NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
529120 | 2lk6 | 17997 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 HN ALA 1 1.884 0.000 0.829 2 HA ALA 1 HA ALA 1 2.190 1.036 -1.563 3 HB1 ALA 1 1HB ALA 1 4.223 0.103 -1.341 4 HB2 ALA 1 2HB ALA 1 3.591 -0.804 0.055 5 HB3 ALA 1 3HB ALA 1 3.554 -1.531 -1.569 6 H ASN 2 HN ASN 2 1.145 -2.415 -1.091 7 HA ASN 2 HA ASN 2 -0.108 -3.710 -2.303 8 HB2 ASN 2 2HB ASN 2 -0.780 -1.326 -4.102 9 HB3 ASN 2 3HB ASN 2 -1.708 -2.805 -3.944 10 HD21 ASN 2 1HD2 ASN 2 -3.444 -2.638 -2.770 11 HD22 ASN 2 2HD2 ASN 2 -3.702 -1.604 -1.405 12 H GLU 3 HN GLU 3 0.582 -5.179 -3.903 13 HA GLU 3 HA GLU 3 2.908 -4.871 -5.200 14 HB2 GLU 3 2HB GLU 3 0.477 -6.524 -5.996 15 HB3 GLU 3 3HB GLU 3 2.041 -6.703 -6.765 16 HG2 GLU 3 2HG GLU 3 3.073 -7.203 -4.534 17 HG3 GLU 3 3HG GLU 3 1.501 -7.041 -3.776 18 H GLY 4 HN GLY 4 3.252 -4.903 -7.716 19 HA2 GLY 4 1HA GLY 4 3.118 -3.850 -9.699 20 HA3 GLY 4 2HA GLY 4 1.411 -3.587 -9.399 21 H ASP 5 HN ASP 5 4.287 -2.451 -7.504 22 HA ASP 5 HA ASP 5 3.523 0.253 -8.259 23 HB2 ASP 5 2HB ASP 5 3.692 -0.985 -5.558 24 HB3 ASP 5 3HB ASP 5 4.546 0.540 -5.693 25 H VAL 6 HN VAL 6 5.445 1.830 -7.580 26 HA VAL 6 HA VAL 6 8.005 0.414 -7.695 27 HB VAL 6 HB VAL 6 6.862 2.375 -9.624 28 HG11 VAL 6 1HG1 VAL 6 8.751 3.605 -8.612 29 HG12 VAL 6 2HG1 VAL 6 9.831 2.243 -8.995 30 HG13 VAL 6 3HG1 VAL 6 9.066 3.169 -10.309 31 HG21 VAL 6 3HG2 VAL 6 7.308 0.750 -11.093 32 HG22 VAL 6 1HG2 VAL 6 8.998 0.629 -10.548 33 HG23 VAL 6 2HG2 VAL 6 7.724 -0.286 -9.707 34 H TYR 7 HN TYR 7 9.733 1.500 -6.637 35 HA TYR 7 HA TYR 7 8.924 3.921 -5.180 36 HB2 TYR 7 2HB TYR 7 10.080 1.230 -4.345 37 HB3 TYR 7 3HB TYR 7 10.629 2.640 -3.461 38 HD1 TYR 7 HD1 TYR 7 8.918 4.081 -2.254 39 HD2 TYR 7 HD2 TYR 7 7.957 0.252 -3.904 40 HE1 TYR 7 HE1 TYR 7 6.845 3.960 -0.786 41 HE2 TYR 7 HE2 TYR 7 5.887 0.145 -2.431 42 HH TYR 7 HH TYR 7 5.393 2.336 0.144 43 H LYS 8 HN LYS 8 10.274 5.587 -5.615 44 HA LYS 8 HA LYS 8 13.006 4.881 -6.433 45 HB2 LYS 8 2HB LYS 8 11.644 5.868 -8.235 46 HB3 LYS 8 3HB LYS 8 11.330 7.276 -7.242 47 HG2 LYS 8 2HG LYS 8 14.212 6.635 -7.419 48 HG3 LYS 8 3HG LYS 8 13.496 6.947 -8.988 49 HD2 LYS 8 2HD LYS 8 12.560 8.886 -6.987 50 HD3 LYS 8 3HD LYS 8 14.309 8.876 -7.091 51 HE2 LYS 8 2HE LYS 8 12.424 9.162 -9.481 52 HE3 LYS 8 3HE LYS 8 13.255 10.492 -8.700 53 HZ1 LYS 8 2HZ LYS 8 14.641 8.187 -9.963 54 HZ3 LYS 8 1HZ LYS 8 15.372 9.491 -9.318 55 H CYS 9 HN CYS 9 14.707 5.722 -5.287 56 HA CYS 9 HA CYS 9 14.032 6.998 -2.819 57 HB2 CYS 9 2HB CYS 9 15.777 5.256 -2.934 58 HB3 CYS 9 3HB CYS 9 16.741 6.275 -3.984 59 H GLU 10 HN GLU 10 14.445 9.181 -2.265 60 HA GLU 10 HA GLU 10 14.955 10.868 -4.557 61 HB2 GLU 10 2HB GLU 10 13.633 11.229 -1.878 62 HB3 GLU 10 3HB GLU 10 14.330 12.647 -2.636 63 HG2 GLU 10 2HG GLU 10 12.763 11.000 -4.528 64 HG3 GLU 10 3HG GLU 10 11.803 11.574 -3.180 65 H LEU 11 HN LEU 11 17.136 9.300 -3.303 66 HA LEU 11 HA LEU 11 18.814 11.575 -2.536 67 HB2 LEU 11 2HB LEU 11 18.068 9.316 -0.902 68 HB3 LEU 11 3HB LEU 11 19.798 9.318 -1.183 69 HG LEU 11 HG LEU 11 18.775 11.967 -0.463 70 HD11 LEU 11 1HD1 LEU 11 17.754 9.702 1.014 71 HD12 LEU 11 2HD1 LEU 11 18.789 10.718 2.047 72 HD13 LEU 11 3HD1 LEU 11 17.400 11.437 1.197 73 HD21 LEU 11 3HD2 LEU 11 20.816 12.188 0.430 74 HD22 LEU 11 1HD2 LEU 11 20.723 10.630 1.286 75 HD23 LEU 11 2HD2 LEU 11 21.187 10.676 -0.432 76 H CYS 12 HN CYS 12 19.045 8.006 -3.209 77 HA CYS 12 HA CYS 12 21.405 8.545 -4.780 78 HB2 CYS 12 2HB CYS 12 21.512 6.064 -4.969 79 HB3 CYS 12 3HB CYS 12 21.599 6.690 -3.334 80 H GLY 13 HN GLY 13 18.030 7.289 -5.101 81 HA2 GLY 13 1HA GLY 13 16.736 7.885 -7.004 82 HA3 GLY 13 2HA GLY 13 18.185 7.860 -7.991 83 H GLN 14 HN GLN 14 17.536 5.376 -5.507 84 HA GLN 14 HA GLN 14 17.731 3.379 -7.518 85 HB2 GLN 14 2HB GLN 14 18.776 2.970 -5.368 86 HB3 GLN 14 3HB GLN 14 17.280 3.276 -4.508 87 HG2 GLN 14 2HG GLN 14 16.362 1.208 -5.065 88 HG3 GLN 14 3HG GLN 14 17.207 1.119 -6.598 89 HE21 GLN 14 1HE2 GLN 14 18.220 1.598 -3.214 90 HE22 GLN 14 2HE2 GLN 14 19.376 0.310 -3.146 91 H VAL 15 HN VAL 15 16.075 2.401 -8.613 92 HA VAL 15 HA VAL 15 13.369 2.906 -7.588 93 HB VAL 15 HB VAL 15 14.187 2.269 -10.423 94 HG11 VAL 15 1HG1 VAL 15 11.896 1.814 -10.174 95 HG12 VAL 15 2HG1 VAL 15 11.639 3.208 -9.098 96 HG13 VAL 15 3HG1 VAL 15 11.940 3.466 -10.833 97 HG21 VAL 15 3HG2 VAL 15 14.539 4.738 -8.934 98 HG22 VAL 15 1HG2 VAL 15 15.059 4.319 -10.584 99 HG23 VAL 15 2HG2 VAL 15 13.424 4.965 -10.303 100 H VAL 16 HN VAL 16 12.175 1.181 -6.935 101 HA VAL 16 HA VAL 16 12.988 -1.451 -7.927 102 HB VAL 16 HB VAL 16 13.092 -2.390 -5.815 103 HG11 VAL 16 1HG1 VAL 16 15.042 -0.965 -6.262 104 HG12 VAL 16 2HG1 VAL 16 14.233 0.403 -5.462 105 HG13 VAL 16 3HG1 VAL 16 14.682 -1.039 -4.520 106 HG21 VAL 16 3HG2 VAL 16 12.288 -1.380 -3.753 107 HG22 VAL 16 1HG2 VAL 16 11.851 0.112 -4.620 108 HG23 VAL 16 2HG2 VAL 16 10.983 -1.404 -4.962 109 H LYS 17 HN LYS 17 11.279 -2.782 -8.460 110 HA LYS 17 HA LYS 17 8.648 -1.554 -8.175 111 HB2 LYS 17 2HB LYS 17 9.324 -2.115 -10.435 112 HB3 LYS 17 3HB LYS 17 9.681 -3.766 -9.971 113 HG2 LYS 17 2HG LYS 17 6.914 -2.694 -9.408 114 HG3 LYS 17 3HG LYS 17 7.322 -3.103 -11.062 115 HD2 LYS 17 2HD LYS 17 8.110 -5.389 -10.193 116 HD3 LYS 17 3HD LYS 17 7.421 -4.957 -8.641 117 HE2 LYS 17 2HE LYS 17 5.202 -4.520 -9.876 118 HE3 LYS 17 3HE LYS 17 5.937 -5.247 -11.291 119 HZ1 LYS 17 2HZ LYS 17 5.472 -7.249 -10.423 120 HZ3 LYS 17 1HZ LYS 17 4.801 -6.574 -9.102 121 H VAL 18 HN VAL 18 7.418 -2.147 -6.480 122 HA VAL 18 HA VAL 18 8.097 -4.285 -4.813 123 HB VAL 18 HB VAL 18 5.493 -2.779 -5.136 124 HG11 VAL 18 1HG1 VAL 18 4.947 -4.672 -3.860 125 HG12 VAL 18 2HG1 VAL 18 6.509 -4.666 -3.007 126 HG13 VAL 18 3HG1 VAL 18 5.292 -3.419 -2.644 127 HG21 VAL 18 3HG2 VAL 18 8.045 -1.884 -4.281 128 HG22 VAL 18 1HG2 VAL 18 6.490 -1.023 -4.192 129 HG23 VAL 18 2HG2 VAL 18 7.031 -2.025 -2.825 130 H LEU 19 HN LEU 19 7.776 -6.441 -5.006 131 HA LEU 19 HA LEU 19 5.974 -7.304 -7.142 132 HB2 LEU 19 2HB LEU 19 7.234 -9.261 -7.295 133 HB3 LEU 19 3HB LEU 19 8.394 -7.955 -7.152 134 HG LEU 19 HG LEU 19 7.980 -8.794 -4.515 135 HD11 LEU 19 1HD1 LEU 19 7.154 -10.866 -4.629 136 HD12 LEU 19 2HD1 LEU 19 7.481 -11.004 -6.374 137 HD13 LEU 19 3HD1 LEU 19 8.774 -11.336 -5.196 138 HD21 LEU 19 3HD2 LEU 19 10.128 -8.805 -6.524 139 HD22 LEU 19 1HD2 LEU 19 10.144 -8.297 -4.818 140 HD23 LEU 19 2HD2 LEU 19 10.315 -10.019 -5.236 141 H GLU 20 HN GLU 20 6.603 -7.439 -3.638 142 HA GLU 20 HA GLU 20 3.973 -8.630 -3.374 143 HB2 GLU 20 2HB GLU 20 6.562 -9.777 -2.413 144 HB3 GLU 20 3HB GLU 20 5.233 -9.831 -1.272 145 HG2 GLU 20 2HG GLU 20 3.798 -10.892 -3.080 146 HG3 GLU 20 3HG GLU 20 5.210 -10.943 -4.117 147 H GLU 21 HN GLU 21 3.050 -6.684 -2.657 148 HA GLU 21 HA GLU 21 4.150 -4.779 -1.153 149 HB2 GLU 21 2HB GLU 21 1.905 -4.116 -0.524 150 HB3 GLU 21 3HB GLU 21 1.836 -4.782 -2.144 151 HG2 GLU 21 2HG GLU 21 1.484 -6.874 -0.105 152 HG3 GLU 21 3HG GLU 21 0.297 -5.598 0.077 153 H GLY 22 HN GLY 22 3.721 -4.190 1.235 154 HA2 GLY 22 1HA GLY 22 3.351 -6.365 3.077 155 HA3 GLY 22 2HA GLY 22 5.025 -5.862 2.943 156 H GLY 23 HN GLY 23 3.561 -5.585 5.361 157 HA2 GLY 23 1HA GLY 23 2.606 -2.859 5.555 158 HA3 GLY 23 2HA GLY 23 2.699 -4.059 6.828 159 H GLY 24 HN GLY 24 5.019 -2.342 4.603 160 HA2 GLY 24 1HA GLY 24 6.439 -1.250 6.878 161 HA3 GLY 24 2HA GLY 24 7.315 -2.488 5.999 162 H THR 25 HN THR 25 8.599 -0.182 5.906 163 HA THR 25 HA THR 25 7.933 0.912 3.256 164 HB THR 25 HB THR 25 8.680 2.329 5.855 165 HG1 THR 25 HG1 THR 25 6.409 1.863 5.116 166 HG21 THR 25 3HG2 THR 25 8.697 4.426 4.441 167 HG22 THR 25 1HG2 THR 25 10.081 3.361 4.095 168 HG23 THR 25 2HG2 THR 25 8.691 3.402 2.985 169 H LEU 26 HN LEU 26 9.814 1.860 2.108 170 HA LEU 26 HA LEU 26 12.182 0.254 2.745 171 HB2 LEU 26 2HB LEU 26 11.644 1.570 0.103 172 HB3 LEU 26 3HB LEU 26 12.694 0.216 0.472 173 HG LEU 26 HG LEU 26 9.715 -0.034 0.830 174 HD11 LEU 26 1HD1 LEU 26 9.331 0.260 -1.335 175 HD12 LEU 26 2HD1 LEU 26 11.067 0.461 -1.672 176 HD13 LEU 26 3HD1 LEU 26 10.346 -1.166 -1.661 177 HD21 LEU 26 3HD2 LEU 26 10.134 -2.187 1.214 178 HD22 LEU 26 1HD2 LEU 26 11.198 -2.317 -0.207 179 HD23 LEU 26 2HD2 LEU 26 11.849 -1.731 1.342 180 H VAL 27 HN VAL 27 12.861 1.769 4.418 181 HA VAL 27 HA VAL 27 13.336 4.487 3.698 182 HB VAL 27 HB VAL 27 14.188 2.786 6.047 183 HG11 VAL 27 1HG1 VAL 27 15.042 4.667 7.125 184 HG12 VAL 27 2HG1 VAL 27 15.612 4.883 5.453 185 HG13 VAL 27 3HG1 VAL 27 14.203 5.799 6.038 186 HG21 VAL 27 3HG2 VAL 27 11.693 3.314 5.587 187 HG22 VAL 27 1HG2 VAL 27 12.345 3.630 7.213 188 HG23 VAL 27 2HG2 VAL 27 12.112 4.975 6.071 189 H CYS 28 HN CYS 28 14.823 4.954 2.146 190 HA CYS 28 HA CYS 28 17.383 3.543 2.374 191 HB2 CYS 28 2HB CYS 28 16.043 2.971 0.338 192 HB3 CYS 28 3HB CYS 28 16.160 4.646 -0.162 193 H CYS 29 HN CYS 29 19.225 4.873 2.479 194 HA CYS 29 HA CYS 29 20.422 6.690 2.750 195 HB2 CYS 29 2HB CYS 29 18.417 7.816 0.800 196 HB3 CYS 29 3HB CYS 29 19.732 8.781 1.440 197 H GLY 30 HN GLY 30 18.172 5.976 4.570 198 HA2 GLY 30 1HA GLY 30 17.244 6.804 6.444 199 HA3 GLY 30 2HA GLY 30 18.208 8.252 6.237 200 H GLU 31 HN GLU 31 16.061 7.169 3.625 201 HA GLU 31 HA GLU 31 14.042 9.045 4.499 202 HB2 GLU 31 2HB GLU 31 15.913 9.957 2.760 203 HB3 GLU 31 3HB GLU 31 14.820 9.217 1.608 204 HG2 GLU 31 2HG GLU 31 13.092 10.592 3.347 205 HG3 GLU 31 3HG GLU 31 14.469 11.669 3.211 206 H ASP 32 HN ASP 32 12.036 8.144 4.253 207 HA ASP 32 HA ASP 32 11.754 5.593 3.288 208 HB2 ASP 32 2HB ASP 32 9.303 6.049 3.404 209 HB3 ASP 32 3HB ASP 32 10.146 6.616 4.832 210 H MET 33 HN MET 33 11.982 4.965 1.135 211 HA MET 33 HA MET 33 12.165 6.577 -0.992 212 HB2 MET 33 2HB MET 33 12.231 3.870 -0.557 213 HB3 MET 33 3HB MET 33 10.699 3.969 -1.402 214 HG2 MET 33 2HG MET 33 11.745 4.254 -3.402 215 HG3 MET 33 3HG MET 33 12.665 5.613 -2.788 216 HE1 MET 33 3HE MET 33 13.987 1.332 -3.374 217 HE2 MET 33 1HE MET 33 12.619 1.554 -2.257 218 HE3 MET 33 2HE MET 33 12.514 2.166 -3.925 219 H VAL 34 HN VAL 34 10.768 7.279 -2.729 220 HA VAL 34 HA VAL 34 8.013 7.623 -1.824 221 HB VAL 34 HB VAL 34 7.938 9.529 -3.132 222 HG11 VAL 34 1HG1 VAL 34 10.047 10.789 -2.668 223 HG12 VAL 34 2HG1 VAL 34 9.413 9.906 -1.258 224 HG13 VAL 34 3HG1 VAL 34 10.803 9.259 -2.163 225 HG21 VAL 34 3HG2 VAL 34 10.251 9.719 -4.695 226 HG22 VAL 34 1HG2 VAL 34 9.705 8.037 -4.897 227 HG23 VAL 34 2HG2 VAL 34 8.598 9.382 -5.262 228 H LYS 35 HN LYS 35 6.273 7.471 -3.532 229 HA LYS 35 HA LYS 35 6.740 5.040 -5.047 230 HB2 LYS 35 2HB LYS 35 4.648 5.885 -3.494 231 HB3 LYS 35 3HB LYS 35 4.067 6.297 -5.094 232 HG2 LYS 35 2HG LYS 35 3.374 4.089 -5.037 233 HG3 LYS 35 3HG LYS 35 4.983 3.838 -5.686 234 HD2 LYS 35 2HD LYS 35 5.499 2.553 -3.894 235 HD3 LYS 35 3HD LYS 35 5.284 3.939 -2.844 236 HE2 LYS 35 2HE LYS 35 2.854 2.395 -3.800 237 HE3 LYS 35 3HE LYS 35 3.812 1.767 -2.473 238 HZ1 LYS 35 2HZ LYS 35 1.876 3.416 -1.984 239 HZ3 LYS 35 1HZ LYS 35 2.944 4.579 -2.380 240 H GLN 36 HN GLN 36 6.317 4.859 -7.321 241 HA GLN 36 HA GLN 36 6.442 7.458 -8.644 242 HB2 GLN 36 2HB GLN 36 7.621 4.849 -9.685 243 HB3 GLN 36 3HB GLN 36 7.834 6.446 -10.373 244 HG2 GLN 36 2HG GLN 36 8.674 5.849 -7.511 245 HG3 GLN 36 3HG GLN 36 9.738 5.490 -8.857 246 HE21 GLN 36 1HE2 GLN 36 8.145 7.958 -6.998 247 HE22 GLN 36 2HE2 GLN 36 9.027 9.329 -7.584 248 H1 ALA 1 HN ALA 1 21.254 -0.642 -4.493 249 HA ALA 1 HA ALA 1 23.208 -2.001 -4.375 250 HB1 ALA 1 1HB ALA 1 22.035 -4.305 -4.174 251 HB2 ALA 1 2HB ALA 1 21.449 -2.980 -3.140 252 HB3 ALA 1 3HB ALA 1 20.547 -3.429 -4.608 253 H ASN 2 HN ASN 2 20.993 -3.472 -6.862 254 HA ASN 2 HA ASN 2 22.917 -3.316 -8.867 255 HB2 ASN 2 2HB ASN 2 22.832 -5.835 -7.211 256 HB3 ASN 2 3HB ASN 2 22.959 -6.043 -8.947 257 HD21 ASN 2 1HD2 ASN 2 24.721 -6.029 -6.300 258 HD22 ASN 2 2HD2 ASN 2 26.225 -5.358 -6.838 259 H GLU 3 HN GLU 3 21.445 -3.039 -10.551 260 HA GLU 3 HA GLU 3 18.836 -3.541 -10.505 261 HB2 GLU 3 2HB GLU 3 20.744 -3.689 -12.874 262 HB3 GLU 3 3HB GLU 3 19.002 -3.691 -13.061 263 HG2 GLU 3 2HG GLU 3 18.906 -1.513 -11.769 264 HG3 GLU 3 3HG GLU 3 20.658 -1.501 -11.723 265 H GLY 4 HN GLY 4 17.398 -5.209 -11.400 266 HA2 GLY 4 1HA GLY 4 16.732 -7.323 -11.797 267 HA3 GLY 4 2HA GLY 4 18.374 -7.728 -12.255 268 H ASP 5 HN ASP 5 17.480 -6.318 -9.081 269 HA ASP 5 HA ASP 5 18.283 -8.864 -7.911 270 HB2 ASP 5 2HB ASP 5 18.805 -6.003 -7.219 271 HB3 ASP 5 3HB ASP 5 18.458 -7.041 -5.851 272 H VAL 6 HN VAL 6 17.226 -9.138 -5.584 273 HA VAL 6 HA VAL 6 14.569 -7.920 -5.504 274 HB VAL 6 HB VAL 6 15.275 -10.817 -5.703 275 HG11 VAL 6 1HG1 VAL 6 12.950 -11.309 -4.760 276 HG12 VAL 6 2HG1 VAL 6 14.219 -10.884 -3.587 277 HG13 VAL 6 3HG1 VAL 6 13.005 -9.673 -4.062 278 HG21 VAL 6 3HG2 VAL 6 13.038 -10.764 -6.956 279 HG22 VAL 6 1HG2 VAL 6 13.150 -8.992 -6.842 280 HG23 VAL 6 2HG2 VAL 6 14.410 -9.910 -7.701 281 H TYR 7 HN TYR 7 13.959 -7.294 -3.462 282 HA TYR 7 HA TYR 7 15.703 -8.211 -1.275 283 HB2 TYR 7 2HB TYR 7 14.659 -5.534 -2.254 284 HB3 TYR 7 3HB TYR 7 14.738 -5.737 -0.515 285 HD1 TYR 7 HD1 TYR 7 16.980 -6.292 0.556 286 HD2 TYR 7 HD2 TYR 7 16.611 -5.068 -3.527 287 HE1 TYR 7 HE1 TYR 7 19.449 -5.688 0.507 288 HE2 TYR 7 HE2 TYR 7 19.081 -4.468 -3.563 289 HH TYR 7 HH TYR 7 21.210 -5.509 -1.889 290 H LYS 8 HN LYS 8 14.641 -9.280 0.314 291 HA LYS 8 HA LYS 8 11.761 -8.746 0.551 292 HB2 LYS 8 2HB LYS 8 12.083 -10.958 -0.321 293 HB3 LYS 8 3HB LYS 8 13.309 -11.327 0.875 294 HG2 LYS 8 2HG LYS 8 10.693 -10.434 2.001 295 HG3 LYS 8 3HG LYS 8 10.640 -11.960 1.142 296 HD2 LYS 8 2HD LYS 8 12.874 -11.505 3.126 297 HD3 LYS 8 3HD LYS 8 11.272 -11.857 3.742 298 HE2 LYS 8 2HE LYS 8 11.839 -14.051 3.460 299 HE3 LYS 8 3HE LYS 8 11.513 -13.776 1.760 300 HZ1 LYS 8 2HZ LYS 8 14.117 -13.872 3.115 301 HZ3 LYS 8 1HZ LYS 8 13.989 -12.958 1.774 302 H CYS 9 HN CYS 9 10.953 -8.211 2.557 303 HA CYS 9 HA CYS 9 12.919 -7.487 4.504 304 HB2 CYS 9 2HB CYS 9 10.986 -6.026 4.003 305 HB3 CYS 9 3HB CYS 9 9.892 -7.259 4.597 306 H GLU 10 HN GLU 10 13.193 -8.463 6.576 307 HA GLU 10 HA GLU 10 12.060 -11.128 6.714 308 HB2 GLU 10 2HB GLU 10 14.541 -9.808 7.768 309 HB3 GLU 10 3HB GLU 10 13.868 -11.108 8.731 310 HG2 GLU 10 2HG GLU 10 14.105 -11.591 5.772 311 HG3 GLU 10 3HG GLU 10 15.597 -11.549 6.689 312 H LEU 11 HN LEU 11 10.473 -8.688 7.317 313 HA LEU 11 HA LEU 11 9.860 -9.344 10.107 314 HB2 LEU 11 2HB LEU 11 10.611 -6.749 8.946 315 HB3 LEU 11 3HB LEU 11 9.144 -6.714 9.904 316 HG LEU 11 HG LEU 11 11.172 -8.192 11.324 317 HD11 LEU 11 1HD1 LEU 11 12.662 -6.772 9.837 318 HD12 LEU 11 2HD1 LEU 11 12.018 -5.358 10.705 319 HD13 LEU 11 3HD1 LEU 11 12.909 -6.618 11.593 320 HD21 LEU 11 3HD2 LEU 11 10.339 -5.498 12.243 321 HD22 LEU 11 1HD2 LEU 11 9.038 -6.681 11.966 322 HD23 LEU 11 2HD2 LEU 11 10.357 -7.058 13.100 323 H CYS 12 HN CYS 12 8.594 -7.354 7.336 324 HA CYS 12 HA CYS 12 5.946 -8.308 7.975 325 HB2 CYS 12 2HB CYS 12 5.247 -6.743 6.164 326 HB3 CYS 12 3HB CYS 12 6.061 -5.996 7.524 327 H GLY 13 HN GLY 13 8.361 -8.339 5.267 328 HA2 GLY 13 1HA GLY 13 8.710 -10.431 4.122 329 HA3 GLY 13 2HA GLY 13 6.985 -10.730 4.203 330 H GLN 14 HN GLN 14 8.299 -7.479 3.540 331 HA GLN 14 HA GLN 14 6.845 -7.434 1.102 332 HB2 GLN 14 2HB GLN 14 6.902 -5.435 2.488 333 HB3 GLN 14 3HB GLN 14 8.655 -5.406 2.478 334 HG2 GLN 14 2HG GLN 14 8.778 -4.636 0.267 335 HG3 GLN 14 3HG GLN 14 7.244 -5.353 -0.186 336 HE21 GLN 14 1HE2 GLN 14 8.388 -3.105 2.336 337 HE22 GLN 14 2HE2 GLN 14 7.209 -1.863 2.072 338 H VAL 15 HN VAL 15 7.593 -7.994 -0.899 339 HA VAL 15 HA VAL 15 10.511 -8.166 -1.200 340 HB VAL 15 HB VAL 15 8.478 -9.696 -2.808 341 HG11 VAL 15 1HG1 VAL 15 11.009 -9.408 -3.400 342 HG12 VAL 15 2HG1 VAL 15 11.261 -10.598 -2.100 343 HG13 VAL 15 3HG1 VAL 15 10.255 -11.017 -3.507 344 HG21 VAL 15 3HG2 VAL 15 8.175 -10.092 -0.319 345 HG22 VAL 15 1HG2 VAL 15 8.555 -11.531 -1.294 346 HG23 VAL 15 2HG2 VAL 15 9.824 -10.762 -0.311 347 H VAL 16 HN VAL 16 11.450 -6.868 -2.706 348 HA VAL 16 HA VAL 16 9.704 -5.767 -4.784 349 HB VAL 16 HB VAL 16 10.477 -3.573 -4.433 350 HG11 VAL 16 1HG1 VAL 16 10.044 -3.295 -1.844 351 HG12 VAL 16 2HG1 VAL 16 8.737 -3.807 -2.938 352 HG13 VAL 16 3HG1 VAL 16 9.596 -5.015 -1.953 353 HG21 VAL 16 3HG2 VAL 16 12.695 -3.480 -3.951 354 HG22 VAL 16 1HG2 VAL 16 12.089 -3.313 -2.285 355 HG23 VAL 16 2HG2 VAL 16 12.637 -4.899 -2.878 356 H LYS 17 HN LYS 17 10.642 -5.689 -6.810 357 HA LYS 17 HA LYS 17 13.331 -6.821 -6.943 358 HB2 LYS 17 2HB LYS 17 11.641 -8.069 -8.135 359 HB3 LYS 17 3HB LYS 17 11.094 -6.633 -8.978 360 HG2 LYS 17 2HG LYS 17 14.004 -7.429 -9.203 361 HG3 LYS 17 3HG LYS 17 12.814 -8.322 -10.128 362 HD2 LYS 17 2HD LYS 17 11.950 -5.990 -10.926 363 HD3 LYS 17 3HD LYS 17 13.449 -5.351 -10.281 364 HE2 LYS 17 2HE LYS 17 14.403 -5.887 -12.275 365 HE3 LYS 17 3HE LYS 17 14.308 -7.563 -11.773 366 HZ1 LYS 17 2HZ LYS 17 11.783 -6.879 -12.729 367 HZ3 LYS 17 1HZ LYS 17 12.860 -7.869 -13.444 368 H VAL 18 HN VAL 18 14.969 -5.388 -7.065 369 HA VAL 18 HA VAL 18 14.510 -2.685 -7.755 370 HB VAL 18 HB VAL 18 17.033 -4.317 -7.412 371 HG11 VAL 18 1HG1 VAL 18 16.839 -1.843 -8.650 372 HG12 VAL 18 2HG1 VAL 18 17.241 -1.430 -6.966 373 HG13 VAL 18 3HG1 VAL 18 18.296 -2.526 -7.889 374 HG21 VAL 18 3HG2 VAL 18 16.926 -2.668 -5.267 375 HG22 VAL 18 1HG2 VAL 18 15.187 -2.915 -5.557 376 HG23 VAL 18 2HG2 VAL 18 16.251 -4.316 -5.283 377 H LEU 19 HN LEU 19 14.463 -1.714 -9.721 378 HA LEU 19 HA LEU 19 15.449 -3.318 -11.977 379 HB2 LEU 19 2HB LEU 19 13.793 -2.137 -13.340 380 HB3 LEU 19 3HB LEU 19 13.078 -3.119 -12.077 381 HG LEU 19 HG LEU 19 11.999 -0.879 -12.482 382 HD11 LEU 19 1HD1 LEU 19 11.164 -1.085 -10.434 383 HD12 LEU 19 2HD1 LEU 19 12.430 -2.293 -10.109 384 HD13 LEU 19 3HD1 LEU 19 12.700 -0.585 -9.685 385 HD21 LEU 19 3HD2 LEU 19 14.266 0.347 -10.932 386 HD22 LEU 19 1HD2 LEU 19 14.319 0.251 -12.709 387 HD23 LEU 19 2HD2 LEU 19 12.999 1.133 -11.904 388 H GLU 20 HN GLU 20 16.050 -0.645 -9.977 389 HA GLU 20 HA GLU 20 17.948 0.316 -11.907 390 HB2 GLU 20 2HB GLU 20 15.687 1.645 -12.068 391 HB3 GLU 20 3HB GLU 20 16.179 2.370 -10.550 392 HG2 GLU 20 2HG GLU 20 17.871 3.594 -11.522 393 HG3 GLU 20 3HG GLU 20 18.316 2.306 -12.624 394 H GLU 21 HN GLU 21 19.743 -0.149 -10.665 395 HA GLU 21 HA GLU 21 19.734 -0.027 -7.895 396 HB2 GLU 21 2HB GLU 21 22.125 -0.420 -8.056 397 HB3 GLU 21 3HB GLU 21 21.332 -1.350 -9.311 398 HG2 GLU 21 2HG GLU 21 21.825 0.517 -10.949 399 HG3 GLU 21 3HG GLU 21 22.707 1.352 -9.685 400 H GLY 22 HN GLY 22 21.032 1.450 -6.478 401 HA2 GLY 22 1HA GLY 22 21.316 4.159 -7.619 402 HA3 GLY 22 2HA GLY 22 20.408 3.890 -6.144 403 H GLY 23 HN GLY 23 21.481 3.723 -4.180 404 HA2 GLY 23 1HA GLY 23 24.141 2.834 -3.895 405 HA3 GLY 23 2HA GLY 23 24.130 4.584 -3.983 406 H GLY 24 HN GLY 24 21.698 2.283 -2.578 407 HA2 GLY 24 1HA GLY 24 22.397 3.102 0.120 408 HA3 GLY 24 2HA GLY 24 20.842 3.664 -0.458 409 H THR 25 HN THR 25 20.108 2.247 1.434 410 HA THR 25 HA THR 25 19.725 -0.498 0.442 411 HB THR 25 HB THR 25 20.486 0.522 3.218 412 HG1 THR 25 HG1 THR 25 22.045 -1.317 2.712 413 HG21 THR 25 3HG2 THR 25 19.430 -2.224 2.364 414 HG22 THR 25 1HG2 THR 25 20.290 -1.917 3.892 415 HG23 THR 25 2HG2 THR 25 18.711 -1.151 3.589 416 H LEU 26 HN LEU 26 17.790 -1.578 1.541 417 HA LEU 26 HA LEU 26 15.663 0.441 1.666 418 HB2 LEU 26 2HB LEU 26 15.189 -2.454 1.071 419 HB3 LEU 26 3HB LEU 26 14.213 -1.057 0.662 420 HG LEU 26 HG LEU 26 16.938 -1.428 -0.568 421 HD11 LEU 26 1HD1 LEU 26 14.373 -2.607 -1.669 422 HD12 LEU 26 2HD1 LEU 26 15.991 -2.670 -2.406 423 HD13 LEU 26 3HD1 LEU 26 15.672 -3.537 -0.885 424 HD21 LEU 26 3HD2 LEU 26 14.438 -0.109 -1.655 425 HD22 LEU 26 1HD2 LEU 26 15.722 0.747 -0.767 426 HD23 LEU 26 2HD2 LEU 26 16.087 -0.039 -2.322 427 H VAL 27 HN VAL 27 16.201 0.825 3.948 428 HA VAL 27 HA VAL 27 16.023 -1.337 5.787 429 HB VAL 27 HB VAL 27 15.929 1.665 6.143 430 HG11 VAL 27 1HG1 VAL 27 16.409 1.286 8.488 431 HG12 VAL 27 2HG1 VAL 27 14.917 0.421 8.047 432 HG13 VAL 27 3HG1 VAL 27 16.443 -0.475 8.234 433 HG21 VAL 27 3HG2 VAL 27 18.015 0.940 5.134 434 HG22 VAL 27 1HG2 VAL 27 18.300 1.393 6.832 435 HG23 VAL 27 2HG2 VAL 27 18.212 -0.324 6.371 436 H CYS 28 HN CYS 28 14.140 -2.454 5.993 437 HA CYS 28 HA CYS 28 11.709 -0.828 6.187 438 HB2 CYS 28 2HB CYS 28 11.918 -2.340 4.162 439 HB3 CYS 28 3HB CYS 28 11.832 -3.700 5.264 440 H CYS 29 HN CYS 29 10.429 -1.178 8.035 441 HA CYS 29 HA CYS 29 9.908 -1.836 10.061 442 HB2 CYS 29 2HB CYS 29 11.002 -4.458 9.051 443 HB3 CYS 29 3HB CYS 29 10.341 -4.284 10.664 444 H GLY 30 HN GLY 30 12.470 -0.500 9.518 445 HA2 GLY 30 1HA GLY 30 14.312 0.128 10.642 446 HA3 GLY 30 2HA GLY 30 13.690 -0.731 12.038 447 H GLU 31 HN GLU 31 14.095 -2.525 9.022 448 HA GLU 31 HA GLU 31 16.659 -3.506 9.955 449 HB2 GLU 31 2HB GLU 31 14.691 -4.984 10.750 450 HB3 GLU 31 3HB GLU 31 14.462 -5.413 9.067 451 HG2 GLU 31 2HG GLU 31 16.795 -6.256 8.936 452 HG3 GLU 31 3HG GLU 31 17.086 -5.765 10.593 453 H ASP 32 HN ASP 32 18.118 -3.617 8.291 454 HA ASP 32 HA ASP 32 17.460 -2.712 5.796 455 HB2 ASP 32 2HB ASP 32 19.749 -4.646 6.328 456 HB3 ASP 32 3HB ASP 32 19.701 -3.345 5.155 457 H MET 33 HN MET 33 16.255 -3.740 4.195 458 HA MET 33 HA MET 33 15.301 -6.264 4.380 459 HB2 MET 33 2HB MET 33 14.836 -4.212 2.726 460 HB3 MET 33 3HB MET 33 15.965 -5.040 1.672 461 HG2 MET 33 2HG MET 33 14.549 -6.900 1.375 462 HG3 MET 33 3HG MET 33 13.717 -6.647 2.897 463 HE1 MET 33 3HE MET 33 13.122 -3.116 2.285 464 HE2 MET 33 1HE MET 33 11.442 -3.699 2.344 465 HE3 MET 33 2HE MET 33 12.668 -4.411 3.419 466 H VAL 34 HN VAL 34 15.791 -8.304 3.333 467 HA VAL 34 HA VAL 34 18.660 -8.627 2.926 468 HB VAL 34 HB VAL 34 18.373 -10.841 3.513 469 HG11 VAL 34 1HG1 VAL 34 17.099 -10.871 5.567 470 HG12 VAL 34 2HG1 VAL 34 17.859 -9.272 5.386 471 HG13 VAL 34 3HG1 VAL 34 16.126 -9.479 5.035 472 HG21 VAL 34 3HG2 VAL 34 15.666 -11.488 3.669 473 HG22 VAL 34 1HG2 VAL 34 15.807 -10.566 2.153 474 HG23 VAL 34 2HG2 VAL 34 16.814 -12.010 2.413 475 H LYS 35 HN LYS 35 19.365 -10.122 1.124 476 HA LYS 35 HA LYS 35 17.828 -9.425 -1.258 477 HB2 LYS 35 2HB LYS 35 20.410 -8.989 -0.799 478 HB3 LYS 35 3HB LYS 35 20.562 -10.641 -1.364 479 HG2 LYS 35 2HG LYS 35 18.781 -8.877 -3.000 480 HG3 LYS 35 3HG LYS 35 20.484 -8.466 -3.029 481 HD2 LYS 35 2HD LYS 35 21.113 -10.527 -3.993 482 HD3 LYS 35 3HD LYS 35 19.689 -11.360 -3.402 483 HE2 LYS 35 2HE LYS 35 18.366 -10.659 -5.169 484 HE3 LYS 35 3HE LYS 35 19.150 -9.096 -5.282 485 HZ1 LYS 35 2HZ LYS 35 20.853 -11.335 -5.982 486 HZ3 LYS 35 1HZ LYS 35 20.668 -9.908 -6.745 487 H GLN 36 HN GLN 36 17.306 -11.031 -2.861 488 HA GLN 36 HA GLN 36 17.207 -13.696 -1.678 489 HB2 GLN 36 2HB GLN 36 15.309 -12.545 -3.766 490 HB3 GLN 36 3HB GLN 36 15.140 -14.075 -2.929 491 HG2 GLN 36 2HG GLN 36 15.270 -11.435 -1.415 492 HG3 GLN 36 3HG GLN 36 13.757 -12.061 -2.039 493 HE21 GLN 36 1HE2 GLN 36 16.381 -12.522 0.206 494 HE22 GLN 36 2HE2 GLN 36 15.638 -13.711 1.223 Start of MODEL 2 1 H1 ALA 1 HN ALA 1 4.130 -2.505 -1.214 2 HA ALA 1 HA ALA 1 1.894 -0.955 -0.108 3 HB1 ALA 1 1HB ALA 1 4.532 -0.246 -0.421 4 HB2 ALA 1 2HB ALA 1 3.818 0.361 -1.934 5 HB3 ALA 1 3HB ALA 1 3.174 0.903 -0.366 6 H ASN 2 HN ASN 2 0.415 -2.394 -1.360 7 HA ASN 2 HA ASN 2 -0.837 -2.853 -3.069 8 HB2 ASN 2 2HB ASN 2 -0.107 -0.005 -3.435 9 HB3 ASN 2 3HB ASN 2 -0.546 -0.770 -4.949 10 HD21 ASN 2 1HD2 ASN 2 -1.966 1.276 -3.565 11 HD22 ASN 2 2HD2 ASN 2 -3.538 0.678 -3.152 12 H GLU 3 HN GLU 3 0.249 -4.650 -4.033 13 HA GLU 3 HA GLU 3 2.595 -4.747 -5.252 14 HB2 GLU 3 2HB GLU 3 0.033 -6.143 -6.139 15 HB3 GLU 3 3HB GLU 3 1.636 -6.617 -6.665 16 HG2 GLU 3 2HG GLU 3 2.308 -7.021 -4.299 17 HG3 GLU 3 3HG GLU 3 0.727 -6.507 -3.750 18 H GLY 4 HN GLY 4 3.242 -4.866 -7.617 19 HA2 GLY 4 1HA GLY 4 3.401 -3.969 -9.673 20 HA3 GLY 4 2HA GLY 4 1.676 -3.666 -9.631 21 H ASP 5 HN ASP 5 4.171 -2.408 -7.342 22 HA ASP 5 HA ASP 5 3.493 0.247 -8.342 23 HB2 ASP 5 2HB ASP 5 3.574 -0.897 -5.623 24 HB3 ASP 5 3HB ASP 5 4.552 0.552 -5.749 25 H VAL 6 HN VAL 6 5.383 1.886 -7.689 26 HA VAL 6 HA VAL 6 7.967 0.505 -7.833 27 HB VAL 6 HB VAL 6 6.796 2.560 -9.658 28 HG11 VAL 6 1HG1 VAL 6 8.723 3.724 -8.718 29 HG12 VAL 6 2HG1 VAL 6 9.761 2.316 -9.045 30 HG13 VAL 6 3HG1 VAL 6 9.056 3.236 -10.397 31 HG21 VAL 6 3HG2 VAL 6 7.066 0.932 -11.156 32 HG22 VAL 6 1HG2 VAL 6 8.808 0.845 -10.800 33 HG23 VAL 6 2HG2 VAL 6 7.656 -0.132 -9.856 34 H TYR 7 HN TYR 7 9.687 1.566 -6.746 35 HA TYR 7 HA TYR 7 8.889 3.953 -5.234 36 HB2 TYR 7 2HB TYR 7 9.950 1.219 -4.435 37 HB3 TYR 7 3HB TYR 7 10.571 2.588 -3.535 38 HD1 TYR 7 HD1 TYR 7 8.932 4.095 -2.302 39 HD2 TYR 7 HD2 TYR 7 7.791 0.330 -3.985 40 HE1 TYR 7 HE1 TYR 7 6.865 4.051 -0.822 41 HE2 TYR 7 HE2 TYR 7 5.729 0.300 -2.499 42 HH TYR 7 HH TYR 7 5.389 2.091 0.148 43 H LYS 8 HN LYS 8 10.296 5.603 -5.538 44 HA LYS 8 HA LYS 8 13.029 4.864 -6.327 45 HB2 LYS 8 2HB LYS 8 11.946 5.825 -8.226 46 HB3 LYS 8 3HB LYS 8 11.259 7.127 -7.276 47 HG2 LYS 8 2HG LYS 8 14.242 6.870 -7.169 48 HG3 LYS 8 3HG LYS 8 13.574 7.366 -8.712 49 HD2 LYS 8 2HD LYS 8 12.538 8.735 -6.232 50 HD3 LYS 8 3HD LYS 8 14.152 9.146 -6.774 51 HE2 LYS 8 2HE LYS 8 12.755 10.712 -7.897 52 HE3 LYS 8 3HE LYS 8 13.111 9.512 -9.123 53 HZ1 LYS 8 2HZ LYS 8 10.737 9.023 -7.496 54 HZ3 LYS 8 1HZ LYS 8 10.966 8.745 -9.084 55 H CYS 9 HN CYS 9 14.698 5.682 -5.124 56 HA CYS 9 HA CYS 9 13.975 6.950 -2.675 57 HB2 CYS 9 2HB CYS 9 15.747 5.231 -2.788 58 HB3 CYS 9 3HB CYS 9 16.715 6.282 -3.802 59 H GLU 10 HN GLU 10 14.362 9.132 -2.089 60 HA GLU 10 HA GLU 10 14.898 10.846 -4.357 61 HB2 GLU 10 2HB GLU 10 13.521 11.193 -1.696 62 HB3 GLU 10 3HB GLU 10 14.169 12.614 -2.492 63 HG2 GLU 10 2HG GLU 10 12.683 10.875 -4.358 64 HG3 GLU 10 3HG GLU 10 11.688 11.408 -3.018 65 H LEU 11 HN LEU 11 17.069 9.309 -3.065 66 HA LEU 11 HA LEU 11 18.678 11.602 -2.210 67 HB2 LEU 11 2HB LEU 11 17.963 9.253 -0.662 68 HB3 LEU 11 3HB LEU 11 19.700 9.392 -0.851 69 HG LEU 11 HG LEU 11 18.480 11.947 -0.133 70 HD11 LEU 11 1HD1 LEU 11 18.391 10.486 2.318 71 HD12 LEU 11 2HD1 LEU 11 17.094 11.393 1.504 72 HD13 LEU 11 3HD1 LEU 11 17.342 9.669 1.135 73 HD21 LEU 11 3HD2 LEU 11 20.780 10.236 0.702 74 HD22 LEU 11 1HD2 LEU 11 20.740 11.938 0.187 75 HD23 LEU 11 2HD2 LEU 11 20.206 11.492 1.825 76 H CYS 12 HN CYS 12 19.014 8.049 -2.922 77 HA CYS 12 HA CYS 12 21.403 8.663 -4.417 78 HB2 CYS 12 2HB CYS 12 21.590 6.199 -4.630 79 HB3 CYS 12 3HB CYS 12 21.568 6.786 -2.979 80 H GLY 13 HN GLY 13 18.136 7.142 -4.886 81 HA2 GLY 13 1HA GLY 13 16.879 7.847 -6.832 82 HA3 GLY 13 2HA GLY 13 18.363 7.792 -7.763 83 H GLN 14 HN GLN 14 17.487 5.372 -5.264 84 HA GLN 14 HA GLN 14 17.793 3.327 -7.219 85 HB2 GLN 14 2HB GLN 14 18.693 2.964 -4.989 86 HB3 GLN 14 3HB GLN 14 17.137 3.278 -4.246 87 HG2 GLN 14 2HG GLN 14 16.228 1.219 -4.933 88 HG3 GLN 14 3HG GLN 14 17.315 1.072 -6.300 89 HE21 GLN 14 1HE2 GLN 14 17.617 1.552 -2.778 90 HE22 GLN 14 2HE2 GLN 14 18.782 0.304 -2.485 91 H VAL 15 HN VAL 15 16.181 2.492 -8.473 92 HA VAL 15 HA VAL 15 13.431 2.973 -7.562 93 HB VAL 15 HB VAL 15 14.665 2.725 -10.305 94 HG11 VAL 15 1HG1 VAL 15 12.720 1.597 -10.754 95 HG12 VAL 15 2HG1 VAL 15 11.826 2.375 -9.425 96 HG13 VAL 15 3HG1 VAL 15 12.137 3.270 -10.933 97 HG21 VAL 15 3HG2 VAL 15 13.690 4.935 -8.608 98 HG22 VAL 15 1HG2 VAL 15 14.852 4.945 -9.956 99 HG23 VAL 15 2HG2 VAL 15 13.103 4.974 -10.289 100 H VAL 16 HN VAL 16 12.254 1.231 -6.950 101 HA VAL 16 HA VAL 16 13.004 -1.359 -8.085 102 HB VAL 16 HB VAL 16 13.099 -2.418 -6.008 103 HG11 VAL 16 1HG1 VAL 16 14.425 0.153 -5.199 104 HG12 VAL 16 2HG1 VAL 16 15.010 -1.523 -5.063 105 HG13 VAL 16 3HG1 VAL 16 14.996 -0.710 -6.647 106 HG21 VAL 16 3HG2 VAL 16 11.156 -1.442 -4.939 107 HG22 VAL 16 1HG2 VAL 16 12.559 -1.295 -3.853 108 HG23 VAL 16 2HG2 VAL 16 11.990 0.122 -4.768 109 H LYS 17 HN LYS 17 11.252 -2.724 -8.491 110 HA LYS 17 HA LYS 17 8.654 -1.435 -8.113 111 HB2 LYS 17 2HB LYS 17 9.091 -1.877 -10.402 112 HB3 LYS 17 3HB LYS 17 9.687 -3.490 -10.072 113 HG2 LYS 17 2HG LYS 17 6.871 -2.841 -9.215 114 HG3 LYS 17 3HG LYS 17 7.169 -3.048 -10.929 115 HD2 LYS 17 2HD LYS 17 8.285 -5.276 -10.395 116 HD3 LYS 17 3HD LYS 17 7.784 -5.073 -8.728 117 HE2 LYS 17 2HE LYS 17 5.951 -6.272 -9.474 118 HE3 LYS 17 3HE LYS 17 5.377 -4.666 -9.882 119 HZ1 LYS 17 2HZ LYS 17 5.907 -6.774 -11.648 120 HZ3 LYS 17 1HZ LYS 17 6.963 -5.588 -12.011 121 H VAL 18 HN VAL 18 7.342 -2.133 -6.520 122 HA VAL 18 HA VAL 18 8.090 -4.336 -4.922 123 HB VAL 18 HB VAL 18 5.599 -2.634 -5.091 124 HG11 VAL 18 1HG1 VAL 18 4.708 -3.649 -3.202 125 HG12 VAL 18 2HG1 VAL 18 5.376 -5.040 -4.089 126 HG13 VAL 18 3HG1 VAL 18 6.267 -4.351 -2.711 127 HG21 VAL 18 3HG2 VAL 18 7.736 -2.627 -2.947 128 HG22 VAL 18 1HG2 VAL 18 7.839 -1.611 -4.405 129 HG23 VAL 18 2HG2 VAL 18 6.482 -1.406 -3.272 130 H LEU 19 HN LEU 19 7.711 -6.471 -5.214 131 HA LEU 19 HA LEU 19 5.903 -7.203 -7.375 132 HB2 LEU 19 2HB LEU 19 6.965 -9.389 -7.223 133 HB3 LEU 19 3HB LEU 19 8.121 -8.101 -7.493 134 HG LEU 19 HG LEU 19 7.835 -8.626 -4.654 135 HD11 LEU 19 1HD1 LEU 19 8.323 -10.848 -4.421 136 HD12 LEU 19 2HD1 LEU 19 7.272 -10.911 -5.856 137 HD13 LEU 19 3HD1 LEU 19 9.041 -10.982 -6.044 138 HD21 LEU 19 3HD2 LEU 19 10.168 -8.551 -4.660 139 HD22 LEU 19 1HD2 LEU 19 10.281 -9.116 -6.344 140 HD23 LEU 19 2HD2 LEU 19 9.701 -7.470 -5.994 141 H GLU 20 HN GLU 20 6.411 -7.576 -3.841 142 HA GLU 20 HA GLU 20 3.630 -8.340 -3.681 143 HB2 GLU 20 2HB GLU 20 3.997 -10.287 -2.355 144 HB3 GLU 20 3HB GLU 20 5.106 -10.439 -3.704 145 HG2 GLU 20 2HG GLU 20 6.846 -9.248 -2.140 146 HG3 GLU 20 3HG GLU 20 5.737 -9.636 -0.840 147 H GLU 21 HN GLU 21 2.794 -6.714 -2.442 148 HA GLU 21 HA GLU 21 4.311 -5.103 -0.818 149 HB2 GLU 21 2HB GLU 21 2.255 -4.190 -1.463 150 HB3 GLU 21 3HB GLU 21 1.364 -5.658 -1.113 151 HG2 GLU 21 2HG GLU 21 1.737 -5.280 1.344 152 HG3 GLU 21 3HG GLU 21 2.586 -3.792 0.975 153 H GLY 22 HN GLY 22 4.075 -4.814 1.621 154 HA2 GLY 22 1HA GLY 22 3.660 -7.389 2.999 155 HA3 GLY 22 2HA GLY 22 5.151 -6.493 3.214 156 H GLY 23 HN GLY 23 5.236 -5.089 4.913 157 HA2 GLY 23 1HA GLY 23 2.933 -3.498 5.624 158 HA3 GLY 23 2HA GLY 23 3.327 -4.743 6.793 159 H GLY 24 HN GLY 24 5.398 -2.632 4.674 160 HA2 GLY 24 1HA GLY 24 6.370 -1.147 6.950 161 HA3 GLY 24 2HA GLY 24 7.528 -2.294 6.306 162 H THR 25 HN THR 25 8.621 -0.018 5.985 163 HA THR 25 HA THR 25 7.932 0.871 3.263 164 HB THR 25 HB THR 25 8.620 2.482 5.767 165 HG1 THR 25 HG1 THR 25 6.589 3.515 4.827 166 HG21 THR 25 3HG2 THR 25 8.217 4.405 3.951 167 HG22 THR 25 1HG2 THR 25 9.849 3.741 4.197 168 HG23 THR 25 2HG2 THR 25 8.857 3.181 2.828 169 H LEU 26 HN LEU 26 9.724 1.674 1.983 170 HA LEU 26 HA LEU 26 12.152 0.229 2.702 171 HB2 LEU 26 2HB LEU 26 11.619 1.545 0.060 172 HB3 LEU 26 3HB LEU 26 12.681 0.202 0.434 173 HG LEU 26 HG LEU 26 9.696 -0.069 0.745 174 HD11 LEU 26 1HD1 LEU 26 9.285 -0.352 -1.455 175 HD12 LEU 26 2HD1 LEU 26 10.686 0.733 -1.631 176 HD13 LEU 26 3HD1 LEU 26 10.898 -1.027 -1.788 177 HD21 LEU 26 3HD2 LEU 26 10.842 -1.866 1.739 178 HD22 LEU 26 1HD2 LEU 26 10.310 -2.470 0.150 179 HD23 LEU 26 2HD2 LEU 26 12.005 -1.982 0.396 180 H VAL 27 HN VAL 27 12.698 1.804 4.412 181 HA VAL 27 HA VAL 27 13.182 4.508 3.663 182 HB VAL 27 HB VAL 27 13.951 2.850 6.072 183 HG11 VAL 27 1HG1 VAL 27 15.023 5.338 5.258 184 HG12 VAL 27 2HG1 VAL 27 13.884 5.688 6.579 185 HG13 VAL 27 3HG1 VAL 27 15.209 4.528 6.832 186 HG21 VAL 27 3HG2 VAL 27 11.538 3.132 5.803 187 HG22 VAL 27 1HG2 VAL 27 12.127 4.089 7.183 188 HG23 VAL 27 2HG2 VAL 27 11.743 4.893 5.643 189 H CYS 28 HN CYS 28 14.717 4.950 2.148 190 HA CYS 28 HA CYS 28 17.273 3.554 2.481 191 HB2 CYS 28 2HB CYS 28 15.973 3.048 0.379 192 HB3 CYS 28 3HB CYS 28 16.197 4.723 -0.090 193 H CYS 29 HN CYS 29 19.135 4.872 2.611 194 HA CYS 29 HA CYS 29 20.329 6.679 2.954 195 HB2 CYS 29 2HB CYS 29 18.353 7.873 1.011 196 HB3 CYS 29 3HB CYS 29 19.681 8.799 1.684 197 H GLY 30 HN GLY 30 17.987 5.929 4.682 198 HA2 GLY 30 1HA GLY 30 17.053 6.710 6.576 199 HA3 GLY 30 2HA GLY 30 18.021 8.163 6.421 200 H GLU 31 HN GLU 31 15.867 7.081 3.793 201 HA GLU 31 HA GLU 31 13.860 8.970 4.657 202 HB2 GLU 31 2HB GLU 31 15.434 10.270 3.224 203 HB3 GLU 31 3HB GLU 31 15.204 9.121 1.921 204 HG2 GLU 31 2HG GLU 31 12.600 9.707 2.381 205 HG3 GLU 31 3HG GLU 31 13.300 11.194 2.990 206 H ASP 32 HN ASP 32 11.835 8.124 4.336 207 HA ASP 32 HA ASP 32 11.547 5.566 3.380 208 HB2 ASP 32 2HB ASP 32 9.031 6.338 3.195 209 HB3 ASP 32 3HB ASP 32 9.800 6.272 4.768 210 H MET 33 HN MET 33 11.870 4.949 1.233 211 HA MET 33 HA MET 33 12.109 6.544 -0.891 212 HB2 MET 33 2HB MET 33 12.161 3.848 -0.460 213 HB3 MET 33 3HB MET 33 10.631 3.938 -1.308 214 HG2 MET 33 2HG MET 33 11.692 4.179 -3.303 215 HG3 MET 33 3HG MET 33 12.566 5.580 -2.718 216 HE1 MET 33 3HE MET 33 13.235 2.084 -4.185 217 HE2 MET 33 1HE MET 33 13.886 1.219 -2.773 218 HE3 MET 33 2HE MET 33 12.220 1.846 -2.743 219 H VAL 34 HN VAL 34 10.772 7.291 -2.644 220 HA VAL 34 HA VAL 34 8.014 7.704 -1.811 221 HB VAL 34 HB VAL 34 8.019 9.569 -3.151 222 HG11 VAL 34 1HG1 VAL 34 9.855 10.844 -2.505 223 HG12 VAL 34 2HG1 VAL 34 9.879 9.512 -1.324 224 HG13 VAL 34 3HG1 VAL 34 10.998 9.495 -2.709 225 HG21 VAL 34 3HG2 VAL 34 10.365 8.499 -4.755 226 HG22 VAL 34 1HG2 VAL 34 8.657 8.344 -5.232 227 HG23 VAL 34 2HG2 VAL 34 9.400 9.955 -5.096 228 H LYS 35 HN LYS 35 6.269 7.493 -3.489 229 HA LYS 35 HA LYS 35 6.724 5.020 -4.956 230 HB2 LYS 35 2HB LYS 35 4.695 5.783 -3.311 231 HB3 LYS 35 3HB LYS 35 4.023 6.236 -4.864 232 HG2 LYS 35 2HG LYS 35 3.566 4.065 -5.325 233 HG3 LYS 35 3HG LYS 35 5.266 3.660 -5.194 234 HD2 LYS 35 2HD LYS 35 4.533 2.348 -3.452 235 HD3 LYS 35 3HD LYS 35 4.681 3.840 -2.545 236 HE2 LYS 35 2HE LYS 35 2.336 4.286 -2.650 237 HE3 LYS 35 3HE LYS 35 2.092 3.190 -3.996 238 HZ1 LYS 35 2HZ LYS 35 2.266 1.341 -2.590 239 HZ3 LYS 35 1HZ LYS 35 1.458 2.392 -1.644 240 H GLN 36 HN GLN 36 5.981 4.810 -7.205 241 HA GLN 36 HA GLN 36 6.095 7.392 -8.560 242 HB2 GLN 36 2HB GLN 36 7.223 4.745 -9.569 243 HB3 GLN 36 3HB GLN 36 7.301 6.279 -10.411 244 HG2 GLN 36 2HG GLN 36 8.461 5.918 -7.617 245 HG3 GLN 36 3HG GLN 36 9.395 5.567 -9.058 246 HE21 GLN 36 1HE2 GLN 36 7.861 8.008 -7.119 247 HE22 GLN 36 2HE2 GLN 36 8.569 9.406 -7.858 248 H1 ALA 1 HN ALA 1 22.310 -1.005 -5.263 249 HA ALA 1 HA ALA 1 23.149 -3.712 -4.737 250 HB1 ALA 1 1HB ALA 1 20.545 -2.988 -4.033 251 HB2 ALA 1 2HB ALA 1 20.365 -3.706 -5.652 252 HB3 ALA 1 3HB ALA 1 21.131 -4.639 -4.345 253 H ASN 2 HN ASN 2 22.414 -5.088 -6.817 254 HA ASN 2 HA ASN 2 23.058 -3.345 -9.054 255 HB2 ASN 2 2HB ASN 2 23.936 -6.021 -8.211 256 HB3 ASN 2 3HB ASN 2 23.309 -6.072 -9.847 257 HD21 ASN 2 1HD2 ASN 2 26.053 -6.207 -8.587 258 HD22 ASN 2 2HD2 ASN 2 27.027 -5.080 -9.472 259 H GLU 3 HN GLU 3 21.750 -3.501 -10.995 260 HA GLU 3 HA GLU 3 19.108 -3.910 -10.689 261 HB2 GLU 3 2HB GLU 3 20.773 -4.246 -13.223 262 HB3 GLU 3 3HB GLU 3 19.029 -4.073 -13.209 263 HG2 GLU 3 2HG GLU 3 19.168 -1.842 -12.253 264 HG3 GLU 3 3HG GLU 3 20.877 -2.024 -11.912 265 H GLY 4 HN GLY 4 17.615 -5.591 -11.620 266 HA2 GLY 4 1HA GLY 4 16.913 -7.713 -11.874 267 HA3 GLY 4 2HA GLY 4 18.543 -8.157 -12.339 268 H ASP 5 HN ASP 5 17.563 -6.643 -9.218 269 HA ASP 5 HA ASP 5 18.409 -9.130 -7.949 270 HB2 ASP 5 2HB ASP 5 18.986 -6.255 -7.395 271 HB3 ASP 5 3HB ASP 5 18.603 -7.204 -5.973 272 H VAL 6 HN VAL 6 17.361 -9.310 -5.615 273 HA VAL 6 HA VAL 6 14.715 -8.061 -5.569 274 HB VAL 6 HB VAL 6 15.395 -10.985 -5.548 275 HG11 VAL 6 1HG1 VAL 6 14.119 -11.214 -3.696 276 HG12 VAL 6 2HG1 VAL 6 13.357 -9.617 -3.892 277 HG13 VAL 6 3HG1 VAL 6 12.768 -11.006 -4.836 278 HG21 VAL 6 3HG2 VAL 6 14.457 -9.447 -7.530 279 HG22 VAL 6 1HG2 VAL 6 13.983 -11.151 -7.334 280 HG23 VAL 6 2HG2 VAL 6 12.909 -9.856 -6.752 281 H TYR 7 HN TYR 7 13.972 -7.545 -3.496 282 HA TYR 7 HA TYR 7 15.805 -8.263 -1.310 283 HB2 TYR 7 2HB TYR 7 14.623 -5.664 -2.349 284 HB3 TYR 7 3HB TYR 7 14.754 -5.815 -0.608 285 HD1 TYR 7 HD1 TYR 7 17.041 -6.223 0.423 286 HD2 TYR 7 HD2 TYR 7 16.523 -5.160 -3.688 287 HE1 TYR 7 HE1 TYR 7 19.477 -5.511 0.293 288 HE2 TYR 7 HE2 TYR 7 18.962 -4.450 -3.804 289 HH TYR 7 HH TYR 7 20.892 -4.163 -0.958 290 H LYS 8 HN LYS 8 14.804 -9.316 0.328 291 HA LYS 8 HA LYS 8 11.907 -8.890 0.580 292 HB2 LYS 8 2HB LYS 8 11.977 -11.076 -0.118 293 HB3 LYS 8 3HB LYS 8 13.556 -11.378 0.576 294 HG2 LYS 8 2HG LYS 8 12.497 -12.375 2.320 295 HG3 LYS 8 3HG LYS 8 11.966 -10.781 2.817 296 HD2 LYS 8 2HD LYS 8 9.856 -11.002 1.721 297 HD3 LYS 8 3HD LYS 8 10.414 -12.317 0.706 298 HE2 LYS 8 2HE LYS 8 10.398 -12.676 3.715 299 HE3 LYS 8 3HE LYS 8 8.894 -12.819 2.829 300 HZ1 LYS 8 2HZ LYS 8 10.043 -14.491 1.391 301 HZ3 LYS 8 1HZ LYS 8 9.921 -14.975 2.940 302 H CYS 9 HN CYS 9 11.128 -8.289 2.569 303 HA CYS 9 HA CYS 9 13.080 -7.476 4.476 304 HB2 CYS 9 2HB CYS 9 11.083 -6.113 4.019 305 HB3 CYS 9 3HB CYS 9 10.046 -7.401 4.596 306 H GLU 10 HN GLU 10 13.187 -8.266 6.718 307 HA GLU 10 HA GLU 10 12.325 -11.043 6.862 308 HB2 GLU 10 2HB GLU 10 14.661 -9.522 8.027 309 HB3 GLU 10 3HB GLU 10 14.095 -10.963 8.846 310 HG2 GLU 10 2HG GLU 10 14.360 -11.314 5.912 311 HG3 GLU 10 3HG GLU 10 15.874 -10.917 6.701 312 H LEU 11 HN LEU 11 10.565 -8.708 7.376 313 HA LEU 11 HA LEU 11 9.927 -9.361 10.157 314 HB2 LEU 11 2HB LEU 11 10.757 -6.788 9.101 315 HB3 LEU 11 3HB LEU 11 9.152 -6.705 9.802 316 HG LEU 11 HG LEU 11 10.861 -8.176 11.587 317 HD11 LEU 11 1HD1 LEU 11 12.790 -7.150 10.685 318 HD12 LEU 11 2HD1 LEU 11 11.991 -5.563 10.571 319 HD13 LEU 11 3HD1 LEU 11 12.395 -6.244 12.166 320 HD21 LEU 11 3HD2 LEU 11 10.286 -6.190 13.082 321 HD22 LEU 11 1HD2 LEU 11 9.345 -5.568 11.705 322 HD23 LEU 11 2HD2 LEU 11 8.928 -7.139 12.430 323 H CYS 12 HN CYS 12 8.620 -7.289 7.470 324 HA CYS 12 HA CYS 12 6.002 -8.307 8.013 325 HB2 CYS 12 2HB CYS 12 5.353 -6.828 6.097 326 HB3 CYS 12 3HB CYS 12 6.091 -6.024 7.468 327 H GLY 13 HN GLY 13 8.400 -8.361 5.280 328 HA2 GLY 13 1HA GLY 13 8.819 -10.506 4.235 329 HA3 GLY 13 2HA GLY 13 7.102 -10.846 4.332 330 H GLN 14 HN GLN 14 8.258 -7.570 3.558 331 HA GLN 14 HA GLN 14 6.837 -7.691 1.104 332 HB2 GLN 14 2HB GLN 14 6.752 -5.641 2.388 333 HB3 GLN 14 3HB GLN 14 8.499 -5.529 2.456 334 HG2 GLN 14 2HG GLN 14 8.690 -4.849 0.214 335 HG3 GLN 14 3HG GLN 14 7.190 -5.619 -0.262 336 HE21 GLN 14 1HE2 GLN 14 8.242 -3.228 2.169 337 HE22 GLN 14 2HE2 GLN 14 7.029 -2.037 1.843 338 H VAL 15 HN VAL 15 7.635 -8.023 -0.951 339 HA VAL 15 HA VAL 15 10.562 -8.160 -1.181 340 HB VAL 15 HB VAL 15 8.567 -9.795 -2.747 341 HG11 VAL 15 1HG1 VAL 15 11.268 -10.851 -2.299 342 HG12 VAL 15 2HG1 VAL 15 10.332 -10.692 -3.805 343 HG13 VAL 15 3HG1 VAL 15 11.253 -9.304 -3.178 344 HG21 VAL 15 3HG2 VAL 15 9.128 -11.685 -1.248 345 HG22 VAL 15 1HG2 VAL 15 10.036 -10.567 -0.203 346 HG23 VAL 15 2HG2 VAL 15 8.278 -10.371 -0.400 347 H VAL 16 HN VAL 16 11.494 -6.942 -2.777 348 HA VAL 16 HA VAL 16 9.706 -5.851 -4.821 349 HB VAL 16 HB VAL 16 10.446 -3.654 -4.496 350 HG11 VAL 16 1HG1 VAL 16 10.011 -4.877 -1.750 351 HG12 VAL 16 2HG1 VAL 16 9.869 -3.148 -2.143 352 HG13 VAL 16 3HG1 VAL 16 8.750 -4.323 -2.876 353 HG21 VAL 16 3HG2 VAL 16 12.775 -4.924 -3.313 354 HG22 VAL 16 1HG2 VAL 16 12.592 -3.288 -3.990 355 HG23 VAL 16 2HG2 VAL 16 12.174 -3.599 -2.288 356 H LYS 17 HN LYS 17 10.695 -5.524 -6.852 357 HA LYS 17 HA LYS 17 13.274 -6.872 -7.077 358 HB2 LYS 17 2HB LYS 17 12.041 -7.938 -8.632 359 HB3 LYS 17 3HB LYS 17 10.859 -6.650 -8.743 360 HG2 LYS 17 2HG LYS 17 11.940 -6.652 -10.869 361 HG3 LYS 17 3HG LYS 17 12.644 -5.291 -10.020 362 HD2 LYS 17 2HD LYS 17 14.682 -6.199 -10.434 363 HD3 LYS 17 3HD LYS 17 14.287 -7.448 -9.270 364 HE2 LYS 17 2HE LYS 17 13.305 -7.710 -12.127 365 HE3 LYS 17 3HE LYS 17 14.968 -8.114 -11.747 366 HZ1 LYS 17 2HZ LYS 17 12.939 -9.837 -11.466 367 HZ3 LYS 17 1HZ LYS 17 12.998 -9.258 -9.945 368 H VAL 18 HN VAL 18 15.106 -5.715 -7.307 369 HA VAL 18 HA VAL 18 14.997 -2.899 -7.452 370 HB VAL 18 HB VAL 18 17.267 -4.870 -7.786 371 HG11 VAL 18 1HG1 VAL 18 18.805 -3.085 -7.527 372 HG12 VAL 18 2HG1 VAL 18 17.640 -2.542 -8.760 373 HG13 VAL 18 3HG1 VAL 18 17.520 -1.934 -7.091 374 HG21 VAL 18 3HG2 VAL 18 17.419 -3.433 -5.342 375 HG22 VAL 18 1HG2 VAL 18 15.747 -4.025 -5.498 376 HG23 VAL 18 2HG2 VAL 18 17.109 -5.169 -5.583 377 H LEU 19 HN LEU 19 14.582 -1.673 -9.208 378 HA LEU 19 HA LEU 19 14.813 -2.903 -11.817 379 HB2 LEU 19 2HB LEU 19 13.876 -0.113 -11.188 380 HB3 LEU 19 3HB LEU 19 13.541 -1.079 -12.611 381 HG LEU 19 HG LEU 19 12.614 -2.234 -10.040 382 HD11 LEU 19 1HD1 LEU 19 12.123 0.102 -9.608 383 HD12 LEU 19 2HD1 LEU 19 11.332 0.259 -11.195 384 HD13 LEU 19 3HD1 LEU 19 10.619 -0.789 -9.945 385 HD21 LEU 19 3HD2 LEU 19 11.887 -2.248 -12.896 386 HD22 LEU 19 1HD2 LEU 19 11.746 -3.521 -11.660 387 HD23 LEU 19 2HD2 LEU 19 10.508 -2.248 -11.770 388 H GLU 20 HN GLU 20 15.870 0.249 -10.338 389 HA GLU 20 HA GLU 20 18.310 -0.075 -11.898 390 HB2 GLU 20 2HB GLU 20 16.905 1.606 -13.008 391 HB3 GLU 20 3HB GLU 20 16.689 2.476 -11.503 392 HG2 GLU 20 2HG GLU 20 18.860 3.340 -11.515 393 HG3 GLU 20 3HG GLU 20 19.518 1.975 -12.396 394 H GLU 21 HN GLU 21 20.117 -0.072 -10.630 395 HA GLU 21 HA GLU 21 19.953 0.176 -7.905 396 HB2 GLU 21 2HB GLU 21 22.406 0.108 -7.931 397 HB3 GLU 21 3HB GLU 21 21.767 -1.008 -9.122 398 HG2 GLU 21 2HG GLU 21 21.992 1.114 -10.748 399 HG3 GLU 21 3HG GLU 21 23.162 1.637 -9.552 400 H GLY 22 HN GLY 22 21.244 1.802 -6.515 401 HA2 GLY 22 1HA GLY 22 21.227 4.505 -7.674 402 HA3 GLY 22 2HA GLY 22 20.265 4.179 -6.245 403 H GLY 23 HN GLY 23 21.617 2.792 -4.482 404 HA2 GLY 23 1HA GLY 23 24.078 2.544 -3.902 405 HA3 GLY 23 2HA GLY 23 24.140 4.281 -4.121 406 H GLY 24 HN GLY 24 21.812 1.968 -2.536 407 HA2 GLY 24 1HA GLY 24 22.347 3.098 0.063 408 HA3 GLY 24 2HA GLY 24 20.795 3.568 -0.603 409 H THR 25 HN THR 25 20.069 2.300 1.409 410 HA THR 25 HA THR 25 19.734 -0.519 0.633 411 HB THR 25 HB THR 25 20.446 0.699 3.346 412 HG1 THR 25 HG1 THR 25 22.298 0.100 2.200 413 HG21 THR 25 3HG2 THR 25 19.297 -2.013 2.593 414 HG22 THR 25 1HG2 THR 25 20.482 -1.888 3.916 415 HG23 THR 25 2HG2 THR 25 18.937 -1.010 4.019 416 H LEU 26 HN LEU 26 17.773 -1.544 1.495 417 HA LEU 26 HA LEU 26 15.646 0.462 1.642 418 HB2 LEU 26 2HB LEU 26 15.287 -2.464 1.061 419 HB3 LEU 26 3HB LEU 26 14.193 -1.136 0.727 420 HG LEU 26 HG LEU 26 16.884 -1.332 -0.625 421 HD11 LEU 26 1HD1 LEU 26 14.301 -2.684 -1.429 422 HD12 LEU 26 2HD1 LEU 26 15.645 -2.376 -2.554 423 HD13 LEU 26 3HD1 LEU 26 15.891 -3.428 -1.140 424 HD21 LEU 26 3HD2 LEU 26 15.999 0.800 -0.952 425 HD22 LEU 26 1HD2 LEU 26 15.517 -0.087 -2.418 426 HD23 LEU 26 2HD2 LEU 26 14.334 0.194 -1.119 427 H VAL 27 HN VAL 27 16.233 0.875 3.932 428 HA VAL 27 HA VAL 27 16.037 -1.224 5.818 429 HB VAL 27 HB VAL 27 15.873 1.785 6.075 430 HG11 VAL 27 1HG1 VAL 27 16.385 -0.249 8.270 431 HG12 VAL 27 2HG1 VAL 27 16.253 1.518 8.441 432 HG13 VAL 27 3HG1 VAL 27 14.823 0.558 7.990 433 HG21 VAL 27 3HG2 VAL 27 17.997 0.681 5.140 434 HG22 VAL 27 1HG2 VAL 27 18.184 1.773 6.534 435 HG23 VAL 27 2HG2 VAL 27 18.219 0.009 6.773 436 H CYS 28 HN CYS 28 14.180 -2.393 6.000 437 HA CYS 28 HA CYS 28 11.708 -0.825 6.168 438 HB2 CYS 28 2HB CYS 28 11.939 -2.289 4.129 439 HB3 CYS 28 3HB CYS 28 11.935 -3.678 5.198 440 H CYS 29 HN CYS 29 10.482 -1.158 8.039 441 HA CYS 29 HA CYS 29 9.936 -1.869 10.041 442 HB2 CYS 29 2HB CYS 29 11.096 -4.454 9.010 443 HB3 CYS 29 3HB CYS 29 10.447 -4.314 10.632 444 H GLY 30 HN GLY 30 12.510 -0.507 9.470 445 HA2 GLY 30 1HA GLY 30 14.312 0.177 10.627 446 HA3 GLY 30 2HA GLY 30 13.706 -0.704 12.015 447 H GLU 31 HN GLU 31 14.170 -2.463 8.987 448 HA GLU 31 HA GLU 31 16.762 -3.376 9.905 449 HB2 GLU 31 2HB GLU 31 14.671 -4.876 10.621 450 HB3 GLU 31 3HB GLU 31 14.782 -5.451 8.970 451 HG2 GLU 31 2HG GLU 31 17.418 -5.600 9.660 452 HG3 GLU 31 3HG GLU 31 16.702 -5.819 11.245 453 H ASP 32 HN ASP 32 18.193 -3.387 8.220 454 HA ASP 32 HA ASP 32 17.465 -2.557 5.728 455 HB2 ASP 32 2HB ASP 32 19.853 -4.304 6.496 456 HB3 ASP 32 3HB ASP 32 19.731 -3.362 5.023 457 H MET 33 HN MET 33 16.230 -3.656 4.199 458 HA MET 33 HA MET 33 15.398 -6.208 4.406 459 HB2 MET 33 2HB MET 33 14.920 -4.158 2.696 460 HB3 MET 33 3HB MET 33 15.972 -5.087 1.648 461 HG2 MET 33 2HG MET 33 14.298 -6.547 1.175 462 HG3 MET 33 3HG MET 33 14.069 -6.899 2.876 463 HE1 MET 33 3HE MET 33 11.763 -3.981 0.248 464 HE2 MET 33 1HE MET 33 13.467 -4.450 0.035 465 HE3 MET 33 2HE MET 33 12.178 -5.663 -0.156 466 H VAL 34 HN VAL 34 15.933 -8.233 3.311 467 HA VAL 34 HA VAL 34 18.814 -8.459 2.895 468 HB VAL 34 HB VAL 34 18.621 -10.673 3.520 469 HG11 VAL 34 1HG1 VAL 34 17.797 -8.848 5.259 470 HG12 VAL 34 2HG1 VAL 34 16.269 -9.752 5.132 471 HG13 VAL 34 3HG1 VAL 34 17.755 -10.584 5.648 472 HG21 VAL 34 3HG2 VAL 34 17.081 -11.957 2.539 473 HG22 VAL 34 1HG2 VAL 34 15.895 -11.352 3.721 474 HG23 VAL 34 2HG2 VAL 34 16.076 -10.541 2.147 475 H LYS 35 HN LYS 35 19.546 -9.951 1.103 476 HA LYS 35 HA LYS 35 17.938 -9.358 -1.260 477 HB2 LYS 35 2HB LYS 35 20.430 -8.699 -0.955 478 HB3 LYS 35 3HB LYS 35 20.771 -10.390 -1.262 479 HG2 LYS 35 2HG LYS 35 18.870 -9.037 -3.155 480 HG3 LYS 35 3HG LYS 35 20.551 -8.551 -3.250 481 HD2 LYS 35 2HD LYS 35 21.290 -10.769 -3.772 482 HD3 LYS 35 3HD LYS 35 19.792 -11.493 -3.222 483 HE2 LYS 35 2HE LYS 35 19.263 -9.538 -5.336 484 HE3 LYS 35 3HE LYS 35 20.445 -10.714 -5.875 485 HZ1 LYS 35 2HZ LYS 35 18.577 -11.928 -6.279 486 HZ3 LYS 35 1HZ LYS 35 17.651 -11.134 -5.199 487 H GLN 36 HN GLN 36 17.394 -10.998 -2.793 488 HA GLN 36 HA GLN 36 17.458 -13.649 -1.579 489 HB2 GLN 36 2HB GLN 36 15.485 -12.668 -3.680 490 HB3 GLN 36 3HB GLN 36 15.377 -14.136 -2.728 491 HG2 GLN 36 2HG GLN 36 15.417 -11.365 -1.454 492 HG3 GLN 36 3HG GLN 36 13.928 -12.147 -1.948 493 HE21 GLN 36 1HE2 GLN 36 16.488 -12.009 0.337 494 HE22 GLN 36 2HE2 GLN 36 15.923 -13.207 1.454 Start of MODEL 3 1 H1 ALA 1 HN ALA 1 2.021 -1.678 1.925 2 HA ALA 1 HA ALA 1 2.104 0.543 0.173 3 HB1 ALA 1 1HB ALA 1 4.543 0.133 0.397 4 HB2 ALA 1 2HB ALA 1 4.297 -1.547 -0.139 5 HB3 ALA 1 3HB ALA 1 3.960 -0.200 -1.252 6 H ASN 2 HN ASN 2 1.505 -0.161 -2.092 7 HA ASN 2 HA ASN 2 -0.159 -2.520 -1.838 8 HB2 ASN 2 2HB ASN 2 -0.413 0.085 -3.152 9 HB3 ASN 2 3HB ASN 2 -0.652 -1.194 -4.326 10 HD21 ASN 2 1HD2 ASN 2 -2.242 -2.809 -3.935 11 HD22 ASN 2 2HD2 ASN 2 -3.635 -2.486 -2.957 12 H GLU 3 HN GLU 3 0.074 -4.281 -3.335 13 HA GLU 3 HA GLU 3 2.581 -4.650 -4.426 14 HB2 GLU 3 2HB GLU 3 -0.082 -6.046 -4.876 15 HB3 GLU 3 3HB GLU 3 1.387 -6.592 -5.660 16 HG2 GLU 3 2HG GLU 3 2.385 -7.269 -3.648 17 HG3 GLU 3 3HG GLU 3 1.480 -6.121 -2.683 18 H GLY 4 HN GLY 4 3.414 -4.524 -6.559 19 HA2 GLY 4 1HA GLY 4 3.426 -4.023 -8.782 20 HA3 GLY 4 2HA GLY 4 1.703 -3.707 -8.737 21 H ASP 5 HN ASP 5 3.843 -2.203 -6.336 22 HA ASP 5 HA ASP 5 3.377 0.322 -7.713 23 HB2 ASP 5 2HB ASP 5 3.548 -0.472 -4.802 24 HB3 ASP 5 3HB ASP 5 4.016 1.157 -5.245 25 H VAL 6 HN VAL 6 5.225 1.531 -8.289 26 HA VAL 6 HA VAL 6 7.786 0.292 -7.715 27 HB VAL 6 HB VAL 6 6.701 2.259 -9.681 28 HG11 VAL 6 1HG1 VAL 6 9.670 1.969 -9.108 29 HG12 VAL 6 2HG1 VAL 6 8.917 2.953 -10.386 30 HG13 VAL 6 3HG1 VAL 6 8.677 3.382 -8.675 31 HG21 VAL 6 3HG2 VAL 6 7.353 0.731 -11.259 32 HG22 VAL 6 1HG2 VAL 6 8.745 0.167 -10.305 33 HG23 VAL 6 2HG2 VAL 6 7.101 -0.366 -9.879 34 H TYR 7 HN TYR 7 9.613 1.567 -6.897 35 HA TYR 7 HA TYR 7 8.845 4.003 -5.485 36 HB2 TYR 7 2HB TYR 7 9.802 1.308 -4.434 37 HB3 TYR 7 3HB TYR 7 10.388 2.741 -3.612 38 HD1 TYR 7 HD1 TYR 7 8.848 4.189 -2.348 39 HD2 TYR 7 HD2 TYR 7 7.467 0.626 -4.271 40 HE1 TYR 7 HE1 TYR 7 6.706 4.273 -0.980 41 HE2 TYR 7 HE2 TYR 7 5.331 0.722 -2.897 42 HH TYR 7 HH TYR 7 4.877 1.952 -0.357 43 H LYS 8 HN LYS 8 10.381 5.559 -5.714 44 HA LYS 8 HA LYS 8 13.081 4.633 -6.411 45 HB2 LYS 8 2HB LYS 8 12.283 5.465 -8.439 46 HB3 LYS 8 3HB LYS 8 11.365 6.751 -7.681 47 HG2 LYS 8 2HG LYS 8 14.355 6.746 -7.285 48 HG3 LYS 8 3HG LYS 8 13.746 7.204 -8.863 49 HD2 LYS 8 2HD LYS 8 12.463 8.456 -6.434 50 HD3 LYS 8 3HD LYS 8 14.059 9.012 -6.899 51 HE2 LYS 8 2HE LYS 8 12.810 10.449 -8.216 52 HE3 LYS 8 3HE LYS 8 12.920 9.112 -9.343 53 HZ1 LYS 8 2HZ LYS 8 10.687 9.054 -9.275 54 HZ3 LYS 8 1HZ LYS 8 10.601 10.134 -8.060 55 H CYS 9 HN CYS 9 14.752 5.498 -5.236 56 HA CYS 9 HA CYS 9 14.018 6.957 -2.908 57 HB2 CYS 9 2HB CYS 9 15.772 5.214 -2.884 58 HB3 CYS 9 3HB CYS 9 16.768 6.190 -3.945 59 H GLU 10 HN GLU 10 14.349 9.174 -2.496 60 HA GLU 10 HA GLU 10 14.968 10.720 -4.857 61 HB2 GLU 10 2HB GLU 10 13.450 11.184 -2.319 62 HB3 GLU 10 3HB GLU 10 14.248 12.584 -3.005 63 HG2 GLU 10 2HG GLU 10 12.733 10.864 -4.938 64 HG3 GLU 10 3HG GLU 10 11.763 11.741 -3.771 65 H LEU 11 HN LEU 11 17.067 9.245 -3.308 66 HA LEU 11 HA LEU 11 18.678 11.592 -2.590 67 HB2 LEU 11 2HB LEU 11 17.884 9.388 -0.926 68 HB3 LEU 11 3HB LEU 11 19.622 9.356 -1.147 69 HG LEU 11 HG LEU 11 18.749 12.055 -0.572 70 HD11 LEU 11 1HD1 LEU 11 18.176 11.423 1.893 71 HD12 LEU 11 2HD1 LEU 11 16.907 11.386 0.646 72 HD13 LEU 11 3HD1 LEU 11 17.671 9.872 1.183 73 HD21 LEU 11 3HD2 LEU 11 20.755 10.085 0.360 74 HD22 LEU 11 1HD2 LEU 11 20.931 11.807 -0.058 75 HD23 LEU 11 2HD2 LEU 11 20.279 11.338 1.531 76 H CYS 12 HN CYS 12 19.012 8.015 -3.175 77 HA CYS 12 HA CYS 12 21.428 8.583 -4.657 78 HB2 CYS 12 2HB CYS 12 21.616 6.095 -4.757 79 HB3 CYS 12 3HB CYS 12 21.644 6.789 -3.148 80 H GLY 13 HN GLY 13 18.151 7.082 -5.064 81 HA2 GLY 13 1HA GLY 13 16.942 7.684 -7.078 82 HA3 GLY 13 2HA GLY 13 18.433 7.500 -7.979 83 H GLN 14 HN GLN 14 17.719 5.266 -5.321 84 HA GLN 14 HA GLN 14 17.914 3.081 -7.066 85 HB2 GLN 14 2HB GLN 14 18.649 2.989 -4.709 86 HB3 GLN 14 3HB GLN 14 17.004 3.239 -4.158 87 HG2 GLN 14 2HG GLN 14 16.439 1.102 -5.588 88 HG3 GLN 14 3HG GLN 14 18.166 0.810 -5.564 89 HE21 GLN 14 1HE2 GLN 14 18.587 2.052 -2.977 90 HE22 GLN 14 2HE2 GLN 14 17.991 0.965 -1.766 91 H VAL 15 HN VAL 15 16.348 2.425 -8.471 92 HA VAL 15 HA VAL 15 13.568 2.951 -7.714 93 HB VAL 15 HB VAL 15 14.600 2.167 -10.433 94 HG11 VAL 15 1HG1 VAL 15 12.486 2.441 -11.105 95 HG12 VAL 15 2HG1 VAL 15 12.029 2.548 -9.388 96 HG13 VAL 15 3HG1 VAL 15 12.372 4.030 -10.313 97 HG21 VAL 15 3HG2 VAL 15 15.161 4.613 -9.002 98 HG22 VAL 15 1HG2 VAL 15 15.683 4.107 -10.626 99 HG23 VAL 15 2HG2 VAL 15 14.131 4.950 -10.413 100 H VAL 16 HN VAL 16 12.268 1.288 -7.121 101 HA VAL 16 HA VAL 16 13.035 -1.392 -8.010 102 HB VAL 16 HB VAL 16 13.000 -2.303 -5.893 103 HG11 VAL 16 1HG1 VAL 16 14.967 -0.798 -6.267 104 HG12 VAL 16 2HG1 VAL 16 14.119 0.464 -5.339 105 HG13 VAL 16 3HG1 VAL 16 14.573 -1.066 -4.552 106 HG21 VAL 16 3HG2 VAL 16 10.989 -1.589 -4.942 107 HG22 VAL 16 1HG2 VAL 16 12.221 -0.887 -3.865 108 HG23 VAL 16 2HG2 VAL 16 11.416 0.133 -5.083 109 H LYS 17 HN LYS 17 11.140 -2.975 -7.540 110 HA LYS 17 HA LYS 17 8.599 -1.530 -7.769 111 HB2 LYS 17 2HB LYS 17 8.894 -2.042 -9.996 112 HB3 LYS 17 3HB LYS 17 9.810 -3.499 -9.668 113 HG2 LYS 17 2HG LYS 17 7.594 -4.123 -10.504 114 HG3 LYS 17 3HG LYS 17 7.730 -4.614 -8.828 115 HD2 LYS 17 2HD LYS 17 5.709 -3.540 -8.622 116 HD3 LYS 17 3HD LYS 17 6.711 -2.112 -8.459 117 HE2 LYS 17 2HE LYS 17 5.384 -1.346 -10.183 118 HE3 LYS 17 3HE LYS 17 6.568 -2.183 -11.167 119 HZ1 LYS 17 2HZ LYS 17 5.106 -3.903 -11.576 120 HZ3 LYS 17 1HZ LYS 17 4.013 -2.710 -11.398 121 H VAL 18 HN VAL 18 7.267 -2.119 -6.151 122 HA VAL 18 HA VAL 18 7.914 -4.297 -4.473 123 HB VAL 18 HB VAL 18 5.609 -2.385 -4.731 124 HG11 VAL 18 1HG1 VAL 18 4.247 -3.791 -3.656 125 HG12 VAL 18 2HG1 VAL 18 5.548 -4.989 -3.457 126 HG13 VAL 18 3HG1 VAL 18 5.343 -3.691 -2.257 127 HG21 VAL 18 3HG2 VAL 18 7.961 -2.745 -2.891 128 HG22 VAL 18 1HG2 VAL 18 7.376 -1.280 -3.718 129 HG23 VAL 18 2HG2 VAL 18 6.496 -1.917 -2.309 130 H LEU 19 HN LEU 19 7.448 -6.424 -4.691 131 HA LEU 19 HA LEU 19 5.449 -7.112 -6.724 132 HB2 LEU 19 2HB LEU 19 6.619 -9.204 -6.974 133 HB3 LEU 19 3HB LEU 19 7.693 -7.848 -7.249 134 HG LEU 19 HG LEU 19 7.910 -8.562 -4.494 135 HD11 LEU 19 1HD1 LEU 19 8.062 -10.799 -4.342 136 HD12 LEU 19 2HD1 LEU 19 7.010 -10.784 -5.779 137 HD13 LEU 19 3HD1 LEU 19 8.771 -10.970 -5.967 138 HD21 LEU 19 3HD2 LEU 19 9.858 -9.018 -6.770 139 HD22 LEU 19 1HD2 LEU 19 9.616 -7.471 -5.921 140 HD23 LEU 19 2HD2 LEU 19 10.239 -8.884 -5.036 141 H GLU 20 HN GLU 20 6.568 -7.615 -3.360 142 HA GLU 20 HA GLU 20 3.941 -8.747 -2.844 143 HB2 GLU 20 2HB GLU 20 6.610 -9.849 -1.868 144 HB3 GLU 20 3HB GLU 20 5.074 -10.300 -1.155 145 HG2 GLU 20 2HG GLU 20 4.375 -10.830 -3.664 146 HG3 GLU 20 3HG GLU 20 6.104 -10.875 -3.944 147 H GLU 21 HN GLU 21 3.189 -6.787 -1.940 148 HA GLU 21 HA GLU 21 4.572 -5.088 -0.372 149 HB2 GLU 21 2HB GLU 21 2.412 -4.285 0.436 150 HB3 GLU 21 3HB GLU 21 2.265 -4.723 -1.255 151 HG2 GLU 21 2HG GLU 21 0.890 -6.534 -0.819 152 HG3 GLU 21 3HG GLU 21 1.692 -6.922 0.689 153 H GLY 22 HN GLY 22 4.294 -4.662 2.068 154 HA2 GLY 22 1HA GLY 22 4.156 -7.192 3.582 155 HA3 GLY 22 2HA GLY 22 5.533 -6.121 3.746 156 H GLY 23 HN GLY 23 5.425 -4.373 5.142 157 HA2 GLY 23 1HA GLY 23 2.978 -3.096 5.834 158 HA3 GLY 23 2HA GLY 23 3.463 -4.227 7.081 159 H GLY 24 HN GLY 24 5.406 -2.093 4.871 160 HA2 GLY 24 1HA GLY 24 6.141 -0.323 7.012 161 HA3 GLY 24 2HA GLY 24 7.417 -1.447 6.588 162 H THR 25 HN THR 25 8.441 0.780 6.036 163 HA THR 25 HA THR 25 7.824 1.366 3.216 164 HB THR 25 HB THR 25 8.496 3.261 5.524 165 HG1 THR 25 HG1 THR 25 6.373 3.670 3.695 166 HG21 THR 25 3HG2 THR 25 7.922 4.956 3.562 167 HG22 THR 25 1HG2 THR 25 9.584 4.341 3.715 168 HG23 THR 25 2HG2 THR 25 8.481 3.634 2.510 169 H LEU 26 HN LEU 26 9.557 1.711 1.819 170 HA LEU 26 HA LEU 26 11.989 0.471 2.735 171 HB2 LEU 26 2HB LEU 26 11.554 1.661 0.017 172 HB3 LEU 26 3HB LEU 26 12.578 0.319 0.488 173 HG LEU 26 HG LEU 26 9.572 0.145 0.689 174 HD11 LEU 26 1HD1 LEU 26 9.888 -1.155 -1.569 175 HD12 LEU 26 2HD1 LEU 26 9.676 0.613 -1.560 176 HD13 LEU 26 3HD1 LEU 26 11.301 -0.088 -1.747 177 HD21 LEU 26 3HD2 LEU 26 10.468 -1.639 1.852 178 HD22 LEU 26 1HD2 LEU 26 10.243 -2.330 0.227 179 HD23 LEU 26 2HD2 LEU 26 11.859 -1.800 0.753 180 H VAL 27 HN VAL 27 12.567 2.090 4.367 181 HA VAL 27 HA VAL 27 13.077 4.763 3.538 182 HB VAL 27 HB VAL 27 13.980 3.225 5.982 183 HG11 VAL 27 1HG1 VAL 27 13.578 6.016 6.469 184 HG12 VAL 27 2HG1 VAL 27 15.077 5.064 6.601 185 HG13 VAL 27 3HG1 VAL 27 14.649 5.839 5.058 186 HG21 VAL 27 3HG2 VAL 27 11.375 3.817 5.216 187 HG22 VAL 27 1HG2 VAL 27 11.933 3.449 6.866 188 HG23 VAL 27 2HG2 VAL 27 11.798 5.141 6.329 189 H CYS 28 HN CYS 28 14.605 5.154 2.003 190 HA CYS 28 HA CYS 28 17.149 3.740 2.347 191 HB2 CYS 28 2HB CYS 28 15.788 3.243 0.257 192 HB3 CYS 28 3HB CYS 28 16.116 4.890 -0.245 193 H CYS 29 HN CYS 29 18.969 5.043 2.627 194 HA CYS 29 HA CYS 29 20.195 6.842 2.904 195 HB2 CYS 29 2HB CYS 29 18.299 8.002 0.864 196 HB3 CYS 29 3HB CYS 29 19.618 8.930 1.551 197 H GLY 30 HN GLY 30 17.862 6.174 4.626 198 HA2 GLY 30 1HA GLY 30 16.889 7.032 6.466 199 HA3 GLY 30 2HA GLY 30 17.842 8.487 6.256 200 H GLU 31 HN GLU 31 15.930 7.478 3.492 201 HA GLU 31 HA GLU 31 13.831 9.325 4.289 202 HB2 GLU 31 2HB GLU 31 15.553 10.426 2.756 203 HB3 GLU 31 3HB GLU 31 15.072 9.297 1.507 204 HG2 GLU 31 2HG GLU 31 12.610 10.249 2.333 205 HG3 GLU 31 3HG GLU 31 13.616 11.662 2.584 206 H ASP 32 HN ASP 32 11.798 8.494 3.961 207 HA ASP 32 HA ASP 32 11.509 5.880 3.153 208 HB2 ASP 32 2HB ASP 32 9.025 6.514 3.002 209 HB3 ASP 32 3HB ASP 32 9.809 6.833 4.536 210 H MET 33 HN MET 33 11.951 5.196 1.040 211 HA MET 33 HA MET 33 12.229 6.622 -1.156 212 HB2 MET 33 2HB MET 33 12.158 3.961 -0.592 213 HB3 MET 33 3HB MET 33 10.629 4.067 -1.439 214 HG2 MET 33 2HG MET 33 11.663 4.226 -3.462 215 HG3 MET 33 3HG MET 33 12.693 5.531 -2.908 216 HE1 MET 33 3HE MET 33 12.328 2.174 -4.073 217 HE2 MET 33 1HE MET 33 13.727 1.216 -3.530 218 HE3 MET 33 2HE MET 33 12.345 1.467 -2.439 219 H VAL 34 HN VAL 34 10.971 7.382 -2.946 220 HA VAL 34 HA VAL 34 8.249 8.027 -2.192 221 HB VAL 34 HB VAL 34 8.363 9.698 -3.792 222 HG11 VAL 34 1HG1 VAL 34 11.285 9.798 -3.398 223 HG12 VAL 34 2HG1 VAL 34 10.020 10.959 -2.928 224 HG13 VAL 34 3HG1 VAL 34 10.346 9.537 -1.908 225 HG21 VAL 34 3HG2 VAL 34 10.724 9.327 -5.303 226 HG22 VAL 34 1HG2 VAL 34 9.876 7.761 -5.300 227 HG23 VAL 34 2HG2 VAL 34 9.038 9.227 -5.864 228 H LYS 35 HN LYS 35 6.479 7.790 -3.853 229 HA LYS 35 HA LYS 35 6.733 5.146 -5.054 230 HB2 LYS 35 2HB LYS 35 4.829 6.055 -3.425 231 HB3 LYS 35 3HB LYS 35 4.144 6.639 -4.929 232 HG2 LYS 35 2HG LYS 35 3.452 4.552 -5.481 233 HG3 LYS 35 3HG LYS 35 5.087 3.934 -5.352 234 HD2 LYS 35 2HD LYS 35 4.259 2.708 -3.607 235 HD3 LYS 35 3HD LYS 35 4.451 4.189 -2.688 236 HE2 LYS 35 2HE LYS 35 2.152 4.747 -2.843 237 HE3 LYS 35 3HE LYS 35 1.899 3.749 -4.261 238 HZ1 LYS 35 2HZ LYS 35 2.623 1.885 -2.504 239 HZ3 LYS 35 1HZ LYS 35 1.069 2.340 -2.686 240 H GLN 36 HN GLN 36 6.156 4.747 -7.265 241 HA GLN 36 HA GLN 36 6.259 7.187 -8.862 242 HB2 GLN 36 2HB GLN 36 7.336 4.454 -9.674 243 HB3 GLN 36 3HB GLN 36 7.519 5.956 -10.558 244 HG2 GLN 36 2HG GLN 36 8.539 5.680 -7.704 245 HG3 GLN 36 3HG GLN 36 9.509 5.152 -9.065 246 HE21 GLN 36 1HE2 GLN 36 8.046 7.847 -7.418 247 HE22 GLN 36 2HE2 GLN 36 8.904 9.126 -8.209 248 H1 ALA 1 HN ALA 1 23.169 -2.252 -4.067 249 HA ALA 1 HA ALA 1 23.225 -5.008 -4.945 250 HB1 ALA 1 1HB ALA 1 21.299 -3.204 -3.909 251 HB2 ALA 1 2HB ALA 1 20.800 -3.555 -5.581 252 HB3 ALA 1 3HB ALA 1 21.043 -4.888 -4.425 253 H ASN 2 HN ASN 2 22.209 -5.496 -7.168 254 HA ASN 2 HA ASN 2 23.149 -3.486 -9.057 255 HB2 ASN 2 2HB ASN 2 23.694 -5.502 -10.574 256 HB3 ASN 2 3HB ASN 2 24.753 -5.284 -9.195 257 HD21 ASN 2 1HD2 ASN 2 22.815 -7.404 -10.883 258 HD22 ASN 2 2HD2 ASN 2 22.656 -8.682 -9.725 259 H GLU 3 HN GLU 3 21.847 -3.346 -11.041 260 HA GLU 3 HA GLU 3 19.181 -3.626 -10.728 261 HB2 GLU 3 2HB GLU 3 20.652 -3.819 -13.393 262 HB3 GLU 3 3HB GLU 3 19.004 -3.274 -13.152 263 HG2 GLU 3 2HG GLU 3 19.694 -1.168 -12.653 264 HG3 GLU 3 3HG GLU 3 20.791 -1.758 -11.420 265 H GLY 4 HN GLY 4 17.602 -5.201 -11.144 266 HA2 GLY 4 1HA GLY 4 16.774 -7.192 -11.947 267 HA3 GLY 4 2HA GLY 4 18.383 -7.692 -12.429 268 H ASP 5 HN ASP 5 17.982 -6.326 -9.201 269 HA ASP 5 HA ASP 5 18.530 -8.967 -8.149 270 HB2 ASP 5 2HB ASP 5 19.008 -6.137 -7.248 271 HB3 ASP 5 3HB ASP 5 18.776 -7.335 -5.989 272 H VAL 6 HN VAL 6 17.451 -9.372 -5.866 273 HA VAL 6 HA VAL 6 14.781 -8.164 -5.786 274 HB VAL 6 HB VAL 6 15.569 -11.053 -5.882 275 HG11 VAL 6 1HG1 VAL 6 12.995 -10.029 -4.635 276 HG12 VAL 6 2HG1 VAL 6 13.445 -11.730 -4.909 277 HG13 VAL 6 3HG1 VAL 6 14.356 -10.746 -3.740 278 HG21 VAL 6 3HG2 VAL 6 13.125 -10.776 -7.090 279 HG22 VAL 6 1HG2 VAL 6 13.863 -9.187 -7.401 280 HG23 VAL 6 2HG2 VAL 6 14.694 -10.671 -7.923 281 H TYR 7 HN TYR 7 14.283 -7.345 -3.811 282 HA TYR 7 HA TYR 7 15.982 -8.228 -1.575 283 HB2 TYR 7 2HB TYR 7 14.788 -5.613 -2.579 284 HB3 TYR 7 3HB TYR 7 14.979 -5.787 -0.847 285 HD1 TYR 7 HD1 TYR 7 17.269 -6.107 0.131 286 HD2 TYR 7 HD2 TYR 7 16.671 -5.201 -4.007 287 HE1 TYR 7 HE1 TYR 7 19.703 -5.397 -0.073 288 HE2 TYR 7 HE2 TYR 7 19.105 -4.495 -4.197 289 HH TYR 7 HH TYR 7 21.065 -4.023 -1.437 290 H LYS 8 HN LYS 8 14.927 -9.412 -0.067 291 HA LYS 8 HA LYS 8 12.054 -8.878 0.246 292 HB2 LYS 8 2HB LYS 8 12.362 -11.049 -0.747 293 HB3 LYS 8 3HB LYS 8 13.582 -11.486 0.432 294 HG2 LYS 8 2HG LYS 8 11.011 -10.612 1.641 295 HG3 LYS 8 3HG LYS 8 10.873 -12.054 0.654 296 HD2 LYS 8 2HD LYS 8 13.188 -11.921 2.576 297 HD3 LYS 8 3HD LYS 8 11.591 -12.147 3.262 298 HE2 LYS 8 2HE LYS 8 11.578 -14.330 2.642 299 HE3 LYS 8 3HE LYS 8 11.853 -13.897 0.967 300 HZ1 LYS 8 2HZ LYS 8 13.803 -14.692 2.978 301 HZ3 LYS 8 1HZ LYS 8 14.302 -13.539 1.942 302 H CYS 9 HN CYS 9 11.272 -8.502 2.311 303 HA CYS 9 HA CYS 9 13.284 -7.855 4.244 304 HB2 CYS 9 2HB CYS 9 11.275 -6.420 3.818 305 HB3 CYS 9 3HB CYS 9 10.265 -7.680 4.498 306 H GLU 10 HN GLU 10 13.655 -8.968 6.216 307 HA GLU 10 HA GLU 10 12.539 -11.638 6.243 308 HB2 GLU 10 2HB GLU 10 14.995 -10.335 7.408 309 HB3 GLU 10 3HB GLU 10 14.367 -11.768 8.197 310 HG2 GLU 10 2HG GLU 10 14.415 -12.144 5.295 311 HG3 GLU 10 3HG GLU 10 15.998 -11.665 5.873 312 H LEU 11 HN LEU 11 11.337 -8.862 7.211 313 HA LEU 11 HA LEU 11 10.705 -9.754 9.935 314 HB2 LEU 11 2HB LEU 11 11.817 -7.591 9.792 315 HB3 LEU 11 3HB LEU 11 10.587 -7.004 8.690 316 HG LEU 11 HG LEU 11 8.975 -6.815 10.350 317 HD11 LEU 11 1HD1 LEU 11 8.932 -7.945 12.458 318 HD12 LEU 11 2HD1 LEU 11 9.265 -9.150 11.192 319 HD13 LEU 11 3HD1 LEU 11 10.587 -8.559 12.227 320 HD21 LEU 11 3HD2 LEU 11 10.982 -6.248 12.374 321 HD22 LEU 11 1HD2 LEU 11 11.459 -5.632 10.772 322 HD23 LEU 11 2HD2 LEU 11 9.903 -5.144 11.487 323 H CYS 12 HN CYS 12 9.090 -7.765 7.358 324 HA CYS 12 HA CYS 12 6.591 -8.993 8.106 325 HB2 CYS 12 2HB CYS 12 5.671 -7.400 6.370 326 HB3 CYS 12 3HB CYS 12 6.391 -6.692 7.802 327 H GLY 13 HN GLY 13 8.894 -8.762 5.331 328 HA2 GLY 13 1HA GLY 13 9.268 -10.780 4.062 329 HA3 GLY 13 2HA GLY 13 7.550 -11.112 4.140 330 H GLN 14 HN GLN 14 8.488 -7.747 3.752 331 HA GLN 14 HA GLN 14 7.090 -7.568 1.349 332 HB2 GLN 14 2HB GLN 14 7.218 -5.643 2.794 333 HB3 GLN 14 3HB GLN 14 8.970 -5.670 2.803 334 HG2 GLN 14 2HG GLN 14 9.137 -4.614 0.764 335 HG3 GLN 14 3HG GLN 14 7.773 -5.477 0.084 336 HE21 GLN 14 1HE2 GLN 14 8.272 -3.323 2.882 337 HE22 GLN 14 2HE2 GLN 14 6.999 -2.203 2.526 338 H VAL 15 HN VAL 15 7.740 -8.298 -0.626 339 HA VAL 15 HA VAL 15 10.628 -8.397 -1.121 340 HB VAL 15 HB VAL 15 8.446 -9.812 -2.648 341 HG11 VAL 15 1HG1 VAL 15 11.205 -9.519 -3.076 342 HG12 VAL 15 2HG1 VAL 15 11.003 -11.163 -2.425 343 HG13 VAL 15 3HG1 VAL 15 10.104 -10.664 -3.877 344 HG21 VAL 15 3HG2 VAL 15 9.306 -11.826 -1.198 345 HG22 VAL 15 1HG2 VAL 15 9.746 -10.547 -0.040 346 HG23 VAL 15 2HG2 VAL 15 8.054 -10.732 -0.561 347 H VAL 16 HN VAL 16 11.536 -7.198 -2.755 348 HA VAL 16 HA VAL 16 9.726 -5.929 -4.655 349 HB VAL 16 HB VAL 16 10.322 -3.774 -4.167 350 HG11 VAL 16 1HG1 VAL 16 9.124 -5.023 -2.225 351 HG12 VAL 16 2HG1 VAL 16 10.668 -4.823 -1.362 352 HG13 VAL 16 3HG1 VAL 16 9.774 -3.393 -1.933 353 HG21 VAL 16 3HG2 VAL 16 12.697 -3.898 -4.284 354 HG22 VAL 16 1HG2 VAL 16 12.308 -3.182 -2.702 355 HG23 VAL 16 2HG2 VAL 16 12.791 -4.891 -2.811 356 H LYS 17 HN LYS 17 10.671 -5.571 -6.689 357 HA LYS 17 HA LYS 17 13.262 -6.883 -6.995 358 HB2 LYS 17 2HB LYS 17 11.898 -7.938 -8.482 359 HB3 LYS 17 3HB LYS 17 10.836 -6.558 -8.678 360 HG2 LYS 17 2HG LYS 17 12.007 -6.771 -10.763 361 HG3 LYS 17 3HG LYS 17 12.733 -5.397 -9.952 362 HD2 LYS 17 2HD LYS 17 14.758 -6.402 -10.081 363 HD3 LYS 17 3HD LYS 17 14.175 -7.694 -9.050 364 HE2 LYS 17 2HE LYS 17 13.181 -7.981 -11.808 365 HE3 LYS 17 3HE LYS 17 14.932 -7.925 -11.756 366 HZ1 LYS 17 2HZ LYS 17 13.230 -9.774 -10.171 367 HZ3 LYS 17 1HZ LYS 17 14.852 -9.698 -10.048 368 H VAL 18 HN VAL 18 15.062 -5.672 -7.176 369 HA VAL 18 HA VAL 18 14.798 -2.834 -7.484 370 HB VAL 18 HB VAL 18 17.022 -4.785 -6.986 371 HG11 VAL 18 1HG1 VAL 18 18.650 -2.942 -7.005 372 HG12 VAL 18 2HG1 VAL 18 17.935 -3.193 -8.615 373 HG13 VAL 18 3HG1 VAL 18 17.394 -1.833 -7.603 374 HG21 VAL 18 3HG2 VAL 18 16.124 -2.312 -5.470 375 HG22 VAL 18 1HG2 VAL 18 15.574 -3.970 -5.126 376 HG23 VAL 18 2HG2 VAL 18 17.290 -3.543 -4.929 377 H LEU 19 HN LEU 19 14.725 -1.761 -9.384 378 HA LEU 19 HA LEU 19 15.581 -3.233 -11.761 379 HB2 LEU 19 2HB LEU 19 14.145 -1.841 -13.007 380 HB3 LEU 19 3HB LEU 19 13.250 -2.404 -11.611 381 HG LEU 19 HG LEU 19 14.427 0.082 -10.886 382 HD11 LEU 19 1HD1 LEU 19 13.461 -0.015 -13.707 383 HD12 LEU 19 2HD1 LEU 19 13.024 1.399 -12.717 384 HD13 LEU 19 3HD1 LEU 19 14.735 0.977 -12.958 385 HD21 LEU 19 3HD2 LEU 19 11.539 -0.159 -11.631 386 HD22 LEU 19 1HD2 LEU 19 12.178 -1.158 -10.303 387 HD23 LEU 19 2HD2 LEU 19 12.300 0.615 -10.220 388 H GLU 20 HN GLU 20 16.063 -0.228 -9.867 389 HA GLU 20 HA GLU 20 18.445 0.194 -11.492 390 HB2 GLU 20 2HB GLU 20 16.716 1.879 -12.074 391 HB3 GLU 20 3HB GLU 20 16.584 2.346 -10.390 392 HG2 GLU 20 2HG GLU 20 18.767 3.302 -10.348 393 HG3 GLU 20 3HG GLU 20 19.283 2.429 -11.777 394 H GLU 21 HN GLU 21 20.037 -0.539 -10.109 395 HA GLU 21 HA GLU 21 19.911 -0.610 -7.411 396 HB2 GLU 21 2HB GLU 21 22.321 -0.919 -7.442 397 HB3 GLU 21 3HB GLU 21 21.647 -1.698 -8.860 398 HG2 GLU 21 2HG GLU 21 22.300 0.174 -10.291 399 HG3 GLU 21 3HG GLU 21 22.759 1.145 -8.906 400 H GLY 22 HN GLY 22 21.373 0.680 -5.811 401 HA2 GLY 22 1HA GLY 22 21.877 3.434 -6.483 402 HA3 GLY 22 2HA GLY 22 20.468 3.216 -5.464 403 H GLY 23 HN GLY 23 23.001 4.545 -4.753 404 HA2 GLY 23 1HA GLY 23 24.484 2.750 -3.063 405 HA3 GLY 23 2HA GLY 23 24.678 4.484 -3.220 406 H GLY 24 HN GLY 24 22.071 2.189 -2.116 407 HA2 GLY 24 1HA GLY 24 22.074 3.394 0.513 408 HA3 GLY 24 2HA GLY 24 20.655 3.759 -0.448 409 H THR 25 HN THR 25 19.948 2.434 1.701 410 HA THR 25 HA THR 25 19.706 -0.372 0.832 411 HB THR 25 HB THR 25 20.218 0.864 3.575 412 HG1 THR 25 HG1 THR 25 21.284 -1.430 2.097 413 HG21 THR 25 3HG2 THR 25 19.274 -1.961 2.860 414 HG22 THR 25 1HG2 THR 25 20.023 -1.525 4.416 415 HG23 THR 25 2HG2 THR 25 18.456 -0.817 3.953 416 H LEU 26 HN LEU 26 17.729 -1.471 1.775 417 HA LEU 26 HA LEU 26 15.521 0.457 1.626 418 HB2 LEU 26 2HB LEU 26 15.490 -2.503 1.026 419 HB3 LEU 26 3HB LEU 26 14.168 -1.372 0.809 420 HG LEU 26 HG LEU 26 16.794 -1.098 -0.666 421 HD11 LEU 26 1HD1 LEU 26 14.919 -2.044 -2.489 422 HD12 LEU 26 2HD1 LEU 26 16.297 -2.941 -1.809 423 HD13 LEU 26 3HD1 LEU 26 14.691 -3.070 -1.052 424 HD21 LEU 26 3HD2 LEU 26 15.915 0.831 -1.321 425 HD22 LEU 26 1HD2 LEU 26 14.647 -0.090 -2.168 426 HD23 LEU 26 2HD2 LEU 26 14.376 0.472 -0.501 427 H VAL 27 HN VAL 27 15.906 0.971 3.931 428 HA VAL 27 HA VAL 27 15.628 -1.090 5.864 429 HB VAL 27 HB VAL 27 15.472 1.925 6.002 430 HG11 VAL 27 1HG1 VAL 27 15.382 1.849 8.327 431 HG12 VAL 27 2HG1 VAL 27 14.262 0.549 7.855 432 HG13 VAL 27 3HG1 VAL 27 15.910 0.151 8.397 433 HG21 VAL 27 3HG2 VAL 27 17.705 0.201 7.063 434 HG22 VAL 27 1HG2 VAL 27 17.651 0.665 5.345 435 HG23 VAL 27 2HG2 VAL 27 17.724 1.921 6.605 436 H CYS 28 HN CYS 28 13.767 -2.264 5.950 437 HA CYS 28 HA CYS 28 11.275 -0.736 5.763 438 HB2 CYS 28 2HB CYS 28 11.492 -2.371 3.991 439 HB3 CYS 28 3HB CYS 28 11.832 -3.643 5.147 440 H CYS 29 HN CYS 29 9.968 -0.703 7.589 441 HA CYS 29 HA CYS 29 9.524 -0.863 9.750 442 HB2 CYS 29 2HB CYS 29 8.933 -3.100 10.537 443 HB3 CYS 29 3HB CYS 29 8.308 -2.768 8.933 444 H GLY 30 HN GLY 30 12.067 -0.022 9.616 445 HA2 GLY 30 1HA GLY 30 14.088 0.004 10.604 446 HA3 GLY 30 2HA GLY 30 13.277 -0.733 11.970 447 H GLU 31 HN GLU 31 13.894 -2.037 8.640 448 HA GLU 31 HA GLU 31 15.899 -3.783 9.660 449 HB2 GLU 31 2HB GLU 31 13.428 -4.764 10.074 450 HB3 GLU 31 3HB GLU 31 13.592 -5.244 8.397 451 HG2 GLU 31 2HG GLU 31 15.839 -6.304 9.007 452 HG3 GLU 31 3HG GLU 31 15.471 -5.972 10.689 453 H ASP 32 HN ASP 32 17.422 -3.556 8.082 454 HA ASP 32 HA ASP 32 16.807 -2.651 5.546 455 HB2 ASP 32 2HB ASP 32 19.034 -2.281 6.076 456 HB3 ASP 32 3HB ASP 32 19.190 -3.793 6.948 457 H MET 33 HN MET 33 16.016 -3.785 3.760 458 HA MET 33 HA MET 33 15.304 -6.436 3.957 459 HB2 MET 33 2HB MET 33 14.778 -4.350 2.245 460 HB3 MET 33 3HB MET 33 15.872 -5.273 1.232 461 HG2 MET 33 2HG MET 33 14.447 -7.200 1.237 462 HG3 MET 33 3HG MET 33 13.547 -6.644 2.634 463 HE1 MET 33 3HE MET 33 12.692 -4.265 2.671 464 HE2 MET 33 1HE MET 33 13.135 -3.229 1.294 465 HE3 MET 33 2HE MET 33 11.456 -3.785 1.484 466 H VAL 34 HN VAL 34 16.099 -8.363 2.853 467 HA VAL 34 HA VAL 34 18.998 -8.232 2.451 468 HB VAL 34 HB VAL 34 19.115 -10.440 3.167 469 HG11 VAL 34 1HG1 VAL 34 18.801 -9.296 5.145 470 HG12 VAL 34 2HG1 VAL 34 17.138 -8.811 4.731 471 HG13 VAL 34 3HG1 VAL 34 17.479 -10.485 5.236 472 HG21 VAL 34 3HG2 VAL 34 17.510 -11.583 1.889 473 HG22 VAL 34 1HG2 VAL 34 16.964 -11.802 3.569 474 HG23 VAL 34 2HG2 VAL 34 16.168 -10.602 2.524 475 H LYS 35 HN LYS 35 19.869 -9.764 0.736 476 HA LYS 35 HA LYS 35 18.233 -9.412 -1.637 477 HB2 LYS 35 2HB LYS 35 20.784 -8.820 -1.286 478 HB3 LYS 35 3HB LYS 35 21.023 -10.514 -1.664 479 HG2 LYS 35 2HG LYS 35 19.160 -8.976 -3.456 480 HG3 LYS 35 3HG LYS 35 20.867 -8.595 -3.577 481 HD2 LYS 35 2HD LYS 35 21.447 -10.836 -4.198 482 HD3 LYS 35 3HD LYS 35 19.917 -11.482 -3.640 483 HE2 LYS 35 2HE LYS 35 19.428 -9.427 -5.649 484 HE3 LYS 35 3HE LYS 35 20.571 -10.598 -6.276 485 HZ1 LYS 35 2HZ LYS 35 17.871 -11.180 -5.195 486 HZ3 LYS 35 1HZ LYS 35 18.954 -12.354 -5.512 487 H GLN 36 HN GLN 36 17.675 -11.141 -3.062 488 HA GLN 36 HA GLN 36 17.672 -13.700 -1.666 489 HB2 GLN 36 2HB GLN 36 15.822 -12.851 -3.932 490 HB3 GLN 36 3HB GLN 36 15.644 -14.244 -2.883 491 HG2 GLN 36 2HG GLN 36 15.686 -11.402 -1.784 492 HG3 GLN 36 3HG GLN 36 14.204 -12.157 -2.335 493 HE21 GLN 36 1HE2 GLN 36 16.753 -12.153 0.028 494 HE22 GLN 36 2HE2 GLN 36 16.022 -13.204 1.195 Start of MODEL 4 1 H1 ALA 1 HN ALA 1 3.748 -3.712 0.133 2 HA ALA 1 HA ALA 1 2.948 -1.647 0.130 3 HB1 ALA 1 1HB ALA 1 4.338 0.167 -1.004 4 HB2 ALA 1 2HB ALA 1 5.181 -0.785 0.241 5 HB3 ALA 1 3HB ALA 1 5.469 -1.121 -1.483 6 H ASN 2 HN ASN 2 1.239 -2.883 -1.134 7 HA ASN 2 HA ASN 2 -0.221 -2.968 -2.732 8 HB2 ASN 2 2HB ASN 2 1.066 -0.319 -3.562 9 HB3 ASN 2 3HB ASN 2 -0.371 -0.953 -4.342 10 HD21 ASN 2 1HD2 ASN 2 -2.130 -0.022 -3.663 11 HD22 ASN 2 2HD2 ASN 2 -2.511 0.469 -2.046 12 H GLU 3 HN GLU 3 0.432 -4.789 -3.967 13 HA GLU 3 HA GLU 3 2.678 -5.096 -5.388 14 HB2 GLU 3 2HB GLU 3 -0.101 -6.124 -6.111 15 HB3 GLU 3 3HB GLU 3 1.393 -6.765 -6.764 16 HG2 GLU 3 2HG GLU 3 2.149 -7.234 -4.371 17 HG3 GLU 3 3HG GLU 3 0.552 -6.756 -3.828 18 H GLY 4 HN GLY 4 3.221 -4.977 -7.711 19 HA2 GLY 4 1HA GLY 4 3.337 -3.938 -9.700 20 HA3 GLY 4 2HA GLY 4 1.614 -3.639 -9.592 21 H ASP 5 HN ASP 5 4.142 -2.524 -7.271 22 HA ASP 5 HA ASP 5 3.440 0.187 -8.085 23 HB2 ASP 5 2HB ASP 5 3.879 -1.102 -5.405 24 HB3 ASP 5 3HB ASP 5 4.458 0.542 -5.585 25 H VAL 6 HN VAL 6 5.302 1.800 -7.705 26 HA VAL 6 HA VAL 6 7.913 0.467 -7.796 27 HB VAL 6 HB VAL 6 6.724 2.484 -9.680 28 HG11 VAL 6 1HG1 VAL 6 9.542 2.046 -10.180 29 HG12 VAL 6 2HG1 VAL 6 8.647 3.573 -9.995 30 HG13 VAL 6 3HG1 VAL 6 9.295 2.743 -8.560 31 HG21 VAL 6 3HG2 VAL 6 6.688 0.739 -11.065 32 HG22 VAL 6 1HG2 VAL 6 8.454 0.580 -10.917 33 HG23 VAL 6 2HG2 VAL 6 7.385 -0.295 -9.794 34 H TYR 7 HN TYR 7 9.487 1.418 -6.539 35 HA TYR 7 HA TYR 7 8.735 3.971 -5.282 36 HB2 TYR 7 2HB TYR 7 9.813 1.296 -4.303 37 HB3 TYR 7 3HB TYR 7 10.367 2.731 -3.465 38 HD1 TYR 7 HD1 TYR 7 8.776 4.135 -2.183 39 HD2 TYR 7 HD2 TYR 7 7.537 0.497 -4.063 40 HE1 TYR 7 HE1 TYR 7 6.663 4.115 -0.770 41 HE2 TYR 7 HE2 TYR 7 5.427 0.491 -2.644 42 HH TYR 7 HH TYR 7 5.071 2.454 0.061 43 H LYS 8 HN LYS 8 10.151 5.594 -5.673 44 HA LYS 8 HA LYS 8 12.875 4.798 -6.436 45 HB2 LYS 8 2HB LYS 8 12.156 5.774 -8.367 46 HB3 LYS 8 3HB LYS 8 10.968 6.781 -7.566 47 HG2 LYS 8 2HG LYS 8 12.687 8.278 -8.329 48 HG3 LYS 8 3HG LYS 8 12.906 8.144 -6.595 49 HD2 LYS 8 2HD LYS 8 14.932 7.085 -6.798 50 HD3 LYS 8 3HD LYS 8 14.393 6.085 -8.131 51 HE2 LYS 8 2HE LYS 8 16.059 7.528 -9.068 52 HE3 LYS 8 3HE LYS 8 14.529 8.183 -9.616 53 HZ1 LYS 8 2HZ LYS 8 15.340 9.281 -7.089 54 HZ3 LYS 8 1HZ LYS 8 14.889 10.063 -8.445 55 H CYS 9 HN CYS 9 14.580 5.634 -5.287 56 HA CYS 9 HA CYS 9 13.923 6.907 -2.829 57 HB2 CYS 9 2HB CYS 9 15.715 5.226 -2.979 58 HB3 CYS 9 3HB CYS 9 16.624 6.266 -4.057 59 H GLU 10 HN GLU 10 14.596 9.067 -2.179 60 HA GLU 10 HA GLU 10 14.901 10.810 -4.485 61 HB2 GLU 10 2HB GLU 10 13.687 11.156 -1.741 62 HB3 GLU 10 3HB GLU 10 14.267 12.572 -2.594 63 HG2 GLU 10 2HG GLU 10 12.649 10.761 -4.299 64 HG3 GLU 10 3HG GLU 10 11.761 11.396 -2.928 65 H LEU 11 HN LEU 11 17.129 9.253 -3.299 66 HA LEU 11 HA LEU 11 18.799 11.539 -2.553 67 HB2 LEU 11 2HB LEU 11 18.131 9.230 -0.923 68 HB3 LEU 11 3HB LEU 11 19.858 9.353 -1.191 69 HG LEU 11 HG LEU 11 18.782 11.948 -0.502 70 HD11 LEU 11 1HD1 LEU 11 17.599 9.699 0.912 71 HD12 LEU 11 2HD1 LEU 11 18.499 10.777 2.007 72 HD13 LEU 11 3HD1 LEU 11 17.203 11.433 0.978 73 HD21 LEU 11 3HD2 LEU 11 20.961 11.922 0.017 74 HD22 LEU 11 1HD2 LEU 11 20.423 11.201 1.553 75 HD23 LEU 11 2HD2 LEU 11 20.996 10.156 0.232 76 H CYS 12 HN CYS 12 19.111 7.964 -3.150 77 HA CYS 12 HA CYS 12 21.431 8.500 -4.758 78 HB2 CYS 12 2HB CYS 12 21.539 6.032 -4.961 79 HB3 CYS 12 3HB CYS 12 21.579 6.627 -3.313 80 H GLY 13 HN GLY 13 18.108 7.075 -5.121 81 HA2 GLY 13 1HA GLY 13 16.803 7.784 -7.025 82 HA3 GLY 13 2HA GLY 13 18.257 7.726 -8.002 83 H GLN 14 HN GLN 14 17.432 5.293 -5.497 84 HA GLN 14 HA GLN 14 17.681 3.256 -7.463 85 HB2 GLN 14 2HB GLN 14 18.577 2.960 -5.179 86 HB3 GLN 14 3HB GLN 14 16.970 3.132 -4.499 87 HG2 GLN 14 2HG GLN 14 16.334 1.124 -6.083 88 HG3 GLN 14 3HG GLN 14 18.061 0.861 -6.195 89 HE21 GLN 14 1HE2 GLN 14 18.563 1.927 -3.507 90 HE22 GLN 14 2HE2 GLN 14 18.085 0.705 -2.378 91 H VAL 15 HN VAL 15 16.052 2.382 -8.672 92 HA VAL 15 HA VAL 15 13.315 2.959 -7.784 93 HB VAL 15 HB VAL 15 14.308 2.284 -10.556 94 HG11 VAL 15 1HG1 VAL 15 12.151 2.145 -11.099 95 HG12 VAL 15 2HG1 VAL 15 11.697 2.448 -9.404 96 HG13 VAL 15 3HG1 VAL 15 11.896 3.813 -10.529 97 HG21 VAL 15 3HG2 VAL 15 13.542 5.049 -9.606 98 HG22 VAL 15 1HG2 VAL 15 15.218 4.455 -9.527 99 HG23 VAL 15 2HG2 VAL 15 14.390 4.574 -11.098 100 H VAL 16 HN VAL 16 12.309 1.269 -6.835 101 HA VAL 16 HA VAL 16 13.022 -1.406 -7.826 102 HB VAL 16 HB VAL 16 13.012 -2.250 -5.695 103 HG11 VAL 16 1HG1 VAL 16 14.881 -0.615 -6.035 104 HG12 VAL 16 2HG1 VAL 16 13.918 0.597 -5.159 105 HG13 VAL 16 3HG1 VAL 16 14.453 -0.884 -4.329 106 HG21 VAL 16 3HG2 VAL 16 10.797 -1.443 -5.036 107 HG22 VAL 16 1HG2 VAL 16 11.978 -1.176 -3.731 108 HG23 VAL 16 2HG2 VAL 16 11.459 0.186 -4.752 109 H LYS 17 HN LYS 17 11.279 -2.948 -7.972 110 HA LYS 17 HA LYS 17 8.654 -1.628 -8.045 111 HB2 LYS 17 2HB LYS 17 8.713 -2.137 -10.222 112 HB3 LYS 17 3HB LYS 17 10.111 -3.178 -10.038 113 HG2 LYS 17 2HG LYS 17 8.211 -4.519 -10.812 114 HG3 LYS 17 3HG LYS 17 8.632 -5.011 -9.184 115 HD2 LYS 17 2HD LYS 17 6.341 -4.788 -8.909 116 HD3 LYS 17 3HD LYS 17 6.823 -3.151 -8.505 117 HE2 LYS 17 2HE LYS 17 5.253 -2.599 -10.098 118 HE3 LYS 17 3HE LYS 17 6.592 -2.854 -11.198 119 HZ1 LYS 17 2HZ LYS 17 5.795 -4.988 -11.745 120 HZ3 LYS 17 1HZ LYS 17 4.426 -4.108 -11.668 121 H VAL 18 HN VAL 18 7.372 -2.257 -6.401 122 HA VAL 18 HA VAL 18 8.005 -4.483 -4.802 123 HB VAL 18 HB VAL 18 5.561 -2.726 -5.052 124 HG11 VAL 18 1HG1 VAL 18 4.729 -3.654 -2.992 125 HG12 VAL 18 2HG1 VAL 18 5.004 -4.991 -4.135 126 HG13 VAL 18 3HG1 VAL 18 6.166 -4.691 -2.820 127 HG21 VAL 18 3HG2 VAL 18 7.455 -2.750 -2.721 128 HG22 VAL 18 1HG2 VAL 18 7.921 -1.907 -4.219 129 HG23 VAL 18 2HG2 VAL 18 6.440 -1.432 -3.352 130 H LEU 19 HN LEU 19 7.666 -6.607 -5.185 131 HA LEU 19 HA LEU 19 5.856 -7.297 -7.357 132 HB2 LEU 19 2HB LEU 19 6.924 -9.471 -7.273 133 HB3 LEU 19 3HB LEU 19 8.091 -8.179 -7.468 134 HG LEU 19 HG LEU 19 7.793 -8.756 -4.663 135 HD11 LEU 19 1HD1 LEU 19 7.070 -10.946 -5.088 136 HD12 LEU 19 2HD1 LEU 19 8.180 -11.145 -6.466 137 HD13 LEU 19 3HD1 LEU 19 8.821 -11.093 -4.806 138 HD21 LEU 19 3HD2 LEU 19 10.308 -9.573 -5.358 139 HD22 LEU 19 1HD2 LEU 19 9.902 -8.470 -6.695 140 HD23 LEU 19 2HD2 LEU 19 9.832 -7.894 -5.012 141 H GLU 20 HN GLU 20 6.351 -7.717 -3.829 142 HA GLU 20 HA GLU 20 3.569 -8.442 -3.666 143 HB2 GLU 20 2HB GLU 20 4.182 -10.340 -2.042 144 HB3 GLU 20 3HB GLU 20 4.443 -10.652 -3.746 145 HG2 GLU 20 2HG GLU 20 6.868 -9.911 -3.430 146 HG3 GLU 20 3HG GLU 20 6.560 -9.832 -1.706 147 H GLU 21 HN GLU 21 2.712 -7.055 -2.185 148 HA GLU 21 HA GLU 21 4.277 -5.451 -0.594 149 HB2 GLU 21 2HB GLU 21 2.146 -4.592 -0.976 150 HB3 GLU 21 3HB GLU 21 1.355 -6.137 -0.733 151 HG2 GLU 21 2HG GLU 21 1.740 -6.001 1.704 152 HG3 GLU 21 3HG GLU 21 2.664 -4.525 1.508 153 H GLY 22 HN GLY 22 4.394 -5.343 1.820 154 HA2 GLY 22 1HA GLY 22 4.232 -8.027 3.053 155 HA3 GLY 22 2HA GLY 22 5.629 -6.986 3.246 156 H GLY 23 HN GLY 23 5.155 -4.686 4.120 157 HA2 GLY 23 1HA GLY 23 3.015 -3.692 5.309 158 HA3 GLY 23 2HA GLY 23 3.391 -4.988 6.427 159 H GLY 24 HN GLY 24 5.420 -2.652 4.506 160 HA2 GLY 24 1HA GLY 24 6.305 -1.298 6.880 161 HA3 GLY 24 2HA GLY 24 7.512 -2.388 6.229 162 H THR 25 HN THR 25 8.666 -0.195 5.977 163 HA THR 25 HA THR 25 7.947 0.924 3.348 164 HB THR 25 HB THR 25 8.859 2.307 5.920 165 HG1 THR 25 HG1 THR 25 6.533 1.765 5.355 166 HG21 THR 25 3HG2 THR 25 8.658 3.336 3.047 167 HG22 THR 25 1HG2 THR 25 8.587 4.411 4.464 168 HG23 THR 25 2HG2 THR 25 10.056 3.460 4.141 169 H LEU 26 HN LEU 26 9.842 1.980 2.233 170 HA LEU 26 HA LEU 26 12.210 0.322 2.750 171 HB2 LEU 26 2HB LEU 26 11.575 1.637 0.129 172 HB3 LEU 26 3HB LEU 26 12.654 0.297 0.460 173 HG LEU 26 HG LEU 26 9.683 0.027 0.894 174 HD11 LEU 26 1HD1 LEU 26 9.453 0.551 -1.295 175 HD12 LEU 26 2HD1 LEU 26 11.148 0.170 -1.686 176 HD13 LEU 26 3HD1 LEU 26 9.960 -1.143 -1.506 177 HD21 LEU 26 3HD2 LEU 26 10.109 -2.337 0.585 178 HD22 LEU 26 1HD2 LEU 26 11.818 -2.012 0.206 179 HD23 LEU 26 2HD2 LEU 26 11.191 -1.685 1.840 180 H VAL 27 HN VAL 27 12.847 1.891 4.432 181 HA VAL 27 HA VAL 27 13.329 4.589 3.668 182 HB VAL 27 HB VAL 27 14.198 2.913 6.029 183 HG11 VAL 27 1HG1 VAL 27 14.662 5.130 7.122 184 HG12 VAL 27 2HG1 VAL 27 15.791 4.698 5.815 185 HG13 VAL 27 3HG1 VAL 27 14.502 5.889 5.519 186 HG21 VAL 27 3HG2 VAL 27 12.465 4.481 7.157 187 HG22 VAL 27 1HG2 VAL 27 11.878 4.767 5.501 188 HG23 VAL 27 2HG2 VAL 27 11.875 3.119 6.175 189 H CYS 28 HN CYS 28 14.793 5.027 2.084 190 HA CYS 28 HA CYS 28 17.359 3.626 2.304 191 HB2 CYS 28 2HB CYS 28 15.964 3.061 0.282 192 HB3 CYS 28 3HB CYS 28 16.145 4.725 -0.236 193 H CYS 29 HN CYS 29 19.195 4.956 2.403 194 HA CYS 29 HA CYS 29 20.389 6.776 2.677 195 HB2 CYS 29 2HB CYS 29 18.428 7.901 0.675 196 HB3 CYS 29 3HB CYS 29 19.790 8.818 1.289 197 H GLY 30 HN GLY 30 18.157 6.122 4.500 198 HA2 GLY 30 1HA GLY 30 17.189 7.006 6.327 199 HA3 GLY 30 2HA GLY 30 18.137 8.458 6.076 200 H GLU 31 HN GLU 31 16.073 7.295 3.448 201 HA GLU 31 HA GLU 31 14.008 9.167 4.241 202 HB2 GLU 31 2HB GLU 31 15.628 10.362 2.722 203 HB3 GLU 31 3HB GLU 31 15.289 9.182 1.473 204 HG2 GLU 31 2HG GLU 31 13.413 10.297 0.863 205 HG3 GLU 31 3HG GLU 31 12.766 10.173 2.487 206 H ASP 32 HN ASP 32 12.007 8.250 3.998 207 HA ASP 32 HA ASP 32 11.770 5.653 3.115 208 HB2 ASP 32 2HB ASP 32 9.498 7.679 3.114 209 HB3 ASP 32 3HB ASP 32 9.389 5.957 3.415 210 H MET 33 HN MET 33 11.904 4.938 0.983 211 HA MET 33 HA MET 33 12.105 6.485 -1.192 212 HB2 MET 33 2HB MET 33 12.141 3.804 -0.699 213 HB3 MET 33 3HB MET 33 10.569 3.892 -1.468 214 HG2 MET 33 2HG MET 33 11.480 4.719 -3.522 215 HG3 MET 33 3HG MET 33 12.988 5.198 -2.767 216 HE1 MET 33 3HE MET 33 13.488 1.862 -1.057 217 HE2 MET 33 1HE MET 33 14.927 2.249 -2.032 218 HE3 MET 33 2HE MET 33 14.052 3.545 -1.182 219 H VAL 34 HN VAL 34 10.738 7.345 -2.819 220 HA VAL 34 HA VAL 34 7.995 7.723 -1.928 221 HB VAL 34 HB VAL 34 7.980 9.633 -3.196 222 HG11 VAL 34 1HG1 VAL 34 9.865 10.879 -2.587 223 HG12 VAL 34 2HG1 VAL 34 9.856 9.541 -1.413 224 HG13 VAL 34 3HG1 VAL 34 10.969 9.499 -2.803 225 HG21 VAL 34 3HG2 VAL 34 9.949 8.215 -4.976 226 HG22 VAL 34 1HG2 VAL 34 8.392 8.974 -5.384 227 HG23 VAL 34 2HG2 VAL 34 9.812 9.989 -5.031 228 H LYS 35 HN LYS 35 6.217 7.568 -3.575 229 HA LYS 35 HA LYS 35 6.588 5.111 -5.067 230 HB2 LYS 35 2HB LYS 35 4.246 6.698 -4.075 231 HB3 LYS 35 3HB LYS 35 4.014 5.612 -5.429 232 HG2 LYS 35 2HG LYS 35 5.573 4.162 -3.525 233 HG3 LYS 35 3HG LYS 35 4.323 4.972 -2.602 234 HD2 LYS 35 2HD LYS 35 2.812 4.066 -4.692 235 HD3 LYS 35 3HD LYS 35 4.063 2.838 -4.692 236 HE2 LYS 35 2HE LYS 35 3.116 3.446 -1.964 237 HE3 LYS 35 3HE LYS 35 1.813 2.913 -3.007 238 HZ1 LYS 35 2HZ LYS 35 3.202 0.966 -3.599 239 HZ3 LYS 35 1HZ LYS 35 2.897 1.008 -2.000 240 H GLN 36 HN GLN 36 5.845 4.933 -7.337 241 HA GLN 36 HA GLN 36 6.258 7.477 -8.708 242 HB2 GLN 36 2HB GLN 36 7.036 4.702 -9.705 243 HB3 GLN 36 3HB GLN 36 7.329 6.214 -10.540 244 HG2 GLN 36 2HG GLN 36 8.415 5.633 -7.748 245 HG3 GLN 36 3HG GLN 36 9.311 5.265 -9.209 246 HE21 GLN 36 1HE2 GLN 36 8.214 7.688 -7.033 247 HE22 GLN 36 2HE2 GLN 36 9.006 9.061 -7.731 248 H1 ALA 1 HN ALA 1 23.415 -1.793 -4.402 249 HA ALA 1 HA ALA 1 23.343 -4.694 -4.850 250 HB1 ALA 1 1HB ALA 1 21.090 -4.800 -4.492 251 HB2 ALA 1 2HB ALA 1 21.407 -3.383 -3.464 252 HB3 ALA 1 3HB ALA 1 20.805 -3.162 -5.124 253 H ASN 2 HN ASN 2 22.270 -5.210 -7.025 254 HA ASN 2 HA ASN 2 22.840 -3.040 -8.884 255 HB2 ASN 2 2HB ASN 2 23.574 -4.895 -10.506 256 HB3 ASN 2 3HB ASN 2 24.658 -4.617 -9.158 257 HD21 ASN 2 1HD2 ASN 2 25.522 -6.632 -9.116 258 HD22 ASN 2 2HD2 ASN 2 24.666 -8.060 -8.641 259 H GLU 3 HN GLU 3 21.505 -3.157 -10.903 260 HA GLU 3 HA GLU 3 18.894 -3.632 -10.487 261 HB2 GLU 3 2HB GLU 3 20.425 -3.816 -13.119 262 HB3 GLU 3 3HB GLU 3 18.683 -3.672 -13.004 263 HG2 GLU 3 2HG GLU 3 18.889 -1.500 -11.852 264 HG3 GLU 3 3HG GLU 3 20.633 -1.659 -11.789 265 H GLY 4 HN GLY 4 17.377 -5.290 -11.418 266 HA2 GLY 4 1HA GLY 4 16.705 -7.407 -11.797 267 HA3 GLY 4 2HA GLY 4 18.340 -7.816 -12.279 268 H ASP 5 HN ASP 5 17.402 -6.406 -9.104 269 HA ASP 5 HA ASP 5 18.278 -8.924 -7.923 270 HB2 ASP 5 2HB ASP 5 18.877 -6.092 -7.347 271 HB3 ASP 5 3HB ASP 5 18.339 -6.950 -5.916 272 H VAL 6 HN VAL 6 17.218 -9.258 -5.628 273 HA VAL 6 HA VAL 6 14.525 -8.102 -5.566 274 HB VAL 6 HB VAL 6 15.357 -10.982 -5.590 275 HG11 VAL 6 1HG1 VAL 6 12.787 -9.950 -4.343 276 HG12 VAL 6 2HG1 VAL 6 13.231 -11.654 -4.599 277 HG13 VAL 6 3HG1 VAL 6 14.158 -10.655 -3.454 278 HG21 VAL 6 3HG2 VAL 6 14.102 -9.308 -7.416 279 HG22 VAL 6 1HG2 VAL 6 14.124 -11.087 -7.459 280 HG23 VAL 6 2HG2 VAL 6 12.757 -10.232 -6.704 281 H TYR 7 HN TYR 7 13.899 -7.396 -3.560 282 HA TYR 7 HA TYR 7 15.642 -8.180 -1.322 283 HB2 TYR 7 2HB TYR 7 14.559 -5.557 -2.415 284 HB3 TYR 7 3HB TYR 7 14.681 -5.688 -0.671 285 HD1 TYR 7 HD1 TYR 7 16.969 -6.248 0.348 286 HD2 TYR 7 HD2 TYR 7 16.459 -5.051 -3.729 287 HE1 TYR 7 HE1 TYR 7 19.429 -5.621 0.217 288 HE2 TYR 7 HE2 TYR 7 18.921 -4.428 -3.846 289 HH TYR 7 HH TYR 7 21.132 -5.351 -1.408 290 H LYS 8 HN LYS 8 14.539 -9.306 0.195 291 HA LYS 8 HA LYS 8 11.684 -8.668 0.484 292 HB2 LYS 8 2HB LYS 8 11.144 -10.868 0.576 293 HB3 LYS 8 3HB LYS 8 12.571 -11.014 -0.429 294 HG2 LYS 8 2HG LYS 8 13.066 -12.602 1.203 295 HG3 LYS 8 3HG LYS 8 13.847 -11.197 1.902 296 HD2 LYS 8 2HD LYS 8 12.556 -11.451 3.747 297 HD3 LYS 8 3HD LYS 8 11.152 -11.043 2.780 298 HE2 LYS 8 2HE LYS 8 11.833 -13.785 2.201 299 HE3 LYS 8 3HE LYS 8 11.847 -13.596 3.944 300 HZ1 LYS 8 2HZ LYS 8 9.616 -13.960 3.555 301 HZ3 LYS 8 1HZ LYS 8 9.598 -13.235 2.097 302 H CYS 9 HN CYS 9 10.937 -8.147 2.514 303 HA CYS 9 HA CYS 9 12.929 -7.518 4.440 304 HB2 CYS 9 2HB CYS 9 10.987 -6.064 4.105 305 HB3 CYS 9 3HB CYS 9 9.901 -7.354 4.584 306 H GLU 10 HN GLU 10 13.197 -8.507 6.537 307 HA GLU 10 HA GLU 10 12.259 -11.249 6.557 308 HB2 GLU 10 2HB GLU 10 14.588 -9.778 7.753 309 HB3 GLU 10 3HB GLU 10 13.986 -11.165 8.638 310 HG2 GLU 10 2HG GLU 10 14.273 -11.618 5.708 311 HG3 GLU 10 3HG GLU 10 15.783 -11.292 6.536 312 H LEU 11 HN LEU 11 10.396 -9.068 7.141 313 HA LEU 11 HA LEU 11 9.671 -9.914 9.831 314 HB2 LEU 11 2HB LEU 11 10.906 -7.883 10.206 315 HB3 LEU 11 3HB LEU 11 9.994 -7.038 8.971 316 HG LEU 11 HG LEU 11 8.025 -6.988 10.293 317 HD11 LEU 11 1HD1 LEU 11 9.354 -8.770 12.349 318 HD12 LEU 11 2HD1 LEU 11 7.677 -8.172 12.345 319 HD13 LEU 11 3HD1 LEU 11 8.209 -9.341 11.112 320 HD21 LEU 11 3HD2 LEU 11 9.366 -6.333 12.657 321 HD22 LEU 11 1HD2 LEU 11 10.540 -6.021 11.356 322 HD23 LEU 11 2HD2 LEU 11 8.939 -5.242 11.317 323 H CYS 12 HN CYS 12 8.426 -7.303 7.667 324 HA CYS 12 HA CYS 12 5.804 -8.268 7.894 325 HB2 CYS 12 2HB CYS 12 5.298 -6.606 6.114 326 HB3 CYS 12 3HB CYS 12 6.122 -5.956 7.517 327 H GLY 13 HN GLY 13 8.390 -8.484 5.372 328 HA2 GLY 13 1HA GLY 13 8.664 -10.475 4.118 329 HA3 GLY 13 2HA GLY 13 6.937 -10.763 4.198 330 H GLN 14 HN GLN 14 8.285 -7.514 3.582 331 HA GLN 14 HA GLN 14 6.832 -7.436 1.136 332 HB2 GLN 14 2HB GLN 14 6.830 -5.454 2.527 333 HB3 GLN 14 3HB GLN 14 8.581 -5.419 2.600 334 HG2 GLN 14 2HG GLN 14 8.790 -4.738 0.321 335 HG3 GLN 14 3HG GLN 14 7.162 -5.249 -0.079 336 HE21 GLN 14 1HE2 GLN 14 8.516 -3.308 2.583 337 HE22 GLN 14 2HE2 GLN 14 7.549 -1.891 2.337 338 H VAL 15 HN VAL 15 7.624 -8.189 -0.776 339 HA VAL 15 HA VAL 15 10.544 -8.183 -1.091 340 HB VAL 15 HB VAL 15 8.618 -9.847 -2.687 341 HG11 VAL 15 1HG1 VAL 15 11.421 -9.480 -2.678 342 HG12 VAL 15 2HG1 VAL 15 11.124 -11.094 -1.988 343 HG13 VAL 15 3HG1 VAL 15 10.477 -10.681 -3.594 344 HG21 VAL 15 3HG2 VAL 15 9.172 -10.087 0.170 345 HG22 VAL 15 1HG2 VAL 15 7.973 -10.932 -0.838 346 HG23 VAL 15 2HG2 VAL 15 9.639 -11.546 -0.734 347 H VAL 16 HN VAL 16 11.419 -6.864 -2.614 348 HA VAL 16 HA VAL 16 9.630 -5.915 -4.732 349 HB VAL 16 HB VAL 16 10.276 -3.684 -4.437 350 HG11 VAL 16 1HG1 VAL 16 8.580 -4.396 -2.834 351 HG12 VAL 16 2HG1 VAL 16 9.845 -4.870 -1.674 352 HG13 VAL 16 3HG1 VAL 16 9.632 -3.157 -2.110 353 HG21 VAL 16 3HG2 VAL 16 12.652 -3.952 -4.070 354 HG22 VAL 16 1HG2 VAL 16 11.971 -2.955 -2.761 355 HG23 VAL 16 2HG2 VAL 16 12.365 -4.667 -2.466 356 H LYS 17 HN LYS 17 10.564 -5.852 -6.761 357 HA LYS 17 HA LYS 17 13.273 -6.923 -6.879 358 HB2 LYS 17 2HB LYS 17 11.519 -8.129 -8.090 359 HB3 LYS 17 3HB LYS 17 11.109 -6.684 -8.992 360 HG2 LYS 17 2HG LYS 17 13.977 -7.640 -9.028 361 HG3 LYS 17 3HG LYS 17 12.797 -8.503 -9.993 362 HD2 LYS 17 2HD LYS 17 12.099 -6.153 -10.902 363 HD3 LYS 17 3HD LYS 17 13.596 -5.575 -10.199 364 HE2 LYS 17 2HE LYS 17 14.663 -7.641 -11.514 365 HE3 LYS 17 3HE LYS 17 13.203 -7.529 -12.477 366 HZ1 LYS 17 2HZ LYS 17 14.820 -6.114 -13.479 367 HZ3 LYS 17 1HZ LYS 17 15.218 -5.390 -12.076 368 H VAL 18 HN VAL 18 14.913 -5.494 -6.994 369 HA VAL 18 HA VAL 18 14.460 -2.779 -7.624 370 HB VAL 18 HB VAL 18 16.953 -4.457 -7.310 371 HG11 VAL 18 1HG1 VAL 18 18.059 -2.775 -8.300 372 HG12 VAL 18 2HG1 VAL 18 16.633 -1.711 -8.279 373 HG13 VAL 18 3HG1 VAL 18 17.680 -1.824 -6.844 374 HG21 VAL 18 3HG2 VAL 18 15.556 -4.221 -5.291 375 HG22 VAL 18 1HG2 VAL 18 17.116 -3.378 -5.122 376 HG23 VAL 18 2HG2 VAL 18 15.633 -2.450 -5.450 377 H LEU 19 HN LEU 19 14.288 -1.811 -9.577 378 HA LEU 19 HA LEU 19 15.084 -3.399 -11.900 379 HB2 LEU 19 2HB LEU 19 13.593 -1.995 -13.164 380 HB3 LEU 19 3HB LEU 19 12.762 -2.716 -11.801 381 HG LEU 19 HG LEU 19 13.849 -0.051 -11.212 382 HD11 LEU 19 1HD1 LEU 19 12.463 -0.447 -13.730 383 HD12 LEU 19 2HD1 LEU 19 11.557 0.640 -12.648 384 HD13 LEU 19 3HD1 LEU 19 13.246 1.009 -13.069 385 HD21 LEU 19 3HD2 LEU 19 12.059 -1.648 -10.032 386 HD22 LEU 19 1HD2 LEU 19 12.018 0.125 -9.883 387 HD23 LEU 19 2HD2 LEU 19 10.949 -0.695 -11.046 388 H GLU 20 HN GLU 20 15.527 -0.243 -10.242 389 HA GLU 20 HA GLU 20 17.801 0.160 -12.024 390 HB2 GLU 20 2HB GLU 20 15.712 1.745 -12.252 391 HB3 GLU 20 3HB GLU 20 16.293 2.468 -10.765 392 HG2 GLU 20 2HG GLU 20 17.895 3.616 -11.885 393 HG3 GLU 20 3HG GLU 20 18.543 2.135 -12.561 394 H GLU 21 HN GLU 21 19.746 0.241 -10.976 395 HA GLU 21 HA GLU 21 19.725 0.112 -8.142 396 HB2 GLU 21 2HB GLU 21 21.334 -1.245 -9.312 397 HB3 GLU 21 3HB GLU 21 21.930 0.120 -10.237 398 HG2 GLU 21 2HG GLU 21 22.645 1.176 -7.999 399 HG3 GLU 21 3HG GLU 21 22.273 -0.361 -7.245 400 H GLY 22 HN GLY 22 20.740 1.616 -6.658 401 HA2 GLY 22 1HA GLY 22 21.083 4.333 -7.783 402 HA3 GLY 22 2HA GLY 22 20.215 4.016 -6.293 403 H GLY 23 HN GLY 23 21.398 3.128 -4.416 404 HA2 GLY 23 1HA GLY 23 23.978 2.472 -4.133 405 HA3 GLY 23 2HA GLY 23 24.086 4.214 -4.293 406 H GLY 24 HN GLY 24 21.540 2.143 -2.739 407 HA2 GLY 24 1HA GLY 24 22.344 3.104 -0.103 408 HA3 GLY 24 2HA GLY 24 20.770 3.610 -0.681 409 H THR 25 HN THR 25 20.088 2.324 1.318 410 HA THR 25 HA THR 25 19.745 -0.497 0.545 411 HB THR 25 HB THR 25 20.884 0.761 2.991 412 HG1 THR 25 HG1 THR 25 21.983 -0.816 1.664 413 HG21 THR 25 3HG2 THR 25 18.906 -1.574 3.170 414 HG22 THR 25 1HG2 THR 25 19.998 -1.046 4.472 415 HG23 THR 25 2HG2 THR 25 18.682 0.021 3.928 416 H LEU 26 HN LEU 26 17.805 -1.531 1.566 417 HA LEU 26 HA LEU 26 15.650 0.459 1.601 418 HB2 LEU 26 2HB LEU 26 15.375 -2.492 1.064 419 HB3 LEU 26 3HB LEU 26 14.203 -1.223 0.773 420 HG LEU 26 HG LEU 26 16.853 -1.313 -0.675 421 HD11 LEU 26 1HD1 LEU 26 15.064 -3.356 -0.858 422 HD12 LEU 26 2HD1 LEU 26 14.480 -2.268 -2.140 423 HD13 LEU 26 3HD1 LEU 26 16.163 -2.847 -2.162 424 HD21 LEU 26 3HD2 LEU 26 16.117 0.422 -1.895 425 HD22 LEU 26 1HD2 LEU 26 14.448 -0.194 -1.965 426 HD23 LEU 26 2HD2 LEU 26 15.012 0.686 -0.525 427 H VAL 27 HN VAL 27 16.335 0.895 3.894 428 HA VAL 27 HA VAL 27 16.122 -1.143 5.824 429 HB VAL 27 HB VAL 27 15.887 1.863 6.063 430 HG11 VAL 27 1HG1 VAL 27 16.377 -0.284 8.149 431 HG12 VAL 27 2HG1 VAL 27 16.641 1.455 8.422 432 HG13 VAL 27 3HG1 VAL 27 15.008 0.849 8.058 433 HG21 VAL 27 3HG2 VAL 27 18.247 -0.021 6.045 434 HG22 VAL 27 1HG2 VAL 27 17.992 1.469 5.105 435 HG23 VAL 27 2HG2 VAL 27 18.325 1.564 6.852 436 H CYS 28 HN CYS 28 14.270 -2.322 6.025 437 HA CYS 28 HA CYS 28 11.791 -0.766 6.180 438 HB2 CYS 28 2HB CYS 28 11.974 -2.230 4.165 439 HB3 CYS 28 3HB CYS 28 12.074 -3.621 5.225 440 H CYS 29 HN CYS 29 10.588 -1.060 8.071 441 HA CYS 29 HA CYS 29 10.077 -1.716 10.100 442 HB2 CYS 29 2HB CYS 29 11.173 -4.351 9.119 443 HB3 CYS 29 3HB CYS 29 10.488 -4.151 10.720 444 H GLY 30 HN GLY 30 12.678 -0.433 9.462 445 HA2 GLY 30 1HA GLY 30 14.502 0.232 10.602 446 HA3 GLY 30 2HA GLY 30 13.921 -0.663 11.993 447 H GLU 31 HN GLU 31 14.304 -2.365 8.914 448 HA GLU 31 HA GLU 31 16.905 -3.318 9.748 449 HB2 GLU 31 2HB GLU 31 14.742 -4.799 10.454 450 HB3 GLU 31 3HB GLU 31 14.976 -5.422 8.833 451 HG2 GLU 31 2HG GLU 31 17.421 -5.833 9.412 452 HG3 GLU 31 3HG GLU 31 17.065 -5.355 11.060 453 H ASP 32 HN ASP 32 18.286 -3.468 8.014 454 HA ASP 32 HA ASP 32 17.472 -2.574 5.546 455 HB2 ASP 32 2HB ASP 32 19.809 -2.488 6.277 456 HB3 ASP 32 3HB ASP 32 19.885 -4.234 6.397 457 H MET 33 HN MET 33 16.084 -3.684 4.156 458 HA MET 33 HA MET 33 15.247 -6.196 4.358 459 HB2 MET 33 2HB MET 33 14.838 -4.162 2.597 460 HB3 MET 33 3HB MET 33 15.830 -5.173 1.566 461 HG2 MET 33 2HG MET 33 14.045 -6.505 1.130 462 HG3 MET 33 3HG MET 33 13.905 -6.897 2.834 463 HE1 MET 33 3HE MET 33 11.691 -5.709 0.051 464 HE2 MET 33 1HE MET 33 11.477 -3.972 0.369 465 HE3 MET 33 2HE MET 33 13.092 -4.614 -0.017 466 H VAL 34 HN VAL 34 15.690 -8.242 3.211 467 HA VAL 34 HA VAL 34 18.570 -8.580 2.835 468 HB VAL 34 HB VAL 34 18.312 -10.743 3.530 469 HG11 VAL 34 1HG1 VAL 34 17.220 -8.841 5.127 470 HG12 VAL 34 2HG1 VAL 34 15.852 -9.973 4.997 471 HG13 VAL 34 3HG1 VAL 34 17.425 -10.543 5.605 472 HG21 VAL 34 3HG2 VAL 34 15.703 -11.593 3.580 473 HG22 VAL 34 1HG2 VAL 34 15.733 -10.588 2.110 474 HG23 VAL 34 2HG2 VAL 34 16.872 -11.945 2.284 475 H LYS 35 HN LYS 35 19.308 -9.988 1.027 476 HA LYS 35 HA LYS 35 17.753 -9.349 -1.345 477 HB2 LYS 35 2HB LYS 35 20.449 -9.208 -0.765 478 HB3 LYS 35 3HB LYS 35 20.345 -10.692 -1.690 479 HG2 LYS 35 2HG LYS 35 20.165 -9.485 -3.598 480 HG3 LYS 35 3HG LYS 35 18.654 -8.807 -3.022 481 HD2 LYS 35 2HD LYS 35 19.896 -6.853 -3.293 482 HD3 LYS 35 3HD LYS 35 20.242 -7.202 -1.611 483 HE2 LYS 35 2HE LYS 35 22.037 -8.386 -3.742 484 HE3 LYS 35 3HE LYS 35 22.220 -6.693 -3.328 485 HZ1 LYS 35 2HZ LYS 35 22.919 -7.222 -1.203 486 HZ3 LYS 35 1HZ LYS 35 23.491 -8.532 -1.981 487 H GLN 36 HN GLN 36 17.328 -10.997 -2.998 488 HA GLN 36 HA GLN 36 17.132 -13.640 -1.775 489 HB2 GLN 36 2HB GLN 36 15.181 -12.399 -3.765 490 HB3 GLN 36 3HB GLN 36 15.028 -13.978 -3.021 491 HG2 GLN 36 2HG GLN 36 15.222 -11.439 -1.350 492 HG3 GLN 36 3HG GLN 36 13.686 -12.019 -1.964 493 HE21 GLN 36 1HE2 GLN 36 16.368 -12.615 0.175 494 HE22 GLN 36 2HE2 GLN 36 15.654 -13.868 1.135 Start of MODEL 5 1 H1 ALA 1 HN ALA 1 3.437 -3.188 -0.337 2 HA ALA 1 HA ALA 1 2.407 -0.849 0.947 3 HB1 ALA 1 1HB ALA 1 4.268 0.276 -0.019 4 HB2 ALA 1 2HB ALA 1 4.137 -0.643 -1.538 5 HB3 ALA 1 3HB ALA 1 2.911 0.582 -1.130 6 H ASN 2 HN ASN 2 2.738 -2.328 -2.365 7 HA ASN 2 HA ASN 2 0.295 -3.520 -2.375 8 HB2 ASN 2 2HB ASN 2 0.144 -0.608 -2.860 9 HB3 ASN 2 3HB ASN 2 -0.505 -1.520 -4.208 10 HD21 ASN 2 1HD2 ASN 2 -1.924 0.162 -2.390 11 HD22 ASN 2 2HD2 ASN 2 -3.111 -0.792 -1.566 12 H GLU 3 HN GLU 3 0.832 -5.044 -3.945 13 HA GLU 3 HA GLU 3 2.865 -4.994 -5.622 14 HB2 GLU 3 2HB GLU 3 0.106 -6.174 -6.162 15 HB3 GLU 3 3HB GLU 3 1.535 -6.583 -7.090 16 HG2 GLU 3 2HG GLU 3 2.521 -7.763 -5.333 17 HG3 GLU 3 3HG GLU 3 1.751 -6.789 -4.096 18 H GLY 4 HN GLY 4 3.114 -4.666 -8.005 19 HA2 GLY 4 1HA GLY 4 2.927 -3.454 -9.892 20 HA3 GLY 4 2HA GLY 4 1.240 -3.178 -9.506 21 H ASP 5 HN ASP 5 4.098 -2.288 -7.487 22 HA ASP 5 HA ASP 5 3.428 0.493 -8.040 23 HB2 ASP 5 2HB ASP 5 3.611 -0.981 -5.463 24 HB3 ASP 5 3HB ASP 5 4.515 0.520 -5.479 25 H VAL 6 HN VAL 6 5.368 1.986 -7.518 26 HA VAL 6 HA VAL 6 7.911 0.535 -7.646 27 HB VAL 6 HB VAL 6 6.750 2.487 -9.563 28 HG11 VAL 6 1HG1 VAL 6 9.726 2.401 -8.962 29 HG12 VAL 6 2HG1 VAL 6 8.932 3.319 -10.264 30 HG13 VAL 6 3HG1 VAL 6 8.631 3.747 -8.563 31 HG21 VAL 6 3HG2 VAL 6 7.157 0.821 -10.990 32 HG22 VAL 6 1HG2 VAL 6 8.884 0.816 -10.558 33 HG23 VAL 6 2HG2 VAL 6 7.729 -0.163 -9.620 34 H TYR 7 HN TYR 7 9.678 1.611 -6.632 35 HA TYR 7 HA TYR 7 8.926 4.037 -5.157 36 HB2 TYR 7 2HB TYR 7 10.056 1.331 -4.331 37 HB3 TYR 7 3HB TYR 7 10.625 2.737 -3.452 38 HD1 TYR 7 HD1 TYR 7 8.938 4.190 -2.228 39 HD2 TYR 7 HD2 TYR 7 7.925 0.374 -3.878 40 HE1 TYR 7 HE1 TYR 7 6.875 4.089 -0.746 41 HE2 TYR 7 HE2 TYR 7 5.866 0.286 -2.390 42 HH TYR 7 HH TYR 7 5.421 2.452 0.201 43 H LYS 8 HN LYS 8 10.328 5.682 -5.518 44 HA LYS 8 HA LYS 8 13.034 4.926 -6.381 45 HB2 LYS 8 2HB LYS 8 11.685 5.899 -8.201 46 HB3 LYS 8 3HB LYS 8 11.387 7.327 -7.231 47 HG2 LYS 8 2HG LYS 8 14.263 6.604 -7.447 48 HG3 LYS 8 3HG LYS 8 13.518 7.006 -8.981 49 HD2 LYS 8 2HD LYS 8 12.754 8.867 -6.807 50 HD3 LYS 8 3HD LYS 8 14.480 8.841 -7.107 51 HE2 LYS 8 2HE LYS 8 12.348 9.258 -9.257 52 HE3 LYS 8 3HE LYS 8 13.278 10.542 -8.513 53 HZ1 LYS 8 2HZ LYS 8 14.921 8.419 -9.566 54 HZ3 LYS 8 1HZ LYS 8 15.068 10.028 -9.775 55 H CYS 9 HN CYS 9 14.719 5.686 -5.182 56 HA CYS 9 HA CYS 9 14.077 7.012 -2.753 57 HB2 CYS 9 2HB CYS 9 15.834 5.274 -2.902 58 HB3 CYS 9 3HB CYS 9 16.787 6.320 -3.935 59 H GLU 10 HN GLU 10 14.439 9.201 -2.220 60 HA GLU 10 HA GLU 10 14.951 10.884 -4.514 61 HB2 GLU 10 2HB GLU 10 13.580 11.220 -1.864 62 HB3 GLU 10 3HB GLU 10 14.304 12.652 -2.569 63 HG2 GLU 10 2HG GLU 10 12.767 11.034 -4.523 64 HG3 GLU 10 3HG GLU 10 11.787 11.636 -3.201 65 H LEU 11 HN LEU 11 17.145 9.351 -3.257 66 HA LEU 11 HA LEU 11 18.788 11.646 -2.473 67 HB2 LEU 11 2HB LEU 11 18.114 9.301 -0.887 68 HB3 LEU 11 3HB LEU 11 19.845 9.467 -1.106 69 HG LEU 11 HG LEU 11 18.716 12.033 -0.419 70 HD11 LEU 11 1HD1 LEU 11 17.082 10.169 0.625 71 HD12 LEU 11 2HD1 LEU 11 18.328 10.216 1.895 72 HD13 LEU 11 3HD1 LEU 11 17.467 11.705 1.437 73 HD21 LEU 11 3HD2 LEU 11 21.019 10.478 0.087 74 HD22 LEU 11 1HD2 LEU 11 20.712 12.173 0.534 75 HD23 LEU 11 2HD2 LEU 11 20.305 10.866 1.671 76 H CYS 12 HN CYS 12 19.057 8.085 -3.177 77 HA CYS 12 HA CYS 12 21.423 8.662 -4.728 78 HB2 CYS 12 2HB CYS 12 21.565 6.187 -4.931 79 HB3 CYS 12 3HB CYS 12 21.624 6.798 -3.290 80 H GLY 13 HN GLY 13 18.098 7.259 -5.087 81 HA2 GLY 13 1HA GLY 13 16.804 7.913 -7.002 82 HA3 GLY 13 2HA GLY 13 18.261 7.866 -7.975 83 H GLN 14 HN GLN 14 17.539 5.421 -5.466 84 HA GLN 14 HA GLN 14 17.758 3.395 -7.445 85 HB2 GLN 14 2HB GLN 14 18.758 3.010 -5.267 86 HB3 GLN 14 3HB GLN 14 17.244 3.333 -4.444 87 HG2 GLN 14 2HG GLN 14 16.300 1.276 -5.057 88 HG3 GLN 14 3HG GLN 14 17.271 1.136 -6.509 89 HE21 GLN 14 1HE2 GLN 14 17.919 1.635 -3.038 90 HE22 GLN 14 2HE2 GLN 14 19.078 0.361 -2.846 91 H VAL 15 HN VAL 15 16.104 2.539 -8.627 92 HA VAL 15 HA VAL 15 13.390 3.029 -7.626 93 HB VAL 15 HB VAL 15 14.467 2.607 -10.418 94 HG11 VAL 15 1HG1 VAL 15 11.623 2.861 -9.409 95 HG12 VAL 15 2HG1 VAL 15 12.084 3.175 -11.099 96 HG13 VAL 15 3HG1 VAL 15 12.333 1.560 -10.393 97 HG21 VAL 15 3HG2 VAL 15 13.627 4.929 -10.776 98 HG22 VAL 15 1HG2 VAL 15 13.269 5.030 -9.035 99 HG23 VAL 15 2HG2 VAL 15 14.949 4.827 -9.587 100 H VAL 16 HN VAL 16 12.309 1.307 -6.827 101 HA VAL 16 HA VAL 16 13.033 -1.325 -7.903 102 HB VAL 16 HB VAL 16 13.130 -2.281 -5.784 103 HG11 VAL 16 1HG1 VAL 16 15.032 -0.652 -6.432 104 HG12 VAL 16 2HG1 VAL 16 14.367 0.401 -5.160 105 HG13 VAL 16 3HG1 VAL 16 14.951 -1.230 -4.749 106 HG21 VAL 16 3HG2 VAL 16 12.645 -0.637 -3.730 107 HG22 VAL 16 1HG2 VAL 16 11.560 0.109 -4.928 108 HG23 VAL 16 2HG2 VAL 16 11.365 -1.608 -4.499 109 H LYS 17 HN LYS 17 11.303 -2.616 -8.441 110 HA LYS 17 HA LYS 17 8.686 -1.381 -8.053 111 HB2 LYS 17 2HB LYS 17 9.316 -1.858 -10.351 112 HB3 LYS 17 3HB LYS 17 9.652 -3.532 -9.958 113 HG2 LYS 17 2HG LYS 17 6.918 -2.439 -9.290 114 HG3 LYS 17 3HG LYS 17 7.281 -2.777 -10.970 115 HD2 LYS 17 2HD LYS 17 7.992 -5.116 -10.296 116 HD3 LYS 17 3HD LYS 17 7.490 -4.760 -8.655 117 HE2 LYS 17 2HE LYS 17 5.166 -4.393 -9.385 118 HE3 LYS 17 3HE LYS 17 5.628 -4.555 -11.069 119 HZ1 LYS 17 2HZ LYS 17 5.746 -6.812 -10.877 120 HZ3 LYS 17 1HZ LYS 17 4.756 -6.606 -9.602 121 H VAL 18 HN VAL 18 7.351 -2.105 -6.491 122 HA VAL 18 HA VAL 18 8.093 -4.228 -4.824 123 HB VAL 18 HB VAL 18 5.484 -2.756 -5.225 124 HG11 VAL 18 1HG1 VAL 18 4.508 -3.880 -3.510 125 HG12 VAL 18 2HG1 VAL 18 5.626 -5.170 -4.015 126 HG13 VAL 18 3HG1 VAL 18 6.045 -4.117 -2.643 127 HG21 VAL 18 3HG2 VAL 18 7.988 -2.173 -3.807 128 HG22 VAL 18 1HG2 VAL 18 6.661 -1.090 -4.287 129 HG23 VAL 18 2HG2 VAL 18 6.542 -2.029 -2.780 130 H LEU 19 HN LEU 19 7.886 -6.394 -5.059 131 HA LEU 19 HA LEU 19 6.391 -7.338 -7.356 132 HB2 LEU 19 2HB LEU 19 8.454 -8.325 -7.320 133 HB3 LEU 19 3HB LEU 19 8.521 -8.410 -5.571 134 HG LEU 19 HG LEU 19 6.767 -10.226 -5.674 135 HD11 LEU 19 1HD1 LEU 19 5.786 -9.823 -7.819 136 HD12 LEU 19 2HD1 LEU 19 7.352 -10.035 -8.638 137 HD13 LEU 19 3HD1 LEU 19 6.562 -11.426 -7.857 138 HD21 LEU 19 3HD2 LEU 19 9.416 -10.753 -7.049 139 HD22 LEU 19 1HD2 LEU 19 9.120 -10.725 -5.294 140 HD23 LEU 19 2HD2 LEU 19 8.364 -11.980 -6.304 141 H GLU 20 HN GLU 20 6.551 -7.869 -3.771 142 HA GLU 20 HA GLU 20 3.715 -8.414 -3.886 143 HB2 GLU 20 2HB GLU 20 4.226 -10.360 -2.178 144 HB3 GLU 20 3HB GLU 20 4.339 -10.660 -3.902 145 HG2 GLU 20 2HG GLU 20 6.841 -10.053 -3.717 146 HG3 GLU 20 3HG GLU 20 6.636 -10.093 -1.977 147 H GLU 21 HN GLU 21 2.802 -7.008 -2.459 148 HA GLU 21 HA GLU 21 4.229 -5.497 -0.703 149 HB2 GLU 21 2HB GLU 21 1.950 -4.947 -1.463 150 HB3 GLU 21 3HB GLU 21 1.292 -6.313 -0.584 151 HG2 GLU 21 2HG GLU 21 2.948 -4.491 1.085 152 HG3 GLU 21 3HG GLU 21 1.514 -3.734 0.417 153 H GLY 22 HN GLY 22 4.502 -5.519 1.623 154 HA2 GLY 22 1HA GLY 22 4.125 -8.193 2.834 155 HA3 GLY 22 2HA GLY 22 5.591 -7.254 3.031 156 H GLY 23 HN GLY 23 4.999 -4.758 3.678 157 HA2 GLY 23 1HA GLY 23 3.046 -3.701 4.964 158 HA3 GLY 23 2HA GLY 23 3.317 -5.023 6.083 159 H GLY 24 HN GLY 24 5.371 -2.645 4.236 160 HA2 GLY 24 1HA GLY 24 6.388 -1.485 6.649 161 HA3 GLY 24 2HA GLY 24 7.541 -2.575 5.904 162 H THR 25 HN THR 25 8.730 -0.369 5.775 163 HA THR 25 HA THR 25 8.016 0.881 3.206 164 HB THR 25 HB THR 25 8.940 2.136 5.837 165 HG1 THR 25 HG1 THR 25 6.815 2.837 5.734 166 HG21 THR 25 3HG2 THR 25 8.716 4.309 4.505 167 HG22 THR 25 1HG2 THR 25 10.144 3.338 4.078 168 HG23 THR 25 2HG2 THR 25 8.710 3.321 3.024 169 H LEU 26 HN LEU 26 9.966 2.067 2.228 170 HA LEU 26 HA LEU 26 12.323 0.369 2.673 171 HB2 LEU 26 2HB LEU 26 11.703 1.687 0.054 172 HB3 LEU 26 3HB LEU 26 12.753 0.325 0.391 173 HG LEU 26 HG LEU 26 9.786 0.085 0.833 174 HD11 LEU 26 1HD1 LEU 26 9.316 0.367 -1.315 175 HD12 LEU 26 2HD1 LEU 26 11.033 0.639 -1.697 176 HD13 LEU 26 3HD1 LEU 26 10.372 -1.013 -1.700 177 HD21 LEU 26 3HD2 LEU 26 10.907 -1.766 1.702 178 HD22 LEU 26 1HD2 LEU 26 10.386 -2.307 0.089 179 HD23 LEU 26 2HD2 LEU 26 12.075 -1.816 0.360 180 H VAL 27 HN VAL 27 12.926 1.948 4.362 181 HA VAL 27 HA VAL 27 13.409 4.646 3.553 182 HB VAL 27 HB VAL 27 14.259 3.085 6.002 183 HG11 VAL 27 1HG1 VAL 27 14.394 6.020 5.296 184 HG12 VAL 27 2HG1 VAL 27 14.324 5.468 6.987 185 HG13 VAL 27 3HG1 VAL 27 15.671 4.960 5.941 186 HG21 VAL 27 3HG2 VAL 27 11.702 4.242 5.169 187 HG22 VAL 27 1HG2 VAL 27 12.073 3.112 6.493 188 HG23 VAL 27 2HG2 VAL 27 12.264 4.864 6.739 189 H CYS 28 HN CYS 28 14.954 5.047 2.041 190 HA CYS 28 HA CYS 28 17.498 3.639 2.416 191 HB2 CYS 28 2HB CYS 28 16.253 3.004 0.349 192 HB3 CYS 28 3HB CYS 28 16.359 4.668 -0.191 193 H CYS 29 HN CYS 29 19.358 4.958 2.503 194 HA CYS 29 HA CYS 29 20.572 6.774 2.710 195 HB2 CYS 29 2HB CYS 29 18.513 7.906 0.822 196 HB3 CYS 29 3HB CYS 29 19.837 8.874 1.436 197 H GLY 30 HN GLY 30 18.198 6.056 4.485 198 HA2 GLY 30 1HA GLY 30 17.375 6.864 6.423 199 HA3 GLY 30 2HA GLY 30 18.332 8.317 6.208 200 H GLU 31 HN GLU 31 16.178 7.283 3.595 201 HA GLU 31 HA GLU 31 14.159 9.141 4.525 202 HB2 GLU 31 2HB GLU 31 15.737 10.399 3.024 203 HB3 GLU 31 3HB GLU 31 15.383 9.268 1.734 204 HG2 GLU 31 2HG GLU 31 13.571 10.503 1.170 205 HG3 GLU 31 3HG GLU 31 12.848 10.126 2.721 206 H ASP 32 HN ASP 32 12.108 8.341 4.204 207 HA ASP 32 HA ASP 32 11.798 5.757 3.301 208 HB2 ASP 32 2HB ASP 32 10.032 6.391 4.653 209 HB3 ASP 32 3HB ASP 32 10.029 8.039 4.058 210 H MET 33 HN MET 33 12.021 5.087 1.159 211 HA MET 33 HA MET 33 12.256 6.658 -0.992 212 HB2 MET 33 2HB MET 33 12.260 3.963 -0.519 213 HB3 MET 33 3HB MET 33 10.725 4.079 -1.357 214 HG2 MET 33 2HG MET 33 11.765 4.302 -3.366 215 HG3 MET 33 3HG MET 33 12.712 5.656 -2.786 216 HE1 MET 33 3HE MET 33 13.051 2.227 -4.282 217 HE2 MET 33 1HE MET 33 13.912 1.271 -3.051 218 HE3 MET 33 2HE MET 33 12.261 1.854 -2.731 219 H VAL 34 HN VAL 34 10.901 7.434 -2.707 220 HA VAL 34 HA VAL 34 8.163 7.884 -1.831 221 HB VAL 34 HB VAL 34 8.175 9.750 -3.161 222 HG11 VAL 34 1HG1 VAL 34 10.115 9.621 -1.395 223 HG12 VAL 34 2HG1 VAL 34 11.161 9.657 -2.834 224 HG13 VAL 34 3HG1 VAL 34 10.023 10.991 -2.528 225 HG21 VAL 34 3HG2 VAL 34 8.609 9.367 -5.333 226 HG22 VAL 34 1HG2 VAL 34 10.286 9.807 -4.931 227 HG23 VAL 34 2HG2 VAL 34 9.800 8.095 -4.969 228 H LYS 35 HN LYS 35 6.379 7.670 -3.451 229 HA LYS 35 HA LYS 35 6.769 5.191 -4.916 230 HB2 LYS 35 2HB LYS 35 4.425 6.686 -3.804 231 HB3 LYS 35 3HB LYS 35 4.158 5.630 -5.176 232 HG2 LYS 35 2HG LYS 35 5.832 4.151 -3.415 233 HG3 LYS 35 3HG LYS 35 4.649 4.927 -2.381 234 HD2 LYS 35 2HD LYS 35 2.891 4.086 -4.163 235 HD3 LYS 35 3HD LYS 35 4.168 3.001 -4.677 236 HE2 LYS 35 2HE LYS 35 4.179 1.814 -2.641 237 HE3 LYS 35 3HE LYS 35 3.534 3.162 -1.726 238 HZ1 LYS 35 2HZ LYS 35 2.083 1.226 -3.371 239 HZ3 LYS 35 1HZ LYS 35 1.475 2.735 -3.311 240 H GLN 36 HN GLN 36 6.167 4.962 -7.161 241 HA GLN 36 HA GLN 36 6.260 7.530 -8.545 242 HB2 GLN 36 2HB GLN 36 7.341 4.874 -9.578 243 HB3 GLN 36 3HB GLN 36 7.511 6.440 -10.345 244 HG2 GLN 36 2HG GLN 36 8.549 5.949 -7.528 245 HG3 GLN 36 3HG GLN 36 9.514 5.538 -8.930 246 HE21 GLN 36 1HE2 GLN 36 7.997 8.094 -7.103 247 HE22 GLN 36 2HE2 GLN 36 8.858 9.434 -7.785 248 H1 ALA 1 HN ALA 1 22.490 -4.274 -4.965 249 HA ALA 1 HA ALA 1 20.846 -5.733 -6.310 250 HB1 ALA 1 1HB ALA 1 20.899 -3.007 -5.506 251 HB2 ALA 1 2HB ALA 1 20.221 -3.038 -7.152 252 HB3 ALA 1 3HB ALA 1 19.474 -4.012 -5.862 253 H ASN 2 HN ASN 2 22.612 -3.056 -8.033 254 HA ASN 2 HA ASN 2 22.969 -2.723 -10.160 255 HB2 ASN 2 2HB ASN 2 23.485 -5.737 -10.308 256 HB3 ASN 2 3HB ASN 2 24.216 -4.501 -11.313 257 HD21 ASN 2 1HD2 ASN 2 26.087 -3.677 -10.740 258 HD22 ASN 2 2HD2 ASN 2 26.857 -3.818 -9.194 259 H GLU 3 HN GLU 3 20.170 -3.335 -9.502 260 HA GLU 3 HA GLU 3 18.265 -3.795 -10.435 261 HB2 GLU 3 2HB GLU 3 18.893 -2.382 -12.270 262 HB3 GLU 3 3HB GLU 3 19.951 -3.600 -12.955 263 HG2 GLU 3 2HG GLU 3 17.942 -5.067 -13.376 264 HG3 GLU 3 3HG GLU 3 16.907 -3.796 -12.755 265 H GLY 4 HN GLY 4 16.895 -5.565 -11.183 266 HA2 GLY 4 1HA GLY 4 16.489 -7.703 -11.928 267 HA3 GLY 4 2HA GLY 4 18.210 -8.013 -12.048 268 H ASP 5 HN ASP 5 18.658 -6.845 -9.245 269 HA ASP 5 HA ASP 5 18.507 -9.274 -7.905 270 HB2 ASP 5 2HB ASP 5 19.222 -6.439 -7.237 271 HB3 ASP 5 3HB ASP 5 18.824 -7.467 -5.875 272 H VAL 6 HN VAL 6 17.403 -9.354 -5.567 273 HA VAL 6 HA VAL 6 14.858 -7.922 -5.577 274 HB VAL 6 HB VAL 6 15.302 -10.860 -5.774 275 HG11 VAL 6 1HG1 VAL 6 14.257 -11.114 -3.753 276 HG12 VAL 6 2HG1 VAL 6 13.405 -9.555 -3.867 277 HG13 VAL 6 3HG1 VAL 6 12.823 -10.959 -4.796 278 HG21 VAL 6 3HG2 VAL 6 13.025 -10.609 -6.939 279 HG22 VAL 6 1HG2 VAL 6 13.297 -8.854 -6.820 280 HG23 VAL 6 2HG2 VAL 6 14.439 -9.873 -7.729 281 H TYR 7 HN TYR 7 14.055 -7.467 -3.492 282 HA TYR 7 HA TYR 7 15.831 -8.312 -1.304 283 HB2 TYR 7 2HB TYR 7 14.654 -5.665 -2.237 284 HB3 TYR 7 3HB TYR 7 14.808 -5.894 -0.507 285 HD1 TYR 7 HD1 TYR 7 17.078 -6.250 0.509 286 HD2 TYR 7 HD2 TYR 7 16.568 -5.209 -3.610 287 HE1 TYR 7 HE1 TYR 7 19.515 -5.537 0.379 288 HE2 TYR 7 HE2 TYR 7 19.006 -4.500 -3.726 289 HH TYR 7 HH TYR 7 21.086 -5.014 -2.551 290 H LYS 8 HN LYS 8 14.833 -9.233 0.435 291 HA LYS 8 HA LYS 8 11.921 -8.881 0.592 292 HB2 LYS 8 2HB LYS 8 11.926 -11.053 -0.079 293 HB3 LYS 8 3HB LYS 8 13.558 -11.354 0.484 294 HG2 LYS 8 2HG LYS 8 12.095 -12.618 1.926 295 HG3 LYS 8 3HG LYS 8 12.675 -11.264 2.874 296 HD2 LYS 8 2HD LYS 8 10.600 -10.251 2.967 297 HD3 LYS 8 3HD LYS 8 10.165 -10.743 1.341 298 HE2 LYS 8 2HE LYS 8 8.733 -11.940 2.918 299 HE3 LYS 8 3HE LYS 8 9.815 -13.096 2.167 300 HZ1 LYS 8 2HZ LYS 8 9.834 -12.115 4.922 301 HZ3 LYS 8 1HZ LYS 8 11.281 -12.476 4.268 302 H CYS 9 HN CYS 9 11.120 -8.285 2.570 303 HA CYS 9 HA CYS 9 13.006 -7.445 4.503 304 HB2 CYS 9 2HB CYS 9 10.948 -6.187 4.107 305 HB3 CYS 9 3HB CYS 9 9.974 -7.558 4.599 306 H GLU 10 HN GLU 10 12.850 -8.171 6.866 307 HA GLU 10 HA GLU 10 12.348 -11.044 6.906 308 HB2 GLU 10 2HB GLU 10 14.439 -9.322 8.258 309 HB3 GLU 10 3HB GLU 10 13.995 -10.864 8.962 310 HG2 GLU 10 2HG GLU 10 14.508 -10.945 6.025 311 HG3 GLU 10 3HG GLU 10 15.906 -10.532 6.996 312 H LEU 11 HN LEU 11 10.347 -8.892 7.342 313 HA LEU 11 HA LEU 11 9.534 -9.734 10.006 314 HB2 LEU 11 2HB LEU 11 10.653 -7.672 10.450 315 HB3 LEU 11 3HB LEU 11 9.837 -6.867 9.125 316 HG LEU 11 HG LEU 11 7.778 -6.782 10.273 317 HD11 LEU 11 1HD1 LEU 11 7.622 -9.040 11.084 318 HD12 LEU 11 2HD1 LEU 11 8.939 -8.763 12.249 319 HD13 LEU 11 3HD1 LEU 11 7.383 -7.922 12.447 320 HD21 LEU 11 3HD2 LEU 11 10.184 -5.846 11.574 321 HD22 LEU 11 1HD2 LEU 11 8.595 -5.061 11.411 322 HD23 LEU 11 2HD2 LEU 11 8.903 -6.174 12.766 323 H CYS 12 HN CYS 12 8.326 -7.226 7.695 324 HA CYS 12 HA CYS 12 5.717 -8.253 7.841 325 HB2 CYS 12 2HB CYS 12 5.234 -6.656 6.016 326 HB3 CYS 12 3HB CYS 12 6.022 -5.938 7.407 327 H GLY 13 HN GLY 13 8.477 -8.566 5.545 328 HA2 GLY 13 1HA GLY 13 8.878 -10.490 4.293 329 HA3 GLY 13 2HA GLY 13 7.185 -10.932 4.394 330 H GLN 14 HN GLN 14 8.349 -7.635 3.587 331 HA GLN 14 HA GLN 14 6.838 -7.767 1.172 332 HB2 GLN 14 2HB GLN 14 6.753 -5.726 2.502 333 HB3 GLN 14 3HB GLN 14 8.497 -5.561 2.462 334 HG2 GLN 14 2HG GLN 14 8.500 -5.072 0.096 335 HG3 GLN 14 3HG GLN 14 6.840 -5.600 -0.093 336 HE21 GLN 14 1HE2 GLN 14 8.457 -3.525 2.305 337 HE22 GLN 14 2HE2 GLN 14 7.471 -2.119 2.083 338 H VAL 15 HN VAL 15 7.615 -8.243 -0.846 339 HA VAL 15 HA VAL 15 10.540 -8.312 -1.122 340 HB VAL 15 HB VAL 15 8.516 -9.864 -2.732 341 HG11 VAL 15 1HG1 VAL 15 11.502 -10.191 -2.282 342 HG12 VAL 15 2HG1 VAL 15 10.474 -11.322 -3.194 343 HG13 VAL 15 3HG1 VAL 15 10.699 -9.655 -3.777 344 HG21 VAL 15 3HG2 VAL 15 8.842 -10.213 -0.027 345 HG22 VAL 15 1HG2 VAL 15 8.324 -11.475 -1.171 346 HG23 VAL 15 2HG2 VAL 15 10.035 -11.353 -0.694 347 H VAL 16 HN VAL 16 11.469 -6.966 -2.593 348 HA VAL 16 HA VAL 16 9.713 -5.839 -4.650 349 HB VAL 16 HB VAL 16 10.434 -3.651 -4.238 350 HG11 VAL 16 1HG1 VAL 16 8.823 -4.777 -2.532 351 HG12 VAL 16 2HG1 VAL 16 10.187 -4.632 -1.399 352 HG13 VAL 16 3HG1 VAL 16 9.500 -3.175 -2.156 353 HG21 VAL 16 3HG2 VAL 16 12.620 -3.402 -3.769 354 HG22 VAL 16 1HG2 VAL 16 12.119 -3.530 -2.065 355 HG23 VAL 16 2HG2 VAL 16 12.716 -4.968 -2.929 356 H LYS 17 HN LYS 17 10.658 -5.661 -6.674 357 HA LYS 17 HA LYS 17 13.305 -6.864 -6.867 358 HB2 LYS 17 2HB LYS 17 11.580 -7.905 -8.195 359 HB3 LYS 17 3HB LYS 17 11.115 -6.371 -8.903 360 HG2 LYS 17 2HG LYS 17 14.002 -7.158 -9.181 361 HG3 LYS 17 3HG LYS 17 12.843 -8.090 -10.109 362 HD2 LYS 17 2HD LYS 17 11.897 -5.648 -10.728 363 HD3 LYS 17 3HD LYS 17 13.530 -5.160 -10.321 364 HE2 LYS 17 2HE LYS 17 13.680 -7.536 -11.971 365 HE3 LYS 17 3HE LYS 17 12.602 -6.395 -12.749 366 HZ1 LYS 17 2HZ LYS 17 14.387 -5.190 -13.331 367 HZ3 LYS 17 1HZ LYS 17 15.390 -6.263 -12.628 368 H VAL 18 HN VAL 18 15.098 -5.663 -7.194 369 HA VAL 18 HA VAL 18 14.851 -2.840 -7.401 370 HB VAL 18 HB VAL 18 17.274 -4.628 -7.684 371 HG11 VAL 18 1HG1 VAL 18 17.978 -2.538 -8.424 372 HG12 VAL 18 2HG1 VAL 18 16.901 -1.663 -7.309 373 HG13 VAL 18 3HG1 VAL 18 18.357 -2.476 -6.685 374 HG21 VAL 18 3HG2 VAL 18 15.875 -3.503 -5.251 375 HG22 VAL 18 1HG2 VAL 18 16.354 -5.183 -5.587 376 HG23 VAL 18 2HG2 VAL 18 17.595 -3.960 -5.226 377 H LEU 19 HN LEU 19 14.557 -1.651 -9.209 378 HA LEU 19 HA LEU 19 14.920 -2.998 -11.761 379 HB2 LEU 19 2HB LEU 19 13.487 -0.504 -10.880 380 HB3 LEU 19 3HB LEU 19 13.785 -0.847 -12.572 381 HG LEU 19 HG LEU 19 12.266 -2.681 -10.699 382 HD11 LEU 19 1HD1 LEU 19 10.277 -1.892 -12.103 383 HD12 LEU 19 2HD1 LEU 19 10.910 -0.775 -10.869 384 HD13 LEU 19 3HD1 LEU 19 11.313 -0.527 -12.585 385 HD21 LEU 19 3HD2 LEU 19 12.889 -4.133 -12.328 386 HD22 LEU 19 1HD2 LEU 19 11.465 -3.432 -13.133 387 HD23 LEU 19 2HD2 LEU 19 13.097 -2.856 -13.552 388 H GLU 20 HN GLU 20 15.977 -0.053 -9.953 389 HA GLU 20 HA GLU 20 18.370 -0.117 -11.577 390 HB2 GLU 20 2HB GLU 20 16.932 1.513 -12.719 391 HB3 GLU 20 3HB GLU 20 16.614 2.349 -11.213 392 HG2 GLU 20 2HG GLU 20 18.786 3.258 -11.090 393 HG3 GLU 20 3HG GLU 20 19.487 1.994 -12.082 394 H GLU 21 HN GLU 21 19.837 -0.571 -9.970 395 HA GLU 21 HA GLU 21 19.502 0.099 -7.333 396 HB2 GLU 21 2HB GLU 21 21.106 -1.604 -8.308 397 HB3 GLU 21 3HB GLU 21 22.158 -0.284 -8.781 398 HG2 GLU 21 2HG GLU 21 22.187 0.458 -6.333 399 HG3 GLU 21 3HG GLU 21 21.318 -1.012 -5.938 400 H GLY 22 HN GLY 22 20.701 1.670 -5.964 401 HA2 GLY 22 1HA GLY 22 21.354 4.141 -7.459 402 HA3 GLY 22 2HA GLY 22 20.448 4.125 -5.959 403 H GLY 23 HN GLY 23 21.513 3.865 -3.953 404 HA2 GLY 23 1HA GLY 23 24.181 2.964 -3.703 405 HA3 GLY 23 2HA GLY 23 24.159 4.715 -3.782 406 H GLY 24 HN GLY 24 21.946 2.233 -2.298 407 HA2 GLY 24 1HA GLY 24 22.624 3.056 0.368 408 HA3 GLY 24 2HA GLY 24 21.071 3.674 -0.157 409 H THR 25 HN THR 25 20.286 2.247 1.680 410 HA THR 25 HA THR 25 19.862 -0.481 0.656 411 HB THR 25 HB THR 25 20.551 0.493 3.472 412 HG1 THR 25 HG1 THR 25 22.322 -0.020 2.039 413 HG21 THR 25 3HG2 THR 25 19.338 -2.114 2.481 414 HG22 THR 25 1HG2 THR 25 20.491 -2.128 3.837 415 HG23 THR 25 2HG2 THR 25 18.970 -1.213 3.972 416 H LEU 26 HN LEU 26 17.852 -1.509 1.383 417 HA LEU 26 HA LEU 26 15.771 0.531 1.559 418 HB2 LEU 26 2HB LEU 26 15.312 -2.385 1.029 419 HB3 LEU 26 3HB LEU 26 14.319 -1.009 0.592 420 HG LEU 26 HG LEU 26 17.057 -1.423 -0.613 421 HD11 LEU 26 1HD1 LEU 26 15.194 -2.235 -2.523 422 HD12 LEU 26 2HD1 LEU 26 16.342 -3.264 -1.634 423 HD13 LEU 26 3HD1 LEU 26 14.684 -3.046 -1.023 424 HD21 LEU 26 3HD2 LEU 26 14.615 0.053 -1.635 425 HD22 LEU 26 1HD2 LEU 26 16.011 0.804 -0.826 426 HD23 LEU 26 2HD2 LEU 26 16.223 -0.011 -2.393 427 H VAL 27 HN VAL 27 16.367 0.937 3.861 428 HA VAL 27 HA VAL 27 16.131 -1.105 5.774 429 HB VAL 27 HB VAL 27 15.849 1.898 5.984 430 HG11 VAL 27 1HG1 VAL 27 16.831 0.788 8.397 431 HG12 VAL 27 2HG1 VAL 27 15.272 1.602 8.118 432 HG13 VAL 27 3HG1 VAL 27 15.397 -0.165 7.943 433 HG21 VAL 27 3HG2 VAL 27 18.055 0.549 5.181 434 HG22 VAL 27 1HG2 VAL 27 18.107 2.064 6.115 435 HG23 VAL 27 2HG2 VAL 27 18.284 0.499 6.946 436 H CYS 28 HN CYS 28 14.307 -2.328 5.937 437 HA CYS 28 HA CYS 28 11.784 -0.837 6.015 438 HB2 CYS 28 2HB CYS 28 12.054 -2.293 4.008 439 HB3 CYS 28 3HB CYS 28 12.175 -3.682 5.068 440 H CYS 29 HN CYS 29 10.619 -1.076 7.919 441 HA CYS 29 HA CYS 29 10.070 -1.738 9.936 442 HB2 CYS 29 2HB CYS 29 11.104 -4.380 8.919 443 HB3 CYS 29 3HB CYS 29 10.480 -4.196 10.546 444 H GLY 30 HN GLY 30 12.664 -0.460 9.367 445 HA2 GLY 30 1HA GLY 30 14.490 0.166 10.522 446 HA3 GLY 30 2HA GLY 30 13.893 -0.746 11.893 447 H GLU 31 HN GLU 31 14.237 -2.462 8.836 448 HA GLU 31 HA GLU 31 16.848 -3.419 9.647 449 HB2 GLU 31 2HB GLU 31 14.671 -4.889 10.345 450 HB3 GLU 31 3HB GLU 31 14.910 -5.508 8.722 451 HG2 GLU 31 2HG GLU 31 17.202 -6.172 9.226 452 HG3 GLU 31 3HG GLU 31 17.170 -5.334 10.764 453 H ASP 32 HN ASP 32 18.215 -3.411 7.910 454 HA ASP 32 HA ASP 32 17.380 -2.567 5.448 455 HB2 ASP 32 2HB ASP 32 19.666 -3.757 4.744 456 HB3 ASP 32 3HB ASP 32 19.669 -2.313 5.735 457 H MET 33 HN MET 33 16.050 -3.695 4.020 458 HA MET 33 HA MET 33 15.262 -6.233 4.222 459 HB2 MET 33 2HB MET 33 14.714 -4.234 2.516 460 HB3 MET 33 3HB MET 33 15.826 -5.083 1.462 461 HG2 MET 33 2HG MET 33 14.447 -7.016 1.337 462 HG3 MET 33 3HG MET 33 13.590 -6.624 2.815 463 HE1 MET 33 3HE MET 33 12.609 -4.304 3.099 464 HE2 MET 33 1HE MET 33 13.026 -3.139 1.820 465 HE3 MET 33 2HE MET 33 11.354 -3.730 1.975 466 H VAL 34 HN VAL 34 15.890 -8.304 3.486 467 HA VAL 34 HA VAL 34 18.724 -8.549 2.978 468 HB VAL 34 HB VAL 34 18.499 -10.725 3.649 469 HG11 VAL 34 1HG1 VAL 34 17.426 -8.895 5.274 470 HG12 VAL 34 2HG1 VAL 34 15.985 -9.912 5.042 471 HG13 VAL 34 3HG1 VAL 34 17.481 -10.623 5.694 472 HG21 VAL 34 3HG2 VAL 34 17.110 -11.943 2.359 473 HG22 VAL 34 1HG2 VAL 34 15.913 -11.635 3.639 474 HG23 VAL 34 2HG2 VAL 34 15.943 -10.612 2.183 475 H LYS 35 HN LYS 35 19.521 -9.982 1.194 476 HA LYS 35 HA LYS 35 17.999 -9.372 -1.215 477 HB2 LYS 35 2HB LYS 35 20.671 -9.083 -0.586 478 HB3 LYS 35 3HB LYS 35 20.667 -10.570 -1.513 479 HG2 LYS 35 2HG LYS 35 20.366 -9.418 -3.443 480 HG3 LYS 35 3HG LYS 35 18.898 -8.690 -2.821 481 HD2 LYS 35 2HD LYS 35 20.249 -6.804 -3.216 482 HD3 LYS 35 3HD LYS 35 20.506 -7.082 -1.506 483 HE2 LYS 35 2HE LYS 35 22.704 -7.704 -1.797 484 HE3 LYS 35 3HE LYS 35 22.365 -8.599 -3.265 485 HZ1 LYS 35 2HZ LYS 35 22.856 -5.705 -2.989 486 HZ3 LYS 35 1HZ LYS 35 22.026 -6.253 -4.279 487 H GLN 36 HN GLN 36 17.517 -10.998 -2.802 488 HA GLN 36 HA GLN 36 17.472 -13.658 -1.603 489 HB2 GLN 36 2HB GLN 36 15.577 -12.602 -3.741 490 HB3 GLN 36 3HB GLN 36 15.420 -14.093 -2.834 491 HG2 GLN 36 2HG GLN 36 15.473 -11.367 -1.473 492 HG3 GLN 36 3HG GLN 36 13.984 -12.092 -2.046 493 HE21 GLN 36 1HE2 GLN 36 16.479 -12.113 0.322 494 HE22 GLN 36 2HE2 GLN 36 15.841 -13.327 1.378 Start of MODEL 6 1 H1 ALA 1 HN ALA 1 1.299 -2.702 0.024 2 HA ALA 1 HA ALA 1 1.608 -0.216 -0.286 3 HB1 ALA 1 1HB ALA 1 4.263 -1.078 -0.355 4 HB2 ALA 1 2HB ALA 1 3.892 -0.712 -2.058 5 HB3 ALA 1 3HB ALA 1 3.670 0.538 -0.810 6 H ASN 2 HN ASN 2 -0.112 -2.207 -1.125 7 HA ASN 2 HA ASN 2 -1.195 -3.065 -2.821 8 HB2 ASN 2 2HB ASN 2 -0.749 -0.175 -3.413 9 HB3 ASN 2 3HB ASN 2 -1.230 -1.113 -4.813 10 HD21 ASN 2 1HD2 ASN 2 -3.298 -1.352 -5.149 11 HD22 ASN 2 2HD2 ASN 2 -4.575 -1.241 -3.982 12 H GLU 3 HN GLU 3 0.235 -4.754 -3.585 13 HA GLU 3 HA GLU 3 2.523 -4.596 -4.877 14 HB2 GLU 3 2HB GLU 3 0.177 -6.443 -5.464 15 HB3 GLU 3 3HB GLU 3 1.760 -6.686 -6.174 16 HG2 GLU 3 2HG GLU 3 2.790 -6.907 -3.956 17 HG3 GLU 3 3HG GLU 3 1.290 -6.465 -3.166 18 H GLY 4 HN GLY 4 3.254 -4.578 -7.140 19 HA2 GLY 4 1HA GLY 4 3.064 -4.082 -9.369 20 HA3 GLY 4 2HA GLY 4 1.368 -3.692 -9.160 21 H ASP 5 HN ASP 5 3.835 -2.349 -6.971 22 HA ASP 5 HA ASP 5 3.355 0.226 -8.250 23 HB2 ASP 5 2HB ASP 5 3.577 -0.666 -5.396 24 HB3 ASP 5 3HB ASP 5 4.322 0.875 -5.770 25 H VAL 6 HN VAL 6 5.356 1.809 -7.409 26 HA VAL 6 HA VAL 6 7.853 0.301 -7.524 27 HB VAL 6 HB VAL 6 6.821 2.272 -9.516 28 HG11 VAL 6 1HG1 VAL 6 8.695 3.523 -8.866 29 HG12 VAL 6 2HG1 VAL 6 9.682 2.071 -8.573 30 HG13 VAL 6 3HG1 VAL 6 9.284 2.556 -10.239 31 HG21 VAL 6 3HG2 VAL 6 7.324 0.673 -11.043 32 HG22 VAL 6 1HG2 VAL 6 8.818 0.188 -10.206 33 HG23 VAL 6 2HG2 VAL 6 7.241 -0.400 -9.625 34 H TYR 7 HN TYR 7 9.618 1.367 -6.501 35 HA TYR 7 HA TYR 7 8.869 3.847 -5.108 36 HB2 TYR 7 2HB TYR 7 9.994 1.159 -4.229 37 HB3 TYR 7 3HB TYR 7 10.598 2.576 -3.395 38 HD1 TYR 7 HD1 TYR 7 8.965 4.073 -2.163 39 HD2 TYR 7 HD2 TYR 7 7.845 0.254 -3.734 40 HE1 TYR 7 HE1 TYR 7 6.927 4.038 -0.644 41 HE2 TYR 7 HE2 TYR 7 5.811 0.232 -2.210 42 HH TYR 7 HH TYR 7 5.457 2.436 0.356 43 H LYS 8 HN LYS 8 10.235 5.488 -5.586 44 HA LYS 8 HA LYS 8 12.958 4.733 -6.393 45 HB2 LYS 8 2HB LYS 8 11.726 5.586 -8.291 46 HB3 LYS 8 3HB LYS 8 11.194 6.989 -7.385 47 HG2 LYS 8 2HG LYS 8 14.157 6.531 -7.488 48 HG3 LYS 8 3HG LYS 8 13.396 6.994 -8.997 49 HD2 LYS 8 2HD LYS 8 12.522 8.586 -6.631 50 HD3 LYS 8 3HD LYS 8 14.214 8.771 -7.046 51 HE2 LYS 8 2HE LYS 8 13.248 10.417 -8.402 52 HE3 LYS 8 3HE LYS 8 13.310 9.070 -9.520 53 HZ1 LYS 8 2HZ LYS 8 10.905 9.178 -7.900 54 HZ3 LYS 8 1HZ LYS 8 11.056 8.881 -9.494 55 H CYS 9 HN CYS 9 14.645 5.616 -5.268 56 HA CYS 9 HA CYS 9 13.966 7.032 -2.886 57 HB2 CYS 9 2HB CYS 9 15.733 5.288 -2.949 58 HB3 CYS 9 3HB CYS 9 16.695 6.308 -4.001 59 H GLU 10 HN GLU 10 14.026 9.254 -2.601 60 HA GLU 10 HA GLU 10 14.709 10.798 -4.928 61 HB2 GLU 10 2HB GLU 10 13.193 11.286 -2.375 62 HB3 GLU 10 3HB GLU 10 13.884 12.678 -3.187 63 HG2 GLU 10 2HG GLU 10 12.599 10.950 -5.150 64 HG3 GLU 10 3HG GLU 10 11.474 11.293 -3.850 65 H LEU 11 HN LEU 11 16.948 9.508 -3.731 66 HA LEU 11 HA LEU 11 18.442 11.872 -2.917 67 HB2 LEU 11 2HB LEU 11 17.801 9.588 -1.208 68 HB3 LEU 11 3HB LEU 11 19.522 9.889 -1.330 69 HG LEU 11 HG LEU 11 17.454 11.948 -0.511 70 HD11 LEU 11 1HD1 LEU 11 17.844 11.500 1.689 71 HD12 LEU 11 2HD1 LEU 11 18.073 9.867 1.018 72 HD13 LEU 11 3HD1 LEU 11 19.488 10.882 1.394 73 HD21 LEU 11 3HD2 LEU 11 19.020 13.468 -0.902 74 HD22 LEU 11 1HD2 LEU 11 20.040 12.692 0.333 75 HD23 LEU 11 2HD2 LEU 11 20.186 12.208 -1.373 76 H CYS 12 HN CYS 12 18.790 8.283 -3.410 77 HA CYS 12 HA CYS 12 21.230 8.825 -4.873 78 HB2 CYS 12 2HB CYS 12 21.513 6.378 -4.852 79 HB3 CYS 12 3HB CYS 12 21.382 7.083 -3.253 80 H GLY 13 HN GLY 13 17.998 7.213 -5.252 81 HA2 GLY 13 1HA GLY 13 16.771 7.726 -7.280 82 HA3 GLY 13 2HA GLY 13 18.272 7.587 -8.174 83 H GLN 14 HN GLN 14 17.398 5.413 -5.465 84 HA GLN 14 HA GLN 14 17.708 3.196 -7.224 85 HB2 GLN 14 2HB GLN 14 18.631 3.057 -4.974 86 HB3 GLN 14 3HB GLN 14 17.075 3.414 -4.252 87 HG2 GLN 14 2HG GLN 14 16.333 1.259 -4.477 88 HG3 GLN 14 3HG GLN 14 16.982 1.099 -6.097 89 HE21 GLN 14 1HE2 GLN 14 18.313 1.718 -2.845 90 HE22 GLN 14 2HE2 GLN 14 19.536 0.491 -2.873 91 H VAL 15 HN VAL 15 16.077 2.403 -8.473 92 HA VAL 15 HA VAL 15 13.339 2.834 -7.503 93 HB VAL 15 HB VAL 15 14.206 2.227 -10.327 94 HG11 VAL 15 1HG1 VAL 15 12.055 2.871 -10.973 95 HG12 VAL 15 2HG1 VAL 15 11.773 1.964 -9.468 96 HG13 VAL 15 3HG1 VAL 15 11.749 3.745 -9.452 97 HG21 VAL 15 3HG2 VAL 15 14.116 4.629 -10.800 98 HG22 VAL 15 1HG2 VAL 15 13.810 4.969 -9.079 99 HG23 VAL 15 2HG2 VAL 15 15.366 4.269 -9.585 100 H VAL 16 HN VAL 16 12.153 1.086 -6.905 101 HA VAL 16 HA VAL 16 13.048 -1.524 -7.898 102 HB VAL 16 HB VAL 16 13.017 -2.484 -5.788 103 HG11 VAL 16 1HG1 VAL 16 14.056 0.070 -4.714 104 HG12 VAL 16 2HG1 VAL 16 14.844 -1.519 -4.872 105 HG13 VAL 16 3HG1 VAL 16 14.744 -0.431 -6.277 106 HG21 VAL 16 3HG2 VAL 16 12.146 -1.377 -3.750 107 HG22 VAL 16 1HG2 VAL 16 11.619 0.002 -4.744 108 HG23 VAL 16 2HG2 VAL 16 10.891 -1.603 -4.992 109 H LYS 17 HN LYS 17 11.327 -3.159 -7.930 110 HA LYS 17 HA LYS 17 8.702 -1.863 -8.136 111 HB2 LYS 17 2HB LYS 17 8.904 -2.644 -10.239 112 HB3 LYS 17 3HB LYS 17 10.159 -3.791 -9.816 113 HG2 LYS 17 2HG LYS 17 8.268 -5.122 -10.447 114 HG3 LYS 17 3HG LYS 17 8.340 -5.217 -8.698 115 HD2 LYS 17 2HD LYS 17 6.083 -4.723 -8.968 116 HD3 LYS 17 3HD LYS 17 6.722 -3.098 -8.814 117 HE2 LYS 17 2HE LYS 17 7.000 -3.281 -11.466 118 HE3 LYS 17 3HE LYS 17 5.790 -4.540 -11.306 119 HZ1 LYS 17 2HZ LYS 17 4.404 -2.878 -10.079 120 HZ3 LYS 17 1HZ LYS 17 4.677 -2.450 -11.626 121 H VAL 18 HN VAL 18 7.197 -2.378 -6.641 122 HA VAL 18 HA VAL 18 7.830 -4.303 -4.647 123 HB VAL 18 HB VAL 18 5.326 -2.711 -5.231 124 HG11 VAL 18 1HG1 VAL 18 4.884 -4.736 -3.864 125 HG12 VAL 18 2HG1 VAL 18 6.099 -4.182 -2.688 126 HG13 VAL 18 3HG1 VAL 18 4.624 -3.224 -2.962 127 HG21 VAL 18 3HG2 VAL 18 7.872 -1.910 -4.260 128 HG22 VAL 18 1HG2 VAL 18 6.373 -0.953 -4.348 129 HG23 VAL 18 2HG2 VAL 18 6.752 -1.882 -2.877 130 H LEU 19 HN LEU 19 7.558 -6.465 -4.789 131 HA LEU 19 HA LEU 19 5.729 -7.440 -6.846 132 HB2 LEU 19 2HB LEU 19 8.179 -8.486 -5.509 133 HB3 LEU 19 3HB LEU 19 6.986 -9.645 -6.062 134 HG LEU 19 HG LEU 19 7.214 -8.117 -8.293 135 HD11 LEU 19 1HD1 LEU 19 9.276 -7.201 -8.652 136 HD12 LEU 19 2HD1 LEU 19 9.111 -6.904 -6.904 137 HD13 LEU 19 3HD1 LEU 19 10.086 -8.275 -7.485 138 HD21 LEU 19 3HD2 LEU 19 9.321 -10.154 -8.155 139 HD22 LEU 19 1HD2 LEU 19 7.737 -10.710 -7.562 140 HD23 LEU 19 2HD2 LEU 19 7.888 -10.044 -9.205 141 H GLU 20 HN GLU 20 6.605 -7.911 -3.359 142 HA GLU 20 HA GLU 20 3.838 -8.747 -2.991 143 HB2 GLU 20 2HB GLU 20 5.734 -10.586 -2.859 144 HB3 GLU 20 3HB GLU 20 6.064 -9.886 -1.286 145 HG2 GLU 20 2HG GLU 20 3.758 -10.296 -0.548 146 HG3 GLU 20 3HG GLU 20 3.290 -10.818 -2.155 147 H GLU 21 HN GLU 21 2.953 -6.949 -2.018 148 HA GLU 21 HA GLU 21 4.305 -5.094 -0.575 149 HB2 GLU 21 2HB GLU 21 2.062 -4.457 0.349 150 HB3 GLU 21 3HB GLU 21 2.047 -4.701 -1.385 151 HG2 GLU 21 2HG GLU 21 0.608 -6.468 -1.240 152 HG3 GLU 21 3HG GLU 21 1.503 -7.202 0.075 153 H GLY 22 HN GLY 22 4.200 -4.580 1.811 154 HA2 GLY 22 1HA GLY 22 4.114 -7.033 3.457 155 HA3 GLY 22 2HA GLY 22 5.461 -5.914 3.539 156 H GLY 23 HN GLY 23 4.641 -3.440 3.753 157 HA2 GLY 23 1HA GLY 23 2.494 -2.387 4.719 158 HA3 GLY 23 2HA GLY 23 2.823 -3.457 6.067 159 H GLY 24 HN GLY 24 5.875 -3.003 5.101 160 HA2 GLY 24 1HA GLY 24 6.298 -0.805 6.974 161 HA3 GLY 24 2HA GLY 24 7.498 -1.910 6.332 162 H THR 25 HN THR 25 8.702 0.232 6.046 163 HA THR 25 HA THR 25 8.040 1.308 3.390 164 HB THR 25 HB THR 25 8.544 2.728 6.022 165 HG1 THR 25 HG1 THR 25 6.405 2.806 5.306 166 HG21 THR 25 3HG2 THR 25 9.075 4.794 4.835 167 HG22 THR 25 1HG2 THR 25 10.266 3.575 4.320 168 HG23 THR 25 2HG2 THR 25 8.900 3.989 3.257 169 H LEU 26 HN LEU 26 9.790 1.846 2.052 170 HA LEU 26 HA LEU 26 12.196 0.409 2.783 171 HB2 LEU 26 2HB LEU 26 11.615 1.823 0.189 172 HB3 LEU 26 3HB LEU 26 12.776 0.546 0.494 173 HG LEU 26 HG LEU 26 9.811 0.082 0.821 174 HD11 LEU 26 1HD1 LEU 26 9.993 -0.946 -1.528 175 HD12 LEU 26 2HD1 LEU 26 9.857 0.824 -1.394 176 HD13 LEU 26 3HD1 LEU 26 11.440 0.075 -1.716 177 HD21 LEU 26 3HD2 LEU 26 10.483 -1.925 1.479 178 HD22 LEU 26 1HD2 LEU 26 11.184 -2.195 -0.134 179 HD23 LEU 26 2HD2 LEU 26 12.183 -1.502 1.166 180 H VAL 27 HN VAL 27 13.238 1.651 4.355 181 HA VAL 27 HA VAL 27 13.627 4.464 3.858 182 HB VAL 27 HB VAL 27 14.452 2.563 6.053 183 HG11 VAL 27 1HG1 VAL 27 15.745 4.974 5.356 184 HG12 VAL 27 2HG1 VAL 27 14.734 5.347 6.774 185 HG13 VAL 27 3HG1 VAL 27 15.929 4.030 6.854 186 HG21 VAL 27 3HG2 VAL 27 12.914 4.219 7.343 187 HG22 VAL 27 1HG2 VAL 27 12.308 4.655 5.727 188 HG23 VAL 27 2HG2 VAL 27 12.173 2.976 6.306 189 H CYS 28 HN CYS 28 15.071 5.028 2.301 190 HA CYS 28 HA CYS 28 17.623 3.589 2.354 191 HB2 CYS 28 2HB CYS 28 16.218 3.042 0.362 192 HB3 CYS 28 3HB CYS 28 16.279 4.730 -0.103 193 H CYS 29 HN CYS 29 19.470 4.929 2.364 194 HA CYS 29 HA CYS 29 20.678 6.751 2.546 195 HB2 CYS 29 2HB CYS 29 18.444 7.920 0.901 196 HB3 CYS 29 3HB CYS 29 19.765 8.916 1.479 197 H GLY 30 HN GLY 30 18.173 5.964 4.319 198 HA2 GLY 30 1HA GLY 30 17.677 6.635 6.449 199 HA3 GLY 30 2HA GLY 30 18.516 8.150 6.189 200 H GLU 31 HN GLU 31 16.507 7.566 3.504 201 HA GLU 31 HA GLU 31 14.415 9.185 4.738 202 HB2 GLU 31 2HB GLU 31 16.029 9.967 2.680 203 HB3 GLU 31 3HB GLU 31 14.735 9.219 1.765 204 HG2 GLU 31 2HG GLU 31 13.727 11.268 1.977 205 HG3 GLU 31 3HG GLU 31 13.249 10.665 3.552 206 H ASP 32 HN ASP 32 12.201 8.922 3.628 207 HA ASP 32 HA ASP 32 11.776 6.094 3.345 208 HB2 ASP 32 2HB ASP 32 9.292 7.017 3.178 209 HB3 ASP 32 3HB ASP 32 10.116 6.972 4.723 210 H MET 33 HN MET 33 11.994 5.294 1.243 211 HA MET 33 HA MET 33 12.183 6.704 -1.016 212 HB2 MET 33 2HB MET 33 12.248 4.072 -0.399 213 HB3 MET 33 3HB MET 33 10.633 4.095 -1.082 214 HG2 MET 33 2HG MET 33 11.397 4.680 -3.238 215 HG3 MET 33 3HG MET 33 12.872 5.410 -2.635 216 HE1 MET 33 3HE MET 33 15.059 2.469 -1.594 217 HE2 MET 33 1HE MET 33 14.487 4.103 -1.181 218 HE3 MET 33 2HE MET 33 13.683 2.676 -0.484 219 H VAL 34 HN VAL 34 10.767 7.241 -2.817 220 HA VAL 34 HA VAL 34 8.027 7.732 -1.902 221 HB VAL 34 HB VAL 34 8.007 9.612 -3.204 222 HG11 VAL 34 1HG1 VAL 34 9.916 10.886 -2.678 223 HG12 VAL 34 2HG1 VAL 34 9.870 9.617 -1.431 224 HG13 VAL 34 3HG1 VAL 34 11.000 9.480 -2.799 225 HG21 VAL 34 3HG2 VAL 34 8.566 8.431 -5.320 226 HG22 VAL 34 1HG2 VAL 34 9.349 10.024 -5.182 227 HG23 VAL 34 2HG2 VAL 34 10.291 8.541 -4.896 228 H LYS 35 HN LYS 35 6.269 7.460 -3.531 229 HA LYS 35 HA LYS 35 6.751 5.005 -5.006 230 HB2 LYS 35 2HB LYS 35 4.699 5.800 -3.390 231 HB3 LYS 35 3HB LYS 35 4.045 6.200 -4.966 232 HG2 LYS 35 2HG LYS 35 3.398 3.973 -4.850 233 HG3 LYS 35 3HG LYS 35 4.963 3.771 -5.615 234 HD2 LYS 35 2HD LYS 35 5.730 2.572 -3.849 235 HD3 LYS 35 3HD LYS 35 5.353 3.879 -2.744 236 HE2 LYS 35 2HE LYS 35 3.108 2.114 -3.758 237 HE3 LYS 35 3HE LYS 35 4.156 1.515 -2.487 238 HZ1 LYS 35 2HZ LYS 35 2.048 2.937 -1.902 239 HZ3 LYS 35 1HZ LYS 35 3.029 4.208 -2.175 240 H GLN 36 HN GLN 36 6.131 4.767 -7.261 241 HA GLN 36 HA GLN 36 6.265 7.336 -8.638 242 HB2 GLN 36 2HB GLN 36 7.261 4.640 -9.658 243 HB3 GLN 36 3HB GLN 36 7.442 6.185 -10.467 244 HG2 GLN 36 2HG GLN 36 8.548 5.687 -7.671 245 HG3 GLN 36 3HG GLN 36 9.475 5.324 -9.113 246 HE21 GLN 36 1HE2 GLN 36 8.103 7.782 -7.092 247 HE22 GLN 36 2HE2 GLN 36 8.883 9.162 -7.793 248 H1 ALA 1 HN ALA 1 23.788 -2.581 -5.472 249 HA ALA 1 HA ALA 1 21.868 -4.389 -4.227 250 HB1 ALA 1 1HB ALA 1 21.339 -1.655 -5.210 251 HB2 ALA 1 2HB ALA 1 20.273 -2.895 -5.915 252 HB3 ALA 1 3HB ALA 1 20.362 -2.698 -4.148 253 H ASN 2 HN ASN 2 22.854 -2.711 -7.298 254 HA ASN 2 HA ASN 2 23.380 -3.507 -9.252 255 HB2 ASN 2 2HB ASN 2 23.131 -6.352 -8.149 256 HB3 ASN 2 3HB ASN 2 24.012 -5.862 -9.583 257 HD21 ASN 2 1HD2 ASN 2 24.647 -7.093 -6.840 258 HD22 ASN 2 2HD2 ASN 2 26.039 -6.225 -6.281 259 H GLU 3 HN GLU 3 21.972 -3.686 -11.032 260 HA GLU 3 HA GLU 3 19.284 -4.056 -10.605 261 HB2 GLU 3 2HB GLU 3 20.838 -4.332 -13.217 262 HB3 GLU 3 3HB GLU 3 19.108 -4.077 -13.091 263 HG2 GLU 3 2HG GLU 3 19.353 -1.866 -12.270 264 HG3 GLU 3 3HG GLU 3 20.990 -2.147 -11.709 265 H GLY 4 HN GLY 4 17.816 -5.758 -11.511 266 HA2 GLY 4 1HA GLY 4 17.192 -7.893 -11.882 267 HA3 GLY 4 2HA GLY 4 18.849 -8.288 -12.297 268 H ASP 5 HN ASP 5 17.635 -6.872 -9.201 269 HA ASP 5 HA ASP 5 18.469 -9.362 -7.933 270 HB2 ASP 5 2HB ASP 5 19.136 -6.512 -7.345 271 HB3 ASP 5 3HB ASP 5 18.710 -7.465 -5.939 272 H VAL 6 HN VAL 6 17.377 -9.542 -5.628 273 HA VAL 6 HA VAL 6 14.763 -8.218 -5.633 274 HB VAL 6 HB VAL 6 15.408 -11.136 -5.607 275 HG11 VAL 6 1HG1 VAL 6 12.937 -9.954 -4.296 276 HG12 VAL 6 2HG1 VAL 6 13.290 -11.682 -4.534 277 HG13 VAL 6 3HG1 VAL 6 14.299 -10.711 -3.435 278 HG21 VAL 6 3HG2 VAL 6 14.572 -10.497 -7.675 279 HG22 VAL 6 1HG2 VAL 6 13.100 -11.047 -6.838 280 HG23 VAL 6 2HG2 VAL 6 13.450 -9.306 -6.975 281 H TYR 7 HN TYR 7 13.930 -7.742 -3.556 282 HA TYR 7 HA TYR 7 15.737 -8.395 -1.334 283 HB2 TYR 7 2HB TYR 7 14.611 -5.798 -2.443 284 HB3 TYR 7 3HB TYR 7 14.725 -5.917 -0.699 285 HD1 TYR 7 HD1 TYR 7 17.006 -6.388 0.349 286 HD2 TYR 7 HD2 TYR 7 16.520 -5.306 -3.762 287 HE1 TYR 7 HE1 TYR 7 19.455 -5.716 0.229 288 HE2 TYR 7 HE2 TYR 7 18.971 -4.638 -3.869 289 HH TYR 7 HH TYR 7 21.144 -5.331 -1.229 290 H LYS 8 HN LYS 8 14.695 -9.353 0.342 291 HA LYS 8 HA LYS 8 11.810 -8.844 0.552 292 HB2 LYS 8 2HB LYS 8 12.123 -11.064 -0.344 293 HB3 LYS 8 3HB LYS 8 13.306 -11.457 0.887 294 HG2 LYS 8 2HG LYS 8 10.751 -10.491 2.026 295 HG3 LYS 8 3HG LYS 8 10.554 -11.934 1.052 296 HD2 LYS 8 2HD LYS 8 12.919 -12.089 2.814 297 HD3 LYS 8 3HD LYS 8 11.437 -11.845 3.715 298 HE2 LYS 8 2HE LYS 8 11.624 -13.963 1.536 299 HE3 LYS 8 3HE LYS 8 12.147 -14.298 3.175 300 HZ1 LYS 8 2HZ LYS 8 9.675 -14.718 2.484 301 HZ3 LYS 8 1HZ LYS 8 9.479 -13.129 2.780 302 H CYS 9 HN CYS 9 11.088 -8.160 2.523 303 HA CYS 9 HA CYS 9 13.046 -7.466 4.442 304 HB2 CYS 9 2HB CYS 9 11.050 -6.083 4.025 305 HB3 CYS 9 3HB CYS 9 10.015 -7.369 4.613 306 H GLU 10 HN GLU 10 13.520 -8.486 6.432 307 HA GLU 10 HA GLU 10 12.574 -11.200 6.596 308 HB2 GLU 10 2HB GLU 10 14.901 -9.651 7.623 309 HB3 GLU 10 3HB GLU 10 14.308 -10.890 8.712 310 HG2 GLU 10 2HG GLU 10 14.620 -11.649 5.816 311 HG3 GLU 10 3HG GLU 10 16.090 -11.420 6.743 312 H LEU 11 HN LEU 11 10.598 -9.156 7.102 313 HA LEU 11 HA LEU 11 9.919 -9.917 9.819 314 HB2 LEU 11 2HB LEU 11 11.082 -7.854 10.178 315 HB3 LEU 11 3HB LEU 11 10.193 -7.057 8.896 316 HG LEU 11 HG LEU 11 8.191 -6.992 10.161 317 HD11 LEU 11 1HD1 LEU 11 9.472 -8.728 12.285 318 HD12 LEU 11 2HD1 LEU 11 7.796 -8.133 12.231 319 HD13 LEU 11 3HD1 LEU 11 8.357 -9.323 11.033 320 HD21 LEU 11 3HD2 LEU 11 8.946 -5.259 11.316 321 HD22 LEU 11 1HD2 LEU 11 9.624 -6.350 12.549 322 HD23 LEU 11 2HD2 LEU 11 10.609 -5.871 11.145 323 H CYS 12 HN CYS 12 8.632 -7.418 7.541 324 HA CYS 12 HA CYS 12 6.030 -8.484 7.793 325 HB2 CYS 12 2HB CYS 12 5.441 -6.816 6.062 326 HB3 CYS 12 3HB CYS 12 6.269 -6.146 7.454 327 H GLY 13 HN GLY 13 8.707 -8.659 5.393 328 HA2 GLY 13 1HA GLY 13 9.071 -10.549 4.064 329 HA3 GLY 13 2HA GLY 13 7.371 -10.962 4.157 330 H GLN 14 HN GLN 14 8.527 -7.634 3.528 331 HA GLN 14 HA GLN 14 6.972 -7.555 1.171 332 HB2 GLN 14 2HB GLN 14 7.147 -5.567 2.553 333 HB3 GLN 14 3HB GLN 14 8.897 -5.577 2.459 334 HG2 GLN 14 2HG GLN 14 8.922 -4.855 0.207 335 HG3 GLN 14 3HG GLN 14 7.297 -5.431 -0.106 336 HE21 GLN 14 1HE2 GLN 14 8.651 -3.448 2.518 337 HE22 GLN 14 2HE2 GLN 14 7.637 -2.060 2.293 338 H VAL 15 HN VAL 15 7.593 -8.351 -0.786 339 HA VAL 15 HA VAL 15 10.470 -8.560 -1.289 340 HB VAL 15 HB VAL 15 8.072 -9.951 -2.494 341 HG11 VAL 15 1HG1 VAL 15 10.059 -11.388 -3.491 342 HG12 VAL 15 2HG1 VAL 15 9.470 -9.928 -4.322 343 HG13 VAL 15 3HG1 VAL 15 10.949 -9.855 -3.333 344 HG21 VAL 15 3HG2 VAL 15 9.463 -11.965 -1.529 345 HG22 VAL 15 1HG2 VAL 15 10.160 -10.712 -0.473 346 HG23 VAL 15 2HG2 VAL 15 8.405 -11.008 -0.465 347 H VAL 16 HN VAL 16 11.443 -7.370 -2.880 348 HA VAL 16 HA VAL 16 9.757 -6.126 -4.889 349 HB VAL 16 HB VAL 16 10.278 -3.939 -4.393 350 HG11 VAL 16 1HG1 VAL 16 8.701 -4.661 -2.753 351 HG12 VAL 16 2HG1 VAL 16 9.974 -5.398 -1.752 352 HG13 VAL 16 3HG1 VAL 16 9.881 -3.627 -1.913 353 HG21 VAL 16 3HG2 VAL 16 12.680 -5.092 -3.057 354 HG22 VAL 16 1HG2 VAL 16 12.525 -3.675 -4.124 355 HG23 VAL 16 2HG2 VAL 16 12.051 -3.555 -2.413 356 H LYS 17 HN LYS 17 10.801 -5.962 -6.857 357 HA LYS 17 HA LYS 17 13.506 -7.049 -6.885 358 HB2 LYS 17 2HB LYS 17 12.048 -8.265 -8.289 359 HB3 LYS 17 3HB LYS 17 11.313 -6.816 -8.946 360 HG2 LYS 17 2HG LYS 17 14.286 -7.162 -9.309 361 HG3 LYS 17 3HG LYS 17 13.228 -8.171 -10.275 362 HD2 LYS 17 2HD LYS 17 11.977 -6.003 -10.926 363 HD3 LYS 17 3HD LYS 17 13.302 -5.124 -10.188 364 HE2 LYS 17 2HE LYS 17 13.572 -7.141 -12.470 365 HE3 LYS 17 3HE LYS 17 13.636 -5.398 -12.644 366 HZ1 LYS 17 2HZ LYS 17 15.658 -5.318 -11.427 367 HZ3 LYS 17 1HZ LYS 17 15.853 -6.584 -12.434 368 H VAL 18 HN VAL 18 15.236 -5.738 -7.093 369 HA VAL 18 HA VAL 18 14.896 -2.958 -7.360 370 HB VAL 18 HB VAL 18 17.265 -4.820 -7.431 371 HG11 VAL 18 1HG1 VAL 18 18.753 -2.916 -7.389 372 HG12 VAL 18 2HG1 VAL 18 17.720 -2.807 -8.835 373 HG13 VAL 18 3HG1 VAL 18 17.377 -1.787 -7.417 374 HG21 VAL 18 3HG2 VAL 18 16.875 -2.725 -5.346 375 HG22 VAL 18 1HG2 VAL 18 15.766 -4.117 -5.322 376 HG23 VAL 18 2HG2 VAL 18 17.523 -4.377 -5.208 377 H LEU 19 HN LEU 19 14.508 -1.782 -9.157 378 HA LEU 19 HA LEU 19 14.818 -3.084 -11.721 379 HB2 LEU 19 2HB LEU 19 13.372 -0.735 -10.635 380 HB3 LEU 19 3HB LEU 19 13.885 -0.633 -12.307 381 HG LEU 19 HG LEU 19 12.467 -3.121 -11.470 382 HD11 LEU 19 1HD1 LEU 19 11.003 -1.671 -10.369 383 HD12 LEU 19 2HD1 LEU 19 11.174 -0.401 -11.606 384 HD13 LEU 19 3HD1 LEU 19 10.268 -1.889 -11.977 385 HD21 LEU 19 3HD2 LEU 19 12.181 -3.399 -13.665 386 HD22 LEU 19 1HD2 LEU 19 11.620 -1.726 -13.897 387 HD23 LEU 19 2HD2 LEU 19 13.364 -2.084 -13.864 388 H GLU 20 HN GLU 20 15.892 0.018 -10.158 389 HA GLU 20 HA GLU 20 18.323 -0.257 -11.727 390 HB2 GLU 20 2HB GLU 20 18.251 1.934 -12.564 391 HB3 GLU 20 3HB GLU 20 16.576 1.436 -12.687 392 HG2 GLU 20 2HG GLU 20 16.175 2.502 -10.398 393 HG3 GLU 20 3HG GLU 20 17.808 3.134 -10.469 394 H GLU 21 HN GLU 21 20.041 -0.312 -10.350 395 HA GLU 21 HA GLU 21 19.835 0.039 -7.672 396 HB2 GLU 21 2HB GLU 21 22.285 0.043 -7.635 397 HB3 GLU 21 3HB GLU 21 21.715 -1.098 -8.838 398 HG2 GLU 21 2HG GLU 21 22.129 0.525 -10.647 399 HG3 GLU 21 3HG GLU 21 22.552 1.768 -9.485 400 H GLY 22 HN GLY 22 21.060 1.726 -6.280 401 HA2 GLY 22 1HA GLY 22 20.853 4.418 -7.471 402 HA3 GLY 22 2HA GLY 22 20.047 4.040 -5.962 403 H GLY 23 HN GLY 23 21.311 3.536 -4.042 404 HA2 GLY 23 1HA GLY 23 24.038 3.282 -3.862 405 HA3 GLY 23 2HA GLY 23 23.758 5.011 -3.916 406 H GLY 24 HN GLY 24 21.814 2.310 -2.454 407 HA2 GLY 24 1HA GLY 24 22.523 3.008 0.223 408 HA3 GLY 24 2HA GLY 24 20.960 3.663 -0.220 409 H THR 25 HN THR 25 20.211 2.137 1.547 410 HA THR 25 HA THR 25 19.709 -0.510 0.365 411 HB THR 25 HB THR 25 20.626 0.247 3.178 412 HG1 THR 25 HG1 THR 25 22.370 -0.379 1.910 413 HG21 THR 25 3HG2 THR 25 20.159 -1.982 3.920 414 HG22 THR 25 1HG2 THR 25 18.660 -1.488 3.099 415 HG23 THR 25 2HG2 THR 25 19.822 -2.547 2.266 416 H LEU 26 HN LEU 26 17.718 -1.548 1.073 417 HA LEU 26 HA LEU 26 15.697 0.496 1.566 418 HB2 LEU 26 2HB LEU 26 15.073 -2.334 0.843 419 HB3 LEU 26 3HB LEU 26 14.185 -0.865 0.490 420 HG LEU 26 HG LEU 26 16.874 -1.374 -0.772 421 HD11 LEU 26 1HD1 LEU 26 14.920 -2.066 -2.662 422 HD12 LEU 26 2HD1 LEU 26 16.105 -3.137 -1.878 423 HD13 LEU 26 3HD1 LEU 26 14.482 -2.943 -1.176 424 HD21 LEU 26 3HD2 LEU 26 14.482 0.346 -1.440 425 HD22 LEU 26 1HD2 LEU 26 16.150 0.851 -1.076 426 HD23 LEU 26 2HD2 LEU 26 15.787 0.010 -2.603 427 H VAL 27 HN VAL 27 16.235 0.757 3.845 428 HA VAL 27 HA VAL 27 16.053 -1.510 5.566 429 HB VAL 27 HB VAL 27 16.102 1.470 6.072 430 HG11 VAL 27 1HG1 VAL 27 16.289 1.098 8.358 431 HG12 VAL 27 2HG1 VAL 27 15.070 -0.108 7.879 432 HG13 VAL 27 3HG1 VAL 27 16.757 -0.607 8.151 433 HG21 VAL 27 3HG2 VAL 27 18.339 -0.518 6.519 434 HG22 VAL 27 1HG2 VAL 27 18.115 0.333 4.971 435 HG23 VAL 27 2HG2 VAL 27 18.422 1.260 6.459 436 H CYS 28 HN CYS 28 14.132 -2.571 5.734 437 HA CYS 28 HA CYS 28 11.751 -0.881 5.979 438 HB2 CYS 28 2HB CYS 28 11.880 -2.465 4.023 439 HB3 CYS 28 3HB CYS 28 11.843 -3.791 5.169 440 H CYS 29 HN CYS 29 10.601 -1.012 7.912 441 HA CYS 29 HA CYS 29 10.058 -1.590 9.957 442 HB2 CYS 29 2HB CYS 29 11.121 -4.307 9.164 443 HB3 CYS 29 3HB CYS 29 10.326 -3.978 10.690 444 H GLY 30 HN GLY 30 12.747 -0.487 9.170 445 HA2 GLY 30 1HA GLY 30 14.578 0.206 10.292 446 HA3 GLY 30 2HA GLY 30 13.992 -0.613 11.726 447 H GLU 31 HN GLU 31 14.231 -2.505 8.763 448 HA GLU 31 HA GLU 31 16.804 -3.525 9.650 449 HB2 GLU 31 2HB GLU 31 14.794 -4.950 10.444 450 HB3 GLU 31 3HB GLU 31 14.554 -5.367 8.759 451 HG2 GLU 31 2HG GLU 31 17.308 -5.771 9.130 452 HG3 GLU 31 3HG GLU 31 16.618 -6.314 10.647 453 H ASP 32 HN ASP 32 18.251 -3.636 7.978 454 HA ASP 32 HA ASP 32 17.576 -2.732 5.481 455 HB2 ASP 32 2HB ASP 32 19.826 -3.942 4.846 456 HB3 ASP 32 3HB ASP 32 19.864 -2.605 5.977 457 H MET 33 HN MET 33 16.189 -3.801 4.054 458 HA MET 33 HA MET 33 15.313 -6.309 4.208 459 HB2 MET 33 2HB MET 33 14.872 -4.276 2.511 460 HB3 MET 33 3HB MET 33 15.975 -5.155 1.471 461 HG2 MET 33 2HG MET 33 14.522 -7.004 1.251 462 HG3 MET 33 3HG MET 33 13.695 -6.670 2.760 463 HE1 MET 33 3HE MET 33 12.633 -4.405 3.189 464 HE2 MET 33 1HE MET 33 13.244 -3.182 2.049 465 HE3 MET 33 2HE MET 33 11.523 -3.633 2.032 466 H VAL 34 HN VAL 34 15.831 -8.386 3.327 467 HA VAL 34 HA VAL 34 18.683 -8.721 2.877 468 HB VAL 34 HB VAL 34 18.412 -10.872 3.595 469 HG11 VAL 34 1HG1 VAL 34 17.541 -10.600 5.654 470 HG12 VAL 34 2HG1 VAL 34 17.203 -8.935 5.120 471 HG13 VAL 34 3HG1 VAL 34 15.931 -10.176 5.025 472 HG21 VAL 34 3HG2 VAL 34 16.959 -11.834 2.035 473 HG22 VAL 34 1HG2 VAL 34 16.081 -12.006 3.574 474 HG23 VAL 34 2HG2 VAL 34 15.631 -10.716 2.433 475 H LYS 35 HN LYS 35 19.436 -10.149 1.089 476 HA LYS 35 HA LYS 35 17.941 -9.495 -1.311 477 HB2 LYS 35 2HB LYS 35 20.601 -9.375 -0.720 478 HB3 LYS 35 3HB LYS 35 20.519 -10.938 -1.509 479 HG2 LYS 35 2HG LYS 35 20.719 -9.667 -3.418 480 HG3 LYS 35 3HG LYS 35 18.980 -9.530 -3.248 481 HD2 LYS 35 2HD LYS 35 19.134 -7.290 -2.928 482 HD3 LYS 35 3HD LYS 35 20.223 -7.518 -1.574 483 HE2 LYS 35 2HE LYS 35 21.144 -7.621 -4.484 484 HE3 LYS 35 3HE LYS 35 21.168 -6.153 -3.527 485 HZ1 LYS 35 2HZ LYS 35 22.522 -8.619 -2.596 486 HZ3 LYS 35 1HZ LYS 35 22.749 -7.100 -2.053 487 H GLN 36 HN GLN 36 17.386 -11.107 -2.920 488 HA GLN 36 HA GLN 36 17.123 -13.751 -1.711 489 HB2 GLN 36 2HB GLN 36 15.195 -12.480 -3.701 490 HB3 GLN 36 3HB GLN 36 14.985 -14.010 -2.873 491 HG2 GLN 36 2HG GLN 36 15.335 -11.418 -1.318 492 HG3 GLN 36 3HG GLN 36 13.762 -11.915 -1.908 493 HE21 GLN 36 1HE2 GLN 36 16.379 -12.575 0.276 494 HE22 GLN 36 2HE2 GLN 36 15.592 -13.753 1.272 Start of MODEL 7 1 H1 ALA 1 HN ALA 1 4.464 -2.356 0.281 2 HA ALA 1 HA ALA 1 2.334 -0.817 1.252 3 HB1 ALA 1 1HB ALA 1 2.906 0.667 -0.630 4 HB2 ALA 1 2HB ALA 1 4.376 0.088 0.188 5 HB3 ALA 1 3HB ALA 1 3.882 -0.628 -1.364 6 H ASN 2 HN ASN 2 2.710 -2.116 -2.123 7 HA ASN 2 HA ASN 2 0.271 -3.437 -2.085 8 HB2 ASN 2 2HB ASN 2 0.248 -0.554 -2.984 9 HB3 ASN 2 3HB ASN 2 -0.683 -1.690 -3.940 10 HD21 ASN 2 1HD2 ASN 2 -1.069 0.515 -1.724 11 HD22 ASN 2 2HD2 ASN 2 -2.323 -0.135 -0.723 12 H GLU 3 HN GLU 3 0.776 -5.017 -3.609 13 HA GLU 3 HA GLU 3 2.883 -5.014 -5.241 14 HB2 GLU 3 2HB GLU 3 0.165 -6.319 -5.674 15 HB3 GLU 3 3HB GLU 3 1.574 -6.709 -6.639 16 HG2 GLU 3 2HG GLU 3 2.814 -7.309 -4.521 17 HG3 GLU 3 3HG GLU 3 1.351 -7.003 -3.606 18 H GLY 4 HN GLY 4 3.207 -4.732 -7.588 19 HA2 GLY 4 1HA GLY 4 2.958 -3.681 -9.568 20 HA3 GLY 4 2HA GLY 4 1.268 -3.409 -9.193 21 H ASP 5 HN ASP 5 4.014 -2.365 -7.122 22 HA ASP 5 HA ASP 5 3.294 0.371 -7.825 23 HB2 ASP 5 2HB ASP 5 3.681 -0.998 -5.206 24 HB3 ASP 5 3HB ASP 5 4.485 0.555 -5.329 25 H VAL 6 HN VAL 6 5.215 1.947 -7.380 26 HA VAL 6 HA VAL 6 7.785 0.565 -7.674 27 HB VAL 6 HB VAL 6 6.491 2.601 -9.430 28 HG11 VAL 6 1HG1 VAL 6 8.645 3.385 -10.275 29 HG12 VAL 6 2HG1 VAL 6 8.482 3.764 -8.544 30 HG13 VAL 6 3HG1 VAL 6 9.500 2.400 -9.063 31 HG21 VAL 6 3HG2 VAL 6 6.558 0.775 -10.729 32 HG22 VAL 6 1HG2 VAL 6 8.302 1.096 -10.893 33 HG23 VAL 6 2HG2 VAL 6 7.720 -0.048 -9.660 34 H TYR 7 HN TYR 7 9.488 1.473 -6.521 35 HA TYR 7 HA TYR 7 8.835 3.932 -5.047 36 HB2 TYR 7 2HB TYR 7 9.886 1.182 -4.271 37 HB3 TYR 7 3HB TYR 7 10.512 2.553 -3.378 38 HD1 TYR 7 HD1 TYR 7 8.867 4.063 -2.143 39 HD2 TYR 7 HD2 TYR 7 7.749 0.273 -3.781 40 HE1 TYR 7 HE1 TYR 7 6.817 4.010 -0.640 41 HE2 TYR 7 HE2 TYR 7 5.704 0.232 -2.272 42 HH TYR 7 HH TYR 7 5.371 2.137 0.364 43 H LYS 8 HN LYS 8 10.279 5.542 -5.397 44 HA LYS 8 HA LYS 8 12.967 4.724 -6.257 45 HB2 LYS 8 2HB LYS 8 11.710 5.687 -8.115 46 HB3 LYS 8 3HB LYS 8 11.327 7.107 -7.164 47 HG2 LYS 8 2HG LYS 8 14.228 6.505 -7.229 48 HG3 LYS 8 3HG LYS 8 13.557 6.813 -8.818 49 HD2 LYS 8 2HD LYS 8 12.700 8.696 -6.650 50 HD3 LYS 8 3HD LYS 8 14.385 8.791 -7.123 51 HE2 LYS 8 2HE LYS 8 13.466 10.267 -8.671 52 HE3 LYS 8 3HE LYS 8 13.379 8.783 -9.598 53 HZ1 LYS 8 2HZ LYS 8 11.143 8.882 -9.554 54 HZ3 LYS 8 1HZ LYS 8 11.249 10.383 -8.932 55 H CYS 9 HN CYS 9 14.703 5.600 -5.170 56 HA CYS 9 HA CYS 9 14.063 6.914 -2.713 57 HB2 CYS 9 2HB CYS 9 15.803 5.167 -2.826 58 HB3 CYS 9 3HB CYS 9 16.756 6.168 -3.903 59 H GLU 10 HN GLU 10 14.603 9.093 -2.160 60 HA GLU 10 HA GLU 10 15.070 10.747 -4.496 61 HB2 GLU 10 2HB GLU 10 13.814 11.227 -1.785 62 HB3 GLU 10 3HB GLU 10 14.396 12.589 -2.722 63 HG2 GLU 10 2HG GLU 10 12.787 10.672 -4.315 64 HG3 GLU 10 3HG GLU 10 11.893 11.395 -2.994 65 H LEU 11 HN LEU 11 17.261 9.221 -3.301 66 HA LEU 11 HA LEU 11 18.934 11.493 -2.532 67 HB2 LEU 11 2HB LEU 11 18.188 9.248 -0.859 68 HB3 LEU 11 3HB LEU 11 19.922 9.298 -1.109 69 HG LEU 11 HG LEU 11 18.923 11.947 -0.493 70 HD11 LEU 11 1HD1 LEU 11 18.550 10.121 1.845 71 HD12 LEU 11 2HD1 LEU 11 17.842 11.720 1.510 72 HD13 LEU 11 3HD1 LEU 11 17.230 10.280 0.661 73 HD21 LEU 11 3HD2 LEU 11 21.021 10.057 0.466 74 HD22 LEU 11 1HD2 LEU 11 21.158 11.736 -0.107 75 HD23 LEU 11 2HD2 LEU 11 20.553 11.402 1.532 76 H CYS 12 HN CYS 12 19.188 7.904 -3.074 77 HA CYS 12 HA CYS 12 21.555 8.382 -4.642 78 HB2 CYS 12 2HB CYS 12 21.643 5.907 -4.783 79 HB3 CYS 12 3HB CYS 12 21.671 6.545 -3.151 80 H GLY 13 HN GLY 13 18.221 6.990 -5.020 81 HA2 GLY 13 1HA GLY 13 16.972 7.688 -6.976 82 HA3 GLY 13 2HA GLY 13 18.439 7.525 -7.921 83 H GLN 14 HN GLN 14 17.600 5.220 -5.327 84 HA GLN 14 HA GLN 14 17.754 3.100 -7.194 85 HB2 GLN 14 2HB GLN 14 18.604 2.881 -4.882 86 HB3 GLN 14 3HB GLN 14 16.993 3.132 -4.239 87 HG2 GLN 14 2HG GLN 14 16.314 1.076 -5.736 88 HG3 GLN 14 3HG GLN 14 18.035 0.756 -5.821 89 HE21 GLN 14 1HE2 GLN 14 18.534 1.932 -3.172 90 HE22 GLN 14 2HE2 GLN 14 18.014 0.772 -1.997 91 H VAL 15 HN VAL 15 16.112 2.393 -8.480 92 HA VAL 15 HA VAL 15 13.381 2.968 -7.571 93 HB VAL 15 HB VAL 15 14.579 2.617 -10.322 94 HG11 VAL 15 1HG1 VAL 15 12.585 1.962 -11.071 95 HG12 VAL 15 2HG1 VAL 15 11.888 2.093 -9.438 96 HG13 VAL 15 3HG1 VAL 15 11.898 3.509 -10.518 97 HG21 VAL 15 3HG2 VAL 15 14.356 4.881 -10.618 98 HG22 VAL 15 1HG2 VAL 15 13.002 5.012 -9.471 99 HG23 VAL 15 2HG2 VAL 15 14.666 4.841 -8.866 100 H VAL 16 HN VAL 16 12.462 1.232 -6.607 101 HA VAL 16 HA VAL 16 13.010 -1.381 -7.836 102 HB VAL 16 HB VAL 16 13.148 -2.389 -5.762 103 HG11 VAL 16 1HG1 VAL 16 14.338 0.169 -4.796 104 HG12 VAL 16 2HG1 VAL 16 15.033 -1.468 -4.866 105 HG13 VAL 16 3HG1 VAL 16 14.937 -0.477 -6.343 106 HG21 VAL 16 3HG2 VAL 16 12.438 -1.406 -3.640 107 HG22 VAL 16 1HG2 VAL 16 11.984 0.101 -4.470 108 HG23 VAL 16 2HG2 VAL 16 11.096 -1.403 -4.809 109 H LYS 17 HN LYS 17 11.235 -2.628 -8.355 110 HA LYS 17 HA LYS 17 8.660 -1.319 -7.916 111 HB2 LYS 17 2HB LYS 17 9.142 -1.700 -10.226 112 HB3 LYS 17 3HB LYS 17 9.621 -3.360 -9.933 113 HG2 LYS 17 2HG LYS 17 6.858 -2.606 -9.038 114 HG3 LYS 17 3HG LYS 17 7.123 -2.647 -10.770 115 HD2 LYS 17 2HD LYS 17 8.259 -4.989 -10.288 116 HD3 LYS 17 3HD LYS 17 7.394 -4.908 -8.766 117 HE2 LYS 17 2HE LYS 17 5.880 -6.047 -10.194 118 HE3 LYS 17 3HE LYS 17 5.271 -4.404 -10.191 119 HZ1 LYS 17 2HZ LYS 17 5.676 -5.629 -12.444 120 HZ3 LYS 17 1HZ LYS 17 7.226 -5.166 -12.253 121 H VAL 18 HN VAL 18 7.325 -2.055 -6.358 122 HA VAL 18 HA VAL 18 8.038 -4.359 -4.867 123 HB VAL 18 HB VAL 18 5.600 -2.572 -4.876 124 HG11 VAL 18 1HG1 VAL 18 4.726 -4.428 -3.829 125 HG12 VAL 18 2HG1 VAL 18 6.307 -4.966 -3.215 126 HG13 VAL 18 3HG1 VAL 18 5.472 -3.597 -2.442 127 HG21 VAL 18 3HG2 VAL 18 7.769 -2.651 -2.780 128 HG22 VAL 18 1HG2 VAL 18 7.950 -1.673 -4.257 129 HG23 VAL 18 2HG2 VAL 18 6.598 -1.360 -3.142 130 H LEU 19 HN LEU 19 7.528 -6.458 -5.232 131 HA LEU 19 HA LEU 19 5.459 -6.956 -7.251 132 HB2 LEU 19 2HB LEU 19 6.592 -9.091 -7.619 133 HB3 LEU 19 3HB LEU 19 7.611 -7.706 -7.957 134 HG LEU 19 HG LEU 19 8.092 -8.434 -5.251 135 HD11 LEU 19 1HD1 LEU 19 7.286 -10.605 -5.428 136 HD12 LEU 19 2HD1 LEU 19 7.838 -10.785 -7.111 137 HD13 LEU 19 3HD1 LEU 19 9.021 -10.791 -5.780 138 HD21 LEU 19 3HD2 LEU 19 9.754 -8.773 -7.762 139 HD22 LEU 19 1HD2 LEU 19 9.704 -7.349 -6.695 140 HD23 LEU 19 2HD2 LEU 19 10.369 -8.888 -6.096 141 H GLU 20 HN GLU 20 6.652 -7.714 -3.963 142 HA GLU 20 HA GLU 20 4.066 -8.985 -3.514 143 HB2 GLU 20 2HB GLU 20 6.450 -10.355 -3.480 144 HB3 GLU 20 3HB GLU 20 6.329 -9.884 -1.796 145 HG2 GLU 20 2HG GLU 20 4.080 -10.897 -1.630 146 HG3 GLU 20 3HG GLU 20 4.088 -11.272 -3.342 147 H GLU 21 HN GLU 21 3.102 -7.125 -2.610 148 HA GLU 21 HA GLU 21 4.347 -5.369 -0.929 149 HB2 GLU 21 2HB GLU 21 2.171 -4.518 -0.452 150 HB3 GLU 21 3HB GLU 21 2.061 -5.174 -2.073 151 HG2 GLU 21 2HG GLU 21 1.468 -7.347 -0.323 152 HG3 GLU 21 3HG GLU 21 0.606 -5.968 0.330 153 H GLY 22 HN GLY 22 4.049 -5.025 1.453 154 HA2 GLY 22 1HA GLY 22 3.622 -7.545 2.927 155 HA3 GLY 22 2HA GLY 22 5.080 -6.605 3.168 156 H GLY 23 HN GLY 23 5.017 -4.607 4.309 157 HA2 GLY 23 1HA GLY 23 2.749 -3.154 4.961 158 HA3 GLY 23 2HA GLY 23 2.926 -4.368 6.212 159 H GLY 24 HN GLY 24 5.388 -2.512 4.285 160 HA2 GLY 24 1HA GLY 24 6.198 -1.052 6.670 161 HA3 GLY 24 2HA GLY 24 7.357 -2.210 6.049 162 H THR 25 HN THR 25 8.412 0.173 5.957 163 HA THR 25 HA THR 25 7.866 1.230 3.261 164 HB THR 25 HB THR 25 7.472 2.656 5.442 165 HG1 THR 25 HG1 THR 25 7.849 3.261 3.051 166 HG21 THR 25 3HG2 THR 25 9.809 3.960 5.704 167 HG22 THR 25 1HG2 THR 25 9.429 2.563 6.740 168 HG23 THR 25 2HG2 THR 25 10.478 2.356 5.318 169 H LEU 26 HN LEU 26 9.844 2.254 2.210 170 HA LEU 26 HA LEU 26 12.112 0.454 2.703 171 HB2 LEU 26 2HB LEU 26 11.430 1.834 0.111 172 HB3 LEU 26 3HB LEU 26 12.622 0.578 0.382 173 HG LEU 26 HG LEU 26 9.691 0.065 0.873 174 HD11 LEU 26 1HD1 LEU 26 9.368 -0.659 -1.374 175 HD12 LEU 26 2HD1 LEU 26 10.027 0.994 -1.435 176 HD13 LEU 26 3HD1 LEU 26 11.082 -0.398 -1.774 177 HD21 LEU 26 3HD2 LEU 26 10.255 -2.231 0.631 178 HD22 LEU 26 1HD2 LEU 26 11.883 -1.840 0.025 179 HD23 LEU 26 2HD2 LEU 26 11.462 -1.510 1.723 180 H VAL 27 HN VAL 27 12.673 2.048 4.455 181 HA VAL 27 HA VAL 27 13.344 4.697 3.725 182 HB VAL 27 HB VAL 27 14.139 2.971 6.078 183 HG11 VAL 27 1HG1 VAL 27 15.218 4.717 7.031 184 HG12 VAL 27 2HG1 VAL 27 15.406 5.265 5.347 185 HG13 VAL 27 3HG1 VAL 27 14.093 5.921 6.355 186 HG21 VAL 27 3HG2 VAL 27 11.708 4.486 5.379 187 HG22 VAL 27 1HG2 VAL 27 11.944 3.163 6.547 188 HG23 VAL 27 2HG2 VAL 27 12.352 4.834 7.002 189 H CYS 28 HN CYS 28 14.867 5.105 2.193 190 HA CYS 28 HA CYS 28 17.366 3.594 2.450 191 HB2 CYS 28 2HB CYS 28 15.985 3.085 0.398 192 HB3 CYS 28 3HB CYS 28 16.255 4.737 -0.117 193 H CYS 29 HN CYS 29 19.264 4.853 2.523 194 HA CYS 29 HA CYS 29 20.526 6.627 2.788 195 HB2 CYS 29 2HB CYS 29 18.553 7.836 0.852 196 HB3 CYS 29 3HB CYS 29 19.927 8.732 1.470 197 H GLY 30 HN GLY 30 18.097 6.016 4.519 198 HA2 GLY 30 1HA GLY 30 17.282 6.880 6.440 199 HA3 GLY 30 2HA GLY 30 18.262 8.313 6.201 200 H GLU 31 HN GLU 31 16.089 7.213 3.619 201 HA GLU 31 HA GLU 31 14.099 9.132 4.471 202 HB2 GLU 31 2HB GLU 31 15.732 10.309 2.939 203 HB3 GLU 31 3HB GLU 31 15.313 9.171 1.674 204 HG2 GLU 31 2HG GLU 31 13.532 10.457 1.122 205 HG3 GLU 31 3HG GLU 31 12.832 10.149 2.698 206 H ASP 32 HN ASP 32 12.047 8.335 4.172 207 HA ASP 32 HA ASP 32 11.717 5.739 3.313 208 HB2 ASP 32 2HB ASP 32 9.959 6.412 4.657 209 HB3 ASP 32 3HB ASP 32 9.964 8.047 4.027 210 H MET 33 HN MET 33 11.877 5.006 1.187 211 HA MET 33 HA MET 33 12.137 6.553 -0.993 212 HB2 MET 33 2HB MET 33 12.203 3.887 -0.507 213 HB3 MET 33 3HB MET 33 10.613 3.942 -1.243 214 HG2 MET 33 2HG MET 33 11.457 4.706 -3.331 215 HG3 MET 33 3HG MET 33 12.942 5.311 -2.624 216 HE1 MET 33 3HE MET 33 15.014 2.349 -1.773 217 HE2 MET 33 1HE MET 33 14.252 3.799 -1.077 218 HE3 MET 33 2HE MET 33 13.576 2.189 -0.736 219 H VAL 34 HN VAL 34 10.794 7.400 -2.649 220 HA VAL 34 HA VAL 34 8.046 7.806 -1.798 221 HB VAL 34 HB VAL 34 8.061 9.687 -3.097 222 HG11 VAL 34 1HG1 VAL 34 9.943 9.641 -1.345 223 HG12 VAL 34 2HG1 VAL 34 11.054 9.478 -2.727 224 HG13 VAL 34 3HG1 VAL 34 10.007 10.911 -2.592 225 HG21 VAL 34 3HG2 VAL 34 8.427 9.177 -5.282 226 HG22 VAL 34 1HG2 VAL 34 10.038 9.852 -4.930 227 HG23 VAL 34 2HG2 VAL 34 9.788 8.089 -4.916 228 H LYS 35 HN LYS 35 6.259 7.560 -3.386 229 HA LYS 35 HA LYS 35 6.675 5.109 -4.888 230 HB2 LYS 35 2HB LYS 35 4.661 5.943 -3.228 231 HB3 LYS 35 3HB LYS 35 3.984 6.320 -4.799 232 HG2 LYS 35 2HG LYS 35 3.521 4.129 -5.136 233 HG3 LYS 35 3HG LYS 35 5.227 3.745 -5.035 234 HD2 LYS 35 2HD LYS 35 4.338 2.445 -3.289 235 HD3 LYS 35 3HD LYS 35 4.884 3.872 -2.432 236 HE2 LYS 35 2HE LYS 35 2.763 4.439 -1.817 237 HE3 LYS 35 3HE LYS 35 2.152 4.238 -3.448 238 HZ1 LYS 35 2HZ LYS 35 2.751 1.700 -2.342 239 HZ3 LYS 35 1HZ LYS 35 1.310 2.257 -2.857 240 H GLN 36 HN GLN 36 5.949 4.900 -7.129 241 HA GLN 36 HA GLN 36 6.060 7.482 -8.488 242 HB2 GLN 36 2HB GLN 36 7.119 4.823 -9.543 243 HB3 GLN 36 3HB GLN 36 7.252 6.380 -10.336 244 HG2 GLN 36 2HG GLN 36 8.383 5.921 -7.547 245 HG3 GLN 36 3HG GLN 36 9.310 5.531 -8.983 246 HE21 GLN 36 1HE2 GLN 36 7.844 8.045 -7.071 247 HE22 GLN 36 2HE2 GLN 36 8.642 9.405 -7.787 248 H1 ALA 1 HN ALA 1 23.566 -2.929 -3.796 249 HA ALA 1 HA ALA 1 21.954 -4.464 -4.276 250 HB1 ALA 1 1HB ALA 1 20.933 -2.217 -4.057 251 HB2 ALA 1 2HB ALA 1 21.080 -1.986 -5.816 252 HB3 ALA 1 3HB ALA 1 20.008 -3.252 -5.171 253 H ASN 2 HN ASN 2 22.801 -2.681 -7.328 254 HA ASN 2 HA ASN 2 23.244 -3.409 -9.328 255 HB2 ASN 2 2HB ASN 2 23.043 -6.290 -8.315 256 HB3 ASN 2 3HB ASN 2 23.866 -5.748 -9.765 257 HD21 ASN 2 1HD2 ASN 2 25.943 -5.334 -9.666 258 HD22 ASN 2 2HD2 ASN 2 26.891 -5.088 -8.236 259 H GLU 3 HN GLU 3 21.761 -3.524 -11.050 260 HA GLU 3 HA GLU 3 19.096 -3.905 -10.534 261 HB2 GLU 3 2HB GLU 3 20.635 -4.029 -13.163 262 HB3 GLU 3 3HB GLU 3 18.885 -3.987 -13.071 263 HG2 GLU 3 2HG GLU 3 19.046 -1.826 -11.762 264 HG3 GLU 3 3HG GLU 3 20.784 -1.857 -11.982 265 H GLY 4 HN GLY 4 17.603 -5.572 -11.578 266 HA2 GLY 4 1HA GLY 4 16.955 -7.696 -11.946 267 HA3 GLY 4 2HA GLY 4 18.604 -8.092 -12.385 268 H ASP 5 HN ASP 5 17.463 -6.725 -9.244 269 HA ASP 5 HA ASP 5 18.270 -9.256 -8.041 270 HB2 ASP 5 2HB ASP 5 18.933 -6.410 -7.348 271 HB3 ASP 5 3HB ASP 5 18.625 -7.483 -5.997 272 H VAL 6 HN VAL 6 17.256 -9.352 -5.649 273 HA VAL 6 HA VAL 6 14.649 -8.026 -5.618 274 HB VAL 6 HB VAL 6 15.246 -10.962 -5.567 275 HG11 VAL 6 1HG1 VAL 6 12.711 -11.045 -4.749 276 HG12 VAL 6 2HG1 VAL 6 14.071 -11.027 -3.601 277 HG13 VAL 6 3HG1 VAL 6 13.181 -9.525 -3.950 278 HG21 VAL 6 3HG2 VAL 6 13.074 -10.943 -6.914 279 HG22 VAL 6 1HG2 VAL 6 13.233 -9.170 -6.945 280 HG23 VAL 6 2HG2 VAL 6 14.498 -10.190 -7.674 281 H TYR 7 HN TYR 7 13.841 -7.592 -3.510 282 HA TYR 7 HA TYR 7 15.721 -8.234 -1.344 283 HB2 TYR 7 2HB TYR 7 14.503 -5.658 -2.398 284 HB3 TYR 7 3HB TYR 7 14.645 -5.792 -0.657 285 HD1 TYR 7 HD1 TYR 7 16.945 -6.173 0.363 286 HD2 TYR 7 HD2 TYR 7 16.387 -5.136 -3.750 287 HE1 TYR 7 HE1 TYR 7 19.373 -5.433 0.214 288 HE2 TYR 7 HE2 TYR 7 18.817 -4.400 -3.886 289 HH TYR 7 HH TYR 7 20.540 -3.593 -2.346 290 H LYS 8 HN LYS 8 14.748 -9.280 0.316 291 HA LYS 8 HA LYS 8 11.846 -8.903 0.576 292 HB2 LYS 8 2HB LYS 8 12.069 -11.110 -0.131 293 HB3 LYS 8 3HB LYS 8 13.562 -11.363 0.752 294 HG2 LYS 8 2HG LYS 8 12.427 -12.117 2.564 295 HG3 LYS 8 3HG LYS 8 11.490 -10.638 2.644 296 HD2 LYS 8 2HD LYS 8 9.657 -11.640 1.745 297 HD3 LYS 8 3HD LYS 8 10.583 -12.300 0.411 298 HE2 LYS 8 2HE LYS 8 11.278 -14.226 1.740 299 HE3 LYS 8 3HE LYS 8 10.634 -13.520 3.209 300 HZ1 LYS 8 2HZ LYS 8 8.646 -14.403 2.709 301 HZ3 LYS 8 1HZ LYS 8 9.261 -15.109 1.376 302 H CYS 9 HN CYS 9 11.087 -8.174 2.514 303 HA CYS 9 HA CYS 9 13.008 -7.289 4.400 304 HB2 CYS 9 2HB CYS 9 10.992 -5.985 3.944 305 HB3 CYS 9 3HB CYS 9 9.973 -7.299 4.499 306 H GLU 10 HN GLU 10 13.089 -7.981 6.695 307 HA GLU 10 HA GLU 10 12.367 -10.794 6.912 308 HB2 GLU 10 2HB GLU 10 14.616 -9.128 8.045 309 HB3 GLU 10 3HB GLU 10 14.103 -10.556 8.922 310 HG2 GLU 10 2HG GLU 10 14.516 -10.889 5.967 311 HG3 GLU 10 3HG GLU 10 15.958 -10.622 6.926 312 H LEU 11 HN LEU 11 10.425 -8.647 7.306 313 HA LEU 11 HA LEU 11 9.775 -9.233 10.086 314 HB2 LEU 11 2HB LEU 11 10.509 -6.616 9.013 315 HB3 LEU 11 3HB LEU 11 8.936 -6.619 9.782 316 HG LEU 11 HG LEU 11 10.838 -8.022 11.447 317 HD11 LEU 11 1HD1 LEU 11 12.584 -6.602 11.726 318 HD12 LEU 11 2HD1 LEU 11 12.248 -6.256 10.013 319 HD13 LEU 11 3HD1 LEU 11 11.638 -5.162 11.278 320 HD21 LEU 11 3HD2 LEU 11 9.924 -6.729 13.151 321 HD22 LEU 11 1HD2 LEU 11 9.561 -5.367 12.064 322 HD23 LEU 11 2HD2 LEU 11 8.593 -6.858 11.975 323 H CYS 12 HN CYS 12 8.490 -7.185 7.372 324 HA CYS 12 HA CYS 12 5.884 -8.273 7.839 325 HB2 CYS 12 2HB CYS 12 5.222 -6.791 5.955 326 HB3 CYS 12 3HB CYS 12 5.974 -5.970 7.310 327 H GLY 13 HN GLY 13 8.450 -8.349 5.278 328 HA2 GLY 13 1HA GLY 13 8.939 -10.397 4.171 329 HA3 GLY 13 2HA GLY 13 7.251 -10.851 4.279 330 H GLN 14 HN GLN 14 8.380 -7.558 3.417 331 HA GLN 14 HA GLN 14 6.850 -7.715 1.026 332 HB2 GLN 14 2HB GLN 14 6.825 -5.638 2.274 333 HB3 GLN 14 3HB GLN 14 8.574 -5.534 2.267 334 HG2 GLN 14 2HG GLN 14 8.675 -4.887 0.014 335 HG3 GLN 14 3HG GLN 14 7.167 -5.680 -0.397 336 HE21 GLN 14 1HE2 GLN 14 8.191 -3.292 2.046 337 HE22 GLN 14 2HE2 GLN 14 6.986 -2.097 1.703 338 H VAL 15 HN VAL 15 7.570 -8.113 -1.044 339 HA VAL 15 HA VAL 15 10.483 -8.339 -1.359 340 HB VAL 15 HB VAL 15 8.248 -9.865 -2.712 341 HG11 VAL 15 1HG1 VAL 15 10.259 -11.268 -3.526 342 HG12 VAL 15 2HG1 VAL 15 9.932 -9.717 -4.337 343 HG13 VAL 15 3HG1 VAL 15 11.238 -9.834 -3.133 344 HG21 VAL 15 3HG2 VAL 15 8.385 -10.816 -0.596 345 HG22 VAL 15 1HG2 VAL 15 9.533 -11.807 -1.525 346 HG23 VAL 15 2HG2 VAL 15 10.133 -10.517 -0.457 347 H VAL 16 HN VAL 16 11.403 -6.892 -2.717 348 HA VAL 16 HA VAL 16 9.685 -5.765 -4.810 349 HB VAL 16 HB VAL 16 10.326 -3.598 -4.340 350 HG11 VAL 16 1HG1 VAL 16 10.116 -4.986 -1.648 351 HG12 VAL 16 2HG1 VAL 16 9.932 -3.236 -1.913 352 HG13 VAL 16 3HG1 VAL 16 8.774 -4.373 -2.643 353 HG21 VAL 16 3HG2 VAL 16 12.643 -3.596 -4.191 354 HG22 VAL 16 1HG2 VAL 16 12.164 -3.166 -2.531 355 HG23 VAL 16 2HG2 VAL 16 12.668 -4.831 -2.909 356 H LYS 17 HN LYS 17 10.641 -5.600 -6.827 357 HA LYS 17 HA LYS 17 13.278 -6.823 -7.012 358 HB2 LYS 17 2HB LYS 17 11.343 -7.710 -8.328 359 HB3 LYS 17 3HB LYS 17 11.278 -6.193 -9.201 360 HG2 LYS 17 2HG LYS 17 13.963 -7.529 -9.052 361 HG3 LYS 17 3HG LYS 17 12.752 -8.325 -10.037 362 HD2 LYS 17 2HD LYS 17 12.348 -5.922 -11.058 363 HD3 LYS 17 3HD LYS 17 13.912 -5.540 -10.365 364 HE2 LYS 17 2HE LYS 17 14.489 -7.936 -11.598 365 HE3 LYS 17 3HE LYS 17 13.242 -7.324 -12.666 366 HZ1 LYS 17 2HZ LYS 17 15.835 -6.074 -12.024 367 HZ3 LYS 17 1HZ LYS 17 14.615 -5.152 -12.585 368 H VAL 18 HN VAL 18 15.077 -5.615 -7.247 369 HA VAL 18 HA VAL 18 14.859 -2.798 -7.465 370 HB VAL 18 HB VAL 18 17.180 -4.728 -7.556 371 HG11 VAL 18 1HG1 VAL 18 17.514 -2.460 -8.753 372 HG12 VAL 18 2HG1 VAL 18 17.455 -1.753 -7.120 373 HG13 VAL 18 3HG1 VAL 18 18.708 -2.952 -7.527 374 HG21 VAL 18 3HG2 VAL 18 17.419 -4.413 -5.294 375 HG22 VAL 18 1HG2 VAL 18 16.682 -2.793 -5.326 376 HG23 VAL 18 2HG2 VAL 18 15.653 -4.242 -5.438 377 H LEU 19 HN LEU 19 14.246 -1.799 -9.317 378 HA LEU 19 HA LEU 19 14.739 -3.072 -11.845 379 HB2 LEU 19 2HB LEU 19 13.205 -0.735 -10.837 380 HB3 LEU 19 3HB LEU 19 13.724 -0.690 -12.510 381 HG LEU 19 HG LEU 19 11.392 -1.600 -12.009 382 HD11 LEU 19 1HD1 LEU 19 13.035 -3.569 -13.581 383 HD12 LEU 19 2HD1 LEU 19 11.409 -2.925 -13.915 384 HD13 LEU 19 3HD1 LEU 19 12.840 -1.888 -14.136 385 HD21 LEU 19 3HD2 LEU 19 11.534 -4.178 -11.602 386 HD22 LEU 19 1HD2 LEU 19 13.083 -3.776 -10.824 387 HD23 LEU 19 2HD2 LEU 19 11.572 -3.050 -10.226 388 H GLU 20 HN GLU 20 15.691 0.058 -10.260 389 HA GLU 20 HA GLU 20 18.097 -0.086 -11.899 390 HB2 GLU 20 2HB GLU 20 16.438 1.641 -12.738 391 HB3 GLU 20 3HB GLU 20 16.600 2.480 -11.208 392 HG2 GLU 20 2HG GLU 20 18.603 3.394 -11.798 393 HG3 GLU 20 3HG GLU 20 19.229 1.860 -12.371 394 H GLU 21 HN GLU 21 19.743 -0.517 -10.489 395 HA GLU 21 HA GLU 21 19.548 -0.036 -7.771 396 HB2 GLU 21 2HB GLU 21 21.893 -0.716 -7.677 397 HB3 GLU 21 3HB GLU 21 21.045 -1.730 -8.827 398 HG2 GLU 21 2HG GLU 21 22.013 -0.633 -10.709 399 HG3 GLU 21 3HG GLU 21 22.455 0.784 -9.777 400 H GLY 22 HN GLY 22 21.170 1.357 -6.477 401 HA2 GLY 22 1HA GLY 22 21.823 3.864 -7.872 402 HA3 GLY 22 2HA GLY 22 20.798 3.911 -6.451 403 H GLY 23 HN GLY 23 21.662 3.093 -4.365 404 HA2 GLY 23 1HA GLY 23 24.147 2.139 -3.830 405 HA3 GLY 23 2HA GLY 23 24.418 3.857 -4.039 406 H GLY 24 HN GLY 24 21.812 1.806 -2.528 407 HA2 GLY 24 1HA GLY 24 22.358 2.998 0.065 408 HA3 GLY 24 2HA GLY 24 20.822 3.433 -0.657 409 H THR 25 HN THR 25 20.073 2.254 1.410 410 HA THR 25 HA THR 25 19.752 -0.598 0.754 411 HB THR 25 HB THR 25 20.555 0.781 3.341 412 HG1 THR 25 HG1 THR 25 21.230 -1.789 2.129 413 HG21 THR 25 3HG2 THR 25 19.161 -1.919 2.985 414 HG22 THR 25 1HG2 THR 25 20.191 -1.542 4.387 415 HG23 THR 25 2HG2 THR 25 18.704 -0.608 4.099 416 H LEU 26 HN LEU 26 17.776 -1.588 1.637 417 HA LEU 26 HA LEU 26 15.643 0.423 1.662 418 HB2 LEU 26 2HB LEU 26 15.377 -2.519 1.064 419 HB3 LEU 26 3HB LEU 26 14.196 -1.253 0.797 420 HG LEU 26 HG LEU 26 16.858 -1.259 -0.629 421 HD11 LEU 26 1HD1 LEU 26 15.290 -3.392 -0.884 422 HD12 LEU 26 2HD1 LEU 26 14.436 -2.312 -2.012 423 HD13 LEU 26 3HD1 LEU 26 16.158 -2.680 -2.265 424 HD21 LEU 26 3HD2 LEU 26 16.133 0.623 -1.545 425 HD22 LEU 26 1HD2 LEU 26 14.668 -0.197 -2.137 426 HD23 LEU 26 2HD2 LEU 26 14.680 0.549 -0.521 427 H VAL 27 HN VAL 27 16.163 0.868 3.960 428 HA VAL 27 HA VAL 27 15.908 -1.213 5.863 429 HB VAL 27 HB VAL 27 15.698 1.790 6.165 430 HG11 VAL 27 1HG1 VAL 27 14.943 0.054 8.043 431 HG12 VAL 27 2HG1 VAL 27 16.697 0.002 8.342 432 HG13 VAL 27 3HG1 VAL 27 15.823 1.550 8.439 433 HG21 VAL 27 3HG2 VAL 27 17.811 0.878 5.069 434 HG22 VAL 27 1HG2 VAL 27 18.038 1.853 6.542 435 HG23 VAL 27 2HG2 VAL 27 18.153 0.078 6.623 436 H CYS 28 HN CYS 28 14.030 -2.351 6.018 437 HA CYS 28 HA CYS 28 11.575 -0.750 6.088 438 HB2 CYS 28 2HB CYS 28 11.867 -2.298 4.104 439 HB3 CYS 28 3HB CYS 28 11.769 -3.639 5.229 440 H CYS 29 HN CYS 29 10.223 -1.089 7.889 441 HA CYS 29 HA CYS 29 9.631 -1.714 9.907 442 HB2 CYS 29 2HB CYS 29 10.839 -4.335 9.025 443 HB3 CYS 29 3HB CYS 29 10.075 -4.129 10.588 444 H GLY 30 HN GLY 30 12.310 -0.462 9.300 445 HA2 GLY 30 1HA GLY 30 14.044 0.284 10.532 446 HA3 GLY 30 2HA GLY 30 13.399 -0.566 11.922 447 H GLU 31 HN GLU 31 14.024 -2.291 8.873 448 HA GLU 31 HA GLU 31 16.551 -3.229 9.913 449 HB2 GLU 31 2HB GLU 31 14.700 -4.771 10.741 450 HB3 GLU 31 3HB GLU 31 14.360 -5.173 9.071 451 HG2 GLU 31 2HG GLU 31 16.457 -6.247 8.761 452 HG3 GLU 31 3HG GLU 31 17.192 -5.426 10.124 453 H ASP 32 HN ASP 32 18.052 -3.444 8.283 454 HA ASP 32 HA ASP 32 17.437 -2.554 5.760 455 HB2 ASP 32 2HB ASP 32 19.707 -2.412 6.105 456 HB3 ASP 32 3HB ASP 32 19.741 -3.835 7.128 457 H MET 33 HN MET 33 16.282 -3.620 4.146 458 HA MET 33 HA MET 33 15.380 -6.177 4.372 459 HB2 MET 33 2HB MET 33 14.906 -4.103 2.691 460 HB3 MET 33 3HB MET 33 15.954 -5.021 1.627 461 HG2 MET 33 2HG MET 33 14.277 -6.477 1.142 462 HG3 MET 33 3HG MET 33 14.040 -6.838 2.839 463 HE1 MET 33 3HE MET 33 11.734 -3.918 0.214 464 HE2 MET 33 1HE MET 33 13.450 -4.348 0.014 465 HE3 MET 33 2HE MET 33 12.191 -5.590 -0.193 466 H VAL 34 HN VAL 34 15.910 -8.193 3.270 467 HA VAL 34 HA VAL 34 18.787 -8.410 2.810 468 HB VAL 34 HB VAL 34 18.633 -10.598 3.490 469 HG11 VAL 34 1HG1 VAL 34 17.400 -10.649 5.558 470 HG12 VAL 34 2HG1 VAL 34 18.006 -8.993 5.313 471 HG13 VAL 34 3HG1 VAL 34 16.297 -9.373 4.991 472 HG21 VAL 34 3HG2 VAL 34 16.298 -11.750 3.658 473 HG22 VAL 34 1HG2 VAL 34 15.784 -10.484 2.520 474 HG23 VAL 34 2HG2 VAL 34 17.090 -11.607 2.071 475 H LYS 35 HN LYS 35 19.497 -9.892 1.009 476 HA LYS 35 HA LYS 35 17.855 -9.307 -1.327 477 HB2 LYS 35 2HB LYS 35 20.507 -8.921 -0.889 478 HB3 LYS 35 3HB LYS 35 20.552 -10.507 -1.631 479 HG2 LYS 35 2HG LYS 35 20.558 -9.249 -3.568 480 HG3 LYS 35 3HG LYS 35 18.822 -9.352 -3.351 481 HD2 LYS 35 2HD LYS 35 18.632 -7.118 -2.929 482 HD3 LYS 35 3HD LYS 35 19.971 -7.130 -1.799 483 HE2 LYS 35 2HE LYS 35 20.249 -7.088 -4.844 484 HE3 LYS 35 3HE LYS 35 20.431 -5.693 -3.799 485 HZ1 LYS 35 2HZ LYS 35 22.552 -6.307 -3.481 486 HZ3 LYS 35 1HZ LYS 35 22.367 -7.636 -4.405 487 H GLN 36 HN GLN 36 17.332 -10.962 -2.889 488 HA GLN 36 HA GLN 36 17.311 -13.599 -1.639 489 HB2 GLN 36 2HB GLN 36 15.338 -12.546 -3.709 490 HB3 GLN 36 3HB GLN 36 15.216 -14.044 -2.809 491 HG2 GLN 36 2HG GLN 36 15.310 -11.320 -1.441 492 HG3 GLN 36 3HG GLN 36 13.807 -12.068 -1.941 493 HE21 GLN 36 1HE2 GLN 36 16.404 -12.040 0.309 494 HE22 GLN 36 2HE2 GLN 36 15.839 -13.265 1.395 Start of MODEL 8 1 H1 ALA 1 HN ALA 1 3.078 0.009 1.479 2 HA ALA 1 HA ALA 1 1.569 0.703 -0.632 3 HB1 ALA 1 1HB ALA 1 4.163 0.505 -0.264 4 HB2 ALA 1 2HB ALA 1 3.967 -1.082 -1.046 5 HB3 ALA 1 3HB ALA 1 3.500 0.403 -1.912 6 H ASN 2 HN ASN 2 1.192 -0.571 -2.749 7 HA ASN 2 HA ASN 2 0.192 -3.209 -2.010 8 HB2 ASN 2 2HB ASN 2 -1.070 -0.923 -3.476 9 HB3 ASN 2 3HB ASN 2 -1.323 -2.491 -4.216 10 HD21 ASN 2 1HD2 ASN 2 -2.196 -4.216 -2.916 11 HD22 ASN 2 2HD2 ASN 2 -3.294 -3.872 -1.621 12 H GLU 3 HN GLU 3 0.371 -4.858 -3.734 13 HA GLU 3 HA GLU 3 2.693 -4.855 -5.103 14 HB2 GLU 3 2HB GLU 3 0.079 -6.296 -5.709 15 HB3 GLU 3 3HB GLU 3 1.575 -6.660 -6.547 16 HG2 GLU 3 2HG GLU 3 2.680 -7.244 -4.418 17 HG3 GLU 3 3HG GLU 3 1.263 -6.756 -3.510 18 H GLY 4 HN GLY 4 3.141 -4.812 -7.498 19 HA2 GLY 4 1HA GLY 4 3.049 -3.855 -9.536 20 HA3 GLY 4 2HA GLY 4 1.337 -3.566 -9.293 21 H ASP 5 HN ASP 5 4.006 -2.396 -7.171 22 HA ASP 5 HA ASP 5 3.306 0.294 -8.054 23 HB2 ASP 5 2HB ASP 5 3.622 -0.906 -5.328 24 HB3 ASP 5 3HB ASP 5 4.327 0.685 -5.536 25 H VAL 6 HN VAL 6 5.220 1.897 -7.454 26 HA VAL 6 HA VAL 6 7.791 0.497 -7.617 27 HB VAL 6 HB VAL 6 6.600 2.498 -9.481 28 HG11 VAL 6 1HG1 VAL 6 8.796 3.262 -10.227 29 HG12 VAL 6 2HG1 VAL 6 8.543 3.677 -8.514 30 HG13 VAL 6 3HG1 VAL 6 9.585 2.301 -8.953 31 HG21 VAL 6 3HG2 VAL 6 6.870 0.812 -10.914 32 HG22 VAL 6 1HG2 VAL 6 8.624 0.816 -10.616 33 HG23 VAL 6 2HG2 VAL 6 7.552 -0.183 -9.606 34 H TYR 7 HN TYR 7 9.565 1.643 -6.655 35 HA TYR 7 HA TYR 7 8.769 4.023 -5.131 36 HB2 TYR 7 2HB TYR 7 9.869 1.312 -4.338 37 HB3 TYR 7 3HB TYR 7 10.567 2.685 -3.503 38 HD1 TYR 7 HD1 TYR 7 9.108 4.172 -2.105 39 HD2 TYR 7 HD2 TYR 7 7.654 0.538 -3.831 40 HE1 TYR 7 HE1 TYR 7 7.138 4.188 -0.498 41 HE2 TYR 7 HE2 TYR 7 5.688 0.566 -2.218 42 HH TYR 7 HH TYR 7 5.597 2.664 0.472 43 H LYS 8 HN LYS 8 10.166 5.695 -5.397 44 HA LYS 8 HA LYS 8 12.858 5.003 -6.353 45 HB2 LYS 8 2HB LYS 8 11.799 5.996 -8.196 46 HB3 LYS 8 3HB LYS 8 10.954 7.174 -7.212 47 HG2 LYS 8 2HG LYS 8 12.678 8.641 -7.356 48 HG3 LYS 8 3HG LYS 8 13.822 7.442 -6.787 49 HD2 LYS 8 2HD LYS 8 14.524 6.904 -8.909 50 HD3 LYS 8 3HD LYS 8 12.909 6.997 -9.582 51 HE2 LYS 8 2HE LYS 8 14.530 9.463 -8.795 52 HE3 LYS 8 3HE LYS 8 14.544 8.785 -10.411 53 HZ1 LYS 8 2HZ LYS 8 12.034 9.604 -9.057 54 HZ3 LYS 8 1HZ LYS 8 12.214 9.227 -10.630 55 H CYS 9 HN CYS 9 14.585 5.842 -5.239 56 HA CYS 9 HA CYS 9 13.960 7.057 -2.726 57 HB2 CYS 9 2HB CYS 9 15.713 5.330 -2.920 58 HB3 CYS 9 3HB CYS 9 16.645 6.377 -3.971 59 H GLU 10 HN GLU 10 14.471 9.220 -2.106 60 HA GLU 10 HA GLU 10 14.917 10.960 -4.385 61 HB2 GLU 10 2HB GLU 10 13.545 11.243 -1.729 62 HB3 GLU 10 3HB GLU 10 14.272 12.686 -2.404 63 HG2 GLU 10 2HG GLU 10 12.693 11.071 -4.350 64 HG3 GLU 10 3HG GLU 10 11.750 11.758 -3.043 65 H LEU 11 HN LEU 11 17.144 9.444 -3.312 66 HA LEU 11 HA LEU 11 18.783 11.697 -2.442 67 HB2 LEU 11 2HB LEU 11 18.061 9.405 -0.836 68 HB3 LEU 11 3HB LEU 11 19.792 9.448 -1.105 69 HG LEU 11 HG LEU 11 18.823 12.086 -0.395 70 HD11 LEU 11 1HD1 LEU 11 18.164 11.594 1.931 71 HD12 LEU 11 2HD1 LEU 11 17.013 10.943 0.741 72 HD13 LEU 11 3HD1 LEU 11 18.167 9.856 1.551 73 HD21 LEU 11 3HD2 LEU 11 20.981 10.213 0.295 74 HD22 LEU 11 1HD2 LEU 11 21.003 11.982 0.104 75 HD23 LEU 11 2HD2 LEU 11 20.459 11.259 1.637 76 H CYS 12 HN CYS 12 18.986 8.144 -3.203 77 HA CYS 12 HA CYS 12 21.360 8.715 -4.755 78 HB2 CYS 12 2HB CYS 12 21.508 6.244 -4.954 79 HB3 CYS 12 3HB CYS 12 21.567 6.851 -3.312 80 H GLY 13 HN GLY 13 18.044 7.276 -5.084 81 HA2 GLY 13 1HA GLY 13 16.741 7.973 -6.999 82 HA3 GLY 13 2HA GLY 13 18.189 7.865 -7.979 83 H GLN 14 HN GLN 14 17.518 5.475 -5.425 84 HA GLN 14 HA GLN 14 17.676 3.400 -7.327 85 HB2 GLN 14 2HB GLN 14 18.572 3.030 -5.113 86 HB3 GLN 14 3HB GLN 14 17.055 3.462 -4.349 87 HG2 GLN 14 2HG GLN 14 16.114 1.396 -4.728 88 HG3 GLN 14 3HG GLN 14 16.826 1.247 -6.323 89 HE21 GLN 14 1HE2 GLN 14 18.049 1.647 -2.996 90 HE22 GLN 14 2HE2 GLN 14 19.173 0.329 -3.016 91 H VAL 15 HN VAL 15 16.052 2.517 -8.534 92 HA VAL 15 HA VAL 15 13.309 3.083 -7.645 93 HB VAL 15 HB VAL 15 14.443 2.652 -10.416 94 HG11 VAL 15 1HG1 VAL 15 11.618 2.913 -9.400 95 HG12 VAL 15 2HG1 VAL 15 12.050 3.462 -11.038 96 HG13 VAL 15 3HG1 VAL 15 12.295 1.760 -10.575 97 HG21 VAL 15 3HG2 VAL 15 13.675 5.029 -10.747 98 HG22 VAL 15 1HG2 VAL 15 13.410 5.121 -8.989 99 HG23 VAL 15 2HG2 VAL 15 15.046 4.833 -9.628 100 H VAL 16 HN VAL 16 12.382 1.343 -6.704 101 HA VAL 16 HA VAL 16 13.042 -1.277 -7.861 102 HB VAL 16 HB VAL 16 13.202 -2.227 -5.785 103 HG11 VAL 16 1HG1 VAL 16 14.076 0.457 -4.791 104 HG12 VAL 16 2HG1 VAL 16 14.905 -1.117 -4.721 105 HG13 VAL 16 3HG1 VAL 16 14.861 -0.201 -6.247 106 HG21 VAL 16 3HG2 VAL 16 11.737 0.132 -4.552 107 HG22 VAL 16 1HG2 VAL 16 11.005 -1.436 -4.968 108 HG23 VAL 16 2HG2 VAL 16 12.264 -1.347 -3.713 109 H LYS 17 HN LYS 17 11.300 -2.787 -8.037 110 HA LYS 17 HA LYS 17 8.685 -1.462 -7.913 111 HB2 LYS 17 2HB LYS 17 8.531 -2.076 -10.047 112 HB3 LYS 17 3HB LYS 17 10.021 -2.995 -9.959 113 HG2 LYS 17 2HG LYS 17 8.301 -4.576 -10.530 114 HG3 LYS 17 3HG LYS 17 8.696 -4.880 -8.850 115 HD2 LYS 17 2HD LYS 17 6.375 -4.816 -8.699 116 HD3 LYS 17 3HD LYS 17 6.736 -3.132 -8.381 117 HE2 LYS 17 2HE LYS 17 5.483 -2.542 -10.177 118 HE3 LYS 17 3HE LYS 17 6.612 -3.377 -11.225 119 HZ1 LYS 17 2HZ LYS 17 5.314 -5.312 -11.169 120 HZ3 LYS 17 1HZ LYS 17 4.170 -4.153 -11.206 121 H VAL 18 HN VAL 18 7.233 -2.157 -6.433 122 HA VAL 18 HA VAL 18 7.978 -4.251 -4.664 123 HB VAL 18 HB VAL 18 5.439 -2.644 -4.999 124 HG11 VAL 18 1HG1 VAL 18 5.375 -4.975 -3.778 125 HG12 VAL 18 2HG1 VAL 18 6.165 -4.076 -2.461 126 HG13 VAL 18 3HG1 VAL 18 4.572 -3.558 -3.062 127 HG21 VAL 18 3HG2 VAL 18 7.969 -1.863 -4.095 128 HG22 VAL 18 1HG2 VAL 18 6.431 -1.003 -3.850 129 HG23 VAL 18 2HG2 VAL 18 7.024 -2.137 -2.613 130 H LEU 19 HN LEU 19 7.748 -6.394 -5.007 131 HA LEU 19 HA LEU 19 5.932 -7.227 -7.122 132 HB2 LEU 19 2HB LEU 19 7.889 -8.277 -7.521 133 HB3 LEU 19 3HB LEU 19 8.372 -8.292 -5.837 134 HG LEU 19 HG LEU 19 6.830 -10.165 -5.399 135 HD11 LEU 19 1HD1 LEU 19 5.759 -11.355 -7.264 136 HD12 LEU 19 2HD1 LEU 19 5.132 -9.700 -7.075 137 HD13 LEU 19 3HD1 LEU 19 6.285 -10.070 -8.379 138 HD21 LEU 19 3HD2 LEU 19 8.171 -11.865 -6.346 139 HD22 LEU 19 1HD2 LEU 19 8.608 -10.853 -7.745 140 HD23 LEU 19 2HD2 LEU 19 9.242 -10.460 -6.127 141 H GLU 20 HN GLU 20 6.694 -7.998 -3.656 142 HA GLU 20 HA GLU 20 3.897 -8.797 -3.439 143 HB2 GLU 20 2HB GLU 20 5.949 -10.577 -3.271 144 HB3 GLU 20 3HB GLU 20 5.890 -10.062 -1.598 145 HG2 GLU 20 2HG GLU 20 3.353 -10.503 -1.672 146 HG3 GLU 20 3HG GLU 20 3.611 -11.260 -3.232 147 H GLU 21 HN GLU 21 3.220 -6.768 -2.611 148 HA GLU 21 HA GLU 21 4.505 -5.176 -0.892 149 HB2 GLU 21 2HB GLU 21 2.424 -4.149 -0.464 150 HB3 GLU 21 3HB GLU 21 2.176 -4.932 -2.013 151 HG2 GLU 21 2HG GLU 21 1.385 -6.983 -0.466 152 HG3 GLU 21 3HG GLU 21 1.103 -5.706 0.700 153 H GLY 22 HN GLY 22 4.038 -4.748 1.520 154 HA2 GLY 22 1HA GLY 22 3.555 -7.229 3.021 155 HA3 GLY 22 2HA GLY 22 5.073 -6.381 3.242 156 H GLY 23 HN GLY 23 5.098 -5.087 5.019 157 HA2 GLY 23 1HA GLY 23 2.853 -3.292 5.493 158 HA3 GLY 23 2HA GLY 23 3.156 -4.493 6.733 159 H GLY 24 HN GLY 24 5.371 -2.546 4.601 160 HA2 GLY 24 1HA GLY 24 6.322 -1.012 6.858 161 HA3 GLY 24 2HA GLY 24 7.461 -2.209 6.275 162 H THR 25 HN THR 25 8.544 0.124 5.969 163 HA THR 25 HA THR 25 7.922 0.974 3.215 164 HB THR 25 HB THR 25 7.641 2.503 5.470 165 HG1 THR 25 HG1 THR 25 7.207 3.008 3.168 166 HG21 THR 25 3HG2 THR 25 10.474 2.972 4.398 167 HG22 THR 25 1HG2 THR 25 9.597 4.078 5.481 168 HG23 THR 25 2HG2 THR 25 10.064 2.458 6.052 169 H LEU 26 HN LEU 26 9.954 2.145 2.228 170 HA LEU 26 HA LEU 26 12.227 0.365 2.777 171 HB2 LEU 26 2HB LEU 26 11.749 1.684 0.129 172 HB3 LEU 26 3HB LEU 26 12.720 0.275 0.511 173 HG LEU 26 HG LEU 26 9.731 0.190 0.859 174 HD11 LEU 26 1HD1 LEU 26 9.297 0.332 -1.310 175 HD12 LEU 26 2HD1 LEU 26 11.000 0.757 -1.606 176 HD13 LEU 26 3HD1 LEU 26 10.485 -0.946 -1.665 177 HD21 LEU 26 3HD2 LEU 26 10.874 -2.209 -0.171 178 HD22 LEU 26 1HD2 LEU 26 11.882 -1.650 1.186 179 HD23 LEU 26 2HD2 LEU 26 10.137 -1.913 1.422 180 H VAL 27 HN VAL 27 12.897 1.904 4.458 181 HA VAL 27 HA VAL 27 13.452 4.592 3.731 182 HB VAL 27 HB VAL 27 14.447 2.932 6.054 183 HG11 VAL 27 1HG1 VAL 27 14.338 5.384 7.070 184 HG12 VAL 27 2HG1 VAL 27 15.770 4.802 6.189 185 HG13 VAL 27 3HG1 VAL 27 14.581 5.842 5.368 186 HG21 VAL 27 3HG2 VAL 27 12.557 3.857 7.313 187 HG22 VAL 27 1HG2 VAL 27 11.979 4.692 5.851 188 HG23 VAL 27 2HG2 VAL 27 11.992 2.914 5.914 189 H CYS 28 HN CYS 28 14.910 5.003 2.131 190 HA CYS 28 HA CYS 28 17.443 3.539 2.316 191 HB2 CYS 28 2HB CYS 28 16.054 3.048 0.290 192 HB3 CYS 28 3HB CYS 28 16.220 4.729 -0.180 193 H CYS 29 HN CYS 29 19.325 4.811 2.419 194 HA CYS 29 HA CYS 29 20.592 6.588 2.641 195 HB2 CYS 29 2HB CYS 29 18.489 7.833 0.880 196 HB3 CYS 29 3HB CYS 29 19.841 8.765 1.494 197 H GLY 30 HN GLY 30 18.238 5.853 4.460 198 HA2 GLY 30 1HA GLY 30 17.541 6.595 6.477 199 HA3 GLY 30 2HA GLY 30 18.504 8.044 6.272 200 H GLU 31 HN GLU 31 16.257 7.171 3.693 201 HA GLU 31 HA GLU 31 14.287 8.991 4.791 202 HB2 GLU 31 2HB GLU 31 15.997 10.104 3.125 203 HB3 GLU 31 3HB GLU 31 15.104 9.247 1.885 204 HG2 GLU 31 2HG GLU 31 13.583 10.928 1.904 205 HG3 GLU 31 3HG GLU 31 13.099 10.409 3.506 206 H ASP 32 HN ASP 32 12.214 8.230 4.512 207 HA ASP 32 HA ASP 32 11.820 5.692 3.553 208 HB2 ASP 32 2HB ASP 32 10.054 6.305 4.894 209 HB3 ASP 32 3HB ASP 32 10.146 7.987 4.416 210 H MET 33 HN MET 33 11.920 5.010 1.408 211 HA MET 33 HA MET 33 12.181 6.637 -0.730 212 HB2 MET 33 2HB MET 33 12.357 3.999 -0.390 213 HB3 MET 33 3HB MET 33 10.691 3.984 -0.935 214 HG2 MET 33 2HG MET 33 11.241 4.740 -3.100 215 HG3 MET 33 3HG MET 33 12.715 5.526 -2.569 216 HE1 MET 33 3HE MET 33 15.317 3.434 -2.249 217 HE2 MET 33 1HE MET 33 14.223 4.191 -1.068 218 HE3 MET 33 2HE MET 33 14.426 2.423 -1.087 219 H VAL 34 HN VAL 34 10.765 7.264 -2.517 220 HA VAL 34 HA VAL 34 8.043 7.740 -1.566 221 HB VAL 34 HB VAL 34 7.983 9.564 -3.029 222 HG11 VAL 34 1HG1 VAL 34 10.793 9.348 -1.898 223 HG12 VAL 34 2HG1 VAL 34 10.060 10.849 -2.512 224 HG13 VAL 34 3HG1 VAL 34 9.357 10.031 -1.096 225 HG21 VAL 34 3HG2 VAL 34 10.497 9.490 -4.414 226 HG22 VAL 34 1HG2 VAL 34 9.634 7.959 -4.695 227 HG23 VAL 34 2HG2 VAL 34 8.848 9.507 -5.082 228 H LYS 35 HN LYS 35 6.290 7.638 -3.310 229 HA LYS 35 HA LYS 35 6.679 5.132 -4.751 230 HB2 LYS 35 2HB LYS 35 4.744 5.662 -3.078 231 HB3 LYS 35 3HB LYS 35 4.047 6.555 -4.414 232 HG2 LYS 35 2HG LYS 35 5.062 3.801 -5.042 233 HG3 LYS 35 3HG LYS 35 3.633 3.890 -4.031 234 HD2 LYS 35 2HD LYS 35 2.442 5.215 -5.716 235 HD3 LYS 35 3HD LYS 35 3.892 5.371 -6.688 236 HE2 LYS 35 2HE LYS 35 3.651 2.595 -6.365 237 HE3 LYS 35 3HE LYS 35 1.985 3.118 -6.516 238 HZ1 LYS 35 2HZ LYS 35 2.467 4.123 -8.609 239 HZ3 LYS 35 1HZ LYS 35 3.182 2.662 -8.675 240 H GLN 36 HN GLN 36 6.042 4.928 -6.999 241 HA GLN 36 HA GLN 36 6.180 7.511 -8.352 242 HB2 GLN 36 2HB GLN 36 7.170 4.824 -9.401 243 HB3 GLN 36 3HB GLN 36 7.342 6.373 -10.201 244 HG2 GLN 36 2HG GLN 36 8.457 5.905 -7.408 245 HG3 GLN 36 3HG GLN 36 9.375 5.475 -8.838 246 HE21 GLN 36 1HE2 GLN 36 8.069 8.024 -6.891 247 HE22 GLN 36 2HE2 GLN 36 8.873 9.363 -7.640 248 H1 ALA 1 HN ALA 1 20.509 -1.612 -6.863 249 HA ALA 1 HA ALA 1 23.046 -2.144 -5.564 250 HB1 ALA 1 1HB ALA 1 22.225 -3.670 -3.976 251 HB2 ALA 1 2HB ALA 1 21.061 -2.325 -3.882 252 HB3 ALA 1 3HB ALA 1 20.642 -3.804 -4.779 253 H ASN 2 HN ASN 2 23.611 -2.432 -7.851 254 HA ASN 2 HA ASN 2 23.778 -3.527 -9.733 255 HB2 ASN 2 2HB ASN 2 23.800 -6.177 -9.317 256 HB3 ASN 2 3HB ASN 2 25.082 -5.167 -8.683 257 HD21 ASN 2 1HD2 ASN 2 25.228 -4.726 -6.516 258 HD22 ASN 2 2HD2 ASN 2 24.325 -5.564 -5.298 259 H GLU 3 HN GLU 3 21.833 -3.029 -10.902 260 HA GLU 3 HA GLU 3 19.338 -3.737 -10.432 261 HB2 GLU 3 2HB GLU 3 20.746 -3.758 -13.136 262 HB3 GLU 3 3HB GLU 3 19.004 -3.772 -12.950 263 HG2 GLU 3 2HG GLU 3 19.015 -1.606 -11.846 264 HG3 GLU 3 3HG GLU 3 20.758 -1.628 -11.678 265 H GLY 4 HN GLY 4 17.861 -5.455 -11.330 266 HA2 GLY 4 1HA GLY 4 17.311 -7.596 -11.815 267 HA3 GLY 4 2HA GLY 4 18.981 -7.933 -12.219 268 H ASP 5 HN ASP 5 17.714 -6.604 -9.108 269 HA ASP 5 HA ASP 5 18.570 -9.107 -7.881 270 HB2 ASP 5 2HB ASP 5 19.364 -6.319 -7.343 271 HB3 ASP 5 3HB ASP 5 18.752 -7.107 -5.903 272 H VAL 6 HN VAL 6 17.466 -9.372 -5.612 273 HA VAL 6 HA VAL 6 14.867 -8.016 -5.561 274 HB VAL 6 HB VAL 6 15.489 -10.936 -5.645 275 HG11 VAL 6 1HG1 VAL 6 14.421 -11.009 -3.576 276 HG12 VAL 6 2HG1 VAL 6 13.345 -9.647 -3.966 277 HG13 VAL 6 3HG1 VAL 6 13.073 -11.238 -4.716 278 HG21 VAL 6 3HG2 VAL 6 13.331 -10.923 -6.951 279 HG22 VAL 6 1HG2 VAL 6 13.331 -9.149 -6.804 280 HG23 VAL 6 2HG2 VAL 6 14.652 -9.970 -7.668 281 H TYR 7 HN TYR 7 14.058 -7.575 -3.474 282 HA TYR 7 HA TYR 7 15.890 -8.286 -1.286 283 HB2 TYR 7 2HB TYR 7 14.633 -5.694 -2.271 284 HB3 TYR 7 3HB TYR 7 14.822 -5.876 -0.538 285 HD1 TYR 7 HD1 TYR 7 17.129 -6.190 0.434 286 HD2 TYR 7 HD2 TYR 7 16.499 -5.182 -3.676 287 HE1 TYR 7 HE1 TYR 7 19.545 -5.418 0.245 288 HE2 TYR 7 HE2 TYR 7 18.915 -4.413 -3.851 289 HH TYR 7 HH TYR 7 20.981 -4.724 -2.801 290 H LYS 8 HN LYS 8 14.915 -9.284 0.411 291 HA LYS 8 HA LYS 8 11.999 -8.971 0.602 292 HB2 LYS 8 2HB LYS 8 12.140 -11.160 -0.070 293 HB3 LYS 8 3HB LYS 8 13.724 -11.407 0.637 294 HG2 LYS 8 2HG LYS 8 12.263 -12.644 2.050 295 HG3 LYS 8 3HG LYS 8 12.574 -11.170 2.947 296 HD2 LYS 8 2HD LYS 8 10.410 -10.404 2.718 297 HD3 LYS 8 3HD LYS 8 10.250 -11.018 1.084 298 HE2 LYS 8 2HE LYS 8 10.350 -12.924 3.452 299 HE3 LYS 8 3HE LYS 8 8.848 -12.150 2.990 300 HZ1 LYS 8 2HZ LYS 8 9.484 -13.048 0.637 301 HZ3 LYS 8 1HZ LYS 8 8.823 -14.072 1.717 302 H CYS 9 HN CYS 9 11.196 -8.314 2.554 303 HA CYS 9 HA CYS 9 13.096 -7.456 4.486 304 HB2 CYS 9 2HB CYS 9 11.086 -6.135 3.983 305 HB3 CYS 9 3HB CYS 9 10.061 -7.435 4.555 306 H GLU 10 HN GLU 10 13.229 -8.235 6.716 307 HA GLU 10 HA GLU 10 12.385 -11.013 6.897 308 HB2 GLU 10 2HB GLU 10 14.680 -9.458 8.119 309 HB3 GLU 10 3HB GLU 10 14.151 -10.963 8.845 310 HG2 GLU 10 2HG GLU 10 14.420 -11.217 5.927 311 HG3 GLU 10 3HG GLU 10 15.917 -10.678 6.662 312 H LEU 11 HN LEU 11 10.557 -8.761 7.365 313 HA LEU 11 HA LEU 11 9.942 -9.358 10.160 314 HB2 LEU 11 2HB LEU 11 10.684 -6.769 9.040 315 HB3 LEU 11 3HB LEU 11 9.115 -6.736 9.819 316 HG LEU 11 HG LEU 11 11.015 -8.135 11.493 317 HD11 LEU 11 1HD1 LEU 11 12.795 -6.923 10.521 318 HD12 LEU 11 2HD1 LEU 11 11.852 -5.414 10.478 319 HD13 LEU 11 3HD1 LEU 11 12.397 -6.079 12.037 320 HD21 LEU 11 3HD2 LEU 11 8.837 -7.077 12.145 321 HD22 LEU 11 1HD2 LEU 11 10.219 -6.643 13.178 322 HD23 LEU 11 2HD2 LEU 11 9.620 -5.490 11.961 323 H CYS 12 HN CYS 12 8.665 -7.460 7.329 324 HA CYS 12 HA CYS 12 6.047 -8.529 7.905 325 HB2 CYS 12 2HB CYS 12 5.327 -7.018 6.059 326 HB3 CYS 12 3HB CYS 12 6.069 -6.218 7.429 327 H GLY 13 HN GLY 13 8.560 -8.500 5.294 328 HA2 GLY 13 1HA GLY 13 9.039 -10.563 4.166 329 HA3 GLY 13 2HA GLY 13 7.335 -10.967 4.223 330 H GLN 14 HN GLN 14 8.436 -7.646 3.536 331 HA GLN 14 HA GLN 14 6.968 -7.627 1.147 332 HB2 GLN 14 2HB GLN 14 7.175 -5.586 2.421 333 HB3 GLN 14 3HB GLN 14 8.925 -5.668 2.406 334 HG2 GLN 14 2HG GLN 14 9.076 -4.734 0.322 335 HG3 GLN 14 3HG GLN 14 7.763 -5.706 -0.314 336 HE21 GLN 14 1HE2 GLN 14 8.078 -3.309 2.308 337 HE22 GLN 14 2HE2 GLN 14 6.786 -2.268 1.810 338 H VAL 15 HN VAL 15 7.569 -8.216 -0.899 339 HA VAL 15 HA VAL 15 10.444 -8.639 -1.333 340 HB VAL 15 HB VAL 15 8.003 -10.001 -2.481 341 HG11 VAL 15 1HG1 VAL 15 9.621 -11.421 -3.742 342 HG12 VAL 15 2HG1 VAL 15 9.591 -9.727 -4.286 343 HG13 VAL 15 3HG1 VAL 15 10.922 -10.307 -3.258 344 HG21 VAL 15 3HG2 VAL 15 8.837 -11.989 -1.406 345 HG22 VAL 15 1HG2 VAL 15 10.326 -11.153 -0.903 346 HG23 VAL 15 2HG2 VAL 15 8.760 -10.687 -0.195 347 H VAL 16 HN VAL 16 11.395 -7.139 -2.601 348 HA VAL 16 HA VAL 16 9.739 -5.958 -4.717 349 HB VAL 16 HB VAL 16 10.409 -3.825 -4.213 350 HG11 VAL 16 1HG1 VAL 16 8.939 -4.634 -2.437 351 HG12 VAL 16 2HG1 VAL 16 10.345 -5.202 -1.506 352 HG13 VAL 16 3HG1 VAL 16 10.112 -3.461 -1.790 353 HG21 VAL 16 3HG2 VAL 16 12.642 -3.572 -4.058 354 HG22 VAL 16 1HG2 VAL 16 12.372 -3.701 -2.303 355 HG23 VAL 16 2HG2 VAL 16 12.863 -5.135 -3.236 356 H LYS 17 HN LYS 17 10.923 -5.335 -6.646 357 HA LYS 17 HA LYS 17 13.468 -6.788 -6.843 358 HB2 LYS 17 2HB LYS 17 12.392 -7.928 -8.439 359 HB3 LYS 17 3HB LYS 17 11.058 -6.794 -8.483 360 HG2 LYS 17 2HG LYS 17 12.040 -6.617 -10.644 361 HG3 LYS 17 3HG LYS 17 12.635 -5.207 -9.789 362 HD2 LYS 17 2HD LYS 17 14.715 -5.902 -10.403 363 HD3 LYS 17 3HD LYS 17 14.557 -7.108 -9.143 364 HE2 LYS 17 2HE LYS 17 13.179 -8.313 -11.230 365 HE3 LYS 17 3HE LYS 17 14.421 -7.433 -12.097 366 HZ1 LYS 17 2HZ LYS 17 14.731 -9.664 -10.256 367 HZ3 LYS 17 1HZ LYS 17 15.881 -8.516 -10.145 368 H VAL 18 HN VAL 18 15.269 -5.597 -7.176 369 HA VAL 18 HA VAL 18 15.047 -2.778 -7.362 370 HB VAL 18 HB VAL 18 17.403 -4.654 -7.642 371 HG11 VAL 18 1HG1 VAL 18 17.409 -2.080 -8.468 372 HG12 VAL 18 2HG1 VAL 18 17.793 -1.848 -6.745 373 HG13 VAL 18 3HG1 VAL 18 18.825 -2.889 -7.755 374 HG21 VAL 18 3HG2 VAL 18 15.812 -4.030 -5.395 375 HG22 VAL 18 1HG2 VAL 18 17.378 -4.873 -5.421 376 HG23 VAL 18 2HG2 VAL 18 17.323 -3.108 -5.201 377 H LEU 19 HN LEU 19 14.556 -1.642 -9.159 378 HA LEU 19 HA LEU 19 14.974 -2.927 -11.731 379 HB2 LEU 19 2HB LEU 19 13.477 -0.447 -10.882 380 HB3 LEU 19 3HB LEU 19 13.661 -0.951 -12.551 381 HG LEU 19 HG LEU 19 12.427 -2.757 -10.468 382 HD11 LEU 19 1HD1 LEU 19 10.913 -1.055 -10.275 383 HD12 LEU 19 2HD1 LEU 19 11.216 -0.441 -11.919 384 HD13 LEU 19 3HD1 LEU 19 10.239 -1.909 -11.683 385 HD21 LEU 19 3HD2 LEU 19 13.078 -3.014 -13.256 386 HD22 LEU 19 1HD2 LEU 19 12.399 -4.219 -12.136 387 HD23 LEU 19 2HD2 LEU 19 11.316 -3.132 -13.037 388 H GLU 20 HN GLU 20 15.708 0.234 -10.097 389 HA GLU 20 HA GLU 20 18.040 0.352 -11.848 390 HB2 GLU 20 2HB GLU 20 16.192 2.052 -12.340 391 HB3 GLU 20 3HB GLU 20 16.518 2.762 -10.772 392 HG2 GLU 20 2HG GLU 20 18.798 3.321 -11.396 393 HG3 GLU 20 3HG GLU 20 18.706 2.356 -12.856 394 H GLU 21 HN GLU 21 19.735 -0.257 -10.544 395 HA GLU 21 HA GLU 21 19.771 -0.096 -7.831 396 HB2 GLU 21 2HB GLU 21 22.228 -0.399 -8.025 397 HB3 GLU 21 3HB GLU 21 21.359 -1.447 -9.129 398 HG2 GLU 21 2HG GLU 21 21.938 -0.152 -11.032 399 HG3 GLU 21 3HG GLU 21 22.278 1.280 -10.080 400 H GLY 22 HN GLY 22 21.159 1.295 -6.375 401 HA2 GLY 22 1HA GLY 22 21.527 4.026 -7.415 402 HA3 GLY 22 2HA GLY 22 20.544 3.758 -5.990 403 H GLY 23 HN GLY 23 21.639 4.217 -4.137 404 HA2 GLY 23 1HA GLY 23 24.254 3.014 -3.717 405 HA3 GLY 23 2HA GLY 23 24.215 4.766 -3.746 406 H GLY 24 HN GLY 24 21.745 2.410 -2.518 407 HA2 GLY 24 1HA GLY 24 22.359 3.082 0.236 408 HA3 GLY 24 2HA GLY 24 20.844 3.727 -0.362 409 H THR 25 HN THR 25 20.251 2.139 1.572 410 HA THR 25 HA THR 25 19.727 -0.503 0.374 411 HB THR 25 HB THR 25 21.294 0.036 2.587 412 HG1 THR 25 HG1 THR 25 21.167 -2.062 1.742 413 HG21 THR 25 3HG2 THR 25 20.106 -0.267 4.589 414 HG22 THR 25 1HG2 THR 25 18.918 0.698 3.679 415 HG23 THR 25 2HG2 THR 25 18.743 -1.071 3.772 416 H LEU 26 HN LEU 26 17.768 -1.593 1.556 417 HA LEU 26 HA LEU 26 15.665 0.456 1.619 418 HB2 LEU 26 2HB LEU 26 15.203 -2.442 0.997 419 HB3 LEU 26 3HB LEU 26 14.190 -1.057 0.636 420 HG LEU 26 HG LEU 26 16.903 -1.343 -0.645 421 HD11 LEU 26 1HD1 LEU 26 14.624 -3.103 -1.028 422 HD12 LEU 26 2HD1 LEU 26 15.055 -2.244 -2.527 423 HD13 LEU 26 3HD1 LEU 26 16.280 -3.213 -1.673 424 HD21 LEU 26 3HD2 LEU 26 14.607 0.443 -0.884 425 HD22 LEU 26 1HD2 LEU 26 16.285 0.644 -1.442 426 HD23 LEU 26 2HD2 LEU 26 15.114 -0.242 -2.448 427 H VAL 27 HN VAL 27 16.212 0.823 3.912 428 HA VAL 27 HA VAL 27 15.983 -1.324 5.752 429 HB VAL 27 HB VAL 27 15.945 1.683 6.046 430 HG11 VAL 27 1HG1 VAL 27 16.705 0.226 8.439 431 HG12 VAL 27 2HG1 VAL 27 15.488 1.506 8.226 432 HG13 VAL 27 3HG1 VAL 27 15.052 -0.193 7.930 433 HG21 VAL 27 3HG2 VAL 27 18.130 1.430 5.603 434 HG22 VAL 27 1HG2 VAL 27 18.249 0.686 7.215 435 HG23 VAL 27 2HG2 VAL 27 18.049 -0.340 5.775 436 H CYS 28 HN CYS 28 14.093 -2.442 5.914 437 HA CYS 28 HA CYS 28 11.662 -0.813 6.073 438 HB2 CYS 28 2HB CYS 28 11.830 -2.284 4.058 439 HB3 CYS 28 3HB CYS 28 11.871 -3.677 5.122 440 H CYS 29 HN CYS 29 10.368 -1.133 7.913 441 HA CYS 29 HA CYS 29 9.796 -1.795 9.924 442 HB2 CYS 29 2HB CYS 29 10.977 -4.406 8.984 443 HB3 CYS 29 3HB CYS 29 10.264 -4.222 10.574 444 H GLY 30 HN GLY 30 12.468 -0.544 9.277 445 HA2 GLY 30 1HA GLY 30 14.228 0.188 10.481 446 HA3 GLY 30 2HA GLY 30 13.602 -0.665 11.878 447 H GLU 31 HN GLU 31 14.152 -2.399 8.824 448 HA GLU 31 HA GLU 31 16.693 -3.354 9.824 449 HB2 GLU 31 2HB GLU 31 14.724 -4.865 10.590 450 HB3 GLU 31 3HB GLU 31 14.571 -5.328 8.907 451 HG2 GLU 31 2HG GLU 31 17.290 -5.629 9.274 452 HG3 GLU 31 3HG GLU 31 16.702 -6.018 10.878 453 H ASP 32 HN ASP 32 18.170 -3.388 8.178 454 HA ASP 32 HA ASP 32 17.506 -2.547 5.664 455 HB2 ASP 32 2HB ASP 32 19.872 -4.382 6.128 456 HB3 ASP 32 3HB ASP 32 19.777 -2.966 5.099 457 H MET 33 HN MET 33 16.200 -3.672 4.207 458 HA MET 33 HA MET 33 15.448 -6.239 4.380 459 HB2 MET 33 2HB MET 33 14.933 -4.176 2.681 460 HB3 MET 33 3HB MET 33 15.968 -5.110 1.620 461 HG2 MET 33 2HG MET 33 14.301 -6.599 1.199 462 HG3 MET 33 3HG MET 33 14.067 -6.898 2.909 463 HE1 MET 33 3HE MET 33 12.864 -5.744 -0.187 464 HE2 MET 33 1HE MET 33 11.442 -4.711 0.092 465 HE3 MET 33 2HE MET 33 13.073 -4.000 0.097 466 H VAL 34 HN VAL 34 16.051 -8.262 3.388 467 HA VAL 34 HA VAL 34 18.919 -8.413 2.898 468 HB VAL 34 HB VAL 34 18.798 -10.605 3.566 469 HG11 VAL 34 1HG1 VAL 34 17.615 -10.672 5.631 470 HG12 VAL 34 2HG1 VAL 34 18.064 -8.970 5.363 471 HG13 VAL 34 3HG1 VAL 34 16.396 -9.510 5.054 472 HG21 VAL 34 3HG2 VAL 34 17.231 -11.508 2.018 473 HG22 VAL 34 1HG2 VAL 34 16.618 -11.907 3.641 474 HG23 VAL 34 2HG2 VAL 34 15.889 -10.570 2.717 475 H LYS 35 HN LYS 35 19.683 -9.856 1.094 476 HA LYS 35 HA LYS 35 18.048 -9.302 -1.255 477 HB2 LYS 35 2HB LYS 35 20.525 -8.618 -0.985 478 HB3 LYS 35 3HB LYS 35 20.892 -10.312 -1.242 479 HG2 LYS 35 2HG LYS 35 18.988 -9.008 -3.175 480 HG3 LYS 35 3HG LYS 35 20.677 -8.556 -3.287 481 HD2 LYS 35 2HD LYS 35 21.368 -10.841 -3.679 482 HD3 LYS 35 3HD LYS 35 19.803 -11.473 -3.205 483 HE2 LYS 35 2HE LYS 35 19.384 -9.569 -5.341 484 HE3 LYS 35 3HE LYS 35 20.671 -10.653 -5.828 485 HZ1 LYS 35 2HZ LYS 35 19.063 -12.142 -6.265 486 HZ3 LYS 35 1HZ LYS 35 17.899 -11.222 -5.595 487 H GLN 36 HN GLN 36 17.537 -10.952 -2.805 488 HA GLN 36 HA GLN 36 17.594 -13.598 -1.579 489 HB2 GLN 36 2HB GLN 36 15.625 -12.597 -3.677 490 HB3 GLN 36 3HB GLN 36 15.526 -14.092 -2.769 491 HG2 GLN 36 2HG GLN 36 15.563 -11.378 -1.385 492 HG3 GLN 36 3HG GLN 36 14.071 -12.104 -1.949 493 HE21 GLN 36 1HE2 GLN 36 16.703 -12.269 0.306 494 HE22 GLN 36 2HE2 GLN 36 16.050 -13.459 1.381 Start of MODEL 9 1 H1 ALA 1 HN ALA 1 3.277 -1.838 1.261 2 HA ALA 1 HA ALA 1 1.682 0.239 -0.053 3 HB1 ALA 1 1HB ALA 1 3.478 -0.386 -1.914 4 HB2 ALA 1 2HB ALA 1 3.894 0.698 -0.565 5 HB3 ALA 1 3HB ALA 1 4.376 -1.015 -0.511 6 H ASN 2 HN ASN 2 0.875 -0.311 -2.292 7 HA ASN 2 HA ASN 2 -0.288 -2.941 -2.147 8 HB2 ASN 2 2HB ASN 2 -0.886 -0.362 -3.576 9 HB3 ASN 2 3HB ASN 2 -1.371 -1.826 -4.407 10 HD21 ASN 2 1HD2 ASN 2 -3.484 -0.736 -4.025 11 HD22 ASN 2 2HD2 ASN 2 -4.357 -1.116 -2.578 12 H GLU 3 HN GLU 3 0.179 -4.588 -3.690 13 HA GLU 3 HA GLU 3 2.581 -4.588 -4.939 14 HB2 GLU 3 2HB GLU 3 0.062 -6.129 -5.704 15 HB3 GLU 3 3HB GLU 3 1.676 -6.535 -6.254 16 HG2 GLU 3 2HG GLU 3 2.423 -7.063 -4.025 17 HG3 GLU 3 3HG GLU 3 1.033 -6.289 -3.288 18 H GLY 4 HN GLY 4 3.053 -4.755 -7.365 19 HA2 GLY 4 1HA GLY 4 2.991 -3.919 -9.456 20 HA3 GLY 4 2HA GLY 4 1.289 -3.563 -9.238 21 H ASP 5 HN ASP 5 3.956 -2.351 -7.147 22 HA ASP 5 HA ASP 5 3.370 0.300 -8.215 23 HB2 ASP 5 2HB ASP 5 3.534 -0.740 -5.420 24 HB3 ASP 5 3HB ASP 5 4.363 0.782 -5.682 25 H VAL 6 HN VAL 6 5.338 1.872 -7.548 26 HA VAL 6 HA VAL 6 7.854 0.377 -7.607 27 HB VAL 6 HB VAL 6 6.785 2.319 -9.600 28 HG11 VAL 6 1HG1 VAL 6 9.019 2.995 -10.306 29 HG12 VAL 6 2HG1 VAL 6 8.730 3.492 -8.622 30 HG13 VAL 6 3HG1 VAL 6 9.746 2.073 -8.970 31 HG21 VAL 6 3HG2 VAL 6 7.921 0.856 -11.178 32 HG22 VAL 6 1HG2 VAL 6 8.683 -0.040 -9.842 33 HG23 VAL 6 2HG2 VAL 6 6.920 -0.112 -10.069 34 H TYR 7 HN TYR 7 9.603 1.435 -6.563 35 HA TYR 7 HA TYR 7 8.864 3.931 -5.197 36 HB2 TYR 7 2HB TYR 7 9.874 1.224 -4.267 37 HB3 TYR 7 3HB TYR 7 10.555 2.619 -3.455 38 HD1 TYR 7 HD1 TYR 7 9.035 4.195 -2.206 39 HD2 TYR 7 HD2 TYR 7 7.653 0.471 -3.794 40 HE1 TYR 7 HE1 TYR 7 7.000 4.293 -0.685 41 HE2 TYR 7 HE2 TYR 7 5.623 0.582 -2.269 42 HH TYR 7 HH TYR 7 5.427 2.772 0.313 43 H LYS 8 HN LYS 8 10.294 5.544 -5.580 44 HA LYS 8 HA LYS 8 13.001 4.728 -6.381 45 HB2 LYS 8 2HB LYS 8 11.845 5.653 -8.278 46 HB3 LYS 8 3HB LYS 8 11.293 7.033 -7.351 47 HG2 LYS 8 2HG LYS 8 14.240 6.648 -7.284 48 HG3 LYS 8 3HG LYS 8 13.606 6.964 -8.887 49 HD2 LYS 8 2HD LYS 8 12.396 8.727 -6.856 50 HD3 LYS 8 3HD LYS 8 14.141 8.883 -6.902 51 HE2 LYS 8 2HE LYS 8 12.307 9.089 -9.339 52 HE3 LYS 8 3HE LYS 8 12.992 10.457 -8.485 53 HZ1 LYS 8 2HZ LYS 8 15.074 8.673 -9.134 54 HZ3 LYS 8 1HZ LYS 8 14.861 10.194 -9.676 55 H CYS 9 HN CYS 9 14.700 5.529 -5.215 56 HA CYS 9 HA CYS 9 14.054 6.877 -2.797 57 HB2 CYS 9 2HB CYS 9 15.818 5.152 -2.915 58 HB3 CYS 9 3HB CYS 9 16.758 6.173 -3.985 59 H GLU 10 HN GLU 10 14.301 9.080 -2.330 60 HA GLU 10 HA GLU 10 14.834 10.736 -4.628 61 HB2 GLU 10 2HB GLU 10 13.457 11.088 -1.984 62 HB3 GLU 10 3HB GLU 10 14.170 12.519 -2.701 63 HG2 GLU 10 2HG GLU 10 12.683 10.909 -4.679 64 HG3 GLU 10 3HG GLU 10 11.668 11.414 -3.342 65 H LEU 11 HN LEU 11 17.088 9.295 -3.518 66 HA LEU 11 HA LEU 11 18.694 11.601 -2.727 67 HB2 LEU 11 2HB LEU 11 18.033 9.321 -1.057 68 HB3 LEU 11 3HB LEU 11 19.763 9.450 -1.310 69 HG LEU 11 HG LEU 11 18.615 12.044 -0.676 70 HD11 LEU 11 1HD1 LEU 11 18.179 9.840 1.359 71 HD12 LEU 11 2HD1 LEU 11 17.994 11.586 1.652 72 HD13 LEU 11 3HD1 LEU 11 16.914 10.755 0.505 73 HD21 LEU 11 3HD2 LEU 11 20.774 10.272 0.468 74 HD22 LEU 11 1HD2 LEU 11 20.940 11.770 -0.478 75 HD23 LEU 11 2HD2 LEU 11 20.339 11.836 1.196 76 H CYS 12 HN CYS 12 18.911 8.033 -3.408 77 HA CYS 12 HA CYS 12 21.282 8.590 -4.979 78 HB2 CYS 12 2HB CYS 12 21.437 6.096 -5.105 79 HB3 CYS 12 3HB CYS 12 21.575 6.786 -3.500 80 H GLY 13 HN GLY 13 17.965 7.154 -5.217 81 HA2 GLY 13 1HA GLY 13 16.653 7.747 -7.154 82 HA3 GLY 13 2HA GLY 13 18.093 7.588 -8.139 83 H GLN 14 HN GLN 14 17.601 5.295 -5.494 84 HA GLN 14 HA GLN 14 17.675 3.150 -7.293 85 HB2 GLN 14 2HB GLN 14 18.518 3.184 -4.887 86 HB3 GLN 14 3HB GLN 14 16.850 3.081 -4.360 87 HG2 GLN 14 2HG GLN 14 16.680 0.983 -5.905 88 HG3 GLN 14 3HG GLN 14 18.431 1.030 -5.957 89 HE21 GLN 14 1HE2 GLN 14 18.597 2.199 -3.251 90 HE22 GLN 14 2HE2 GLN 14 18.319 0.908 -2.131 91 H VAL 15 HN VAL 15 16.010 2.532 -8.601 92 HA VAL 15 HA VAL 15 13.293 2.950 -7.580 93 HB VAL 15 HB VAL 15 14.355 2.630 -10.393 94 HG11 VAL 15 1HG1 VAL 15 12.152 1.663 -10.298 95 HG12 VAL 15 2HG1 VAL 15 11.528 3.050 -9.373 96 HG13 VAL 15 3HG1 VAL 15 12.024 3.263 -11.069 97 HG21 VAL 15 3HG2 VAL 15 14.064 4.923 -8.652 98 HG22 VAL 15 1HG2 VAL 15 14.763 4.821 -10.286 99 HG23 VAL 15 2HG2 VAL 15 13.016 5.089 -10.081 100 H VAL 16 HN VAL 16 12.248 1.186 -6.829 101 HA VAL 16 HA VAL 16 12.997 -1.394 -8.017 102 HB VAL 16 HB VAL 16 12.953 -2.432 -5.920 103 HG11 VAL 16 1HG1 VAL 16 14.258 0.160 -5.124 104 HG12 VAL 16 2HG1 VAL 16 14.802 -1.513 -4.858 105 HG13 VAL 16 3HG1 VAL 16 14.910 -0.790 -6.480 106 HG21 VAL 16 3HG2 VAL 16 11.862 0.142 -4.734 107 HG22 VAL 16 1HG2 VAL 16 10.942 -1.355 -5.019 108 HG23 VAL 16 2HG2 VAL 16 12.266 -1.338 -3.830 109 H LYS 17 HN LYS 17 11.239 -3.020 -7.969 110 HA LYS 17 HA LYS 17 8.632 -1.669 -8.046 111 HB2 LYS 17 2HB LYS 17 8.585 -2.393 -10.155 112 HB3 LYS 17 3HB LYS 17 10.011 -3.387 -9.936 113 HG2 LYS 17 2HG LYS 17 8.179 -4.873 -10.494 114 HG3 LYS 17 3HG LYS 17 8.561 -5.132 -8.804 115 HD2 LYS 17 2HD LYS 17 6.279 -4.891 -8.567 116 HD3 LYS 17 3HD LYS 17 6.702 -3.193 -8.480 117 HE2 LYS 17 2HE LYS 17 5.219 -2.937 -10.201 118 HE3 LYS 17 3HE LYS 17 6.521 -3.530 -11.214 119 HZ1 LYS 17 2HZ LYS 17 5.375 -5.417 -11.585 120 HZ3 LYS 17 1HZ LYS 17 4.082 -4.747 -10.858 121 H VAL 18 HN VAL 18 7.193 -2.230 -6.506 122 HA VAL 18 HA VAL 18 7.873 -4.209 -4.603 123 HB VAL 18 HB VAL 18 5.271 -2.748 -5.101 124 HG11 VAL 18 1HG1 VAL 18 4.418 -3.868 -3.373 125 HG12 VAL 18 2HG1 VAL 18 5.899 -4.853 -3.298 126 HG13 VAL 18 3HG1 VAL 18 5.774 -3.358 -2.340 127 HG21 VAL 18 3HG2 VAL 18 7.832 -1.958 -3.780 128 HG22 VAL 18 1HG2 VAL 18 6.662 -0.978 -4.697 129 HG23 VAL 18 2HG2 VAL 18 6.309 -1.444 -3.015 130 H LEU 19 HN LEU 19 7.813 -6.361 -4.984 131 HA LEU 19 HA LEU 19 6.108 -7.379 -7.062 132 HB2 LEU 19 2HB LEU 19 8.387 -8.313 -5.449 133 HB3 LEU 19 3HB LEU 19 7.210 -9.552 -5.835 134 HG LEU 19 HG LEU 19 7.495 -8.479 -8.288 135 HD11 LEU 19 1HD1 LEU 19 9.833 -7.928 -8.719 136 HD12 LEU 19 2HD1 LEU 19 9.109 -6.788 -7.559 137 HD13 LEU 19 3HD1 LEU 19 10.200 -8.071 -6.983 138 HD21 LEU 19 3HD2 LEU 19 9.307 -10.273 -8.630 139 HD22 LEU 19 1HD2 LEU 19 9.080 -10.633 -6.901 140 HD23 LEU 19 2HD2 LEU 19 7.712 -10.787 -8.029 141 H GLU 20 HN GLU 20 6.535 -8.131 -3.527 142 HA GLU 20 HA GLU 20 3.649 -8.519 -3.468 143 HB2 GLU 20 2HB GLU 20 3.809 -10.561 -2.310 144 HB3 GLU 20 3HB GLU 20 5.084 -10.695 -3.504 145 HG2 GLU 20 2HG GLU 20 6.662 -9.707 -1.684 146 HG3 GLU 20 3HG GLU 20 5.366 -10.020 -0.548 147 H GLU 21 HN GLU 21 2.800 -7.007 -2.109 148 HA GLU 21 HA GLU 21 4.275 -5.409 -0.485 149 HB2 GLU 21 2HB GLU 21 2.154 -4.700 0.492 150 HB3 GLU 21 3HB GLU 21 1.927 -4.985 -1.222 151 HG2 GLU 21 2HG GLU 21 1.354 -7.487 -0.244 152 HG3 GLU 21 3HG GLU 21 0.844 -6.504 1.115 153 H GLY 22 HN GLY 22 4.043 -5.213 2.011 154 HA2 GLY 22 1HA GLY 22 3.928 -7.847 3.310 155 HA3 GLY 22 2HA GLY 22 5.393 -6.894 3.444 156 H GLY 23 HN GLY 23 4.899 -4.411 4.028 157 HA2 GLY 23 1HA GLY 23 2.927 -3.251 5.228 158 HA3 GLY 23 2HA GLY 23 3.177 -4.519 6.412 159 H GLY 24 HN GLY 24 5.336 -2.346 4.436 160 HA2 GLY 24 1HA GLY 24 6.343 -1.046 6.794 161 HA3 GLY 24 2HA GLY 24 7.474 -2.200 6.116 162 H THR 25 HN THR 25 8.677 0.014 5.903 163 HA THR 25 HA THR 25 8.048 1.082 3.231 164 HB THR 25 HB THR 25 8.736 2.505 5.840 165 HG1 THR 25 HG1 THR 25 6.896 3.784 4.595 166 HG21 THR 25 3HG2 THR 25 8.596 3.858 3.116 167 HG22 THR 25 1HG2 THR 25 9.207 4.521 4.651 168 HG23 THR 25 2HG2 THR 25 10.156 3.301 3.768 169 H LEU 26 HN LEU 26 9.879 1.844 1.993 170 HA LEU 26 HA LEU 26 12.260 0.304 2.705 171 HB2 LEU 26 2HB LEU 26 11.718 1.578 0.042 172 HB3 LEU 26 3HB LEU 26 12.787 0.246 0.429 173 HG LEU 26 HG LEU 26 9.805 -0.022 0.775 174 HD11 LEU 26 1HD1 LEU 26 9.489 0.253 -1.410 175 HD12 LEU 26 2HD1 LEU 26 11.238 0.325 -1.731 176 HD13 LEU 26 3HD1 LEU 26 10.413 -1.250 -1.645 177 HD21 LEU 26 3HD2 LEU 26 12.045 -2.006 0.307 178 HD22 LEU 26 1HD2 LEU 26 11.125 -1.750 1.810 179 HD23 LEU 26 2HD2 LEU 26 10.314 -2.417 0.372 180 H VAL 27 HN VAL 27 12.896 1.870 4.370 181 HA VAL 27 HA VAL 27 13.403 4.562 3.607 182 HB VAL 27 HB VAL 27 14.281 2.900 5.977 183 HG11 VAL 27 1HG1 VAL 27 15.195 5.464 5.120 184 HG12 VAL 27 2HG1 VAL 27 14.175 5.699 6.560 185 HG13 VAL 27 3HG1 VAL 27 15.570 4.597 6.628 186 HG21 VAL 27 3HG2 VAL 27 11.854 3.119 5.814 187 HG22 VAL 27 1HG2 VAL 27 12.476 4.088 7.170 188 HG23 VAL 27 2HG2 VAL 27 12.005 4.886 5.650 189 H CYS 28 HN CYS 28 14.885 4.992 2.037 190 HA CYS 28 HA CYS 28 17.437 3.567 2.275 191 HB2 CYS 28 2HB CYS 28 16.039 3.058 0.230 192 HB3 CYS 28 3HB CYS 28 16.283 4.720 -0.269 193 H CYS 29 HN CYS 29 19.282 4.875 2.430 194 HA CYS 29 HA CYS 29 20.504 6.677 2.693 195 HB2 CYS 29 2HB CYS 29 18.514 7.849 0.753 196 HB3 CYS 29 3HB CYS 29 19.859 8.777 1.389 197 H GLY 30 HN GLY 30 18.295 5.980 4.536 198 HA2 GLY 30 1HA GLY 30 17.372 6.812 6.410 199 HA3 GLY 30 2HA GLY 30 18.331 8.262 6.190 200 H GLU 31 HN GLU 31 16.248 7.261 3.527 201 HA GLU 31 HA GLU 31 14.217 9.128 4.430 202 HB2 GLU 31 2HB GLU 31 16.001 10.109 2.750 203 HB3 GLU 31 3HB GLU 31 15.137 9.176 1.545 204 HG2 GLU 31 2HG GLU 31 13.063 10.426 2.944 205 HG3 GLU 31 3HG GLU 31 14.317 11.650 2.948 206 H ASP 32 HN ASP 32 12.170 8.310 4.166 207 HA ASP 32 HA ASP 32 11.835 5.717 3.313 208 HB2 ASP 32 2HB ASP 32 9.372 6.293 3.338 209 HB3 ASP 32 3HB ASP 32 10.224 6.746 4.800 210 H MET 33 HN MET 33 12.022 4.990 1.187 211 HA MET 33 HA MET 33 12.277 6.494 -1.003 212 HB2 MET 33 2HB MET 33 12.316 3.850 -0.530 213 HB3 MET 33 3HB MET 33 10.684 3.907 -1.166 214 HG2 MET 33 2HG MET 33 11.392 4.565 -3.319 215 HG3 MET 33 3HG MET 33 12.882 5.276 -2.731 216 HE1 MET 33 3HE MET 33 13.957 2.136 -0.869 217 HE2 MET 33 1HE MET 33 15.233 2.698 -1.975 218 HE3 MET 33 2HE MET 33 14.226 3.879 -1.103 219 H VAL 34 HN VAL 34 10.930 7.252 -2.738 220 HA VAL 34 HA VAL 34 8.204 7.788 -1.856 221 HB VAL 34 HB VAL 34 8.229 9.598 -3.327 222 HG11 VAL 34 1HG1 VAL 34 9.938 10.914 -2.496 223 HG12 VAL 34 2HG1 VAL 34 9.943 9.569 -1.329 224 HG13 VAL 34 3HG1 VAL 34 11.152 9.620 -2.634 225 HG21 VAL 34 3HG2 VAL 34 10.702 9.452 -4.740 226 HG22 VAL 34 1HG2 VAL 34 9.853 7.904 -4.963 227 HG23 VAL 34 2HG2 VAL 34 9.046 9.431 -5.392 228 H LYS 35 HN LYS 35 6.463 7.705 -3.601 229 HA LYS 35 HA LYS 35 6.756 5.155 -4.973 230 HB2 LYS 35 2HB LYS 35 4.736 6.204 -3.437 231 HB3 LYS 35 3HB LYS 35 4.156 6.545 -5.055 232 HG2 LYS 35 2HG LYS 35 3.574 4.373 -5.327 233 HG3 LYS 35 3HG LYS 35 5.240 3.880 -5.090 234 HD2 LYS 35 2HD LYS 35 4.240 2.755 -3.314 235 HD3 LYS 35 3HD LYS 35 4.675 4.251 -2.510 236 HE2 LYS 35 2HE LYS 35 2.342 5.137 -3.093 237 HE3 LYS 35 3HE LYS 35 1.941 3.528 -3.662 238 HZ1 LYS 35 2HZ LYS 35 2.360 2.660 -1.455 239 HZ3 LYS 35 1HZ LYS 35 1.330 3.912 -1.302 240 H GLN 36 HN GLN 36 6.182 4.906 -7.234 241 HA GLN 36 HA GLN 36 6.505 7.424 -8.674 242 HB2 GLN 36 2HB GLN 36 7.433 4.667 -9.587 243 HB3 GLN 36 3HB GLN 36 7.711 6.184 -10.419 244 HG2 GLN 36 2HG GLN 36 8.667 5.743 -7.562 245 HG3 GLN 36 3HG GLN 36 9.635 5.245 -8.935 246 HE21 GLN 36 1HE2 GLN 36 8.230 7.916 -7.192 247 HE22 GLN 36 2HE2 GLN 36 9.160 9.196 -7.899 248 H1 ALA 1 HN ALA 1 21.418 -0.997 -5.690 249 HA ALA 1 HA ALA 1 23.427 -2.602 -4.265 250 HB1 ALA 1 1HB ALA 1 21.628 -4.420 -4.554 251 HB2 ALA 1 2HB ALA 1 21.277 -3.116 -3.393 252 HB3 ALA 1 3HB ALA 1 20.528 -3.096 -5.007 253 H ASN 2 HN ASN 2 21.175 -3.269 -7.021 254 HA ASN 2 HA ASN 2 22.915 -3.043 -9.061 255 HB2 ASN 2 2HB ASN 2 23.551 -5.535 -9.411 256 HB3 ASN 2 3HB ASN 2 24.459 -4.666 -8.189 257 HD21 ASN 2 1HD2 ASN 2 23.720 -7.539 -8.594 258 HD22 ASN 2 2HD2 ASN 2 23.029 -8.071 -7.097 259 H GLU 3 HN GLU 3 21.523 -3.207 -10.838 260 HA GLU 3 HA GLU 3 18.920 -3.867 -10.593 261 HB2 GLU 3 2HB GLU 3 20.631 -4.119 -13.107 262 HB3 GLU 3 3HB GLU 3 18.884 -3.982 -13.083 263 HG2 GLU 3 2HG GLU 3 18.978 -1.724 -12.844 264 HG3 GLU 3 3HG GLU 3 20.077 -1.847 -11.485 265 H GLY 4 HN GLY 4 17.649 -5.697 -11.627 266 HA2 GLY 4 1HA GLY 4 17.176 -7.881 -11.881 267 HA3 GLY 4 2HA GLY 4 18.866 -8.163 -12.250 268 H ASP 5 HN ASP 5 17.455 -6.784 -9.219 269 HA ASP 5 HA ASP 5 18.383 -9.199 -7.877 270 HB2 ASP 5 2HB ASP 5 19.045 -6.337 -7.390 271 HB3 ASP 5 3HB ASP 5 18.585 -7.216 -5.945 272 H VAL 6 HN VAL 6 17.271 -9.382 -5.603 273 HA VAL 6 HA VAL 6 14.682 -8.019 -5.576 274 HB VAL 6 HB VAL 6 15.245 -10.956 -5.656 275 HG11 VAL 6 1HG1 VAL 6 14.034 -11.239 -3.767 276 HG12 VAL 6 2HG1 VAL 6 13.318 -9.612 -3.855 277 HG13 VAL 6 3HG1 VAL 6 12.648 -10.934 -4.840 278 HG21 VAL 6 3HG2 VAL 6 14.487 -9.847 -7.693 279 HG22 VAL 6 1HG2 VAL 6 13.230 -10.952 -7.087 280 HG23 VAL 6 2HG2 VAL 6 13.068 -9.197 -6.838 281 H TYR 7 HN TYR 7 13.965 -7.450 -3.518 282 HA TYR 7 HA TYR 7 15.736 -8.277 -1.318 283 HB2 TYR 7 2HB TYR 7 14.586 -5.638 -2.307 284 HB3 TYR 7 3HB TYR 7 14.752 -5.828 -0.573 285 HD1 TYR 7 HD1 TYR 7 17.042 -6.249 0.415 286 HD2 TYR 7 HD2 TYR 7 16.478 -5.181 -3.689 287 HE1 TYR 7 HE1 TYR 7 19.487 -5.573 0.247 288 HE2 TYR 7 HE2 TYR 7 18.925 -4.508 -3.843 289 HH TYR 7 HH TYR 7 20.993 -4.986 -2.747 290 H LYS 8 HN LYS 8 14.704 -9.324 0.307 291 HA LYS 8 HA LYS 8 11.816 -8.837 0.549 292 HB2 LYS 8 2HB LYS 8 12.157 -11.037 -0.366 293 HB3 LYS 8 3HB LYS 8 13.367 -11.422 0.841 294 HG2 LYS 8 2HG LYS 8 10.788 -10.529 2.007 295 HG3 LYS 8 3HG LYS 8 10.645 -11.988 1.045 296 HD2 LYS 8 2HD LYS 8 12.984 -11.899 2.912 297 HD3 LYS 8 3HD LYS 8 11.409 -11.969 3.677 298 HE2 LYS 8 2HE LYS 8 10.830 -13.983 2.305 299 HE3 LYS 8 3HE LYS 8 12.404 -13.911 1.535 300 HZ1 LYS 8 2HZ LYS 8 11.810 -14.550 4.356 301 HZ3 LYS 8 1HZ LYS 8 13.298 -14.041 3.935 302 H CYS 9 HN CYS 9 11.050 -8.269 2.551 303 HA CYS 9 HA CYS 9 13.017 -7.567 4.485 304 HB2 CYS 9 2HB CYS 9 11.063 -6.136 4.070 305 HB3 CYS 9 3HB CYS 9 9.986 -7.415 4.598 306 H GLU 10 HN GLU 10 13.343 -8.553 6.550 307 HA GLU 10 HA GLU 10 12.398 -11.279 6.639 308 HB2 GLU 10 2HB GLU 10 14.661 -9.745 7.894 309 HB3 GLU 10 3HB GLU 10 14.072 -11.159 8.744 310 HG2 GLU 10 2HG GLU 10 14.347 -11.745 5.893 311 HG3 GLU 10 3HG GLU 10 15.850 -11.101 6.523 312 H LEU 11 HN LEU 11 10.483 -9.126 7.130 313 HA LEU 11 HA LEU 11 9.701 -9.929 9.814 314 HB2 LEU 11 2HB LEU 11 10.901 -7.888 10.208 315 HB3 LEU 11 3HB LEU 11 10.039 -7.066 8.922 316 HG LEU 11 HG LEU 11 8.030 -6.968 10.161 317 HD11 LEU 11 1HD1 LEU 11 8.090 -9.311 10.980 318 HD12 LEU 11 2HD1 LEU 11 9.235 -8.806 12.247 319 HD13 LEU 11 3HD1 LEU 11 7.585 -8.137 12.220 320 HD21 LEU 11 3HD2 LEU 11 8.876 -5.255 11.286 321 HD22 LEU 11 1HD2 LEU 11 9.329 -6.374 12.594 322 HD23 LEU 11 2HD2 LEU 11 10.491 -6.004 11.297 323 H CYS 12 HN CYS 12 8.494 -7.359 7.580 324 HA CYS 12 HA CYS 12 5.875 -8.354 7.749 325 HB2 CYS 12 2HB CYS 12 5.391 -6.704 5.957 326 HB3 CYS 12 3HB CYS 12 6.182 -6.037 7.372 327 H GLY 13 HN GLY 13 8.575 -8.629 5.376 328 HA2 GLY 13 1HA GLY 13 8.911 -10.559 4.092 329 HA3 GLY 13 2HA GLY 13 7.200 -10.926 4.171 330 H GLN 14 HN GLN 14 8.436 -7.637 3.503 331 HA GLN 14 HA GLN 14 6.945 -7.608 1.090 332 HB2 GLN 14 2HB GLN 14 7.018 -5.607 2.475 333 HB3 GLN 14 3HB GLN 14 8.769 -5.567 2.426 334 HG2 GLN 14 2HG GLN 14 8.828 -4.885 0.156 335 HG3 GLN 14 3HG GLN 14 7.215 -5.483 -0.173 336 HE21 GLN 14 1HE2 GLN 14 8.540 -3.439 2.422 337 HE22 GLN 14 2HE2 GLN 14 7.505 -2.071 2.177 338 H VAL 15 HN VAL 15 7.663 -8.296 -0.876 339 HA VAL 15 HA VAL 15 10.573 -8.410 -1.247 340 HB VAL 15 HB VAL 15 8.386 -9.993 -2.610 341 HG11 VAL 15 1HG1 VAL 15 11.286 -10.765 -2.611 342 HG12 VAL 15 2HG1 VAL 15 10.008 -11.124 -3.796 343 HG13 VAL 15 3HG1 VAL 15 10.727 -9.497 -3.729 344 HG21 VAL 15 3HG2 VAL 15 8.317 -10.990 -0.560 345 HG22 VAL 15 1HG2 VAL 15 9.732 -11.851 -1.214 346 HG23 VAL 15 2HG2 VAL 15 9.959 -10.465 -0.122 347 H VAL 16 HN VAL 16 11.466 -7.040 -2.705 348 HA VAL 16 HA VAL 16 9.721 -6.023 -4.824 349 HB VAL 16 HB VAL 16 10.375 -3.793 -4.459 350 HG11 VAL 16 1HG1 VAL 16 8.986 -3.442 -2.736 351 HG12 VAL 16 2HG1 VAL 16 8.926 -5.212 -2.561 352 HG13 VAL 16 3HG1 VAL 16 10.073 -4.258 -1.588 353 HG21 VAL 16 3HG2 VAL 16 12.617 -5.008 -3.005 354 HG22 VAL 16 1HG2 VAL 16 12.511 -3.449 -3.858 355 HG23 VAL 16 2HG2 VAL 16 11.924 -3.589 -2.183 356 H LYS 17 HN LYS 17 10.722 -5.835 -6.824 357 HA LYS 17 HA LYS 17 13.425 -6.925 -6.909 358 HB2 LYS 17 2HB LYS 17 11.757 -8.091 -8.230 359 HB3 LYS 17 3HB LYS 17 11.289 -6.608 -9.036 360 HG2 LYS 17 2HG LYS 17 14.196 -7.409 -9.139 361 HG3 LYS 17 3HG LYS 17 13.064 -8.311 -10.127 362 HD2 LYS 17 2HD LYS 17 12.264 -6.186 -11.166 363 HD3 LYS 17 3HD LYS 17 13.374 -5.270 -10.165 364 HE2 LYS 17 2HE LYS 17 15.307 -6.206 -11.255 365 HE3 LYS 17 3HE LYS 17 14.371 -7.488 -11.996 366 HZ1 LYS 17 2HZ LYS 17 13.136 -5.576 -13.163 367 HZ3 LYS 17 1HZ LYS 17 14.641 -5.906 -13.689 368 H VAL 18 HN VAL 18 15.147 -5.614 -7.169 369 HA VAL 18 HA VAL 18 14.777 -2.833 -7.481 370 HB VAL 18 HB VAL 18 17.212 -4.620 -7.601 371 HG11 VAL 18 1HG1 VAL 18 18.318 -2.861 -8.433 372 HG12 VAL 18 2HG1 VAL 18 16.916 -1.785 -8.219 373 HG13 VAL 18 3HG1 VAL 18 18.041 -2.060 -6.867 374 HG21 VAL 18 3HG2 VAL 18 15.592 -3.989 -5.452 375 HG22 VAL 18 1HG2 VAL 18 17.288 -4.521 -5.359 376 HG23 VAL 18 2HG2 VAL 18 16.898 -2.784 -5.333 377 H LEU 19 HN LEU 19 14.441 -1.679 -9.306 378 HA LEU 19 HA LEU 19 14.858 -3.053 -11.838 379 HB2 LEU 19 2HB LEU 19 13.396 -0.508 -11.126 380 HB3 LEU 19 3HB LEU 19 13.547 -1.148 -12.750 381 HG LEU 19 HG LEU 19 12.415 -2.963 -10.669 382 HD11 LEU 19 1HD1 LEU 19 11.315 -0.335 -11.214 383 HD12 LEU 19 2HD1 LEU 19 10.182 -1.627 -11.678 384 HD13 LEU 19 3HD1 LEU 19 10.822 -1.558 -10.018 385 HD21 LEU 19 3HD2 LEU 19 11.428 -2.469 -13.476 386 HD22 LEU 19 1HD2 LEU 19 12.833 -3.509 -13.139 387 HD23 LEU 19 2HD2 LEU 19 11.240 -3.916 -12.456 388 H GLU 20 HN GLU 20 15.620 0.119 -10.241 389 HA GLU 20 HA GLU 20 17.966 0.184 -11.973 390 HB2 GLU 20 2HB GLU 20 16.118 1.891 -12.512 391 HB3 GLU 20 3HB GLU 20 16.481 2.646 -10.973 392 HG2 GLU 20 2HG GLU 20 18.530 3.463 -11.689 393 HG3 GLU 20 3HG GLU 20 18.841 2.088 -12.730 394 H GLU 21 HN GLU 21 19.813 -0.043 -10.795 395 HA GLU 21 HA GLU 21 19.769 0.054 -8.018 396 HB2 GLU 21 2HB GLU 21 21.421 -1.335 -8.965 397 HB3 GLU 21 3HB GLU 21 21.936 -0.120 -10.117 398 HG2 GLU 21 2HG GLU 21 22.863 1.256 -8.225 399 HG3 GLU 21 3HG GLU 21 22.384 0.003 -7.096 400 H GLY 22 HN GLY 22 21.006 1.526 -6.569 401 HA2 GLY 22 1HA GLY 22 21.327 4.235 -7.705 402 HA3 GLY 22 2HA GLY 22 20.428 3.958 -6.226 403 H GLY 23 HN GLY 23 21.512 3.571 -4.262 404 HA2 GLY 23 1HA GLY 23 24.154 2.735 -3.991 405 HA3 GLY 23 2HA GLY 23 24.181 4.485 -4.085 406 H GLY 24 HN GLY 24 21.723 2.225 -2.655 407 HA2 GLY 24 1HA GLY 24 22.442 3.070 0.033 408 HA3 GLY 24 2HA GLY 24 20.881 3.620 -0.545 409 H THR 25 HN THR 25 20.085 2.244 1.317 410 HA THR 25 HA THR 25 19.724 -0.517 0.372 411 HB THR 25 HB THR 25 20.841 0.535 2.950 412 HG1 THR 25 HG1 THR 25 21.599 -1.855 2.637 413 HG21 THR 25 3HG2 THR 25 19.970 -1.253 4.298 414 HG22 THR 25 1HG2 THR 25 18.534 -0.561 3.507 415 HG23 THR 25 2HG2 THR 25 19.252 -2.068 2.889 416 H LEU 26 HN LEU 26 17.786 -1.585 1.422 417 HA LEU 26 HA LEU 26 15.668 0.437 1.567 418 HB2 LEU 26 2HB LEU 26 15.284 -2.489 0.994 419 HB3 LEU 26 3HB LEU 26 14.185 -1.159 0.691 420 HG LEU 26 HG LEU 26 16.840 -1.359 -0.730 421 HD11 LEU 26 1HD1 LEU 26 15.623 -3.473 -1.083 422 HD12 LEU 26 2HD1 LEU 26 14.218 -2.552 -1.675 423 HD13 LEU 26 3HD1 LEU 26 15.756 -2.507 -2.572 424 HD21 LEU 26 3HD2 LEU 26 14.269 0.151 -1.205 425 HD22 LEU 26 1HD2 LEU 26 15.916 0.788 -0.981 426 HD23 LEU 26 2HD2 LEU 26 15.493 -0.078 -2.477 427 H VAL 27 HN VAL 27 16.229 0.877 3.835 428 HA VAL 27 HA VAL 27 16.088 -1.225 5.734 429 HB VAL 27 HB VAL 27 15.925 1.783 5.995 430 HG11 VAL 27 1HG1 VAL 27 16.674 1.281 8.383 431 HG12 VAL 27 2HG1 VAL 27 14.978 0.917 7.986 432 HG13 VAL 27 3HG1 VAL 27 16.171 -0.399 8.079 433 HG21 VAL 27 3HG2 VAL 27 18.243 -0.160 6.259 434 HG22 VAL 27 1HG2 VAL 27 18.030 1.104 5.023 435 HG23 VAL 27 2HG2 VAL 27 18.306 1.557 6.723 436 H CYS 28 HN CYS 28 14.227 -2.391 5.929 437 HA CYS 28 HA CYS 28 11.759 -0.819 6.104 438 HB2 CYS 28 2HB CYS 28 11.964 -2.350 4.118 439 HB3 CYS 28 3HB CYS 28 11.996 -3.703 5.231 440 H CYS 29 HN CYS 29 10.521 -1.117 7.980 441 HA CYS 29 HA CYS 29 10.030 -1.717 10.032 442 HB2 CYS 29 2HB CYS 29 11.139 -4.379 9.133 443 HB3 CYS 29 3HB CYS 29 10.393 -4.129 10.698 444 H GLY 30 HN GLY 30 12.548 -0.364 9.472 445 HA2 GLY 30 1HA GLY 30 14.413 0.278 10.550 446 HA3 GLY 30 2HA GLY 30 13.816 -0.569 11.964 447 H GLU 31 HN GLU 31 14.174 -2.413 8.979 448 HA GLU 31 HA GLU 31 16.763 -3.361 9.880 449 HB2 GLU 31 2HB GLU 31 14.848 -4.847 10.739 450 HB3 GLU 31 3HB GLU 31 14.536 -5.273 9.068 451 HG2 GLU 31 2HG GLU 31 17.173 -5.778 9.052 452 HG3 GLU 31 3HG GLU 31 16.932 -5.937 10.781 453 H ASP 32 HN ASP 32 18.198 -3.479 8.196 454 HA ASP 32 HA ASP 32 17.481 -2.623 5.694 455 HB2 ASP 32 2HB ASP 32 19.755 -2.452 5.879 456 HB3 ASP 32 3HB ASP 32 19.852 -3.786 7.012 457 H MET 33 HN MET 33 16.240 -3.715 4.164 458 HA MET 33 HA MET 33 15.373 -6.260 4.403 459 HB2 MET 33 2HB MET 33 14.905 -4.209 2.685 460 HB3 MET 33 3HB MET 33 15.931 -5.163 1.633 461 HG2 MET 33 2HG MET 33 14.227 -6.598 1.190 462 HG3 MET 33 3HG MET 33 14.015 -6.937 2.896 463 HE1 MET 33 3HE MET 33 13.425 -4.435 0.075 464 HE2 MET 33 1HE MET 33 12.151 -5.662 -0.133 465 HE3 MET 33 2HE MET 33 11.716 -3.989 0.290 466 H VAL 34 HN VAL 34 15.868 -8.286 3.272 467 HA VAL 34 HA VAL 34 18.748 -8.541 2.837 468 HB VAL 34 HB VAL 34 18.550 -10.746 3.486 469 HG11 VAL 34 1HG1 VAL 34 17.569 -10.705 5.609 470 HG12 VAL 34 2HG1 VAL 34 17.873 -8.986 5.263 471 HG13 VAL 34 3HG1 VAL 34 16.233 -9.655 5.081 472 HG21 VAL 34 3HG2 VAL 34 15.881 -11.490 3.737 473 HG22 VAL 34 1HG2 VAL 34 15.929 -10.584 2.205 474 HG23 VAL 34 2HG2 VAL 34 17.002 -11.984 2.445 475 H LYS 35 HN LYS 35 19.447 -10.035 1.041 476 HA LYS 35 HA LYS 35 17.814 -9.442 -1.303 477 HB2 LYS 35 2HB LYS 35 20.541 -9.199 -0.786 478 HB3 LYS 35 3HB LYS 35 20.439 -10.642 -1.774 479 HG2 LYS 35 2HG LYS 35 20.068 -9.391 -3.626 480 HG3 LYS 35 3HG LYS 35 18.639 -8.684 -2.895 481 HD2 LYS 35 2HD LYS 35 19.973 -6.785 -3.266 482 HD3 LYS 35 3HD LYS 35 20.332 -7.151 -1.589 483 HE2 LYS 35 2HE LYS 35 22.512 -7.673 -2.046 484 HE3 LYS 35 3HE LYS 35 22.087 -8.626 -3.452 485 HZ1 LYS 35 2HZ LYS 35 21.850 -6.560 -4.720 486 HZ3 LYS 35 1HZ LYS 35 23.340 -6.626 -4.065 487 H GLN 36 HN GLN 36 17.317 -11.102 -2.873 488 HA GLN 36 HA GLN 36 17.276 -13.732 -1.611 489 HB2 GLN 36 2HB GLN 36 15.367 -12.698 -3.749 490 HB3 GLN 36 3HB GLN 36 15.217 -14.188 -2.839 491 HG2 GLN 36 2HG GLN 36 15.287 -11.463 -1.474 492 HG3 GLN 36 3HG GLN 36 13.792 -12.179 -2.042 493 HE21 GLN 36 1HE2 GLN 36 16.376 -12.311 0.258 494 HE22 GLN 36 2HE2 GLN 36 15.710 -13.493 1.334 Start of MODEL 10 1 H1 ALA 1 HN ALA 1 1.831 -0.298 1.763 2 HA ALA 1 HA ALA 1 1.746 0.316 -0.365 3 HB1 ALA 1 1HB ALA 1 4.134 0.072 -0.247 4 HB2 ALA 1 2HB ALA 1 4.025 -1.694 -0.448 5 HB3 ALA 1 3HB ALA 1 3.620 -0.616 -1.806 6 H ASN 2 HN ASN 2 1.478 -0.513 -2.762 7 HA ASN 2 HA ASN 2 -0.182 -2.904 -2.582 8 HB2 ASN 2 2HB ASN 2 -0.789 -0.257 -3.521 9 HB3 ASN 2 3HB ASN 2 -0.737 -1.279 -4.943 10 HD21 ASN 2 1HD2 ASN 2 -2.965 -1.001 -5.204 11 HD22 ASN 2 2HD2 ASN 2 -4.129 -1.866 -4.257 12 H GLU 3 HN GLU 3 0.235 -4.548 -4.142 13 HA GLU 3 HA GLU 3 2.691 -4.674 -5.298 14 HB2 GLU 3 2HB GLU 3 0.081 -6.089 -5.942 15 HB3 GLU 3 3HB GLU 3 1.564 -6.486 -6.785 16 HG2 GLU 3 2HG GLU 3 2.662 -6.863 -4.506 17 HG3 GLU 3 3HG GLU 3 1.083 -6.657 -3.775 18 H GLY 4 HN GLY 4 3.186 -4.897 -7.737 19 HA2 GLY 4 1HA GLY 4 3.311 -3.975 -9.782 20 HA3 GLY 4 2HA GLY 4 1.589 -3.659 -9.680 21 H ASP 5 HN ASP 5 4.069 -2.396 -7.399 22 HA ASP 5 HA ASP 5 3.468 0.249 -8.473 23 HB2 ASP 5 2HB ASP 5 3.634 -0.817 -5.675 24 HB3 ASP 5 3HB ASP 5 4.331 0.771 -5.927 25 H VAL 6 HN VAL 6 5.360 1.870 -7.765 26 HA VAL 6 HA VAL 6 7.923 0.451 -7.757 27 HB VAL 6 HB VAL 6 6.831 2.357 -9.758 28 HG11 VAL 6 1HG1 VAL 6 8.544 3.772 -8.873 29 HG12 VAL 6 2HG1 VAL 6 9.703 2.424 -8.788 30 HG13 VAL 6 3HG1 VAL 6 9.182 3.051 -10.370 31 HG21 VAL 6 3HG2 VAL 6 7.345 0.678 -11.133 32 HG22 VAL 6 1HG2 VAL 6 9.049 0.726 -10.619 33 HG23 VAL 6 2HG2 VAL 6 7.877 -0.270 -9.723 34 H TYR 7 HN TYR 7 9.626 1.560 -6.670 35 HA TYR 7 HA TYR 7 8.748 3.971 -5.231 36 HB2 TYR 7 2HB TYR 7 9.952 1.304 -4.393 37 HB3 TYR 7 3HB TYR 7 10.481 2.721 -3.507 38 HD1 TYR 7 HD1 TYR 7 8.845 4.049 -2.172 39 HD2 TYR 7 HD2 TYR 7 7.746 0.382 -4.082 40 HE1 TYR 7 HE1 TYR 7 6.773 3.898 -0.706 41 HE2 TYR 7 HE2 TYR 7 5.677 0.244 -2.610 42 HH TYR 7 HH TYR 7 5.293 1.665 0.093 43 H LYS 8 HN LYS 8 10.115 5.674 -5.453 44 HA LYS 8 HA LYS 8 12.838 5.044 -6.359 45 HB2 LYS 8 2HB LYS 8 11.801 6.078 -8.188 46 HB3 LYS 8 3HB LYS 8 10.912 7.207 -7.185 47 HG2 LYS 8 2HG LYS 8 12.571 8.712 -7.549 48 HG3 LYS 8 3HG LYS 8 13.607 7.721 -6.539 49 HD2 LYS 8 2HD LYS 8 14.705 6.763 -8.349 50 HD3 LYS 8 3HD LYS 8 13.289 6.815 -9.380 51 HE2 LYS 8 2HE LYS 8 14.486 8.521 -10.386 52 HE3 LYS 8 3HE LYS 8 13.677 9.479 -9.161 53 HZ1 LYS 8 2HZ LYS 8 15.700 9.988 -8.368 54 HZ3 LYS 8 1HZ LYS 8 16.445 8.999 -9.427 55 H CYS 9 HN CYS 9 14.531 5.840 -5.174 56 HA CYS 9 HA CYS 9 13.883 6.931 -2.629 57 HB2 CYS 9 2HB CYS 9 15.704 5.365 -2.771 58 HB3 CYS 9 3HB CYS 9 16.522 6.322 -3.990 59 H GLU 10 HN GLU 10 14.511 9.063 -1.846 60 HA GLU 10 HA GLU 10 14.648 10.973 -4.026 61 HB2 GLU 10 2HB GLU 10 13.660 11.094 -1.172 62 HB3 GLU 10 3HB GLU 10 14.124 12.579 -1.977 63 HG2 GLU 10 2HG GLU 10 12.406 10.812 -3.637 64 HG3 GLU 10 3HG GLU 10 11.630 11.367 -2.167 65 H LEU 11 HN LEU 11 17.000 9.408 -3.183 66 HA LEU 11 HA LEU 11 18.679 11.670 -2.404 67 HB2 LEU 11 2HB LEU 11 18.130 9.338 -0.813 68 HB3 LEU 11 3HB LEU 11 19.819 9.349 -1.276 69 HG LEU 11 HG LEU 11 19.015 11.984 -0.382 70 HD11 LEU 11 1HD1 LEU 11 17.848 9.767 1.083 71 HD12 LEU 11 2HD1 LEU 11 18.965 10.711 2.100 72 HD13 LEU 11 3HD1 LEU 11 17.611 11.521 1.277 73 HD21 LEU 11 3HD2 LEU 11 21.093 9.937 0.350 74 HD22 LEU 11 1HD2 LEU 11 21.292 11.545 -0.385 75 HD23 LEU 11 2HD2 LEU 11 20.868 11.401 1.337 76 H CYS 12 HN CYS 12 19.072 8.139 -3.172 77 HA CYS 12 HA CYS 12 21.199 8.842 -4.975 78 HB2 CYS 12 2HB CYS 12 21.356 6.356 -5.277 79 HB3 CYS 12 3HB CYS 12 21.647 6.955 -3.656 80 H GLY 13 HN GLY 13 17.917 7.293 -5.043 81 HA2 GLY 13 1HA GLY 13 16.423 7.992 -6.813 82 HA3 GLY 13 2HA GLY 13 17.778 7.955 -7.923 83 H GLN 14 HN GLN 14 17.527 5.470 -5.409 84 HA GLN 14 HA GLN 14 17.625 3.436 -7.298 85 HB2 GLN 14 2HB GLN 14 18.500 3.122 -5.047 86 HB3 GLN 14 3HB GLN 14 16.929 3.420 -4.331 87 HG2 GLN 14 2HG GLN 14 16.118 1.385 -5.783 88 HG3 GLN 14 3HG GLN 14 17.822 1.016 -5.961 89 HE21 GLN 14 1HE2 GLN 14 18.559 2.117 -3.370 90 HE22 GLN 14 2HE2 GLN 14 18.046 0.990 -2.158 91 H VAL 15 HN VAL 15 16.040 2.446 -8.484 92 HA VAL 15 HA VAL 15 13.273 2.979 -7.654 93 HB VAL 15 HB VAL 15 14.542 2.607 -10.368 94 HG11 VAL 15 1HG1 VAL 15 11.688 2.328 -9.503 95 HG12 VAL 15 2HG1 VAL 15 12.031 3.126 -11.057 96 HG13 VAL 15 3HG1 VAL 15 12.591 1.462 -10.768 97 HG21 VAL 15 3HG2 VAL 15 12.794 4.893 -9.452 98 HG22 VAL 15 1HG2 VAL 15 14.542 4.871 -9.123 99 HG23 VAL 15 2HG2 VAL 15 13.953 4.835 -10.802 100 H VAL 16 HN VAL 16 12.199 1.256 -6.852 101 HA VAL 16 HA VAL 16 12.957 -1.379 -7.893 102 HB VAL 16 HB VAL 16 13.051 -2.323 -5.774 103 HG11 VAL 16 1HG1 VAL 16 14.862 -1.275 -4.761 104 HG12 VAL 16 2HG1 VAL 16 14.911 -0.603 -6.408 105 HG13 VAL 16 3HG1 VAL 16 14.230 0.359 -5.074 106 HG21 VAL 16 3HG2 VAL 16 11.193 -1.630 -4.588 107 HG22 VAL 16 1HG2 VAL 16 12.492 -0.792 -3.706 108 HG23 VAL 16 2HG2 VAL 16 11.505 0.096 -4.892 109 H LYS 17 HN LYS 17 11.238 -2.689 -8.430 110 HA LYS 17 HA LYS 17 8.612 -1.461 -8.082 111 HB2 LYS 17 2HB LYS 17 9.142 -1.911 -10.363 112 HB3 LYS 17 3HB LYS 17 9.697 -3.533 -10.000 113 HG2 LYS 17 2HG LYS 17 6.872 -2.840 -9.221 114 HG3 LYS 17 3HG LYS 17 7.206 -3.031 -10.930 115 HD2 LYS 17 2HD LYS 17 8.299 -5.282 -10.368 116 HD3 LYS 17 3HD LYS 17 7.700 -5.090 -8.733 117 HE2 LYS 17 2HE LYS 17 5.356 -4.704 -9.896 118 HE3 LYS 17 3HE LYS 17 6.109 -5.451 -11.292 119 HZ1 LYS 17 2HZ LYS 17 6.423 -7.448 -10.112 120 HZ3 LYS 17 1HZ LYS 17 4.946 -6.978 -9.614 121 H VAL 18 HN VAL 18 7.278 -2.173 -6.514 122 HA VAL 18 HA VAL 18 8.027 -4.398 -4.925 123 HB VAL 18 HB VAL 18 5.547 -2.676 -5.047 124 HG11 VAL 18 1HG1 VAL 18 5.784 -5.185 -3.824 125 HG12 VAL 18 2HG1 VAL 18 6.004 -4.009 -2.506 126 HG13 VAL 18 3HG1 VAL 18 4.539 -3.951 -3.515 127 HG21 VAL 18 3HG2 VAL 18 7.802 -2.663 -3.019 128 HG22 VAL 18 1HG2 VAL 18 7.730 -1.580 -4.430 129 HG23 VAL 18 2HG2 VAL 18 6.468 -1.494 -3.178 130 H LEU 19 HN LEU 19 7.591 -6.522 -5.223 131 HA LEU 19 HA LEU 19 5.725 -7.184 -7.367 132 HB2 LEU 19 2HB LEU 19 6.779 -9.414 -7.237 133 HB3 LEU 19 3HB LEU 19 7.875 -8.116 -7.665 134 HG LEU 19 HG LEU 19 7.806 -8.685 -4.780 135 HD11 LEU 19 1HD1 LEU 19 7.459 -10.954 -5.415 136 HD12 LEU 19 2HD1 LEU 19 8.662 -10.840 -6.722 137 HD13 LEU 19 3HD1 LEU 19 9.186 -10.770 -5.023 138 HD21 LEU 19 3HD2 LEU 19 10.091 -8.268 -4.890 139 HD22 LEU 19 1HD2 LEU 19 10.205 -8.766 -6.596 140 HD23 LEU 19 2HD2 LEU 19 9.424 -7.225 -6.170 141 H GLU 20 HN GLU 20 6.382 -7.679 -3.870 142 HA GLU 20 HA GLU 20 3.599 -8.331 -3.572 143 HB2 GLU 20 2HB GLU 20 4.276 -10.315 -2.043 144 HB3 GLU 20 3HB GLU 20 4.323 -10.568 -3.777 145 HG2 GLU 20 2HG GLU 20 6.783 -10.059 -3.773 146 HG3 GLU 20 3HG GLU 20 6.726 -9.840 -2.035 147 H GLU 21 HN GLU 21 3.183 -6.535 -2.295 148 HA GLU 21 HA GLU 21 4.900 -5.338 -0.588 149 HB2 GLU 21 2HB GLU 21 3.011 -4.188 0.301 150 HB3 GLU 21 3HB GLU 21 2.571 -4.583 -1.348 151 HG2 GLU 21 2HG GLU 21 1.766 -6.844 0.148 152 HG3 GLU 21 3HG GLU 21 1.345 -5.482 1.165 153 H GLY 22 HN GLY 22 4.676 -5.208 1.918 154 HA2 GLY 22 1HA GLY 22 4.254 -7.913 3.030 155 HA3 GLY 22 2HA GLY 22 5.703 -6.990 3.374 156 H GLY 23 HN GLY 23 5.296 -4.652 4.242 157 HA2 GLY 23 1HA GLY 23 3.067 -3.635 5.317 158 HA3 GLY 23 2HA GLY 23 3.450 -4.900 6.468 159 H GLY 24 HN GLY 24 5.451 -2.553 4.531 160 HA2 GLY 24 1HA GLY 24 6.268 -1.122 6.879 161 HA3 GLY 24 2HA GLY 24 7.508 -2.215 6.296 162 H THR 25 HN THR 25 8.654 -0.037 5.988 163 HA THR 25 HA THR 25 7.977 0.996 3.313 164 HB THR 25 HB THR 25 8.781 2.448 5.878 165 HG1 THR 25 HG1 THR 25 6.695 3.229 5.537 166 HG21 THR 25 3HG2 THR 25 8.590 4.510 4.291 167 HG22 THR 25 1HG2 THR 25 10.113 3.592 4.234 168 HG23 THR 25 2HG2 THR 25 8.885 3.357 2.967 169 H LEU 26 HN LEU 26 9.836 1.898 2.111 170 HA LEU 26 HA LEU 26 12.206 0.293 2.732 171 HB2 LEU 26 2HB LEU 26 11.590 1.600 0.097 172 HB3 LEU 26 3HB LEU 26 12.705 0.291 0.439 173 HG LEU 26 HG LEU 26 9.749 -0.078 0.877 174 HD11 LEU 26 1HD1 LEU 26 9.565 0.571 -1.315 175 HD12 LEU 26 2HD1 LEU 26 11.209 0.031 -1.734 176 HD13 LEU 26 3HD1 LEU 26 9.908 -1.164 -1.514 177 HD21 LEU 26 3HD2 LEU 26 10.855 -1.893 1.770 178 HD22 LEU 26 1HD2 LEU 26 10.523 -2.454 0.113 179 HD23 LEU 26 2HD2 LEU 26 12.143 -1.854 0.543 180 H VAL 27 HN VAL 27 12.839 1.858 4.416 181 HA VAL 27 HA VAL 27 13.338 4.553 3.688 182 HB VAL 27 HB VAL 27 14.185 2.807 6.003 183 HG11 VAL 27 1HG1 VAL 27 15.160 4.643 7.091 184 HG12 VAL 27 2HG1 VAL 27 15.773 4.761 5.424 185 HG13 VAL 27 3HG1 VAL 27 14.443 5.816 5.960 186 HG21 VAL 27 3HG2 VAL 27 12.577 4.528 7.156 187 HG22 VAL 27 1HG2 VAL 27 11.959 4.766 5.503 188 HG23 VAL 27 2HG2 VAL 27 11.908 3.150 6.248 189 H CYS 28 HN CYS 28 14.783 5.041 2.105 190 HA CYS 28 HA CYS 28 17.332 3.596 2.213 191 HB2 CYS 28 2HB CYS 28 15.896 3.184 0.185 192 HB3 CYS 28 3HB CYS 28 16.097 4.875 -0.232 193 H CYS 29 HN CYS 29 19.210 4.881 2.310 194 HA CYS 29 HA CYS 29 20.445 6.655 2.686 195 HB2 CYS 29 2HB CYS 29 18.470 7.900 0.778 196 HB3 CYS 29 3HB CYS 29 19.807 8.809 1.453 197 H GLY 30 HN GLY 30 18.192 5.933 4.490 198 HA2 GLY 30 1HA GLY 30 17.293 6.717 6.396 199 HA3 GLY 30 2HA GLY 30 18.278 8.157 6.227 200 H GLU 31 HN GLU 31 15.987 7.065 3.704 201 HA GLU 31 HA GLU 31 14.044 8.985 4.615 202 HB2 GLU 31 2HB GLU 31 15.816 10.074 3.005 203 HB3 GLU 31 3HB GLU 31 14.986 9.187 1.742 204 HG2 GLU 31 2HG GLU 31 12.823 10.276 3.000 205 HG3 GLU 31 3HG GLU 31 14.018 11.496 3.395 206 H ASP 32 HN ASP 32 12.032 8.096 4.385 207 HA ASP 32 HA ASP 32 11.692 5.581 3.388 208 HB2 ASP 32 2HB ASP 32 9.178 6.409 3.220 209 HB3 ASP 32 3HB ASP 32 9.956 6.269 4.784 210 H MET 33 HN MET 33 11.777 4.882 1.248 211 HA MET 33 HA MET 33 12.042 6.539 -0.885 212 HB2 MET 33 2HB MET 33 12.142 3.831 -0.444 213 HB3 MET 33 3HB MET 33 10.622 3.913 -1.314 214 HG2 MET 33 2HG MET 33 11.715 4.165 -3.290 215 HG3 MET 33 3HG MET 33 12.545 5.588 -2.691 216 HE1 MET 33 3HE MET 33 13.826 2.469 -4.465 217 HE2 MET 33 1HE MET 33 13.921 1.343 -3.090 218 HE3 MET 33 2HE MET 33 12.373 2.122 -3.498 219 H VAL 34 HN VAL 34 10.661 7.345 -2.544 220 HA VAL 34 HA VAL 34 7.897 7.615 -1.677 221 HB VAL 34 HB VAL 34 7.821 9.527 -2.945 222 HG11 VAL 34 1HG1 VAL 34 9.715 10.841 -2.381 223 HG12 VAL 34 2HG1 VAL 34 9.601 9.586 -1.124 224 HG13 VAL 34 3HG1 VAL 34 10.803 9.433 -2.428 225 HG21 VAL 34 3HG2 VAL 34 10.162 8.550 -4.615 226 HG22 VAL 34 1HG2 VAL 34 8.448 8.459 -5.086 227 HG23 VAL 34 2HG2 VAL 34 9.228 10.043 -4.868 228 H LYS 35 HN LYS 35 6.150 7.430 -3.370 229 HA LYS 35 HA LYS 35 6.675 5.025 -4.929 230 HB2 LYS 35 2HB LYS 35 4.268 6.293 -3.699 231 HB3 LYS 35 3HB LYS 35 4.028 5.358 -5.161 232 HG2 LYS 35 2HG LYS 35 5.809 3.831 -3.523 233 HG3 LYS 35 3HG LYS 35 4.545 4.413 -2.458 234 HD2 LYS 35 2HD LYS 35 2.990 3.633 -4.545 235 HD3 LYS 35 3HD LYS 35 4.344 2.553 -4.810 236 HE2 LYS 35 2HE LYS 35 4.065 1.466 -2.719 237 HE3 LYS 35 3HE LYS 35 3.185 2.811 -2.021 238 HZ1 LYS 35 2HZ LYS 35 1.529 2.166 -3.995 239 HZ3 LYS 35 1HZ LYS 35 1.432 1.456 -2.532 240 H GLN 36 HN GLN 36 5.989 4.877 -7.181 241 HA GLN 36 HA GLN 36 6.013 7.514 -8.430 242 HB2 GLN 36 2HB GLN 36 7.081 4.916 -9.616 243 HB3 GLN 36 3HB GLN 36 7.203 6.512 -10.329 244 HG2 GLN 36 2HG GLN 36 8.361 5.894 -7.581 245 HG3 GLN 36 3HG GLN 36 9.277 5.620 -9.049 246 HE21 GLN 36 1HE2 GLN 36 7.854 7.956 -6.914 247 HE22 GLN 36 2HE2 GLN 36 8.603 9.381 -7.552 248 H1 ALA 1 HN ALA 1 24.267 -2.468 -4.509 249 HA ALA 1 HA ALA 1 22.924 -5.036 -4.484 250 HB1 ALA 1 1HB ALA 1 21.616 -2.700 -3.564 251 HB2 ALA 1 2HB ALA 1 21.005 -2.988 -5.211 252 HB3 ALA 1 3HB ALA 1 20.875 -4.264 -3.978 253 H ASN 2 HN ASN 2 21.976 -5.528 -6.647 254 HA ASN 2 HA ASN 2 23.214 -3.857 -8.691 255 HB2 ASN 2 2HB ASN 2 23.309 -6.838 -8.262 256 HB3 ASN 2 3HB ASN 2 23.156 -6.297 -9.922 257 HD21 ASN 2 1HD2 ASN 2 25.289 -7.189 -7.648 258 HD22 ASN 2 2HD2 ASN 2 26.716 -6.342 -8.143 259 H GLU 3 HN GLU 3 21.943 -3.691 -10.688 260 HA GLU 3 HA GLU 3 19.250 -3.608 -10.366 261 HB2 GLU 3 2HB GLU 3 21.030 -3.778 -12.809 262 HB3 GLU 3 3HB GLU 3 19.288 -3.747 -13.002 263 HG2 GLU 3 2HG GLU 3 19.195 -1.630 -11.644 264 HG3 GLU 3 3HG GLU 3 20.943 -1.653 -11.513 265 H GLY 4 HN GLY 4 17.486 -4.907 -11.384 266 HA2 GLY 4 1HA GLY 4 16.406 -6.840 -11.773 267 HA3 GLY 4 2HA GLY 4 17.897 -7.475 -12.439 268 H ASP 5 HN ASP 5 17.463 -6.251 -9.082 269 HA ASP 5 HA ASP 5 18.102 -8.949 -8.201 270 HB2 ASP 5 2HB ASP 5 18.784 -6.203 -7.262 271 HB3 ASP 5 3HB ASP 5 18.384 -7.324 -5.976 272 H VAL 6 HN VAL 6 17.202 -9.111 -5.664 273 HA VAL 6 HA VAL 6 14.501 -8.002 -5.579 274 HB VAL 6 HB VAL 6 15.298 -10.892 -5.613 275 HG11 VAL 6 1HG1 VAL 6 14.183 -10.771 -3.505 276 HG12 VAL 6 2HG1 VAL 6 12.914 -9.709 -4.160 277 HG13 VAL 6 3HG1 VAL 6 13.004 -11.410 -4.675 278 HG21 VAL 6 3HG2 VAL 6 13.805 -9.109 -7.292 279 HG22 VAL 6 1HG2 VAL 6 14.214 -10.820 -7.558 280 HG23 VAL 6 2HG2 VAL 6 12.716 -10.386 -6.698 281 H TYR 7 HN TYR 7 13.850 -7.412 -3.518 282 HA TYR 7 HA TYR 7 15.707 -8.137 -1.354 283 HB2 TYR 7 2HB TYR 7 14.541 -5.543 -2.409 284 HB3 TYR 7 3HB TYR 7 14.649 -5.677 -0.664 285 HD1 TYR 7 HD1 TYR 7 16.937 -6.153 0.381 286 HD2 TYR 7 HD2 TYR 7 16.443 -4.997 -3.708 287 HE1 TYR 7 HE1 TYR 7 19.380 -5.453 0.276 288 HE2 TYR 7 HE2 TYR 7 18.887 -4.301 -3.800 289 HH TYR 7 HH TYR 7 20.749 -3.900 -1.033 290 H LYS 8 HN LYS 8 14.726 -9.194 0.293 291 HA LYS 8 HA LYS 8 11.835 -8.757 0.591 292 HB2 LYS 8 2HB LYS 8 11.934 -10.952 -0.109 293 HB3 LYS 8 3HB LYS 8 13.493 -11.248 0.634 294 HG2 LYS 8 2HG LYS 8 12.559 -11.875 2.625 295 HG3 LYS 8 3HG LYS 8 11.432 -10.532 2.624 296 HD2 LYS 8 2HD LYS 8 9.778 -11.726 1.488 297 HD3 LYS 8 3HD LYS 8 10.930 -12.731 0.632 298 HE2 LYS 8 2HE LYS 8 10.852 -13.044 3.618 299 HE3 LYS 8 3HE LYS 8 9.455 -13.630 2.739 300 HZ1 LYS 8 2HZ LYS 8 10.810 -15.454 2.571 301 HZ3 LYS 8 1HZ LYS 8 12.203 -14.613 2.643 302 H CYS 9 HN CYS 9 11.091 -8.108 2.574 303 HA CYS 9 HA CYS 9 13.055 -7.259 4.441 304 HB2 CYS 9 2HB CYS 9 11.043 -5.930 4.037 305 HB3 CYS 9 3HB CYS 9 10.023 -7.243 4.591 306 H GLU 10 HN GLU 10 13.150 -7.991 6.728 307 HA GLU 10 HA GLU 10 12.402 -10.801 6.901 308 HB2 GLU 10 2HB GLU 10 14.671 -9.189 8.096 309 HB3 GLU 10 3HB GLU 10 14.178 -10.695 8.844 310 HG2 GLU 10 2HG GLU 10 14.465 -10.911 5.904 311 HG3 GLU 10 3HG GLU 10 15.955 -10.444 6.702 312 H LEU 11 HN LEU 11 10.494 -8.642 7.370 313 HA LEU 11 HA LEU 11 9.885 -9.274 10.148 314 HB2 LEU 11 2HB LEU 11 10.666 -6.651 9.133 315 HB3 LEU 11 3HB LEU 11 9.092 -6.632 9.905 316 HG LEU 11 HG LEU 11 10.945 -8.116 11.545 317 HD11 LEU 11 1HD1 LEU 11 11.848 -5.274 11.306 318 HD12 LEU 11 2HD1 LEU 11 12.714 -6.707 11.912 319 HD13 LEU 11 3HD1 LEU 11 12.479 -6.483 10.162 320 HD21 LEU 11 3HD2 LEU 11 8.769 -6.930 12.142 321 HD22 LEU 11 1HD2 LEU 11 10.134 -6.737 13.268 322 HD23 LEU 11 2HD2 LEU 11 9.717 -5.424 12.141 323 H CYS 12 HN CYS 12 8.581 -7.117 7.529 324 HA CYS 12 HA CYS 12 5.966 -8.149 8.013 325 HB2 CYS 12 2HB CYS 12 5.317 -6.643 6.145 326 HB3 CYS 12 3HB CYS 12 6.120 -5.848 7.485 327 H GLY 13 HN GLY 13 8.420 -8.223 5.333 328 HA2 GLY 13 1HA GLY 13 8.843 -10.322 4.245 329 HA3 GLY 13 2HA GLY 13 7.136 -10.703 4.364 330 H GLN 14 HN GLN 14 8.406 -7.455 3.520 331 HA GLN 14 HA GLN 14 6.867 -7.550 1.123 332 HB2 GLN 14 2HB GLN 14 6.870 -5.494 2.422 333 HB3 GLN 14 3HB GLN 14 8.620 -5.404 2.387 334 HG2 GLN 14 2HG GLN 14 8.685 -4.639 0.196 335 HG3 GLN 14 3HG GLN 14 7.263 -5.544 -0.282 336 HE21 GLN 14 1HE2 GLN 14 8.017 -3.110 2.214 337 HE22 GLN 14 2HE2 GLN 14 6.725 -2.016 1.849 338 H VAL 15 HN VAL 15 7.599 -8.058 -0.905 339 HA VAL 15 HA VAL 15 10.517 -8.220 -1.223 340 HB VAL 15 HB VAL 15 8.536 -9.756 -2.872 341 HG11 VAL 15 1HG1 VAL 15 11.250 -10.690 -1.964 342 HG12 VAL 15 2HG1 VAL 15 10.333 -11.121 -3.427 343 HG13 VAL 15 3HG1 VAL 15 11.104 -9.523 -3.299 344 HG21 VAL 15 3HG2 VAL 15 8.640 -11.627 -1.309 345 HG22 VAL 15 1HG2 VAL 15 9.637 -10.667 -0.191 346 HG23 VAL 15 2HG2 VAL 15 7.951 -10.194 -0.510 347 H VAL 16 HN VAL 16 11.418 -6.839 -2.664 348 HA VAL 16 HA VAL 16 9.683 -5.816 -4.790 349 HB VAL 16 HB VAL 16 10.275 -3.600 -4.399 350 HG11 VAL 16 1HG1 VAL 16 9.952 -4.826 -1.638 351 HG12 VAL 16 2HG1 VAL 16 9.613 -3.138 -2.089 352 HG13 VAL 16 3HG1 VAL 16 8.631 -4.457 -2.772 353 HG21 VAL 16 3HG2 VAL 16 12.495 -3.332 -4.016 354 HG22 VAL 16 1HG2 VAL 16 11.966 -3.240 -2.319 355 HG23 VAL 16 2HG2 VAL 16 12.601 -4.769 -2.970 356 H LYS 17 HN LYS 17 10.668 -5.697 -6.791 357 HA LYS 17 HA LYS 17 13.353 -6.812 -6.888 358 HB2 LYS 17 2HB LYS 17 11.801 -7.949 -8.276 359 HB3 LYS 17 3HB LYS 17 11.146 -6.458 -8.921 360 HG2 LYS 17 2HG LYS 17 14.085 -6.797 -9.311 361 HG3 LYS 17 3HG LYS 17 13.094 -7.968 -10.159 362 HD2 LYS 17 2HD LYS 17 11.728 -5.602 -10.670 363 HD3 LYS 17 3HD LYS 17 13.391 -5.049 -10.631 364 HE2 LYS 17 2HE LYS 17 12.805 -7.567 -12.180 365 HE3 LYS 17 3HE LYS 17 12.265 -6.052 -12.874 366 HZ1 LYS 17 2HZ LYS 17 14.473 -5.248 -12.941 367 HZ3 LYS 17 1HZ LYS 17 14.623 -6.793 -13.430 368 H VAL 18 HN VAL 18 15.116 -5.549 -7.104 369 HA VAL 18 HA VAL 18 14.799 -2.743 -7.416 370 HB VAL 18 HB VAL 18 17.142 -4.628 -7.232 371 HG11 VAL 18 1HG1 VAL 18 17.162 -2.012 -8.390 372 HG12 VAL 18 2HG1 VAL 18 17.992 -1.936 -6.818 373 HG13 VAL 18 3HG1 VAL 18 18.534 -3.096 -8.056 374 HG21 VAL 18 3HG2 VAL 18 16.401 -2.408 -5.325 375 HG22 VAL 18 1HG2 VAL 18 15.621 -4.006 -5.236 376 HG23 VAL 18 2HG2 VAL 18 17.384 -3.864 -5.031 377 H LEU 19 HN LEU 19 14.586 -1.619 -9.277 378 HA LEU 19 HA LEU 19 15.191 -3.029 -11.753 379 HB2 LEU 19 2HB LEU 19 13.706 -0.441 -11.284 380 HB3 LEU 19 3HB LEU 19 13.871 -1.279 -12.814 381 HG LEU 19 HG LEU 19 12.660 -2.789 -10.538 382 HD11 LEU 19 1HD1 LEU 19 10.492 -1.552 -11.813 383 HD12 LEU 19 2HD1 LEU 19 11.053 -1.312 -10.141 384 HD13 LEU 19 3HD1 LEU 19 11.636 -0.240 -11.436 385 HD21 LEU 19 3HD2 LEU 19 12.480 -2.760 -13.532 386 HD22 LEU 19 1HD2 LEU 19 12.784 -4.114 -12.416 387 HD23 LEU 19 2HD2 LEU 19 11.145 -3.439 -12.571 388 H GLU 20 HN GLU 20 15.843 0.115 -10.070 389 HA GLU 20 HA GLU 20 18.280 0.226 -11.667 390 HB2 GLU 20 2HB GLU 20 16.640 1.910 -12.469 391 HB3 GLU 20 3HB GLU 20 16.512 2.574 -10.852 392 HG2 GLU 20 2HG GLU 20 18.496 3.709 -11.020 393 HG3 GLU 20 3HG GLU 20 19.311 2.370 -11.804 394 H GLU 21 HN GLU 21 20.048 0.024 -10.370 395 HA GLU 21 HA GLU 21 19.755 0.277 -7.575 396 HB2 GLU 21 2HB GLU 21 22.121 -0.369 -7.490 397 HB3 GLU 21 3HB GLU 21 21.266 -1.385 -8.633 398 HG2 GLU 21 2HG GLU 21 22.130 -0.117 -10.530 399 HG3 GLU 21 3HG GLU 21 22.784 1.122 -9.479 400 H GLY 22 HN GLY 22 21.475 1.617 -6.274 401 HA2 GLY 22 1HA GLY 22 22.588 3.946 -7.404 402 HA3 GLY 22 2HA GLY 22 21.017 4.334 -6.733 403 H GLY 23 HN GLY 23 23.698 2.089 -5.719 404 HA2 GLY 23 1HA GLY 23 24.362 1.645 -3.563 405 HA3 GLY 23 2HA GLY 23 24.961 3.280 -3.767 406 H GLY 24 HN GLY 24 22.061 1.397 -2.701 407 HA2 GLY 24 1HA GLY 24 21.728 3.220 -0.463 408 HA3 GLY 24 2HA GLY 24 20.424 3.216 -1.634 409 H THR 25 HN THR 25 20.143 2.373 1.111 410 HA THR 25 HA THR 25 19.783 -0.531 0.776 411 HB THR 25 HB THR 25 21.310 0.674 2.646 412 HG1 THR 25 HG1 THR 25 21.025 -1.579 2.681 413 HG21 THR 25 3HG2 THR 25 18.470 0.637 3.795 414 HG22 THR 25 1HG2 THR 25 19.949 0.729 4.783 415 HG23 THR 25 2HG2 THR 25 19.538 2.056 3.669 416 H LEU 26 HN LEU 26 17.861 -1.465 1.907 417 HA LEU 26 HA LEU 26 15.624 0.428 1.682 418 HB2 LEU 26 2HB LEU 26 15.603 -2.534 1.099 419 HB3 LEU 26 3HB LEU 26 14.256 -1.426 0.935 420 HG LEU 26 HG LEU 26 16.817 -1.175 -0.659 421 HD11 LEU 26 1HD1 LEU 26 14.869 -2.016 -2.422 422 HD12 LEU 26 2HD1 LEU 26 16.179 -3.015 -1.747 423 HD13 LEU 26 3HD1 LEU 26 14.571 -3.021 -0.982 424 HD21 LEU 26 3HD2 LEU 26 15.942 0.636 -1.632 425 HD22 LEU 26 1HD2 LEU 26 14.321 -0.092 -1.755 426 HD23 LEU 26 2HD2 LEU 26 14.838 0.681 -0.236 427 H VAL 27 HN VAL 27 16.369 0.851 4.015 428 HA VAL 27 HA VAL 27 16.063 -1.168 5.939 429 HB VAL 27 HB VAL 27 15.911 1.847 6.121 430 HG11 VAL 27 1HG1 VAL 27 14.826 0.722 8.052 431 HG12 VAL 27 2HG1 VAL 27 16.341 -0.162 8.358 432 HG13 VAL 27 3HG1 VAL 27 16.300 1.612 8.505 433 HG21 VAL 27 3HG2 VAL 27 18.287 0.774 7.265 434 HG22 VAL 27 1HG2 VAL 27 18.089 0.042 5.655 435 HG23 VAL 27 2HG2 VAL 27 18.120 1.813 5.830 436 H CYS 28 HN CYS 28 14.200 -2.319 6.140 437 HA CYS 28 HA CYS 28 11.736 -0.733 6.248 438 HB2 CYS 28 2HB CYS 28 12.007 -2.232 4.220 439 HB3 CYS 28 3HB CYS 28 11.918 -3.599 5.312 440 H CYS 29 HN CYS 29 10.469 -1.067 8.095 441 HA CYS 29 HA CYS 29 9.916 -1.743 10.107 442 HB2 CYS 29 2HB CYS 29 11.023 -4.370 9.114 443 HB3 CYS 29 3HB CYS 29 10.301 -4.189 10.701 444 H GLY 30 HN GLY 30 12.596 -0.532 9.474 445 HA2 GLY 30 1HA GLY 30 14.395 0.117 10.667 446 HA3 GLY 30 2HA GLY 30 13.762 -0.754 12.050 447 H GLU 31 HN GLU 31 14.268 -2.388 8.925 448 HA GLU 31 HA GLU 31 16.789 -3.432 9.864 449 HB2 GLU 31 2HB GLU 31 14.682 -4.890 10.575 450 HB3 GLU 31 3HB GLU 31 14.731 -5.425 8.906 451 HG2 GLU 31 2HG GLU 31 16.980 -6.286 9.143 452 HG3 GLU 31 3HG GLU 31 17.210 -5.470 10.677 453 H ASP 32 HN ASP 32 18.206 -3.322 8.179 454 HA ASP 32 HA ASP 32 17.492 -2.487 5.700 455 HB2 ASP 32 2HB ASP 32 19.748 -3.226 4.987 456 HB3 ASP 32 3HB ASP 32 19.806 -2.451 6.558 457 H MET 33 HN MET 33 16.226 -3.552 4.170 458 HA MET 33 HA MET 33 15.394 -6.108 4.335 459 HB2 MET 33 2HB MET 33 14.914 -4.010 2.669 460 HB3 MET 33 3HB MET 33 15.924 -4.950 1.588 461 HG2 MET 33 2HG MET 33 14.201 -6.359 1.134 462 HG3 MET 33 3HG MET 33 14.020 -6.743 2.834 463 HE1 MET 33 3HE MET 33 12.738 -5.492 -0.143 464 HE2 MET 33 1HE MET 33 11.265 -4.561 0.220 465 HE3 MET 33 2HE MET 33 12.844 -3.741 0.156 466 H VAL 34 HN VAL 34 15.935 -8.121 3.267 467 HA VAL 34 HA VAL 34 18.801 -8.318 2.746 468 HB VAL 34 HB VAL 34 18.665 -10.516 3.411 469 HG11 VAL 34 1HG1 VAL 34 17.547 -10.558 5.517 470 HG12 VAL 34 2HG1 VAL 34 18.037 -8.871 5.234 471 HG13 VAL 34 3HG1 VAL 34 16.344 -9.360 4.982 472 HG21 VAL 34 3HG2 VAL 34 17.072 -11.480 1.992 473 HG22 VAL 34 1HG2 VAL 34 16.370 -11.699 3.614 474 HG23 VAL 34 2HG2 VAL 34 15.772 -10.400 2.553 475 H LYS 35 HN LYS 35 19.487 -9.808 0.935 476 HA LYS 35 HA LYS 35 17.816 -9.215 -1.380 477 HB2 LYS 35 2HB LYS 35 20.322 -8.609 -1.161 478 HB3 LYS 35 3HB LYS 35 20.626 -10.312 -1.436 479 HG2 LYS 35 2HG LYS 35 18.714 -8.944 -3.315 480 HG3 LYS 35 3HG LYS 35 20.409 -8.529 -3.464 481 HD2 LYS 35 2HD LYS 35 21.043 -10.816 -3.900 482 HD3 LYS 35 3HD LYS 35 19.489 -11.430 -3.372 483 HE2 LYS 35 2HE LYS 35 19.109 -9.481 -5.515 484 HE3 LYS 35 3HE LYS 35 20.250 -10.710 -6.023 485 HZ1 LYS 35 2HZ LYS 35 18.387 -11.906 -6.428 486 HZ3 LYS 35 1HZ LYS 35 17.428 -10.986 -5.487 487 H GLN 36 HN GLN 36 17.267 -10.864 -2.934 488 HA GLN 36 HA GLN 36 17.273 -13.506 -1.697 489 HB2 GLN 36 2HB GLN 36 15.254 -12.443 -3.717 490 HB3 GLN 36 3HB GLN 36 15.155 -13.950 -2.828 491 HG2 GLN 36 2HG GLN 36 15.306 -11.264 -1.400 492 HG3 GLN 36 3HG GLN 36 13.776 -11.936 -1.933 493 HE21 GLN 36 1HE2 GLN 36 16.465 -12.215 0.242 494 HE22 GLN 36 2HE2 GLN 36 15.811 -13.411 1.311 Start of MODEL 11 1 H1 ALA 1 HN ALA 1 3.726 -2.277 0.098 2 HA ALA 1 HA ALA 1 1.829 -0.699 -0.328 3 HB1 ALA 1 1HB ALA 1 3.479 0.611 -2.065 4 HB2 ALA 1 2HB ALA 1 3.735 0.546 -0.305 5 HB3 ALA 1 3HB ALA 1 4.607 -0.580 -1.373 6 H ASN 2 HN ASN 2 0.405 -2.491 -1.486 7 HA ASN 2 HA ASN 2 -0.860 -3.029 -3.162 8 HB2 ASN 2 2HB ASN 2 -0.173 -0.176 -3.721 9 HB3 ASN 2 3HB ASN 2 -0.751 -1.056 -5.121 10 HD21 ASN 2 1HD2 ASN 2 -1.744 0.964 -2.896 11 HD22 ASN 2 2HD2 ASN 2 -3.370 0.450 -2.594 12 H GLU 3 HN GLU 3 0.199 -4.814 -4.140 13 HA GLU 3 HA GLU 3 2.571 -4.859 -5.363 14 HB2 GLU 3 2HB GLU 3 0.078 -6.410 -6.191 15 HB3 GLU 3 3HB GLU 3 1.716 -6.850 -6.632 16 HG2 GLU 3 2HG GLU 3 2.283 -6.957 -4.151 17 HG3 GLU 3 3HG GLU 3 0.588 -6.690 -3.799 18 H GLY 4 HN GLY 4 3.269 -4.907 -7.662 19 HA2 GLY 4 1HA GLY 4 3.259 -4.199 -9.812 20 HA3 GLY 4 2HA GLY 4 1.548 -3.844 -9.689 21 H ASP 5 HN ASP 5 3.921 -2.548 -7.357 22 HA ASP 5 HA ASP 5 3.472 0.063 -8.578 23 HB2 ASP 5 2HB ASP 5 3.445 -0.900 -5.742 24 HB3 ASP 5 3HB ASP 5 4.222 0.648 -6.002 25 H VAL 6 HN VAL 6 5.359 1.639 -8.143 26 HA VAL 6 HA VAL 6 7.885 0.174 -7.826 27 HB VAL 6 HB VAL 6 6.935 2.010 -9.968 28 HG11 VAL 6 1HG1 VAL 6 9.351 2.528 -10.534 29 HG12 VAL 6 2HG1 VAL 6 8.690 3.383 -9.119 30 HG13 VAL 6 3HG1 VAL 6 9.768 1.986 -8.890 31 HG21 VAL 6 3HG2 VAL 6 7.481 0.290 -11.290 32 HG22 VAL 6 1HG2 VAL 6 9.108 0.162 -10.577 33 HG23 VAL 6 2HG2 VAL 6 7.729 -0.659 -9.804 34 H TYR 7 HN TYR 7 9.567 1.302 -6.730 35 HA TYR 7 HA TYR 7 8.676 3.795 -5.446 36 HB2 TYR 7 2HB TYR 7 9.816 1.160 -4.469 37 HB3 TYR 7 3HB TYR 7 10.421 2.596 -3.666 38 HD1 TYR 7 HD2 TYR 7 7.398 0.568 -4.329 39 HD2 TYR 7 HD1 TYR 7 9.045 3.852 -2.134 40 HE1 TYR 7 HE2 TYR 7 5.349 0.600 -2.824 41 HE2 TYR 7 HE1 TYR 7 6.990 3.871 -0.636 42 HH TYR 7 HH TYR 7 5.236 1.909 0.036 43 H LYS 8 HN LYS 8 10.053 5.491 -5.693 44 HA LYS 8 HA LYS 8 12.796 4.827 -6.514 45 HB2 LYS 8 2HB LYS 8 11.968 5.758 -8.445 46 HB3 LYS 8 3HB LYS 8 10.819 6.782 -7.607 47 HG2 LYS 8 2HG LYS 8 12.517 8.264 -8.425 48 HG3 LYS 8 3HG LYS 8 12.815 8.118 -6.704 49 HD2 LYS 8 2HD LYS 8 14.800 6.984 -6.999 50 HD3 LYS 8 3HD LYS 8 14.201 6.073 -8.371 51 HE2 LYS 8 2HE LYS 8 15.954 7.607 -9.138 52 HE3 LYS 8 3HE LYS 8 14.418 8.114 -9.815 53 HZ1 LYS 8 2HZ LYS 8 14.572 10.056 -8.711 54 HZ3 LYS 8 1HZ LYS 8 16.103 9.676 -8.305 55 H CYS 9 HN CYS 9 14.472 5.813 -5.415 56 HA CYS 9 HA CYS 9 13.727 7.048 -2.944 57 HB2 CYS 9 2HB CYS 9 15.567 5.406 -3.053 58 HB3 CYS 9 3HB CYS 9 16.471 6.472 -4.110 59 H GLU 10 HN GLU 10 14.153 9.247 -2.354 60 HA GLU 10 HA GLU 10 14.542 10.955 -4.667 61 HB2 GLU 10 2HB GLU 10 13.257 11.353 -1.950 62 HB3 GLU 10 3HB GLU 10 13.733 12.739 -2.913 63 HG2 GLU 10 2HG GLU 10 12.184 10.607 -4.346 64 HG3 GLU 10 3HG GLU 10 11.301 11.520 -3.140 65 H LEU 11 HN LEU 11 16.770 9.501 -3.334 66 HA LEU 11 HA LEU 11 18.304 11.867 -2.527 67 HB2 LEU 11 2HB LEU 11 17.783 9.402 -1.024 68 HB3 LEU 11 3HB LEU 11 19.484 9.800 -1.157 69 HG LEU 11 HG LEU 11 18.028 12.180 -0.456 70 HD11 LEU 11 1HD1 LEU 11 17.194 11.483 1.766 71 HD12 LEU 11 2HD1 LEU 11 16.287 10.751 0.421 72 HD13 LEU 11 3HD1 LEU 11 17.481 9.785 1.318 73 HD21 LEU 11 3HD2 LEU 11 20.344 10.607 0.446 74 HD22 LEU 11 1HD2 LEU 11 20.129 12.368 0.299 75 HD23 LEU 11 2HD2 LEU 11 19.519 11.514 1.736 76 H CYS 12 HN CYS 12 18.763 8.334 -3.271 77 HA CYS 12 HA CYS 12 21.097 9.063 -4.812 78 HB2 CYS 12 2HB CYS 12 21.437 6.620 -4.993 79 HB3 CYS 12 3HB CYS 12 21.394 7.218 -3.346 80 H GLY 13 HN GLY 13 17.911 7.354 -5.175 81 HA2 GLY 13 1HA GLY 13 16.578 7.977 -7.107 82 HA3 GLY 13 2HA GLY 13 18.041 7.952 -8.070 83 H GLN 14 HN GLN 14 17.404 5.558 -5.492 84 HA GLN 14 HA GLN 14 17.739 3.475 -7.376 85 HB2 GLN 14 2HB GLN 14 18.637 3.177 -5.153 86 HB3 GLN 14 3HB GLN 14 17.092 3.527 -4.403 87 HG2 GLN 14 2HG GLN 14 16.335 1.389 -4.690 88 HG3 GLN 14 3HG GLN 14 16.913 1.307 -6.342 89 HE21 GLN 14 1HE2 GLN 14 18.392 1.737 -3.125 90 HE22 GLN 14 2HE2 GLN 14 19.590 0.493 -3.267 91 H VAL 15 HN VAL 15 16.188 2.351 -8.498 92 HA VAL 15 HA VAL 15 13.405 2.868 -7.711 93 HB VAL 15 HB VAL 15 14.504 2.146 -10.433 94 HG11 VAL 15 1HG1 VAL 15 12.309 2.698 -11.273 95 HG12 VAL 15 2HG1 VAL 15 12.134 1.502 -9.967 96 HG13 VAL 15 3HG1 VAL 15 11.772 3.217 -9.657 97 HG21 VAL 15 3HG2 VAL 15 13.419 4.867 -9.798 98 HG22 VAL 15 1HG2 VAL 15 15.090 4.477 -9.324 99 HG23 VAL 15 2HG2 VAL 15 14.599 4.366 -11.031 100 H VAL 16 HN VAL 16 12.145 1.149 -7.137 101 HA VAL 16 HA VAL 16 13.118 -1.513 -7.862 102 HB VAL 16 HB VAL 16 13.143 -2.304 -5.721 103 HG11 VAL 16 1HG1 VAL 16 14.922 -0.599 -6.009 104 HG12 VAL 16 2HG1 VAL 16 13.852 0.613 -5.263 105 HG13 VAL 16 3HG1 VAL 16 14.414 -0.783 -4.313 106 HG21 VAL 16 3HG2 VAL 16 10.845 -1.605 -5.155 107 HG22 VAL 16 1HG2 VAL 16 11.973 -1.335 -3.805 108 HG23 VAL 16 2HG2 VAL 16 11.437 0.037 -4.803 109 H LYS 17 HN LYS 17 11.417 -3.145 -7.903 110 HA LYS 17 HA LYS 17 8.783 -1.890 -8.230 111 HB2 LYS 17 2HB LYS 17 9.136 -2.718 -10.312 112 HB3 LYS 17 3HB LYS 17 10.291 -3.920 -9.772 113 HG2 LYS 17 2HG LYS 17 8.322 -5.115 -10.513 114 HG3 LYS 17 3HG LYS 17 8.368 -5.238 -8.766 115 HD2 LYS 17 2HD LYS 17 6.195 -4.521 -8.882 116 HD3 LYS 17 3HD LYS 17 6.911 -2.929 -9.035 117 HE2 LYS 17 2HE LYS 17 6.946 -3.315 -11.583 118 HE3 LYS 17 3HE LYS 17 5.977 -4.748 -11.300 119 HZ1 LYS 17 2HZ LYS 17 4.216 -3.370 -11.303 120 HZ3 LYS 17 1HZ LYS 17 5.138 -2.028 -11.292 121 H VAL 18 HN VAL 18 7.474 -2.206 -6.517 122 HA VAL 18 HA VAL 18 8.007 -4.126 -4.549 123 HB VAL 18 HB VAL 18 5.627 -2.407 -5.231 124 HG11 VAL 18 1HG1 VAL 18 4.310 -3.549 -3.843 125 HG12 VAL 18 2HG1 VAL 18 5.601 -4.751 -3.607 126 HG13 VAL 18 3HG1 VAL 18 5.491 -3.340 -2.527 127 HG21 VAL 18 3HG2 VAL 18 7.507 -2.256 -2.859 128 HG22 VAL 18 1HG2 VAL 18 7.784 -1.383 -4.385 129 HG23 VAL 18 2HG2 VAL 18 6.334 -1.038 -3.412 130 H LEU 19 HN LEU 19 7.949 -6.291 -4.882 131 HA LEU 19 HA LEU 19 6.232 -7.379 -6.902 132 HB2 LEU 19 2HB LEU 19 8.537 -8.193 -5.349 133 HB3 LEU 19 3HB LEU 19 7.315 -9.450 -5.364 134 HG LEU 19 HG LEU 19 7.570 -8.479 -8.035 135 HD11 LEU 19 1HD1 LEU 19 9.685 -7.808 -8.195 136 HD12 LEU 19 2HD1 LEU 19 10.073 -8.376 -6.553 137 HD13 LEU 19 3HD1 LEU 19 10.149 -9.506 -7.927 138 HD21 LEU 19 3HD2 LEU 19 8.438 -10.848 -8.383 139 HD22 LEU 19 1HD2 LEU 19 8.236 -11.066 -6.628 140 HD23 LEU 19 2HD2 LEU 19 6.827 -10.677 -7.645 141 H GLU 20 HN GLU 20 6.545 -7.802 -3.303 142 HA GLU 20 HA GLU 20 3.661 -8.081 -3.258 143 HB2 GLU 20 2HB GLU 20 3.651 -10.128 -2.099 144 HB3 GLU 20 3HB GLU 20 4.911 -10.370 -3.292 145 HG2 GLU 20 2HG GLU 20 6.544 -9.470 -1.443 146 HG3 GLU 20 3HG GLU 20 5.223 -9.767 -0.330 147 H GLU 21 HN GLU 21 2.927 -6.528 -1.881 148 HA GLU 21 HA GLU 21 4.514 -5.018 -0.291 149 HB2 GLU 21 2HB GLU 21 2.444 -4.232 0.772 150 HB3 GLU 21 3HB GLU 21 2.191 -4.442 -0.949 151 HG2 GLU 21 2HG GLU 21 1.321 -6.826 -0.359 152 HG3 GLU 21 3HG GLU 21 1.276 -6.275 1.303 153 H GLY 22 HN GLY 22 4.494 -4.819 2.173 154 HA2 GLY 22 1HA GLY 22 4.362 -7.483 3.447 155 HA3 GLY 22 2HA GLY 22 5.752 -6.434 3.639 156 H GLY 23 HN GLY 23 4.996 -3.976 4.207 157 HA2 GLY 23 1HA GLY 23 2.802 -3.190 5.469 158 HA3 GLY 23 2HA GLY 23 3.479 -4.261 6.680 159 H GLY 24 HN GLY 24 6.304 -3.565 5.520 160 HA2 GLY 24 1HA GLY 24 6.667 -1.208 7.215 161 HA3 GLY 24 2HA GLY 24 7.904 -2.304 6.635 162 H THR 25 HN THR 25 8.950 -0.096 6.146 163 HA THR 25 HA THR 25 8.136 0.716 3.435 164 HB THR 25 HB THR 25 8.977 2.408 5.840 165 HG1 THR 25 HG1 THR 25 6.774 2.540 3.916 166 HG21 THR 25 3HG2 THR 25 8.839 4.355 4.340 167 HG22 THR 25 1HG2 THR 25 10.072 3.240 3.702 168 HG23 THR 25 2HG2 THR 25 8.456 3.302 2.957 169 H LEU 26 HN LEU 26 9.970 1.803 2.218 170 HA LEU 26 HA LEU 26 12.394 0.257 2.788 171 HB2 LEU 26 2HB LEU 26 11.762 1.571 0.167 172 HB3 LEU 26 3HB LEU 26 12.845 0.235 0.504 173 HG LEU 26 HG LEU 26 9.866 -0.037 0.891 174 HD11 LEU 26 1HD1 LEU 26 10.095 -1.206 -1.466 175 HD12 LEU 26 2HD1 LEU 26 9.762 0.536 -1.320 176 HD13 LEU 26 3HD1 LEU 26 11.415 -0.028 -1.665 177 HD21 LEU 26 3HD2 LEU 26 10.748 -2.457 0.099 178 HD22 LEU 26 1HD2 LEU 26 12.218 -1.840 0.891 179 HD23 LEU 26 2HD2 LEU 26 10.691 -1.933 1.799 180 H VAL 27 HN VAL 27 12.972 1.842 4.484 181 HA VAL 27 HA VAL 27 13.401 4.549 3.740 182 HB VAL 27 HB VAL 27 14.407 2.915 6.078 183 HG11 VAL 27 1HG1 VAL 27 15.511 4.714 6.798 184 HG12 VAL 27 2HG1 VAL 27 15.165 5.503 5.240 185 HG13 VAL 27 3HG1 VAL 27 14.061 5.731 6.618 186 HG21 VAL 27 3HG2 VAL 27 12.253 2.891 6.693 187 HG22 VAL 27 1HG2 VAL 27 12.422 4.640 6.975 188 HG23 VAL 27 2HG2 VAL 27 11.793 4.047 5.420 189 H CYS 28 HN CYS 28 14.848 5.035 2.154 190 HA CYS 28 HA CYS 28 17.453 3.708 2.364 191 HB2 CYS 28 2HB CYS 28 16.213 3.005 0.364 192 HB3 CYS 28 3HB CYS 28 16.058 4.676 -0.140 193 H CYS 29 HN CYS 29 19.268 5.094 2.364 194 HA CYS 29 HA CYS 29 20.427 6.952 2.508 195 HB2 CYS 29 2HB CYS 29 18.192 8.000 0.788 196 HB3 CYS 29 3HB CYS 29 19.453 9.066 1.373 197 H GLY 30 HN GLY 30 17.980 6.130 4.303 198 HA2 GLY 30 1HA GLY 30 17.382 6.844 6.381 199 HA3 GLY 30 2HA GLY 30 18.230 8.355 6.121 200 H GLU 31 HN GLU 31 16.062 7.382 3.550 201 HA GLU 31 HA GLU 31 13.954 9.017 4.697 202 HB2 GLU 31 2HB GLU 31 15.604 10.183 2.941 203 HB3 GLU 31 3HB GLU 31 14.604 9.346 1.771 204 HG2 GLU 31 2HG GLU 31 12.735 10.635 2.226 205 HG3 GLU 31 3HG GLU 31 13.111 10.777 3.932 206 H ASP 32 HN ASP 32 11.941 8.102 4.445 207 HA ASP 32 HA ASP 32 11.716 5.545 3.498 208 HB2 ASP 32 2HB ASP 32 9.154 6.299 3.345 209 HB3 ASP 32 3HB ASP 32 9.954 6.109 4.893 210 H MET 33 HN MET 33 12.093 4.983 1.337 211 HA MET 33 HA MET 33 12.191 6.521 -0.799 212 HB2 MET 33 2HB MET 33 12.347 3.865 -0.404 213 HB3 MET 33 3HB MET 33 10.719 3.873 -1.051 214 HG2 MET 33 2HG MET 33 11.443 4.821 -3.152 215 HG3 MET 33 3HG MET 33 13.008 5.266 -2.503 216 HE1 MET 33 3HE MET 33 15.006 2.119 -2.246 217 HE2 MET 33 1HE MET 33 14.705 3.781 -1.686 218 HE3 MET 33 2HE MET 33 13.914 2.411 -0.871 219 H VAL 34 HN VAL 34 10.721 6.874 -2.711 220 HA VAL 34 HA VAL 34 8.002 7.399 -1.743 221 HB VAL 34 HB VAL 34 7.938 9.263 -3.081 222 HG11 VAL 34 1HG1 VAL 34 10.870 9.537 -2.865 223 HG12 VAL 34 2HG1 VAL 34 9.568 10.539 -2.182 224 HG13 VAL 34 3HG1 VAL 34 10.056 9.035 -1.364 225 HG21 VAL 34 3HG2 VAL 34 9.656 7.684 -4.866 226 HG22 VAL 34 1HG2 VAL 34 8.425 8.911 -5.246 227 HG23 VAL 34 2HG2 VAL 34 10.078 9.412 -4.816 228 H LYS 35 HN LYS 35 6.245 7.163 -3.417 229 HA LYS 35 HA LYS 35 6.829 4.786 -5.028 230 HB2 LYS 35 2HB LYS 35 4.638 4.084 -4.691 231 HB3 LYS 35 3HB LYS 35 5.076 4.771 -3.139 232 HG2 LYS 35 2HG LYS 35 2.981 5.761 -3.517 233 HG3 LYS 35 3HG LYS 35 4.066 7.007 -4.099 234 HD2 LYS 35 2HD LYS 35 2.899 6.926 -6.051 235 HD3 LYS 35 3HD LYS 35 3.729 5.415 -6.365 236 HE2 LYS 35 2HE LYS 35 1.603 4.723 -4.615 237 HE3 LYS 35 3HE LYS 35 0.904 5.876 -5.734 238 HZ1 LYS 35 2HZ LYS 35 2.567 3.680 -6.786 239 HZ3 LYS 35 1HZ LYS 35 1.375 4.496 -7.540 240 H GLN 36 HN GLN 36 6.173 4.686 -7.226 241 HA GLN 36 HA GLN 36 5.785 7.346 -8.343 242 HB2 GLN 36 2HB GLN 36 6.662 4.875 -9.878 243 HB3 GLN 36 3HB GLN 36 6.841 6.554 -10.349 244 HG2 GLN 36 2HG GLN 36 8.178 5.409 -7.859 245 HG3 GLN 36 3HG GLN 36 8.950 5.382 -9.431 246 HE21 GLN 36 1HE2 GLN 36 7.990 7.270 -6.719 247 HE22 GLN 36 2HE2 GLN 36 8.711 8.779 -7.169 248 H1 ALA 1 HN ALA 1 23.256 -4.149 -3.488 249 HA ALA 1 HA ALA 1 21.808 -5.146 -4.909 250 HB1 ALA 1 1HB ALA 1 20.591 -3.304 -3.851 251 HB2 ALA 1 2HB ALA 1 21.125 -2.186 -5.130 252 HB3 ALA 1 3HB ALA 1 20.018 -3.526 -5.522 253 H ASN 2 HN ASN 2 20.661 -4.935 -7.219 254 HA ASN 2 HA ASN 2 22.226 -3.652 -9.183 255 HB2 ASN 2 2HB ASN 2 23.068 -6.280 -8.392 256 HB3 ASN 2 3HB ASN 2 22.269 -6.475 -9.939 257 HD21 ASN 2 1HD2 ASN 2 24.155 -6.952 -11.009 258 HD22 ASN 2 2HD2 ASN 2 25.372 -5.779 -11.385 259 H GLU 3 HN GLU 3 20.971 -3.524 -11.132 260 HA GLU 3 HA GLU 3 18.327 -3.782 -11.034 261 HB2 GLU 3 2HB GLU 3 19.587 -2.661 -12.856 262 HB3 GLU 3 3HB GLU 3 20.078 -4.217 -13.495 263 HG2 GLU 3 2HG GLU 3 17.896 -4.761 -14.231 264 HG3 GLU 3 3HG GLU 3 17.128 -3.661 -13.103 265 H GLY 4 HN GLY 4 16.864 -5.426 -10.865 266 HA2 GLY 4 1HA GLY 4 15.969 -7.463 -11.653 267 HA3 GLY 4 2HA GLY 4 17.585 -8.046 -11.998 268 H ASP 5 HN ASP 5 18.481 -6.763 -9.283 269 HA ASP 5 HA ASP 5 18.502 -9.060 -7.833 270 HB2 ASP 5 2HB ASP 5 18.874 -6.141 -7.223 271 HB3 ASP 5 3HB ASP 5 18.679 -7.206 -5.845 272 H VAL 6 HN VAL 6 17.403 -9.442 -5.618 273 HA VAL 6 HA VAL 6 14.735 -8.230 -5.521 274 HB VAL 6 HB VAL 6 15.515 -11.124 -5.595 275 HG11 VAL 6 1HG1 VAL 6 13.132 -11.586 -4.757 276 HG12 VAL 6 2HG1 VAL 6 14.353 -11.130 -3.545 277 HG13 VAL 6 3HG1 VAL 6 13.168 -9.929 -4.110 278 HG21 VAL 6 3HG2 VAL 6 13.347 -11.167 -6.962 279 HG22 VAL 6 1HG2 VAL 6 13.425 -9.389 -6.927 280 HG23 VAL 6 2HG2 VAL 6 14.743 -10.324 -7.676 281 H TYR 7 HN TYR 7 14.058 -7.640 -3.477 282 HA TYR 7 HA TYR 7 15.837 -8.440 -1.273 283 HB2 TYR 7 2HB TYR 7 14.722 -5.808 -2.302 284 HB3 TYR 7 3HB TYR 7 14.822 -5.978 -0.561 285 HD1 TYR 7 HD1 TYR 7 17.076 -6.422 0.511 286 HD2 TYR 7 HD2 TYR 7 16.661 -5.350 -3.610 287 HE1 TYR 7 HE1 TYR 7 19.529 -5.757 0.429 288 HE2 TYR 7 HE2 TYR 7 19.114 -4.689 -3.678 289 HH TYR 7 HH TYR 7 20.810 -3.851 -1.594 290 H LYS 8 HN LYS 8 14.820 -9.381 0.432 291 HA LYS 8 HA LYS 8 11.930 -8.906 0.655 292 HB2 LYS 8 2HB LYS 8 11.977 -11.075 -0.169 293 HB3 LYS 8 3HB LYS 8 13.472 -11.480 0.649 294 HG2 LYS 8 2HG LYS 8 12.370 -12.199 2.505 295 HG3 LYS 8 3HG LYS 8 11.418 -10.730 2.595 296 HD2 LYS 8 2HD LYS 8 9.639 -11.637 1.420 297 HD3 LYS 8 3HD LYS 8 10.670 -12.608 0.389 298 HE2 LYS 8 2HE LYS 8 10.135 -13.217 3.335 299 HE3 LYS 8 3HE LYS 8 9.278 -13.970 2.004 300 HZ1 LYS 8 2HZ LYS 8 12.109 -14.294 2.747 301 HZ3 LYS 8 1HZ LYS 8 11.666 -14.565 1.204 302 H CYS 9 HN CYS 9 11.205 -8.295 2.653 303 HA CYS 9 HA CYS 9 13.179 -7.619 4.571 304 HB2 CYS 9 2HB CYS 9 11.201 -6.212 4.201 305 HB3 CYS 9 3HB CYS 9 10.149 -7.509 4.733 306 H GLU 10 HN GLU 10 13.283 -8.477 6.796 307 HA GLU 10 HA GLU 10 12.458 -11.264 6.837 308 HB2 GLU 10 2HB GLU 10 14.744 -9.728 8.052 309 HB3 GLU 10 3HB GLU 10 14.165 -11.141 8.912 310 HG2 GLU 10 2HG GLU 10 14.514 -11.548 5.981 311 HG3 GLU 10 3HG GLU 10 15.999 -11.199 6.841 312 H LEU 11 HN LEU 11 10.574 -9.073 7.353 313 HA LEU 11 HA LEU 11 9.818 -9.874 10.046 314 HB2 LEU 11 2HB LEU 11 11.062 -7.837 10.396 315 HB3 LEU 11 3HB LEU 11 10.143 -7.008 9.156 316 HG LEU 11 HG LEU 11 8.198 -6.906 10.480 317 HD11 LEU 11 1HD1 LEU 11 9.436 -8.755 12.532 318 HD12 LEU 11 2HD1 LEU 11 7.767 -8.137 12.476 319 HD13 LEU 11 3HD1 LEU 11 8.329 -9.294 11.246 320 HD21 LEU 11 3HD2 LEU 11 9.460 -6.311 12.872 321 HD22 LEU 11 1HD2 LEU 11 10.741 -6.090 11.656 322 HD23 LEU 11 2HD2 LEU 11 9.205 -5.202 11.503 323 H CYS 12 HN CYS 12 8.649 -7.333 7.747 324 HA CYS 12 HA CYS 12 6.005 -8.288 7.977 325 HB2 CYS 12 2HB CYS 12 5.512 -6.626 6.205 326 HB3 CYS 12 3HB CYS 12 6.337 -5.970 7.605 327 H GLY 13 HN GLY 13 8.671 -8.554 5.560 328 HA2 GLY 13 1HA GLY 13 8.982 -10.494 4.275 329 HA3 GLY 13 2HA GLY 13 7.267 -10.842 4.363 330 H GLN 14 HN GLN 14 8.576 -7.575 3.692 331 HA GLN 14 HA GLN 14 7.040 -7.485 1.313 332 HB2 GLN 14 2HB GLN 14 7.226 -5.488 2.687 333 HB3 GLN 14 3HB GLN 14 8.976 -5.526 2.612 334 HG2 GLN 14 2HG GLN 14 9.047 -4.604 0.502 335 HG3 GLN 14 3HG GLN 14 7.638 -5.487 -0.049 336 HE21 GLN 14 1HE2 GLN 14 8.165 -3.298 2.706 337 HE22 GLN 14 2HE2 GLN 14 6.939 -2.141 2.308 338 H VAL 15 HN VAL 15 7.679 -8.097 -0.709 339 HA VAL 15 HA VAL 15 10.569 -8.406 -1.130 340 HB VAL 15 HB VAL 15 8.225 -9.811 -2.428 341 HG11 VAL 15 1HG1 VAL 15 10.828 -11.046 -2.807 342 HG12 VAL 15 2HG1 VAL 15 9.601 -10.582 -4.011 343 HG13 VAL 15 3HG1 VAL 15 10.799 -9.388 -3.453 344 HG21 VAL 15 3HG2 VAL 15 9.514 -11.807 -1.258 345 HG22 VAL 15 1HG2 VAL 15 10.056 -10.513 -0.162 346 HG23 VAL 15 2HG2 VAL 15 8.317 -10.833 -0.371 347 H VAL 16 HN VAL 16 11.549 -7.179 -2.676 348 HA VAL 16 HA VAL 16 9.859 -5.968 -4.718 349 HB VAL 16 HB VAL 16 10.472 -3.785 -4.264 350 HG11 VAL 16 1HG1 VAL 16 10.394 -4.723 -1.407 351 HG12 VAL 16 2HG1 VAL 16 9.571 -3.343 -2.174 352 HG13 VAL 16 3HG1 VAL 16 8.995 -5.000 -2.472 353 HG21 VAL 16 3HG2 VAL 16 12.819 -5.015 -2.916 354 HG22 VAL 16 1HG2 VAL 16 12.711 -3.567 -3.945 355 HG23 VAL 16 2HG2 VAL 16 12.229 -3.480 -2.234 356 H LYS 17 HN LYS 17 10.873 -5.847 -6.704 357 HA LYS 17 HA LYS 17 13.573 -6.957 -6.754 358 HB2 LYS 17 2HB LYS 17 12.091 -8.241 -8.068 359 HB3 LYS 17 3HB LYS 17 11.327 -6.826 -8.765 360 HG2 LYS 17 2HG LYS 17 14.291 -7.127 -9.195 361 HG3 LYS 17 3HG LYS 17 13.245 -8.234 -10.064 362 HD2 LYS 17 2HD LYS 17 11.909 -5.907 -10.553 363 HD3 LYS 17 3HD LYS 17 13.526 -5.261 -10.352 364 HE2 LYS 17 2HE LYS 17 13.960 -7.504 -11.971 365 HE3 LYS 17 3HE LYS 17 12.420 -6.902 -12.553 366 HZ1 LYS 17 2HZ LYS 17 13.818 -5.554 -13.739 367 HZ3 LYS 17 1HZ LYS 17 15.032 -5.606 -12.655 368 H VAL 18 HN VAL 18 15.237 -5.556 -6.869 369 HA VAL 18 HA VAL 18 14.810 -2.823 -7.430 370 HB VAL 18 HB VAL 18 17.157 -4.613 -6.933 371 HG11 VAL 18 1HG1 VAL 18 17.799 -3.012 -8.762 372 HG12 VAL 18 2HG1 VAL 18 17.442 -1.676 -7.641 373 HG13 VAL 18 3HG1 VAL 18 18.738 -2.835 -7.260 374 HG21 VAL 18 3HG2 VAL 18 15.771 -2.338 -5.535 375 HG22 VAL 18 1HG2 VAL 18 16.203 -3.953 -4.923 376 HG23 VAL 18 2HG2 VAL 18 17.467 -2.720 -5.152 377 H LEU 19 HN LEU 19 14.729 -1.760 -9.346 378 HA LEU 19 HA LEU 19 15.508 -3.304 -11.712 379 HB2 LEU 19 2HB LEU 19 14.019 -1.809 -12.941 380 HB3 LEU 19 3HB LEU 19 13.193 -2.719 -11.692 381 HG LEU 19 HG LEU 19 14.036 -0.176 -10.623 382 HD11 LEU 19 1HD1 LEU 19 13.767 1.235 -12.312 383 HD12 LEU 19 2HD1 LEU 19 13.249 -0.079 -13.395 384 HD13 LEU 19 3HD1 LEU 19 12.053 0.762 -12.381 385 HD21 LEU 19 3HD2 LEU 19 11.902 -1.970 -10.409 386 HD22 LEU 19 1HD2 LEU 19 12.126 -0.443 -9.522 387 HD23 LEU 19 2HD2 LEU 19 11.183 -0.466 -11.031 388 H GLU 20 HN GLU 20 15.966 -0.265 -9.890 389 HA GLU 20 HA GLU 20 18.215 0.253 -11.667 390 HB2 GLU 20 2HB GLU 20 16.205 1.814 -12.024 391 HB3 GLU 20 3HB GLU 20 16.504 2.439 -10.415 392 HG2 GLU 20 2HG GLU 20 18.732 3.207 -11.035 393 HG3 GLU 20 3HG GLU 20 18.661 2.363 -12.569 394 H GLU 21 HN GLU 21 19.811 -0.559 -10.282 395 HA GLU 21 HA GLU 21 19.780 -0.334 -7.556 396 HB2 GLU 21 2HB GLU 21 21.281 -1.867 -8.708 397 HB3 GLU 21 3HB GLU 21 22.111 -0.547 -9.507 398 HG2 GLU 21 2HG GLU 21 22.630 0.310 -7.075 399 HG3 GLU 21 3HG GLU 21 22.188 -1.308 -6.568 400 H GLY 22 HN GLY 22 20.749 1.122 -6.041 401 HA2 GLY 22 1HA GLY 22 21.524 3.736 -7.194 402 HA3 GLY 22 2HA GLY 22 20.483 3.575 -5.794 403 H GLY 23 HN GLY 23 21.821 4.577 -4.258 404 HA2 GLY 23 1HA GLY 23 24.284 3.081 -3.612 405 HA3 GLY 23 2HA GLY 23 24.281 4.831 -3.700 406 H GLY 24 HN GLY 24 21.868 2.456 -2.369 407 HA2 GLY 24 1HA GLY 24 22.417 3.331 0.340 408 HA3 GLY 24 2HA GLY 24 20.871 3.846 -0.305 409 H THR 25 HN THR 25 20.288 2.370 1.685 410 HA THR 25 HA THR 25 19.887 -0.351 0.632 411 HB THR 25 HB THR 25 20.652 0.595 3.439 412 HG1 THR 25 HG1 THR 25 22.467 0.195 2.125 413 HG21 THR 25 3HG2 THR 25 19.423 -1.975 2.443 414 HG22 THR 25 1HG2 THR 25 20.775 -2.102 3.594 415 HG23 THR 25 2HG2 THR 25 19.298 -1.217 4.049 416 H LEU 26 HN LEU 26 17.929 -1.430 1.319 417 HA LEU 26 HA LEU 26 15.804 0.530 1.662 418 HB2 LEU 26 2HB LEU 26 15.404 -2.390 1.119 419 HB3 LEU 26 3HB LEU 26 14.363 -1.035 0.727 420 HG LEU 26 HG LEU 26 17.062 -1.415 -0.578 421 HD11 LEU 26 1HD1 LEU 26 14.404 -2.633 -1.322 422 HD12 LEU 26 2HD1 LEU 26 15.688 -2.346 -2.522 423 HD13 LEU 26 3HD1 LEU 26 15.988 -3.424 -1.138 424 HD21 LEU 26 3HD2 LEU 26 14.646 0.007 -1.689 425 HD22 LEU 26 1HD2 LEU 26 15.813 0.821 -0.620 426 HD23 LEU 26 2HD2 LEU 26 16.352 0.145 -2.175 427 H VAL 27 HN VAL 27 16.414 0.954 3.935 428 HA VAL 27 HA VAL 27 16.305 -1.149 5.824 429 HB VAL 27 HB VAL 27 16.102 1.857 6.073 430 HG11 VAL 27 1HG1 VAL 27 15.646 -0.213 8.044 431 HG12 VAL 27 2HG1 VAL 27 17.076 0.755 8.476 432 HG13 VAL 27 3HG1 VAL 27 15.509 1.554 8.203 433 HG21 VAL 27 3HG2 VAL 27 18.285 1.776 5.584 434 HG22 VAL 27 1HG2 VAL 27 18.516 0.968 7.153 435 HG23 VAL 27 2HG2 VAL 27 18.314 -0.001 5.673 436 H CYS 28 HN CYS 28 14.475 -2.355 6.040 437 HA CYS 28 HA CYS 28 11.978 -0.835 6.270 438 HB2 CYS 28 2HB CYS 28 12.142 -2.245 4.216 439 HB3 CYS 28 3HB CYS 28 12.281 -3.662 5.238 440 H CYS 29 HN CYS 29 10.850 -1.155 8.193 441 HA CYS 29 HA CYS 29 10.374 -1.874 10.210 442 HB2 CYS 29 2HB CYS 29 11.451 -4.475 9.125 443 HB3 CYS 29 3HB CYS 29 10.832 -4.327 10.759 444 H GLY 30 HN GLY 30 12.924 -0.529 9.588 445 HA2 GLY 30 1HA GLY 30 14.783 0.103 10.684 446 HA3 GLY 30 2HA GLY 30 14.230 -0.816 12.069 447 H GLU 31 HN GLU 31 14.478 -2.570 9.039 448 HA GLU 31 HA GLU 31 17.128 -3.494 9.778 449 HB2 GLU 31 2HB GLU 31 15.254 -5.020 10.694 450 HB3 GLU 31 3HB GLU 31 14.911 -5.438 9.027 451 HG2 GLU 31 2HG GLU 31 17.470 -5.979 8.847 452 HG3 GLU 31 3HG GLU 31 17.462 -5.951 10.599 453 H ASP 32 HN ASP 32 18.465 -3.475 8.018 454 HA ASP 32 HA ASP 32 17.585 -2.618 5.575 455 HB2 ASP 32 2HB ASP 32 19.854 -3.706 4.793 456 HB3 ASP 32 3HB ASP 32 19.887 -2.364 5.919 457 H MET 33 HN MET 33 16.158 -3.760 4.247 458 HA MET 33 HA MET 33 15.383 -6.272 4.411 459 HB2 MET 33 2HB MET 33 14.927 -4.262 2.659 460 HB3 MET 33 3HB MET 33 15.976 -5.215 1.629 461 HG2 MET 33 2HG MET 33 14.322 -6.720 1.207 462 HG3 MET 33 3HG MET 33 14.016 -6.956 2.916 463 HE1 MET 33 3HE MET 33 11.758 -4.321 -0.015 464 HE2 MET 33 1HE MET 33 13.519 -4.102 0.120 465 HE3 MET 33 2HE MET 33 12.852 -5.690 -0.325 466 H VAL 34 HN VAL 34 15.890 -8.341 3.426 467 HA VAL 34 HA VAL 34 18.758 -8.646 3.020 468 HB VAL 34 HB VAL 34 18.489 -10.846 3.657 469 HG11 VAL 34 1HG1 VAL 34 17.628 -8.970 5.348 470 HG12 VAL 34 2HG1 VAL 34 16.116 -9.897 5.207 471 HG13 VAL 34 3HG1 VAL 34 17.605 -10.700 5.763 472 HG21 VAL 34 3HG2 VAL 34 15.908 -10.621 2.293 473 HG22 VAL 34 1HG2 VAL 34 16.956 -12.040 2.539 474 HG23 VAL 34 2HG2 VAL 34 15.808 -11.549 3.809 475 H LYS 35 HN LYS 35 19.473 -10.192 1.257 476 HA LYS 35 HA LYS 35 17.949 -9.549 -1.148 477 HB2 LYS 35 2HB LYS 35 20.643 -9.326 -0.546 478 HB3 LYS 35 3HB LYS 35 20.579 -10.803 -1.487 479 HG2 LYS 35 2HG LYS 35 20.295 -9.618 -3.396 480 HG3 LYS 35 3HG LYS 35 18.842 -8.878 -2.755 481 HD2 LYS 35 2HD LYS 35 20.187 -6.993 -3.114 482 HD3 LYS 35 3HD LYS 35 20.511 -7.323 -1.424 483 HE2 LYS 35 2HE LYS 35 22.717 -7.509 -1.916 484 HE3 LYS 35 3HE LYS 35 22.359 -8.937 -2.867 485 HZ1 LYS 35 2HZ LYS 35 22.897 -7.747 -4.677 486 HZ3 LYS 35 1HZ LYS 35 23.126 -6.391 -3.804 487 H GLN 36 HN GLN 36 17.478 -11.201 -2.737 488 HA GLN 36 HA GLN 36 17.364 -13.835 -1.487 489 HB2 GLN 36 2HB GLN 36 15.489 -12.760 -3.636 490 HB3 GLN 36 3HB GLN 36 15.309 -14.251 -2.734 491 HG2 GLN 36 2HG GLN 36 15.407 -11.535 -1.355 492 HG3 GLN 36 3HG GLN 36 13.906 -12.223 -1.942 493 HE21 GLN 36 1HE2 GLN 36 16.414 -12.348 0.419 494 HE22 GLN 36 2HE2 GLN 36 15.735 -13.546 1.469 Start of MODEL 12 1 H1 ALA 1 HN ALA 1 5.028 -2.481 0.134 2 HA ALA 1 HA ALA 1 2.820 -1.232 1.293 3 HB1 ALA 1 1HB ALA 1 5.094 -0.401 0.117 4 HB2 ALA 1 2HB ALA 1 3.979 -0.171 -1.252 5 HB3 ALA 1 3HB ALA 1 3.672 0.653 0.295 6 H ASN 2 HN ASN 2 3.378 -2.059 -2.209 7 HA ASN 2 HA ASN 2 0.681 -2.966 -2.379 8 HB2 ASN 2 2HB ASN 2 1.388 -0.241 -3.166 9 HB3 ASN 2 3HB ASN 2 0.907 -1.146 -4.587 10 HD21 ASN 2 1HD2 ASN 2 -1.160 -1.866 -4.834 11 HD22 ASN 2 2HD2 ASN 2 -2.482 -1.406 -3.814 12 H GLU 3 HN GLU 3 0.758 -4.703 -3.828 13 HA GLU 3 HA GLU 3 3.144 -5.306 -5.126 14 HB2 GLU 3 2HB GLU 3 0.368 -6.458 -5.647 15 HB3 GLU 3 3HB GLU 3 1.891 -7.211 -6.074 16 HG2 GLU 3 2HG GLU 3 2.445 -7.695 -3.832 17 HG3 GLU 3 3HG GLU 3 1.430 -6.417 -3.193 18 H GLY 4 HN GLY 4 3.969 -4.417 -6.963 19 HA2 GLY 4 1HA GLY 4 3.722 -4.118 -9.318 20 HA3 GLY 4 2HA GLY 4 2.063 -3.611 -9.069 21 H ASP 5 HN ASP 5 2.941 -2.035 -6.558 22 HA ASP 5 HA ASP 5 3.291 0.390 -7.906 23 HB2 ASP 5 2HB ASP 5 3.182 -0.549 -5.055 24 HB3 ASP 5 3HB ASP 5 3.930 1.012 -5.326 25 H VAL 6 HN VAL 6 5.209 1.670 -8.144 26 HA VAL 6 HA VAL 6 7.688 0.251 -7.504 27 HB VAL 6 HB VAL 6 6.717 1.921 -9.701 28 HG11 VAL 6 1HG1 VAL 6 8.896 2.974 -10.192 29 HG12 VAL 6 2HG1 VAL 6 8.176 3.595 -8.687 30 HG13 VAL 6 3HG1 VAL 6 9.510 2.418 -8.616 31 HG21 VAL 6 3HG2 VAL 6 8.345 0.640 -10.973 32 HG22 VAL 6 1HG2 VAL 6 9.091 0.042 -9.472 33 HG23 VAL 6 2HG2 VAL 6 7.433 -0.447 -9.898 34 H TYR 7 HN TYR 7 9.563 1.649 -6.795 35 HA TYR 7 HA TYR 7 8.678 4.023 -5.333 36 HB2 TYR 7 2HB TYR 7 9.898 1.399 -4.388 37 HB3 TYR 7 3HB TYR 7 10.430 2.857 -3.577 38 HD1 TYR 7 HD2 TYR 7 7.480 0.729 -4.296 39 HD2 TYR 7 HD1 TYR 7 9.023 3.992 -1.998 40 HE1 TYR 7 HE2 TYR 7 5.430 0.651 -2.793 41 HE2 TYR 7 HE1 TYR 7 6.969 3.903 -0.503 42 HH TYR 7 HH TYR 7 5.268 1.835 0.094 43 H LYS 8 HN LYS 8 10.152 5.689 -5.380 44 HA LYS 8 HA LYS 8 12.830 5.007 -6.367 45 HB2 LYS 8 2HB LYS 8 11.802 5.917 -8.269 46 HB3 LYS 8 3HB LYS 8 10.918 7.117 -7.348 47 HG2 LYS 8 2HG LYS 8 12.607 8.604 -7.613 48 HG3 LYS 8 3HG LYS 8 13.720 7.516 -6.808 49 HD2 LYS 8 2HD LYS 8 14.624 6.759 -8.785 50 HD3 LYS 8 3HD LYS 8 13.076 6.735 -9.607 51 HE2 LYS 8 2HE LYS 8 14.588 9.310 -8.961 52 HE3 LYS 8 3HE LYS 8 14.742 8.461 -10.487 53 HZ1 LYS 8 2HZ LYS 8 13.050 10.098 -10.759 54 HZ3 LYS 8 1HZ LYS 8 12.271 9.682 -9.391 55 H CYS 9 HN CYS 9 14.534 5.970 -5.295 56 HA CYS 9 HA CYS 9 13.836 7.245 -2.824 57 HB2 CYS 9 2HB CYS 9 15.619 5.548 -2.908 58 HB3 CYS 9 3HB CYS 9 16.551 6.556 -3.997 59 H GLU 10 HN GLU 10 14.306 9.439 -2.276 60 HA GLU 10 HA GLU 10 14.762 11.099 -4.612 61 HB2 GLU 10 2HB GLU 10 13.462 11.571 -1.916 62 HB3 GLU 10 3HB GLU 10 13.992 12.931 -2.885 63 HG2 GLU 10 2HG GLU 10 12.511 10.982 -4.512 64 HG3 GLU 10 3HG GLU 10 11.557 11.518 -3.143 65 H LEU 11 HN LEU 11 16.967 9.632 -3.341 66 HA LEU 11 HA LEU 11 18.554 11.957 -2.542 67 HB2 LEU 11 2HB LEU 11 17.827 9.714 -0.890 68 HB3 LEU 11 3HB LEU 11 19.560 9.723 -1.149 69 HG LEU 11 HG LEU 11 18.677 12.396 -0.523 70 HD11 LEU 11 1HD1 LEU 11 18.014 11.879 1.874 71 HD12 LEU 11 2HD1 LEU 11 16.790 11.562 0.621 72 HD13 LEU 11 3HD1 LEU 11 17.711 10.212 1.327 73 HD21 LEU 11 3HD2 LEU 11 20.557 10.372 0.677 74 HD22 LEU 11 1HD2 LEU 11 20.926 11.889 -0.180 75 HD23 LEU 11 2HD2 LEU 11 20.248 11.938 1.466 76 H CYS 12 HN CYS 12 18.872 8.393 -3.203 77 HA CYS 12 HA CYS 12 21.246 8.999 -4.745 78 HB2 CYS 12 2HB CYS 12 21.463 6.515 -4.867 79 HB3 CYS 12 3HB CYS 12 21.534 7.198 -3.255 80 H GLY 13 HN GLY 13 17.995 7.417 -5.056 81 HA2 GLY 13 1HA GLY 13 16.708 8.037 -7.029 82 HA3 GLY 13 2HA GLY 13 18.172 7.863 -7.977 83 H GLN 14 HN GLN 14 17.610 5.613 -5.307 84 HA GLN 14 HA GLN 14 17.819 3.420 -6.985 85 HB2 GLN 14 2HB GLN 14 18.433 3.267 -4.641 86 HB3 GLN 14 3HB GLN 14 16.817 3.706 -4.124 87 HG2 GLN 14 2HG GLN 14 16.177 1.533 -4.178 88 HG3 GLN 14 3HG GLN 14 16.573 1.437 -5.883 89 HE21 GLN 14 1HE2 GLN 14 18.412 1.838 -2.854 90 HE22 GLN 14 2HE2 GLN 14 19.551 0.559 -3.119 91 H VAL 15 HN VAL 15 16.342 2.365 -8.251 92 HA VAL 15 HA VAL 15 13.516 3.007 -7.760 93 HB VAL 15 HB VAL 15 15.010 2.434 -10.324 94 HG11 VAL 15 1HG1 VAL 15 12.502 1.554 -9.898 95 HG12 VAL 15 2HG1 VAL 15 12.140 3.227 -10.389 96 HG13 VAL 15 3HG1 VAL 15 13.064 2.161 -11.474 97 HG21 VAL 15 3HG2 VAL 15 13.986 4.887 -8.986 98 HG22 VAL 15 1HG2 VAL 15 15.384 4.663 -10.064 99 HG23 VAL 15 2HG2 VAL 15 13.744 4.775 -10.746 100 H VAL 16 HN VAL 16 12.410 1.337 -6.893 101 HA VAL 16 HA VAL 16 13.178 -1.353 -7.781 102 HB VAL 16 HB VAL 16 13.190 -2.191 -5.643 103 HG11 VAL 16 1HG1 VAL 16 14.991 -1.154 -4.785 104 HG12 VAL 16 2HG1 VAL 16 14.821 -0.029 -6.153 105 HG13 VAL 16 3HG1 VAL 16 14.121 0.383 -4.569 106 HG21 VAL 16 3HG2 VAL 16 11.764 0.289 -4.623 107 HG22 VAL 16 1HG2 VAL 16 10.985 -1.269 -4.989 108 HG23 VAL 16 2HG2 VAL 16 12.186 -1.159 -3.680 109 H LYS 17 HN LYS 17 11.399 -2.914 -7.758 110 HA LYS 17 HA LYS 17 8.806 -1.542 -7.916 111 HB2 LYS 17 2HB LYS 17 9.199 -2.197 -10.095 112 HB3 LYS 17 3HB LYS 17 10.099 -3.628 -9.632 113 HG2 LYS 17 2HG LYS 17 7.949 -4.364 -10.485 114 HG3 LYS 17 3HG LYS 17 7.952 -4.643 -8.754 115 HD2 LYS 17 2HD LYS 17 5.911 -3.571 -8.902 116 HD3 LYS 17 3HD LYS 17 6.919 -2.149 -8.721 117 HE2 LYS 17 2HE LYS 17 5.883 -1.458 -10.648 118 HE3 LYS 17 3HE LYS 17 7.070 -2.477 -11.438 119 HZ1 LYS 17 2HZ LYS 17 4.247 -2.883 -11.221 120 HZ3 LYS 17 1HZ LYS 17 5.063 -4.208 -10.743 121 H VAL 18 HN VAL 18 7.327 -2.108 -6.415 122 HA VAL 18 HA VAL 18 7.971 -4.155 -4.544 123 HB VAL 18 HB VAL 18 5.496 -2.467 -4.962 124 HG11 VAL 18 1HG1 VAL 18 4.551 -3.973 -3.572 125 HG12 VAL 18 2HG1 VAL 18 6.121 -4.636 -3.055 126 HG13 VAL 18 3HG1 VAL 18 5.498 -3.141 -2.315 127 HG21 VAL 18 3HG2 VAL 18 7.732 -2.131 -2.938 128 HG22 VAL 18 1HG2 VAL 18 7.622 -1.231 -4.469 129 HG23 VAL 18 2HG2 VAL 18 6.360 -1.036 -3.229 130 H LEU 19 HN LEU 19 7.706 -6.294 -4.884 131 HA LEU 19 HA LEU 19 5.779 -7.107 -6.912 132 HB2 LEU 19 2HB LEU 19 8.290 -8.171 -5.798 133 HB3 LEU 19 3HB LEU 19 7.057 -9.375 -6.106 134 HG LEU 19 HG LEU 19 7.320 -7.558 -8.362 135 HD11 LEU 19 1HD1 LEU 19 9.574 -7.193 -7.890 136 HD12 LEU 19 2HD1 LEU 19 9.822 -8.852 -7.294 137 HD13 LEU 19 3HD1 LEU 19 9.597 -8.556 -9.034 138 HD21 LEU 19 3HD2 LEU 19 6.982 -9.441 -9.573 139 HD22 LEU 19 1HD2 LEU 19 8.065 -10.427 -8.561 140 HD23 LEU 19 2HD2 LEU 19 6.415 -10.057 -8.002 141 H GLU 20 HN GLU 20 6.773 -8.066 -3.546 142 HA GLU 20 HA GLU 20 3.972 -8.791 -3.160 143 HB2 GLU 20 2HB GLU 20 6.185 -10.470 -2.983 144 HB3 GLU 20 3HB GLU 20 5.923 -10.025 -1.309 145 HG2 GLU 20 2HG GLU 20 3.911 -11.141 -1.179 146 HG3 GLU 20 3HG GLU 20 3.436 -10.700 -2.806 147 H GLU 21 HN GLU 21 3.263 -6.807 -2.291 148 HA GLU 21 HA GLU 21 4.658 -5.197 -0.620 149 HB2 GLU 21 2HB GLU 21 2.501 -4.233 0.015 150 HB3 GLU 21 3HB GLU 21 2.474 -4.644 -1.689 151 HG2 GLU 21 2HG GLU 21 0.661 -5.957 -1.345 152 HG3 GLU 21 3HG GLU 21 1.602 -6.982 -0.281 153 H GLY 22 HN GLY 22 4.386 -4.780 1.767 154 HA2 GLY 22 1HA GLY 22 3.827 -7.262 3.268 155 HA3 GLY 22 2HA GLY 22 5.306 -6.357 3.519 156 H GLY 23 HN GLY 23 5.307 -4.803 5.092 157 HA2 GLY 23 1HA GLY 23 2.992 -3.172 5.584 158 HA3 GLY 23 2HA GLY 23 3.267 -4.365 6.839 159 H GLY 24 HN GLY 24 5.504 -2.362 4.781 160 HA2 GLY 24 1HA GLY 24 6.392 -0.884 7.116 161 HA3 GLY 24 2HA GLY 24 7.569 -1.997 6.444 162 H THR 25 HN THR 25 8.707 0.219 6.152 163 HA THR 25 HA THR 25 7.982 1.237 3.486 164 HB THR 25 HB THR 25 8.694 2.729 6.052 165 HG1 THR 25 HG1 THR 25 6.441 2.309 5.491 166 HG21 THR 25 3HG2 THR 25 8.293 4.683 4.164 167 HG22 THR 25 1HG2 THR 25 9.912 4.143 4.673 168 HG23 THR 25 2HG2 THR 25 9.178 3.483 3.192 169 H LEU 26 HN LEU 26 9.687 1.764 2.092 170 HA LEU 26 HA LEU 26 12.124 0.357 2.767 171 HB2 LEU 26 2HB LEU 26 11.592 1.772 0.179 172 HB3 LEU 26 3HB LEU 26 12.600 0.374 0.493 173 HG LEU 26 HG LEU 26 9.605 0.241 0.824 174 HD11 LEU 26 1HD1 LEU 26 9.941 -0.908 -1.588 175 HD12 LEU 26 2HD1 LEU 26 9.473 0.794 -1.362 176 HD13 LEU 26 3HD1 LEU 26 11.171 0.375 -1.690 177 HD21 LEU 26 3HD2 LEU 26 10.012 -2.167 0.316 178 HD22 LEU 26 1HD2 LEU 26 11.760 -1.830 0.339 179 HD23 LEU 26 2HD2 LEU 26 10.788 -1.595 1.813 180 H VAL 27 HN VAL 27 12.710 1.884 4.524 181 HA VAL 27 HA VAL 27 13.231 4.592 3.904 182 HB VAL 27 HB VAL 27 14.147 2.767 6.134 183 HG11 VAL 27 1HG1 VAL 27 14.164 5.596 6.782 184 HG12 VAL 27 2HG1 VAL 27 15.453 4.380 6.959 185 HG13 VAL 27 3HG1 VAL 27 15.253 5.248 5.417 186 HG21 VAL 27 3HG2 VAL 27 12.444 4.051 7.448 187 HG22 VAL 27 1HG2 VAL 27 11.917 4.816 5.930 188 HG23 VAL 27 2HG2 VAL 27 11.755 3.056 6.143 189 H CYS 28 HN CYS 28 14.647 5.113 2.298 190 HA CYS 28 HA CYS 28 17.237 3.744 2.403 191 HB2 CYS 28 2HB CYS 28 15.872 3.157 0.407 192 HB3 CYS 28 3HB CYS 28 15.870 4.847 -0.060 193 H CYS 29 HN CYS 29 19.036 5.109 2.545 194 HA CYS 29 HA CYS 29 20.212 6.947 2.774 195 HB2 CYS 29 2HB CYS 29 18.127 7.995 0.882 196 HB3 CYS 29 3HB CYS 29 19.331 9.072 1.562 197 H GLY 30 HN GLY 30 18.001 6.138 4.634 198 HA2 GLY 30 1HA GLY 30 17.172 6.901 6.586 199 HA3 GLY 30 2HA GLY 30 18.060 8.393 6.353 200 H GLU 31 HN GLU 31 15.929 7.361 3.745 201 HA GLU 31 HA GLU 31 13.833 9.084 4.771 202 HB2 GLU 31 2HB GLU 31 15.580 10.155 3.024 203 HB3 GLU 31 3HB GLU 31 14.548 9.347 1.861 204 HG2 GLU 31 2HG GLU 31 12.685 10.668 2.371 205 HG3 GLU 31 3HG GLU 31 13.196 10.948 4.024 206 H ASP 32 HN ASP 32 11.805 8.220 4.449 207 HA ASP 32 HA ASP 32 11.577 5.640 3.531 208 HB2 ASP 32 2HB ASP 32 9.037 6.348 3.369 209 HB3 ASP 32 3HB ASP 32 9.828 6.301 4.932 210 H MET 33 HN MET 33 12.057 5.112 1.375 211 HA MET 33 HA MET 33 12.151 6.670 -0.754 212 HB2 MET 33 2HB MET 33 12.366 3.999 -0.335 213 HB3 MET 33 3HB MET 33 10.791 3.982 -1.104 214 HG2 MET 33 2HG MET 33 11.704 4.325 -3.163 215 HG3 MET 33 3HG MET 33 12.611 5.715 -2.600 216 HE1 MET 33 3HE MET 33 13.441 1.444 -3.019 217 HE2 MET 33 1HE MET 33 12.374 2.583 -3.874 218 HE3 MET 33 2HE MET 33 14.066 2.387 -4.393 219 H VAL 34 HN VAL 34 10.770 7.316 -2.523 220 HA VAL 34 HA VAL 34 8.017 7.673 -1.662 221 HB VAL 34 HB VAL 34 7.933 9.456 -3.121 222 HG11 VAL 34 1HG1 VAL 34 9.722 9.635 -1.277 223 HG12 VAL 34 2HG1 VAL 34 10.909 9.469 -2.593 224 HG13 VAL 34 3HG1 VAL 34 9.765 10.833 -2.593 225 HG21 VAL 34 3HG2 VAL 34 9.674 7.796 -4.791 226 HG22 VAL 34 1HG2 VAL 34 8.481 9.033 -5.253 227 HG23 VAL 34 2HG2 VAL 34 10.135 9.515 -4.806 228 H LYS 35 HN LYS 35 6.250 7.360 -3.318 229 HA LYS 35 HA LYS 35 6.837 4.920 -4.836 230 HB2 LYS 35 2HB LYS 35 4.683 4.176 -4.403 231 HB3 LYS 35 3HB LYS 35 5.132 4.948 -2.896 232 HG2 LYS 35 2HG LYS 35 2.994 5.847 -3.283 233 HG3 LYS 35 3HG LYS 35 4.034 7.105 -3.921 234 HD2 LYS 35 2HD LYS 35 2.882 6.919 -5.871 235 HD3 LYS 35 3HD LYS 35 3.705 5.391 -6.116 236 HE2 LYS 35 2HE LYS 35 1.855 4.245 -4.806 237 HE3 LYS 35 3HE LYS 35 1.015 5.780 -4.719 238 HZ1 LYS 35 2HZ LYS 35 0.870 3.983 -6.795 239 HZ3 LYS 35 1HZ LYS 35 1.783 5.185 -7.404 240 H GLN 36 HN GLN 36 5.961 4.700 -6.990 241 HA GLN 36 HA GLN 36 5.505 7.321 -8.185 242 HB2 GLN 36 2HB GLN 36 6.563 4.813 -9.558 243 HB3 GLN 36 3HB GLN 36 6.467 6.419 -10.252 244 HG2 GLN 36 2HG GLN 36 8.053 5.899 -7.707 245 HG3 GLN 36 3HG GLN 36 8.764 5.632 -9.288 246 HE21 GLN 36 1HE2 GLN 36 7.578 7.942 -6.997 247 HE22 GLN 36 2HE2 GLN 36 8.138 9.388 -7.769 248 H1 ALA 1 HN ALA 1 23.412 -3.231 -5.383 249 HA ALA 1 HA ALA 1 20.959 -4.536 -4.560 250 HB1 ALA 1 1HB ALA 1 20.949 -1.787 -4.829 251 HB2 ALA 1 2HB ALA 1 20.469 -2.327 -6.456 252 HB3 ALA 1 3HB ALA 1 19.531 -2.842 -5.033 253 H ASN 2 HN ASN 2 22.991 -3.117 -7.195 254 HA ASN 2 HA ASN 2 23.322 -3.739 -9.260 255 HB2 ASN 2 2HB ASN 2 23.713 -6.337 -9.497 256 HB3 ASN 2 3HB ASN 2 24.766 -5.429 -8.429 257 HD21 ASN 2 1HD2 ASN 2 24.485 -5.523 -6.191 258 HD22 ASN 2 2HD2 ASN 2 23.633 -6.811 -5.410 259 H GLU 3 HN GLU 3 21.480 -3.287 -10.542 260 HA GLU 3 HA GLU 3 19.015 -4.109 -10.377 261 HB2 GLU 3 2HB GLU 3 20.622 -3.979 -12.966 262 HB3 GLU 3 3HB GLU 3 18.871 -3.979 -12.895 263 HG2 GLU 3 2HG GLU 3 19.010 -1.921 -11.386 264 HG3 GLU 3 3HG GLU 3 20.736 -1.883 -11.691 265 H GLY 4 HN GLY 4 17.643 -5.845 -11.206 266 HA2 GLY 4 1HA GLY 4 17.188 -7.957 -11.932 267 HA3 GLY 4 2HA GLY 4 18.891 -8.238 -12.234 268 H ASP 5 HN ASP 5 17.699 -6.961 -9.118 269 HA ASP 5 HA ASP 5 18.287 -9.577 -7.972 270 HB2 ASP 5 2HB ASP 5 19.389 -6.920 -7.382 271 HB3 ASP 5 3HB ASP 5 18.657 -7.622 -5.953 272 H VAL 6 HN VAL 6 17.241 -9.658 -5.599 273 HA VAL 6 HA VAL 6 14.739 -8.136 -5.573 274 HB VAL 6 HB VAL 6 15.144 -11.083 -5.656 275 HG11 VAL 6 1HG1 VAL 6 14.241 -10.919 -3.444 276 HG12 VAL 6 2HG1 VAL 6 13.033 -9.718 -3.960 277 HG13 VAL 6 3HG1 VAL 6 12.912 -11.403 -4.524 278 HG21 VAL 6 3HG2 VAL 6 12.902 -10.915 -6.812 279 HG22 VAL 6 1HG2 VAL 6 13.042 -9.146 -6.666 280 HG23 VAL 6 2HG2 VAL 6 14.239 -10.059 -7.615 281 H TYR 7 HN TYR 7 13.933 -7.671 -3.465 282 HA TYR 7 HA TYR 7 15.776 -8.407 -1.296 283 HB2 TYR 7 2HB TYR 7 14.575 -5.783 -2.281 284 HB3 TYR 7 3HB TYR 7 14.839 -5.953 -0.558 285 HD1 TYR 7 HD1 TYR 7 17.169 -6.302 0.318 286 HD2 TYR 7 HD2 TYR 7 16.396 -5.383 -3.788 287 HE1 TYR 7 HE1 TYR 7 19.597 -5.615 0.007 288 HE2 TYR 7 HE2 TYR 7 18.826 -4.700 -4.086 289 HH TYR 7 HH TYR 7 21.021 -4.599 -1.323 290 H LYS 8 HN LYS 8 14.755 -9.494 0.306 291 HA LYS 8 HA LYS 8 11.869 -9.015 0.580 292 HB2 LYS 8 2HB LYS 8 12.332 -11.250 -0.258 293 HB3 LYS 8 3HB LYS 8 13.465 -11.550 1.044 294 HG2 LYS 8 2HG LYS 8 10.806 -10.645 1.996 295 HG3 LYS 8 3HG LYS 8 10.743 -12.149 1.099 296 HD2 LYS 8 2HD LYS 8 13.014 -12.126 2.961 297 HD3 LYS 8 3HD LYS 8 11.508 -11.820 3.803 298 HE2 LYS 8 2HE LYS 8 11.876 -14.133 1.845 299 HE3 LYS 8 3HE LYS 8 12.155 -14.288 3.568 300 HZ1 LYS 8 2HZ LYS 8 9.924 -14.148 4.005 301 HZ3 LYS 8 1HZ LYS 8 9.779 -14.717 2.487 302 H CYS 9 HN CYS 9 11.157 -8.213 2.496 303 HA CYS 9 HA CYS 9 13.094 -7.454 4.413 304 HB2 CYS 9 2HB CYS 9 11.153 -6.047 3.953 305 HB3 CYS 9 3HB CYS 9 10.062 -7.314 4.480 306 H GLU 10 HN GLU 10 13.554 -8.411 6.431 307 HA GLU 10 HA GLU 10 12.540 -11.095 6.706 308 HB2 GLU 10 2HB GLU 10 14.923 -9.573 7.683 309 HB3 GLU 10 3HB GLU 10 14.322 -10.821 8.757 310 HG2 GLU 10 2HG GLU 10 14.525 -11.607 5.879 311 HG3 GLU 10 3HG GLU 10 16.053 -11.291 6.677 312 H LEU 11 HN LEU 11 10.684 -8.899 7.181 313 HA LEU 11 HA LEU 11 10.111 -9.470 9.989 314 HB2 LEU 11 2HB LEU 11 10.815 -6.891 8.847 315 HB3 LEU 11 3HB LEU 11 9.227 -6.862 9.585 316 HG LEU 11 HG LEU 11 11.168 -8.196 11.301 317 HD11 LEU 11 1HD1 LEU 11 12.949 -6.890 11.119 318 HD12 LEU 11 2HD1 LEU 11 12.142 -5.899 9.880 319 HD13 LEU 11 3HD1 LEU 11 11.953 -5.498 11.604 320 HD21 LEU 11 3HD2 LEU 11 8.937 -7.373 11.985 321 HD22 LEU 11 1HD2 LEU 11 10.258 -6.714 12.978 322 HD23 LEU 11 2HD2 LEU 11 9.497 -5.704 11.725 323 H CYS 12 HN CYS 12 8.768 -7.647 7.141 324 HA CYS 12 HA CYS 12 6.196 -8.846 7.738 325 HB2 CYS 12 2HB CYS 12 5.399 -7.276 5.932 326 HB3 CYS 12 3HB CYS 12 6.007 -6.543 7.403 327 H GLY 13 HN GLY 13 8.700 -8.563 5.143 328 HA2 GLY 13 1HA GLY 13 9.211 -10.616 3.947 329 HA3 GLY 13 2HA GLY 13 7.490 -10.934 3.850 330 H GLN 14 HN GLN 14 8.383 -7.568 3.571 331 HA GLN 14 HA GLN 14 7.209 -7.266 1.131 332 HB2 GLN 14 2HB GLN 14 7.611 -5.370 2.592 333 HB3 GLN 14 3HB GLN 14 9.346 -5.606 2.526 334 HG2 GLN 14 2HG GLN 14 9.471 -4.280 0.695 335 HG3 GLN 14 3HG GLN 14 8.438 -5.386 -0.188 336 HE21 GLN 14 1HE2 GLN 14 8.000 -3.172 2.574 337 HE22 GLN 14 2HE2 GLN 14 6.634 -2.310 1.948 338 H VAL 15 HN VAL 15 7.765 -8.297 -0.744 339 HA VAL 15 HA VAL 15 10.627 -8.612 -1.289 340 HB VAL 15 HB VAL 15 8.175 -10.074 -2.277 341 HG11 VAL 15 1HG1 VAL 15 10.074 -9.648 -3.998 342 HG12 VAL 15 2HG1 VAL 15 10.999 -10.821 -3.029 343 HG13 VAL 15 3HG1 VAL 15 9.462 -11.307 -3.785 344 HG21 VAL 15 3HG2 VAL 15 9.773 -11.989 -1.281 345 HG22 VAL 15 1HG2 VAL 15 10.315 -10.624 -0.274 346 HG23 VAL 15 2HG2 VAL 15 8.599 -11.098 -0.284 347 H VAL 16 HN VAL 16 11.445 -7.001 -2.523 348 HA VAL 16 HA VAL 16 9.747 -6.060 -4.728 349 HB VAL 16 HB VAL 16 10.454 -3.850 -4.385 350 HG11 VAL 16 1HG1 VAL 16 9.325 -5.338 -2.147 351 HG12 VAL 16 2HG1 VAL 16 10.175 -3.870 -1.609 352 HG13 VAL 16 3HG1 VAL 16 8.867 -3.752 -2.811 353 HG21 VAL 16 3HG2 VAL 16 12.682 -3.723 -3.921 354 HG22 VAL 16 1HG2 VAL 16 12.067 -3.502 -2.265 355 HG23 VAL 16 2HG2 VAL 16 12.642 -5.100 -2.795 356 H LYS 17 HN LYS 17 10.815 -5.666 -6.721 357 HA LYS 17 HA LYS 17 13.446 -6.945 -6.844 358 HB2 LYS 17 2HB LYS 17 11.686 -7.996 -8.176 359 HB3 LYS 17 3HB LYS 17 11.354 -6.481 -8.989 360 HG2 LYS 17 2HG LYS 17 14.191 -7.509 -9.025 361 HG3 LYS 17 3HG LYS 17 13.014 -8.314 -10.046 362 HD2 LYS 17 2HD LYS 17 12.418 -6.134 -11.100 363 HD3 LYS 17 3HD LYS 17 13.556 -5.305 -10.056 364 HE2 LYS 17 2HE LYS 17 15.097 -5.645 -11.700 365 HE3 LYS 17 3HE LYS 17 15.140 -7.314 -11.168 366 HZ1 LYS 17 2HZ LYS 17 14.653 -7.136 -13.552 367 HZ3 LYS 17 1HZ LYS 17 13.306 -6.269 -13.260 368 H VAL 18 HN VAL 18 15.229 -5.725 -7.161 369 HA VAL 18 HA VAL 18 14.989 -2.920 -7.353 370 HB VAL 18 HB VAL 18 17.362 -4.759 -7.728 371 HG11 VAL 18 1HG1 VAL 18 18.775 -2.945 -7.668 372 HG12 VAL 18 2HG1 VAL 18 17.392 -2.234 -8.533 373 HG13 VAL 18 3HG1 VAL 18 17.609 -1.922 -6.794 374 HG21 VAL 18 3HG2 VAL 18 15.808 -4.128 -5.408 375 HG22 VAL 18 1HG2 VAL 18 17.281 -5.120 -5.531 376 HG23 VAL 18 2HG2 VAL 18 17.409 -3.369 -5.238 377 H LEU 19 HN LEU 19 14.485 -1.750 -9.125 378 HA LEU 19 HA LEU 19 14.721 -3.014 -11.713 379 HB2 LEU 19 2HB LEU 19 13.242 -0.767 -10.518 380 HB3 LEU 19 3HB LEU 19 13.786 -0.491 -12.160 381 HG LEU 19 HG LEU 19 11.430 -1.557 -11.640 382 HD11 LEU 19 1HD1 LEU 19 13.348 -2.058 -13.872 383 HD12 LEU 19 2HD1 LEU 19 11.818 -2.967 -13.849 384 HD13 LEU 19 3HD1 LEU 19 11.796 -1.188 -13.862 385 HD21 LEU 19 3HD2 LEU 19 11.281 -3.781 -11.232 386 HD22 LEU 19 1HD2 LEU 19 12.802 -4.159 -12.075 387 HD23 LEU 19 2HD2 LEU 19 12.841 -3.481 -10.430 388 H GLU 20 HN GLU 20 15.894 0.006 -10.072 389 HA GLU 20 HA GLU 20 18.201 -0.171 -11.838 390 HB2 GLU 20 2HB GLU 20 17.851 1.878 -12.734 391 HB3 GLU 20 3HB GLU 20 16.227 1.782 -12.083 392 HG2 GLU 20 2HG GLU 20 16.957 2.886 -9.992 393 HG3 GLU 20 3HG GLU 20 18.620 2.893 -10.542 394 H GLU 21 HN GLU 21 20.031 -0.388 -10.632 395 HA GLU 21 HA GLU 21 19.999 -0.208 -7.888 396 HB2 GLU 21 2HB GLU 21 21.648 -1.490 -9.293 397 HB3 GLU 21 3HB GLU 21 22.415 0.021 -9.736 398 HG2 GLU 21 2HG GLU 21 22.810 0.483 -7.272 399 HG3 GLU 21 3HG GLU 21 22.156 -1.101 -6.906 400 H GLY 22 HN GLY 22 21.198 1.301 -6.438 401 HA2 GLY 22 1HA GLY 22 21.561 3.993 -7.575 402 HA3 GLY 22 2HA GLY 22 20.490 3.760 -6.208 403 H GLY 23 HN GLY 23 21.543 4.616 -4.450 404 HA2 GLY 23 1HA GLY 23 24.133 3.423 -3.756 405 HA3 GLY 23 2HA GLY 23 24.020 5.168 -3.873 406 H GLY 24 HN GLY 24 21.733 2.638 -2.608 407 HA2 GLY 24 1HA GLY 24 22.101 3.536 0.110 408 HA3 GLY 24 2HA GLY 24 20.576 4.031 -0.598 409 H THR 25 HN THR 25 19.966 2.516 1.373 410 HA THR 25 HA THR 25 19.610 -0.186 0.257 411 HB THR 25 HB THR 25 20.311 0.680 3.110 412 HG1 THR 25 HG1 THR 25 21.495 -1.197 1.198 413 HG21 THR 25 3HG2 THR 25 19.434 -1.995 1.932 414 HG22 THR 25 1HG2 THR 25 20.486 -1.910 3.366 415 HG23 THR 25 2HG2 THR 25 18.851 -1.208 3.419 416 H LEU 26 HN LEU 26 17.718 -1.357 1.300 417 HA LEU 26 HA LEU 26 15.554 0.602 1.578 418 HB2 LEU 26 2HB LEU 26 15.129 -2.281 0.898 419 HB3 LEU 26 3HB LEU 26 14.118 -0.891 0.551 420 HG LEU 26 HG LEU 26 16.824 -1.188 -0.744 421 HD11 LEU 26 1HD1 LEU 26 15.604 -3.289 -1.136 422 HD12 LEU 26 2HD1 LEU 26 14.234 -2.362 -1.793 423 HD13 LEU 26 3HD1 LEU 26 15.807 -2.336 -2.627 424 HD21 LEU 26 3HD2 LEU 26 16.273 0.685 -1.793 425 HD22 LEU 26 1HD2 LEU 26 14.763 -0.047 -2.388 426 HD23 LEU 26 2HD2 LEU 26 14.792 0.775 -0.809 427 H VAL 27 HN VAL 27 16.029 0.952 3.849 428 HA VAL 27 HA VAL 27 15.971 -1.290 5.620 429 HB VAL 27 HB VAL 27 15.889 1.703 6.041 430 HG11 VAL 27 1HG1 VAL 27 15.616 1.434 8.250 431 HG12 VAL 27 2HG1 VAL 27 15.070 -0.217 7.871 432 HG13 VAL 27 3HG1 VAL 27 16.769 0.080 8.312 433 HG21 VAL 27 3HG2 VAL 27 18.244 1.352 6.795 434 HG22 VAL 27 1HG2 VAL 27 18.122 -0.342 6.263 435 HG23 VAL 27 2HG2 VAL 27 17.981 0.976 5.076 436 H CYS 28 HN CYS 28 14.108 -2.438 5.834 437 HA CYS 28 HA CYS 28 11.664 -0.851 6.144 438 HB2 CYS 28 2HB CYS 28 11.762 -2.196 4.044 439 HB3 CYS 28 3HB CYS 28 11.871 -3.649 5.017 440 H CYS 29 HN CYS 29 10.475 -1.261 8.028 441 HA CYS 29 HA CYS 29 9.991 -2.037 10.022 442 HB2 CYS 29 2HB CYS 29 11.047 -4.584 8.814 443 HB3 CYS 29 3HB CYS 29 10.523 -4.522 10.485 444 H GLY 30 HN GLY 30 12.545 -0.668 9.454 445 HA2 GLY 30 1HA GLY 30 14.408 -0.072 10.562 446 HA3 GLY 30 2HA GLY 30 13.824 -0.989 11.937 447 H GLU 31 HN GLU 31 14.206 -2.605 8.805 448 HA GLU 31 HA GLU 31 16.788 -3.614 9.633 449 HB2 GLU 31 2HB GLU 31 14.908 -5.151 10.476 450 HB3 GLU 31 3HB GLU 31 14.551 -5.505 8.798 451 HG2 GLU 31 2HG GLU 31 16.451 -6.782 8.514 452 HG3 GLU 31 3HG GLU 31 17.433 -5.746 9.529 453 H ASP 32 HN ASP 32 18.178 -3.601 7.911 454 HA ASP 32 HA ASP 32 17.363 -2.681 5.459 455 HB2 ASP 32 2HB ASP 32 19.809 -4.420 6.023 456 HB3 ASP 32 3HB ASP 32 19.624 -3.294 4.692 457 H MET 33 HN MET 33 16.063 -3.789 3.988 458 HA MET 33 HA MET 33 15.267 -6.316 4.111 459 HB2 MET 33 2HB MET 33 14.893 -4.259 2.370 460 HB3 MET 33 3HB MET 33 15.937 -5.241 1.362 461 HG2 MET 33 2HG MET 33 14.391 -7.031 1.260 462 HG3 MET 33 3HG MET 33 13.587 -6.561 2.745 463 HE1 MET 33 3HE MET 33 11.590 -3.475 1.873 464 HE2 MET 33 1HE MET 33 12.758 -4.173 3.020 465 HE3 MET 33 2HE MET 33 13.318 -3.067 1.743 466 H VAL 34 HN VAL 34 15.872 -8.383 3.284 467 HA VAL 34 HA VAL 34 18.738 -8.621 2.843 468 HB VAL 34 HB VAL 34 18.564 -10.738 3.656 469 HG11 VAL 34 1HG1 VAL 34 17.278 -8.837 5.116 470 HG12 VAL 34 2HG1 VAL 34 16.006 -10.076 4.995 471 HG13 VAL 34 3HG1 VAL 34 17.593 -10.494 5.685 472 HG21 VAL 34 3HG2 VAL 34 17.039 -11.556 1.896 473 HG22 VAL 34 1HG2 VAL 34 16.607 -12.195 3.500 474 HG23 VAL 34 2HG2 VAL 34 15.656 -10.871 2.785 475 H LYS 35 HN LYS 35 19.559 -10.009 1.080 476 HA LYS 35 HA LYS 35 18.019 -9.507 -1.322 477 HB2 LYS 35 2HB LYS 35 20.477 -8.956 -1.072 478 HB3 LYS 35 3HB LYS 35 20.800 -10.678 -1.061 479 HG2 LYS 35 2HG LYS 35 19.079 -9.582 -3.284 480 HG3 LYS 35 3HG LYS 35 20.800 -9.256 -3.344 481 HD2 LYS 35 2HD LYS 35 21.310 -11.668 -3.228 482 HD3 LYS 35 3HD LYS 35 19.614 -12.050 -3.007 483 HE2 LYS 35 2HE LYS 35 19.510 -12.264 -5.272 484 HE3 LYS 35 3HE LYS 35 19.567 -10.514 -5.333 485 HZ1 LYS 35 2HZ LYS 35 21.551 -10.700 -6.337 486 HZ3 LYS 35 1HZ LYS 35 21.535 -12.323 -6.210 487 H GLN 36 HN GLN 36 17.320 -11.129 -2.783 488 HA GLN 36 HA GLN 36 17.208 -13.758 -1.525 489 HB2 GLN 36 2HB GLN 36 15.268 -12.627 -3.584 490 HB3 GLN 36 3HB GLN 36 15.082 -14.110 -2.669 491 HG2 GLN 36 2HG GLN 36 15.361 -11.415 -1.280 492 HG3 GLN 36 3HG GLN 36 13.803 -12.002 -1.830 493 HE21 GLN 36 1HE2 GLN 36 16.514 -12.546 0.310 494 HE22 GLN 36 2HE2 GLN 36 15.745 -13.638 1.412 Start of MODEL 13 1 H1 ALA 1 HN ALA 1 2.524 -1.105 1.386 2 HA ALA 1 HA ALA 1 1.466 0.719 -0.652 3 HB1 ALA 1 1HB ALA 1 3.458 -0.702 -1.870 4 HB2 ALA 1 2HB ALA 1 3.711 0.839 -1.016 5 HB3 ALA 1 3HB ALA 1 4.032 -0.702 -0.185 6 H ASN 2 HN ASN 2 1.245 -0.461 -2.900 7 HA ASN 2 HA ASN 2 -0.130 -2.974 -2.350 8 HB2 ASN 2 2HB ASN 2 -0.894 -0.551 -3.926 9 HB3 ASN 2 3HB ASN 2 -1.209 -2.069 -4.744 10 HD21 ASN 2 1HD2 ASN 2 -2.481 -3.683 -3.675 11 HD22 ASN 2 2HD2 ASN 2 -3.703 -3.240 -2.530 12 H GLU 3 HN GLU 3 0.380 -4.726 -3.772 13 HA GLU 3 HA GLU 3 2.788 -4.801 -4.967 14 HB2 GLU 3 2HB GLU 3 0.272 -6.351 -5.728 15 HB3 GLU 3 3HB GLU 3 1.889 -6.791 -6.241 16 HG2 GLU 3 2HG GLU 3 2.606 -7.217 -3.972 17 HG3 GLU 3 3HG GLU 3 1.191 -6.433 -3.297 18 H GLY 4 HN GLY 4 3.421 -4.976 -7.313 19 HA2 GLY 4 1HA GLY 4 3.469 -4.225 -9.436 20 HA3 GLY 4 2HA GLY 4 1.740 -3.950 -9.352 21 H ASP 5 HN ASP 5 4.140 -2.514 -7.096 22 HA ASP 5 HA ASP 5 3.430 0.066 -8.252 23 HB2 ASP 5 2HB ASP 5 3.758 -0.924 -5.453 24 HB3 ASP 5 3HB ASP 5 4.462 0.651 -5.759 25 H VAL 6 HN VAL 6 5.301 1.780 -7.661 26 HA VAL 6 HA VAL 6 7.908 0.449 -7.854 27 HB VAL 6 HB VAL 6 6.670 2.500 -9.653 28 HG11 VAL 6 1HG1 VAL 6 9.668 2.134 -9.355 29 HG12 VAL 6 2HG1 VAL 6 8.814 3.253 -10.445 30 HG13 VAL 6 3HG1 VAL 6 8.753 3.505 -8.684 31 HG21 VAL 6 3HG2 VAL 6 7.446 1.114 -11.404 32 HG22 VAL 6 1HG2 VAL 6 8.576 0.251 -10.334 33 HG23 VAL 6 2HG2 VAL 6 6.822 -0.001 -10.165 34 H TYR 7 HN TYR 7 9.645 1.577 -6.851 35 HA TYR 7 HA TYR 7 8.845 3.970 -5.352 36 HB2 TYR 7 2HB TYR 7 9.901 1.254 -4.521 37 HB3 TYR 7 3HB TYR 7 10.603 2.624 -3.686 38 HD1 TYR 7 HD1 TYR 7 9.090 4.188 -2.388 39 HD2 TYR 7 HD2 TYR 7 7.720 0.460 -3.977 40 HE1 TYR 7 HE1 TYR 7 7.096 4.241 -0.811 41 HE2 TYR 7 HE2 TYR 7 5.730 0.526 -2.396 42 HH TYR 7 HH TYR 7 5.493 1.926 0.142 43 H LYS 8 HN LYS 8 10.221 5.627 -5.740 44 HA LYS 8 HA LYS 8 12.948 4.900 -6.562 45 HB2 LYS 8 2HB LYS 8 11.907 5.808 -8.472 46 HB3 LYS 8 3HB LYS 8 11.084 7.054 -7.555 47 HG2 LYS 8 2HG LYS 8 14.099 7.001 -7.463 48 HG3 LYS 8 3HG LYS 8 13.338 7.566 -8.936 49 HD2 LYS 8 2HD LYS 8 12.210 8.686 -6.400 50 HD3 LYS 8 3HD LYS 8 13.854 9.169 -6.769 51 HE2 LYS 8 2HE LYS 8 12.512 10.818 -7.844 52 HE3 LYS 8 3HE LYS 8 12.998 9.752 -9.146 53 HZ1 LYS 8 2HZ LYS 8 10.848 9.270 -9.512 54 HZ3 LYS 8 1HZ LYS 8 10.397 10.348 -8.378 55 H CYS 9 HN CYS 9 14.619 5.713 -5.371 56 HA CYS 9 HA CYS 9 13.925 7.062 -2.959 57 HB2 CYS 9 2HB CYS 9 15.671 5.337 -2.989 58 HB3 CYS 9 3HB CYS 9 16.634 6.295 -4.097 59 H GLU 10 HN GLU 10 14.138 9.268 -2.520 60 HA GLU 10 HA GLU 10 14.736 10.903 -4.813 61 HB2 GLU 10 2HB GLU 10 13.278 11.248 -2.227 62 HB3 GLU 10 3HB GLU 10 14.070 12.683 -2.848 63 HG2 GLU 10 2HG GLU 10 12.585 11.139 -4.911 64 HG3 GLU 10 3HG GLU 10 11.568 11.779 -3.635 65 H LEU 11 HN LEU 11 16.923 9.410 -3.503 66 HA LEU 11 HA LEU 11 18.530 11.728 -2.703 67 HB2 LEU 11 2HB LEU 11 17.853 9.394 -1.133 68 HB3 LEU 11 3HB LEU 11 19.585 9.497 -1.378 69 HG LEU 11 HG LEU 11 18.503 12.089 -0.644 70 HD11 LEU 11 1HD1 LEU 11 17.538 9.736 0.878 71 HD12 LEU 11 2HD1 LEU 11 18.188 11.087 1.838 72 HD13 LEU 11 3HD1 LEU 11 16.844 11.365 0.704 73 HD21 LEU 11 3HD2 LEU 11 20.727 10.282 0.078 74 HD22 LEU 11 1HD2 LEU 11 20.707 12.040 -0.196 75 HD23 LEU 11 2HD2 LEU 11 20.175 11.377 1.368 76 H CYS 12 HN CYS 12 18.811 8.191 -3.514 77 HA CYS 12 HA CYS 12 21.150 8.877 -5.097 78 HB2 CYS 12 2HB CYS 12 21.444 6.394 -5.224 79 HB3 CYS 12 3HB CYS 12 21.580 7.097 -3.626 80 H GLY 13 HN GLY 13 17.895 7.306 -5.260 81 HA2 GLY 13 1HA GLY 13 16.545 7.851 -7.199 82 HA3 GLY 13 2HA GLY 13 17.975 7.667 -8.196 83 H GLN 14 HN GLN 14 17.639 5.445 -5.494 84 HA GLN 14 HA GLN 14 17.737 3.239 -7.154 85 HB2 GLN 14 2HB GLN 14 18.518 3.127 -4.854 86 HB3 GLN 14 3HB GLN 14 16.932 3.539 -4.231 87 HG2 GLN 14 2HG GLN 14 16.256 1.372 -4.301 88 HG3 GLN 14 3HG GLN 14 16.715 1.222 -5.986 89 HE21 GLN 14 1HE2 GLN 14 18.457 1.793 -2.927 90 HE22 GLN 14 2HE2 GLN 14 19.621 0.523 -3.097 91 H VAL 15 HN VAL 15 16.181 2.399 -8.467 92 HA VAL 15 HA VAL 15 13.393 2.917 -7.713 93 HB VAL 15 HB VAL 15 14.476 2.159 -10.426 94 HG11 VAL 15 1HG1 VAL 15 11.877 2.252 -9.431 95 HG12 VAL 15 2HG1 VAL 15 12.059 3.792 -10.303 96 HG13 VAL 15 3HG1 VAL 15 12.357 2.252 -11.144 97 HG21 VAL 15 3HG2 VAL 15 14.018 4.708 -10.848 98 HG22 VAL 15 1HG2 VAL 15 14.285 4.847 -9.094 99 HG23 VAL 15 2HG2 VAL 15 15.564 4.184 -10.138 100 H VAL 16 HN VAL 16 12.295 1.227 -6.874 101 HA VAL 16 HA VAL 16 13.056 -1.445 -7.812 102 HB VAL 16 HB VAL 16 13.253 -2.295 -5.710 103 HG11 VAL 16 1HG1 VAL 16 14.674 -0.872 -4.374 104 HG12 VAL 16 2HG1 VAL 16 15.014 -0.567 -6.094 105 HG13 VAL 16 3HG1 VAL 16 14.030 0.588 -5.163 106 HG21 VAL 16 3HG2 VAL 16 11.667 0.032 -4.571 107 HG22 VAL 16 1HG2 VAL 16 11.011 -1.577 -4.952 108 HG23 VAL 16 2HG2 VAL 16 12.242 -1.397 -3.680 109 H LYS 17 HN LYS 17 11.335 -2.806 -8.270 110 HA LYS 17 HA LYS 17 8.719 -1.524 -8.100 111 HB2 LYS 17 2HB LYS 17 9.380 -2.190 -10.319 112 HB3 LYS 17 3HB LYS 17 9.780 -3.809 -9.782 113 HG2 LYS 17 2HG LYS 17 6.987 -2.815 -9.240 114 HG3 LYS 17 3HG LYS 17 7.393 -3.219 -10.895 115 HD2 LYS 17 2HD LYS 17 8.409 -5.427 -9.727 116 HD3 LYS 17 3HD LYS 17 7.247 -5.018 -8.481 117 HE2 LYS 17 2HE LYS 17 5.525 -5.792 -9.742 118 HE3 LYS 17 3HE LYS 17 5.974 -4.754 -11.082 119 HZ1 LYS 17 2HZ LYS 17 6.481 -7.546 -10.759 120 HZ3 LYS 17 1HZ LYS 17 7.860 -6.751 -11.101 121 H VAL 18 HN VAL 18 7.441 -2.022 -6.409 122 HA VAL 18 HA VAL 18 8.074 -4.127 -4.656 123 HB VAL 18 HB VAL 18 5.703 -2.303 -5.018 124 HG11 VAL 18 1HG1 VAL 18 4.709 -4.239 -4.073 125 HG12 VAL 18 2HG1 VAL 18 6.092 -4.516 -2.987 126 HG13 VAL 18 3HG1 VAL 18 5.006 -3.132 -2.712 127 HG21 VAL 18 3HG2 VAL 18 7.533 -2.402 -2.632 128 HG22 VAL 18 1HG2 VAL 18 8.057 -1.586 -4.124 129 HG23 VAL 18 2HG2 VAL 18 6.586 -1.042 -3.282 130 H LEU 19 HN LEU 19 7.772 -6.269 -4.940 131 HA LEU 19 HA LEU 19 5.890 -7.100 -6.995 132 HB2 LEU 19 2HB LEU 19 7.799 -8.234 -7.393 133 HB3 LEU 19 3HB LEU 19 8.313 -8.210 -5.717 134 HG LEU 19 HG LEU 19 6.800 -10.036 -5.172 135 HD11 LEU 19 1HD1 LEU 19 5.195 -10.924 -6.529 136 HD12 LEU 19 2HD1 LEU 19 5.175 -9.241 -7.109 137 HD13 LEU 19 3HD1 LEU 19 6.052 -10.488 -8.027 138 HD21 LEU 19 3HD2 LEU 19 8.561 -10.539 -7.582 139 HD22 LEU 19 1HD2 LEU 19 8.992 -10.691 -5.861 140 HD23 LEU 19 2HD2 LEU 19 7.829 -11.824 -6.592 141 H GLU 20 HN GLU 20 6.739 -8.068 -3.591 142 HA GLU 20 HA GLU 20 3.886 -8.571 -3.251 143 HB2 GLU 20 2HB GLU 20 6.271 -10.252 -2.541 144 HB3 GLU 20 3HB GLU 20 4.930 -10.256 -1.412 145 HG2 GLU 20 2HG GLU 20 3.530 -10.569 -3.728 146 HG3 GLU 20 3HG GLU 20 5.048 -11.288 -4.230 147 H GLU 21 HN GLU 21 3.417 -6.555 -2.287 148 HA GLU 21 HA GLU 21 5.073 -5.404 -0.368 149 HB2 GLU 21 2HB GLU 21 3.335 -4.212 -1.752 150 HB3 GLU 21 3HB GLU 21 2.084 -4.969 -0.787 151 HG2 GLU 21 2HG GLU 21 4.237 -3.571 0.754 152 HG3 GLU 21 3HG GLU 21 3.193 -2.534 -0.197 153 H GLY 22 HN GLY 22 4.574 -5.059 1.973 154 HA2 GLY 22 1HA GLY 22 3.033 -7.305 3.124 155 HA3 GLY 22 2HA GLY 22 4.630 -6.877 3.701 156 H GLY 23 HN GLY 23 4.939 -5.046 5.037 157 HA2 GLY 23 1HA GLY 23 2.823 -3.138 5.432 158 HA3 GLY 23 2HA GLY 23 2.976 -4.279 6.752 159 H GLY 24 HN GLY 24 5.327 -2.545 4.576 160 HA2 GLY 24 1HA GLY 24 6.433 -1.123 6.851 161 HA3 GLY 24 2HA GLY 24 7.480 -2.346 6.159 162 H THR 25 HN THR 25 8.573 0.051 5.964 163 HA THR 25 HA THR 25 7.931 0.980 3.241 164 HB THR 25 HB THR 25 7.687 2.435 5.552 165 HG1 THR 25 HG1 THR 25 8.836 3.912 3.466 166 HG21 THR 25 3HG2 THR 25 10.505 2.909 4.444 167 HG22 THR 25 1HG2 THR 25 9.647 4.028 5.530 168 HG23 THR 25 2HG2 THR 25 10.103 2.406 6.103 169 H LEU 26 HN LEU 26 9.942 2.152 2.244 170 HA LEU 26 HA LEU 26 12.231 0.376 2.741 171 HB2 LEU 26 2HB LEU 26 11.686 1.707 0.110 172 HB3 LEU 26 3HB LEU 26 12.695 0.319 0.461 173 HG LEU 26 HG LEU 26 9.713 0.171 0.861 174 HD11 LEU 26 1HD1 LEU 26 9.792 -0.908 -1.520 175 HD12 LEU 26 2HD1 LEU 26 9.641 0.855 -1.338 176 HD13 LEU 26 3HD1 LEU 26 11.218 0.134 -1.733 177 HD21 LEU 26 3HD2 LEU 26 11.967 -1.788 0.531 178 HD22 LEU 26 1HD2 LEU 26 10.695 -1.715 1.774 179 HD23 LEU 26 2HD2 LEU 26 10.299 -2.255 0.124 180 H VAL 27 HN VAL 27 12.846 1.953 4.440 181 HA VAL 27 HA VAL 27 13.401 4.632 3.707 182 HB VAL 27 HB VAL 27 14.282 2.904 6.026 183 HG11 VAL 27 1HG1 VAL 27 15.342 4.669 7.008 184 HG12 VAL 27 2HG1 VAL 27 15.615 5.121 5.308 185 HG13 VAL 27 3HG1 VAL 27 14.294 5.879 6.228 186 HG21 VAL 27 3HG2 VAL 27 11.803 4.233 5.370 187 HG22 VAL 27 1HG2 VAL 27 12.195 3.190 6.758 188 HG23 VAL 27 2HG2 VAL 27 12.504 4.940 6.845 189 H CYS 28 HN CYS 28 14.857 5.084 2.120 190 HA CYS 28 HA CYS 28 17.410 3.655 2.296 191 HB2 CYS 28 2HB CYS 28 16.092 3.022 0.304 192 HB3 CYS 28 3HB CYS 28 16.063 4.700 -0.203 193 H CYS 29 HN CYS 29 19.254 4.978 2.371 194 HA CYS 29 HA CYS 29 20.479 6.792 2.521 195 HB2 CYS 29 2HB CYS 29 18.345 7.871 0.704 196 HB3 CYS 29 3HB CYS 29 19.587 8.931 1.338 197 H GLY 30 HN GLY 30 18.129 6.051 4.362 198 HA2 GLY 30 1HA GLY 30 17.459 6.830 6.379 199 HA3 GLY 30 2HA GLY 30 18.355 8.311 6.108 200 H GLU 31 HN GLU 31 16.205 7.378 3.513 201 HA GLU 31 HA GLU 31 14.120 9.074 4.610 202 HB2 GLU 31 2HB GLU 31 15.843 10.177 2.872 203 HB3 GLU 31 3HB GLU 31 14.817 9.379 1.696 204 HG2 GLU 31 2HG GLU 31 13.088 10.637 3.625 205 HG3 GLU 31 3HG GLU 31 14.304 11.814 3.170 206 H ASP 32 HN ASP 32 12.059 8.283 4.243 207 HA ASP 32 HA ASP 32 11.791 5.702 3.327 208 HB2 ASP 32 2HB ASP 32 9.514 7.702 3.225 209 HB3 ASP 32 3HB ASP 32 9.449 6.008 3.666 210 H MET 33 HN MET 33 12.052 5.044 1.187 211 HA MET 33 HA MET 33 12.323 6.570 -0.964 212 HB2 MET 33 2HB MET 33 12.298 3.913 -0.540 213 HB3 MET 33 3HB MET 33 10.686 4.020 -1.218 214 HG2 MET 33 2HG MET 33 11.470 4.735 -3.334 215 HG3 MET 33 3HG MET 33 12.973 5.359 -2.683 216 HE1 MET 33 3HE MET 33 15.062 2.287 -1.889 217 HE2 MET 33 1HE MET 33 14.570 3.919 -1.378 218 HE3 MET 33 2HE MET 33 13.723 2.493 -0.733 219 H VAL 34 HN VAL 34 10.957 7.156 -2.833 220 HA VAL 34 HA VAL 34 8.268 7.859 -1.929 221 HB VAL 34 HB VAL 34 8.350 9.637 -3.403 222 HG11 VAL 34 1HG1 VAL 34 10.276 9.462 -1.547 223 HG12 VAL 34 2HG1 VAL 34 11.304 9.604 -2.993 224 HG13 VAL 34 3HG1 VAL 34 10.106 10.868 -2.624 225 HG21 VAL 34 3HG2 VAL 34 9.910 7.822 -5.054 226 HG22 VAL 34 1HG2 VAL 34 8.936 9.237 -5.522 227 HG23 VAL 34 2HG2 VAL 34 10.630 9.450 -5.016 228 H LYS 35 HN LYS 35 6.495 7.726 -3.613 229 HA LYS 35 HA LYS 35 6.743 5.145 -4.940 230 HB2 LYS 35 2HB LYS 35 4.804 6.098 -3.320 231 HB3 LYS 35 3HB LYS 35 4.154 6.608 -4.864 232 HG2 LYS 35 2HG LYS 35 3.363 4.491 -5.103 233 HG3 LYS 35 3HG LYS 35 5.020 4.000 -5.394 234 HD2 LYS 35 2HD LYS 35 4.977 2.764 -3.497 235 HD3 LYS 35 3HD LYS 35 4.762 4.229 -2.559 236 HE2 LYS 35 2HE LYS 35 2.201 3.835 -3.555 237 HE3 LYS 35 3HE LYS 35 2.754 2.183 -3.354 238 HZ1 LYS 35 2HZ LYS 35 2.599 4.273 -1.263 239 HZ3 LYS 35 1HZ LYS 35 3.455 2.908 -1.034 240 H GLN 36 HN GLN 36 6.024 4.866 -7.174 241 HA GLN 36 HA GLN 36 6.285 7.361 -8.664 242 HB2 GLN 36 2HB GLN 36 7.260 4.605 -9.533 243 HB3 GLN 36 3HB GLN 36 7.438 6.092 -10.443 244 HG2 GLN 36 2HG GLN 36 8.557 5.785 -7.625 245 HG3 GLN 36 3HG GLN 36 9.476 5.319 -9.042 246 HE21 GLN 36 1HE2 GLN 36 8.144 7.910 -7.174 247 HE22 GLN 36 2HE2 GLN 36 8.914 9.237 -7.978 248 H1 ALA 1 HN ALA 1 23.797 -1.890 -3.909 249 HA ALA 1 HA ALA 1 23.069 -4.683 -4.448 250 HB1 ALA 1 1HB ALA 1 21.027 -4.073 -3.747 251 HB2 ALA 1 2HB ALA 1 21.611 -2.416 -3.457 252 HB3 ALA 1 3HB ALA 1 20.948 -2.860 -5.048 253 H ASN 2 HN ASN 2 22.008 -5.048 -6.625 254 HA ASN 2 HA ASN 2 23.005 -3.154 -8.589 255 HB2 ASN 2 2HB ASN 2 23.235 -6.195 -8.875 256 HB3 ASN 2 3HB ASN 2 23.839 -4.999 -10.005 257 HD21 ASN 2 1HD2 ASN 2 25.879 -4.478 -9.870 258 HD22 ASN 2 2HD2 ASN 2 26.920 -4.647 -8.496 259 H GLU 3 HN GLU 3 21.716 -3.193 -10.605 260 HA GLU 3 HA GLU 3 19.054 -3.526 -10.256 261 HB2 GLU 3 2HB GLU 3 20.645 -3.694 -12.854 262 HB3 GLU 3 3HB GLU 3 18.912 -3.449 -12.769 263 HG2 GLU 3 2HG GLU 3 19.175 -1.318 -11.634 264 HG3 GLU 3 3HG GLU 3 20.880 -1.603 -11.350 265 H GLY 4 HN GLY 4 17.508 -5.073 -11.369 266 HA2 GLY 4 1HA GLY 4 16.744 -7.145 -11.792 267 HA3 GLY 4 2HA GLY 4 18.363 -7.596 -12.292 268 H ASP 5 HN ASP 5 17.663 -6.264 -9.049 269 HA ASP 5 HA ASP 5 18.384 -8.880 -7.995 270 HB2 ASP 5 2HB ASP 5 18.933 -6.056 -7.189 271 HB3 ASP 5 3HB ASP 5 18.569 -7.139 -5.860 272 H VAL 6 HN VAL 6 17.345 -9.218 -5.655 273 HA VAL 6 HA VAL 6 14.660 -8.049 -5.580 274 HB VAL 6 HB VAL 6 15.466 -10.928 -5.685 275 HG11 VAL 6 1HG1 VAL 6 12.933 -9.935 -4.338 276 HG12 VAL 6 2HG1 VAL 6 13.378 -11.630 -4.647 277 HG13 VAL 6 3HG1 VAL 6 14.330 -10.654 -3.503 278 HG21 VAL 6 3HG2 VAL 6 13.203 -10.948 -6.951 279 HG22 VAL 6 1HG2 VAL 6 13.364 -9.175 -6.955 280 HG23 VAL 6 2HG2 VAL 6 14.610 -10.184 -7.730 281 H TYR 7 HN TYR 7 13.976 -7.461 -3.537 282 HA TYR 7 HA TYR 7 15.743 -8.260 -1.325 283 HB2 TYR 7 2HB TYR 7 14.676 -5.618 -2.373 284 HB3 TYR 7 3HB TYR 7 14.755 -5.781 -0.630 285 HD1 TYR 7 HD1 TYR 7 17.015 -6.346 0.437 286 HD2 TYR 7 HD2 TYR 7 16.610 -5.101 -3.636 287 HE1 TYR 7 HE1 TYR 7 19.478 -5.716 0.378 288 HE2 TYR 7 HE2 TYR 7 19.074 -4.475 -3.682 289 HH TYR 7 HH TYR 7 20.791 -3.764 -1.483 290 H LYS 8 HN LYS 8 14.667 -9.346 0.240 291 HA LYS 8 HA LYS 8 11.793 -8.780 0.487 292 HB2 LYS 8 2HB LYS 8 12.117 -10.987 -0.439 293 HB3 LYS 8 3HB LYS 8 13.285 -11.398 0.801 294 HG2 LYS 8 2HG LYS 8 10.722 -10.445 1.928 295 HG3 LYS 8 3HG LYS 8 10.526 -11.867 0.923 296 HD2 LYS 8 2HD LYS 8 12.865 -12.029 2.742 297 HD3 LYS 8 3HD LYS 8 11.339 -11.874 3.588 298 HE2 LYS 8 2HE LYS 8 10.732 -13.750 1.610 299 HE3 LYS 8 3HE LYS 8 12.391 -14.150 2.007 300 HZ1 LYS 8 2HZ LYS 8 11.617 -14.077 4.420 301 HZ3 LYS 8 1HZ LYS 8 11.061 -15.330 3.543 302 H CYS 9 HN CYS 9 11.041 -8.168 2.477 303 HA CYS 9 HA CYS 9 12.996 -7.500 4.420 304 HB2 CYS 9 2HB CYS 9 11.061 -6.060 4.042 305 HB3 CYS 9 3HB CYS 9 9.965 -7.349 4.500 306 H GLU 10 HN GLU 10 13.405 -8.536 6.423 307 HA GLU 10 HA GLU 10 12.447 -11.250 6.523 308 HB2 GLU 10 2HB GLU 10 14.756 -9.728 7.637 309 HB3 GLU 10 3HB GLU 10 14.138 -10.998 8.674 310 HG2 GLU 10 2HG GLU 10 14.487 -11.701 5.776 311 HG3 GLU 10 3HG GLU 10 15.957 -11.446 6.695 312 H LEU 11 HN LEU 11 10.479 -9.192 7.020 313 HA LEU 11 HA LEU 11 9.758 -9.973 9.726 314 HB2 LEU 11 2HB LEU 11 10.887 -7.891 10.086 315 HB3 LEU 11 3HB LEU 11 10.001 -7.116 8.789 316 HG LEU 11 HG LEU 11 7.985 -7.071 10.030 317 HD11 LEU 11 1HD1 LEU 11 8.096 -8.113 12.460 318 HD12 LEU 11 2HD1 LEU 11 7.633 -9.088 11.045 319 HD13 LEU 11 3HD1 LEU 11 9.289 -9.187 11.689 320 HD21 LEU 11 3HD2 LEU 11 8.769 -5.296 11.102 321 HD22 LEU 11 1HD2 LEU 11 9.273 -6.359 12.437 322 HD23 LEU 11 2HD2 LEU 11 10.412 -5.981 11.122 323 H CYS 12 HN CYS 12 8.481 -7.520 7.390 324 HA CYS 12 HA CYS 12 5.895 -8.675 7.602 325 HB2 CYS 12 2HB CYS 12 5.303 -6.962 5.873 326 HB3 CYS 12 3HB CYS 12 5.967 -6.339 7.370 327 H GLY 13 HN GLY 13 8.597 -8.598 5.218 328 HA2 GLY 13 1HA GLY 13 9.019 -10.523 3.885 329 HA3 GLY 13 2HA GLY 13 7.297 -10.831 3.794 330 H GLN 14 HN GLN 14 8.336 -7.476 3.569 331 HA GLN 14 HA GLN 14 7.110 -7.132 1.125 332 HB2 GLN 14 2HB GLN 14 7.446 -5.264 2.637 333 HB3 GLN 14 3HB GLN 14 9.187 -5.464 2.600 334 HG2 GLN 14 2HG GLN 14 9.367 -4.194 0.728 335 HG3 GLN 14 3HG GLN 14 8.193 -5.180 -0.122 336 HE21 GLN 14 1HE2 GLN 14 8.005 -3.128 2.783 337 HE22 GLN 14 2HE2 GLN 14 6.720 -2.101 2.244 338 H VAL 15 HN VAL 15 7.723 -8.124 -0.755 339 HA VAL 15 HA VAL 15 10.601 -8.364 -1.254 340 HB VAL 15 HB VAL 15 8.217 -9.834 -2.397 341 HG11 VAL 15 1HG1 VAL 15 10.483 -9.360 -3.790 342 HG12 VAL 15 2HG1 VAL 15 10.978 -10.817 -2.893 343 HG13 VAL 15 3HG1 VAL 15 9.535 -10.860 -3.935 344 HG21 VAL 15 3HG2 VAL 15 8.476 -11.318 -0.752 345 HG22 VAL 15 1HG2 VAL 15 10.212 -11.483 -1.112 346 HG23 VAL 15 2HG2 VAL 15 9.651 -10.215 0.003 347 H VAL 16 HN VAL 16 11.468 -6.838 -2.551 348 HA VAL 16 HA VAL 16 9.751 -5.805 -4.698 349 HB VAL 16 HB VAL 16 10.419 -3.620 -4.301 350 HG11 VAL 16 1HG1 VAL 16 9.121 -4.989 -2.319 351 HG12 VAL 16 2HG1 VAL 16 10.450 -4.230 -1.412 352 HG13 VAL 16 3HG1 VAL 16 9.333 -3.222 -2.365 353 HG21 VAL 16 3HG2 VAL 16 12.770 -4.871 -2.978 354 HG22 VAL 16 1HG2 VAL 16 12.667 -3.438 -4.030 355 HG23 VAL 16 2HG2 VAL 16 12.218 -3.315 -2.313 356 H LYS 17 HN LYS 17 10.694 -5.715 -6.721 357 HA LYS 17 HA LYS 17 13.384 -6.847 -6.854 358 HB2 LYS 17 2HB LYS 17 11.353 -7.880 -8.043 359 HB3 LYS 17 3HB LYS 17 11.439 -6.519 -9.143 360 HG2 LYS 17 2HG LYS 17 13.937 -8.136 -8.558 361 HG3 LYS 17 3HG LYS 17 12.757 -8.746 -9.701 362 HD2 LYS 17 2HD LYS 17 13.030 -6.091 -10.506 363 HD3 LYS 17 3HD LYS 17 14.654 -6.482 -9.978 364 HE2 LYS 17 2HE LYS 17 13.025 -8.146 -11.959 365 HE3 LYS 17 3HE LYS 17 14.268 -6.997 -12.410 366 HZ1 LYS 17 2HZ LYS 17 14.589 -9.605 -11.119 367 HZ3 LYS 17 1HZ LYS 17 15.676 -8.455 -10.739 368 H VAL 18 HN VAL 18 15.044 -5.451 -7.036 369 HA VAL 18 HA VAL 18 14.554 -2.735 -7.752 370 HB VAL 18 HB VAL 18 17.095 -4.299 -7.255 371 HG11 VAL 18 1HG1 VAL 18 16.741 -1.688 -8.363 372 HG12 VAL 18 2HG1 VAL 18 17.398 -1.509 -6.719 373 HG13 VAL 18 3HG1 VAL 18 18.253 -2.514 -7.914 374 HG21 VAL 18 3HG2 VAL 18 15.341 -2.592 -5.468 375 HG22 VAL 18 1HG2 VAL 18 15.793 -4.302 -5.262 376 HG23 VAL 18 2HG2 VAL 18 17.018 -3.027 -5.058 377 H LEU 19 HN LEU 19 14.784 -1.736 -9.714 378 HA LEU 19 HA LEU 19 15.879 -3.403 -11.871 379 HB2 LEU 19 2HB LEU 19 14.227 -1.898 -13.259 380 HB3 LEU 19 3HB LEU 19 13.726 -3.408 -12.523 381 HG LEU 19 HG LEU 19 12.108 -1.520 -12.271 382 HD11 LEU 19 1HD1 LEU 19 11.372 -2.207 -10.189 383 HD12 LEU 19 2HD1 LEU 19 12.420 -3.558 -10.684 384 HD13 LEU 19 3HD1 LEU 19 13.020 -2.343 -9.530 385 HD21 LEU 19 3HD2 LEU 19 13.184 0.451 -11.904 386 HD22 LEU 19 1HD2 LEU 19 12.836 0.008 -10.216 387 HD23 LEU 19 2HD2 LEU 19 14.452 -0.293 -10.899 388 H GLU 20 HN GLU 20 16.245 -0.665 -9.914 389 HA GLU 20 HA GLU 20 18.161 0.371 -11.805 390 HB2 GLU 20 2HB GLU 20 15.773 1.604 -11.815 391 HB3 GLU 20 3HB GLU 20 16.442 2.411 -10.411 392 HG2 GLU 20 2HG GLU 20 18.259 3.341 -11.652 393 HG3 GLU 20 3HG GLU 20 18.065 2.202 -12.970 394 H GLU 21 HN GLU 21 20.020 0.134 -10.630 395 HA GLU 21 HA GLU 21 19.964 0.185 -7.819 396 HB2 GLU 21 2HB GLU 21 22.399 -0.124 -7.988 397 HB3 GLU 21 3HB GLU 21 21.574 -1.183 -9.115 398 HG2 GLU 21 2HG GLU 21 21.980 0.478 -10.955 399 HG3 GLU 21 3HG GLU 21 22.834 1.509 -9.824 400 H GLY 22 HN GLY 22 21.361 1.679 -6.457 401 HA2 GLY 22 1HA GLY 22 21.673 4.354 -7.639 402 HA3 GLY 22 2HA GLY 22 20.666 4.156 -6.219 403 H GLY 23 HN GLY 23 21.607 4.095 -4.191 404 HA2 GLY 23 1HA GLY 23 24.257 3.172 -3.740 405 HA3 GLY 23 2HA GLY 23 24.219 4.923 -3.811 406 H GLY 24 HN GLY 24 21.798 2.516 -2.563 407 HA2 GLY 24 1HA GLY 24 22.303 3.300 0.174 408 HA3 GLY 24 2HA GLY 24 20.790 3.897 -0.480 409 H THR 25 HN THR 25 20.245 2.328 1.515 410 HA THR 25 HA THR 25 19.764 -0.343 0.361 411 HB THR 25 HB THR 25 21.321 0.245 2.554 412 HG1 THR 25 HG1 THR 25 21.171 -1.878 1.772 413 HG21 THR 25 3HG2 THR 25 18.890 0.915 3.599 414 HG22 THR 25 1HG2 THR 25 18.832 -0.848 3.836 415 HG23 THR 25 2HG2 THR 25 20.149 0.105 4.561 416 H LEU 26 HN LEU 26 17.822 -1.442 1.577 417 HA LEU 26 HA LEU 26 15.682 0.571 1.597 418 HB2 LEU 26 2HB LEU 26 15.205 -2.324 1.019 419 HB3 LEU 26 3HB LEU 26 14.258 -0.923 0.562 420 HG LEU 26 HG LEU 26 17.010 -1.353 -0.586 421 HD11 LEU 26 1HD1 LEU 26 15.470 -3.407 -0.839 422 HD12 LEU 26 2HD1 LEU 26 14.538 -2.384 -1.960 423 HD13 LEU 26 3HD1 LEU 26 16.250 -2.741 -2.293 424 HD21 LEU 26 3HD2 LEU 26 16.048 0.834 -0.941 425 HD22 LEU 26 1HD2 LEU 26 16.059 -0.068 -2.476 426 HD23 LEU 26 2HD2 LEU 26 14.543 0.112 -1.560 427 H VAL 27 HN VAL 27 16.252 0.943 3.896 428 HA VAL 27 HA VAL 27 16.041 -1.191 5.743 429 HB VAL 27 HB VAL 27 15.938 1.816 6.019 430 HG11 VAL 27 1HG1 VAL 27 14.765 0.731 7.902 431 HG12 VAL 27 2HG1 VAL 27 16.206 -0.265 8.215 432 HG13 VAL 27 3HG1 VAL 27 16.284 1.502 8.415 433 HG21 VAL 27 3HG2 VAL 27 18.124 1.568 5.544 434 HG22 VAL 27 1HG2 VAL 27 18.255 0.932 7.201 435 HG23 VAL 27 2HG2 VAL 27 18.088 -0.189 5.828 436 H CYS 28 HN CYS 28 14.178 -2.348 5.921 437 HA CYS 28 HA CYS 28 11.709 -0.774 6.047 438 HB2 CYS 28 2HB CYS 28 11.886 -2.243 4.052 439 HB3 CYS 28 3HB CYS 28 12.019 -3.634 5.111 440 H CYS 29 HN CYS 29 10.498 -1.016 7.935 441 HA CYS 29 HA CYS 29 9.944 -1.650 9.959 442 HB2 CYS 29 2HB CYS 29 11.046 -4.307 9.045 443 HB3 CYS 29 3HB CYS 29 10.315 -4.075 10.621 444 H GLY 30 HN GLY 30 12.595 -0.430 9.304 445 HA2 GLY 30 1HA GLY 30 14.388 0.258 10.484 446 HA3 GLY 30 2HA GLY 30 13.795 -0.633 11.871 447 H GLU 31 HN GLU 31 14.106 -2.456 8.889 448 HA GLU 31 HA GLU 31 16.727 -3.384 9.727 449 HB2 GLU 31 2HB GLU 31 14.861 -4.898 10.608 450 HB3 GLU 31 3HB GLU 31 14.479 -5.283 8.942 451 HG2 GLU 31 2HG GLU 31 16.802 -6.119 8.587 452 HG3 GLU 31 3HG GLU 31 17.214 -5.703 10.239 453 H ASP 32 HN ASP 32 18.140 -3.493 8.022 454 HA ASP 32 HA ASP 32 17.377 -2.606 5.539 455 HB2 ASP 32 2HB ASP 32 19.660 -2.400 5.825 456 HB3 ASP 32 3HB ASP 32 19.781 -3.875 6.763 457 H MET 33 HN MET 33 16.105 -3.700 4.036 458 HA MET 33 HA MET 33 15.238 -6.224 4.240 459 HB2 MET 33 2HB MET 33 14.807 -4.201 2.506 460 HB3 MET 33 3HB MET 33 15.891 -5.125 1.485 461 HG2 MET 33 2HG MET 33 14.416 -6.979 1.361 462 HG3 MET 33 3HG MET 33 13.573 -6.539 2.833 463 HE1 MET 33 3HE MET 33 12.780 -4.153 3.092 464 HE2 MET 33 1HE MET 33 13.090 -3.009 1.764 465 HE3 MET 33 2HE MET 33 11.443 -3.625 2.044 466 H VAL 34 HN VAL 34 15.758 -8.288 3.259 467 HA VAL 34 HA VAL 34 18.632 -8.588 2.868 468 HB VAL 34 HB VAL 34 18.395 -10.736 3.603 469 HG11 VAL 34 1HG1 VAL 34 17.404 -10.564 5.648 470 HG12 VAL 34 2HG1 VAL 34 17.287 -8.853 5.168 471 HG13 VAL 34 3HG1 VAL 34 15.881 -9.928 4.982 472 HG21 VAL 34 3HG2 VAL 34 16.045 -11.876 3.599 473 HG22 VAL 34 1HG2 VAL 34 15.642 -10.632 2.392 474 HG23 VAL 34 2HG2 VAL 34 16.975 -11.772 2.085 475 H LYS 35 HN LYS 35 19.399 -10.036 1.096 476 HA LYS 35 HA LYS 35 17.891 -9.423 -1.310 477 HB2 LYS 35 2HB LYS 35 20.413 -8.982 -0.939 478 HB3 LYS 35 3HB LYS 35 20.620 -10.705 -1.179 479 HG2 LYS 35 2HG LYS 35 18.923 -9.241 -3.188 480 HG3 LYS 35 3HG LYS 35 20.649 -8.937 -3.231 481 HD2 LYS 35 2HD LYS 35 21.133 -11.323 -3.511 482 HD3 LYS 35 3HD LYS 35 19.452 -11.745 -3.246 483 HE2 LYS 35 2HE LYS 35 18.761 -10.877 -5.344 484 HE3 LYS 35 3HE LYS 35 20.164 -9.837 -5.492 485 HZ1 LYS 35 2HZ LYS 35 21.537 -11.835 -5.799 486 HZ3 LYS 35 1HZ LYS 35 20.361 -11.792 -6.925 487 H GLN 36 HN GLN 36 17.265 -11.032 -2.854 488 HA GLN 36 HA GLN 36 17.096 -13.678 -1.634 489 HB2 GLN 36 2HB GLN 36 15.153 -12.472 -3.650 490 HB3 GLN 36 3HB GLN 36 14.965 -13.989 -2.792 491 HG2 GLN 36 2HG GLN 36 15.267 -11.358 -1.292 492 HG3 GLN 36 3HG GLN 36 13.704 -11.897 -1.871 493 HE21 GLN 36 1HE2 GLN 36 16.391 -12.559 0.259 494 HE22 GLN 36 2HE2 GLN 36 15.605 -13.694 1.306 Start of MODEL 14 1 H1 ALA 1 HN ALA 1 3.632 -2.063 0.272 2 HA ALA 1 HA ALA 1 1.991 0.223 0.223 3 HB1 ALA 1 1HB ALA 1 4.419 -0.027 -0.519 4 HB2 ALA 1 2HB ALA 1 3.797 -0.805 -1.994 5 HB3 ALA 1 3HB ALA 1 3.362 0.881 -1.626 6 H ASN 2 HN ASN 2 2.456 -2.270 -2.386 7 HA ASN 2 HA ASN 2 -0.061 -3.094 -2.661 8 HB2 ASN 2 2HB ASN 2 0.218 -0.303 -3.647 9 HB3 ASN 2 3HB ASN 2 -0.445 -1.388 -4.853 10 HD21 ASN 2 1HD2 ASN 2 -1.559 0.825 -3.144 11 HD22 ASN 2 2HD2 ASN 2 -2.987 0.179 -2.408 12 H GLU 3 HN GLU 3 0.431 -4.879 -3.945 13 HA GLU 3 HA GLU 3 2.692 -5.244 -5.316 14 HB2 GLU 3 2HB GLU 3 -0.056 -6.364 -6.027 15 HB3 GLU 3 3HB GLU 3 1.467 -7.032 -6.581 16 HG2 GLU 3 2HG GLU 3 1.997 -7.926 -4.511 17 HG3 GLU 3 3HG GLU 3 1.245 -6.614 -3.626 18 H GLY 4 HN GLY 4 3.357 -5.161 -7.569 19 HA2 GLY 4 1HA GLY 4 3.463 -4.299 -9.645 20 HA3 GLY 4 2HA GLY 4 1.734 -4.018 -9.590 21 H ASP 5 HN ASP 5 4.093 -2.717 -7.211 22 HA ASP 5 HA ASP 5 3.433 -0.076 -8.256 23 HB2 ASP 5 2HB ASP 5 3.788 -1.170 -5.470 24 HB3 ASP 5 3HB ASP 5 4.294 0.484 -5.751 25 H VAL 6 HN VAL 6 5.273 1.595 -7.718 26 HA VAL 6 HA VAL 6 7.889 0.267 -7.723 27 HB VAL 6 HB VAL 6 6.677 2.105 -9.718 28 HG11 VAL 6 1HG1 VAL 6 9.013 2.841 -10.401 29 HG12 VAL 6 2HG1 VAL 6 8.348 3.605 -8.937 30 HG13 VAL 6 3HG1 VAL 6 9.554 2.304 -8.792 31 HG21 VAL 6 3HG2 VAL 6 8.054 0.795 -11.266 32 HG22 VAL 6 1HG2 VAL 6 8.817 -0.043 -9.893 33 HG23 VAL 6 2HG2 VAL 6 7.082 -0.269 -10.220 34 H TYR 7 HN TYR 7 9.591 1.480 -6.728 35 HA TYR 7 HA TYR 7 8.679 3.889 -5.316 36 HB2 TYR 7 2HB TYR 7 9.817 1.236 -4.407 37 HB3 TYR 7 3HB TYR 7 10.488 2.646 -3.611 38 HD1 TYR 7 HD1 TYR 7 9.068 4.085 -2.188 39 HD2 TYR 7 HD2 TYR 7 7.527 0.531 -4.002 40 HE1 TYR 7 HE1 TYR 7 7.075 4.135 -0.610 41 HE2 TYR 7 HE2 TYR 7 5.540 0.592 -2.419 42 HH TYR 7 HH TYR 7 5.485 2.338 0.336 43 H LYS 8 HN LYS 8 10.050 5.596 -5.529 44 HA LYS 8 HA LYS 8 12.767 4.966 -6.457 45 HB2 LYS 8 2HB LYS 8 11.925 5.997 -8.316 46 HB3 LYS 8 3HB LYS 8 10.745 6.930 -7.419 47 HG2 LYS 8 2HG LYS 8 12.390 8.509 -8.180 48 HG3 LYS 8 3HG LYS 8 12.682 8.303 -6.464 49 HD2 LYS 8 2HD LYS 8 14.709 7.251 -6.789 50 HD3 LYS 8 3HD LYS 8 14.157 6.387 -8.209 51 HE2 LYS 8 2HE LYS 8 15.834 7.993 -8.931 52 HE3 LYS 8 3HE LYS 8 14.280 8.548 -9.523 53 HZ1 LYS 8 2HZ LYS 8 15.744 10.253 -8.343 54 HZ3 LYS 8 1HZ LYS 8 15.354 9.521 -6.942 55 H CYS 9 HN CYS 9 14.485 5.920 -5.387 56 HA CYS 9 HA CYS 9 13.826 7.039 -2.833 57 HB2 CYS 9 2HB CYS 9 15.646 5.400 -3.047 58 HB3 CYS 9 3HB CYS 9 16.518 6.477 -4.121 59 H GLU 10 HN GLU 10 14.362 9.201 -2.149 60 HA GLU 10 HA GLU 10 14.638 11.011 -4.402 61 HB2 GLU 10 2HB GLU 10 13.598 11.392 -1.568 62 HB3 GLU 10 3HB GLU 10 13.888 12.742 -2.647 63 HG2 GLU 10 2HG GLU 10 12.367 10.659 -4.025 64 HG3 GLU 10 3HG GLU 10 11.568 11.101 -2.528 65 H LEU 11 HN LEU 11 16.946 9.524 -3.414 66 HA LEU 11 HA LEU 11 18.559 11.815 -2.597 67 HB2 LEU 11 2HB LEU 11 17.964 9.480 -0.982 68 HB3 LEU 11 3HB LEU 11 19.684 9.623 -1.286 69 HG LEU 11 HG LEU 11 18.538 12.188 -0.528 70 HD11 LEU 11 1HD1 LEU 11 18.528 10.612 1.907 71 HD12 LEU 11 2HD1 LEU 11 17.312 11.745 1.271 72 HD13 LEU 11 3HD1 LEU 11 17.296 10.042 0.755 73 HD21 LEU 11 3HD2 LEU 11 20.550 12.452 0.407 74 HD22 LEU 11 1HD2 LEU 11 20.449 10.911 1.292 75 HD23 LEU 11 2HD2 LEU 11 20.978 10.928 -0.407 76 H CYS 12 HN CYS 12 19.015 8.258 -3.186 77 HA CYS 12 HA CYS 12 21.268 8.873 -4.845 78 HB2 CYS 12 2HB CYS 12 21.461 6.419 -5.065 79 HB3 CYS 12 3HB CYS 12 21.470 6.989 -3.408 80 H GLY 13 HN GLY 13 18.001 7.312 -5.186 81 HA2 GLY 13 1HA GLY 13 16.643 8.019 -7.062 82 HA3 GLY 13 2HA GLY 13 18.085 8.013 -8.059 83 H GLN 14 HN GLN 14 17.345 5.538 -5.565 84 HA GLN 14 HA GLN 14 17.628 3.527 -7.560 85 HB2 GLN 14 2HB GLN 14 18.550 3.317 -5.233 86 HB3 GLN 14 3HB GLN 14 16.915 3.271 -4.604 87 HG2 GLN 14 2HG GLN 14 16.580 1.281 -6.316 88 HG3 GLN 14 3HG GLN 14 18.331 1.215 -6.326 89 HE21 GLN 14 1HE2 GLN 14 18.549 2.209 -3.575 90 HE22 GLN 14 2HE2 GLN 14 18.142 0.894 -2.523 91 H VAL 15 HN VAL 15 16.018 2.355 -8.575 92 HA VAL 15 HA VAL 15 13.277 2.935 -7.684 93 HB VAL 15 HB VAL 15 14.268 2.321 -10.473 94 HG11 VAL 15 1HG1 VAL 15 11.569 2.746 -9.260 95 HG12 VAL 15 2HG1 VAL 15 11.871 3.409 -10.885 96 HG13 VAL 15 3HG1 VAL 15 12.075 1.667 -10.581 97 HG21 VAL 15 3HG2 VAL 15 13.302 4.993 -9.417 98 HG22 VAL 15 1HG2 VAL 15 15.021 4.544 -9.532 99 HG23 VAL 15 2HG2 VAL 15 14.025 4.637 -11.005 100 H VAL 16 HN VAL 16 12.148 1.217 -6.932 101 HA VAL 16 HA VAL 16 12.980 -1.431 -7.875 102 HB VAL 16 HB VAL 16 13.044 -2.314 -5.739 103 HG11 VAL 16 1HG1 VAL 16 14.101 0.491 -5.271 104 HG12 VAL 16 2HG1 VAL 16 14.651 -1.021 -4.510 105 HG13 VAL 16 3HG1 VAL 16 14.940 -0.741 -6.243 106 HG21 VAL 16 3HG2 VAL 16 12.344 -0.527 -3.792 107 HG22 VAL 16 1HG2 VAL 16 11.189 -0.111 -5.081 108 HG23 VAL 16 2HG2 VAL 16 11.266 -1.777 -4.458 109 H LYS 17 HN LYS 17 11.293 -2.847 -8.324 110 HA LYS 17 HA LYS 17 8.634 -1.639 -8.099 111 HB2 LYS 17 2HB LYS 17 9.383 -2.110 -10.377 112 HB3 LYS 17 3HB LYS 17 9.694 -3.784 -9.963 113 HG2 LYS 17 2HG LYS 17 6.941 -2.662 -9.421 114 HG3 LYS 17 3HG LYS 17 7.374 -3.039 -11.077 115 HD2 LYS 17 2HD LYS 17 8.056 -5.367 -10.299 116 HD3 LYS 17 3HD LYS 17 7.434 -4.967 -8.710 117 HE2 LYS 17 2HE LYS 17 5.242 -5.171 -9.370 118 HE3 LYS 17 3HE LYS 17 5.524 -4.380 -10.908 119 HZ1 LYS 17 2HZ LYS 17 5.012 -6.707 -11.266 120 HZ3 LYS 17 1HZ LYS 17 6.207 -7.201 -10.276 121 H VAL 18 HN VAL 18 7.483 -2.302 -6.371 122 HA VAL 18 HA VAL 18 8.195 -4.542 -4.853 123 HB VAL 18 HB VAL 18 5.736 -2.802 -5.007 124 HG11 VAL 18 1HG1 VAL 18 5.908 -5.397 -3.833 125 HG12 VAL 18 2HG1 VAL 18 5.866 -4.201 -2.515 126 HG13 VAL 18 3HG1 VAL 18 4.575 -4.220 -3.739 127 HG21 VAL 18 3HG2 VAL 18 8.312 -2.704 -3.611 128 HG22 VAL 18 1HG2 VAL 18 7.119 -1.417 -3.912 129 HG23 VAL 18 2HG2 VAL 18 6.918 -2.511 -2.522 130 H LEU 19 HN LEU 19 7.886 -6.673 -5.226 131 HA LEU 19 HA LEU 19 6.091 -7.401 -7.389 132 HB2 LEU 19 2HB LEU 19 7.182 -9.532 -7.331 133 HB3 LEU 19 3HB LEU 19 8.374 -8.249 -7.390 134 HG LEU 19 HG LEU 19 7.776 -9.077 -4.648 135 HD11 LEU 19 1HD1 LEU 19 7.452 -11.268 -5.232 136 HD12 LEU 19 2HD1 LEU 19 8.480 -11.155 -6.682 137 HD13 LEU 19 3HD1 LEU 19 9.224 -11.238 -5.067 138 HD21 LEU 19 3HD2 LEU 19 10.402 -9.140 -6.144 139 HD22 LEU 19 1HD2 LEU 19 9.689 -7.651 -5.477 140 HD23 LEU 19 2HD2 LEU 19 10.130 -8.991 -4.391 141 H GLU 20 HN GLU 20 6.505 -7.725 -3.849 142 HA GLU 20 HA GLU 20 3.732 -8.459 -3.716 143 HB2 GLU 20 2HB GLU 20 4.277 -10.370 -2.107 144 HB3 GLU 20 3HB GLU 20 4.622 -10.676 -3.798 145 HG2 GLU 20 2HG GLU 20 6.960 -10.474 -3.504 146 HG3 GLU 20 3HG GLU 20 6.800 -9.511 -2.048 147 H GLU 21 HN GLU 21 2.896 -7.011 -2.282 148 HA GLU 21 HA GLU 21 4.456 -5.442 -0.664 149 HB2 GLU 21 2HB GLU 21 2.231 -4.737 -1.282 150 HB3 GLU 21 3HB GLU 21 1.501 -6.155 -0.557 151 HG2 GLU 21 2HG GLU 21 2.335 -5.382 1.703 152 HG3 GLU 21 3HG GLU 21 2.955 -3.928 0.946 153 H GLY 22 HN GLY 22 4.641 -5.346 1.716 154 HA2 GLY 22 1HA GLY 22 4.369 -8.010 2.976 155 HA3 GLY 22 2HA GLY 22 5.792 -7.006 3.168 156 H GLY 23 HN GLY 23 5.113 -4.535 3.779 157 HA2 GLY 23 1HA GLY 23 3.120 -3.507 5.012 158 HA3 GLY 23 2HA GLY 23 3.379 -4.818 6.146 159 H GLY 24 HN GLY 24 5.510 -2.487 4.327 160 HA2 GLY 24 1HA GLY 24 6.421 -1.272 6.766 161 HA3 GLY 24 2HA GLY 24 7.605 -2.352 6.061 162 H THR 25 HN THR 25 8.797 -0.165 5.927 163 HA THR 25 HA THR 25 8.116 1.086 3.349 164 HB THR 25 HB THR 25 9.084 2.363 5.959 165 HG1 THR 25 HG1 THR 25 6.777 1.932 5.730 166 HG21 THR 25 3HG2 THR 25 8.511 4.483 4.459 167 HG22 THR 25 1HG2 THR 25 10.127 3.746 4.343 168 HG23 THR 25 2HG2 THR 25 8.895 3.389 3.108 169 H LEU 26 HN LEU 26 9.990 2.065 2.217 170 HA LEU 26 HA LEU 26 12.362 0.419 2.742 171 HB2 LEU 26 2HB LEU 26 11.671 1.739 0.130 172 HB3 LEU 26 3HB LEU 26 12.825 0.457 0.436 173 HG LEU 26 HG LEU 26 9.884 0.018 0.922 174 HD11 LEU 26 1HD1 LEU 26 10.270 -1.108 -1.528 175 HD12 LEU 26 2HD1 LEU 26 9.511 0.477 -1.243 176 HD13 LEU 26 3HD1 LEU 26 11.235 0.380 -1.673 177 HD21 LEU 26 3HD2 LEU 26 11.111 -1.745 1.819 178 HD22 LEU 26 1HD2 LEU 26 10.649 -2.344 0.207 179 HD23 LEU 26 2HD2 LEU 26 12.297 -1.732 0.491 180 H VAL 27 HN VAL 27 12.996 1.983 4.431 181 HA VAL 27 HA VAL 27 13.478 4.683 3.686 182 HB VAL 27 HB VAL 27 14.392 2.999 6.025 183 HG11 VAL 27 1HG1 VAL 27 14.478 6.018 5.717 184 HG12 VAL 27 2HG1 VAL 27 14.970 5.079 7.145 185 HG13 VAL 27 3HG1 VAL 27 15.887 4.936 5.627 186 HG21 VAL 27 3HG2 VAL 27 12.492 3.595 7.135 187 HG22 VAL 27 1HG2 VAL 27 12.362 5.163 6.302 188 HG23 VAL 27 2HG2 VAL 27 11.850 3.672 5.476 189 H CYS 28 HN CYS 28 14.921 5.117 2.079 190 HA CYS 28 HA CYS 28 17.504 3.746 2.294 191 HB2 CYS 28 2HB CYS 28 16.177 3.075 0.303 192 HB3 CYS 28 3HB CYS 28 16.177 4.742 -0.236 193 H CYS 29 HN CYS 29 19.333 5.101 2.308 194 HA CYS 29 HA CYS 29 20.518 6.941 2.469 195 HB2 CYS 29 2HB CYS 29 18.384 8.009 0.628 196 HB3 CYS 29 3HB CYS 29 19.703 9.015 1.194 197 H GLY 30 HN GLY 30 18.199 6.206 4.317 198 HA2 GLY 30 1HA GLY 30 17.434 7.026 6.277 199 HA3 GLY 30 2HA GLY 30 18.348 8.498 6.006 200 H GLU 31 HN GLU 31 16.109 7.337 3.510 201 HA GLU 31 HA GLU 31 14.082 9.165 4.471 202 HB2 GLU 31 2HB GLU 31 15.827 10.135 2.656 203 HB3 GLU 31 3HB GLU 31 14.747 9.319 1.543 204 HG2 GLU 31 2HG GLU 31 12.923 10.587 3.177 205 HG3 GLU 31 3HG GLU 31 14.257 11.722 3.243 206 H ASP 32 HN ASP 32 12.056 8.280 4.254 207 HA ASP 32 HA ASP 32 11.787 5.687 3.386 208 HB2 ASP 32 2HB ASP 32 10.075 6.351 4.818 209 HB3 ASP 32 3HB ASP 32 9.944 7.944 4.100 210 H MET 33 HN MET 33 12.003 5.009 1.245 211 HA MET 33 HA MET 33 12.074 6.585 -0.928 212 HB2 MET 33 2HB MET 33 12.345 3.919 -0.451 213 HB3 MET 33 3HB MET 33 10.758 3.871 -1.193 214 HG2 MET 33 2HG MET 33 11.631 4.193 -3.271 215 HG3 MET 33 3HG MET 33 12.530 5.603 -2.746 216 HE1 MET 33 3HE MET 33 14.044 1.376 -3.348 217 HE2 MET 33 1HE MET 33 12.453 1.671 -2.607 218 HE3 MET 33 2HE MET 33 12.801 2.284 -4.242 219 H VAL 34 HN VAL 34 10.613 7.232 -2.607 220 HA VAL 34 HA VAL 34 7.860 7.419 -1.666 221 HB VAL 34 HB VAL 34 7.665 9.305 -2.966 222 HG11 VAL 34 1HG1 VAL 34 10.635 9.266 -2.337 223 HG12 VAL 34 2HG1 VAL 34 9.608 10.703 -2.547 224 HG13 VAL 34 3HG1 VAL 34 9.343 9.614 -1.164 225 HG21 VAL 34 3HG2 VAL 34 8.150 8.784 -5.146 226 HG22 VAL 34 1HG2 VAL 34 9.578 9.772 -4.756 227 HG23 VAL 34 2HG2 VAL 34 9.692 7.996 -4.734 228 H LYS 35 HN LYS 35 6.098 7.147 -3.345 229 HA LYS 35 HA LYS 35 6.787 4.837 -5.012 230 HB2 LYS 35 2HB LYS 35 4.665 3.995 -4.645 231 HB3 LYS 35 3HB LYS 35 5.042 4.726 -3.098 232 HG2 LYS 35 2HG LYS 35 2.888 5.570 -3.497 233 HG3 LYS 35 3HG LYS 35 3.889 6.878 -4.096 234 HD2 LYS 35 2HD LYS 35 2.706 6.684 -6.034 235 HD3 LYS 35 3HD LYS 35 3.683 5.264 -6.345 236 HE2 LYS 35 2HE LYS 35 1.656 4.334 -4.611 237 HE3 LYS 35 3HE LYS 35 0.824 5.444 -5.681 238 HZ1 LYS 35 2HZ LYS 35 2.109 4.176 -7.525 239 HZ3 LYS 35 1HZ LYS 35 0.808 3.452 -6.864 240 H GLN 36 HN GLN 36 6.112 4.756 -7.206 241 HA GLN 36 HA GLN 36 5.582 7.417 -8.255 242 HB2 GLN 36 2HB GLN 36 6.607 4.995 -9.791 243 HB3 GLN 36 3HB GLN 36 6.593 6.661 -10.333 244 HG2 GLN 36 2HG GLN 36 8.097 5.829 -7.821 245 HG3 GLN 36 3HG GLN 36 8.833 5.699 -9.406 246 HE21 GLN 36 1HE2 GLN 36 7.793 7.778 -6.868 247 HE22 GLN 36 2HE2 GLN 36 8.384 9.282 -7.490 248 H1 ALA 1 HN ALA 1 24.911 -3.500 -4.270 249 HA ALA 1 HA ALA 1 23.186 -5.260 -4.738 250 HB1 ALA 1 1HB ALA 1 20.869 -4.641 -4.837 251 HB2 ALA 1 2HB ALA 1 21.536 -3.895 -3.365 252 HB3 ALA 1 3HB ALA 1 21.266 -2.907 -4.820 253 H ASN 2 HN ASN 2 22.099 -5.629 -6.916 254 HA ASN 2 HA ASN 2 23.129 -3.706 -8.847 255 HB2 ASN 2 2HB ASN 2 23.094 -6.745 -9.220 256 HB3 ASN 2 3HB ASN 2 23.780 -5.573 -10.327 257 HD21 ASN 2 1HD2 ASN 2 24.469 -7.751 -7.984 258 HD22 ASN 2 2HD2 ASN 2 25.997 -7.171 -7.411 259 H GLU 3 HN GLU 3 21.772 -3.498 -10.781 260 HA GLU 3 HA GLU 3 19.123 -3.605 -10.425 261 HB2 GLU 3 2HB GLU 3 20.639 -3.956 -13.049 262 HB3 GLU 3 3HB GLU 3 18.944 -3.530 -12.938 263 HG2 GLU 3 2HG GLU 3 19.385 -1.364 -12.277 264 HG3 GLU 3 3HG GLU 3 20.754 -1.830 -11.288 265 H GLY 4 HN GLY 4 17.373 -5.003 -11.229 266 HA2 GLY 4 1HA GLY 4 16.377 -6.980 -11.654 267 HA3 GLY 4 2HA GLY 4 17.898 -7.590 -12.273 268 H ASP 5 HN ASP 5 17.550 -6.212 -8.988 269 HA ASP 5 HA ASP 5 18.226 -8.845 -7.978 270 HB2 ASP 5 2HB ASP 5 18.746 -6.028 -7.148 271 HB3 ASP 5 3HB ASP 5 18.396 -7.118 -5.823 272 H VAL 6 HN VAL 6 17.272 -9.071 -5.518 273 HA VAL 6 HA VAL 6 14.557 -8.002 -5.421 274 HB VAL 6 HB VAL 6 15.379 -10.880 -5.567 275 HG11 VAL 6 1HG1 VAL 6 14.265 -10.821 -3.442 276 HG12 VAL 6 2HG1 VAL 6 12.961 -9.797 -4.089 277 HG13 VAL 6 3HG1 VAL 6 13.122 -11.483 -4.634 278 HG21 VAL 6 3HG2 VAL 6 14.508 -10.290 -7.607 279 HG22 VAL 6 1HG2 VAL 6 13.014 -10.788 -6.778 280 HG23 VAL 6 2HG2 VAL 6 13.421 -9.061 -6.916 281 H TYR 7 HN TYR 7 13.979 -7.361 -3.380 282 HA TYR 7 HA TYR 7 15.763 -8.231 -1.208 283 HB2 TYR 7 2HB TYR 7 14.714 -5.571 -2.215 284 HB3 TYR 7 3HB TYR 7 14.791 -5.748 -0.473 285 HD1 TYR 7 HD1 TYR 7 17.062 -6.415 0.566 286 HD2 TYR 7 HD2 TYR 7 16.636 -4.993 -3.447 287 HE1 TYR 7 HE1 TYR 7 19.530 -5.809 0.510 288 HE2 TYR 7 HE2 TYR 7 19.106 -4.392 -3.489 289 HH TYR 7 HH TYR 7 20.838 -3.762 -1.502 290 H LYS 8 HN LYS 8 14.709 -9.331 0.363 291 HA LYS 8 HA LYS 8 11.839 -8.769 0.656 292 HB2 LYS 8 2HB LYS 8 12.151 -10.981 -0.236 293 HB3 LYS 8 3HB LYS 8 13.370 -11.364 0.962 294 HG2 LYS 8 2HG LYS 8 10.800 -10.440 2.133 295 HG3 LYS 8 3HG LYS 8 10.656 -11.919 1.204 296 HD2 LYS 8 2HD LYS 8 13.009 -11.794 3.047 297 HD3 LYS 8 3HD LYS 8 11.444 -11.830 3.834 298 HE2 LYS 8 2HE LYS 8 11.559 -14.095 3.570 299 HE3 LYS 8 3HE LYS 8 11.114 -13.788 1.903 300 HZ1 LYS 8 2HZ LYS 8 13.299 -15.093 2.461 301 HZ3 LYS 8 1HZ LYS 8 13.957 -13.613 2.623 302 H CYS 9 HN CYS 9 11.084 -8.188 2.661 303 HA CYS 9 HA CYS 9 13.071 -7.483 4.578 304 HB2 CYS 9 2HB CYS 9 11.138 -6.028 4.158 305 HB3 CYS 9 3HB CYS 9 10.043 -7.286 4.694 306 H GLU 10 HN GLU 10 13.431 -8.478 6.619 307 HA GLU 10 HA GLU 10 12.442 -11.182 6.748 308 HB2 GLU 10 2HB GLU 10 14.735 -9.660 7.945 309 HB3 GLU 10 3HB GLU 10 14.119 -11.014 8.871 310 HG2 GLU 10 2HG GLU 10 14.383 -11.705 6.026 311 HG3 GLU 10 3HG GLU 10 15.904 -11.136 6.683 312 H LEU 11 HN LEU 11 10.560 -8.985 7.228 313 HA LEU 11 HA LEU 11 9.763 -9.769 9.913 314 HB2 LEU 11 2HB LEU 11 10.990 -7.740 10.291 315 HB3 LEU 11 3HB LEU 11 10.130 -6.915 9.005 316 HG LEU 11 HG LEU 11 8.125 -6.798 10.253 317 HD11 LEU 11 1HD1 LEU 11 8.148 -9.121 11.091 318 HD12 LEU 11 2HD1 LEU 11 9.339 -8.645 12.325 319 HD13 LEU 11 3HD1 LEU 11 7.706 -7.938 12.345 320 HD21 LEU 11 3HD2 LEU 11 9.023 -5.071 11.318 321 HD22 LEU 11 1HD2 LEU 11 9.393 -6.167 12.671 322 HD23 LEU 11 2HD2 LEU 11 10.610 -5.872 11.406 323 H CYS 12 HN CYS 12 8.564 -7.178 7.709 324 HA CYS 12 HA CYS 12 5.942 -8.138 7.872 325 HB2 CYS 12 2HB CYS 12 5.483 -6.507 6.057 326 HB3 CYS 12 3HB CYS 12 6.284 -5.833 7.462 327 H GLY 13 HN GLY 13 8.626 -8.482 5.486 328 HA2 GLY 13 1HA GLY 13 8.930 -10.433 4.226 329 HA3 GLY 13 2HA GLY 13 7.215 -10.782 4.325 330 H GLN 14 HN GLN 14 8.484 -7.517 3.598 331 HA GLN 14 HA GLN 14 6.984 -7.527 1.183 332 HB2 GLN 14 2HB GLN 14 7.019 -5.511 2.547 333 HB3 GLN 14 3HB GLN 14 8.770 -5.445 2.507 334 HG2 GLN 14 2HG GLN 14 8.822 -4.840 0.196 335 HG3 GLN 14 3HG GLN 14 7.178 -5.382 -0.078 336 HE21 GLN 14 1HE2 GLN 14 8.663 -3.348 2.438 337 HE22 GLN 14 2HE2 GLN 14 7.669 -1.949 2.207 338 H VAL 15 HN VAL 15 7.726 -8.199 -0.781 339 HA VAL 15 HA VAL 15 10.643 -8.281 -1.126 340 HB VAL 15 HB VAL 15 8.698 -9.860 -2.769 341 HG11 VAL 15 1HG1 VAL 15 11.495 -9.612 -2.662 342 HG12 VAL 15 2HG1 VAL 15 11.132 -11.193 -1.929 343 HG13 VAL 15 3HG1 VAL 15 10.550 -10.818 -3.568 344 HG21 VAL 15 3HG2 VAL 15 8.825 -11.717 -1.157 345 HG22 VAL 15 1HG2 VAL 15 9.704 -10.668 -0.020 346 HG23 VAL 15 2HG2 VAL 15 8.019 -10.293 -0.456 347 H VAL 16 HN VAL 16 11.496 -6.835 -2.524 348 HA VAL 16 HA VAL 16 9.724 -5.850 -4.648 349 HB VAL 16 HB VAL 16 10.445 -3.641 -4.317 350 HG11 VAL 16 1HG1 VAL 16 9.693 -3.108 -2.090 351 HG12 VAL 16 2HG1 VAL 16 8.753 -4.498 -2.683 352 HG13 VAL 16 3HG1 VAL 16 10.074 -4.749 -1.516 353 HG21 VAL 16 3HG2 VAL 16 12.621 -3.355 -3.839 354 HG22 VAL 16 1HG2 VAL 16 12.122 -3.463 -2.134 355 HG23 VAL 16 2HG2 VAL 16 12.732 -4.907 -2.976 356 H LYS 17 HN LYS 17 10.638 -5.749 -6.688 357 HA LYS 17 HA LYS 17 13.310 -6.901 -6.868 358 HB2 LYS 17 2HB LYS 17 11.760 -8.113 -8.157 359 HB3 LYS 17 3HB LYS 17 10.978 -6.668 -8.765 360 HG2 LYS 17 2HG LYS 17 13.907 -6.968 -9.369 361 HG3 LYS 17 3HG LYS 17 12.818 -8.063 -10.199 362 HD2 LYS 17 2HD LYS 17 11.443 -5.755 -10.592 363 HD3 LYS 17 3HD LYS 17 13.049 -5.074 -10.427 364 HE2 LYS 17 2HE LYS 17 13.081 -7.453 -12.154 365 HE3 LYS 17 3HE LYS 17 11.946 -6.257 -12.747 366 HZ1 LYS 17 2HZ LYS 17 14.817 -5.781 -12.162 367 HZ3 LYS 17 1HZ LYS 17 13.778 -4.593 -12.561 368 H VAL 18 HN VAL 18 14.992 -5.519 -6.946 369 HA VAL 18 HA VAL 18 14.613 -2.775 -7.514 370 HB VAL 18 HB VAL 18 17.033 -4.542 -7.161 371 HG11 VAL 18 1HG1 VAL 18 18.460 -2.648 -7.206 372 HG12 VAL 18 2HG1 VAL 18 17.451 -2.531 -8.667 373 HG13 VAL 18 3HG1 VAL 18 17.087 -1.516 -7.252 374 HG21 VAL 18 3HG2 VAL 18 15.854 -4.302 -5.114 375 HG22 VAL 18 1HG2 VAL 18 17.213 -3.156 -5.033 376 HG23 VAL 18 2HG2 VAL 18 15.572 -2.566 -5.391 377 H LEU 19 HN LEU 19 14.516 -1.753 -9.447 378 HA LEU 19 HA LEU 19 15.337 -3.314 -11.786 379 HB2 LEU 19 2HB LEU 19 13.866 -1.830 -13.048 380 HB3 LEU 19 3HB LEU 19 13.022 -2.722 -11.798 381 HG LEU 19 HG LEU 19 13.934 -0.064 -10.926 382 HD11 LEU 19 1HD1 LEU 19 13.142 -0.035 -13.515 383 HD12 LEU 19 2HD1 LEU 19 11.574 0.156 -12.695 384 HD13 LEU 19 3HD1 LEU 19 12.892 1.309 -12.376 385 HD21 LEU 19 3HD2 LEU 19 12.206 -1.869 -9.962 386 HD22 LEU 19 1HD2 LEU 19 12.068 -0.123 -9.641 387 HD23 LEU 19 2HD2 LEU 19 11.075 -0.876 -10.911 388 H GLU 20 HN GLU 20 15.693 -0.184 -10.065 389 HA GLU 20 HA GLU 20 17.968 0.313 -11.824 390 HB2 GLU 20 2HB GLU 20 15.975 1.886 -12.127 391 HB3 GLU 20 3HB GLU 20 16.262 2.460 -10.497 392 HG2 GLU 20 2HG GLU 20 18.412 3.359 -11.063 393 HG3 GLU 20 3HG GLU 20 18.506 2.434 -12.548 394 H GLU 21 HN GLU 21 19.741 -0.254 -10.612 395 HA GLU 21 HA GLU 21 19.763 -0.258 -7.854 396 HB2 GLU 21 2HB GLU 21 21.356 -1.619 -8.981 397 HB3 GLU 21 3HB GLU 21 21.940 -0.290 -9.963 398 HG2 GLU 21 2HG GLU 21 22.772 0.818 -7.810 399 HG3 GLU 21 3HG GLU 21 22.359 -0.659 -6.962 400 H GLY 22 HN GLY 22 20.929 1.126 -6.315 401 HA2 GLY 22 1HA GLY 22 21.395 3.867 -7.313 402 HA3 GLY 22 2HA GLY 22 20.407 3.563 -5.899 403 H GLY 23 HN GLY 23 21.768 4.619 -4.394 404 HA2 GLY 23 1HA GLY 23 24.293 3.189 -3.849 405 HA3 GLY 23 2HA GLY 23 24.235 4.940 -3.904 406 H GLY 24 HN GLY 24 21.819 2.574 -2.590 407 HA2 GLY 24 1HA GLY 24 22.469 3.325 0.138 408 HA3 GLY 24 2HA GLY 24 20.922 3.900 -0.449 409 H THR 25 HN THR 25 20.274 2.394 1.462 410 HA THR 25 HA THR 25 19.833 -0.297 0.348 411 HB THR 25 HB THR 25 20.615 0.575 3.175 412 HG1 THR 25 HG1 THR 25 21.593 -1.328 1.163 413 HG21 THR 25 3HG2 THR 25 20.385 -1.757 3.845 414 HG22 THR 25 1HG2 THR 25 18.820 -1.265 3.153 415 HG23 THR 25 2HG2 THR 25 19.950 -2.244 2.188 416 H LEU 26 HN LEU 26 17.895 -1.404 1.289 417 HA LEU 26 HA LEU 26 15.783 0.603 1.550 418 HB2 LEU 26 2HB LEU 26 15.315 -2.304 1.011 419 HB3 LEU 26 3HB LEU 26 14.318 -0.922 0.608 420 HG LEU 26 HG LEU 26 17.012 -1.332 -0.685 421 HD11 LEU 26 1HD1 LEU 26 14.616 -2.958 -1.033 422 HD12 LEU 26 2HD1 LEU 26 15.147 -2.187 -2.547 423 HD13 LEU 26 3HD1 LEU 26 16.274 -3.212 -1.626 424 HD21 LEU 26 3HD2 LEU 26 14.609 -0.037 -1.935 425 HD22 LEU 26 1HD2 LEU 26 15.609 0.860 -0.769 426 HD23 LEU 26 2HD2 LEU 26 16.340 0.220 -2.261 427 H VAL 27 HN VAL 27 16.350 1.033 3.812 428 HA VAL 27 HA VAL 27 16.259 -1.082 5.700 429 HB VAL 27 HB VAL 27 16.070 1.924 5.967 430 HG11 VAL 27 1HG1 VAL 27 15.293 1.404 8.034 431 HG12 VAL 27 2HG1 VAL 27 15.927 -0.258 7.976 432 HG13 VAL 27 3HG1 VAL 27 17.015 1.096 8.365 433 HG21 VAL 27 3HG2 VAL 27 18.282 0.048 5.562 434 HG22 VAL 27 1HG2 VAL 27 18.237 1.821 5.403 435 HG23 VAL 27 2HG2 VAL 27 18.499 1.077 6.999 436 H CYS 28 HN CYS 28 14.420 -2.273 5.928 437 HA CYS 28 HA CYS 28 11.929 -0.741 6.121 438 HB2 CYS 28 2HB CYS 28 12.175 -2.299 4.139 439 HB3 CYS 28 3HB CYS 28 12.166 -3.631 5.279 440 H CYS 29 HN CYS 29 10.755 -1.011 8.032 441 HA CYS 29 HA CYS 29 10.321 -1.588 10.103 442 HB2 CYS 29 2HB CYS 29 11.300 -4.287 9.164 443 HB3 CYS 29 3HB CYS 29 10.597 -4.014 10.745 444 H GLY 30 HN GLY 30 12.799 -0.256 9.579 445 HA2 GLY 30 1HA GLY 30 14.739 0.282 10.575 446 HA3 GLY 30 2HA GLY 30 14.153 -0.565 11.993 447 H GLU 31 HN GLU 31 14.396 -2.353 8.954 448 HA GLU 31 HA GLU 31 16.968 -3.403 9.782 449 HB2 GLU 31 2HB GLU 31 15.083 -4.860 10.689 450 HB3 GLU 31 3HB GLU 31 14.626 -5.204 9.033 451 HG2 GLU 31 2HG GLU 31 16.452 -6.570 8.660 452 HG3 GLU 31 3HG GLU 31 17.524 -5.591 9.641 453 H ASP 32 HN ASP 32 18.347 -3.387 8.058 454 HA ASP 32 HA ASP 32 17.553 -2.544 5.584 455 HB2 ASP 32 2HB ASP 32 19.818 -3.643 4.863 456 HB3 ASP 32 3HB ASP 32 19.853 -2.337 6.032 457 H MET 33 HN MET 33 16.169 -3.665 4.197 458 HA MET 33 HA MET 33 15.367 -6.190 4.387 459 HB2 MET 33 2HB MET 33 14.972 -4.133 2.619 460 HB3 MET 33 3HB MET 33 15.912 -5.195 1.589 461 HG2 MET 33 2HG MET 33 14.087 -6.495 1.226 462 HG3 MET 33 3HG MET 33 13.955 -6.823 2.942 463 HE1 MET 33 3HE MET 33 11.168 -5.413 0.395 464 HE2 MET 33 1HE MET 33 12.070 -3.887 0.240 465 HE3 MET 33 2HE MET 33 12.897 -5.440 -0.028 466 H VAL 34 HN VAL 34 15.875 -8.248 3.377 467 HA VAL 34 HA VAL 34 18.743 -8.523 2.921 468 HB VAL 34 HB VAL 34 18.545 -10.671 3.666 469 HG11 VAL 34 1HG1 VAL 34 17.505 -8.824 5.277 470 HG12 VAL 34 2HG1 VAL 34 16.048 -9.827 5.081 471 HG13 VAL 34 3HG1 VAL 34 17.544 -10.546 5.724 472 HG21 VAL 34 3HG2 VAL 34 17.038 -11.574 2.053 473 HG22 VAL 34 1HG2 VAL 34 16.364 -11.958 3.656 474 HG23 VAL 34 2HG2 VAL 34 15.674 -10.627 2.695 475 H LYS 35 HN LYS 35 19.479 -9.961 1.129 476 HA LYS 35 HA LYS 35 17.887 -9.379 -1.234 477 HB2 LYS 35 2HB LYS 35 20.500 -9.005 -0.797 478 HB3 LYS 35 3HB LYS 35 20.584 -10.653 -1.385 479 HG2 LYS 35 2HG LYS 35 18.816 -8.836 -2.966 480 HG3 LYS 35 3HG LYS 35 20.521 -8.435 -3.011 481 HD2 LYS 35 2HD LYS 35 21.125 -10.536 -3.957 482 HD3 LYS 35 3HD LYS 35 19.633 -11.303 -3.452 483 HE2 LYS 35 2HE LYS 35 19.190 -8.979 -5.237 484 HE3 LYS 35 3HE LYS 35 20.137 -10.248 -5.988 485 HZ1 LYS 35 2HZ LYS 35 18.352 -11.828 -5.243 486 HZ3 LYS 35 1HZ LYS 35 17.833 -10.740 -6.339 487 H GLN 36 HN GLN 36 17.358 -11.030 -2.806 488 HA GLN 36 HA GLN 36 17.213 -13.654 -1.539 489 HB2 GLN 36 2HB GLN 36 15.321 -12.511 -3.640 490 HB3 GLN 36 3HB GLN 36 15.138 -14.036 -2.796 491 HG2 GLN 36 2HG GLN 36 15.307 -11.394 -1.290 492 HG3 GLN 36 3HG GLN 36 13.783 -11.999 -1.910 493 HE21 GLN 36 1HE2 GLN 36 16.333 -12.394 0.397 494 HE22 GLN 36 2HE2 GLN 36 15.599 -13.605 1.394 Start of MODEL 15 1 H1 ALA 1 HN ALA 1 2.615 -0.497 1.819 2 HA ALA 1 HA ALA 1 1.648 0.495 -0.346 3 HB1 ALA 1 1HB ALA 1 3.985 -1.331 0.070 4 HB2 ALA 1 2HB ALA 1 3.571 -0.889 -1.604 5 HB3 ALA 1 3HB ALA 1 3.946 0.381 -0.415 6 H ASN 2 HN ASN 2 1.419 -0.394 -2.693 7 HA ASN 2 HA ASN 2 -0.259 -2.770 -2.494 8 HB2 ASN 2 2HB ASN 2 -0.602 -0.147 -3.811 9 HB3 ASN 2 3HB ASN 2 -0.843 -1.467 -4.939 10 HD21 ASN 2 1HD2 ASN 2 -2.862 -2.022 -5.136 11 HD22 ASN 2 2HD2 ASN 2 -4.070 -2.076 -3.896 12 H GLU 3 HN GLU 3 0.119 -4.459 -4.046 13 HA GLU 3 HA GLU 3 2.665 -4.663 -5.058 14 HB2 GLU 3 2HB GLU 3 0.129 -6.131 -5.908 15 HB3 GLU 3 3HB GLU 3 1.756 -6.640 -6.316 16 HG2 GLU 3 2HG GLU 3 2.297 -6.782 -3.854 17 HG3 GLU 3 3HG GLU 3 0.640 -6.350 -3.486 18 H GLY 4 HN GLY 4 3.357 -4.873 -7.384 19 HA2 GLY 4 1HA GLY 4 3.496 -4.129 -9.504 20 HA3 GLY 4 2HA GLY 4 1.771 -3.823 -9.481 21 H ASP 5 HN ASP 5 4.203 -2.424 -7.218 22 HA ASP 5 HA ASP 5 3.572 0.161 -8.412 23 HB2 ASP 5 2HB ASP 5 3.785 -0.776 -5.570 24 HB3 ASP 5 3HB ASP 5 4.446 0.813 -5.904 25 H VAL 6 HN VAL 6 5.456 1.836 -7.716 26 HA VAL 6 HA VAL 6 8.032 0.434 -7.761 27 HB VAL 6 HB VAL 6 6.937 2.475 -9.654 28 HG11 VAL 6 1HG1 VAL 6 9.294 2.975 -10.377 29 HG12 VAL 6 2HG1 VAL 6 8.844 3.650 -8.792 30 HG13 VAL 6 3HG1 VAL 6 9.857 2.189 -8.881 31 HG21 VAL 6 3HG2 VAL 6 7.045 0.679 -10.978 32 HG22 VAL 6 1HG2 VAL 6 8.819 0.809 -10.897 33 HG23 VAL 6 2HG2 VAL 6 7.949 -0.245 -9.756 34 H TYR 7 HN TYR 7 9.726 1.500 -6.643 35 HA TYR 7 HA TYR 7 8.903 3.928 -5.207 36 HB2 TYR 7 2HB TYR 7 9.935 1.208 -4.329 37 HB3 TYR 7 3HB TYR 7 10.547 2.592 -3.446 38 HD1 TYR 7 HD1 TYR 7 8.893 4.132 -2.276 39 HD2 TYR 7 HD2 TYR 7 7.763 0.341 -3.906 40 HE1 TYR 7 HE1 TYR 7 6.797 4.129 -0.836 41 HE2 TYR 7 HE2 TYR 7 5.672 0.350 -2.459 42 HH TYR 7 HH TYR 7 5.232 1.814 0.059 43 H LYS 8 HN LYS 8 10.280 5.562 -5.670 44 HA LYS 8 HA LYS 8 13.038 4.806 -6.341 45 HB2 LYS 8 2HB LYS 8 11.887 5.748 -8.249 46 HB3 LYS 8 3HB LYS 8 11.342 7.124 -7.309 47 HG2 LYS 8 2HG LYS 8 14.274 6.735 -7.176 48 HG3 LYS 8 3HG LYS 8 13.699 6.999 -8.811 49 HD2 LYS 8 2HD LYS 8 12.441 8.822 -6.847 50 HD3 LYS 8 3HD LYS 8 14.185 8.990 -6.908 51 HE2 LYS 8 2HE LYS 8 12.332 9.098 -9.338 52 HE3 LYS 8 3HE LYS 8 13.022 10.497 -8.540 53 HZ1 LYS 8 2HZ LYS 8 14.549 8.357 -9.919 54 HZ3 LYS 8 1HZ LYS 8 15.256 9.543 -9.057 55 H CYS 9 HN CYS 9 14.691 5.623 -5.119 56 HA CYS 9 HA CYS 9 13.965 6.898 -2.690 57 HB2 CYS 9 2HB CYS 9 15.783 5.240 -2.806 58 HB3 CYS 9 3HB CYS 9 16.706 6.302 -3.851 59 H GLU 10 HN GLU 10 14.286 9.090 -2.101 60 HA GLU 10 HA GLU 10 14.718 10.830 -4.367 61 HB2 GLU 10 2HB GLU 10 13.325 11.037 -1.730 62 HB3 GLU 10 3HB GLU 10 14.063 12.515 -2.317 63 HG2 GLU 10 2HG GLU 10 12.476 10.930 -4.314 64 HG3 GLU 10 3HG GLU 10 11.563 11.717 -3.043 65 H LEU 11 HN LEU 11 17.000 9.377 -3.277 66 HA LEU 11 HA LEU 11 18.585 11.694 -2.474 67 HB2 LEU 11 2HB LEU 11 17.948 9.404 -0.817 68 HB3 LEU 11 3HB LEU 11 19.676 9.526 -1.086 69 HG LEU 11 HG LEU 11 18.595 12.129 -0.435 70 HD11 LEU 11 1HD1 LEU 11 18.172 11.354 2.048 71 HD12 LEU 11 2HD1 LEU 11 16.863 11.344 0.843 72 HD13 LEU 11 3HD1 LEU 11 17.701 9.830 1.259 73 HD21 LEU 11 3HD2 LEU 11 20.940 10.683 -0.076 74 HD22 LEU 11 1HD2 LEU 11 20.582 12.311 0.551 75 HD23 LEU 11 2HD2 LEU 11 20.296 10.882 1.572 76 H CYS 12 HN CYS 12 18.949 8.124 -3.079 77 HA CYS 12 HA CYS 12 21.284 8.709 -4.661 78 HB2 CYS 12 2HB CYS 12 21.442 6.229 -4.845 79 HB3 CYS 12 3HB CYS 12 21.509 6.860 -3.212 80 H GLY 13 HN GLY 13 17.958 7.316 -5.002 81 HA2 GLY 13 1HA GLY 13 16.655 7.908 -6.915 82 HA3 GLY 13 2HA GLY 13 18.109 7.902 -7.892 83 H GLN 14 HN GLN 14 17.489 5.426 -5.394 84 HA GLN 14 HA GLN 14 17.715 3.421 -7.400 85 HB2 GLN 14 2HB GLN 14 18.797 3.057 -5.254 86 HB3 GLN 14 3HB GLN 14 17.297 3.313 -4.385 87 HG2 GLN 14 2HG GLN 14 16.360 1.250 -5.135 88 HG3 GLN 14 3HG GLN 14 17.494 1.109 -6.464 89 HE21 GLN 14 1HE2 GLN 14 17.716 1.683 -2.951 90 HE22 GLN 14 2HE2 GLN 14 18.883 0.451 -2.601 91 H VAL 15 HN VAL 15 16.044 2.549 -8.544 92 HA VAL 15 HA VAL 15 13.354 2.927 -7.433 93 HB VAL 15 HB VAL 15 14.083 2.368 -10.304 94 HG11 VAL 15 1HG1 VAL 15 11.761 1.955 -9.758 95 HG12 VAL 15 2HG1 VAL 15 11.625 3.542 -8.961 96 HG13 VAL 15 3HG1 VAL 15 11.876 3.448 -10.721 97 HG21 VAL 15 3HG2 VAL 15 13.944 5.028 -8.862 98 HG22 VAL 15 1HG2 VAL 15 15.270 4.372 -9.852 99 HG23 VAL 15 2HG2 VAL 15 13.746 4.873 -10.624 100 H VAL 16 HN VAL 16 12.174 1.158 -6.860 101 HA VAL 16 HA VAL 16 13.037 -1.422 -7.935 102 HB VAL 16 HB VAL 16 13.125 -2.438 -5.834 103 HG11 VAL 16 1HG1 VAL 16 15.103 -1.046 -6.368 104 HG12 VAL 16 2HG1 VAL 16 14.388 0.297 -5.444 105 HG13 VAL 16 3HG1 VAL 16 14.840 -1.212 -4.615 106 HG21 VAL 16 3HG2 VAL 16 12.132 0.090 -4.488 107 HG22 VAL 16 1HG2 VAL 16 11.070 -1.261 -4.951 108 HG23 VAL 16 2HG2 VAL 16 12.370 -1.518 -3.763 109 H LYS 17 HN LYS 17 11.345 -2.759 -8.501 110 HA LYS 17 HA LYS 17 8.705 -1.581 -8.204 111 HB2 LYS 17 2HB LYS 17 9.501 -2.270 -10.437 112 HB3 LYS 17 3HB LYS 17 9.665 -3.922 -9.877 113 HG2 LYS 17 2HG LYS 17 7.008 -2.542 -9.483 114 HG3 LYS 17 3HG LYS 17 7.429 -3.078 -11.097 115 HD2 LYS 17 2HD LYS 17 8.093 -5.332 -9.719 116 HD3 LYS 17 3HD LYS 17 6.862 -4.707 -8.639 117 HE2 LYS 17 2HE LYS 17 5.189 -4.696 -10.399 118 HE3 LYS 17 3HE LYS 17 6.394 -4.979 -11.640 119 HZ1 LYS 17 2HZ LYS 17 5.029 -6.971 -10.696 120 HZ3 LYS 17 1HZ LYS 17 6.109 -6.956 -9.478 121 H VAL 18 HN VAL 18 7.518 -2.098 -6.453 122 HA VAL 18 HA VAL 18 8.203 -4.233 -4.764 123 HB VAL 18 HB VAL 18 5.779 -2.456 -5.027 124 HG11 VAL 18 1HG1 VAL 18 5.856 -4.949 -3.709 125 HG12 VAL 18 2HG1 VAL 18 6.000 -3.715 -2.434 126 HG13 VAL 18 3HG1 VAL 18 4.622 -3.675 -3.559 127 HG21 VAL 18 3HG2 VAL 18 7.815 -2.499 -2.796 128 HG22 VAL 18 1HG2 VAL 18 8.088 -1.577 -4.293 129 HG23 VAL 18 2HG2 VAL 18 6.688 -1.203 -3.260 130 H LEU 19 HN LEU 19 7.882 -6.374 -5.042 131 HA LEU 19 HA LEU 19 6.082 -7.220 -7.137 132 HB2 LEU 19 2HB LEU 19 7.963 -8.450 -7.318 133 HB3 LEU 19 3HB LEU 19 8.334 -8.366 -5.608 134 HG LEU 19 HG LEU 19 6.656 -10.088 -5.130 135 HD11 LEU 19 1HD1 LEU 19 4.992 -10.548 -6.519 136 HD12 LEU 19 2HD1 LEU 19 5.665 -9.402 -7.704 137 HD13 LEU 19 3HD1 LEU 19 6.148 -11.114 -7.747 138 HD21 LEU 19 3HD2 LEU 19 7.854 -11.819 -6.916 139 HD22 LEU 19 1HD2 LEU 19 9.029 -10.488 -6.790 140 HD23 LEU 19 2HD2 LEU 19 8.490 -11.342 -5.324 141 H GLU 20 HN GLU 20 6.559 -7.898 -3.598 142 HA GLU 20 HA GLU 20 3.673 -8.163 -3.445 143 HB2 GLU 20 2HB GLU 20 3.759 -10.223 -2.233 144 HB3 GLU 20 3HB GLU 20 4.791 -10.452 -3.630 145 HG2 GLU 20 2HG GLU 20 6.702 -9.570 -1.987 146 HG3 GLU 20 3HG GLU 20 5.580 -10.063 -0.736 147 H GLU 21 HN GLU 21 3.116 -6.486 -2.114 148 HA GLU 21 HA GLU 21 4.859 -5.265 -0.383 149 HB2 GLU 21 2HB GLU 21 2.682 -4.342 -1.292 150 HB3 GLU 21 3HB GLU 21 1.820 -5.350 -0.145 151 HG2 GLU 21 2HG GLU 21 4.002 -3.682 1.030 152 HG3 GLU 21 3HG GLU 21 2.651 -2.779 0.377 153 H GLY 22 HN GLY 22 4.777 -5.149 2.040 154 HA2 GLY 22 1HA GLY 22 3.996 -7.752 3.212 155 HA3 GLY 22 2HA GLY 22 5.506 -6.947 3.586 156 H GLY 23 HN GLY 23 5.410 -4.749 4.618 157 HA2 GLY 23 1HA GLY 23 3.134 -3.512 5.552 158 HA3 GLY 23 2HA GLY 23 3.509 -4.740 6.744 159 H GLY 24 HN GLY 24 5.476 -2.470 4.681 160 HA2 GLY 24 1HA GLY 24 6.419 -1.029 6.978 161 HA3 GLY 24 2HA GLY 24 7.617 -2.134 6.337 162 H THR 25 HN THR 25 8.634 0.189 6.062 163 HA THR 25 HA THR 25 7.930 1.106 3.351 164 HB THR 25 HB THR 25 8.629 2.660 5.886 165 HG1 THR 25 HG1 THR 25 6.612 3.004 3.798 166 HG21 THR 25 3HG2 THR 25 8.427 3.690 3.006 167 HG22 THR 25 1HG2 THR 25 8.594 4.698 4.463 168 HG23 THR 25 2HG2 THR 25 9.928 3.632 3.961 169 H LEU 26 HN LEU 26 9.684 1.887 2.037 170 HA LEU 26 HA LEU 26 12.134 0.461 2.702 171 HB2 LEU 26 2HB LEU 26 11.451 1.815 0.103 172 HB3 LEU 26 3HB LEU 26 12.661 0.585 0.402 173 HG LEU 26 HG LEU 26 9.730 0.008 0.810 174 HD11 LEU 26 1HD1 LEU 26 9.296 0.185 -1.355 175 HD12 LEU 26 2HD1 LEU 26 10.975 0.674 -1.686 176 HD13 LEU 26 3HD1 LEU 26 10.535 -1.050 -1.688 177 HD21 LEU 26 3HD2 LEU 26 11.735 -1.987 -0.146 178 HD22 LEU 26 1HD2 LEU 26 11.798 -1.471 1.557 179 HD23 LEU 26 2HD2 LEU 26 10.311 -2.197 0.901 180 H VAL 27 HN VAL 27 12.879 1.903 4.377 181 HA VAL 27 HA VAL 27 13.303 4.660 3.685 182 HB VAL 27 HB VAL 27 14.156 3.010 6.074 183 HG11 VAL 27 1HG1 VAL 27 15.092 4.840 6.999 184 HG12 VAL 27 2HG1 VAL 27 15.185 5.437 5.325 185 HG13 VAL 27 3HG1 VAL 27 13.831 5.927 6.370 186 HG21 VAL 27 3HG2 VAL 27 11.608 4.259 5.300 187 HG22 VAL 27 1HG2 VAL 27 11.954 3.012 6.523 188 HG23 VAL 27 2HG2 VAL 27 12.180 4.733 6.918 189 H CYS 28 HN CYS 28 14.836 5.090 2.162 190 HA CYS 28 HA CYS 28 17.388 3.690 2.501 191 HB2 CYS 28 2HB CYS 28 16.100 3.110 0.422 192 HB3 CYS 28 3HB CYS 28 16.275 4.776 -0.092 193 H CYS 29 HN CYS 29 19.256 5.020 2.540 194 HA CYS 29 HA CYS 29 20.453 6.840 2.793 195 HB2 CYS 29 2HB CYS 29 18.378 7.979 0.928 196 HB3 CYS 29 3HB CYS 29 19.693 8.955 1.553 197 H GLY 30 HN GLY 30 17.956 6.106 4.484 198 HA2 GLY 30 1HA GLY 30 17.196 6.879 6.474 199 HA3 GLY 30 2HA GLY 30 18.123 8.352 6.262 200 H GLU 31 HN GLU 31 15.959 7.259 3.673 201 HA GLU 31 HA GLU 31 13.923 9.095 4.609 202 HB2 GLU 31 2HB GLU 31 15.761 9.918 2.714 203 HB3 GLU 31 3HB GLU 31 14.477 9.296 1.697 204 HG2 GLU 31 2HG GLU 31 12.849 10.693 3.158 205 HG3 GLU 31 3HG GLU 31 14.273 11.476 3.814 206 H ASP 32 HN ASP 32 11.828 8.406 4.134 207 HA ASP 32 HA ASP 32 11.547 5.755 3.342 208 HB2 ASP 32 2HB ASP 32 9.032 6.527 3.161 209 HB3 ASP 32 3HB ASP 32 9.817 6.507 4.728 210 H MET 33 HN MET 33 11.918 5.113 1.205 211 HA MET 33 HA MET 33 12.123 6.624 -0.961 212 HB2 MET 33 2HB MET 33 12.132 3.939 -0.453 213 HB3 MET 33 3HB MET 33 10.602 4.035 -1.302 214 HG2 MET 33 2HG MET 33 11.674 4.169 -3.299 215 HG3 MET 33 3HG MET 33 12.533 5.605 -2.775 216 HE1 MET 33 3HE MET 33 14.091 1.561 -3.546 217 HE2 MET 33 1HE MET 33 12.874 1.447 -2.253 218 HE3 MET 33 2HE MET 33 12.467 2.248 -3.789 219 H VAL 34 HN VAL 34 10.775 7.287 -2.758 220 HA VAL 34 HA VAL 34 8.010 7.725 -1.919 221 HB VAL 34 HB VAL 34 8.018 9.618 -3.224 222 HG11 VAL 34 1HG1 VAL 34 9.821 9.554 -1.347 223 HG12 VAL 34 2HG1 VAL 34 10.985 9.564 -2.694 224 HG13 VAL 34 3HG1 VAL 34 9.827 10.903 -2.507 225 HG21 VAL 34 3HG2 VAL 34 8.707 8.486 -5.321 226 HG22 VAL 34 1HG2 VAL 34 9.489 10.071 -5.107 227 HG23 VAL 34 2HG2 VAL 34 10.403 8.576 -4.790 228 H LYS 35 HN LYS 35 6.304 7.557 -3.652 229 HA LYS 35 HA LYS 35 6.780 5.098 -5.127 230 HB2 LYS 35 2HB LYS 35 4.691 5.911 -3.578 231 HB3 LYS 35 3HB LYS 35 4.104 6.369 -5.164 232 HG2 LYS 35 2HG LYS 35 3.393 4.160 -5.136 233 HG3 LYS 35 3HG LYS 35 4.980 3.928 -5.840 234 HD2 LYS 35 2HD LYS 35 5.722 2.757 -4.033 235 HD3 LYS 35 3HD LYS 35 5.131 3.964 -2.909 236 HE2 LYS 35 2HE LYS 35 3.163 2.104 -4.275 237 HE3 LYS 35 3HE LYS 35 4.082 1.530 -2.898 238 HZ1 LYS 35 2HZ LYS 35 1.820 2.739 -2.521 239 HZ3 LYS 35 1HZ LYS 35 2.684 4.110 -2.674 240 H GLN 36 HN GLN 36 6.329 4.897 -7.403 241 HA GLN 36 HA GLN 36 6.499 7.484 -8.744 242 HB2 GLN 36 2HB GLN 36 7.583 4.830 -9.780 243 HB3 GLN 36 3HB GLN 36 7.831 6.413 -10.489 244 HG2 GLN 36 2HG GLN 36 8.702 5.810 -7.635 245 HG3 GLN 36 3HG GLN 36 9.734 5.428 -9.000 246 HE21 GLN 36 1HE2 GLN 36 8.217 7.933 -7.122 247 HE22 GLN 36 2HE2 GLN 36 9.120 9.283 -7.721 248 H1 ALA 1 HN ALA 1 23.109 -1.931 -3.872 249 HA ALA 1 HA ALA 1 23.295 -4.594 -4.722 250 HB1 ALA 1 1HB ALA 1 21.348 -3.132 -3.664 251 HB2 ALA 1 2HB ALA 1 20.925 -2.859 -5.372 252 HB3 ALA 1 3HB ALA 1 20.977 -4.515 -4.721 253 H ASN 2 HN ASN 2 22.072 -5.234 -6.913 254 HA ASN 2 HA ASN 2 23.069 -3.481 -9.005 255 HB2 ASN 2 2HB ASN 2 24.059 -6.125 -8.340 256 HB3 ASN 2 3HB ASN 2 23.246 -6.232 -9.888 257 HD21 ASN 2 1HD2 ASN 2 25.561 -6.739 -10.422 258 HD22 ASN 2 2HD2 ASN 2 26.581 -5.434 -10.926 259 H GLU 3 HN GLU 3 21.769 -3.608 -10.989 260 HA GLU 3 HA GLU 3 19.123 -3.921 -10.672 261 HB2 GLU 3 2HB GLU 3 20.777 -4.317 -13.202 262 HB3 GLU 3 3HB GLU 3 19.035 -4.126 -13.201 263 HG2 GLU 3 2HG GLU 3 19.342 -1.914 -11.981 264 HG3 GLU 3 3HG GLU 3 21.074 -2.097 -12.175 265 H GLY 4 HN GLY 4 17.560 -5.547 -11.592 266 HA2 GLY 4 1HA GLY 4 16.773 -7.642 -11.830 267 HA3 GLY 4 2HA GLY 4 18.384 -8.155 -12.292 268 H ASP 5 HN ASP 5 17.752 -6.514 -9.185 269 HA ASP 5 HA ASP 5 18.444 -9.026 -7.895 270 HB2 ASP 5 2HB ASP 5 19.023 -6.150 -7.373 271 HB3 ASP 5 3HB ASP 5 18.620 -7.071 -5.938 272 H VAL 6 HN VAL 6 17.365 -9.276 -5.616 273 HA VAL 6 HA VAL 6 14.746 -7.974 -5.522 274 HB VAL 6 HB VAL 6 15.365 -10.885 -5.744 275 HG11 VAL 6 1HG1 VAL 6 14.322 -11.165 -3.718 276 HG12 VAL 6 2HG1 VAL 6 13.359 -9.677 -3.878 277 HG13 VAL 6 3HG1 VAL 6 12.900 -11.137 -4.789 278 HG21 VAL 6 3HG2 VAL 6 13.037 -10.712 -6.894 279 HG22 VAL 6 1HG2 VAL 6 13.332 -8.956 -6.852 280 HG23 VAL 6 2HG2 VAL 6 14.461 -10.028 -7.715 281 H TYR 7 HN TYR 7 14.106 -7.401 -3.459 282 HA TYR 7 HA TYR 7 15.908 -8.277 -1.302 283 HB2 TYR 7 2HB TYR 7 14.683 -5.647 -2.213 284 HB3 TYR 7 3HB TYR 7 14.851 -5.873 -0.483 285 HD1 TYR 7 HD1 TYR 7 17.121 -6.165 0.527 286 HD2 TYR 7 HD2 TYR 7 16.591 -5.201 -3.608 287 HE1 TYR 7 HE1 TYR 7 19.547 -5.418 0.382 288 HE2 TYR 7 HE2 TYR 7 19.019 -4.459 -3.738 289 HH TYR 7 HH TYR 7 21.162 -5.075 -2.422 290 H LYS 8 HN LYS 8 14.955 -9.285 0.404 291 HA LYS 8 HA LYS 8 12.040 -8.984 0.626 292 HB2 LYS 8 2HB LYS 8 12.217 -11.171 -0.069 293 HB3 LYS 8 3HB LYS 8 13.787 -11.410 0.670 294 HG2 LYS 8 2HG LYS 8 12.608 -12.530 2.281 295 HG3 LYS 8 3HG LYS 8 12.281 -10.928 2.913 296 HD2 LYS 8 2HD LYS 8 10.099 -10.866 2.032 297 HD3 LYS 8 3HD LYS 8 10.466 -12.008 0.754 298 HE2 LYS 8 2HE LYS 8 10.911 -13.601 2.942 299 HE3 LYS 8 3HE LYS 8 9.694 -12.525 3.600 300 HZ1 LYS 8 2HZ LYS 8 8.133 -13.546 2.367 301 HZ3 LYS 8 1HZ LYS 8 9.230 -14.670 1.934 302 H CYS 9 HN CYS 9 11.248 -8.332 2.582 303 HA CYS 9 HA CYS 9 13.128 -7.416 4.488 304 HB2 CYS 9 2HB CYS 9 11.043 -6.206 4.057 305 HB3 CYS 9 3HB CYS 9 10.099 -7.574 4.611 306 H GLU 10 HN GLU 10 13.176 -8.133 6.800 307 HA GLU 10 HA GLU 10 12.684 -10.997 6.927 308 HB2 GLU 10 2HB GLU 10 14.686 -9.164 8.265 309 HB3 GLU 10 3HB GLU 10 14.292 -10.703 9.005 310 HG2 GLU 10 2HG GLU 10 14.820 -10.891 6.089 311 HG3 GLU 10 3HG GLU 10 16.196 -10.321 7.013 312 H LEU 11 HN LEU 11 10.551 -9.005 7.273 313 HA LEU 11 HA LEU 11 9.745 -9.810 9.943 314 HB2 LEU 11 2HB LEU 11 10.781 -7.698 10.377 315 HB3 LEU 11 3HB LEU 11 9.942 -6.940 9.039 316 HG LEU 11 HG LEU 11 7.874 -6.931 10.168 317 HD11 LEU 11 1HD1 LEU 11 9.017 -8.683 12.355 318 HD12 LEU 11 2HD1 LEU 11 7.333 -8.145 12.153 319 HD13 LEU 11 3HD1 LEU 11 8.046 -9.288 10.992 320 HD21 LEU 11 3HD2 LEU 11 8.695 -5.152 11.234 321 HD22 LEU 11 1HD2 LEU 11 8.848 -6.217 12.652 322 HD23 LEU 11 2HD2 LEU 11 10.243 -5.961 11.577 323 H CYS 12 HN CYS 12 8.494 -7.383 7.566 324 HA CYS 12 HA CYS 12 5.923 -8.525 7.679 325 HB2 CYS 12 2HB CYS 12 5.397 -6.939 5.855 326 HB3 CYS 12 3HB CYS 12 6.118 -6.195 7.268 327 H GLY 13 HN GLY 13 8.760 -8.734 5.481 328 HA2 GLY 13 1HA GLY 13 9.277 -10.588 4.195 329 HA3 GLY 13 2HA GLY 13 7.618 -11.144 4.290 330 H GLN 14 HN GLN 14 8.574 -7.779 3.482 331 HA GLN 14 HA GLN 14 7.038 -7.960 1.101 332 HB2 GLN 14 2HB GLN 14 6.964 -5.904 2.389 333 HB3 GLN 14 3HB GLN 14 8.708 -5.736 2.339 334 HG2 GLN 14 2HG GLN 14 8.701 -5.264 -0.030 335 HG3 GLN 14 3HG GLN 14 7.041 -5.798 -0.209 336 HE21 GLN 14 1HE2 GLN 14 8.608 -3.728 2.221 337 HE22 GLN 14 2HE2 GLN 14 7.635 -2.317 1.973 338 H VAL 15 HN VAL 15 7.746 -8.324 -0.978 339 HA VAL 15 HA VAL 15 10.661 -8.462 -1.325 340 HB VAL 15 HB VAL 15 8.470 -9.979 -2.756 341 HG11 VAL 15 1HG1 VAL 15 10.892 -9.376 -3.789 342 HG12 VAL 15 2HG1 VAL 15 11.307 -10.855 -2.890 343 HG13 VAL 15 3HG1 VAL 15 10.030 -10.895 -4.129 344 HG21 VAL 15 3HG2 VAL 15 8.650 -11.655 -1.267 345 HG22 VAL 15 1HG2 VAL 15 10.418 -11.492 -1.152 346 HG23 VAL 15 2HG2 VAL 15 9.362 -10.428 -0.192 347 H VAL 16 HN VAL 16 11.581 -7.102 -2.790 348 HA VAL 16 HA VAL 16 9.800 -5.890 -4.774 349 HB VAL 16 HB VAL 16 10.564 -3.726 -4.323 350 HG11 VAL 16 1HG1 VAL 16 9.986 -5.233 -1.766 351 HG12 VAL 16 2HG1 VAL 16 10.181 -3.463 -1.800 352 HG13 VAL 16 3HG1 VAL 16 8.885 -4.234 -2.746 353 HG21 VAL 16 3HG2 VAL 16 12.772 -5.093 -2.815 354 HG22 VAL 16 1HG2 VAL 16 12.853 -3.791 -4.026 355 HG23 VAL 16 2HG2 VAL 16 12.307 -3.433 -2.369 356 H LYS 17 HN LYS 17 10.673 -5.775 -6.817 357 HA LYS 17 HA LYS 17 13.340 -6.925 -7.075 358 HB2 LYS 17 2HB LYS 17 12.173 -8.145 -8.554 359 HB3 LYS 17 3HB LYS 17 10.856 -6.992 -8.632 360 HG2 LYS 17 2HG LYS 17 11.899 -7.061 -10.824 361 HG3 LYS 17 3HG LYS 17 12.290 -5.513 -10.100 362 HD2 LYS 17 2HD LYS 17 14.416 -6.118 -10.794 363 HD3 LYS 17 3HD LYS 17 14.439 -6.856 -9.205 364 HE2 LYS 17 2HE LYS 17 15.045 -8.737 -10.386 365 HE3 LYS 17 3HE LYS 17 13.315 -8.906 -10.604 366 HZ1 LYS 17 2HZ LYS 17 14.973 -7.377 -12.525 367 HZ3 LYS 17 1HZ LYS 17 13.459 -7.931 -12.752 368 H VAL 18 HN VAL 18 15.043 -5.582 -7.258 369 HA VAL 18 HA VAL 18 14.658 -2.811 -7.698 370 HB VAL 18 HB VAL 18 17.085 -4.600 -7.556 371 HG11 VAL 18 1HG1 VAL 18 17.711 -2.722 -8.935 372 HG12 VAL 18 2HG1 VAL 18 16.952 -1.579 -7.801 373 HG13 VAL 18 3HG1 VAL 18 18.400 -2.488 -7.311 374 HG21 VAL 18 3HG2 VAL 18 17.326 -3.126 -5.393 375 HG22 VAL 18 1HG2 VAL 18 15.578 -2.875 -5.612 376 HG23 VAL 18 2HG2 VAL 18 16.222 -4.522 -5.411 377 H LEU 19 HN LEU 19 14.494 -1.709 -9.584 378 HA LEU 19 HA LEU 19 15.019 -3.217 -12.026 379 HB2 LEU 19 2HB LEU 19 13.763 -1.328 -13.085 380 HB3 LEU 19 3HB LEU 19 12.850 -2.353 -11.995 381 HG LEU 19 HG LEU 19 14.021 0.047 -10.729 382 HD11 LEU 19 1HD1 LEU 19 13.360 0.802 -13.070 383 HD12 LEU 19 2HD1 LEU 19 11.680 0.459 -12.591 384 HD13 LEU 19 3HD1 LEU 19 12.627 1.675 -11.703 385 HD21 LEU 19 3HD2 LEU 19 11.132 -0.786 -10.706 386 HD22 LEU 19 1HD2 LEU 19 12.353 -1.706 -9.794 387 HD23 LEU 19 2HD2 LEU 19 12.093 0.020 -9.442 388 H GLU 20 HN GLU 20 15.936 -0.241 -10.233 389 HA GLU 20 HA GLU 20 18.351 -0.211 -11.803 390 HB2 GLU 20 2HB GLU 20 18.162 1.999 -12.597 391 HB3 GLU 20 3HB GLU 20 16.554 1.351 -12.853 392 HG2 GLU 20 2HG GLU 20 16.028 2.298 -10.455 393 HG3 GLU 20 3HG GLU 20 17.492 3.239 -10.665 394 H GLU 21 HN GLU 21 19.917 -0.331 -10.256 395 HA GLU 21 HA GLU 21 19.463 0.224 -7.605 396 HB2 GLU 21 2HB GLU 21 21.869 -0.058 -7.314 397 HB3 GLU 21 3HB GLU 21 21.297 -1.216 -8.498 398 HG2 GLU 21 2HG GLU 21 21.912 0.957 -10.110 399 HG3 GLU 21 3HG GLU 21 23.126 1.103 -8.853 400 H GLY 22 HN GLY 22 20.779 1.892 -6.257 401 HA2 GLY 22 1HA GLY 22 20.917 4.473 -7.690 402 HA3 GLY 22 2HA GLY 22 20.043 4.308 -6.181 403 H GLY 23 HN GLY 23 21.324 3.376 -4.259 404 HA2 GLY 23 1HA GLY 23 23.963 3.040 -3.986 405 HA3 GLY 23 2HA GLY 23 23.861 4.784 -4.127 406 H GLY 24 HN GLY 24 21.799 2.246 -2.522 407 HA2 GLY 24 1HA GLY 24 22.471 3.160 0.105 408 HA3 GLY 24 2HA GLY 24 20.906 3.755 -0.413 409 H THR 25 HN THR 25 20.151 2.366 1.462 410 HA THR 25 HA THR 25 19.706 -0.377 0.493 411 HB THR 25 HB THR 25 20.453 0.591 3.301 412 HG1 THR 25 HG1 THR 25 21.558 -1.430 1.493 413 HG21 THR 25 3HG2 THR 25 19.081 -1.221 3.878 414 HG22 THR 25 1HG2 THR 25 19.253 -1.985 2.279 415 HG23 THR 25 2HG2 THR 25 20.573 -2.102 3.467 416 H LEU 26 HN LEU 26 17.722 -1.388 1.271 417 HA LEU 26 HA LEU 26 15.670 0.667 1.606 418 HB2 LEU 26 2HB LEU 26 15.040 -2.177 0.975 419 HB3 LEU 26 3HB LEU 26 14.204 -0.708 0.511 420 HG LEU 26 HG LEU 26 16.933 -1.290 -0.610 421 HD11 LEU 26 1HD1 LEU 26 14.903 -3.142 -0.847 422 HD12 LEU 26 2HD1 LEU 26 14.730 -2.164 -2.324 423 HD13 LEU 26 3HD1 LEU 26 16.284 -2.948 -1.954 424 HD21 LEU 26 3HD2 LEU 26 14.626 0.484 -1.258 425 HD22 LEU 26 1HD2 LEU 26 16.376 0.801 -1.316 426 HD23 LEU 26 2HD2 LEU 26 15.600 -0.146 -2.608 427 H VAL 27 HN VAL 27 16.085 1.023 3.877 428 HA VAL 27 HA VAL 27 15.988 -1.161 5.691 429 HB VAL 27 HB VAL 27 15.766 1.835 6.033 430 HG11 VAL 27 1HG1 VAL 27 16.443 -0.050 8.278 431 HG12 VAL 27 2HG1 VAL 27 15.814 1.613 8.342 432 HG13 VAL 27 3HG1 VAL 27 14.741 0.274 7.870 433 HG21 VAL 27 3HG2 VAL 27 18.049 1.878 6.426 434 HG22 VAL 27 1HG2 VAL 27 18.119 0.153 6.859 435 HG23 VAL 27 2HG2 VAL 27 17.928 0.636 5.156 436 H CYS 28 HN CYS 28 14.172 -2.379 5.892 437 HA CYS 28 HA CYS 28 11.647 -0.895 6.029 438 HB2 CYS 28 2HB CYS 28 11.951 -2.387 4.018 439 HB3 CYS 28 3HB CYS 28 11.982 -3.755 5.112 440 H CYS 29 HN CYS 29 10.487 -1.166 7.935 441 HA CYS 29 HA CYS 29 9.973 -1.830 9.961 442 HB2 CYS 29 2HB CYS 29 11.058 -4.473 8.983 443 HB3 CYS 29 3HB CYS 29 10.349 -4.266 10.572 444 H GLY 30 HN GLY 30 12.488 -0.467 9.442 445 HA2 GLY 30 1HA GLY 30 14.356 0.141 10.531 446 HA3 GLY 30 2HA GLY 30 13.757 -0.738 11.924 447 H GLU 31 HN GLU 31 14.129 -2.489 8.879 448 HA GLU 31 HA GLU 31 16.708 -3.475 9.765 449 HB2 GLU 31 2HB GLU 31 14.595 -4.937 10.461 450 HB3 GLU 31 3HB GLU 31 14.657 -5.464 8.791 451 HG2 GLU 31 2HG GLU 31 16.686 -6.570 9.057 452 HG3 GLU 31 3HG GLU 31 17.264 -5.454 10.279 453 H ASP 32 HN ASP 32 18.130 -3.382 8.082 454 HA ASP 32 HA ASP 32 17.389 -2.536 5.599 455 HB2 ASP 32 2HB ASP 32 19.806 -4.290 6.235 456 HB3 ASP 32 3HB ASP 32 19.664 -3.166 4.898 457 H MET 33 HN MET 33 16.150 -3.643 4.078 458 HA MET 33 HA MET 33 15.382 -6.214 4.245 459 HB2 MET 33 2HB MET 33 14.796 -4.182 2.589 460 HB3 MET 33 3HB MET 33 15.937 -4.976 1.521 461 HG2 MET 33 2HG MET 33 14.599 -6.916 1.303 462 HG3 MET 33 3HG MET 33 13.757 -6.634 2.813 463 HE1 MET 33 3HE MET 33 12.829 -4.319 3.225 464 HE2 MET 33 1HE MET 33 12.924 -3.083 1.947 465 HE3 MET 33 2HE MET 33 11.378 -3.900 2.283 466 H VAL 34 HN VAL 34 16.047 -8.245 3.409 467 HA VAL 34 HA VAL 34 18.896 -8.375 2.855 468 HB VAL 34 HB VAL 34 18.811 -10.532 3.603 469 HG11 VAL 34 1HG1 VAL 34 17.672 -8.707 5.208 470 HG12 VAL 34 2HG1 VAL 34 16.311 -9.846 5.075 471 HG13 VAL 34 3HG1 VAL 34 17.886 -10.409 5.684 472 HG21 VAL 34 3HG2 VAL 34 16.810 -11.985 3.571 473 HG22 VAL 34 1HG2 VAL 34 15.878 -10.663 2.826 474 HG23 VAL 34 2HG2 VAL 34 17.243 -11.394 1.948 475 H LYS 35 HN LYS 35 19.668 -9.832 1.072 476 HA LYS 35 HA LYS 35 18.019 -9.336 -1.278 477 HB2 LYS 35 2HB LYS 35 20.512 -8.667 -1.009 478 HB3 LYS 35 3HB LYS 35 20.854 -10.365 -1.281 479 HG2 LYS 35 2HG LYS 35 18.943 -9.033 -3.187 480 HG3 LYS 35 3HG LYS 35 20.633 -8.586 -3.311 481 HD2 LYS 35 2HD LYS 35 21.318 -10.833 -3.787 482 HD3 LYS 35 3HD LYS 35 19.810 -11.510 -3.203 483 HE2 LYS 35 2HE LYS 35 19.395 -9.573 -5.397 484 HE3 LYS 35 3HE LYS 35 20.423 -10.911 -5.875 485 HZ1 LYS 35 2HZ LYS 35 18.716 -12.402 -5.597 486 HZ3 LYS 35 1HZ LYS 35 17.793 -11.101 -5.919 487 H GLN 36 HN GLN 36 17.574 -11.029 -2.833 488 HA GLN 36 HA GLN 36 17.571 -13.638 -1.531 489 HB2 GLN 36 2HB GLN 36 15.673 -12.668 -3.710 490 HB3 GLN 36 3HB GLN 36 15.542 -14.155 -2.792 491 HG2 GLN 36 2HG GLN 36 15.528 -11.417 -1.452 492 HG3 GLN 36 3HG GLN 36 14.059 -12.179 -2.028 493 HE21 GLN 36 1HE2 GLN 36 16.620 -12.214 0.302 494 HE22 GLN 36 2HE2 GLN 36 15.974 -13.403 1.384 Start of MODEL 16 1 H1 ALA 1 HN ALA 1 3.822 -3.562 0.398 2 HA ALA 1 HA ALA 1 3.105 -1.073 1.586 3 HB1 ALA 1 1HB ALA 1 4.081 -0.016 -0.746 4 HB2 ALA 1 2HB ALA 1 4.927 0.050 0.818 5 HB3 ALA 1 3HB ALA 1 5.336 -1.218 -0.362 6 H ASN 2 HN ASN 2 3.547 -2.308 -1.807 7 HA ASN 2 HA ASN 2 0.842 -3.037 -1.994 8 HB2 ASN 2 2HB ASN 2 1.725 -0.347 -3.084 9 HB3 ASN 2 3HB ASN 2 0.535 -1.264 -3.986 10 HD21 ASN 2 1HD2 ASN 2 -1.387 -2.002 -2.854 11 HD22 ASN 2 2HD2 ASN 2 -2.072 -1.035 -1.590 12 H GLU 3 HN GLU 3 0.703 -4.516 -3.736 13 HA GLU 3 HA GLU 3 3.103 -5.097 -5.090 14 HB2 GLU 3 2HB GLU 3 0.271 -6.177 -5.412 15 HB3 GLU 3 3HB GLU 3 1.660 -6.834 -6.254 16 HG2 GLU 3 2HG GLU 3 2.767 -7.176 -3.969 17 HG3 GLU 3 3HG GLU 3 1.243 -6.723 -3.233 18 H GLY 4 HN GLY 4 3.707 -4.710 -7.243 19 HA2 GLY 4 1HA GLY 4 3.565 -3.912 -9.360 20 HA3 GLY 4 2HA GLY 4 1.841 -3.672 -9.160 21 H ASP 5 HN ASP 5 3.973 -2.334 -6.691 22 HA ASP 5 HA ASP 5 3.440 0.293 -7.832 23 HB2 ASP 5 2HB ASP 5 3.691 -0.714 -4.979 24 HB3 ASP 5 3HB ASP 5 3.946 0.983 -5.334 25 H VAL 6 HN VAL 6 5.268 1.543 -8.344 26 HA VAL 6 HA VAL 6 7.852 0.358 -7.753 27 HB VAL 6 HB VAL 6 6.741 2.321 -9.702 28 HG11 VAL 6 1HG1 VAL 6 9.702 2.189 -9.040 29 HG12 VAL 6 2HG1 VAL 6 8.930 3.165 -10.314 30 HG13 VAL 6 3HG1 VAL 6 8.617 3.530 -8.600 31 HG21 VAL 6 3HG2 VAL 6 7.603 0.895 -11.302 32 HG22 VAL 6 1HG2 VAL 6 8.913 0.319 -10.244 33 HG23 VAL 6 2HG2 VAL 6 7.246 -0.248 -9.985 34 H TYR 7 HN TYR 7 9.624 1.684 -6.875 35 HA TYR 7 HA TYR 7 8.711 4.017 -5.365 36 HB2 TYR 7 2HB TYR 7 9.891 1.355 -4.459 37 HB3 TYR 7 3HB TYR 7 10.363 2.790 -3.571 38 HD1 TYR 7 HD2 TYR 7 7.564 0.545 -4.402 39 HD2 TYR 7 HD1 TYR 7 8.781 3.968 -2.143 40 HE1 TYR 7 HE2 TYR 7 5.441 0.392 -3.012 41 HE2 TYR 7 HE1 TYR 7 6.655 3.804 -0.760 42 HH TYR 7 HH TYR 7 5.038 2.194 -0.133 43 H LYS 8 HN LYS 8 10.098 5.693 -5.635 44 HA LYS 8 HA LYS 8 12.833 5.002 -6.458 45 HB2 LYS 8 2HB LYS 8 11.966 6.022 -8.340 46 HB3 LYS 8 3HB LYS 8 10.908 7.081 -7.428 47 HG2 LYS 8 2HG LYS 8 12.519 8.646 -7.945 48 HG3 LYS 8 3HG LYS 8 13.279 8.007 -6.500 49 HD2 LYS 8 2HD LYS 8 14.989 7.042 -7.675 50 HD3 LYS 8 3HD LYS 8 13.914 6.414 -8.908 51 HE2 LYS 8 2HE LYS 8 14.761 9.345 -8.734 52 HE3 LYS 8 3HE LYS 8 15.569 8.159 -9.741 53 HZ1 LYS 8 2HZ LYS 8 12.677 8.320 -10.062 54 HZ3 LYS 8 1HZ LYS 8 13.827 8.126 -11.198 55 H CYS 9 HN CYS 9 14.528 5.850 -5.296 56 HA CYS 9 HA CYS 9 13.842 6.998 -2.778 57 HB2 CYS 9 2HB CYS 9 15.653 5.353 -2.965 58 HB3 CYS 9 3HB CYS 9 16.548 6.421 -4.028 59 H GLU 10 HN GLU 10 14.463 9.143 -2.047 60 HA GLU 10 HA GLU 10 14.751 10.977 -4.284 61 HB2 GLU 10 2HB GLU 10 13.559 11.214 -1.514 62 HB3 GLU 10 3HB GLU 10 14.088 12.662 -2.347 63 HG2 GLU 10 2HG GLU 10 12.415 10.752 -3.946 64 HG3 GLU 10 3HG GLU 10 11.596 11.591 -2.644 65 H LEU 11 HN LEU 11 17.036 9.461 -3.315 66 HA LEU 11 HA LEU 11 18.672 11.722 -2.467 67 HB2 LEU 11 2HB LEU 11 17.986 9.461 -0.819 68 HB3 LEU 11 3HB LEU 11 19.707 9.455 -1.151 69 HG LEU 11 HG LEU 11 18.698 12.104 -0.389 70 HD11 LEU 11 1HD1 LEU 11 17.521 9.997 1.000 71 HD12 LEU 11 2HD1 LEU 11 18.862 10.527 2.044 72 HD13 LEU 11 3HD1 LEU 11 17.629 11.697 1.517 73 HD21 LEU 11 3HD2 LEU 11 20.797 12.343 0.314 74 HD22 LEU 11 1HD2 LEU 11 20.719 10.869 1.308 75 HD23 LEU 11 2HD2 LEU 11 21.120 10.755 -0.421 76 H CYS 12 HN CYS 12 19.010 8.156 -3.100 77 HA CYS 12 HA CYS 12 21.314 8.728 -4.720 78 HB2 CYS 12 2HB CYS 12 21.464 6.271 -4.933 79 HB3 CYS 12 3HB CYS 12 21.479 6.846 -3.278 80 H GLY 13 HN GLY 13 17.973 7.356 -5.054 81 HA2 GLY 13 1HA GLY 13 16.639 7.995 -6.926 82 HA3 GLY 13 2HA GLY 13 18.080 8.044 -7.923 83 H GLN 14 HN GLN 14 17.359 5.489 -5.500 84 HA GLN 14 HA GLN 14 17.700 3.536 -7.542 85 HB2 GLN 14 2HB GLN 14 18.647 3.102 -5.349 86 HB3 GLN 14 3HB GLN 14 17.102 3.355 -4.561 87 HG2 GLN 14 2HG GLN 14 16.175 1.332 -5.475 88 HG3 GLN 14 3HG GLN 14 17.454 1.185 -6.664 89 HE21 GLN 14 1HE2 GLN 14 17.279 1.723 -3.143 90 HE22 GLN 14 2HE2 GLN 14 18.374 0.466 -2.674 91 H VAL 15 HN VAL 15 16.123 2.363 -8.610 92 HA VAL 15 HA VAL 15 13.359 2.948 -7.806 93 HB VAL 15 HB VAL 15 14.613 2.388 -10.495 94 HG11 VAL 15 1HG1 VAL 15 12.408 2.434 -11.482 95 HG12 VAL 15 2HG1 VAL 15 12.450 1.170 -10.230 96 HG13 VAL 15 3HG1 VAL 15 11.656 2.727 -9.895 97 HG21 VAL 15 3HG2 VAL 15 13.844 4.593 -11.091 98 HG22 VAL 15 1HG2 VAL 15 12.984 4.766 -9.542 99 HG23 VAL 15 2HG2 VAL 15 14.764 4.712 -9.571 100 H VAL 16 HN VAL 16 12.256 1.282 -6.927 101 HA VAL 16 HA VAL 16 13.029 -1.417 -7.773 102 HB VAL 16 HB VAL 16 13.166 -2.209 -5.618 103 HG11 VAL 16 1HG1 VAL 16 14.989 -1.130 -4.818 104 HG12 VAL 16 2HG1 VAL 16 14.818 -0.166 -6.305 105 HG13 VAL 16 3HG1 VAL 16 14.167 0.448 -4.767 106 HG21 VAL 16 3HG2 VAL 16 11.323 -1.635 -4.408 107 HG22 VAL 16 1HG2 VAL 16 12.465 -0.484 -3.674 108 HG23 VAL 16 2HG2 VAL 16 11.353 0.059 -4.953 109 H LYS 17 HN LYS 17 11.314 -2.788 -8.190 110 HA LYS 17 HA LYS 17 8.682 -1.535 -7.951 111 HB2 LYS 17 2HB LYS 17 8.984 -2.063 -10.180 112 HB3 LYS 17 3HB LYS 17 9.915 -3.508 -9.838 113 HG2 LYS 17 2HG LYS 17 7.719 -4.197 -10.636 114 HG3 LYS 17 3HG LYS 17 7.829 -4.604 -8.935 115 HD2 LYS 17 2HD LYS 17 5.755 -3.561 -8.930 116 HD3 LYS 17 3HD LYS 17 6.767 -2.167 -8.610 117 HE2 LYS 17 2HE LYS 17 5.364 -1.432 -10.378 118 HE3 LYS 17 3HE LYS 17 6.860 -1.847 -11.193 119 HZ1 LYS 17 2HZ LYS 17 4.640 -2.791 -12.100 120 HZ3 LYS 17 1HZ LYS 17 4.761 -3.899 -10.911 121 H VAL 18 HN VAL 18 7.305 -2.197 -6.394 122 HA VAL 18 HA VAL 18 8.070 -4.352 -4.696 123 HB VAL 18 HB VAL 18 5.569 -2.657 -4.845 124 HG11 VAL 18 1HG1 VAL 18 5.614 -5.009 -3.601 125 HG12 VAL 18 2HG1 VAL 18 6.422 -4.049 -2.338 126 HG13 VAL 18 3HG1 VAL 18 4.796 -3.592 -2.899 127 HG21 VAL 18 3HG2 VAL 18 8.135 -1.865 -4.204 128 HG22 VAL 18 1HG2 VAL 18 6.636 -1.059 -3.683 129 HG23 VAL 18 2HG2 VAL 18 7.430 -2.239 -2.612 130 H LEU 19 HN LEU 19 7.663 -6.477 -4.990 131 HA LEU 19 HA LEU 19 5.665 -7.169 -7.007 132 HB2 LEU 19 2HB LEU 19 8.163 -8.413 -5.977 133 HB3 LEU 19 3HB LEU 19 6.886 -9.489 -6.506 134 HG LEU 19 HG LEU 19 6.989 -7.758 -8.615 135 HD11 LEU 19 1HD1 LEU 19 8.914 -6.562 -7.621 136 HD12 LEU 19 2HD1 LEU 19 9.856 -8.070 -7.687 137 HD13 LEU 19 3HD1 LEU 19 9.291 -7.308 -9.193 138 HD21 LEU 19 3HD2 LEU 19 7.963 -9.531 -9.843 139 HD22 LEU 19 1HD2 LEU 19 8.783 -10.182 -8.404 140 HD23 LEU 19 2HD2 LEU 19 7.012 -10.288 -8.542 141 H GLU 20 HN GLU 20 6.792 -8.192 -3.706 142 HA GLU 20 HA GLU 20 4.062 -9.118 -3.280 143 HB2 GLU 20 2HB GLU 20 6.405 -10.541 -3.002 144 HB3 GLU 20 3HB GLU 20 6.170 -9.972 -1.362 145 HG2 GLU 20 2HG GLU 20 3.673 -10.791 -1.714 146 HG3 GLU 20 3HG GLU 20 4.349 -11.730 -3.030 147 H GLU 21 HN GLU 21 2.812 -7.950 -1.883 148 HA GLU 21 HA GLU 21 3.897 -5.702 -0.624 149 HB2 GLU 21 2HB GLU 21 1.589 -5.683 -1.351 150 HB3 GLU 21 3HB GLU 21 1.205 -7.101 -0.398 151 HG2 GLU 21 2HG GLU 21 1.559 -5.868 1.697 152 HG3 GLU 21 3HG GLU 21 2.153 -4.469 0.822 153 H GLY 22 HN GLY 22 4.034 -5.228 1.694 154 HA2 GLY 22 1HA GLY 22 4.220 -7.645 3.385 155 HA3 GLY 22 2HA GLY 22 5.507 -6.456 3.336 156 H GLY 23 HN GLY 23 4.557 -4.020 3.553 157 HA2 GLY 23 1HA GLY 23 2.631 -2.867 4.611 158 HA3 GLY 23 2HA GLY 23 2.710 -4.088 5.866 159 H GLY 24 HN GLY 24 5.359 -2.307 4.134 160 HA2 GLY 24 1HA GLY 24 6.024 -0.909 6.622 161 HA3 GLY 24 2HA GLY 24 7.219 -1.999 5.950 162 H THR 25 HN THR 25 8.460 0.155 5.871 163 HA THR 25 HA THR 25 7.892 1.445 3.286 164 HB THR 25 HB THR 25 8.535 2.617 6.018 165 HG1 THR 25 HG1 THR 25 6.364 2.808 5.442 166 HG21 THR 25 3HG2 THR 25 9.013 4.771 4.934 167 HG22 THR 25 1HG2 THR 25 10.189 3.576 4.336 168 HG23 THR 25 2HG2 THR 25 8.803 4.046 3.323 169 H LEU 26 HN LEU 26 9.684 2.044 2.011 170 HA LEU 26 HA LEU 26 12.053 0.487 2.699 171 HB2 LEU 26 2HB LEU 26 11.500 1.814 0.061 172 HB3 LEU 26 3HB LEU 26 12.565 0.468 0.414 173 HG LEU 26 HG LEU 26 9.598 0.187 0.827 174 HD11 LEU 26 1HD1 LEU 26 10.087 -0.920 -1.668 175 HD12 LEU 26 2HD1 LEU 26 9.204 0.587 -1.328 176 HD13 LEU 26 3HD1 LEU 26 10.938 0.641 -1.721 177 HD21 LEU 26 3HD2 LEU 26 10.518 -1.720 1.645 178 HD22 LEU 26 1HD2 LEU 26 10.417 -2.192 -0.068 179 HD23 LEU 26 2HD2 LEU 26 11.959 -1.612 0.604 180 H VAL 27 HN VAL 27 12.746 2.007 4.379 181 HA VAL 27 HA VAL 27 13.296 4.704 3.653 182 HB VAL 27 HB VAL 27 14.182 3.004 5.993 183 HG11 VAL 27 1HG1 VAL 27 15.108 5.554 5.167 184 HG12 VAL 27 2HG1 VAL 27 14.045 5.820 6.570 185 HG13 VAL 27 3HG1 VAL 27 15.430 4.710 6.701 186 HG21 VAL 27 3HG2 VAL 27 12.384 4.353 7.186 187 HG22 VAL 27 1HG2 VAL 27 11.817 4.851 5.573 188 HG23 VAL 27 2HG2 VAL 27 11.809 3.130 6.027 189 H CYS 28 HN CYS 28 14.783 5.139 2.094 190 HA CYS 28 HA CYS 28 17.311 3.670 2.304 191 HB2 CYS 28 2HB CYS 28 15.934 3.140 0.272 192 HB3 CYS 28 3HB CYS 28 16.111 4.812 -0.226 193 H CYS 29 HN CYS 29 19.177 4.956 2.426 194 HA CYS 29 HA CYS 29 20.426 6.744 2.658 195 HB2 CYS 29 2HB CYS 29 18.391 7.953 0.788 196 HB3 CYS 29 3HB CYS 29 19.759 8.864 1.395 197 H GLY 30 HN GLY 30 18.128 6.053 4.480 198 HA2 GLY 30 1HA GLY 30 17.305 6.869 6.411 199 HA3 GLY 30 2HA GLY 30 18.276 8.311 6.191 200 H GLU 31 HN GLU 31 16.111 7.340 3.573 201 HA GLU 31 HA GLU 31 14.115 9.212 4.535 202 HB2 GLU 31 2HB GLU 31 15.773 10.370 2.965 203 HB3 GLU 31 3HB GLU 31 15.200 9.315 1.690 204 HG2 GLU 31 2HG GLU 31 12.816 10.150 2.259 205 HG3 GLU 31 3HG GLU 31 13.584 11.376 3.249 206 H ASP 32 HN ASP 32 12.055 8.427 4.251 207 HA ASP 32 HA ASP 32 11.695 5.854 3.353 208 HB2 ASP 32 2HB ASP 32 9.512 7.971 3.327 209 HB3 ASP 32 3HB ASP 32 9.339 6.260 3.662 210 H MET 33 HN MET 33 11.731 5.110 1.228 211 HA MET 33 HA MET 33 11.986 6.731 -0.940 212 HB2 MET 33 2HB MET 33 12.131 4.050 -0.478 213 HB3 MET 33 3HB MET 33 10.555 4.080 -1.244 214 HG2 MET 33 2HG MET 33 11.487 4.341 -3.302 215 HG3 MET 33 3HG MET 33 12.393 5.745 -2.773 216 HE1 MET 33 3HE MET 33 13.013 2.337 -4.350 217 HE2 MET 33 1HE MET 33 13.734 1.407 -3.013 218 HE3 MET 33 2HE MET 33 12.066 2.013 -2.878 219 H VAL 34 HN VAL 34 10.552 7.301 -2.724 220 HA VAL 34 HA VAL 34 7.808 7.670 -1.785 221 HB VAL 34 HB VAL 34 7.707 9.544 -3.115 222 HG11 VAL 34 1HG1 VAL 34 10.647 9.339 -2.379 223 HG12 VAL 34 2HG1 VAL 34 9.765 10.841 -2.745 224 HG13 VAL 34 3HG1 VAL 34 9.330 9.880 -1.311 225 HG21 VAL 34 3HG2 VAL 34 9.907 8.301 -4.783 226 HG22 VAL 34 1HG2 VAL 34 8.239 8.695 -5.263 227 HG23 VAL 34 2HG2 VAL 34 9.409 10.001 -4.960 228 H LYS 35 HN LYS 35 6.039 7.404 -3.425 229 HA LYS 35 HA LYS 35 6.526 4.943 -4.881 230 HB2 LYS 35 2HB LYS 35 4.477 5.714 -3.291 231 HB3 LYS 35 3HB LYS 35 3.835 6.204 -4.847 232 HG2 LYS 35 2HG LYS 35 3.351 4.050 -5.359 233 HG3 LYS 35 3HG LYS 35 5.038 3.606 -5.188 234 HD2 LYS 35 2HD LYS 35 4.217 2.284 -3.490 235 HD3 LYS 35 3HD LYS 35 4.400 3.755 -2.555 236 HE2 LYS 35 2HE LYS 35 1.839 3.773 -3.971 237 HE3 LYS 35 3HE LYS 35 1.997 2.306 -3.026 238 HZ1 LYS 35 2HZ LYS 35 1.132 4.482 -1.905 239 HZ3 LYS 35 1HZ LYS 35 2.709 4.865 -1.762 240 H GLN 36 HN GLN 36 5.912 4.685 -7.142 241 HA GLN 36 HA GLN 36 6.032 7.241 -8.546 242 HB2 GLN 36 2HB GLN 36 7.192 4.586 -9.498 243 HB3 GLN 36 3HB GLN 36 7.324 6.128 -10.320 244 HG2 GLN 36 2HG GLN 36 8.350 5.742 -7.478 245 HG3 GLN 36 3HG GLN 36 9.343 5.365 -8.872 246 HE21 GLN 36 1HE2 GLN 36 7.791 7.843 -7.004 247 HE22 GLN 36 2HE2 GLN 36 8.555 9.224 -7.719 248 H1 ALA 1 HN ALA 1 20.963 -1.328 -5.794 249 HA ALA 1 HA ALA 1 23.293 -2.129 -4.187 250 HB1 ALA 1 1HB ALA 1 20.594 -2.821 -3.844 251 HB2 ALA 1 2HB ALA 1 21.320 -4.227 -4.661 252 HB3 ALA 1 3HB ALA 1 22.003 -3.640 -3.127 253 H ASN 2 HN ASN 2 21.118 -3.327 -6.851 254 HA ASN 2 HA ASN 2 23.075 -3.330 -8.763 255 HB2 ASN 2 2HB ASN 2 23.303 -5.578 -6.915 256 HB3 ASN 2 3HB ASN 2 22.860 -6.185 -8.499 257 HD21 ASN 2 1HD2 ASN 2 24.350 -6.385 -10.011 258 HD22 ASN 2 2HD2 ASN 2 25.967 -5.767 -9.955 259 H GLU 3 HN GLU 3 21.739 -3.264 -10.576 260 HA GLU 3 HA GLU 3 19.085 -3.745 -10.524 261 HB2 GLU 3 2HB GLU 3 20.977 -3.997 -12.905 262 HB3 GLU 3 3HB GLU 3 19.237 -3.833 -13.034 263 HG2 GLU 3 2HG GLU 3 19.245 -1.606 -12.245 264 HG3 GLU 3 3HG GLU 3 20.773 -1.796 -11.409 265 H GLY 4 HN GLY 4 17.692 -5.462 -11.338 266 HA2 GLY 4 1HA GLY 4 17.080 -7.598 -11.732 267 HA3 GLY 4 2HA GLY 4 18.738 -7.977 -12.153 268 H ASP 5 HN ASP 5 17.699 -6.535 -9.029 269 HA ASP 5 HA ASP 5 18.549 -9.034 -7.788 270 HB2 ASP 5 2HB ASP 5 18.954 -6.138 -7.099 271 HB3 ASP 5 3HB ASP 5 18.704 -7.228 -5.750 272 H VAL 6 HN VAL 6 17.422 -9.377 -5.548 273 HA VAL 6 HA VAL 6 14.745 -8.181 -5.536 274 HB VAL 6 HB VAL 6 15.545 -11.063 -5.583 275 HG11 VAL 6 1HG1 VAL 6 12.975 -10.051 -4.319 276 HG12 VAL 6 2HG1 VAL 6 13.440 -11.750 -4.578 277 HG13 VAL 6 3HG1 VAL 6 14.354 -10.741 -3.430 278 HG21 VAL 6 3HG2 VAL 6 14.684 -10.606 -7.637 279 HG22 VAL 6 1HG2 VAL 6 13.143 -10.913 -6.802 280 HG23 VAL 6 2HG2 VAL 6 13.704 -9.243 -7.047 281 H TYR 7 HN TYR 7 14.030 -7.544 -3.522 282 HA TYR 7 HA TYR 7 15.757 -8.307 -1.263 283 HB2 TYR 7 2HB TYR 7 14.624 -5.696 -2.339 284 HB3 TYR 7 3HB TYR 7 14.741 -5.847 -0.597 285 HD1 TYR 7 HD1 TYR 7 17.022 -6.304 0.443 286 HD2 TYR 7 HD2 TYR 7 16.533 -5.193 -3.658 287 HE1 TYR 7 HE1 TYR 7 19.468 -5.620 0.330 288 HE2 TYR 7 HE2 TYR 7 18.980 -4.512 -3.758 289 HH TYR 7 HH TYR 7 21.033 -4.740 -0.867 290 H LYS 8 HN LYS 8 14.685 -9.346 0.340 291 HA LYS 8 HA LYS 8 11.790 -8.867 0.501 292 HB2 LYS 8 2HB LYS 8 12.160 -11.085 -0.339 293 HB3 LYS 8 3HB LYS 8 13.362 -11.426 0.889 294 HG2 LYS 8 2HG LYS 8 10.705 -10.549 1.936 295 HG3 LYS 8 3HG LYS 8 10.698 -12.091 1.103 296 HD2 LYS 8 2HD LYS 8 12.901 -11.606 3.100 297 HD3 LYS 8 3HD LYS 8 11.289 -11.878 3.731 298 HE2 LYS 8 2HE LYS 8 12.046 -14.080 3.607 299 HE3 LYS 8 3HE LYS 8 11.287 -13.935 2.034 300 HZ1 LYS 8 2HZ LYS 8 13.808 -14.712 2.331 301 HZ3 LYS 8 1HZ LYS 8 14.081 -13.115 2.170 302 H CYS 9 HN CYS 9 10.985 -8.194 2.446 303 HA CYS 9 HA CYS 9 12.891 -7.456 4.423 304 HB2 CYS 9 2HB CYS 9 10.929 -6.049 3.867 305 HB3 CYS 9 3HB CYS 9 9.859 -7.293 4.485 306 H GLU 10 HN GLU 10 13.174 -8.399 6.505 307 HA GLU 10 HA GLU 10 12.100 -11.084 6.679 308 HB2 GLU 10 2HB GLU 10 14.515 -9.673 7.782 309 HB3 GLU 10 3HB GLU 10 13.866 -11.005 8.718 310 HG2 GLU 10 2HG GLU 10 14.050 -11.612 5.824 311 HG3 GLU 10 3HG GLU 10 15.604 -11.237 6.542 312 H LEU 11 HN LEU 11 10.468 -8.636 7.221 313 HA LEU 11 HA LEU 11 9.810 -9.274 10.007 314 HB2 LEU 11 2HB LEU 11 10.627 -6.726 8.869 315 HB3 LEU 11 3HB LEU 11 9.042 -6.629 9.609 316 HG LEU 11 HG LEU 11 10.822 -8.058 11.369 317 HD11 LEU 11 1HD1 LEU 11 12.679 -6.967 10.341 318 HD12 LEU 11 2HD1 LEU 11 11.844 -5.396 10.355 319 HD13 LEU 11 3HD1 LEU 11 12.356 -6.146 11.886 320 HD21 LEU 11 3HD2 LEU 11 9.041 -7.116 12.442 321 HD22 LEU 11 1HD2 LEU 11 10.266 -5.856 12.736 322 HD23 LEU 11 2HD2 LEU 11 9.064 -5.645 11.440 323 H CYS 12 HN CYS 12 8.529 -7.348 7.199 324 HA CYS 12 HA CYS 12 5.901 -8.363 7.806 325 HB2 CYS 12 2HB CYS 12 5.199 -6.859 5.939 326 HB3 CYS 12 3HB CYS 12 5.957 -6.063 7.304 327 H GLY 13 HN GLY 13 8.349 -8.388 5.128 328 HA2 GLY 13 1HA GLY 13 8.768 -10.501 4.041 329 HA3 GLY 13 2HA GLY 13 7.050 -10.837 4.100 330 H GLN 14 HN GLN 14 8.299 -7.572 3.386 331 HA GLN 14 HA GLN 14 6.869 -7.592 0.941 332 HB2 GLN 14 2HB GLN 14 6.907 -5.552 2.238 333 HB3 GLN 14 3HB GLN 14 8.658 -5.542 2.305 334 HG2 GLN 14 2HG GLN 14 8.876 -4.943 0.011 335 HG3 GLN 14 3HG GLN 14 7.253 -5.474 -0.383 336 HE21 GLN 14 1HE2 GLN 14 8.793 -3.302 1.992 337 HE22 GLN 14 2HE2 GLN 14 7.751 -1.940 1.750 338 H VAL 15 HN VAL 15 7.618 -8.318 -1.000 339 HA VAL 15 HA VAL 15 10.533 -8.482 -1.307 340 HB VAL 15 HB VAL 15 8.309 -10.059 -2.617 341 HG11 VAL 15 1HG1 VAL 15 10.943 -9.564 -3.529 342 HG12 VAL 15 2HG1 VAL 15 10.929 -11.228 -2.897 343 HG13 VAL 15 3HG1 VAL 15 9.768 -10.744 -4.158 344 HG21 VAL 15 3HG2 VAL 15 9.511 -11.962 -1.339 345 HG22 VAL 15 1HG2 VAL 15 10.208 -10.659 -0.350 346 HG23 VAL 15 2HG2 VAL 15 8.442 -10.871 -0.425 347 H VAL 16 HN VAL 16 11.408 -6.944 -2.583 348 HA VAL 16 HA VAL 16 9.746 -5.972 -4.803 349 HB VAL 16 HB VAL 16 10.433 -3.764 -4.421 350 HG11 VAL 16 1HG1 VAL 16 8.912 -3.559 -2.805 351 HG12 VAL 16 2HG1 VAL 16 9.161 -5.257 -2.328 352 HG13 VAL 16 3HG1 VAL 16 10.152 -3.972 -1.595 353 HG21 VAL 16 3HG2 VAL 16 12.587 -3.469 -3.853 354 HG22 VAL 16 1HG2 VAL 16 12.018 -3.587 -2.170 355 HG23 VAL 16 2HG2 VAL 16 12.671 -5.025 -2.993 356 H LYS 17 HN LYS 17 10.762 -5.834 -6.794 357 HA LYS 17 HA LYS 17 13.443 -6.981 -6.852 358 HB2 LYS 17 2HB LYS 17 11.853 -8.159 -8.194 359 HB3 LYS 17 3HB LYS 17 11.268 -6.682 -8.934 360 HG2 LYS 17 2HG LYS 17 14.208 -7.268 -9.196 361 HG3 LYS 17 3HG LYS 17 13.112 -8.272 -10.122 362 HD2 LYS 17 2HD LYS 17 12.011 -5.936 -10.796 363 HD3 LYS 17 3HD LYS 17 13.567 -5.287 -10.317 364 HE2 LYS 17 2HE LYS 17 13.416 -7.654 -12.216 365 HE3 LYS 17 3HE LYS 17 13.208 -6.023 -12.820 366 HZ1 LYS 17 2HZ LYS 17 15.504 -6.384 -11.082 367 HZ3 LYS 17 1HZ LYS 17 15.398 -5.563 -12.484 368 H VAL 18 HN VAL 18 15.132 -5.606 -6.876 369 HA VAL 18 HA VAL 18 14.815 -2.858 -7.323 370 HB VAL 18 HB VAL 18 17.202 -4.699 -7.206 371 HG11 VAL 18 1HG1 VAL 18 17.595 -2.609 -8.612 372 HG12 VAL 18 2HG1 VAL 18 17.340 -1.676 -7.117 373 HG13 VAL 18 3HG1 VAL 18 18.679 -2.844 -7.219 374 HG21 VAL 18 3HG2 VAL 18 16.415 -2.581 -5.205 375 HG22 VAL 18 1HG2 VAL 18 15.690 -4.206 -5.167 376 HG23 VAL 18 2HG2 VAL 18 17.449 -4.013 -4.980 377 H LEU 19 HN LEU 19 14.547 -1.757 -9.190 378 HA LEU 19 HA LEU 19 15.109 -3.176 -11.667 379 HB2 LEU 19 2HB LEU 19 13.452 -0.797 -10.903 380 HB3 LEU 19 3HB LEU 19 13.931 -1.039 -12.572 381 HG LEU 19 HG LEU 19 12.459 -3.134 -10.959 382 HD11 LEU 19 1HD1 LEU 19 11.331 -0.967 -12.749 383 HD12 LEU 19 2HD1 LEU 19 10.422 -2.391 -12.186 384 HD13 LEU 19 3HD1 LEU 19 11.033 -1.204 -11.010 385 HD21 LEU 19 3HD2 LEU 19 13.619 -4.067 -12.846 386 HD22 LEU 19 1HD2 LEU 19 11.879 -4.013 -13.213 387 HD23 LEU 19 2HD2 LEU 19 12.976 -2.806 -13.925 388 H GLU 20 HN GLU 20 15.836 -0.030 -10.019 389 HA GLU 20 HA GLU 20 18.242 0.036 -11.666 390 HB2 GLU 20 2HB GLU 20 16.548 1.740 -12.398 391 HB3 GLU 20 3HB GLU 20 16.586 2.445 -10.794 392 HG2 GLU 20 2HG GLU 20 18.788 3.260 -11.046 393 HG3 GLU 20 3HG GLU 20 19.194 2.085 -12.280 394 H GLU 21 HN GLU 21 19.797 -0.626 -10.207 395 HA GLU 21 HA GLU 21 19.669 -0.324 -7.510 396 HB2 GLU 21 2HB GLU 21 21.952 -0.999 -7.469 397 HB3 GLU 21 3HB GLU 21 21.293 -1.725 -8.921 398 HG2 GLU 21 2HG GLU 21 22.133 0.733 -9.883 399 HG3 GLU 21 3HG GLU 21 23.329 0.428 -8.639 400 H GLY 22 HN GLY 22 21.046 1.071 -6.038 401 HA2 GLY 22 1HA GLY 22 21.575 3.735 -7.182 402 HA3 GLY 22 2HA GLY 22 20.535 3.566 -5.783 403 H GLY 23 HN GLY 23 21.667 4.275 -4.018 404 HA2 GLY 23 1HA GLY 23 24.208 2.934 -3.433 405 HA3 GLY 23 2HA GLY 23 24.199 4.685 -3.518 406 H GLY 24 HN GLY 24 21.750 2.319 -2.246 407 HA2 GLY 24 1HA GLY 24 22.262 3.144 0.482 408 HA3 GLY 24 2HA GLY 24 20.745 3.719 -0.181 409 H THR 25 HN THR 25 20.109 2.220 1.789 410 HA THR 25 HA THR 25 19.609 -0.458 0.668 411 HB THR 25 HB THR 25 20.426 0.384 3.494 412 HG1 THR 25 HG1 THR 25 21.388 -1.615 1.580 413 HG21 THR 25 3HG2 THR 25 19.409 -1.499 4.291 414 HG22 THR 25 1HG2 THR 25 18.752 -1.843 2.673 415 HG23 THR 25 2HG2 THR 25 20.354 -2.466 3.135 416 H LEU 26 HN LEU 26 17.586 -1.411 1.121 417 HA LEU 26 HA LEU 26 15.553 0.595 1.610 418 HB2 LEU 26 2HB LEU 26 14.987 -2.271 0.972 419 HB3 LEU 26 3HB LEU 26 14.071 -0.832 0.567 420 HG LEU 26 HG LEU 26 16.790 -1.252 -0.643 421 HD11 LEU 26 1HD1 LEU 26 14.434 -2.940 -1.074 422 HD12 LEU 26 2HD1 LEU 26 15.075 -2.211 -2.567 423 HD13 LEU 26 3HD1 LEU 26 16.135 -3.195 -1.530 424 HD21 LEU 26 3HD2 LEU 26 14.281 0.236 -1.432 425 HD22 LEU 26 1HD2 LEU 26 15.897 0.890 -1.075 426 HD23 LEU 26 2HD2 LEU 26 15.629 -0.056 -2.558 427 H VAL 27 HN VAL 27 15.976 0.967 3.881 428 HA VAL 27 HA VAL 27 15.829 -1.223 5.700 429 HB VAL 27 HB VAL 27 15.747 1.779 6.039 430 HG11 VAL 27 1HG1 VAL 27 14.795 -0.012 7.885 431 HG12 VAL 27 2HG1 VAL 27 16.503 0.131 8.365 432 HG13 VAL 27 3HG1 VAL 27 15.479 1.585 8.268 433 HG21 VAL 27 3HG2 VAL 27 18.029 0.073 6.942 434 HG22 VAL 27 1HG2 VAL 27 17.847 0.367 5.196 435 HG23 VAL 27 2HG2 VAL 27 18.019 1.739 6.316 436 H CYS 28 HN CYS 28 13.962 -2.362 5.905 437 HA CYS 28 HA CYS 28 11.508 -0.767 6.078 438 HB2 CYS 28 2HB CYS 28 11.744 -2.254 4.043 439 HB3 CYS 28 3HB CYS 28 11.685 -3.629 5.128 440 H CYS 29 HN CYS 29 10.213 -1.150 7.910 441 HA CYS 29 HA CYS 29 9.663 -1.849 9.914 442 HB2 CYS 29 2HB CYS 29 10.871 -4.422 8.909 443 HB3 CYS 29 3HB CYS 29 10.195 -4.284 10.521 444 H GLY 30 HN GLY 30 12.250 -0.478 9.346 445 HA2 GLY 30 1HA GLY 30 14.021 0.242 10.534 446 HA3 GLY 30 2HA GLY 30 13.411 -0.647 11.917 447 H GLU 31 HN GLU 31 13.955 -2.371 8.872 448 HA GLU 31 HA GLU 31 16.539 -3.259 9.826 449 HB2 GLU 31 2HB GLU 31 14.793 -4.848 10.715 450 HB3 GLU 31 3HB GLU 31 14.311 -5.199 9.068 451 HG2 GLU 31 2HG GLU 31 16.869 -5.750 8.694 452 HG3 GLU 31 3HG GLU 31 16.935 -5.855 10.442 453 H ASP 32 HN ASP 32 18.000 -3.434 8.155 454 HA ASP 32 HA ASP 32 17.284 -2.554 5.647 455 HB2 ASP 32 2HB ASP 32 19.583 -3.711 5.035 456 HB3 ASP 32 3HB ASP 32 19.563 -2.323 6.106 457 H MET 33 HN MET 33 16.020 -3.681 4.160 458 HA MET 33 HA MET 33 15.199 -6.214 4.358 459 HB2 MET 33 2HB MET 33 14.807 -4.192 2.587 460 HB3 MET 33 3HB MET 33 15.866 -5.171 1.593 461 HG2 MET 33 2HG MET 33 14.178 -6.620 1.123 462 HG3 MET 33 3HG MET 33 13.882 -6.899 2.828 463 HE1 MET 33 3HE MET 33 13.530 -4.371 -0.019 464 HE2 MET 33 1HE MET 33 12.261 -5.571 -0.367 465 HE3 MET 33 2HE MET 33 11.815 -3.903 0.063 466 H VAL 34 HN VAL 34 15.747 -8.268 3.328 467 HA VAL 34 HA VAL 34 18.636 -8.536 3.015 468 HB VAL 34 HB VAL 34 18.411 -10.684 3.747 469 HG11 VAL 34 1HG1 VAL 34 17.269 -8.844 5.304 470 HG12 VAL 34 2HG1 VAL 34 15.840 -9.872 5.038 471 HG13 VAL 34 3HG1 VAL 34 17.314 -10.566 5.754 472 HG21 VAL 34 3HG2 VAL 34 16.881 -11.397 1.938 473 HG22 VAL 34 1HG2 VAL 34 16.440 -12.098 3.514 474 HG23 VAL 34 2HG2 VAL 34 15.508 -10.733 2.856 475 H LYS 35 HN LYS 35 19.460 -9.959 1.251 476 HA LYS 35 HA LYS 35 17.954 -9.393 -1.175 477 HB2 LYS 35 2HB LYS 35 20.531 -8.935 -0.640 478 HB3 LYS 35 3HB LYS 35 20.695 -10.583 -1.212 479 HG2 LYS 35 2HG LYS 35 18.940 -8.823 -2.875 480 HG3 LYS 35 3HG LYS 35 20.637 -8.388 -2.860 481 HD2 LYS 35 2HD LYS 35 21.318 -10.485 -3.763 482 HD3 LYS 35 3HD LYS 35 19.822 -11.275 -3.310 483 HE2 LYS 35 2HE LYS 35 19.501 -8.957 -5.165 484 HE3 LYS 35 3HE LYS 35 20.369 -10.322 -5.838 485 HZ1 LYS 35 2HZ LYS 35 18.352 -11.622 -4.748 486 HZ3 LYS 35 1HZ LYS 35 18.218 -10.975 -6.236 487 H GLN 36 HN GLN 36 17.569 -11.058 -2.787 488 HA GLN 36 HA GLN 36 17.430 -13.687 -1.528 489 HB2 GLN 36 2HB GLN 36 15.611 -12.576 -3.708 490 HB3 GLN 36 3HB GLN 36 15.437 -14.125 -2.906 491 HG2 GLN 36 2HG GLN 36 15.447 -11.516 -1.335 492 HG3 GLN 36 3HG GLN 36 13.976 -12.147 -2.049 493 HE21 GLN 36 1HE2 GLN 36 16.385 -12.499 0.400 494 HE22 GLN 36 2HE2 GLN 36 15.645 -13.766 1.321 Start of MODEL 17 1 H1 ALA 1 HN ALA 1 1.297 -0.923 1.435 2 HA ALA 1 HA ALA 1 1.968 0.595 -0.652 3 HB1 ALA 1 1HB ALA 1 4.132 0.251 -1.150 4 HB2 ALA 1 2HB ALA 1 4.269 -0.999 0.110 5 HB3 ALA 1 3HB ALA 1 3.728 -1.440 -1.529 6 H ASN 2 HN ASN 2 1.891 -0.873 -2.874 7 HA ASN 2 HA ASN 2 0.151 -3.125 -2.336 8 HB2 ASN 2 2HB ASN 2 -0.669 -0.539 -3.474 9 HB3 ASN 2 3HB ASN 2 -0.955 -1.833 -4.621 10 HD21 ASN 2 1HD2 ASN 2 -2.725 -0.127 -2.913 11 HD22 ASN 2 2HD2 ASN 2 -3.769 -1.218 -2.065 12 H GLU 3 HN GLU 3 0.369 -4.768 -3.967 13 HA GLU 3 HA GLU 3 2.676 -4.926 -5.342 14 HB2 GLU 3 2HB GLU 3 0.001 -6.178 -6.108 15 HB3 GLU 3 3HB GLU 3 1.564 -6.725 -6.681 16 HG2 GLU 3 2HG GLU 3 2.260 -7.107 -4.273 17 HG3 GLU 3 3HG GLU 3 0.639 -6.673 -3.770 18 H GLY 4 HN GLY 4 3.165 -4.883 -7.711 19 HA2 GLY 4 1HA GLY 4 3.163 -3.916 -9.744 20 HA3 GLY 4 2HA GLY 4 1.454 -3.586 -9.551 21 H ASP 5 HN ASP 5 4.079 -2.473 -7.348 22 HA ASP 5 HA ASP 5 3.473 0.230 -8.258 23 HB2 ASP 5 2HB ASP 5 3.704 -0.967 -5.517 24 HB3 ASP 5 3HB ASP 5 4.416 0.623 -5.720 25 H VAL 6 HN VAL 6 5.409 1.787 -7.580 26 HA VAL 6 HA VAL 6 7.950 0.334 -7.642 27 HB VAL 6 HB VAL 6 6.855 2.268 -9.623 28 HG11 VAL 6 1HG1 VAL 6 9.066 3.046 -10.287 29 HG12 VAL 6 2HG1 VAL 6 8.741 3.501 -8.597 30 HG13 VAL 6 3HG1 VAL 6 9.816 2.129 -8.959 31 HG21 VAL 6 3HG2 VAL 6 7.281 0.590 -11.032 32 HG22 VAL 6 1HG2 VAL 6 8.984 0.519 -10.517 33 HG23 VAL 6 2HG2 VAL 6 7.745 -0.401 -9.628 34 H TYR 7 HN TYR 7 9.704 1.457 -6.632 35 HA TYR 7 HA TYR 7 8.897 3.892 -5.202 36 HB2 TYR 7 2HB TYR 7 10.010 1.203 -4.323 37 HB3 TYR 7 3HB TYR 7 10.610 2.614 -3.473 38 HD1 TYR 7 HD1 TYR 7 8.972 4.108 -2.248 39 HD2 TYR 7 HD2 TYR 7 7.849 0.308 -3.859 40 HE1 TYR 7 HE1 TYR 7 6.917 4.073 -0.752 41 HE2 TYR 7 HE2 TYR 7 5.798 0.286 -2.358 42 HH TYR 7 HH TYR 7 5.448 2.362 0.246 43 H LYS 8 HN LYS 8 10.267 5.548 -5.618 44 HA LYS 8 HA LYS 8 12.993 4.816 -6.435 45 HB2 LYS 8 2HB LYS 8 11.788 5.763 -8.293 46 HB3 LYS 8 3HB LYS 8 11.225 7.109 -7.324 47 HG2 LYS 8 2HG LYS 8 14.187 6.742 -7.353 48 HG3 LYS 8 3HG LYS 8 13.485 7.167 -8.901 49 HD2 LYS 8 2HD LYS 8 12.521 8.733 -6.528 50 HD3 LYS 8 3HD LYS 8 14.178 9.017 -7.026 51 HE2 LYS 8 2HE LYS 8 13.025 10.584 -8.341 52 HE3 LYS 8 3HE LYS 8 13.163 9.236 -9.453 53 HZ1 LYS 8 2HZ LYS 8 10.822 8.979 -7.845 54 HZ3 LYS 8 1HZ LYS 8 10.936 9.027 -9.469 55 H CYS 9 HN CYS 9 14.659 5.548 -5.199 56 HA CYS 9 HA CYS 9 14.012 6.851 -2.769 57 HB2 CYS 9 2HB CYS 9 15.795 5.160 -2.918 58 HB3 CYS 9 3HB CYS 9 16.716 6.198 -3.988 59 H GLU 10 HN GLU 10 14.456 9.031 -2.166 60 HA GLU 10 HA GLU 10 14.871 10.764 -4.450 61 HB2 GLU 10 2HB GLU 10 13.528 11.029 -1.782 62 HB3 GLU 10 3HB GLU 10 14.239 12.484 -2.451 63 HG2 GLU 10 2HG GLU 10 12.583 10.801 -4.313 64 HG3 GLU 10 3HG GLU 10 11.724 11.674 -3.060 65 H LEU 11 HN LEU 11 17.103 9.235 -3.264 66 HA LEU 11 HA LEU 11 18.734 11.532 -2.467 67 HB2 LEU 11 2HB LEU 11 18.078 9.200 -0.880 68 HB3 LEU 11 3HB LEU 11 19.805 9.306 -1.154 69 HG LEU 11 HG LEU 11 18.658 11.883 -0.387 70 HD11 LEU 11 1HD1 LEU 11 17.377 9.795 0.856 71 HD12 LEU 11 2HD1 LEU 11 18.697 10.167 1.991 72 HD13 LEU 11 3HD1 LEU 11 17.555 11.443 1.507 73 HD21 LEU 11 3HD2 LEU 11 21.117 10.770 -0.371 74 HD22 LEU 11 1HD2 LEU 11 20.645 12.151 0.647 75 HD23 LEU 11 2HD2 LEU 11 20.644 10.505 1.325 76 H CYS 12 HN CYS 12 19.019 7.983 -3.224 77 HA CYS 12 HA CYS 12 21.359 8.600 -4.800 78 HB2 CYS 12 2HB CYS 12 21.518 6.127 -5.036 79 HB3 CYS 12 3HB CYS 12 21.599 6.720 -3.389 80 H GLY 13 HN GLY 13 18.046 7.158 -5.128 81 HA2 GLY 13 1HA GLY 13 16.711 7.817 -7.010 82 HA3 GLY 13 2HA GLY 13 18.153 7.816 -8.007 83 H GLN 14 HN GLN 14 17.471 5.319 -5.528 84 HA GLN 14 HA GLN 14 17.699 3.333 -7.557 85 HB2 GLN 14 2HB GLN 14 18.770 2.932 -5.413 86 HB3 GLN 14 3HB GLN 14 17.269 3.194 -4.545 87 HG2 GLN 14 2HG GLN 14 16.310 1.153 -5.330 88 HG3 GLN 14 3HG GLN 14 17.456 1.012 -6.649 89 HE21 GLN 14 1HE2 GLN 14 17.616 1.518 -3.121 90 HE22 GLN 14 2HE2 GLN 14 18.776 0.280 -2.775 91 H VAL 15 HN VAL 15 16.033 2.404 -8.673 92 HA VAL 15 HA VAL 15 13.337 2.862 -7.604 93 HB VAL 15 HB VAL 15 14.172 2.280 -10.449 94 HG11 VAL 15 1HG1 VAL 15 11.952 2.913 -11.064 95 HG12 VAL 15 2HG1 VAL 15 11.808 1.742 -9.731 96 HG13 VAL 15 3HG1 VAL 15 11.586 3.481 -9.416 97 HG21 VAL 15 3HG2 VAL 15 14.275 4.773 -8.903 98 HG22 VAL 15 1HG2 VAL 15 15.008 4.364 -10.473 99 HG23 VAL 15 2HG2 VAL 15 13.313 4.906 -10.394 100 H VAL 16 HN VAL 16 12.183 1.127 -6.920 101 HA VAL 16 HA VAL 16 13.006 -1.497 -7.936 102 HB VAL 16 HB VAL 16 13.083 -2.441 -5.817 103 HG11 VAL 16 1HG1 VAL 16 14.213 0.283 -5.164 104 HG12 VAL 16 2HG1 VAL 16 14.832 -1.325 -4.721 105 HG13 VAL 16 3HG1 VAL 16 14.952 -0.758 -6.404 106 HG21 VAL 16 3HG2 VAL 16 11.012 -1.501 -4.921 107 HG22 VAL 16 1HG2 VAL 16 12.339 -1.326 -3.746 108 HG23 VAL 16 2HG2 VAL 16 11.803 0.078 -4.701 109 H LYS 17 HN LYS 17 11.312 -2.850 -8.468 110 HA LYS 17 HA LYS 17 8.666 -1.649 -8.182 111 HB2 LYS 17 2HB LYS 17 9.574 -2.270 -10.448 112 HB3 LYS 17 3HB LYS 17 9.530 -3.950 -9.955 113 HG2 LYS 17 2HG LYS 17 7.037 -2.267 -9.621 114 HG3 LYS 17 3HG LYS 17 7.457 -2.844 -11.221 115 HD2 LYS 17 2HD LYS 17 7.461 -5.179 -10.440 116 HD3 LYS 17 3HD LYS 17 7.225 -4.665 -8.781 117 HE2 LYS 17 2HE LYS 17 5.015 -5.106 -9.309 118 HE3 LYS 17 3HE LYS 17 5.072 -3.437 -9.841 119 HZ1 LYS 17 2HZ LYS 17 4.346 -5.471 -11.430 120 HZ3 LYS 17 1HZ LYS 17 5.919 -5.361 -11.838 121 H VAL 18 HN VAL 18 7.385 -2.319 -6.555 122 HA VAL 18 HA VAL 18 8.115 -4.545 -4.969 123 HB VAL 18 HB VAL 18 5.688 -2.753 -5.092 124 HG11 VAL 18 1HG1 VAL 18 4.869 -4.798 -4.179 125 HG12 VAL 18 2HG1 VAL 18 6.320 -5.012 -3.172 126 HG13 VAL 18 3HG1 VAL 18 5.167 -3.707 -2.804 127 HG21 VAL 18 3HG2 VAL 18 8.267 -2.311 -4.135 128 HG22 VAL 18 1HG2 VAL 18 6.810 -1.369 -3.739 129 HG23 VAL 18 2HG2 VAL 18 7.326 -2.701 -2.677 130 H LEU 19 HN LEU 19 7.729 -6.664 -5.332 131 HA LEU 19 HA LEU 19 5.849 -7.331 -7.448 132 HB2 LEU 19 2HB LEU 19 6.864 -9.594 -7.218 133 HB3 LEU 19 3HB LEU 19 7.957 -8.322 -7.725 134 HG LEU 19 HG LEU 19 7.910 -8.784 -4.811 135 HD11 LEU 19 1HD1 LEU 19 8.745 -10.906 -4.686 136 HD12 LEU 19 2HD1 LEU 19 7.643 -11.096 -6.072 137 HD13 LEU 19 3HD1 LEU 19 9.388 -10.877 -6.346 138 HD21 LEU 19 3HD2 LEU 19 10.188 -8.321 -4.943 139 HD22 LEU 19 1HD2 LEU 19 10.300 -8.842 -6.641 140 HD23 LEU 19 2HD2 LEU 19 9.484 -7.313 -6.231 141 H GLU 20 HN GLU 20 6.431 -7.786 -3.933 142 HA GLU 20 HA GLU 20 3.633 -8.389 -3.680 143 HB2 GLU 20 2HB GLU 20 4.201 -10.374 -2.145 144 HB3 GLU 20 3HB GLU 20 4.378 -10.641 -3.867 145 HG2 GLU 20 2HG GLU 20 6.781 -10.400 -3.763 146 HG3 GLU 20 3HG GLU 20 6.719 -9.735 -2.142 147 H GLU 21 HN GLU 21 3.225 -6.566 -2.437 148 HA GLU 21 HA GLU 21 4.985 -5.463 -0.655 149 HB2 GLU 21 2HB GLU 21 2.840 -4.460 -1.615 150 HB3 GLU 21 3HB GLU 21 1.948 -5.379 -0.420 151 HG2 GLU 21 2HG GLU 21 4.227 -3.834 0.705 152 HG3 GLU 21 3HG GLU 21 2.982 -2.836 -0.021 153 H GLY 22 HN GLY 22 4.819 -5.340 1.777 154 HA2 GLY 22 1HA GLY 22 3.928 -7.928 2.903 155 HA3 GLY 22 2HA GLY 22 5.436 -7.151 3.344 156 H GLY 23 HN GLY 23 5.326 -4.939 4.363 157 HA2 GLY 23 1HA GLY 23 3.025 -3.687 5.220 158 HA3 GLY 23 2HA GLY 23 3.359 -4.914 6.427 159 H GLY 24 HN GLY 24 5.323 -2.580 4.430 160 HA2 GLY 24 1HA GLY 24 6.211 -1.141 6.727 161 HA3 GLY 24 2HA GLY 24 7.432 -2.269 6.174 162 H THR 25 HN THR 25 8.491 0.027 5.886 163 HA THR 25 HA THR 25 7.903 0.907 3.135 164 HB THR 25 HB THR 25 8.665 2.513 5.627 165 HG1 THR 25 HG1 THR 25 6.504 2.713 3.661 166 HG21 THR 25 3HG2 THR 25 8.384 3.352 2.695 167 HG22 THR 25 1HG2 THR 25 8.372 4.494 4.059 168 HG23 THR 25 2HG2 THR 25 9.831 3.535 3.714 169 H LEU 26 HN LEU 26 9.768 1.796 1.950 170 HA LEU 26 HA LEU 26 12.160 0.291 2.716 171 HB2 LEU 26 2HB LEU 26 11.739 1.501 0.015 172 HB3 LEU 26 3HB LEU 26 12.691 0.105 0.480 173 HG LEU 26 HG LEU 26 9.706 -0.008 0.770 174 HD11 LEU 26 1HD1 LEU 26 9.261 -0.395 -1.454 175 HD12 LEU 26 2HD1 LEU 26 10.487 0.890 -1.564 176 HD13 LEU 26 3HD1 LEU 26 10.949 -0.807 -1.838 177 HD21 LEU 26 3HD2 LEU 26 10.653 -1.920 1.648 178 HD22 LEU 26 1HD2 LEU 26 10.307 -2.420 -0.026 179 HD23 LEU 26 2HD2 LEU 26 11.962 -1.960 0.442 180 H VAL 27 HN VAL 27 12.946 1.790 4.287 181 HA VAL 27 HA VAL 27 13.351 4.519 3.473 182 HB VAL 27 HB VAL 27 14.170 2.970 5.938 183 HG11 VAL 27 1HG1 VAL 27 15.220 5.380 5.056 184 HG12 VAL 27 2HG1 VAL 27 13.938 5.879 6.185 185 HG13 VAL 27 3HG1 VAL 27 15.228 4.780 6.732 186 HG21 VAL 27 3HG2 VAL 27 11.996 3.096 6.454 187 HG22 VAL 27 1HG2 VAL 27 12.230 4.853 6.621 188 HG23 VAL 27 2HG2 VAL 27 11.654 4.175 5.079 189 H CYS 28 HN CYS 28 14.886 4.885 1.936 190 HA CYS 28 HA CYS 28 17.413 3.443 2.286 191 HB2 CYS 28 2HB CYS 28 16.145 2.948 0.191 192 HB3 CYS 28 3HB CYS 28 16.312 4.632 -0.267 193 H CYS 29 HN CYS 29 19.335 4.707 2.327 194 HA CYS 29 HA CYS 29 20.591 6.478 2.646 195 HB2 CYS 29 2HB CYS 29 18.540 7.761 0.847 196 HB3 CYS 29 3HB CYS 29 19.906 8.656 1.485 197 H GLY 30 HN GLY 30 18.148 5.748 4.370 198 HA2 GLY 30 1HA GLY 30 17.397 6.478 6.374 199 HA3 GLY 30 2HA GLY 30 18.385 7.916 6.217 200 H GLU 31 HN GLU 31 16.122 6.987 3.635 201 HA GLU 31 HA GLU 31 14.184 8.876 4.653 202 HB2 GLU 31 2HB GLU 31 15.849 10.071 3.108 203 HB3 GLU 31 3HB GLU 31 15.234 9.080 1.801 204 HG2 GLU 31 2HG GLU 31 13.246 10.234 1.676 205 HG3 GLU 31 3HG GLU 31 13.111 10.400 3.415 206 H ASP 32 HN ASP 32 12.072 8.253 4.209 207 HA ASP 32 HA ASP 32 11.661 5.673 3.319 208 HB2 ASP 32 2HB ASP 32 9.563 7.875 3.232 209 HB3 ASP 32 3HB ASP 32 9.305 6.168 3.531 210 H MET 33 HN MET 33 11.796 4.944 1.192 211 HA MET 33 HA MET 33 12.193 6.518 -0.963 212 HB2 MET 33 2HB MET 33 12.232 3.876 -0.561 213 HB3 MET 33 3HB MET 33 10.599 3.932 -1.193 214 HG2 MET 33 2HG MET 33 11.293 4.551 -3.340 215 HG3 MET 33 3HG MET 33 12.721 5.387 -2.761 216 HE1 MET 33 3HE MET 33 15.312 3.268 -2.109 217 HE2 MET 33 1HE MET 33 14.124 4.104 -1.081 218 HE3 MET 33 2HE MET 33 14.279 2.333 -1.000 219 H VAL 34 HN VAL 34 10.879 7.225 -2.778 220 HA VAL 34 HA VAL 34 8.158 7.843 -1.935 221 HB VAL 34 HB VAL 34 8.271 9.667 -3.306 222 HG11 VAL 34 1HG1 VAL 34 10.425 9.267 -1.651 223 HG12 VAL 34 2HG1 VAL 34 11.215 9.677 -3.192 224 HG13 VAL 34 3HG1 VAL 34 10.033 10.796 -2.474 225 HG21 VAL 34 3HG2 VAL 34 8.595 8.910 -5.457 226 HG22 VAL 34 1HG2 VAL 34 10.142 9.742 -5.173 227 HG23 VAL 34 2HG2 VAL 34 10.045 7.971 -5.029 228 H LYS 35 HN LYS 35 6.368 7.605 -3.515 229 HA LYS 35 HA LYS 35 6.673 5.074 -4.903 230 HB2 LYS 35 2HB LYS 35 4.721 5.961 -3.284 231 HB3 LYS 35 3HB LYS 35 4.071 6.528 -4.809 232 HG2 LYS 35 2HG LYS 35 3.275 4.419 -5.108 233 HG3 LYS 35 3HG LYS 35 4.928 3.948 -5.449 234 HD2 LYS 35 2HD LYS 35 5.111 2.790 -3.495 235 HD3 LYS 35 3HD LYS 35 4.460 4.119 -2.555 236 HE2 LYS 35 2HE LYS 35 2.447 3.085 -2.392 237 HE3 LYS 35 3HE LYS 35 2.315 2.975 -4.135 238 HZ1 LYS 35 2HZ LYS 35 2.735 0.868 -2.423 239 HZ3 LYS 35 1HZ LYS 35 4.190 1.072 -3.126 240 H GLN 36 HN GLN 36 6.071 4.784 -7.142 241 HA GLN 36 HA GLN 36 6.261 7.292 -8.621 242 HB2 GLN 36 2HB GLN 36 7.312 4.565 -9.492 243 HB3 GLN 36 3HB GLN 36 7.478 6.065 -10.382 244 HG2 GLN 36 2HG GLN 36 8.545 5.758 -7.545 245 HG3 GLN 36 3HG GLN 36 9.501 5.309 -8.943 246 HE21 GLN 36 1HE2 GLN 36 8.075 7.881 -7.113 247 HE22 GLN 36 2HE2 GLN 36 8.849 9.219 -7.894 248 H1 ALA 1 HN ALA 1 23.035 -3.320 -4.133 249 HA ALA 1 HA ALA 1 21.174 -4.344 -4.810 250 HB1 ALA 1 1HB ALA 1 19.519 -2.833 -5.446 251 HB2 ALA 1 2HB ALA 1 20.765 -1.739 -4.798 252 HB3 ALA 1 3HB ALA 1 20.600 -1.956 -6.557 253 H ASN 2 HN ASN 2 22.955 -2.819 -7.548 254 HA ASN 2 HA ASN 2 23.175 -3.398 -9.640 255 HB2 ASN 2 2HB ASN 2 23.583 -6.003 -9.930 256 HB3 ASN 2 3HB ASN 2 24.708 -5.065 -8.968 257 HD21 ASN 2 1HD2 ASN 2 22.547 -7.655 -9.053 258 HD22 ASN 2 2HD2 ASN 2 22.524 -8.082 -7.375 259 H GLU 3 HN GLU 3 21.280 -2.997 -10.846 260 HA GLU 3 HA GLU 3 18.835 -3.835 -10.554 261 HB2 GLU 3 2HB GLU 3 20.331 -3.719 -13.208 262 HB3 GLU 3 3HB GLU 3 18.584 -3.775 -13.079 263 HG2 GLU 3 2HG GLU 3 18.636 -1.679 -11.691 264 HG3 GLU 3 3HG GLU 3 20.378 -1.615 -11.873 265 H GLY 4 HN GLY 4 17.439 -5.597 -11.259 266 HA2 GLY 4 1HA GLY 4 16.963 -7.724 -11.934 267 HA3 GLY 4 2HA GLY 4 18.652 -8.002 -12.311 268 H ASP 5 HN ASP 5 17.471 -6.712 -9.176 269 HA ASP 5 HA ASP 5 18.265 -9.262 -8.003 270 HB2 ASP 5 2HB ASP 5 19.106 -6.498 -7.431 271 HB3 ASP 5 3HB ASP 5 18.476 -7.284 -5.997 272 H VAL 6 HN VAL 6 17.227 -9.424 -5.638 273 HA VAL 6 HA VAL 6 14.621 -8.094 -5.588 274 HB VAL 6 HB VAL 6 15.217 -11.027 -5.634 275 HG11 VAL 6 1HG1 VAL 6 12.636 -11.043 -4.801 276 HG12 VAL 6 2HG1 VAL 6 14.031 -11.269 -3.719 277 HG13 VAL 6 3HG1 VAL 6 13.265 -9.669 -3.861 278 HG21 VAL 6 3HG2 VAL 6 13.971 -9.190 -7.366 279 HG22 VAL 6 1HG2 VAL 6 14.021 -10.963 -7.517 280 HG23 VAL 6 2HG2 VAL 6 12.656 -10.180 -6.685 281 H TYR 7 HN TYR 7 13.972 -7.451 -3.544 282 HA TYR 7 HA TYR 7 15.774 -8.248 -1.356 283 HB2 TYR 7 2HB TYR 7 14.567 -5.645 -2.365 284 HB3 TYR 7 3HB TYR 7 14.749 -5.805 -0.629 285 HD1 TYR 7 HD1 TYR 7 17.041 -6.127 0.358 286 HD2 TYR 7 HD2 TYR 7 16.451 -5.220 -3.782 287 HE1 TYR 7 HE1 TYR 7 19.472 -5.410 0.161 288 HE2 TYR 7 HE2 TYR 7 18.884 -4.506 -3.965 289 HH TYR 7 HH TYR 7 20.667 -3.865 -2.733 290 H LYS 8 HN LYS 8 14.777 -9.344 0.255 291 HA LYS 8 HA LYS 8 11.880 -8.933 0.522 292 HB2 LYS 8 2HB LYS 8 11.924 -11.129 -0.069 293 HB3 LYS 8 3HB LYS 8 13.567 -11.374 0.488 294 HG2 LYS 8 2HG LYS 8 12.451 -12.547 2.148 295 HG3 LYS 8 3HG LYS 8 12.462 -10.964 2.899 296 HD2 LYS 8 2HD LYS 8 10.190 -10.553 2.400 297 HD3 LYS 8 3HD LYS 8 10.172 -11.677 1.056 298 HE2 LYS 8 2HE LYS 8 10.743 -13.428 3.066 299 HE3 LYS 8 3HE LYS 8 9.877 -12.221 3.994 300 HZ1 LYS 8 2HZ LYS 8 8.017 -12.428 2.429 301 HZ3 LYS 8 1HZ LYS 8 8.364 -13.888 3.063 302 H CYS 9 HN CYS 9 11.042 -8.455 2.547 303 HA CYS 9 HA CYS 9 12.979 -7.501 4.430 304 HB2 CYS 9 2HB CYS 9 10.965 -6.185 3.956 305 HB3 CYS 9 3HB CYS 9 9.944 -7.496 4.514 306 H GLU 10 HN GLU 10 13.011 -8.225 6.721 307 HA GLU 10 HA GLU 10 12.249 -11.031 6.889 308 HB2 GLU 10 2HB GLU 10 14.477 -9.442 8.215 309 HB3 GLU 10 3HB GLU 10 14.002 -11.024 8.800 310 HG2 GLU 10 2HG GLU 10 14.326 -11.075 5.892 311 HG3 GLU 10 3HG GLU 10 15.775 -10.449 6.654 312 H LEU 11 HN LEU 11 10.355 -8.853 7.320 313 HA LEU 11 HA LEU 11 9.706 -9.459 10.096 314 HB2 LEU 11 2HB LEU 11 10.563 -6.877 9.099 315 HB3 LEU 11 3HB LEU 11 8.933 -6.796 9.738 316 HG LEU 11 HG LEU 11 10.553 -8.285 11.581 317 HD11 LEU 11 1HD1 LEU 11 12.502 -7.225 10.630 318 HD12 LEU 11 2HD1 LEU 11 11.734 -5.623 10.745 319 HD13 LEU 11 3HD1 LEU 11 12.159 -6.515 12.226 320 HD21 LEU 11 3HD2 LEU 11 8.423 -6.772 11.818 321 HD22 LEU 11 1HD2 LEU 11 9.595 -6.906 13.152 322 HD23 LEU 11 2HD2 LEU 11 9.619 -5.481 12.084 323 H CYS 12 HN CYS 12 8.455 -7.362 7.402 324 HA CYS 12 HA CYS 12 5.825 -8.383 7.874 325 HB2 CYS 12 2HB CYS 12 5.206 -6.894 5.975 326 HB3 CYS 12 3HB CYS 12 5.962 -6.090 7.336 327 H GLY 13 HN GLY 13 8.327 -8.475 5.241 328 HA2 GLY 13 1HA GLY 13 8.765 -10.584 4.175 329 HA3 GLY 13 2HA GLY 13 7.055 -10.956 4.260 330 H GLN 14 HN GLN 14 8.242 -7.685 3.459 331 HA GLN 14 HA GLN 14 6.813 -7.831 1.001 332 HB2 GLN 14 2HB GLN 14 6.666 -5.771 2.242 333 HB3 GLN 14 3HB GLN 14 8.407 -5.643 2.386 334 HG2 GLN 14 2HG GLN 14 8.672 -5.152 0.036 335 HG3 GLN 14 3HG GLN 14 7.033 -5.651 -0.332 336 HE21 GLN 14 1HE2 GLN 14 8.616 -3.506 2.040 337 HE22 GLN 14 2HE2 GLN 14 7.614 -2.117 1.780 338 H VAL 15 HN VAL 15 7.637 -8.179 -1.040 339 HA VAL 15 HA VAL 15 10.570 -8.277 -1.236 340 HB VAL 15 HB VAL 15 8.577 -9.936 -2.787 341 HG11 VAL 15 1HG1 VAL 15 11.541 -9.676 -2.734 342 HG12 VAL 15 2HG1 VAL 15 10.883 -11.325 -2.862 343 HG13 VAL 15 3HG1 VAL 15 10.446 -10.096 -4.073 344 HG21 VAL 15 3HG2 VAL 15 8.339 -11.301 -1.041 345 HG22 VAL 15 1HG2 VAL 15 10.104 -11.527 -0.967 346 HG23 VAL 15 2HG2 VAL 15 9.337 -10.210 -0.048 347 H VAL 16 HN VAL 16 11.489 -6.951 -2.732 348 HA VAL 16 HA VAL 16 9.736 -5.919 -4.841 349 HB VAL 16 HB VAL 16 10.403 -3.707 -4.479 350 HG11 VAL 16 1HG1 VAL 16 10.234 -4.343 -1.587 351 HG12 VAL 16 2HG1 VAL 16 9.230 -3.268 -2.590 352 HG13 VAL 16 3HG1 VAL 16 8.944 -5.025 -2.607 353 HG21 VAL 16 3HG2 VAL 16 12.690 -4.936 -3.072 354 HG22 VAL 16 1HG2 VAL 16 12.596 -3.435 -4.025 355 HG23 VAL 16 2HG2 VAL 16 12.066 -3.446 -2.325 356 H LYS 17 HN LYS 17 10.687 -5.836 -6.859 357 HA LYS 17 HA LYS 17 13.373 -6.954 -6.983 358 HB2 LYS 17 2HB LYS 17 11.622 -8.070 -8.265 359 HB3 LYS 17 3HB LYS 17 11.235 -6.578 -9.100 360 HG2 LYS 17 2HG LYS 17 14.096 -7.535 -9.177 361 HG3 LYS 17 3HG LYS 17 12.920 -8.390 -10.156 362 HD2 LYS 17 2HD LYS 17 12.233 -6.225 -11.215 363 HD3 LYS 17 3HD LYS 17 13.418 -5.376 -10.243 364 HE2 LYS 17 2HE LYS 17 14.907 -5.756 -11.919 365 HE3 LYS 17 3HE LYS 17 14.926 -7.432 -11.409 366 HZ1 LYS 17 2HZ LYS 17 13.870 -6.376 -13.796 367 HZ3 LYS 17 1HZ LYS 17 12.646 -7.082 -12.986 368 H VAL 18 HN VAL 18 15.094 -5.632 -7.155 369 HA VAL 18 HA VAL 18 14.746 -2.860 -7.586 370 HB VAL 18 HB VAL 18 17.165 -4.664 -7.473 371 HG11 VAL 18 1HG1 VAL 18 18.468 -2.551 -7.135 372 HG12 VAL 18 2HG1 VAL 18 17.802 -2.741 -8.774 373 HG13 VAL 18 3HG1 VAL 18 17.019 -1.636 -7.618 374 HG21 VAL 18 3HG2 VAL 18 15.546 -4.147 -5.441 375 HG22 VAL 18 1HG2 VAL 18 17.312 -4.181 -5.229 376 HG23 VAL 18 2HG2 VAL 18 16.466 -2.624 -5.392 377 H LEU 19 HN LEU 19 14.435 -1.823 -9.481 378 HA LEU 19 HA LEU 19 15.157 -3.269 -11.916 379 HB2 LEU 19 2HB LEU 19 13.606 -1.842 -13.044 380 HB3 LEU 19 3HB LEU 19 12.832 -2.577 -11.655 381 HG LEU 19 HG LEU 19 13.932 -0.013 -10.905 382 HD11 LEU 19 1HD1 LEU 19 13.787 0.765 -13.120 383 HD12 LEU 19 2HD1 LEU 19 12.242 -0.069 -13.406 384 HD13 LEU 19 3HD1 LEU 19 12.304 1.342 -12.324 385 HD21 LEU 19 3HD2 LEU 19 11.180 0.182 -10.810 386 HD22 LEU 19 1HD2 LEU 19 11.470 -1.566 -10.649 387 HD23 LEU 19 2HD2 LEU 19 12.238 -0.429 -9.516 388 H GLU 20 HN GLU 20 15.749 -0.294 -10.028 389 HA GLU 20 HA GLU 20 17.980 0.196 -11.830 390 HB2 GLU 20 2HB GLU 20 16.102 1.783 -12.345 391 HB3 GLU 20 3HB GLU 20 16.154 2.360 -10.691 392 HG2 GLU 20 2HG GLU 20 18.070 3.587 -11.033 393 HG3 GLU 20 3HG GLU 20 18.798 2.365 -12.055 394 H GLU 21 HN GLU 21 19.629 -0.482 -10.472 395 HA GLU 21 HA GLU 21 19.532 -0.150 -7.713 396 HB2 GLU 21 2HB GLU 21 21.848 -0.924 -7.738 397 HB3 GLU 21 3HB GLU 21 20.923 -1.846 -8.905 398 HG2 GLU 21 2HG GLU 21 22.068 -0.980 -10.704 399 HG3 GLU 21 3HG GLU 21 22.141 0.630 -10.017 400 H GLY 22 HN GLY 22 21.206 1.138 -6.406 401 HA2 GLY 22 1HA GLY 22 21.976 3.653 -7.717 402 HA3 GLY 22 2HA GLY 22 20.927 3.715 -6.314 403 H GLY 23 HN GLY 23 21.863 3.789 -4.308 404 HA2 GLY 23 1HA GLY 23 24.334 2.418 -3.760 405 HA3 GLY 23 2HA GLY 23 24.520 4.157 -3.864 406 H GLY 24 HN GLY 24 21.963 1.927 -2.536 407 HA2 GLY 24 1HA GLY 24 22.452 2.868 0.152 408 HA3 GLY 24 2HA GLY 24 20.958 3.456 -0.550 409 H THR 25 HN THR 25 20.284 2.048 1.486 410 HA THR 25 HA THR 25 19.773 -0.681 0.494 411 HB THR 25 HB THR 25 21.349 -0.038 2.649 412 HG1 THR 25 HG1 THR 25 20.830 -2.275 3.167 413 HG21 THR 25 3HG2 THR 25 19.486 0.955 3.968 414 HG22 THR 25 1HG2 THR 25 18.500 -0.498 3.681 415 HG23 THR 25 2HG2 THR 25 19.973 -0.603 4.675 416 H LEU 26 HN LEU 26 17.796 -1.664 1.735 417 HA LEU 26 HA LEU 26 15.718 0.413 1.681 418 HB2 LEU 26 2HB LEU 26 15.260 -2.502 1.109 419 HB3 LEU 26 3HB LEU 26 14.219 -1.137 0.759 420 HG LEU 26 HG LEU 26 16.914 -1.445 -0.566 421 HD11 LEU 26 1HD1 LEU 26 15.480 -2.358 -2.523 422 HD12 LEU 26 2HD1 LEU 26 15.967 -3.460 -1.213 423 HD13 LEU 26 3HD1 LEU 26 14.317 -2.796 -1.251 424 HD21 LEU 26 3HD2 LEU 26 15.304 0.696 -0.530 425 HD22 LEU 26 1HD2 LEU 26 16.306 0.256 -1.933 426 HD23 LEU 26 2HD2 LEU 26 14.580 -0.179 -1.900 427 H VAL 27 HN VAL 27 16.056 0.899 3.937 428 HA VAL 27 HA VAL 27 15.897 -1.183 5.867 429 HB VAL 27 HB VAL 27 15.775 1.829 5.975 430 HG11 VAL 27 1HG1 VAL 27 16.328 1.038 8.549 431 HG12 VAL 27 2HG1 VAL 27 14.743 1.597 7.962 432 HG13 VAL 27 3HG1 VAL 27 15.094 -0.145 8.052 433 HG21 VAL 27 3HG2 VAL 27 18.008 1.789 6.483 434 HG22 VAL 27 1HG2 VAL 27 17.921 0.186 7.253 435 HG23 VAL 27 2HG2 VAL 27 17.918 0.323 5.479 436 H CYS 28 HN CYS 28 14.062 -2.378 6.061 437 HA CYS 28 HA CYS 28 11.557 -0.857 6.122 438 HB2 CYS 28 2HB CYS 28 11.869 -2.328 4.097 439 HB3 CYS 28 3HB CYS 28 11.856 -3.711 5.173 440 H CYS 29 HN CYS 29 10.254 -1.238 7.940 441 HA CYS 29 HA CYS 29 9.682 -1.931 9.940 442 HB2 CYS 29 2HB CYS 29 10.893 -4.505 8.942 443 HB3 CYS 29 3HB CYS 29 10.205 -4.370 10.548 444 H GLY 30 HN GLY 30 12.347 -0.638 9.335 445 HA2 GLY 30 1HA GLY 30 14.073 0.106 10.584 446 HA3 GLY 30 2HA GLY 30 13.460 -0.806 11.949 447 H GLU 31 HN GLU 31 14.056 -2.437 8.851 448 HA GLU 31 HA GLU 31 16.634 -3.332 9.791 449 HB2 GLU 31 2HB GLU 31 14.773 -4.912 10.638 450 HB3 GLU 31 3HB GLU 31 14.524 -5.362 8.963 451 HG2 GLU 31 2HG GLU 31 17.222 -5.664 9.066 452 HG3 GLU 31 3HG GLU 31 16.864 -5.937 10.760 453 H ASP 32 HN ASP 32 18.069 -3.395 8.101 454 HA ASP 32 HA ASP 32 17.309 -2.549 5.609 455 HB2 ASP 32 2HB ASP 32 19.720 -4.343 5.971 456 HB3 ASP 32 3HB ASP 32 19.569 -2.902 4.985 457 H MET 33 HN MET 33 16.161 -3.672 4.029 458 HA MET 33 HA MET 33 15.372 -6.252 4.265 459 HB2 MET 33 2HB MET 33 14.752 -4.249 2.594 460 HB3 MET 33 3HB MET 33 15.904 -5.028 1.529 461 HG2 MET 33 2HG MET 33 14.600 -6.994 1.327 462 HG3 MET 33 3HG MET 33 13.750 -6.711 2.833 463 HE1 MET 33 3HE MET 33 12.510 -4.532 3.249 464 HE2 MET 33 1HE MET 33 13.070 -3.277 2.117 465 HE3 MET 33 2HE MET 33 11.376 -3.824 2.073 466 H VAL 34 HN VAL 34 15.971 -8.265 3.211 467 HA VAL 34 HA VAL 34 18.847 -8.378 2.700 468 HB VAL 34 HB VAL 34 18.795 -10.558 3.436 469 HG11 VAL 34 1HG1 VAL 34 18.321 -9.109 5.311 470 HG12 VAL 34 2HG1 VAL 34 16.578 -9.142 4.951 471 HG13 VAL 34 3HG1 VAL 34 17.401 -10.620 5.506 472 HG21 VAL 34 3HG2 VAL 34 16.126 -10.599 2.221 473 HG22 VAL 34 1HG2 VAL 34 17.317 -11.906 2.420 474 HG23 VAL 34 2HG2 VAL 34 16.213 -11.498 3.755 475 H LYS 35 HN LYS 35 19.580 -9.879 0.927 476 HA LYS 35 HA LYS 35 17.896 -9.400 -1.396 477 HB2 LYS 35 2HB LYS 35 20.632 -9.175 -0.925 478 HB3 LYS 35 3HB LYS 35 20.498 -10.647 -1.865 479 HG2 LYS 35 2HG LYS 35 20.265 -9.372 -3.725 480 HG3 LYS 35 3HG LYS 35 18.707 -8.846 -3.117 481 HD2 LYS 35 2HD LYS 35 19.775 -6.786 -3.360 482 HD3 LYS 35 3HD LYS 35 20.151 -7.135 -1.685 483 HE2 LYS 35 2HE LYS 35 22.043 -8.123 -3.829 484 HE3 LYS 35 3HE LYS 35 22.074 -6.424 -3.401 485 HZ1 LYS 35 2HZ LYS 35 22.708 -8.731 -1.688 486 HZ3 LYS 35 1HZ LYS 35 22.201 -7.353 -0.986 487 H GLN 36 HN GLN 36 17.424 -11.120 -2.938 488 HA GLN 36 HA GLN 36 17.345 -13.701 -1.581 489 HB2 GLN 36 2HB GLN 36 15.419 -12.688 -3.716 490 HB3 GLN 36 3HB GLN 36 15.274 -14.177 -2.803 491 HG2 GLN 36 2HG GLN 36 15.347 -11.435 -1.467 492 HG3 GLN 36 3HG GLN 36 13.853 -12.198 -1.975 493 HE21 GLN 36 1HE2 GLN 36 16.436 -12.138 0.298 494 HE22 GLN 36 2HE2 GLN 36 15.856 -13.344 1.398 Start of MODEL 18 1 H1 ALA 1 HN ALA 1 1.738 0.134 0.295 2 HA ALA 1 HA ALA 1 3.838 0.338 -1.070 3 HB1 ALA 1 1HB ALA 1 5.470 -1.088 -0.474 4 HB2 ALA 1 2HB ALA 1 4.362 -1.975 0.601 5 HB3 ALA 1 3HB ALA 1 4.480 -2.418 -1.119 6 H ASN 2 HN ASN 2 1.825 -2.663 -0.640 7 HA ASN 2 HA ASN 2 0.371 -3.623 -1.930 8 HB2 ASN 2 2HB ASN 2 0.169 -0.776 -2.793 9 HB3 ASN 2 3HB ASN 2 -0.393 -1.914 -4.002 10 HD21 ASN 2 1HD2 ASN 2 -2.497 -2.042 -3.934 11 HD22 ASN 2 2HD2 ASN 2 -3.496 -2.192 -2.527 12 H GLU 3 HN GLU 3 0.511 -5.012 -3.782 13 HA GLU 3 HA GLU 3 2.952 -5.060 -5.098 14 HB2 GLU 3 2HB GLU 3 0.319 -6.446 -5.771 15 HB3 GLU 3 3HB GLU 3 1.860 -6.851 -6.501 16 HG2 GLU 3 2HG GLU 3 2.796 -7.505 -4.337 17 HG3 GLU 3 3HG GLU 3 1.390 -6.897 -3.486 18 H GLY 4 HN GLY 4 3.316 -4.940 -7.505 19 HA2 GLY 4 1HA GLY 4 3.187 -3.889 -9.489 20 HA3 GLY 4 2HA GLY 4 1.472 -3.656 -9.214 21 H ASP 5 HN ASP 5 4.206 -2.484 -7.161 22 HA ASP 5 HA ASP 5 3.364 0.213 -7.884 23 HB2 ASP 5 2HB ASP 5 3.766 -1.102 -5.250 24 HB3 ASP 5 3HB ASP 5 4.570 0.448 -5.386 25 H VAL 6 HN VAL 6 5.243 1.861 -7.387 26 HA VAL 6 HA VAL 6 7.851 0.564 -7.713 27 HB VAL 6 HB VAL 6 6.548 2.673 -9.405 28 HG11 VAL 6 1HG1 VAL 6 8.647 3.411 -10.278 29 HG12 VAL 6 2HG1 VAL 6 8.742 3.548 -8.506 30 HG13 VAL 6 3HG1 VAL 6 9.541 2.193 -9.337 31 HG21 VAL 6 3HG2 VAL 6 6.338 0.593 -10.426 32 HG22 VAL 6 1HG2 VAL 6 7.821 1.238 -11.171 33 HG23 VAL 6 2HG2 VAL 6 7.932 0.037 -9.861 34 H TYR 7 HN TYR 7 9.531 1.521 -6.564 35 HA TYR 7 HA TYR 7 8.818 3.964 -5.090 36 HB2 TYR 7 2HB TYR 7 9.815 1.214 -4.289 37 HB3 TYR 7 3HB TYR 7 10.537 2.562 -3.434 38 HD1 TYR 7 HD1 TYR 7 9.011 4.170 -2.169 39 HD2 TYR 7 HD2 TYR 7 7.651 0.422 -3.721 40 HE1 TYR 7 HE1 TYR 7 7.010 4.239 -0.602 41 HE2 TYR 7 HE2 TYR 7 5.654 0.504 -2.148 42 HH TYR 7 HH TYR 7 5.460 2.101 0.432 43 H LYS 8 HN LYS 8 10.214 5.587 -5.542 44 HA LYS 8 HA LYS 8 12.937 4.798 -6.316 45 HB2 LYS 8 2HB LYS 8 11.768 5.699 -8.224 46 HB3 LYS 8 3HB LYS 8 11.215 7.086 -7.306 47 HG2 LYS 8 2HG LYS 8 14.164 6.700 -7.244 48 HG3 LYS 8 3HG LYS 8 13.523 7.014 -8.845 49 HD2 LYS 8 2HD LYS 8 12.535 8.746 -6.584 50 HD3 LYS 8 3HD LYS 8 14.172 9.009 -7.151 51 HE2 LYS 8 2HE LYS 8 13.240 10.323 -8.765 52 HE3 LYS 8 3HE LYS 8 12.768 8.826 -9.546 53 HZ1 LYS 8 2HZ LYS 8 10.629 9.295 -9.101 54 HZ3 LYS 8 1HZ LYS 8 11.064 10.750 -8.510 55 H CYS 9 HN CYS 9 14.641 5.703 -5.210 56 HA CYS 9 HA CYS 9 13.960 7.035 -2.781 57 HB2 CYS 9 2HB CYS 9 15.748 5.331 -2.881 58 HB3 CYS 9 3HB CYS 9 16.680 6.360 -3.950 59 H GLU 10 HN GLU 10 14.462 9.229 -2.237 60 HA GLU 10 HA GLU 10 14.887 10.880 -4.585 61 HB2 GLU 10 2HB GLU 10 13.527 11.275 -1.931 62 HB3 GLU 10 3HB GLU 10 14.200 12.689 -2.716 63 HG2 GLU 10 2HG GLU 10 12.666 10.929 -4.553 64 HG3 GLU 10 3HG GLU 10 11.700 11.594 -3.252 65 H LEU 11 HN LEU 11 17.067 9.373 -3.200 66 HA LEU 11 HA LEU 11 18.687 11.706 -2.470 67 HB2 LEU 11 2HB LEU 11 18.013 9.389 -0.856 68 HB3 LEU 11 3HB LEU 11 19.745 9.533 -1.079 69 HG LEU 11 HG LEU 11 18.588 12.109 -0.414 70 HD11 LEU 11 1HD1 LEU 11 17.095 10.151 0.734 71 HD12 LEU 11 2HD1 LEU 11 18.363 10.376 1.964 72 HD13 LEU 11 3HD1 LEU 11 17.372 11.759 1.443 73 HD21 LEU 11 3HD2 LEU 11 20.934 10.550 0.098 74 HD22 LEU 11 1HD2 LEU 11 20.659 12.291 0.350 75 HD23 LEU 11 2HD2 LEU 11 20.274 11.133 1.645 76 H CYS 12 HN CYS 12 19.051 8.140 -3.091 77 HA CYS 12 HA CYS 12 21.407 8.733 -4.644 78 HB2 CYS 12 2HB CYS 12 21.610 6.271 -4.804 79 HB3 CYS 12 3HB CYS 12 21.597 6.889 -3.164 80 H GLY 13 HN GLY 13 18.132 7.211 -5.027 81 HA2 GLY 13 1HA GLY 13 16.847 7.861 -6.970 82 HA3 GLY 13 2HA GLY 13 18.316 7.791 -7.921 83 H GLN 14 HN GLN 14 17.518 5.417 -5.360 84 HA GLN 14 HA GLN 14 17.804 3.331 -7.265 85 HB2 GLN 14 2HB GLN 14 18.704 3.024 -5.026 86 HB3 GLN 14 3HB GLN 14 17.149 3.353 -4.290 87 HG2 GLN 14 2HG GLN 14 16.244 1.275 -4.922 88 HG3 GLN 14 3HG GLN 14 17.325 1.098 -6.290 89 HE21 GLN 14 1HE2 GLN 14 17.705 1.715 -2.798 90 HE22 GLN 14 2HE2 GLN 14 18.853 0.458 -2.476 91 H VAL 15 HN VAL 15 16.198 2.416 -8.473 92 HA VAL 15 HA VAL 15 13.445 2.949 -7.602 93 HB VAL 15 HB VAL 15 14.578 2.404 -10.354 94 HG11 VAL 15 1HG1 VAL 15 12.402 1.541 -10.428 95 HG12 VAL 15 2HG1 VAL 15 11.760 2.803 -9.348 96 HG13 VAL 15 3HG1 VAL 15 12.212 3.208 -11.021 97 HG21 VAL 15 3HG2 VAL 15 13.525 4.961 -9.098 98 HG22 VAL 15 1HG2 VAL 15 15.209 4.615 -9.559 99 HG23 VAL 15 2HG2 VAL 15 13.955 4.760 -10.814 100 H VAL 16 HN VAL 16 12.189 1.246 -7.006 101 HA VAL 16 HA VAL 16 12.972 -1.402 -7.955 102 HB VAL 16 HB VAL 16 13.160 -2.337 -5.874 103 HG11 VAL 16 1HG1 VAL 16 14.103 0.428 -5.110 104 HG12 VAL 16 2HG1 VAL 16 14.817 -1.152 -4.708 105 HG13 VAL 16 3HG1 VAL 16 14.926 -0.523 -6.370 106 HG21 VAL 16 3HG2 VAL 16 12.266 -1.459 -3.801 107 HG22 VAL 16 1HG2 VAL 16 11.795 0.059 -4.603 108 HG23 VAL 16 2HG2 VAL 16 10.982 -1.465 -5.035 109 H LYS 17 HN LYS 17 11.227 -2.726 -8.420 110 HA LYS 17 HA LYS 17 8.620 -1.443 -8.072 111 HB2 LYS 17 2HB LYS 17 9.221 -1.896 -10.372 112 HB3 LYS 17 3HB LYS 17 9.592 -3.568 -10.001 113 HG2 LYS 17 2HG LYS 17 6.844 -2.549 -9.290 114 HG3 LYS 17 3HG LYS 17 7.196 -2.831 -10.983 115 HD2 LYS 17 2HD LYS 17 7.955 -5.171 -10.397 116 HD3 LYS 17 3HD LYS 17 7.488 -4.877 -8.734 117 HE2 LYS 17 2HE LYS 17 5.277 -5.215 -9.182 118 HE3 LYS 17 3HE LYS 17 5.318 -4.172 -10.590 119 HZ1 LYS 17 2HZ LYS 17 6.032 -5.958 -11.943 120 HZ3 LYS 17 1HZ LYS 17 4.893 -6.638 -10.999 121 H VAL 18 HN VAL 18 7.398 -2.111 -6.400 122 HA VAL 18 HA VAL 18 8.100 -4.415 -4.918 123 HB VAL 18 HB VAL 18 5.666 -2.619 -4.890 124 HG11 VAL 18 1HG1 VAL 18 5.868 -5.136 -3.735 125 HG12 VAL 18 2HG1 VAL 18 6.298 -4.032 -2.407 126 HG13 VAL 18 3HG1 VAL 18 4.744 -3.843 -3.255 127 HG21 VAL 18 3HG2 VAL 18 8.177 -2.655 -3.181 128 HG22 VAL 18 1HG2 VAL 18 7.724 -1.422 -4.383 129 HG23 VAL 18 2HG2 VAL 18 6.756 -1.619 -2.902 130 H LEU 19 HN LEU 19 7.519 -6.511 -5.196 131 HA LEU 19 HA LEU 19 5.407 -7.012 -7.171 132 HB2 LEU 19 2HB LEU 19 6.502 -9.125 -7.608 133 HB3 LEU 19 3HB LEU 19 7.578 -7.771 -7.891 134 HG LEU 19 HG LEU 19 8.001 -8.606 -5.206 135 HD11 LEU 19 1HD1 LEU 19 8.800 -10.967 -5.695 136 HD12 LEU 19 2HD1 LEU 19 7.041 -10.731 -5.558 137 HD13 LEU 19 3HD1 LEU 19 7.794 -10.899 -7.162 138 HD21 LEU 19 3HD2 LEU 19 10.247 -8.843 -5.882 139 HD22 LEU 19 1HD2 LEU 19 9.792 -9.188 -7.569 140 HD23 LEU 19 2HD2 LEU 19 9.573 -7.551 -6.904 141 H GLU 20 HN GLU 20 6.620 -7.609 -3.882 142 HA GLU 20 HA GLU 20 4.075 -8.928 -3.362 143 HB2 GLU 20 2HB GLU 20 6.431 -10.301 -3.338 144 HB3 GLU 20 3HB GLU 20 6.418 -9.727 -1.682 145 HG2 GLU 20 2HG GLU 20 4.300 -10.792 -1.219 146 HG3 GLU 20 3HG GLU 20 3.984 -11.076 -2.919 147 H GLU 21 HN GLU 21 3.054 -7.126 -2.446 148 HA GLU 21 HA GLU 21 4.321 -5.279 -0.852 149 HB2 GLU 21 2HB GLU 21 2.061 -4.549 -0.225 150 HB3 GLU 21 3HB GLU 21 2.114 -4.936 -1.934 151 HG2 GLU 21 2HG GLU 21 1.090 -7.139 -1.522 152 HG3 GLU 21 3HG GLU 21 1.168 -6.893 0.212 153 H GLY 22 HN GLY 22 3.931 -4.861 1.536 154 HA2 GLY 22 1HA GLY 22 3.547 -7.341 3.076 155 HA3 GLY 22 2HA GLY 22 5.014 -6.406 3.283 156 H GLY 23 HN GLY 23 5.021 -4.662 4.678 157 HA2 GLY 23 1HA GLY 23 2.718 -3.092 5.217 158 HA3 GLY 23 2HA GLY 23 2.961 -4.274 6.489 159 H GLY 24 HN GLY 24 5.367 -2.480 4.444 160 HA2 GLY 24 1HA GLY 24 6.203 -0.906 6.746 161 HA3 GLY 24 2HA GLY 24 7.359 -2.083 6.156 162 H THR 25 HN THR 25 8.453 0.240 5.911 163 HA THR 25 HA THR 25 7.852 1.175 3.180 164 HB THR 25 HB THR 25 7.561 2.645 5.458 165 HG1 THR 25 HG1 THR 25 8.935 3.666 3.093 166 HG21 THR 25 3HG2 THR 25 10.419 3.147 4.469 167 HG22 THR 25 1HG2 THR 25 9.534 4.149 5.644 168 HG23 THR 25 2HG2 THR 25 9.998 2.483 6.066 169 H LEU 26 HN LEU 26 9.854 2.266 2.150 170 HA LEU 26 HA LEU 26 12.119 0.474 2.677 171 HB2 LEU 26 2HB LEU 26 11.515 1.864 0.076 172 HB3 LEU 26 3HB LEU 26 12.657 0.567 0.375 173 HG LEU 26 HG LEU 26 9.695 0.162 0.780 174 HD11 LEU 26 1HD1 LEU 26 9.895 -0.928 -1.590 175 HD12 LEU 26 2HD1 LEU 26 9.595 0.818 -1.425 176 HD13 LEU 26 3HD1 LEU 26 11.234 0.229 -1.794 177 HD21 LEU 26 3HD2 LEU 26 10.289 -1.895 1.348 178 HD22 LEU 26 1HD2 LEU 26 11.108 -2.116 -0.218 179 HD23 LEU 26 2HD2 LEU 26 12.002 -1.444 1.167 180 H VAL 27 HN VAL 27 12.711 2.023 4.429 181 HA VAL 27 HA VAL 27 13.337 4.695 3.765 182 HB VAL 27 HB VAL 27 14.305 2.956 6.042 183 HG11 VAL 27 1HG1 VAL 27 14.740 5.010 7.231 184 HG12 VAL 27 2HG1 VAL 27 15.593 5.065 5.669 185 HG13 VAL 27 3HG1 VAL 27 14.081 5.979 5.891 186 HG21 VAL 27 3HG2 VAL 27 12.426 4.108 7.300 187 HG22 VAL 27 1HG2 VAL 27 11.806 4.640 5.719 188 HG23 VAL 27 2HG2 VAL 27 11.924 2.903 6.090 189 H CYS 28 HN CYS 28 14.810 5.155 2.196 190 HA CYS 28 HA CYS 28 17.338 3.679 2.357 191 HB2 CYS 28 2HB CYS 28 15.937 3.194 0.327 192 HB3 CYS 28 3HB CYS 28 16.130 4.871 -0.144 193 H CYS 29 HN CYS 29 19.201 4.962 2.505 194 HA CYS 29 HA CYS 29 20.456 6.746 2.746 195 HB2 CYS 29 2HB CYS 29 18.400 7.962 0.910 196 HB3 CYS 29 3HB CYS 29 19.733 8.904 1.548 197 H GLY 30 HN GLY 30 18.052 6.030 4.507 198 HA2 GLY 30 1HA GLY 30 17.311 6.798 6.500 199 HA3 GLY 30 2HA GLY 30 18.257 8.257 6.287 200 H GLU 31 HN GLU 31 16.103 7.325 3.660 201 HA GLU 31 HA GLU 31 14.074 9.129 4.683 202 HB2 GLU 31 2HB GLU 31 15.691 10.365 3.141 203 HB3 GLU 31 3HB GLU 31 15.156 9.319 1.840 204 HG2 GLU 31 2HG GLU 31 12.734 10.181 2.888 205 HG3 GLU 31 3HG GLU 31 13.745 11.589 3.142 206 H ASP 32 HN ASP 32 12.031 8.303 4.405 207 HA ASP 32 HA ASP 32 11.700 5.751 3.463 208 HB2 ASP 32 2HB ASP 32 9.435 7.756 3.361 209 HB3 ASP 32 3HB ASP 32 9.387 6.080 3.871 210 H MET 33 HN MET 33 11.957 5.109 1.315 211 HA MET 33 HA MET 33 12.200 6.659 -0.828 212 HB2 MET 33 2HB MET 33 12.255 4.013 -0.445 213 HB3 MET 33 3HB MET 33 10.610 4.069 -1.046 214 HG2 MET 33 2HG MET 33 11.265 4.775 -3.197 215 HG3 MET 33 3HG MET 33 12.752 5.505 -2.624 216 HE1 MET 33 3HE MET 33 13.885 2.931 -0.694 217 HE2 MET 33 1HE MET 33 15.090 2.557 -1.948 218 HE3 MET 33 2HE MET 33 14.657 4.249 -1.607 219 H VAL 34 HN VAL 34 10.808 7.232 -2.685 220 HA VAL 34 HA VAL 34 8.094 7.831 -1.764 221 HB VAL 34 HB VAL 34 8.159 9.725 -3.033 222 HG11 VAL 34 1HG1 VAL 34 10.205 9.431 -1.349 223 HG12 VAL 34 2HG1 VAL 34 11.142 9.623 -2.850 224 HG13 VAL 34 3HG1 VAL 34 10.004 10.894 -2.344 225 HG21 VAL 34 3HG2 VAL 34 10.347 8.558 -4.786 226 HG22 VAL 34 1HG2 VAL 34 8.609 8.537 -5.172 227 HG23 VAL 34 2HG2 VAL 34 9.473 10.087 -5.038 228 H LYS 35 HN LYS 35 6.323 7.646 -3.393 229 HA LYS 35 HA LYS 35 6.679 5.170 -4.859 230 HB2 LYS 35 2HB LYS 35 4.643 6.157 -3.295 231 HB3 LYS 35 3HB LYS 35 4.046 6.492 -4.908 232 HG2 LYS 35 2HG LYS 35 3.432 4.314 -5.061 233 HG3 LYS 35 3HG LYS 35 5.131 3.890 -5.102 234 HD2 LYS 35 2HD LYS 35 4.776 2.763 -3.161 235 HD3 LYS 35 3HD LYS 35 4.683 4.328 -2.377 236 HE2 LYS 35 2HE LYS 35 2.450 4.102 -1.997 237 HE3 LYS 35 3HE LYS 35 2.137 3.695 -3.672 238 HZ1 LYS 35 2HZ LYS 35 2.722 1.882 -1.441 239 HZ3 LYS 35 1HZ LYS 35 3.181 1.413 -2.931 240 H GLN 36 HN GLN 36 6.030 4.956 -7.121 241 HA GLN 36 HA GLN 36 6.319 7.504 -8.517 242 HB2 GLN 36 2HB GLN 36 7.270 4.778 -9.499 243 HB3 GLN 36 3HB GLN 36 7.521 6.316 -10.298 244 HG2 GLN 36 2HG GLN 36 8.517 5.816 -7.465 245 HG3 GLN 36 3HG GLN 36 9.474 5.371 -8.863 246 HE21 GLN 36 1HE2 GLN 36 8.140 7.948 -6.964 247 HE22 GLN 36 2HE2 GLN 36 9.013 9.268 -7.669 248 H1 ALA 1 HN ALA 1 21.105 -1.154 -5.144 249 HA ALA 1 HA ALA 1 22.931 -2.718 -5.177 250 HB1 ALA 1 1HB ALA 1 22.019 -3.852 -3.455 251 HB2 ALA 1 2HB ALA 1 20.489 -3.030 -3.846 252 HB3 ALA 1 3HB ALA 1 20.828 -4.643 -4.515 253 H ASN 2 HN ASN 2 23.249 -2.700 -7.653 254 HA ASN 2 HA ASN 2 23.562 -3.781 -9.504 255 HB2 ASN 2 2HB ASN 2 23.579 -5.903 -7.438 256 HB3 ASN 2 3HB ASN 2 23.140 -6.528 -9.015 257 HD21 ASN 2 1HD2 ASN 2 25.575 -6.733 -7.271 258 HD22 ASN 2 2HD2 ASN 2 26.919 -6.325 -8.282 259 H GLU 3 HN GLU 3 21.815 -3.263 -10.878 260 HA GLU 3 HA GLU 3 19.222 -3.717 -10.512 261 HB2 GLU 3 2HB GLU 3 20.723 -3.916 -13.161 262 HB3 GLU 3 3HB GLU 3 18.994 -3.669 -13.015 263 HG2 GLU 3 2HG GLU 3 19.216 -1.468 -12.334 264 HG3 GLU 3 3HG GLU 3 20.687 -1.779 -11.433 265 H GLY 4 HN GLY 4 17.646 -5.313 -11.391 266 HA2 GLY 4 1HA GLY 4 16.911 -7.399 -11.845 267 HA3 GLY 4 2HA GLY 4 18.533 -7.852 -12.331 268 H ASP 5 HN ASP 5 17.608 -6.471 -9.136 269 HA ASP 5 HA ASP 5 18.403 -9.034 -7.994 270 HB2 ASP 5 2HB ASP 5 18.981 -6.190 -7.272 271 HB3 ASP 5 3HB ASP 5 18.621 -7.240 -5.915 272 H VAL 6 HN VAL 6 17.387 -9.197 -5.591 273 HA VAL 6 HA VAL 6 14.711 -8.013 -5.573 274 HB VAL 6 HB VAL 6 15.447 -10.927 -5.459 275 HG11 VAL 6 1HG1 VAL 6 13.451 -11.529 -4.402 276 HG12 VAL 6 2HG1 VAL 6 14.010 -10.130 -3.454 277 HG13 VAL 6 3HG1 VAL 6 12.716 -9.928 -4.658 278 HG21 VAL 6 3HG2 VAL 6 14.836 -10.380 -7.636 279 HG22 VAL 6 1HG2 VAL 6 13.298 -10.945 -6.940 280 HG23 VAL 6 2HG2 VAL 6 13.611 -9.201 -7.107 281 H TYR 7 HN TYR 7 13.947 -7.493 -3.507 282 HA TYR 7 HA TYR 7 15.774 -8.163 -1.302 283 HB2 TYR 7 2HB TYR 7 14.617 -5.580 -2.398 284 HB3 TYR 7 3HB TYR 7 14.697 -5.702 -0.652 285 HD1 TYR 7 HD1 TYR 7 16.969 -6.155 0.435 286 HD2 TYR 7 HD2 TYR 7 16.540 -5.040 -3.672 287 HE1 TYR 7 HE1 TYR 7 19.409 -5.447 0.366 288 HE2 TYR 7 HE2 TYR 7 18.982 -4.335 -3.728 289 HH TYR 7 HH TYR 7 20.658 -3.510 -1.918 290 H LYS 8 HN LYS 8 14.750 -9.233 0.310 291 HA LYS 8 HA LYS 8 11.853 -8.797 0.539 292 HB2 LYS 8 2HB LYS 8 12.024 -11.000 -0.168 293 HB3 LYS 8 3HB LYS 8 13.523 -11.285 0.692 294 HG2 LYS 8 2HG LYS 8 12.421 -11.980 2.554 295 HG3 LYS 8 3HG LYS 8 11.418 -10.543 2.578 296 HD2 LYS 8 2HD LYS 8 9.697 -11.543 1.365 297 HD3 LYS 8 3HD LYS 8 10.782 -12.589 0.471 298 HE2 LYS 8 2HE LYS 8 11.158 -13.559 3.019 299 HE3 LYS 8 3HE LYS 8 9.494 -13.021 3.133 300 HZ1 LYS 8 2HZ LYS 8 9.148 -14.310 0.976 301 HZ3 LYS 8 1HZ LYS 8 9.400 -15.217 2.304 302 H CYS 9 HN CYS 9 11.061 -8.123 2.491 303 HA CYS 9 HA CYS 9 12.976 -7.268 4.408 304 HB2 CYS 9 2HB CYS 9 10.974 -5.937 3.919 305 HB3 CYS 9 3HB CYS 9 9.941 -7.234 4.486 306 H GLU 10 HN GLU 10 13.142 -8.042 6.632 307 HA GLU 10 HA GLU 10 12.303 -10.819 6.834 308 HB2 GLU 10 2HB GLU 10 14.617 -9.237 7.938 309 HB3 GLU 10 3HB GLU 10 14.058 -10.626 8.848 310 HG2 GLU 10 2HG GLU 10 14.316 -11.164 5.944 311 HG3 GLU 10 3HG GLU 10 15.831 -10.707 6.697 312 H LEU 11 HN LEU 11 10.422 -8.629 7.271 313 HA LEU 11 HA LEU 11 9.801 -9.211 10.063 314 HB2 LEU 11 2HB LEU 11 10.564 -6.621 8.974 315 HB3 LEU 11 3HB LEU 11 8.971 -6.584 9.704 316 HG LEU 11 HG LEU 11 10.771 -7.991 11.455 317 HD11 LEU 11 1HD1 LEU 11 12.203 -5.952 12.006 318 HD12 LEU 11 2HD1 LEU 11 12.645 -6.892 10.561 319 HD13 LEU 11 3HD1 LEU 11 11.770 -5.352 10.387 320 HD21 LEU 11 3HD2 LEU 11 9.800 -5.269 12.132 321 HD22 LEU 11 1HD2 LEU 11 8.565 -6.486 11.731 322 HD23 LEU 11 2HD2 LEU 11 9.716 -6.788 13.055 323 H CYS 12 HN CYS 12 8.551 -7.321 7.215 324 HA CYS 12 HA CYS 12 5.930 -8.398 7.767 325 HB2 CYS 12 2HB CYS 12 5.231 -6.886 5.904 326 HB3 CYS 12 3HB CYS 12 5.927 -6.092 7.302 327 H GLY 13 HN GLY 13 8.475 -8.353 5.188 328 HA2 GLY 13 1HA GLY 13 8.972 -10.406 4.056 329 HA3 GLY 13 2HA GLY 13 7.269 -10.817 4.090 330 H GLN 14 HN GLN 14 8.331 -7.482 3.439 331 HA GLN 14 HA GLN 14 6.925 -7.497 1.005 332 HB2 GLN 14 2HB GLN 14 6.979 -5.459 2.282 333 HB3 GLN 14 3HB GLN 14 8.730 -5.471 2.376 334 HG2 GLN 14 2HG GLN 14 9.000 -4.756 0.155 335 HG3 GLN 14 3HG GLN 14 7.466 -5.427 -0.365 336 HE21 GLN 14 1HE2 GLN 14 7.896 -3.552 2.569 337 HE22 GLN 14 2HE2 GLN 14 7.011 -2.142 2.089 338 H VAL 15 HN VAL 15 7.629 -8.168 -0.974 339 HA VAL 15 HA VAL 15 10.538 -8.353 -1.337 340 HB VAL 15 HB VAL 15 8.328 -9.901 -2.702 341 HG11 VAL 15 1HG1 VAL 15 11.344 -10.000 -2.856 342 HG12 VAL 15 2HG1 VAL 15 10.338 -11.405 -3.283 343 HG13 VAL 15 3HG1 VAL 15 10.157 -9.877 -4.177 344 HG21 VAL 15 3HG2 VAL 15 9.300 -11.828 -1.330 345 HG22 VAL 15 1HG2 VAL 15 10.078 -10.578 -0.329 346 HG23 VAL 15 2HG2 VAL 15 8.303 -10.639 -0.457 347 H VAL 16 HN VAL 16 11.429 -6.914 -2.718 348 HA VAL 16 HA VAL 16 9.678 -5.848 -4.821 349 HB VAL 16 HB VAL 16 10.401 -3.685 -4.447 350 HG11 VAL 16 1HG1 VAL 16 8.883 -4.451 -2.667 351 HG12 VAL 16 2HG1 VAL 16 10.284 -4.915 -1.673 352 HG13 VAL 16 3HG1 VAL 16 10.008 -3.204 -2.076 353 HG21 VAL 16 3HG2 VAL 16 12.691 -3.643 -4.330 354 HG22 VAL 16 1HG2 VAL 16 12.302 -3.334 -2.620 355 HG23 VAL 16 2HG2 VAL 16 12.768 -4.970 -3.145 356 H LYS 17 HN LYS 17 10.738 -5.345 -6.832 357 HA LYS 17 HA LYS 17 13.263 -6.810 -7.102 358 HB2 LYS 17 2HB LYS 17 12.026 -7.879 -8.645 359 HB3 LYS 17 3HB LYS 17 10.822 -6.609 -8.722 360 HG2 LYS 17 2HG LYS 17 11.848 -6.581 -10.872 361 HG3 LYS 17 3HG LYS 17 12.561 -5.218 -10.033 362 HD2 LYS 17 2HD LYS 17 14.482 -6.231 -10.891 363 HD3 LYS 17 3HD LYS 17 14.412 -6.979 -9.308 364 HE2 LYS 17 2HE LYS 17 14.072 -9.049 -10.196 365 HE3 LYS 17 3HE LYS 17 12.779 -8.475 -11.230 366 HZ1 LYS 17 2HZ LYS 17 14.291 -8.871 -12.857 367 HZ3 LYS 17 1HZ LYS 17 15.582 -8.813 -11.866 368 H VAL 18 HN VAL 18 15.088 -5.643 -7.325 369 HA VAL 18 HA VAL 18 14.960 -2.826 -7.535 370 HB VAL 18 HB VAL 18 17.280 -4.747 -7.814 371 HG11 VAL 18 1HG1 VAL 18 17.270 -2.077 -8.458 372 HG12 VAL 18 2HG1 VAL 18 17.777 -2.044 -6.752 373 HG13 VAL 18 3HG1 VAL 18 18.698 -3.003 -7.936 374 HG21 VAL 18 3HG2 VAL 18 15.815 -3.629 -5.466 375 HG22 VAL 18 1HG2 VAL 18 16.628 -5.199 -5.672 376 HG23 VAL 18 2HG2 VAL 18 17.588 -3.734 -5.354 377 H LEU 19 HN LEU 19 14.740 -1.584 -9.321 378 HA LEU 19 HA LEU 19 15.203 -2.905 -11.894 379 HB2 LEU 19 2HB LEU 19 13.303 -0.841 -10.909 380 HB3 LEU 19 3HB LEU 19 13.868 -0.690 -12.561 381 HG LEU 19 HG LEU 19 13.000 -3.413 -11.918 382 HD11 LEU 19 1HD1 LEU 19 10.848 -1.289 -11.905 383 HD12 LEU 19 2HD1 LEU 19 10.672 -3.041 -11.646 384 HD13 LEU 19 3HD1 LEU 19 11.498 -2.040 -10.428 385 HD21 LEU 19 3HD2 LEU 19 13.313 -2.992 -14.173 386 HD22 LEU 19 1HD2 LEU 19 11.547 -2.851 -13.998 387 HD23 LEU 19 2HD2 LEU 19 12.552 -1.385 -14.091 388 H GLU 20 HN GLU 20 15.724 0.197 -10.092 389 HA GLU 20 HA GLU 20 17.973 0.633 -11.900 390 HB2 GLU 20 2HB GLU 20 15.970 2.298 -11.892 391 HB3 GLU 20 3HB GLU 20 16.565 2.820 -10.329 392 HG2 GLU 20 2HG GLU 20 18.368 3.913 -11.232 393 HG3 GLU 20 3HG GLU 20 18.695 2.632 -12.384 394 H GLU 21 HN GLU 21 19.718 -0.218 -10.787 395 HA GLU 21 HA GLU 21 19.987 -0.486 -8.131 396 HB2 GLU 21 2HB GLU 21 21.582 -1.496 -9.619 397 HB3 GLU 21 3HB GLU 21 22.071 0.051 -10.278 398 HG2 GLU 21 2HG GLU 21 22.966 0.699 -8.006 399 HG3 GLU 21 3HG GLU 21 22.541 -0.895 -7.411 400 H GLY 22 HN GLY 22 21.223 0.706 -6.461 401 HA2 GLY 22 1HA GLY 22 21.885 3.471 -6.941 402 HA3 GLY 22 2HA GLY 22 20.421 3.254 -6.003 403 H GLY 23 HN GLY 23 23.316 4.212 -5.374 404 HA2 GLY 23 1HA GLY 23 24.449 2.294 -3.609 405 HA3 GLY 23 2HA GLY 23 24.849 3.996 -3.735 406 H GLY 24 HN GLY 24 22.008 1.969 -2.686 407 HA2 GLY 24 1HA GLY 24 22.061 3.262 -0.080 408 HA3 GLY 24 2HA GLY 24 20.655 3.596 -1.072 409 H THR 25 HN THR 25 20.007 2.372 1.199 410 HA THR 25 HA THR 25 19.592 -0.432 0.398 411 HB THR 25 HB THR 25 20.377 0.763 3.101 412 HG1 THR 25 HG1 THR 25 21.875 -1.236 2.609 413 HG21 THR 25 3HG2 THR 25 18.746 -0.900 3.719 414 HG22 THR 25 1HG2 THR 25 19.221 -1.968 2.377 415 HG23 THR 25 2HG2 THR 25 20.307 -1.754 3.771 416 H LEU 26 HN LEU 26 17.639 -1.432 1.376 417 HA LEU 26 HA LEU 26 15.550 0.620 1.575 418 HB2 LEU 26 2HB LEU 26 15.015 -2.247 0.905 419 HB3 LEU 26 3HB LEU 26 14.075 -0.817 0.526 420 HG LEU 26 HG LEU 26 16.795 -1.187 -0.704 421 HD11 LEU 26 1HD1 LEU 26 15.550 -3.306 -1.039 422 HD12 LEU 26 2HD1 LEU 26 14.247 -2.383 -1.826 423 HD13 LEU 26 3HD1 LEU 26 15.871 -2.426 -2.552 424 HD21 LEU 26 3HD2 LEU 26 14.516 0.609 -1.024 425 HD22 LEU 26 1HD2 LEU 26 16.208 0.792 -1.545 426 HD23 LEU 26 2HD2 LEU 26 15.055 -0.104 -2.563 427 H VAL 27 HN VAL 27 16.050 0.948 3.860 428 HA VAL 27 HA VAL 27 15.866 -1.260 5.646 429 HB VAL 27 HB VAL 27 15.853 1.739 6.010 430 HG11 VAL 27 1HG1 VAL 27 16.576 0.187 8.369 431 HG12 VAL 27 2HG1 VAL 27 15.427 1.535 8.197 432 HG13 VAL 27 3HG1 VAL 27 14.903 -0.130 7.852 433 HG21 VAL 27 3HG2 VAL 27 18.082 1.625 5.947 434 HG22 VAL 27 1HG2 VAL 27 18.109 0.283 7.115 435 HG23 VAL 27 2HG2 VAL 27 17.916 -0.053 5.377 436 H CYS 28 HN CYS 28 13.982 -2.375 5.832 437 HA CYS 28 HA CYS 28 11.548 -0.751 6.015 438 HB2 CYS 28 2HB CYS 28 11.775 -2.284 4.009 439 HB3 CYS 28 3HB CYS 28 11.691 -3.633 5.124 440 H CYS 29 HN CYS 29 10.264 -1.076 7.862 441 HA CYS 29 HA CYS 29 9.718 -1.723 9.885 442 HB2 CYS 29 2HB CYS 29 10.859 -4.343 8.924 443 HB3 CYS 29 3HB CYS 29 10.179 -4.156 10.529 444 H GLY 30 HN GLY 30 12.348 -0.443 9.259 445 HA2 GLY 30 1HA GLY 30 14.140 0.256 10.429 446 HA3 GLY 30 2HA GLY 30 13.522 -0.597 11.829 447 H GLU 31 HN GLU 31 14.033 -2.331 8.772 448 HA GLU 31 HA GLU 31 16.574 -3.307 9.757 449 HB2 GLU 31 2HB GLU 31 14.408 -4.779 10.362 450 HB3 GLU 31 3HB GLU 31 14.628 -5.357 8.722 451 HG2 GLU 31 2HG GLU 31 17.232 -5.407 9.746 452 HG3 GLU 31 3HG GLU 31 16.265 -5.875 11.131 453 H ASP 32 HN ASP 32 18.058 -3.385 8.113 454 HA ASP 32 HA ASP 32 17.410 -2.489 5.608 455 HB2 ASP 32 2HB ASP 32 19.678 -2.307 5.915 456 HB3 ASP 32 3HB ASP 32 19.748 -3.717 6.954 457 H MET 33 HN MET 33 16.125 -3.569 4.103 458 HA MET 33 HA MET 33 15.292 -6.110 4.245 459 HB2 MET 33 2HB MET 33 14.804 -4.071 2.570 460 HB3 MET 33 3HB MET 33 15.947 -4.898 1.531 461 HG2 MET 33 2HG MET 33 14.554 -6.776 1.248 462 HG3 MET 33 3HG MET 33 13.721 -6.524 2.769 463 HE1 MET 33 3HE MET 33 11.425 -3.554 2.141 464 HE2 MET 33 1HE MET 33 12.559 -4.326 3.275 465 HE3 MET 33 2HE MET 33 13.129 -3.042 2.181 466 H VAL 34 HN VAL 34 15.869 -8.155 3.305 467 HA VAL 34 HA VAL 34 18.740 -8.393 2.877 468 HB VAL 34 HB VAL 34 18.529 -10.591 3.529 469 HG11 VAL 34 1HG1 VAL 34 17.739 -8.817 5.264 470 HG12 VAL 34 2HG1 VAL 34 16.133 -9.550 5.033 471 HG13 VAL 34 3HG1 VAL 34 17.490 -10.544 5.615 472 HG21 VAL 34 3HG2 VAL 34 15.878 -11.383 3.675 473 HG22 VAL 34 1HG2 VAL 34 15.941 -10.444 2.163 474 HG23 VAL 34 2HG2 VAL 34 17.037 -11.827 2.400 475 H LYS 35 HN LYS 35 19.501 -9.876 1.101 476 HA LYS 35 HA LYS 35 17.997 -9.233 -1.302 477 HB2 LYS 35 2HB LYS 35 20.596 -8.925 -0.802 478 HB3 LYS 35 3HB LYS 35 20.664 -10.586 -1.355 479 HG2 LYS 35 2HG LYS 35 18.991 -8.767 -3.033 480 HG3 LYS 35 3HG LYS 35 20.705 -8.400 -3.026 481 HD2 LYS 35 2HD LYS 35 21.289 -10.596 -3.834 482 HD3 LYS 35 3HD LYS 35 19.693 -11.234 -3.491 483 HE2 LYS 35 2HE LYS 35 19.290 -9.000 -5.229 484 HE3 LYS 35 3HE LYS 35 20.643 -9.892 -5.896 485 HZ1 LYS 35 2HZ LYS 35 17.952 -10.982 -5.288 486 HZ3 LYS 35 1HZ LYS 35 19.214 -11.935 -5.676 487 H GLN 36 HN GLN 36 17.511 -10.870 -2.922 488 HA GLN 36 HA GLN 36 17.208 -13.486 -1.664 489 HB2 GLN 36 2HB GLN 36 15.457 -12.261 -3.841 490 HB3 GLN 36 3HB GLN 36 15.188 -13.795 -3.037 491 HG2 GLN 36 2HG GLN 36 15.365 -11.192 -1.468 492 HG3 GLN 36 3HG GLN 36 13.856 -11.729 -2.177 493 HE21 GLN 36 1HE2 GLN 36 16.242 -12.228 0.267 494 HE22 GLN 36 2HE2 GLN 36 15.427 -13.447 1.190
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