ALA 47 HB3 ALA 47 4.725 17.221 18.445 337 H ASP 48 H ASP 48 3.369 13.560 17.204 338 HA ASP 48 HA ASP 48 3.798 13.904 14.487 339 HB2 ASP 48 HB2 ASP 48 1.331 12.955 15.674 340 HB3 ASP 48 HB3 ASP 48 1.875 12.577 14.181 341 H GLY 49 H GLY 49 3.175 15.498 13.070 342 HA2 GLY 49 HA2 GLY 49 2.064 17.355 12.402 343 HA3 GLY 49 HA3 GLY 49 0.802 16.915 13.340 344 H GLN 50 H GLN 50 3.560 17.117 15.084 345 HA GLN 50 HA GLN 50 4.168 18.393 16.751 346 HB2 GLN 50 HB2 GLN 50 3.659 20.486 14.837 347 HB3 GLN 50 HB3 GLN 50 4.338 20.833 16.281 348 HG2 GLN 50 HG2 GLN 50 6.071 20.652 14.732 349 HG3 GLN 50 HG3 GLN 50 6.165 19.351 15.715 350 HE21 GLN 50 HE21 GLN 50 6.518 17.278 13.000 351 HE22 GLN 50 HE22 GLN 50 7.135 17.820 14.525 352 H ILE 51 H ILE 51 1.315 17.708 16.627 353 HA ILE 51 HA ILE 51 -0.138 19.816 17.556 354 HB ILE 51 HB ILE 51 -0.720 16.941 17.945 355 HG12 ILE 51 HG12 ILE 51 -1.869 18.568 15.864 356 HG13 ILE 51 HG13 ILE 51 -0.498 17.712 15.626 357 HG21 ILE 51 HG21 ILE 51 -3.059 17.509 18.261 358 HG22 ILE 51 HG22 ILE 51 -2.697 19.082 18.155 359 HG23 ILE 51 HG23 ILE 51 -2.167 18.213 19.412 360 HD11 ILE 51 HD11 ILE 51 -2.377 16.509 14.742 361 HD12 ILE 51 HD12 ILE 51 -3.083 16.516 16.197 362 HD13 ILE 51 HD13 ILE 51 -1.726 15.669 15.961 363 H ALA 52 H ALA 52 1.482 17.350 19.376 364 HA ALA 52 HA ALA 52 0.268 17.975 21.757 365 HB1 ALA 52 HB1 ALA 52 1.420 15.838 21.374 366 HB2 ALA 52 HB2 ALA 52 1.932 16.484 22.765 367 HB3 ALA 52 HB3 ALA 52 2.843 16.603 21.435 368 H SER 53 H SER 53 2.943 19.492 20.319 369 HA SER 53 HA SER 53 3.429 20.914 22.783 370 HB2 SER 53 HB2 SER 53 5.430 19.813 22.104 371 HB3 SER 53 HB3 SER 53 5.268 20.368 20.576 372 HG SER 53 HG SER 53 6.851 21.400 21.930 373 H ALA 54 H ALA 54 2.441 21.274 19.625 374 HA ALA 54 HA ALA 54 2.067 22.990 18.333 375 HB1 ALA 54 HB1 ALA 54 0.252 23.268 19.966 376 HB2 ALA 54 HB2 ALA 54 0.599 24.693 19.285 377 HB3 ALA 54 HB3 ALA 54 1.151 24.349 20.765 378 H GLY 55 H GLY 55 4.791 23.047 19.257 379 HA2 GLY 55 HA2 GLY 55 5.322 25.882 19.053 380 HA3 GLY 55 HA3 GLY 55 6.319 24.808 19.775 381 H GLY 56 H GLY 56 6.332 22.800 17.820 382 HA2 GLY 56 HA2 GLY 56 8.239 23.995 16.085 383 HA3 GLY 56 HA3 GLY 56 7.948 22.397 16.252 384 H LEU 57 H LEU 57 5.288 24.395 15.599 385 HA LEU 57 HA LEU 57 4.557 22.854 13.456 386 HB2 LEU 57 HB2 LEU 57 3.606 25.436 14.365 387 HB3 LEU 57 HB3 LEU 57 2.878 24.695 13.105 388 HG LEU 57 HG LEU 57 3.083 23.282 15.582 389 HD11 LEU 57 HD11 LEU 57 1.012 24.187 16.353 390 HD12 LEU 57 HD12 LEU 57 0.994 25.217 15.107 391 HD13 LEU 57 HD13 LEU 57 2.129 25.352 16.250 392 HD21 LEU 57 HD21 LEU 57 1.064 22.225 14.808 393 HD22 LEU 57 HD22 LEU 57 2.223 22.089 13.689 394 HD23 LEU 57 HD23 LEU 57 1.054 23.191 13.511 395 H PHE 58 H PHE 58 6.228 25.864 13.413 396 HA PHE 58 HA PHE 58 6.057 26.277 10.701 397 HB2 PHE 58 HB2 PHE 58 8.146 27.191 12.499 398 HB3 PHE 58 HB3 PHE 58 7.920 27.810 11.004 399 HD1 PHE 58 HD1 PHE 58 7.568 28.735 14.142 400 HD2 PHE 58 HD2 PHE 58 5.187 28.408 10.744 401 HE1 PHE 58 HE1 PHE 58 6.065 30.394 15.042 402 HE2 PHE 58 HE2 PHE 58 3.669 30.048 11.639 403 HZ PHE 58 HZ PHE 58 4.120 31.066 13.781 404 H GLY 59 H GLY 59 7.718 23.894 12.262 405 HA2 GLY 59 HA2 GLY 59 10.002 23.613 10.794 406 HA3 GLY 59 HA3 GLY 59 9.199 22.386 11.513 407 H GLY 60 H GLY 60 6.792 22.961 9.765 408 HA2 GLY 60 HA2 GLY 60 7.427 21.232 7.680 409 HA3 GLY 60 HA3 GLY 60 6.072 22.138 7.785 410 H ILE 61 H ILE 61 7.738 24.605 7.965 411 HA ILE 61 HA ILE 61 8.027 25.027 5.174 412 HB ILE 61 HB ILE 61 8.550 26.934 7.337 413 HG12 ILE 61 HG12 ILE 61 6.300 26.306 7.412 414 HG13 ILE 61 HG13 ILE 61 6.420 27.862 6.930 415 HG21 ILE 61 HG21 ILE 61 8.426 28.678 5.671 416 HG22 ILE 61 HG22 ILE 61 8.234 27.565 4.514 417 HG23 ILE 61 HG23 ILE 61 9.633 27.661 5.318 418 HD11 ILE 61 HD11 ILE 61 4.730 26.740 5.656 419 HD12 ILE 61 HD12 ILE 61 5.813 25.652 5.149 420 HD13 ILE 61 HD13 ILE 61 5.931 27.192 4.672 421 H LEU 62 H LEU 62 9.961 24.731 7.997 422 HA LEU 62 HA LEU 62 12.378 25.405 6.797 423 HB2 LEU 62 HB2 LEU 62 11.643 24.317 9.334 424 HB3 LEU 62 HB3 LEU 62 13.212 24.154 8.912 425 HG LEU 62 HG LEU 62 13.353 26.552 8.781 426 HD11 LEU 62 HD11 LEU 62 11.700 27.915 9.824 427 HD12 LEU 62 HD12 LEU 62 10.745 26.623 10.009 428 HD13 LEU 62 HD13 LEU 62 11.087 27.171 8.526 429 HD21 LEU 62 HD21 LEU 62 13.464 26.822 11.209 430 HD22 LEU 62 HD22 LEU 62 14.098 25.397 10.783 431 HD23 LEU 62 HD23 LEU 62 12.600 25.467 11.389 432 H ASP 63 H ASP 63 10.566 22.675 6.568 433 HA ASP 63 HA ASP 63 12.394 20.671 6.533 434 HB2 ASP 63 HB2 ASP 63 10.033 20.261 6.362 435 HB3 ASP 63 HB3 ASP 63 10.037 20.864 4.844 436 H GLN 64 H GLN 64 11.779 23.027 4.123 437 HA GLN 64 HA GLN 64 13.019 21.730 2.056 438 HB2 GLN 64 HB2 GLN 64 12.966 23.811 0.915 439 HB3 GLN 64 HB3 GLN 64 11.602 23.691 1.804 440 HG2 GLN 64 HG2 GLN 64 12.662 25.086 3.468 441 HG3 GLN 64 HG3 GLN 64 13.883 25.323 2.410 442 HE21 GLN 64 HE21 GLN 64 10.604 27.510 2.178 443 HE22 GLN 64 HE22 GLN 64 10.968 26.424 3.477 444 H GLN 65 H GLN 65 14.505 22.833 4.736 445 HA GLN 65 HA GLN 65 17.080 22.839 3.424 446 HB2 GLN 65 HB2 GLN 65 16.253 25.051 4.282 447 HB3 GLN 65 HB3 GLN 65 16.624 24.457 5.757 448 HG2 GLN 65 HG2 GLN 65 18.882 24.370 5.223 449 HG3 GLN 65 HG3 GLN 65 18.574 24.737 3.662 450 HE21 GLN 65 HE21 GLN 65 19.584 27.963 4.438 451 HE22 GLN 65 HE22 GLN 65 20.011 26.484 3.644 452 H SER 66 H SER 66 15.494 20.738 4.729 453 HA SER 66 HA SER 66 17.080 20.210 7.050 454 HB2 SER 66 HB2 SER 66 14.632 19.973 7.212 455 HB3 SER 66 HB3 SER 66 14.740 18.688 6.210 456 HG SER 66 HG SER 66 15.534 18.913 8.806 457 H GLU 67 H GLU 67 17.848 17.938 7.494 458 HA GLU 67 HA GLU 67 19.261 16.901 5.327 459 HB2 GLU 67 HB2 GLU 67 19.849 16.613 7.671 460 HB3 GLU 67 HB3 GLU 67 18.643 15.517 7.786 461 HG2 GLU 67 HG2 GLU 67 19.778 14.117 6.255 462 HG3 GLU 67 HG3 GLU 67 20.988 15.209 6.160 463 H ASN 68 H ASN 68 16.200 16.205 6.724 464 HA ASN 68 HA ASN 68 15.759 14.010 4.954 465 HB2 ASN 68 HB2 ASN 68 13.792 13.575 6.280 466 HB3 ASN 68 HB3 ASN 68 15.071 13.783 7.274 467 HD21 ASN 68 HD21 ASN 68 11.993 16.346 7.371 468 HD22 ASN 68 HD22 ASN 68 12.112 15.087 6.187 469 H ARG 69 H ARG 69 15.822 16.841 4.117 470 HA ARG 69 HA ARG 69 13.400 17.884 3.583 471 HB2 ARG 69 HB2 ARG 69 15.306 19.145 3.131 472 HB3 ARG 69 HB3 ARG 69 15.884 18.013 2.105 473 HG2 ARG 69 HG2 ARG 69 13.551 19.224 1.178 474 HG3 ARG 69 HG3 ARG 69 14.794 20.268 1.351 475 HD2 ARG 69 HD2 ARG 69 14.968 17.842 -0.195 476 HD3 ARG 69 HD3 ARG 69 14.717 19.315 -0.854 477 HE ARG 69 HE ARG 69 17.013 19.466 0.674 478 HH11 ARG 69 HH11 ARG 69 19.034 19.397 -0.206 479 HH12 ARG 69 HH12 ARG 69 19.280 18.775 -1.804 480 HH21 ARG 69 HH21 ARG 69 15.961 18.023 -2.353 481 HH22 ARG 69 HH22 ARG 69 17.567 18.009 -3.002 482 H TRP 70 H TRP 70 11.743 17.846 2.226 483 HA TRP 70 HA TRP 70 11.548 15.474 0.670 484 HB2 TRP 70 HB2 TRP 70 9.587 17.495 1.344 485 HB3 TRP 70 HB3 TRP 70 9.214 16.235 0.374 486 HD1 TRP 70 HD1 TRP 70 10.681 16.429 3.858 487 HE1 TRP 70 HE1 TRP 70 9.611 14.797 5.423 488 HE3 TRP 70 HE3 TRP 70 7.490 14.424 0.572 489 HZ2 TRP 70 HZ2 TRP 70 7.538 12.899 5.187 490 HZ3 TRP 70 HZ3 TRP 70 5.940 12.734 1.333 491 HH2 TRP 70 HH2 TRP 70 5.974 11.982 3.631 492 H PHE 71 H PHE 71 10.652 15.525 -1.583 493 HA PHE 71 HA PHE 71 12.280 17.179 -3.055 494 HB2 PHE 71 HB2 PHE 71 11.109 16.184 -5.008 495 HB3 PHE 71 HB3 PHE 71 11.723 15.081 -3.972 496 HD1 PHE 71 HD1 PHE 71 10.266 13.635 -2.653 497 HD2 PHE 71 HD2 PHE 71 8.685 16.495 -5.229 498 HE1 PHE 71 HE1 PHE 71 8.081 12.638 -2.410 499 HE2 PHE 71 HE2 PHE 71 6.499 15.509 -4.998 500 HZ PHE 71 HZ PHE 71 6.189 13.581 -3.577 501 H LYS 72 H LYS 72 12.159 19.060 -4.097 502 HA LYS 72 HA LYS 72 9.844 20.629 -3.741 503 HB2 LYS 72 HB2 LYS 72 12.377 21.132 -5.029 504 HB3 LYS 72 HB3 LYS 72 11.175 22.230 -5.166 505 HG2 LYS 72 HG2 LYS 72 11.751 21.564 -2.514 506 HG3 LYS 72 HG3 LYS 72 13.000 22.279 -3.286 507 HD2 LYS 72 HD2 LYS 72 11.539 24.096 -3.886 508 HD3 LYS 72 HD3 LYS 72 10.350 23.396 -3.013 509 HE2 LYS 72 HE2 LYS 72 11.695 23.633 -1.043 510 HE3 LYS 72 HE3 LYS 72 12.828 24.404 -1.932 511 HZ1 LYS 72 HZ1 LYS 72 11.490 25.981 -0.769 512 HZ2 LYS 72 HZ2 LYS 72 10.161 25.397 -1.482 513 HZ3 LYS 72 HZ3 LYS 72 11.282 26.160 -2.362 514 H HIS 73 H HIS 73 8.283 21.265 -5.284 515 HA HIS 73 HA HIS 73 8.778 20.353 -7.954 516 HB2 HIS 73 HB2 HIS 73 6.507 19.797 -6.362 517 HB3 HIS 73 HB3 HIS 73 6.120 20.278 -7.874 518 HD1 HIS 73 HD1 HIS 73 9.066 18.112 -7.161 519 HD2 HIS 73 HD2 HIS 73 5.327 17.810 -8.813 520 HE1 HIS 73 HE1 HIS 73 8.845 15.870 -8.215 521 HE2 HIS 73 HE2 HIS 73 6.600 15.667 -9.221 522 H ILE 74 H ILE 74 9.469 22.352 -8.839 523 HA ILE 74 HA ILE 74 7.763 24.591 -8.733 524 HB ILE 74 HB ILE 74 10.028 24.887 -9.406 525 HG12 ILE 74 HG12 ILE 74 8.345 25.793 -11.550 526 HG13 ILE 74 HG13 ILE 74 8.224 26.441 -10.056 527 HG21 ILE 74 HG21 ILE 74 10.777 24.256 -11.603 528 HG22 ILE 74 HG22 ILE 74 9.367 23.515 -11.881 529 HG23 ILE 74 HG23 ILE 74 10.376 22.938 -10.756 530 HD11 ILE 74 HD11 ILE 74 9.582 27.836 -11.444 531 HD12 ILE 74 HD12 ILE 74 10.597 26.607 -11.712 532 HD13 ILE 74 HD13 ILE 74 10.478 27.248 -10.233 533 H MET 75 H MET 75 5.929 25.067 -10.047 534 HA MET 75 HA MET 75 5.263 23.182 -12.088 535 HB2 MET 75 HB2 MET 75 4.278 22.436 -9.927 536 HB3 MET 75 HB3 MET 75 3.303 23.742 -10.033 537 HG2 MET 75 HG2 MET 75 2.130 21.948 -10.732 538 HG3 MET 75 HG3 MET 75 2.420 22.911 -12.019 539 HE1 MET 75 HE1 MET 75 2.703 19.699 -14.040 540 HE2 MET 75 HE2 MET 75 2.224 21.243 -14.078 541 HE3 MET 75 HE3 MET 75 1.530 20.206 -13.049 542 H THR 76 H THR 76 3.863 23.957 -13.690 543 HA THR 76 HA THR 76 3.545 26.799 -13.659 544 HB THR 76 HB THR 76 2.876 26.411 -16.034 545 HG1 THR 76 HG1 THR 76 3.101 23.899 -15.143 546 HG21 THR 76 HG21 THR 76 5.125 25.992 -16.774 547 HG22 THR 76 HG22 THR 76 5.524 25.448 -15.304 548 HG23 THR 76 HG23 THR 76 5.178 27.012 -15.520 549 H GLY 77 H GLY 77 1.367 27.589 -14.745 550 HA2 GLY 77 HA2 GLY 77 -0.678 26.797 -13.079 551 HA3 GLY 77 HA3 GLY 77 -0.829 27.763 -14.387 552 H GLY 78 H GLY 78 -3.017 26.665 -14.137 553 HA2 GLY 78 HA2 GLY 78 -4.336 25.471 -15.631 554 HA3 GLY 78 HA3 GLY 78 -3.069 24.535 -16.059 555 H GLU 79 H GLU 79 -5.208 23.087 -15.768 556 HA GLU 79 HA GLU 79 -5.464 22.282 -13.053 557 HB2 GLU 79 HB2 GLU 79 -7.361 22.428 -14.626 558 HB3 GLU 79 HB3 GLU 79 -6.806 21.040 -15.285 559 HG2 GLU 79 HG2 GLU 79 -7.257 20.938 -12.512 560 HG3 GLU 79 HG3 GLU 79 -8.603 21.087 -13.425 561 H HIS 80 H HIS 80 -4.606 20.524 -12.048 562 HA HIS 80 HA HIS 80 -3.344 18.554 -13.735 563 HB2 HIS 80 HB2 HIS 80 -2.090 19.425 -11.288 564 HB3 HIS 80 HB3 HIS 80 -1.398 18.546 -12.479 565 HD1 HIS 80 HD1 HIS 80 -0.938 21.624 -11.117 566 HD2 HIS 80 HD2 HIS 80 -1.590 20.446 -14.984 567 HE1 HIS 80 HE1 HIS 80 -0.217 23.453 -12.630 568 HE2 HIS 80 HE2 HIS 80 -0.610 22.775 -14.965 569 H THR 81 H THR 81 -3.562 16.396 -13.103 570 HA THR 81 HA THR 81 -5.339 16.093 -10.891 571 HB THR 81 HB THR 81 -4.832 14.088 -12.977 572 HG1 THR 81 HG1 THR 81 -6.329 14.954 -14.235 573 HG21 THR 81 HG21 THR 81 -6.975 13.196 -12.410 574 HG22 THR 81 HG22 THR 81 -7.180 14.348 -11.294 575 HG23 THR 81 HG23 THR 81 -6.051 13.210 -11.084 576 H PHE 82 H PHE 82 -5.061 14.870 -9.114 577 HA PHE 82 HA PHE 82 -2.563 13.433 -8.877 578 HB2 PHE 82 HB2 PHE 82 -4.270 14.598 -6.863 579 HB3 PHE 82 HB3 PHE 82 -3.109 13.524 -6.453 580 HD1 PHE 82 HD1 PHE 82 -0.987 14.286 -5.867 581 HD2 PHE 82 HD2 PHE 82 -3.472 16.743 -8.128 582 HE1 PHE 82 HE1 PHE 82 0.628 16.070 -5.690 583 HE2 PHE 82 HE2 PHE 82 -1.864 18.533 -7.964 584 HZ PHE 82 HZ PHE 82 0.188 18.200 -6.733 585 H THR 83 H THR 83 -2.667 11.170 -8.743 586 HA THR 83 HA THR 83 -5.194 10.063 -7.988 587 HB THR 83 HB THR 83 -3.751 9.073 -10.345 588 HG1 THR 83 HG1 THR 83 -5.439 9.904 -11.561 589 HG21 THR 83 HG21 THR 83 -5.647 7.670 -10.735 590 HG22 THR 83 HG22 THR 83 -6.364 8.235 -9.401 591 HG23 THR 83 HG23 THR 83 -5.035 7.321 -9.280 592 H TRP 84 H TRP 84 -5.042 8.455 -6.490 593 HA TRP 84 HA TRP 84 -2.519 7.014 -6.315 594 HB2 TRP 84 HB2 TRP 84 -4.212 7.732 -4.098 595 HB3 TRP 84 HB3 TRP 84 -2.861 6.823 -3.972 596 HD1 TRP 84 HD1 TRP 84 -1.225 8.910 -5.928 597 HE1 TRP 84 HE1 TRP 84 -0.255 11.020 -4.993 598 HE3 TRP 84 HE3 TRP 84 -4.045 9.107 -1.807 599 HZ2 TRP 84 HZ2 TRP 84 -0.703 12.535 -2.656 600 HZ3 TRP 84 HZ3 TRP 84 -3.704 10.925 -0.239 601 HH2 TRP 84 HH2 TRP 84 -2.035 12.616 -0.671 602 H THR 85 H THR 85 -2.733 4.695 -6.097 603 HA THR 85 HA THR 85 -5.394 3.712 -5.907 604 HB THR 85 HB THR 85 -5.050 3.963 -8.329 605 HG1 THR 85 HG1 THR 85 -6.478 2.446 -8.028 606 HG21 THR 85 HG21 THR 85 -3.455 2.571 -9.453 607 HG22 THR 85 HG22 THR 85 -2.948 1.976 -8.038 608 HG23 THR 85 HG23 THR 85 -2.666 3.524 -8.412 609 H TYR 86 H TYR 86 -5.631 1.419 -5.411 610 HA TYR 86 HA TYR 86 -3.147 0.055 -4.876 611 HB2 TYR 86 HB2 TYR 86 -3.901 0.962 -2.786 612 HB3 TYR 86 HB3 TYR 86 -5.223 0.011 -2.904 613 HD1 TYR 86 HD1 TYR 86 -5.138 -1.903 -1.533 614 HD2 TYR 86 HD2 TYR 86 -1.614 -0.518 -3.264 615 HE1 TYR 86 HE1 TYR 86 -3.928 -3.747 -0.555 616 HE2 TYR 86 HE2 TYR 86 -0.410 -2.370 -2.281 617 HH TYR 86 HH TYR 86 -2.003 -5.009 -0.686 618 H THR 87 H THR 87 -3.554 -2.392 -4.644 619 HA THR 87 HA THR 87 -5.206 -3.107 -6.747 620 HB THR 87 HB THR 87 -3.116 -4.345 -6.218 621 HG1 THR 87 HG1 THR 87 -4.601 -6.470 -6.173 622 HG21 THR 87 HG21 THR 87 -3.128 -5.978 -4.457 623 HG22 THR 87 HG22 THR 87 -4.632 -5.549 -4.044 624 HG23 THR 87 HG23 THR 87 -3.405 -4.522 -3.811 625 H ALA 88 H ALA 88 -5.897 -2.856 -3.480 626 HA ALA 88 HA ALA 88 -8.470 -4.025 -3.947 627 HB1 ALA 88 HB1 ALA 88 -7.192 -5.776 -2.836 628 HB2 ALA 88 HB2 ALA 88 -8.377 -5.285 -1.852 629 HB3 ALA 88 HB3 ALA 88 -6.864 -4.769 -1.614 630 HA PRO 89 HA PRO 89 -9.668 -0.545 -1.607 631 HB2 PRO 89 HB2 PRO 89 -12.204 -1.021 -1.021 632 HB3 PRO 89 HB3 PRO 89 -11.815 -0.742 -2.582 633 HG2 PRO 89 HG2 PRO 89 -12.183 -3.265 -1.299 634 HG3 PRO 89 HG3 PRO 89 -12.802 -2.771 -2.727 635 HD2 PRO 89 HD2 PRO 89 -10.644 -4.251 -2.652 636 HD3 PRO 89 HD3 PRO 89 -10.849 -3.143 -3.834 637 H HIS 90 H HIS 90 -9.734 0.246 0.473 638 HA HIS 90 HA HIS 90 -9.930 -1.777 2.527 639 HB2 HIS 90 HB2 HIS 90 -7.598 -1.037 2.063 640 HB3 HIS 90 HB3 HIS 90 -8.023 0.354 2.804 641 HD1 HIS 90 HD1 HIS 90 -7.762 0.496 5.331 642 HD2 HIS 90 HD2 HIS 90 -7.781 -3.332 3.859 643 HE1 HIS 90 HE1 HIS 90 -7.219 -1.071 7.181 644 HE2 HIS 90 HE2 HIS 90 -7.272 -3.379 6.332 645 H ASN 91 H ASN 91 -10.560 -0.951 4.705 646 HA ASN 91 HA ASN 91 -12.513 1.019 4.568 647 HB2 ASN 91 HB2 ASN 91 -12.354 -0.673 6.320 648 HB3 ASN 91 HB3 ASN 91 -11.183 0.238 7.003 649 HD21 ASN 91 HD21 ASN 91 -13.999 1.247 8.909 650 HD22 ASN 91 HD22 ASN 91 -12.801 -0.002 8.826 651 H THR 92 H THR 92 -12.405 3.251 4.715 652 HA THR 92 HA THR 92 -9.938 4.440 5.564 653 HB THR 92 HB THR 92 -10.059 5.953 3.561 654 HG1 THR 92 HG1 THR 92 -11.032 4.756 1.751 655 HG21 THR 92 HG21 THR 92 -8.848 4.430 2.152 656 HG22 THR 92 HG22 THR 92 -9.373 3.177 3.029 657 HG23 THR 92 HG23 THR 92 -8.340 4.240 3.675 658 H SER 93 H SER 93 -10.215 6.747 6.181 659 HA SER 93 HA SER 93 -12.965 7.187 6.835 660 HB2 SER 93 HB2 SER 93 -11.514 7.141 8.766 661 HB3 SER 93 HB3 SER 93 -10.559 8.288 8.104 662 HG SER 93 HG SER 93 -11.697 9.714 8.999 663 H GLN 94 H GLN 94 -10.207 9.155 5.913 664 HA GLN 94 HA GLN 94 -11.858 10.838 4.356 665 HB2 GLN 94 HB2 GLN 94 -12.191 11.679 6.647 666 HB3 GLN 94 HB3 GLN 94 -10.588 11.978 6.727 667 HG2 GLN 94 HG2 GLN 94 -10.802 13.689 5.124 668 HG3 GLN 94 HG3 GLN 94 -12.394 13.361 4.961 669 HE21 GLN 94 HE21 GLN 94 -13.235 14.735 8.180 670 HE22 GLN 94 HE22 GLN 94 -13.534 13.291 7.272 671 H TRP 95 H TRP 95 -10.732 12.171 2.866 672 HA TRP 95 HA TRP 95 -7.862 12.215 3.286 673 HB2 TRP 95 HB2 TRP 95 -7.870 12.531 0.742 674 HB3 TRP 95 HB3 TRP 95 -7.714 11.063 1.441 675 HD1 TRP 95 HD1 TRP 95 -10.224 13.062 -0.423 676 HE1 TRP 95 HE1 TRP 95 -12.104 11.665 -1.323 677 HE3 TRP 95 HE3 TRP 95 -8.922 8.778 1.782 678 HZ2 TRP 95 HZ2 TRP 95 -12.871 8.972 -1.035 679 HZ3 TRP 95 HZ3 TRP 95 -10.259 6.801 1.383 680 HH2 TRP 95 HH2 TRP 95 -12.220 6.911 -0.018 681 H HIS 96 H HIS 96 -6.957 14.244 3.405 682 HA HIS 96 HA HIS 96 -8.396 16.432 2.293 683 HB2 HIS 96 HB2 HIS 96 -8.456 17.672 4.380 684 HB3 HIS 96 HB3 HIS 96 -9.422 16.356 4.411 685 HD1 HIS 96 HD1 HIS 96 -9.490 15.756 6.856 686 HD2 HIS 96 HD2 HIS 96 -5.707 16.305 5.391 687 HE1 HIS 96 HE1 HIS 96 -7.861 15.120 8.623 688 HE2 HIS 96 HE2 HIS 96 -5.573 15.451 7.763 689 H TYR 97 H TYR 97 -7.241 18.522 2.330 690 HA TYR 97 HA TYR 97 -4.457 18.208 2.727 691 HB2 TYR 97 HB2 TYR 97 -3.990 19.013 0.419 692 HB3 TYR 97 HB3 TYR 97 -4.501 17.466 0.535 693 HD1 TYR 97 HD1 TYR 97 -6.818 16.849 -0.185 694 HD2 TYR 97 HD2 TYR 97 -5.277 20.666 -0.785 695 HE1 TYR 97 HE1 TYR 97 -8.593 17.317 -1.754 696 HE2 TYR 97 HE2 TYR 97 -7.055 21.126 -2.364 697 HH TYR 97 HH TYR 97 -8.620 19.590 -3.955 698 H TYR 98 H TYR 98 -3.147 20.055 2.685 699 HA TYR 98 HA TYR 98 -4.628 22.460 3.248 700 HB2 TYR 98 HB2 TYR 98 -2.292 21.584 4.743 701 HB3 TYR 98 HB3 TYR 98 -3.225 22.870 5.124 702 HD1 TYR 98 HD1 TYR 98 -3.216 19.240 5.099 703 HD2 TYR 98 HD2 TYR 98 -5.065 22.642 6.620 704 HE1 TYR 98 HE1 TYR 98 -4.482 17.870 6.625 705 HE2 TYR 98 HE2 TYR 98 -6.331 21.265 8.150 706 HH TYR 98 HH TYR 98 -6.410 19.167 9.174 707 H ILE 99 H ILE 99 -3.425 24.496 2.821 708 HA ILE 99 HA ILE 99 -0.885 24.019 1.701 709 HB ILE 99 HB ILE 99 -1.233 25.620 -0.166 710 HG12 ILE 99 HG12 ILE 99 -3.996 25.745 0.606 711 HG13 ILE 99 HG13 ILE 99 -2.920 26.925 0.951 712 HG21 ILE 99 HG21 ILE 99 -2.677 24.225 -1.519 713 HG22 ILE 99 HG22 ILE 99 -3.189 23.459 -0.190 714 HG23 ILE 99 HG23 ILE 99 -1.654 23.300 -0.675 715 HD11 ILE 99 HD11 ILE 99 -4.199 27.528 -0.988 716 HD12 ILE 99 HD12 ILE 99 -3.711 26.185 -1.744 717 HD13 ILE 99 HD13 ILE 99 -2.646 27.353 -1.402 718 H THR 100 H THR 100 0.735 25.611 1.810 719 HA THR 100 HA THR 100 0.305 27.685 3.715 720 HB THR 100 HB THR 100 2.719 27.103 2.176 721 HG1 THR 100 HG1 THR 100 2.519 26.431 4.804 722 HG21 THR 100 HG21 THR 100 3.909 28.333 3.820 723 HG22 THR 100 HG22 THR 100 2.531 28.669 4.597 724 HG23 THR 100 HG23 THR 100 2.810 29.302 3.135 725 H LYS 101 H LYS 101 -0.488 29.720 3.108 726 HA LYS 101 HA LYS 101 -0.048 30.451 0.353 727 HB2 LYS 101 HB2 LYS 101 -1.970 31.882 0.535 728 HB3 LYS 101 HB3 LYS 101 -2.345 30.322 0.843 729 HG2 LYS 101 HG2 LYS 101 -2.207 30.886 3.221 730 HG3 LYS 101 HG3 LYS 101 -2.150 32.452 2.762 731 HD2 LYS 101 HD2 LYS 101 -4.340 32.075 3.296 732 HD3 LYS 101 HD3 LYS 101 -4.304 32.074 1.663 733 HE2 LYS 101 HE2 LYS 101 -4.518 29.788 1.560 734 HE3 LYS 101 HE3 LYS 101 -4.131 29.609 3.137 735 HZ1 LYS 101 HZ1 LYS 101 -6.461 29.284 2.825 736 HZ2 LYS 101 HZ2 LYS 101 -6.593 30.764 2.188 737 HZ3 LYS 101 HZ3 LYS 101 -6.211 30.587 3.749 738 H LYS 102 H LYS 102 1.398 32.061 -0.203 739 HA LYS 102 HA LYS 102 2.398 33.707 1.878 740 HB2 LYS 102 HB2 LYS 102 3.839 34.624 0.440 741 HB3 LYS 102 HB3 LYS 102 3.664 33.100 -0.122 742 HG2 LYS 102 HG2 LYS 102 2.288 33.892 -1.887 743 HG3 LYS 102 HG3 LYS 102 2.404 35.415 -1.311 744 HD2 LYS 102 HD2 LYS 102 4.887 35.073 -1.605 745 HD3 LYS 102 HD3 LYS 102 4.440 33.874 -2.621 746 HE2 LYS 102 HE2 LYS 102 3.618 36.624 -2.970 747 HE3 LYS 102 HE3 LYS 102 4.879 35.963 -3.770 748 HZ1 LYS 102 HZ1 LYS 102 2.978 36.034 -5.160 749 HZ2 LYS 102 HZ2 LYS 102 2.143 35.150 -4.094 750 HZ3 LYS 102 HZ3 LYS 102 3.392 34.496 -4.886 751 H GLY 103 H GLY 103 1.889 35.971 2.289 752 HA2 GLY 103 HA2 GLY 103 0.821 37.915 1.508 753 HA3 GLY 103 HA3 GLY 103 -0.233 37.011 0.649 754 H TRP 104 H TRP 104 -0.009 35.795 3.748 755 HA TRP 104 HA TRP 104 -2.514 36.928 4.421 756 HB2 TRP 104 HB2 TRP 104 -2.218 35.580 6.498 757 HB3 TRP 104 HB3 TRP 104 -2.319 34.733 5.105 758 HD1 TRP 104 HD1 TRP 104 0.811 36.275 6.541 759 HE1 TRP 104 HE1 TRP 104 2.639 34.590 6.817 760 HE3 TRP 104 HE3 TRP 104 -1.864 32.248 5.270 761 HZ2 TRP 104 HZ2 TRP 104 2.833 31.811 6.424 762 HZ3 TRP 104 HZ3 TRP 104 -0.774 30.088 5.241 763 HH2 TRP 104 HH2 TRP 104 1.557 29.890 5.815 764 H ASP 105 H ASP 105 -2.994 37.967 6.516 765 HA ASP 105 HA ASP 105 -1.224 40.065 7.031 766 HB2 ASP 105 HB2 ASP 105 -3.472 39.279 8.688 767 HB3 ASP 105 HB3 ASP 105 -2.838 40.782 8.596 768 HA PRO 106 HA PRO 106 1.061 37.933 10.061 769 HB2 PRO 106 HB2 PRO 106 2.527 39.844 11.202 770 HB3 PRO 106 HB3 PRO 106 2.817 39.484 9.636 771 HG2 PRO 106 HG2 PRO 106 1.174 41.581 10.665 772 HG3 PRO 106 HG3 PRO 106 2.346 41.699 9.534 773 HD2 PRO 106 HD2 PRO 106 -0.149 41.491 8.798 774 HD3 PRO 106 HD3 PRO 106 1.021 40.788 7.901 775 H ASP 107 H ASP 107 -1.195 40.161 10.982 776 HA ASP 107 HA ASP 107 -0.977 39.834 13.746 777 HB2 ASP 107 HB2 ASP 107 -2.145 41.696 12.718 778 HB3 ASP 107 HB3 ASP 107 -3.303 40.664 12.206 779 H LYS 108 H LYS 108 -2.073 37.783 11.394 780 HA LYS 108 HA LYS 108 -4.145 36.550 12.931 781 HB2 LYS 108 HB2 LYS 108 -3.019 35.922 10.355 782 HB3 LYS 108 HB3 LYS 108 -4.182 35.001 11.038 783 HG2 LYS 108 HG2 LYS 108 -5.698 36.762 10.961 784 HG3 LYS 108 HG3 LYS 108 -4.535 37.792 10.457 785 HD2 LYS 108 HD2 LYS 108 -4.407 36.680 8.394 786 HD3 LYS 108 HD3 LYS 108 -5.500 35.576 8.899 787 HE2 LYS 108 HE2 LYS 108 -7.189 37.191 8.981 788 HE3 LYS 108 HE3 LYS 108 -6.115 38.393 8.719 789 HZ1 LYS 108 HZ1 LYS 108 -7.344 37.952 6.751 790 HZ2 LYS 108 HZ2 LYS 108 -6.847 36.414 6.770 791 HZ3 LYS 108 HZ3 LYS 108 -5.784 37.604 6.510 792 HA PRO 109 HA PRO 109 -1.404 33.928 14.976 793 HB2 PRO 109 HB2 PRO 109 -2.869 31.799 15.617 794 HB3 PRO 109 HB3 PRO 109 -3.182 33.228 16.343 795 HG2 PRO 109 HG2 PRO 109 -4.506 32.107 14.066 796 HG3 PRO 109 HG3 PRO 109 -5.195 32.733 15.408 797 HD2 PRO 109 HD2 PRO 109 -4.995 34.206 13.298 798 HD3 PRO 109 HD3 PRO 109 -4.759 34.886 14.764 799 H LEU 110 H LEU 110 0.167 33.654 13.601 800 HA LEU 110 HA LEU 110 0.015 32.155 11.374 801 HB2 LEU 110 HB2 LEU 110 1.975 33.501 12.755 802 HB3 LEU 110 HB3 LEU 110 2.623 32.069 12.310 803 HG LEU 110 HG LEU 110 1.474 33.885 10.401 804 HD11 LEU 110 HD11 LEU 110 3.733 34.589 9.903 805 HD12 LEU 110 HD12 LEU 110 4.286 33.666 11.110 806 HD13 LEU 110 HD13 LEU 110 3.367 34.956 11.435 807 HD21 LEU 110 HD21 LEU 110 2.670 32.602 8.776 808 HD22 LEU 110 HD22 LEU 110 1.644 31.653 9.589 809 HD23 LEU 110 HD23 LEU 110 3.222 31.628 9.943 810 H LYS 111 H LYS 111 0.855 30.948 14.510 811 HA LYS 111 HA LYS 111 1.766 28.518 13.614 812 HB2 LYS 111 HB2 LYS 111 0.578 29.148 16.165 813 HB3 LYS 111 HB3 LYS 111 1.244 27.687 15.866 814 HG2 LYS 111 HG2 LYS 111 3.287 29.038 15.271 815 HG3 LYS 111 HG3 LYS 111 2.572 30.197 16.173 816 HD2 LYS 111 HD2 LYS 111 3.210 27.585 17.190 817 HD3 LYS 111 HD3 LYS 111 4.175 28.886 17.400 818 HE2 LYS 111 HE2 LYS 111 2.429 29.945 18.651 819 HE3 LYS 111 HE3 LYS 111 1.519 28.599 18.487 820 HZ1 LYS 111 HZ1 LYS 111 2.618 28.590 20.601 821 HZ2 LYS 111 HZ2 LYS 111 4.054 28.690 19.864 822 HZ3 LYS 111 HZ3 LYS 111 3.153 27.357 19.702 823 H ARG 112 H ARG 112 -1.488 29.576 14.004 824 HA ARG 112 HA ARG 112 -2.514 27.020 13.400 825 HB2 ARG 112 HB2 ARG 112 -3.765 29.570 13.787 826 HB3 ARG 112 HB3 ARG 112 -4.639 28.420 13.025 827 HG2 ARG 112 HG2 ARG 112 -5.315 28.253 15.172 828 HG3 ARG 112 HG3 ARG 112 -4.237 27.035 15.025 829 HD2 ARG 112 HD2 ARG 112 -2.605 28.265 16.154 830 HD3 ARG 112 HD3 ARG 112 -3.549 29.598 16.152 831 HE ARG 112 HE ARG 112 -3.765 27.360 17.917 832 HH11 ARG 112 HH11 ARG 112 -5.309 30.340 16.828 833 HH12 ARG 112 HH12 ARG 112 -6.328 30.418 18.227 834 HH21 ARG 112 HH21 ARG 112 -5.102 27.538 19.665 835 HH22 ARG 112 HH22 ARG 112 -6.212 28.861 19.801 836 H ALA 113 H ALA 113 -2.041 30.010 11.745 837 HA ALA 113 HA ALA 113 -3.461 29.166 9.498 838 HB1 ALA 113 HB1 ALA 113 -3.469 31.541 10.258 839 HB2 ALA 113 HB2 ALA 113 -3.047 31.478 8.698 840 HB3 ALA 113 HB3 ALA 113 -1.913 31.662 9.836 841 H ASP 114 H ASP 114 -0.392 28.444 10.195 842 HA ASP 114 HA ASP 114 0.891 29.163 7.850 843 HB2 ASP 114 HB2 ASP 114 1.974 28.446 9.958 844 HB3 ASP 114 HB3 ASP 114 1.650 26.907 9.518 845 H PHE 115 H PHE 115 -0.917 26.365 8.676 846 HA PHE 115 HA PHE 115 -0.848 25.589 5.884 847 HB2 PHE 115 HB2 PHE 115 -1.129 23.708 8.047 848 HB3 PHE 115 HB3 PHE 115 -0.925 23.339 6.470 849 HD1 PHE 115 HD1 PHE 115 0.730 23.465 9.442 850 HD2 PHE 115 HD2 PHE 115 1.314 24.371 5.423 851 HE1 PHE 115 HE1 PHE 115 3.117 23.443 9.787 852 HE2 PHE 115 HE2 PHE 115 3.699 24.354 5.758 853 HZ PHE 115 HZ PHE 115 4.603 23.906 7.944 854 H GLU 116 H GLU 116 -2.720 26.233 4.980 855 HA GLU 116 HA GLU 116 -5.025 26.161 6.688 856 HB2 GLU 116 HB2 GLU 116 -4.505 27.674 4.285 857 HB3 GLU 116 HB3 GLU 116 -5.998 27.638 4.944 858 HG2 GLU 116 HG2 GLU 116 -4.311 28.371 6.914 859 HG3 GLU 116 HG3 GLU 116 -3.922 29.272 5.609 860 H LEU 117 H LEU 117 -6.776 24.898 6.385 861 HA LEU 117 HA LEU 117 -6.645 22.826 4.572 862 HB2 LEU 117 HB2 LEU 117 -7.991 22.779 6.559 863 HB3 LEU 117 HB3 LEU 117 -9.015 23.851 5.874 864 HG LEU 117 HG LEU 117 -9.506 22.130 4.208 865 HD11 LEU 117 HD11 LEU 117 -9.027 19.859 4.789 866 HD12 LEU 117 HD12 LEU 117 -8.179 20.362 6.071 867 HD13 LEU 117 HD13 LEU 117 -7.652 20.682 4.576 868 HD21 LEU 117 HD21 LEU 117 -11.075 21.006 5.655 869 HD22 LEU 117 HD22 LEU 117 -11.061 22.590 5.980 870 HD23 LEU 117 HD23 LEU 117 -10.277 21.559 6.948 871 H ILE 118 H ILE 118 -7.143 22.632 2.421 872 HA ILE 118 HA ILE 118 -8.768 24.745 1.285 873 HB ILE 118 HB ILE 118 -6.145 24.707 0.889 874 HG12 ILE 118 HG12 ILE 118 -7.541 26.541 0.397 875 HG13 ILE 118 HG13 ILE 118 -6.424 26.292 -0.768 876 HG21 ILE 118 HG21 ILE 118 -5.614 23.921 -1.261 877 HG22 ILE 118 HG22 ILE 118 -7.094 23.285 -1.404 878 HG23 ILE 118 HG23 ILE 118 -6.070 22.708 -0.293 879 HD11 ILE 118 HD11 ILE 118 -8.515 26.892 -1.757 880 HD12 ILE 118 HD12 ILE 118 -9.234 25.631 -1.044 881 HD13 ILE 118 HD13 ILE 118 -8.127 25.385 -2.197 882 H GLY 119 H GLY 119 -8.599 21.603 1.888 883 HA2 GLY 119 HA2 GLY 119 -10.897 21.119 0.429 884 HA3 GLY 119 HA3 GLY 119 -9.643 20.461 -0.386 885 H ALA 120 H ALA 120 -12.015 19.340 1.066 886 HA ALA 120 HA ALA 120 -10.603 17.210 2.327 887 HB1 ALA 120 HB1 ALA 120 -11.022 18.675 4.209 888 HB2 ALA 120 HB2 ALA 120 -11.930 17.347 4.377 889 HB3 ALA 120 HB3 ALA 120 -12.596 18.720 3.842 890 H VAL 121 H VAL 121 -11.532 15.257 1.849 891 HA VAL 121 HA VAL 121 -14.318 15.310 1.158 892 HB VAL 121 HB VAL 121 -12.360 13.819 -0.399 893 HG11 VAL 121 HG11 VAL 121 -14.183 13.156 -1.824 894 HG12 VAL 121 HG12 VAL 121 -15.225 13.912 -0.847 895 HG13 VAL 121 HG13 VAL 121 -14.424 12.610 -0.322 896 HG21 VAL 121 HG21 VAL 121 -12.903 15.284 -2.237 897 HG22 VAL 121 HG22 VAL 121 -12.306 16.143 -1.004 898 HG23 VAL 121 HG23 VAL 121 -13.900 16.123 -1.280 899 HA PRO 122 HA PRO 122 -13.742 11.923 3.969 900 HB2 PRO 122 HB2 PRO 122 -16.092 11.752 5.103 901 HB3 PRO 122 HB3 PRO 122 -15.174 13.050 5.477 902 HG2 PRO 122 HG2 PRO 122 -17.296 12.902 3.573 903 HG3 PRO 122 HG3 PRO 122 -17.054 14.048 4.710 904 HD2 PRO 122 HD2 PRO 122 -16.278 14.407 2.205 905 HD3 PRO 122 HD3 PRO 122 -15.505 15.134 3.446 906 H HIS 123 H HIS 123 -14.461 9.714 4.234 907 HA HIS 123 HA HIS 123 -15.617 8.806 1.735 908 HB2 HIS 123 HB2 HIS 123 -13.498 7.882 2.235 909 HB3 HIS 123 HB3 HIS 123 -14.045 7.367 3.685 910 HD1 HIS 123 HD1 HIS 123 -15.333 6.826 0.174 911 HD2 HIS 123 HD2 HIS 123 -14.318 4.700 3.528 912 HE1 HIS 123 HE1 HIS 123 -15.800 4.418 -0.244 913 HE2 HIS 123 HE2 HIS 123 -15.200 3.117 1.767 914 H ASP 124 H ASP 124 -17.731 8.722 1.863 915 HA ASP 124 HA ASP 124 -18.964 7.667 4.250 916 HB2 ASP 124 HB2 ASP 124 -20.909 8.984 3.631 917 HB3 ASP 124 HB3 ASP 124 -19.603 9.937 3.863 918 H GLY 125 H GLY 125 -18.516 7.394 0.963 919 HA2 GLY 125 HA2 GLY 125 -19.677 4.879 0.687 920 HA3 GLY 125 HA3 GLY 125 -20.673 6.002 0.044 921 H SER 126 H SER 126 -20.068 5.012 -2.129 922 HA SER 126 HA SER 126 -17.595 6.202 -2.918 923 HB2 SER 126 HB2 SER 126 -17.537 3.696 -2.857 924 HB3 SER 126 HB3 SER 126 -18.534 3.722 -4.151 925 HG SER 126 HG SER 126 -15.901 4.348 -3.997 926 HA PRO 127 HA PRO 127 -20.470 7.589 -6.111 927 HB2 PRO 127 HB2 PRO 127 -20.804 10.141 -5.573 928 HB3 PRO 127 HB3 PRO 127 -21.805 9.071 -4.852 929 HG2 PRO 127 HG2 PRO 127 -19.452 10.251 -3.783 930 HG3 PRO 127 HG3 PRO 127 -20.927 10.153 -3.089 931 HD2 PRO 127 HD2 PRO 127 -19.079 8.418 -2.473 932 HD3 PRO 127 HD3 PRO 127 -20.644 7.955 -2.532 933 H ALA 128 H ALA 128 -19.817 9.231 -7.822 934 HA ALA 128 HA ALA 128 -17.188 8.811 -8.334 935 HB1 ALA 128 HB1 ALA 128 -18.818 9.455 -10.052 936 HB2 ALA 128 HB2 ALA 128 -17.490 10.367 -10.199 937 HB3 ALA 128 HB3 ALA 128 -18.810 10.969 -9.484 938 H SER 129 H SER 129 -18.476 11.421 -6.545 939 HA SER 129 HA SER 129 -16.208 13.024 -6.673 940 HB2 SER 129 HB2 SER 129 -17.298 14.194 -4.762 941 HB3 SER 129 HB3 SER 129 -18.296 14.001 -6.040 942 HG SER 129 HG SER 129 -19.499 12.676 -4.995 943 H ARG 130 H ARG 130 -16.752 10.223 -4.962 944 HA ARG 130 HA ARG 130 -14.771 10.855 -2.992 945 HB2 ARG 130 HB2 ARG 130 -16.930 9.034 -3.044 946 HB3 ARG 130 HB3 ARG 130 -15.596 8.431 -2.321 947 HG2 ARG 130 HG2 ARG 130 -16.918 9.349 -0.657 948 HG3 ARG 130 HG3 ARG 130 -15.623 10.329 -0.835 949 HD2 ARG 130 HD2 ARG 130 -16.923 11.867 -2.072 950 HD3 ARG 130 HD3 ARG 130 -18.213 10.870 -1.993 951 HE ARG 130 HE ARG 130 -17.187 11.700 0.530 952 HH11 ARG 130 HH11 ARG 130 -19.582 12.395 -1.961 953 HH12 ARG 130 HH12 ARG 130 -20.592 13.273 -0.861 954 HH21 ARG 130 HH21 ARG 130 -18.551 12.799 1.874 955 HH22 ARG 130 HH22 ARG 130 -20.016 13.496 1.269 956 H ASN 131 H ASN 131 -14.592 9.826 -5.968 957 HA ASN 131 HA ASN 131 -12.964 7.610 -5.842 958 HB2 ASN 131 HB2 ASN 131 -13.145 9.705 -7.795 959 HB3 ASN 131 HB3 ASN 131 -12.000 8.553 -7.966 960 HD21 ASN 131 HD21 ASN 131 -15.194 7.749 -9.771 961 HD22 ASN 131 HD22 ASN 131 -14.348 9.252 -9.602 962 H LEU 132 H LEU 132 -10.604 7.397 -5.866 963 HA LEU 132 HA LEU 132 -9.406 9.204 -4.128 964 HB2 LEU 132 HB2 LEU 132 -8.737 6.733 -5.161 965 HB3 LEU 132 HB3 LEU 132 -7.421 7.698 -5.232 966 HG LEU 132 HG LEU 132 -7.341 6.380 -3.314 967 HD11 LEU 132 HD11 LEU 132 -7.000 8.088 -1.633 968 HD12 LEU 132 HD12 LEU 132 -7.772 9.156 -2.570 969 HD13 LEU 132 HD13 LEU 132 -6.352 8.543 -3.043 970 HD21 LEU 132 HD21 LEU 132 -8.974 6.576 -1.550 971 HD22 LEU 132 HD22 LEU 132 -9.657 6.008 -2.902 972 HD23 LEU 132 HD23 LEU 132 -9.856 7.557 -2.485 973 H SER 133 H SER 133 -9.821 9.396 -7.372 974 HA SER 133 HA SER 133 -7.405 10.820 -7.914 975 HB2 SER 133 HB2 SER 133 -8.291 9.362 -9.628 976 HB3 SER 133 HB3 SER 133 -9.617 10.309 -9.730 977 HG SER 133 HG SER 133 -7.824 10.616 -11.266 978 H HIS 134 H HIS 134 -7.207 13.008 -7.742 979 HA HIS 134 HA HIS 134 -9.647 14.548 -7.627 980 HB2 HIS 134 HB2 HIS 134 -7.413 15.005 -5.835 981 HB3 HIS 134 HB3 HIS 134 -8.863 15.751 -5.752 982 HD1 HIS 134 HD1 HIS 134 -7.123 13.511 -3.833 983 HD2 HIS 134 HD2 HIS 134 -10.893 13.412 -5.435 984 HE1 HIS 134 HE1 HIS 134 -8.463 11.811 -2.604 985 HE2 HIS 134 HE2 HIS 134 -10.732 11.725 -3.567 986 H HIS 135 H HIS 135 -9.683 16.562 -8.541 987 HA HIS 135 HA HIS 135 -7.394 17.143 -10.207 988 HB2 HIS 135 HB2 HIS 135 -10.158 17.986 -10.398 989 HB3 HIS 135 HB3 HIS 135 -9.005 18.532 -11.417 990 HD1 HIS 135 HD1 HIS 135 -8.685 17.298 -13.579 991 HD2 HIS 135 HD2 HIS 135 -10.542 15.070 -10.686 992 HE1 HIS 135 HE1 HIS 135 -9.331 15.109 -14.565 993 HE2 HIS 135 HE2 HIS 135 -10.440 13.742 -12.836 994 H ILE 136 H ILE 136 -6.223 19.040 -10.054 995 HA ILE 136 HA ILE 136 -7.110 20.892 -8.038 996 HB ILE 136 HB ILE 136 -4.330 20.001 -8.330 997 HG12 ILE 136 HG12 ILE 136 -5.649 18.363 -7.228 998 HG13 ILE 136 HG13 ILE 136 -4.451 18.933 -6.276 999 HG21 ILE 136 HG21 ILE 136 -3.783 21.403 -6.429 1000 HG22 ILE 136 HG22 ILE 136 -5.307 21.942 -6.386 1001 HG23 ILE 136 HG23 ILE 136 -4.355 22.308 -7.640 1002 HD11 ILE 136 HD11 ILE 136 -6.462 18.667 -4.986 1003 HD12 ILE 136 HD12 ILE 136 -7.251 19.669 -5.979 1004 HD13 ILE 136 HD13 ILE 136 -6.064 20.234 -5.037 1005 H TYR 137 H TYR 137 -7.265 22.985 -8.874 1006 HA TYR 137 HA TYR 137 -5.889 23.455 -11.332 1007 HB2 TYR 137 HB2 TYR 137 -8.242 24.122 -11.012 1008 HB3 TYR 137 HB3 TYR 137 -7.677 25.346 -10.090 1009 HD1 TYR 137 HD1 TYR 137 -6.346 27.197 -11.138 1010 HD2 TYR 137 HD2 TYR 137 -8.119 24.212 -13.430 1011 HE1 TYR 137 HE1 TYR 137 -5.971 28.505 -13.134 1012 HE2 TYR 137 HE2 TYR 137 -7.743 25.522 -15.424 1013 HH TYR 137 HH TYR 137 -6.528 27.279 -16.328 1014 H ILE 138 H ILE 138 -4.144 24.776 -11.623 1015 HA ILE 138 HA ILE 138 -3.147 26.094 -9.263 1016 HB ILE 138 HB ILE 138 -1.656 25.141 -11.582 1017 HG12 ILE 138 HG12 ILE 138 -2.294 23.345 -10.203 1018 HG13 ILE 138 HG13 ILE 138 -0.676 23.547 -10.105 1019 HG21 ILE 138 HG21 ILE 138 0.364 25.770 -10.483 1020 HG22 ILE 138 HG22 ILE 138 -0.491 26.440 -9.285 1021 HG23 ILE 138 HG23 ILE 138 -0.553 27.069 -10.773 1022 HD11 ILE 138 HD11 ILE 138 -1.570 23.053 -7.936 1023 HD12 ILE 138 HD12 ILE 138 -2.542 24.342 -8.024 1024 HD13 ILE 138 HD13 ILE 138 -0.941 24.542 -7.927 1025 HA PRO 139 HA PRO 139 -3.972 29.745 -11.550 1026 HB2 PRO 139 HB2 PRO 139 -2.869 31.616 -10.001 1027 HB3 PRO 139 HB3 PRO 139 -4.252 30.902 -9.506 1028 HG2 PRO 139 HG2 PRO 139 -1.582 30.223 -8.768 1029 HG3 PRO 139 HG3 PRO 139 -2.858 30.473 -7.779 1030 HD2 PRO 139 HD2 PRO 139 -2.212 28.052 -8.416 1031 HD3 PRO 139 HD3 PRO 139 -3.792 28.445 -8.289 1032 H GLU 140 H GLU 140 -3.079 31.149 -13.018 1033 HA GLU 140 HA GLU 140 -0.275 30.578 -13.533 1034 HB2 GLU 140 HB2 GLU 140 -2.022 29.635 -15.053 1035 HB3 GLU 140 HB3 GLU 140 -2.236 31.169 -15.573 1036 HG2 GLU 140 HG2 GLU 140 -0.205 31.220 -16.568 1037 HG3 GLU 140 HG3 GLU 140 0.296 29.880 -15.780 1038 H ASP 141 H ASP 141 -2.303 32.889 -12.602 1039 HA ASP 141 HA ASP 141 -1.197 35.020 -14.087 1040 HB2 ASP 141 HB2 ASP 141 -2.831 36.375 -12.957 1041 HB3 ASP 141 HB3 ASP 141 -3.563 34.975 -13.373 1042 H ARG 142 H ARG 142 0.215 33.434 -11.818 1043 HA ARG 142 HA ARG 142 1.584 35.642 -10.723 1044 HB2 ARG 142 HB2 ARG 142 1.002 35.184 -8.428 1045 HB3 ARG 142 HB3 ARG 142 -0.348 35.530 -9.279 1046 HG2 ARG 142 HG2 ARG 142 -0.695 33.099 -9.468 1047 HG3 ARG 142 HG3 ARG 142 0.474 32.934 -8.339 1048 HD2 ARG 142 HD2 ARG 142 -1.573 32.896 -7.211 1049 HD3 ARG 142 HD3 ARG 142 -0.872 34.329 -6.863 1050 HE ARG 142 HE ARG 142 -2.498 34.616 -9.102 1051 HH11 ARG 142 HH11 ARG 142 -4.403 35.687 -8.991 1052 HH12 ARG 142 HH12 ARG 142 -5.202 35.924 -7.473 1053 HH21 ARG 142 HH21 ARG 142 -2.794 34.334 -5.602 1054 HH22 ARG 142 HH22 ARG 142 -4.310 35.172 -5.586 1055 H LEU 143 H LEU 143 3.249 35.057 -9.084 1056 HA LEU 143 HA LEU 143 4.245 32.373 -9.532 1057 HB2 LEU 143 HB2 LEU 143 5.801 34.775 -9.428 1058 HB3 LEU 143 HB3 LEU 143 6.473 33.296 -9.259 1059 HG LEU 143 HG LEU 143 5.493 32.901 -11.540 1060 HD11 LEU 143 HD11 LEU 143 5.471 34.822 -12.966 1061 HD12 LEU 143 HD12 LEU 143 5.704 35.780 -11.684 1062 HD13 LEU 143 HD13 LEU 143 4.326 34.946 -11.830 1063 HD21 LEU 143 HD21 LEU 143 7.610 33.645 -12.500 1064 HD22 LEU 143 HD22 LEU 143 7.871 32.901 -11.089 1065 HD23 LEU 143 HD23 LEU 143 7.897 34.516 -11.168 1066 H GLY 144 H GLY 144 5.299 31.417 -7.564 1067 HA2 GLY 144 HA2 GLY 144 5.944 32.580 -5.315 1068 HA3 GLY 144 HA3 GLY 144 4.317 32.640 -5.185 1069 H TYR 145 H TYR 145 6.339 31.383 -3.557 1070 HA TYR 145 HA TYR 145 6.036 28.627 -3.973 1071 HB2 TYR 145 HB2 TYR 145 7.332 28.618 -1.759 1072 HB3 TYR 145 HB3 TYR 145 8.108 29.118 -3.106 1073 HD1 TYR 145 HD1 TYR 145 9.004 31.333 -3.255 1074 HD2 TYR 145 HD2 TYR 145 6.387 30.377 -0.160 1075 HE1 TYR 145 HE1 TYR 145 9.451 33.465 -2.212 1076 HE2 TYR 145 HE2 TYR 145 6.807 32.527 0.855 1077 HH TYR 145 HH TYR 145 8.470 35.056 -0.693 1078 H HIS 146 H HIS 146 5.125 27.055 -2.731 1079 HA HIS 146 HA HIS 146 3.390 27.824 -0.570 1080 HB2 HIS 146 HB2 HIS 146 2.414 26.322 -2.843 1081 HB3 HIS 146 HB3 HIS 146 1.545 26.632 -1.496 1082 HD1 HIS 146 HD1 HIS 146 0.518 29.002 -1.153 1083 HD2 HIS 146 HD2 HIS 146 2.531 28.429 -4.670 1084 HE1 HIS 146 HE1 HIS 146 -0.010 30.898 -2.684 1085 HE2 HIS 146 HE2 HIS 146 1.207 30.572 -4.810 1086 H VAL 147 H VAL 147 2.889 25.870 0.791 1087 HA VAL 147 HA VAL 147 4.451 23.535 -0.001 1088 HB VAL 147 HB VAL 147 3.932 24.247 2.747 1089 HG11 VAL 147 HG11 VAL 147 5.476 22.493 3.267 1090 HG12 VAL 147 HG12 VAL 147 5.633 22.157 1.694 1091 HG13 VAL 147 HG13 VAL 147 4.221 21.898 2.439 1092 HG21 VAL 147 HG21 VAL 147 6.273 24.849 2.885 1093 HG22 VAL 147 HG22 VAL 147 5.531 25.801 1.808 1094 HG23 VAL 147 HG23 VAL 147 6.444 24.566 1.302 1095 H ILE 148 H ILE 148 3.192 21.704 -0.347 1096 HA ILE 148 HA ILE 148 0.417 21.996 0.353 1097 HB ILE 148 HB ILE 148 1.497 20.292 -1.769 1098 HG12 ILE 148 HG12 ILE 148 -0.034 22.708 -2.104 1099 HG13 ILE 148 HG13 ILE 148 1.586 22.627 -2.294 1100 HG21 ILE 148 HG21 ILE 148 -0.818 19.837 -2.387 1101 HG22 ILE 148 HG22 ILE 148 -1.333 20.721 -1.134 1102 HG23 ILE 148 HG23 ILE 148 -0.555 19.327 -0.876 1103 HD11 ILE 148 HD11 ILE 148 0.510 22.598 -4.441 1104 HD12 ILE 148 HD12 ILE 148 -0.323 21.277 -4.021 1105 HD13 ILE 148 HD13 ILE 148 1.281 21.196 -4.209 1106 H LEU 149 H LEU 149 -0.298 20.779 2.028 1107 HA LEU 149 HA LEU 149 1.212 18.407 2.704 1108 HB2 LEU 149 HB2 LEU 149 -0.490 20.059 4.335 1109 HB3 LEU 149 HB3 LEU 149 0.068 18.617 4.859 1110 HG LEU 149 HG LEU 149 2.285 19.537 4.803 1111 HD11 LEU 149 HD11 LEU 149 2.611 21.886 4.758 1112 HD12 LEU 149 HD12 LEU 149 1.053 22.101 4.383 1113 HD13 LEU 149 HD13 LEU 149 2.041 21.362 3.338 1114 HD21 LEU 149 HD21 LEU 149 1.944 20.784 6.883 1115 HD22 LEU 149 HD22 LEU 149 1.023 19.455 6.883 1116 HD23 LEU 149 HD23 LEU 149 0.366 20.894 6.547 1117 H ALA 150 H ALA 150 0.158 16.388 2.467 1118 HA ALA 150 HA ALA 150 -2.717 16.508 2.278 1119 HB1 ALA 150 HB1 ALA 150 -1.891 16.273 0.027 1120 HB2 ALA 150 HB2 ALA 150 -2.686 14.928 0.443 1121 HB3 ALA 150 HB3 ALA 150 -1.069 14.948 0.455 1122 H VAL 151 H VAL 151 -3.855 15.020 3.412 1123 HA VAL 151 HA VAL 151 -2.315 12.899 4.574 1124 HB VAL 151 HB VAL 151 -4.371 14.274 6.115 1125 HG11 VAL 151 HG11 VAL 151 -3.400 13.185 8.028 1126 HG12 VAL 151 HG12 VAL 151 -2.315 12.464 7.071 1127 HG13 VAL 151 HG13 VAL 151 -3.881 12.083 6.946 1128 HG21 VAL 151 HG21 VAL 151 -2.644 15.483 7.282 1129 HG22 VAL 151 HG22 VAL 151 -2.634 15.878 5.714 1130 HG23 VAL 151 HG23 VAL 151 -1.530 14.850 6.296 1131 H TRP 152 H TRP 152 -3.195 10.888 4.498 1132 HA TRP 152 HA TRP 152 -5.982 10.656 3.663 1133 HB2 TRP 152 HB2 TRP 152 -4.583 10.028 1.909 1134 HB3 TRP 152 HB3 TRP 152 -3.749 9.027 2.894 1135 HD1 TRP 152 HD1 TRP 152 -7.075 8.223 3.686 1136 HE1 TRP 152 HE1 TRP 152 -8.025 6.253 2.472 1137 HE3 TRP 152 HE3 TRP 152 -3.564 7.920 0.136 1138 HZ2 TRP 152 HZ2 TRP 152 -7.261 4.765 0.204 1139 HZ3 TRP 152 HZ3 TRP 152 -3.737 6.175 -1.534 1140 HH2 TRP 152 HH2 TRP 152 -5.574 4.608 -1.482 1141 H ASP 153 H ASP 153 -7.122 10.141 5.379 1142 HA ASP 153 HA ASP 153 -5.901 8.765 7.532 1143 HB2 ASP 153 HB2 ASP 153 -7.464 10.735 7.691 1144 HB3 ASP 153 HB3 ASP 153 -8.657 9.640 7.480 1145 H VAL 154 H VAL 154 -6.178 6.733 8.202 1146 HA VAL 154 HA VAL 154 -7.968 5.055 6.636 1147 HB VAL 154 HB VAL 154 -5.511 4.282 7.946 1148 HG11 VAL 154 HG11 VAL 154 -5.779 2.151 6.901 1149 HG12 VAL 154 HG12 VAL 154 -7.208 2.618 6.305 1150 HG13 VAL 154 HG13 VAL 154 -7.015 2.444 7.901 1151 HG21 VAL 154 HG21 VAL 154 -4.619 4.028 5.701 1152 HG22 VAL 154 HG22 VAL 154 -5.072 5.562 5.937 1153 HG23 VAL 154 HG23 VAL 154 -6.015 4.562 5.085 1154 H ALA 155 H ALA 155 -9.582 3.946 7.726 1155 HA ALA 155 HA ALA 155 -10.104 5.098 10.191 1156 HB1 ALA 155 HB1 ALA 155 -11.881 4.569 8.554 1157 HB2 ALA 155 HB2 ALA 155 -12.268 3.935 9.990 1158 HB3 ALA 155 HB3 ALA 155 -11.649 2.993 8.831 1159 H ASP 156 H ASP 156 -8.792 2.093 9.445 1160 HA ASP 156 HA ASP 156 -9.304 1.165 12.100 1161 HB2 ASP 156 HB2 ASP 156 -9.138 -1.098 11.217 1162 HB3 ASP 156 HB3 ASP 156 -10.280 -0.252 10.412 1163 H THR 157 H THR 157 -7.005 2.803 11.244 1164 HA THR 157 HA THR 157 -5.083 1.134 12.521 1165 HB THR 157 HB THR 157 -3.285 2.047 10.999 1166 HG1 THR 157 HG1 THR 157 -4.637 2.634 8.931 1167 HG21 THR 157 HG21 THR 157 -3.772 0.588 9.157 1168 HG22 THR 157 HG22 THR 157 -5.315 0.480 9.629 1169 HG23 THR 157 HG23 THR 157 -4.145 -0.176 10.532 1170 H GLU 158 H GLU 158 -3.343 2.204 13.715 1171 HA GLU 158 HA GLU 158 -4.129 4.693 14.741 1172 HB2 GLU 158 HB2 GLU 158 -1.622 3.311 15.229 1173 HB3 GLU 158 HB3 GLU 158 -2.203 4.522 16.158 1174 HG2 GLU 158 HG2 GLU 158 -2.685 2.735 17.407 1175 HG3 GLU 158 HG3 GLU 158 -4.092 2.956 16.608 1176 H ASN 159 H ASN 159 -2.525 3.799 12.092 1177 HA ASN 159 HA ASN 159 -0.884 6.162 11.936 1178 HB2 ASN 159 HB2 ASN 159 -0.537 3.551 10.805 1179 HB3 ASN 159 HB3 ASN 159 0.172 4.819 10.060 1180 HD21 ASN 159 HD21 ASN 159 1.766 3.278 13.363 1181 HD22 ASN 159 HD22 ASN 159 0.337 2.643 12.618 1182 H ALA 160 H ALA 160 -0.684 7.213 9.808 1183 HA ALA 160 HA ALA 160 -2.985 6.875 8.098 1184 HB1 ALA 160 HB1 ALA 160 -3.714 8.611 9.559 1185 HB2 ALA 160 HB2 ALA 160 -3.416 9.262 8.109 1186 HB3 ALA 160 HB3 ALA 160 -2.346 9.437 9.309 1187 H PHE 161 H PHE 161 -2.556 7.991 5.959 1188 HA PHE 161 HA PHE 161 0.234 7.745 5.428 1189 HB2 PHE 161 HB2 PHE 161 -1.856 8.314 3.520 1190 HB3 PHE 161 HB3 PHE 161 -0.345 7.819 3.147 1191 HD1 PHE 161 HD1 PHE 161 -3.325 6.647 2.761 1192 HD2 PHE 161 HD2 PHE 161 0.060 5.564 4.891 1193 HE1 PHE 161 HE1 PHE 161 -4.040 4.341 2.704 1194 HE2 PHE 161 HE2 PHE 161 -0.630 3.261 4.852 1195 HZ PHE 161 HZ PHE 161 -2.684 2.638 3.759 1196 H TYR 162 H TYR 162 1.620 9.441 5.081 1197 HA TYR 162 HA TYR 162 0.396 12.032 4.903 1198 HB2 TYR 162 HB2 TYR 162 1.210 11.701 7.141 1199 HB3 TYR 162 HB3 TYR 162 2.701 11.399 6.548 1200 HD1 TYR 162 HD1 TYR 162 4.188 13.215 5.895 1201 HD2 TYR 162 HD2 TYR 162 0.289 14.003 7.110 1202 HE1 TYR 162 HE1 TYR 162 4.689 15.577 5.979 1203 HE2 TYR 162 HE2 TYR 162 0.786 16.361 7.181 1204 HH TYR 162 HH TYR 162 3.998 17.629 6.643 1205 H GLN 163 H GLN 163 1.169 13.415 3.394 1206 HA GLN 163 HA GLN 163 3.824 12.988 2.425 1207 HB2 GLN 163 HB2 GLN 163 2.930 13.268 0.103 1208 HB3 GLN 163 HB3 GLN 163 2.920 11.781 0.777 1209 HG2 GLN 163 HG2 GLN 163 0.561 13.381 0.953 1210 HG3 GLN 163 HG3 GLN 163 0.869 12.582 -0.438 1211 HE21 GLN 163 HE21 GLN 163 -1.035 10.702 2.396 1212 HE22 GLN 163 HE22 GLN 163 -0.880 12.419 2.231 1213 H VAL 164 H VAL 164 4.855 14.910 1.862 1214 HA VAL 164 HA VAL 164 3.190 17.260 1.702 1215 HB VAL 164 HB VAL 164 4.015 17.298 3.933 1216 HG11 VAL 164 HG11 VAL 164 6.355 17.361 4.431 1217 HG12 VAL 164 HG12 VAL 164 6.700 17.144 2.866 1218 HG13 VAL 164 HG13 VAL 164 5.978 15.966 3.705 1219 HG21 VAL 164 HG21 VAL 164 5.066 19.433 3.963 1220 HG22 VAL 164 HG22 VAL 164 3.818 19.432 2.935 1221 HG23 VAL 164 HG23 VAL 164 5.331 19.330 2.372 1222 H ILE 165 H ILE 165 3.815 18.753 0.135 1223 HA ILE 165 HA ILE 165 6.277 18.161 -1.198 1224 HB ILE 165 HB ILE 165 3.827 18.675 -2.723 1225 HG12 ILE 165 HG12 ILE 165 5.202 16.150 -2.585 1226 HG13 ILE 165 HG13 ILE 165 3.835 16.477 -1.753 1227 HG21 ILE 165 HG21 ILE 165 5.177 18.206 -4.697 1228 HG22 ILE 165 HG22 ILE 165 6.478 17.995 -3.761 1229 HG23 ILE 165 HG23 ILE 165 5.809 19.461 -3.896 1230 HD11 ILE 165 HD11 ILE 165 3.313 15.190 -3.710 1231 HD12 ILE 165 HD12 ILE 165 3.978 16.325 -4.651 1232 HD13 ILE 165 HD13 ILE 165 2.624 16.649 -3.828 1233 H ASP 166 H ASP 166 7.530 19.977 -1.121 1234 HA ASP 166 HA ASP 166 6.357 22.559 -0.815 1235 HB2 ASP 166 HB2 ASP 166 8.480 21.933 0.163 1236 HB3 ASP 166 HB3 ASP 166 9.119 21.957 -1.340 1237 H VAL 167 H VAL 167 5.835 23.997 -2.493 1238 HA VAL 167 HA VAL 167 6.790 23.257 -5.056 1239 HB VAL 167 HB VAL 167 4.525 23.643 -6.059 1240 HG11 VAL 167 HG11 VAL 167 3.466 21.636 -5.292 1241 HG12 VAL 167 HG12 VAL 167 4.473 21.580 -4.028 1242 HG13 VAL 167 HG13 VAL 167 5.044 21.371 -5.527 1243 HG21 VAL 167 HG21 VAL 167 2.626 23.873 -4.630 1244 HG22 VAL 167 HG22 VAL 167 3.638 25.115 -4.410 1245 HG23 VAL 167 HG23 VAL 167 3.594 23.906 -3.336 1246 H ASP 168 H ASP 168 6.606 24.903 -6.791 1247 HA ASP 168 HA ASP 168 6.190 27.611 -5.771 1248 HB2 ASP 168 HB2 ASP 168 8.507 27.261 -6.187 1249 HB3 ASP 168 HB3 ASP 168 8.141 27.022 -7.761 1250 H LEU 169 H LEU 169 4.416 28.457 -6.805 1251 HA LEU 169 HA LEU 169 3.469 27.014 -9.131 1252 HB2 LEU 169 HB2 LEU 169 1.952 28.681 -7.346 1253 HB3 LEU 169 HB3 LEU 169 1.325 27.792 -8.565 1254 HG LEU 169 HG LEU 169 2.495 26.724 -6.163 1255 HD11 LEU 169 HD11 LEU 169 0.228 25.990 -5.650 1256 HD12 LEU 169 HD12 LEU 169 -0.300 26.703 -7.002 1257 HD13 LEU 169 HD13 LEU 169 0.275 27.601 -5.786 1258 HD21 LEU 169 HD21 LEU 169 1.850 24.543 -6.891 1259 HD22 LEU 169 HD22 LEU 169 2.933 25.187 -7.904 1260 HD23 LEU 169 HD23 LEU 169 1.367 25.156 -8.307 1261 H VAL 170 H VAL 170 3.908 27.962 -11.044 1262 HA VAL 170 HA VAL 170 4.110 30.788 -10.987 1263 HB VAL 170 HB VAL 170 6.167 30.634 -12.417 1264 HG11 VAL 170 HG11 VAL 170 7.695 29.813 -10.723 1265 HG12 VAL 170 HG12 VAL 170 6.457 29.138 -9.932 1266 HG13 VAL 170 HG13 VAL 170 6.568 30.748 -10.039 1267 HG21 VAL 170 HG21 VAL 170 7.202 28.496 -12.794 1268 HG22 VAL 170 HG22 VAL 170 5.737 28.533 -13.478 1269 HG23 VAL 170 HG23 VAL 170 5.954 27.761 -12.074 1270 H ASN 171 H ASN 171 4.287 31.956 -13.085 1271 HA ASN 171 HA ASN 171 2.290 31.162 -14.900 1272 HB2 ASN 171 HB2 ASN 171 3.024 33.466 -14.444 1273 HB3 ASN 171 HB3 ASN 171 4.339 33.148 -15.359 1274 HD21 ASN 171 HD21 ASN 171 2.179 34.914 -17.602 1275 HD22 ASN 171 HD22 ASN 171 3.214 35.220 -16.248 1276 H LYS 172 H LYS 172 2.586 30.454 -17.142 1277 HA LYS 172 HA LYS 172 5.022 28.986 -17.497 1278 HB2 LYS 172 HB2 LYS 172 3.845 28.003 -19.430 1279 HB3 LYS 172 HB3 LYS 172 3.231 27.634 -17.962 1280 HG2 LYS 172 HG2 LYS 172 1.392 28.026 -19.229 1281 HG3 LYS 172 HG3 LYS 172 1.573 29.412 -18.384 1282 HD2 LYS 172 HD2 LYS 172 2.921 29.657 -20.757 1283 HD3 LYS 172 HD3 LYS 172 1.393 29.172 -21.071 1284 HE2 LYS 172 HE2 LYS 172 0.614 31.187 -20.675 1285 HE3 LYS 172 HE3 LYS 172 1.371 31.246 -19.229 1286 HZ1 LYS 172 HZ1 LYS 172 2.158 32.983 -20.634 1287 HZ2 LYS 172 HZ2 LYS 172 2.613 31.896 -21.741 1288 HZ3 LYS 172 HZ3 LYS 172 3.363 31.955 -20.309
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