NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
13919 | 1w4u | 6277 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT3 MET 1 21.375 -5.268 5.066 2 H2 MET 1 HT2 MET 1 22.803 -4.594 5.664 3 H3 MET 1 HT1 MET 1 21.353 -3.733 5.774 4 HA MET 1 HA MET 1 22.680 -2.826 3.995 5 1HB MET 1 HB2 MET 1 23.829 -5.112 3.680 6 2HB MET 1 HB1 MET 1 22.452 -5.530 2.672 7 1HG MET 1 HG2 MET 1 22.982 -3.539 1.265 8 2HG MET 1 HG1 MET 1 24.462 -3.351 2.206 9 1HE MET 1 HE1 MET 1 25.107 -6.500 2.733 10 2HE MET 1 HE3 MET 1 26.241 -6.816 1.424 11 3HE MET 1 HE2 MET 1 26.356 -5.316 2.345 12 H ALA 2 HN ALA 2 19.776 -3.918 4.734 13 HA ALA 2 HA ALA 2 18.440 -4.087 2.241 14 1HB ALA 2 HB2 ALA 2 16.437 -4.213 3.478 15 2HB ALA 2 HB3 ALA 2 17.173 -3.434 4.879 16 3HB ALA 2 HB1 ALA 2 17.659 -5.065 4.421 17 H LEU 3 HN LEU 3 19.254 -1.415 4.328 18 HA LEU 3 HA LEU 3 17.104 0.275 3.467 19 1HB LEU 3 HB2 LEU 3 18.396 2.076 4.562 20 2HB LEU 3 HB1 LEU 3 18.112 0.701 5.605 21 HG LEU 3 HG LEU 3 20.521 0.030 4.648 22 1HD1 LEU 3 2HD1 LEU 3 20.460 3.044 4.630 23 2HD1 LEU 3 1HD1 LEU 3 21.934 2.076 4.658 24 3HD1 LEU 3 3HD1 LEU 3 20.839 1.976 3.278 25 1HD2 LEU 3 1HD2 LEU 3 19.876 0.174 7.007 26 2HD2 LEU 3 3HD2 LEU 3 21.451 0.914 6.726 27 3HD2 LEU 3 2HD2 LEU 3 20.026 1.929 6.941 28 H LYS 4 HN LYS 4 20.200 -0.592 2.331 29 HA LYS 4 HA LYS 4 20.532 1.809 0.810 30 1HB LYS 4 HB2 LYS 4 22.700 1.140 0.424 31 2HB LYS 4 HB1 LYS 4 22.333 0.500 2.013 32 1HG LYS 4 HG2 LYS 4 23.325 -1.338 1.154 33 2HG LYS 4 HG1 LYS 4 21.683 -1.636 0.575 34 1HD LYS 4 HD2 LYS 4 22.239 -0.695 -1.589 35 2HD LYS 4 HD1 LYS 4 23.852 -0.259 -1.023 36 1HE LYS 4 HE2 LYS 4 24.350 -2.648 -0.683 37 2HE LYS 4 HE1 LYS 4 22.746 -3.060 -1.283 38 1HZ LYS 4 HZ2 LYS 4 24.819 -1.638 -2.867 39 2HZ LYS 4 HZ1 LYS 4 24.497 -3.294 -2.965 40 3HZ LYS 4 HZ3 LYS 4 23.318 -2.175 -3.426 41 H ARG 5 HN ARG 5 19.193 -1.230 0.400 42 HA ARG 5 HA ARG 5 19.143 -1.084 -2.500 43 1HB ARG 5 HB2 ARG 5 18.982 -3.310 -1.592 44 2HB ARG 5 HB1 ARG 5 17.658 -2.835 -0.528 45 1HG ARG 5 HG2 ARG 5 16.613 -3.959 -2.297 46 2HG ARG 5 HG1 ARG 5 16.380 -2.234 -2.640 47 1HD ARG 5 HD2 ARG 5 18.674 -2.611 -3.953 48 2HD ARG 5 HD1 ARG 5 18.017 -4.244 -4.070 49 HE ARG 5 HE ARG 5 15.910 -2.751 -4.812 50 1HH1 ARG 5 1HH1 ARG 5 19.239 -2.868 -5.914 51 2HH1 ARG 5 2HH1 ARG 5 18.889 -2.113 -7.435 52 1HH2 ARG 5 1HH2 ARG 5 15.459 -1.737 -6.788 53 2HH2 ARG 5 2HH2 ARG 5 16.738 -1.495 -7.947 54 H ILE 6 HN ILE 6 17.136 -0.589 0.287 55 HA ILE 6 HA ILE 6 14.824 0.388 -0.921 56 HB ILE 6 HB ILE 6 15.927 1.251 1.761 57 1HG1 ILE 6 2HG1 ILE 6 14.407 -1.221 0.953 58 2HG1 ILE 6 1HG1 ILE 6 15.970 -1.112 1.765 59 1HG2 ILE 6 2HG2 ILE 6 13.228 1.331 0.471 60 2HG2 ILE 6 1HG2 ILE 6 13.374 1.209 2.229 61 3HG2 ILE 6 3HG2 ILE 6 14.075 2.584 1.381 62 1HD1 ILE 6 1HD1 ILE 6 14.790 -0.077 3.708 63 2HD1 ILE 6 3HD1 ILE 6 13.269 -0.470 2.906 64 3HD1 ILE 6 2HD1 ILE 6 14.375 -1.757 3.385 65 H HIS 7 HN HIS 7 17.926 1.781 -0.402 66 HA HIS 7 HA HIS 7 17.680 4.459 -0.819 67 1HB HIS 7 HB2 HIS 7 19.570 2.389 -1.762 68 2HB HIS 7 HB1 HIS 7 19.679 3.977 -2.524 69 HD1 HIS 7 HD1 HIS 7 22.111 3.236 -1.049 70 HD2 HIS 7 HD2 HIS 7 18.881 5.026 0.860 71 HE1 HIS 7 HE1 HIS 7 23.045 4.261 1.054 72 HE2 HIS 7 HE2 HIS 7 21.111 5.506 2.078 73 H LYS 8 HN LYS 8 17.204 1.901 -3.207 74 HA LYS 8 HA LYS 8 16.602 3.901 -5.245 75 1HB LYS 8 HB2 LYS 8 16.318 0.917 -5.506 76 2HB LYS 8 HB1 LYS 8 16.403 2.114 -6.789 77 1HG LYS 8 HG2 LYS 8 18.669 1.508 -4.901 78 2HG LYS 8 HG1 LYS 8 18.478 0.767 -6.492 79 1HD LYS 8 HD2 LYS 8 18.548 3.014 -7.514 80 2HD LYS 8 HD1 LYS 8 18.811 3.717 -5.912 81 1HE LYS 8 HE2 LYS 8 20.900 2.587 -5.685 82 2HE LYS 8 HE1 LYS 8 20.608 1.635 -7.140 83 1HZ LYS 8 HZ2 LYS 8 20.673 3.716 -8.419 84 2HZ LYS 8 HZ1 LYS 8 21.067 4.561 -7.008 85 3HZ LYS 8 HZ3 LYS 8 22.131 3.401 -7.626 86 H GLU 9 HN GLU 9 15.075 1.077 -3.775 87 HA GLU 9 HA GLU 9 12.622 1.240 -4.930 88 1HB GLU 9 HB2 GLU 9 12.778 0.532 -2.027 89 2HB GLU 9 HB1 GLU 9 11.958 -0.313 -3.330 90 1HG GLU 9 HG2 GLU 9 14.928 -0.293 -2.861 91 2HG GLU 9 HG1 GLU 9 13.823 -1.584 -2.409 92 H LEU 10 HN LEU 10 13.494 2.586 -1.798 93 HA LEU 10 HA LEU 10 11.107 4.095 -1.497 94 1HB LEU 10 HB2 LEU 10 12.018 3.383 0.483 95 2HB LEU 10 HB1 LEU 10 13.646 3.674 -0.060 96 HG LEU 10 HG LEU 10 11.933 6.037 0.495 97 1HD1 LEU 10 3HD1 LEU 10 13.364 4.403 2.580 98 2HD1 LEU 10 2HD1 LEU 10 12.646 5.993 2.836 99 3HD1 LEU 10 1HD1 LEU 10 11.620 4.613 2.448 100 1HD2 LEU 10 3HD2 LEU 10 14.168 6.341 -0.448 101 2HD2 LEU 10 2HD2 LEU 10 14.069 7.001 1.188 102 3HD2 LEU 10 1HD2 LEU 10 14.859 5.448 0.905 103 H ASN 11 HN ASN 11 14.490 4.964 -2.337 104 HA ASN 11 HA ASN 11 13.784 7.764 -2.135 105 1HB ASN 11 HB2 ASN 11 16.067 6.553 -1.530 106 2HB ASN 11 HB1 ASN 11 16.408 6.932 -3.216 107 1HD2 ASN 11 1HD2 ASN 11 14.971 9.401 -3.297 108 2HD2 ASN 11 2HD2 ASN 11 15.848 10.544 -2.336 109 H ASP 12 HN ASP 12 14.065 5.408 -4.638 110 HA ASP 12 HA ASP 12 14.387 7.186 -6.793 111 1HB ASP 12 HB2 ASP 12 14.694 4.816 -7.182 112 2HB ASP 12 HB1 ASP 12 13.044 4.450 -6.671 113 H LEU 13 HN LEU 13 11.772 6.265 -4.812 114 HA LEU 13 HA LEU 13 9.658 7.420 -6.209 115 1HB LEU 13 HB2 LEU 13 10.196 6.844 -3.326 116 2HB LEU 13 HB1 LEU 13 8.733 7.679 -3.808 117 HG LEU 13 HG LEU 13 9.443 5.056 -5.062 118 1HD1 LEU 13 1HD1 LEU 13 8.065 5.493 -2.427 119 2HD1 LEU 13 3HD1 LEU 13 8.011 3.994 -3.352 120 3HD1 LEU 13 2HD1 LEU 13 9.553 4.582 -2.713 121 1HD2 LEU 13 2HD2 LEU 13 6.944 6.633 -4.561 122 2HD2 LEU 13 1HD2 LEU 13 7.679 6.231 -6.112 123 3HD2 LEU 13 3HD2 LEU 13 6.936 4.966 -5.130 124 H ALA 14 HN ALA 14 12.065 8.705 -4.042 125 HA ALA 14 HA ALA 14 10.899 11.327 -3.921 126 1HB ALA 14 HB2 ALA 14 12.136 10.364 -2.018 127 2HB ALA 14 HB3 ALA 14 12.784 11.917 -2.542 128 3HB ALA 14 HB1 ALA 14 13.612 10.423 -2.980 129 H ARG 15 HN ARG 15 13.352 9.681 -5.803 130 HA ARG 15 HA ARG 15 14.657 11.902 -6.911 131 1HB ARG 15 HB2 ARG 15 14.031 9.308 -8.328 132 2HB ARG 15 HB1 ARG 15 15.354 10.413 -8.677 133 1HG ARG 15 HG2 ARG 15 15.087 9.019 -6.039 134 2HG ARG 15 HG1 ARG 15 15.898 8.286 -7.405 135 1HD ARG 15 HD2 ARG 15 16.633 10.894 -6.089 136 2HD ARG 15 HD1 ARG 15 17.473 9.358 -5.883 137 HE ARG 15 HE ARG 15 17.346 10.104 -8.624 138 1HH1 ARG 15 1HH1 ARG 15 19.040 10.730 -5.629 139 2HH1 ARG 15 2HH1 ARG 15 20.474 11.317 -6.406 140 1HH2 ARG 15 1HH2 ARG 15 19.231 10.875 -9.663 141 2HH2 ARG 15 2HH2 ARG 15 20.586 11.392 -8.710 142 H ASP 16 HN ASP 16 11.802 10.096 -8.014 143 HA ASP 16 HA ASP 16 10.902 12.507 -9.388 144 1HB ASP 16 HB2 ASP 16 12.135 11.093 -11.049 145 2HB ASP 16 HB1 ASP 16 10.936 9.828 -10.785 146 HA PRO 17 HA PRO 17 7.327 10.567 -7.392 147 1HB PRO 17 HB2 PRO 17 6.554 12.971 -6.199 148 2HB PRO 17 HB1 PRO 17 7.468 11.678 -5.426 149 1HG PRO 17 HG2 PRO 17 8.380 14.287 -6.060 150 2HG PRO 17 HG1 PRO 17 9.337 12.942 -5.423 151 1HD PRO 17 HD2 PRO 17 9.104 13.950 -8.200 152 2HD PRO 17 HD1 PRO 17 10.438 13.075 -7.421 153 HA PRO 18 HA PRO 18 4.993 12.529 -10.718 154 1HB PRO 18 HB2 PRO 18 3.637 10.226 -11.400 155 2HB PRO 18 HB1 PRO 18 5.186 10.733 -12.079 156 1HG PRO 18 HG2 PRO 18 4.620 8.518 -10.307 157 2HG PRO 18 HG1 PRO 18 6.135 8.920 -11.125 158 1HD PRO 18 HD2 PRO 18 5.371 9.371 -8.352 159 2HD PRO 18 HD1 PRO 18 6.965 9.526 -9.111 160 H ALA 19 HN ALA 19 3.024 9.866 -9.451 161 HA ALA 19 HA ALA 19 1.359 11.559 -7.844 162 1HB ALA 19 HB2 ALA 19 0.254 10.564 -10.474 163 2HB ALA 19 HB1 ALA 19 -0.681 11.333 -9.192 164 3HB ALA 19 HB3 ALA 19 0.560 12.247 -10.049 165 H GLN 20 HN GLN 20 -0.492 10.310 -6.966 166 HA GLN 20 HA GLN 20 -1.194 8.586 -5.700 167 1HB GLN 20 HB2 GLN 20 -1.767 6.518 -6.877 168 2HB GLN 20 HB1 GLN 20 -2.290 7.954 -7.771 169 1HG GLN 20 HG2 GLN 20 -0.018 7.615 -9.027 170 2HG GLN 20 HG1 GLN 20 -0.121 5.980 -8.380 171 1HE2 GLN 20 1HE2 GLN 20 -3.033 5.903 -8.535 172 2HE2 GLN 20 2HE2 GLN 20 -3.426 5.738 -10.208 173 H CYS 21 HN CYS 21 1.905 8.825 -6.124 174 HA CYS 21 HA CYS 21 2.504 6.701 -4.291 175 1HB CYS 21 HB2 CYS 21 4.167 5.583 -5.681 176 2HB CYS 21 HB1 CYS 21 2.591 5.517 -6.463 177 HG CYS 21 HG CYS 21 4.770 7.981 -7.299 178 H SER 22 HN SER 22 3.670 7.814 -2.847 179 HA SER 22 HA SER 22 6.232 8.835 -3.737 180 1HB SER 22 HB2 SER 22 4.331 10.636 -2.206 181 2HB SER 22 HB1 SER 22 6.001 11.018 -2.623 182 HG SER 22 HG SER 22 4.754 10.322 -4.856 183 H ALA 23 HN ALA 23 7.663 7.988 -2.384 184 HA ALA 23 HA ALA 23 7.160 8.200 0.512 185 1HB ALA 23 HB1 ALA 23 6.911 5.814 -0.369 186 2HB ALA 23 HB3 ALA 23 8.652 5.857 -0.649 187 3HB ALA 23 HB2 ALA 23 8.011 6.070 0.980 188 H GLY 24 HN GLY 24 9.593 7.409 1.443 189 1HA GLY 24 HA1 GLY 24 11.283 9.564 0.487 190 2HA GLY 24 HA2 GLY 24 11.960 7.953 0.256 191 HA PRO 25 HA PRO 25 13.497 8.268 4.436 192 1HB PRO 25 HB2 PRO 25 14.926 10.573 4.693 193 2HB PRO 25 HB1 PRO 25 15.512 9.177 3.780 194 1HG PRO 25 HG2 PRO 25 14.139 11.649 2.778 195 2HG PRO 25 HG1 PRO 25 15.599 10.859 2.147 196 1HD PRO 25 HD2 PRO 25 13.212 10.479 0.992 197 2HD PRO 25 HD1 PRO 25 14.379 9.147 1.142 198 H VAL 26 HN VAL 26 11.875 8.471 5.952 199 HA VAL 26 HA VAL 26 10.632 11.130 6.239 200 HB VAL 26 HB VAL 26 9.763 8.438 7.287 201 1HG1 VAL 26 3HG1 VAL 26 9.249 10.243 8.908 202 2HG1 VAL 26 2HG1 VAL 26 8.394 11.108 7.631 203 3HG1 VAL 26 1HG1 VAL 26 7.801 9.544 8.187 204 1HG2 VAL 26 2HG2 VAL 26 9.400 8.844 4.901 205 2HG2 VAL 26 1HG2 VAL 26 7.876 8.781 5.792 206 3HG2 VAL 26 3HG2 VAL 26 8.540 10.335 5.291 207 H GLY 27 HN GLY 27 11.635 8.526 8.471 208 1HA GLY 27 HA1 GLY 27 12.606 8.761 10.582 209 2HA GLY 27 HA2 GLY 27 12.458 10.518 10.425 210 H ASP 28 HN ASP 28 13.546 9.887 7.610 211 HA ASP 28 HA ASP 28 15.492 9.939 6.457 212 1HB ASP 28 HB2 ASP 28 16.464 10.787 9.138 213 2HB ASP 28 HB1 ASP 28 17.668 10.225 7.983 214 H ASP 29 HN ASP 29 14.670 7.787 8.753 215 HA ASP 29 HA ASP 29 16.675 5.811 8.125 216 1HB ASP 29 HB2 ASP 29 14.935 4.323 9.396 217 2HB ASP 29 HB1 ASP 29 15.910 5.481 10.296 218 H MET 30 HN MET 30 16.392 4.114 6.749 219 HA MET 30 HA MET 30 14.319 4.390 4.763 220 1HB MET 30 HB2 MET 30 16.934 3.213 4.974 221 2HB MET 30 HB1 MET 30 15.799 2.044 4.340 222 1HG MET 30 HG2 MET 30 16.036 2.959 2.365 223 2HG MET 30 HG1 MET 30 15.336 4.427 2.953 224 1HE MET 30 HE2 MET 30 16.611 6.528 3.752 225 2HE MET 30 HE1 MET 30 17.395 5.593 5.026 226 3HE MET 30 HE3 MET 30 18.362 6.610 3.958 227 H PHE 31 HN PHE 31 13.915 3.403 7.665 228 HA PHE 31 HA PHE 31 12.381 1.019 6.926 229 1HB PHE 31 HB2 PHE 31 12.747 0.339 9.342 230 2HB PHE 31 HB1 PHE 31 14.027 0.022 8.212 231 HD1 PHE 31 HD1 PHE 31 12.986 1.803 11.183 232 HD2 PHE 31 HD2 PHE 31 16.104 1.388 8.308 233 HE1 PHE 31 HE1 PHE 31 14.541 2.940 12.712 234 HE2 PHE 31 HE2 PHE 31 17.661 2.527 9.837 235 HZ PHE 31 HZ PHE 31 16.881 3.302 12.039 236 H HIS 32 HN HIS 32 12.112 4.060 7.665 237 HA HIS 32 HA HIS 32 9.489 3.553 8.725 238 1HB HIS 32 HB2 HIS 32 10.442 3.888 10.811 239 2HB HIS 32 HB1 HIS 32 11.678 4.980 10.194 240 HD1 HIS 32 HD1 HIS 32 11.307 7.366 10.697 241 HD2 HIS 32 HD2 HIS 32 7.788 5.177 10.982 242 HE1 HIS 32 HE1 HIS 32 9.591 8.963 11.622 243 HE2 HIS 32 HE2 HIS 32 7.553 7.537 12.023 244 H TRP 33 HN TRP 33 8.721 4.199 6.808 245 HA TRP 33 HA TRP 33 9.194 6.925 5.975 246 1HB TRP 33 HB2 TRP 33 9.485 5.889 3.589 247 2HB TRP 33 HB1 TRP 33 10.835 6.083 4.662 248 HD1 TRP 33 HD1 TRP 33 11.254 3.554 6.162 249 HE1 TRP 33 HE1 TRP 33 11.480 1.269 5.049 250 HE3 TRP 33 HE3 TRP 33 9.023 4.615 1.722 251 HZ2 TRP 33 HZ2 TRP 33 10.847 0.072 2.603 252 HZ3 TRP 33 HZ3 TRP 33 8.909 2.855 0.029 253 HH2 TRP 33 HH2 TRP 33 9.816 0.634 0.472 254 H GLN 34 HN GLN 34 7.817 7.568 4.192 255 HA GLN 34 HA GLN 34 5.122 6.555 4.806 256 1HB GLN 34 HB2 GLN 34 5.938 8.703 5.997 257 2HB GLN 34 HB1 GLN 34 5.775 9.464 4.418 258 1HG GLN 34 HG2 GLN 34 3.810 9.847 5.787 259 2HG GLN 34 HG1 GLN 34 3.416 8.901 4.354 260 1HE2 GLN 34 1HE2 GLN 34 1.563 8.064 5.272 261 2HE2 GLN 34 2HE2 GLN 34 1.596 6.872 6.528 262 H ALA 35 HN ALA 35 4.143 5.924 3.062 263 HA ALA 35 HA ALA 35 4.773 7.218 0.504 264 1HB ALA 35 HB1 ALA 35 3.679 4.455 1.014 265 2HB ALA 35 HB2 ALA 35 5.357 4.839 0.647 266 3HB ALA 35 HB3 ALA 35 4.101 5.135 -0.552 267 H THR 36 HN THR 36 3.186 8.382 -0.424 268 HA THR 36 HA THR 36 0.472 8.146 0.636 269 HB THR 36 HB THR 36 0.106 10.235 -0.799 270 HG1 THR 36 HG1 THR 36 1.882 10.161 -2.136 271 1HG2 THR 36 2HG2 THR 36 2.112 10.333 1.462 272 2HG2 THR 36 1HG2 THR 36 1.176 11.703 0.862 273 3HG2 THR 36 3HG2 THR 36 0.355 10.343 1.626 274 H ILE 37 HN ILE 37 -0.447 6.405 -0.369 275 HA ILE 37 HA ILE 37 -0.388 6.234 -3.286 276 HB ILE 37 HB ILE 37 -0.978 4.335 -1.070 277 1HG1 ILE 37 2HG1 ILE 37 0.516 2.926 -2.334 278 2HG1 ILE 37 1HG1 ILE 37 0.528 4.071 -3.675 279 1HG2 ILE 37 3HG2 ILE 37 -1.980 3.988 -3.885 280 2HG2 ILE 37 2HG2 ILE 37 -1.922 2.719 -2.663 281 3HG2 ILE 37 1HG2 ILE 37 -2.958 4.125 -2.424 282 1HD1 ILE 37 1HD1 ILE 37 1.571 5.716 -2.160 283 2HD1 ILE 37 3HD1 ILE 37 1.645 4.473 -0.911 284 3HD1 ILE 37 2HD1 ILE 37 2.551 4.275 -2.414 285 H MET 38 HN MET 38 -2.292 6.314 -4.536 286 HA MET 38 HA MET 38 -4.403 7.720 -3.079 287 1HB MET 38 HB2 MET 38 -3.121 8.465 -5.690 288 2HB MET 38 HB1 MET 38 -4.477 9.297 -4.947 289 1HG MET 38 HG2 MET 38 -3.213 9.974 -3.124 290 2HG MET 38 HG1 MET 38 -1.884 8.894 -3.551 291 1HE MET 38 HE2 MET 38 -0.055 10.805 -3.360 292 2HE MET 38 HE1 MET 38 -0.207 12.391 -4.116 293 3HE MET 38 HE3 MET 38 -1.302 11.926 -2.816 294 H GLY 39 HN GLY 39 -6.431 7.429 -3.614 295 1HA GLY 39 HA1 GLY 39 -8.247 7.175 -4.910 296 2HA GLY 39 HA2 GLY 39 -7.463 5.710 -5.489 297 HA PRO 40 HA PRO 40 -7.532 10.106 -8.296 298 1HB PRO 40 HB2 PRO 40 -4.600 9.977 -7.674 299 2HB PRO 40 HB1 PRO 40 -5.554 11.353 -8.246 300 1HG PRO 40 HG2 PRO 40 -5.016 10.952 -5.621 301 2HG PRO 40 HG1 PRO 40 -6.503 11.723 -6.187 302 1HD PRO 40 HD2 PRO 40 -6.206 9.168 -4.855 303 2HD PRO 40 HD1 PRO 40 -7.691 10.007 -5.322 304 H ASN 41 HN ASN 41 -8.165 8.508 -9.725 305 HA ASN 41 HA ASN 41 -6.802 8.619 -12.063 306 1HB ASN 41 HB2 ASN 41 -5.189 6.979 -11.048 307 2HB ASN 41 HB1 ASN 41 -6.513 5.825 -10.926 308 1HD2 ASN 41 1HD2 ASN 41 -6.281 8.014 -13.617 309 2HD2 ASN 41 2HD2 ASN 41 -5.830 6.829 -14.796 310 H ASP 42 HN ASP 42 -8.155 5.534 -11.178 311 HA ASP 42 HA ASP 42 -10.868 6.475 -11.403 312 1HB ASP 42 HB2 ASP 42 -10.025 5.725 -13.764 313 2HB ASP 42 HB1 ASP 42 -10.165 4.096 -13.102 314 H SER 43 HN SER 43 -11.138 5.932 -9.350 315 HA SER 43 HA SER 43 -10.613 3.168 -8.557 316 1HB SER 43 HB2 SER 43 -8.687 4.314 -7.771 317 2HB SER 43 HB1 SER 43 -9.628 5.718 -7.291 318 HG SER 43 HG SER 43 -9.475 3.189 -6.047 319 HA PRO 44 HA PRO 44 -14.581 3.402 -6.431 320 1HB PRO 44 HB2 PRO 44 -12.988 1.800 -4.475 321 2HB PRO 44 HB1 PRO 44 -14.623 1.519 -5.084 322 1HG PRO 44 HG2 PRO 44 -12.584 0.093 -6.013 323 2HG PRO 44 HG1 PRO 44 -13.865 0.657 -7.103 324 1HD PRO 44 HD2 PRO 44 -11.078 1.665 -6.770 325 2HD PRO 44 HD1 PRO 44 -12.090 1.594 -8.227 326 H TYR 45 HN TYR 45 -11.439 3.790 -4.752 327 HA TYR 45 HA TYR 45 -12.698 5.823 -3.071 328 1HB TYR 45 HB2 TYR 45 -9.897 4.944 -2.577 329 2HB TYR 45 HB1 TYR 45 -11.175 5.337 -1.454 330 HD1 TYR 45 HD1 TYR 45 -13.312 3.398 -2.167 331 HD2 TYR 45 HD2 TYR 45 -9.095 2.949 -1.946 332 HE1 TYR 45 HE1 TYR 45 -13.595 1.002 -1.682 333 HE2 TYR 45 HE2 TYR 45 -9.354 0.558 -1.478 334 HH TYR 45 HH TYR 45 -11.357 -0.901 -0.396 335 H GLN 46 HN GLN 46 -12.151 6.422 -5.811 336 HA GLN 46 HA GLN 46 -9.828 7.817 -6.335 337 1HB GLN 46 HB2 GLN 46 -12.377 7.565 -7.494 338 2HB GLN 46 HB1 GLN 46 -12.095 9.291 -7.317 339 1HG GLN 46 HG2 GLN 46 -10.062 7.474 -8.591 340 2HG GLN 46 HG1 GLN 46 -11.372 8.204 -9.495 341 1HE2 GLN 46 1HE2 GLN 46 -9.950 9.239 -10.775 342 2HE2 GLN 46 2HE2 GLN 46 -9.082 10.630 -10.239 343 H GLY 47 HN GLY 47 -9.151 9.925 -5.995 344 1HA GLY 47 HA1 GLY 47 -10.609 11.591 -4.115 345 2HA GLY 47 HA2 GLY 47 -9.115 12.004 -4.936 346 H GLY 48 HN GLY 48 -8.955 8.928 -3.515 347 1HA GLY 48 HA1 GLY 48 -8.626 8.249 -1.291 348 2HA GLY 48 HA2 GLY 48 -8.467 9.928 -0.824 349 H VAL 49 HN VAL 49 -6.510 10.949 -0.914 350 HA VAL 49 HA VAL 49 -4.178 9.464 -1.667 351 HB VAL 49 HB VAL 49 -4.410 11.891 0.110 352 1HG1 VAL 49 1HG1 VAL 49 -2.044 10.738 -1.357 353 2HG1 VAL 49 3HG1 VAL 49 -2.050 12.277 -0.494 354 3HG1 VAL 49 2HG1 VAL 49 -2.283 10.767 0.390 355 1HG2 VAL 49 1HG2 VAL 49 -5.385 12.320 -2.071 356 2HG2 VAL 49 3HG2 VAL 49 -3.869 13.203 -1.884 357 3HG2 VAL 49 2HG2 VAL 49 -3.920 11.736 -2.857 358 H PHE 50 HN PHE 50 -4.077 7.579 -0.610 359 HA PHE 50 HA PHE 50 -4.519 7.480 2.232 360 1HB PHE 50 HB2 PHE 50 -3.888 5.422 0.139 361 2HB PHE 50 HB1 PHE 50 -3.946 5.034 1.855 362 HD1 PHE 50 HD1 PHE 50 -6.045 5.399 3.123 363 HD2 PHE 50 HD2 PHE 50 -5.828 5.714 -1.121 364 HE1 PHE 50 HE1 PHE 50 -8.503 5.213 2.982 365 HE2 PHE 50 HE2 PHE 50 -8.265 5.539 -1.257 366 HZ PHE 50 HZ PHE 50 -9.572 5.312 0.783 367 H PHE 51 HN PHE 51 -2.894 5.966 3.413 368 HA PHE 51 HA PHE 51 -0.279 7.274 3.141 369 1HB PHE 51 HB2 PHE 51 -1.556 6.840 5.818 370 2HB PHE 51 HB1 PHE 51 -0.345 8.026 5.352 371 HD1 PHE 51 HD1 PHE 51 -3.933 7.173 5.062 372 HD2 PHE 51 HD2 PHE 51 -0.969 10.219 4.727 373 HE1 PHE 51 HE1 PHE 51 -5.695 8.871 4.839 374 HE2 PHE 51 HE2 PHE 51 -2.727 11.923 4.503 375 HZ PHE 51 HZ PHE 51 -5.096 11.241 4.549 376 H LEU 52 HN LEU 52 1.300 5.757 3.157 377 HA LEU 52 HA LEU 52 0.782 3.253 4.623 378 1HB LEU 52 HB2 LEU 52 2.558 3.470 2.198 379 2HB LEU 52 HB1 LEU 52 1.953 2.020 2.966 380 HG LEU 52 HG LEU 52 0.307 3.987 1.375 381 1HD1 LEU 52 2HD1 LEU 52 1.828 2.616 0.017 382 2HD1 LEU 52 1HD1 LEU 52 1.137 1.164 0.743 383 3HD1 LEU 52 3HD1 LEU 52 0.131 2.214 -0.254 384 1HD2 LEU 52 3HD2 LEU 52 -0.925 2.940 3.210 385 2HD2 LEU 52 2HD2 LEU 52 -1.498 2.416 1.625 386 3HD2 LEU 52 1HD2 LEU 52 -0.471 1.352 2.589 387 H THR 53 HN THR 53 2.186 2.987 6.294 388 HA THR 53 HA THR 53 4.815 4.287 6.054 389 HB THR 53 HB THR 53 3.810 3.009 8.582 390 HG1 THR 53 HG1 THR 53 3.408 5.731 7.783 391 1HG2 THR 53 2HG2 THR 53 5.743 5.262 8.014 392 2HG2 THR 53 1HG2 THR 53 5.334 4.640 9.616 393 3HG2 THR 53 3HG2 THR 53 6.175 3.607 8.456 394 H ILE 54 HN ILE 54 6.606 3.057 5.855 395 HA ILE 54 HA ILE 54 6.175 0.145 5.859 396 HB ILE 54 HB ILE 54 8.299 1.366 4.175 397 1HG1 ILE 54 2HG1 ILE 54 5.337 1.526 3.632 398 2HG1 ILE 54 1HG1 ILE 54 6.537 2.812 3.551 399 1HG2 ILE 54 2HG2 ILE 54 6.451 -0.991 3.846 400 2HG2 ILE 54 1HG2 ILE 54 7.690 -0.511 2.687 401 3HG2 ILE 54 3HG2 ILE 54 8.152 -1.036 4.307 402 1HD1 ILE 54 2HD1 ILE 54 6.354 0.495 1.642 403 2HD1 ILE 54 1HD1 ILE 54 5.749 2.124 1.346 404 3HD1 ILE 54 3HD1 ILE 54 7.477 1.850 1.551 405 H HIS 55 HN HIS 55 7.668 -1.124 6.828 406 HA HIS 55 HA HIS 55 10.115 0.153 7.781 407 1HB HIS 55 HB2 HIS 55 9.976 -1.196 9.875 408 2HB HIS 55 HB1 HIS 55 8.829 0.128 9.729 409 HD1 HIS 55 HD1 HIS 55 6.657 -0.506 10.613 410 HD2 HIS 55 HD2 HIS 55 8.554 -3.663 8.733 411 HE1 HIS 55 HE1 HIS 55 5.060 -2.395 10.718 412 HE2 HIS 55 HE2 HIS 55 6.374 -4.393 9.936 413 H PHE 56 HN PHE 56 11.960 -1.153 8.001 414 HA PHE 56 HA PHE 56 11.695 -3.931 7.035 415 1HB PHE 56 HB2 PHE 56 13.485 -3.750 5.567 416 2HB PHE 56 HB1 PHE 56 12.685 -2.212 5.336 417 HD1 PHE 56 HD1 PHE 56 15.619 -3.901 6.787 418 HD2 PHE 56 HD2 PHE 56 13.738 -0.194 5.942 419 HE1 PHE 56 HE1 PHE 56 17.716 -2.729 7.303 420 HE2 PHE 56 HE2 PHE 56 15.810 0.996 6.450 421 HZ PHE 56 HZ PHE 56 17.818 -0.277 7.146 422 HA PRO 57 HA PRO 57 14.860 -4.516 10.212 423 1HB PRO 57 HB2 PRO 57 14.223 -7.060 10.831 424 2HB PRO 57 HB1 PRO 57 13.264 -5.695 11.408 425 1HG PRO 57 HG2 PRO 57 12.564 -7.735 9.429 426 2HG PRO 57 HG1 PRO 57 11.512 -6.582 10.263 427 1HD PRO 57 HD2 PRO 57 12.703 -6.400 7.589 428 2HD PRO 57 HD1 PRO 57 11.393 -5.435 8.302 429 H THR 58 HN THR 58 16.590 -4.445 8.728 430 HA THR 58 HA THR 58 18.046 -5.191 7.063 431 HB THR 58 HB THR 58 19.486 -7.048 8.182 432 HG1 THR 58 HG1 THR 58 17.798 -7.652 9.678 433 1HG2 THR 58 3HG2 THR 58 20.094 -4.685 8.068 434 2HG2 THR 58 2HG2 THR 58 19.077 -4.346 9.470 435 3HG2 THR 58 1HG2 THR 58 20.508 -5.364 9.644 436 H ASP 59 HN ASP 59 16.291 -6.040 5.607 437 HA ASP 59 HA ASP 59 15.840 -8.906 5.654 438 1HB ASP 59 HB2 ASP 59 14.870 -6.891 3.657 439 2HB ASP 59 HB1 ASP 59 14.245 -8.517 3.898 440 H TYR 60 HN TYR 60 17.102 -6.549 3.318 441 HA TYR 60 HA TYR 60 17.235 -7.960 1.030 442 1HB TYR 60 HB2 TYR 60 17.835 -5.607 1.240 443 2HB TYR 60 HB1 TYR 60 19.332 -6.035 2.057 444 HD1 TYR 60 HD1 TYR 60 17.523 -6.122 -1.148 445 HD2 TYR 60 HD2 TYR 60 21.271 -6.646 0.792 446 HE1 TYR 60 HE1 TYR 60 18.644 -6.144 -3.333 447 HE2 TYR 60 HE2 TYR 60 22.404 -6.675 -1.392 448 HH TYR 60 HH TYR 60 21.817 -7.190 -3.766 449 HA PRO 61 HA PRO 61 18.734 -8.680 -1.054 450 1HB PRO 61 HB2 PRO 61 18.194 -11.608 -1.053 451 2HB PRO 61 HB1 PRO 61 18.954 -10.596 -2.288 452 1HG PRO 61 HG2 PRO 61 20.440 -12.168 -0.759 453 2HG PRO 61 HG1 PRO 61 20.989 -10.532 -1.169 454 1HD PRO 61 HD2 PRO 61 19.807 -11.552 1.379 455 2HD PRO 61 HD1 PRO 61 21.129 -10.392 1.135 456 H PHE 62 HN PHE 62 16.896 -11.063 0.914 457 HA PHE 62 HA PHE 62 14.513 -10.496 -0.568 458 1HB PHE 62 HB2 PHE 62 15.030 -12.759 0.535 459 2HB PHE 62 HB1 PHE 62 14.607 -11.957 2.060 460 HD1 PHE 62 HD1 PHE 62 13.155 -14.344 0.988 461 HD2 PHE 62 HD2 PHE 62 12.496 -10.165 0.418 462 HE1 PHE 62 HE1 PHE 62 10.768 -14.779 0.561 463 HE2 PHE 62 HE2 PHE 62 10.109 -10.607 -0.006 464 HZ PHE 62 HZ PHE 62 9.247 -12.905 0.065 465 H LYS 63 HN LYS 63 13.910 -8.489 -0.272 466 HA LYS 63 HA LYS 63 13.494 -7.528 2.443 467 1HB LYS 63 HB2 LYS 63 14.749 -6.371 0.409 468 2HB LYS 63 HB1 LYS 63 13.138 -5.755 0.114 469 1HG LYS 63 HG2 LYS 63 13.901 -5.500 2.897 470 2HG LYS 63 HG1 LYS 63 15.034 -4.683 1.828 471 1HD LYS 63 HD2 LYS 63 13.463 -3.050 2.329 472 2HD LYS 63 HD1 LYS 63 12.941 -3.647 0.757 473 1HE LYS 63 HE2 LYS 63 11.074 -3.316 2.326 474 2HE LYS 63 HE1 LYS 63 11.225 -4.989 1.792 475 1HZ LYS 63 HZ3 LYS 63 12.527 -5.319 3.961 476 2HZ LYS 63 HZ2 LYS 63 11.882 -3.831 4.428 477 3HZ LYS 63 HZ1 LYS 63 10.848 -5.118 4.079 478 HA PRO 64 HA PRO 64 9.087 -8.139 1.387 479 1HB PRO 64 HB2 PRO 64 8.727 -8.720 4.192 480 2HB PRO 64 HB1 PRO 64 8.491 -9.798 2.817 481 1HG PRO 64 HG2 PRO 64 10.479 -10.108 4.674 482 2HG PRO 64 HG1 PRO 64 10.575 -10.706 3.010 483 1HD PRO 64 HD2 PRO 64 11.778 -8.249 4.214 484 2HD PRO 64 HD1 PRO 64 12.461 -9.376 3.021 485 HA PRO 65 HA PRO 65 8.891 -3.985 3.218 486 1HB PRO 65 HB2 PRO 65 6.991 -3.366 1.109 487 2HB PRO 65 HB1 PRO 65 8.600 -2.697 1.374 488 1HG PRO 65 HG2 PRO 65 8.002 -4.313 -0.723 489 2HG PRO 65 HG1 PRO 65 9.612 -4.242 0.017 490 1HD PRO 65 HD2 PRO 65 7.427 -6.254 0.427 491 2HD PRO 65 HD1 PRO 65 9.174 -6.517 0.227 492 H LYS 66 HN LYS 66 7.712 -4.733 5.076 493 HA LYS 66 HA LYS 66 4.891 -5.061 4.915 494 1HB LYS 66 HB2 LYS 66 6.400 -5.704 6.903 495 2HB LYS 66 HB1 LYS 66 6.306 -4.004 7.357 496 1HG LYS 66 HG2 LYS 66 4.384 -4.386 8.376 497 2HG LYS 66 HG1 LYS 66 3.666 -4.891 6.844 498 1HD LYS 66 HD2 LYS 66 5.229 -6.681 8.705 499 2HD LYS 66 HD1 LYS 66 3.468 -6.601 8.623 500 1HE LYS 66 HE2 LYS 66 3.522 -7.355 6.312 501 2HE LYS 66 HE1 LYS 66 5.284 -7.365 6.333 502 1HZ LYS 66 HZ1 LYS 66 5.178 -9.064 8.084 503 2HZ LYS 66 HZ3 LYS 66 3.491 -9.099 7.946 504 3HZ LYS 66 HZ2 LYS 66 4.456 -9.581 6.647 505 H VAL 67 HN VAL 67 4.233 -3.503 3.586 506 HA VAL 67 HA VAL 67 4.534 -0.707 4.352 507 HB VAL 67 HB VAL 67 5.173 -1.026 2.103 508 1HG1 VAL 67 1HG1 VAL 67 4.326 -3.281 1.800 509 2HG1 VAL 67 3HG1 VAL 67 2.675 -2.664 1.686 510 3HG1 VAL 67 2HG1 VAL 67 3.865 -2.252 0.448 511 1HG2 VAL 67 1HG2 VAL 67 2.302 -0.120 2.045 512 2HG2 VAL 67 3HG2 VAL 67 3.718 0.889 2.342 513 3HG2 VAL 67 2HG2 VAL 67 3.492 0.132 0.765 514 H ALA 68 HN ALA 68 2.965 0.151 5.502 515 HA ALA 68 HA ALA 68 0.426 -1.332 5.604 516 1HB ALA 68 HB1 ALA 68 1.867 -1.842 7.499 517 2HB ALA 68 HB2 ALA 68 0.402 -1.001 8.010 518 3HB ALA 68 HB3 ALA 68 1.935 -0.131 7.912 519 H PHE 69 HN PHE 69 -1.384 -0.240 5.434 520 HA PHE 69 HA PHE 69 -1.572 2.496 5.025 521 1HB PHE 69 HB2 PHE 69 -3.560 0.381 5.655 522 2HB PHE 69 HB1 PHE 69 -4.058 2.062 5.712 523 HD1 PHE 69 HD1 PHE 69 -4.630 3.207 3.734 524 HD2 PHE 69 HD2 PHE 69 -2.605 -0.535 3.503 525 HE1 PHE 69 HE1 PHE 69 -4.947 3.171 1.290 526 HE2 PHE 69 HE2 PHE 69 -2.931 -0.554 1.057 527 HZ PHE 69 HZ PHE 69 -4.320 1.234 -0.002 528 H THR 70 HN THR 70 -1.287 4.105 6.346 529 HA THR 70 HA THR 70 -1.196 3.942 9.173 530 HB THR 70 HB THR 70 -1.802 6.451 7.607 531 HG1 THR 70 HG1 THR 70 0.743 5.171 7.966 532 1HG2 THR 70 1HG2 THR 70 -1.792 6.559 10.075 533 2HG2 THR 70 3HG2 THR 70 -0.126 5.984 10.074 534 3HG2 THR 70 2HG2 THR 70 -0.522 7.542 9.348 535 H THR 71 HN THR 71 -3.648 4.771 6.842 536 HA THR 71 HA THR 71 -5.540 5.571 8.896 537 HB THR 71 HB THR 71 -5.195 6.841 6.693 538 HG1 THR 71 HG1 THR 71 -7.290 7.494 6.796 539 1HG2 THR 71 3HG2 THR 71 -6.811 4.517 5.644 540 2HG2 THR 71 2HG2 THR 71 -6.566 6.044 4.795 541 3HG2 THR 71 1HG2 THR 71 -5.188 4.994 5.136 542 H ARG 72 HN ARG 72 -7.887 4.837 8.028 543 HA ARG 72 HA ARG 72 -7.853 1.945 8.201 544 1HB ARG 72 HB2 ARG 72 -10.398 2.278 8.440 545 2HB ARG 72 HB1 ARG 72 -9.366 2.758 9.775 546 1HG ARG 72 HG2 ARG 72 -9.817 4.943 7.928 547 2HG ARG 72 HG1 ARG 72 -11.318 4.274 8.559 548 1HD ARG 72 HD2 ARG 72 -10.345 6.137 9.921 549 2HD ARG 72 HD1 ARG 72 -10.656 4.642 10.800 550 HE ARG 72 HE ARG 72 -7.983 4.722 9.862 551 1HH1 ARG 72 1HH1 ARG 72 -10.085 6.029 12.327 552 2HH1 ARG 72 2HH1 ARG 72 -8.809 6.263 13.475 553 1HH2 ARG 72 1HH2 ARG 72 -6.279 5.052 11.374 554 2HH2 ARG 72 2HH2 ARG 72 -6.637 5.726 12.931 555 H ILE 73 HN ILE 73 -8.868 0.623 6.662 556 HA ILE 73 HA ILE 73 -9.841 1.741 4.192 557 HB ILE 73 HB ILE 73 -7.718 2.155 3.517 558 1HG1 ILE 73 2HG1 ILE 73 -6.733 0.072 2.284 559 2HG1 ILE 73 1HG1 ILE 73 -8.233 -0.715 2.761 560 1HG2 ILE 73 2HG2 ILE 73 -6.865 -0.145 5.247 561 2HG2 ILE 73 1HG2 ILE 73 -5.754 0.675 4.144 562 3HG2 ILE 73 3HG2 ILE 73 -6.527 1.573 5.451 563 1HD1 ILE 73 2HD1 ILE 73 -8.450 1.919 1.426 564 2HD1 ILE 73 1HD1 ILE 73 -7.916 0.553 0.433 565 3HD1 ILE 73 3HD1 ILE 73 -9.469 0.486 1.286 566 H TYR 74 HN TYR 74 -11.308 0.394 3.487 567 HA TYR 74 HA TYR 74 -11.294 -2.398 4.291 568 1HB TYR 74 HB2 TYR 74 -13.319 -0.503 3.233 569 2HB TYR 74 HB1 TYR 74 -13.522 -2.193 2.795 570 HD1 TYR 74 HD1 TYR 74 -14.191 0.275 5.261 571 HD2 TYR 74 HD2 TYR 74 -13.458 -3.877 4.758 572 HE1 TYR 74 HE1 TYR 74 -15.309 -0.195 7.409 573 HE2 TYR 74 HE2 TYR 74 -14.543 -4.356 6.897 574 HH TYR 74 HH TYR 74 -15.106 -3.211 8.984 575 H HIS 75 HN HIS 75 -10.423 -3.883 3.080 576 HA HIS 75 HA HIS 75 -10.953 -4.349 0.387 577 1HB HIS 75 HB2 HIS 75 -9.247 -2.290 0.375 578 2HB HIS 75 HB1 HIS 75 -8.066 -3.583 0.567 579 HD1 HIS 75 HD1 HIS 75 -7.405 -4.838 -1.516 580 HD2 HIS 75 HD2 HIS 75 -10.847 -2.568 -2.044 581 HE1 HIS 75 HE1 HIS 75 -7.956 -5.006 -3.958 582 HE2 HIS 75 HE2 HIS 75 -9.982 -3.540 -4.272 583 HA PRO 76 HA PRO 76 -9.964 -8.290 1.889 584 1HB PRO 76 HB2 PRO 76 -8.918 -9.503 -0.372 585 2HB PRO 76 HB1 PRO 76 -10.638 -9.321 -0.027 586 1HG PRO 76 HG2 PRO 76 -8.865 -7.644 -1.747 587 2HG PRO 76 HG1 PRO 76 -10.535 -8.171 -2.036 588 1HD PRO 76 HD2 PRO 76 -10.011 -5.692 -1.228 589 2HD PRO 76 HD1 PRO 76 -11.415 -6.574 -0.593 590 H ASN 77 HN ASN 77 -7.416 -6.491 0.410 591 HA ASN 77 HA ASN 77 -5.413 -8.475 1.167 592 1HB ASN 77 HB2 ASN 77 -4.585 -6.020 -0.288 593 2HB ASN 77 HB1 ASN 77 -4.027 -7.674 -0.479 594 1HD2 ASN 77 1HD2 ASN 77 -4.350 -8.243 -2.529 595 2HD2 ASN 77 2HD2 ASN 77 -5.778 -7.922 -3.450 596 H ILE 78 HN ILE 78 -6.748 -5.590 2.291 597 HA ILE 78 HA ILE 78 -4.375 -4.926 3.821 598 HB ILE 78 HB ILE 78 -6.859 -3.276 3.279 599 1HG1 ILE 78 2HG1 ILE 78 -5.073 -1.678 2.488 600 2HG1 ILE 78 1HG1 ILE 78 -3.981 -3.013 2.609 601 1HG2 ILE 78 1HG2 ILE 78 -6.075 -3.041 5.610 602 2HG2 ILE 78 3HG2 ILE 78 -4.466 -2.644 4.996 603 3HG2 ILE 78 2HG2 ILE 78 -5.822 -1.572 4.669 604 1HD1 ILE 78 1HD1 ILE 78 -5.440 -4.243 0.974 605 2HD1 ILE 78 3HD1 ILE 78 -6.276 -2.709 0.721 606 3HD1 ILE 78 2HD1 ILE 78 -4.561 -2.856 0.334 607 H ASN 79 HN ASN 79 -4.378 -5.933 5.659 608 HA ASN 79 HA ASN 79 -6.918 -6.244 7.029 609 1HB ASN 79 HB2 ASN 79 -5.510 -7.567 8.737 610 2HB ASN 79 HB1 ASN 79 -5.905 -8.270 7.167 611 1HD2 ASN 79 1HD2 ASN 79 -3.324 -5.934 7.525 612 2HD2 ASN 79 2HD2 ASN 79 -2.089 -7.095 7.241 613 H SER 80 HN SER 80 -6.657 -5.900 9.594 614 HA SER 80 HA SER 80 -7.137 -3.146 9.520 615 1HB SER 80 HB2 SER 80 -7.397 -3.608 12.108 616 2HB SER 80 HB1 SER 80 -8.550 -4.241 10.933 617 HG SER 80 HG SER 80 -6.872 -5.580 12.590 618 H ASN 81 HN ASN 81 -4.125 -4.142 9.511 619 HA ASN 81 HA ASN 81 -3.241 -1.887 11.189 620 1HB ASN 81 HB2 ASN 81 -1.060 -3.042 11.361 621 2HB ASN 81 HB1 ASN 81 -2.365 -4.023 12.025 622 1HD2 ASN 81 1HD2 ASN 81 0.161 -4.979 11.122 623 2HD2 ASN 81 2HD2 ASN 81 -0.144 -6.040 9.790 624 H GLY 82 HN GLY 82 -4.069 -2.423 8.215 625 1HA GLY 82 HA1 GLY 82 -2.292 -0.550 7.033 626 2HA GLY 82 HA2 GLY 82 -3.647 -1.364 6.259 627 H SER 83 HN SER 83 -2.015 -3.857 7.444 628 HA SER 83 HA SER 83 0.222 -3.904 5.620 629 1HB SER 83 HB2 SER 83 0.465 -4.920 7.816 630 2HB SER 83 HB1 SER 83 -0.894 -5.983 7.483 631 HG SER 83 HG SER 83 0.472 -7.304 6.573 632 H ILE 84 HN ILE 84 0.280 -4.791 3.703 633 HA ILE 84 HA ILE 84 -2.254 -5.730 2.633 634 HB ILE 84 HB ILE 84 0.093 -4.448 1.275 635 1HG1 ILE 84 2HG1 ILE 84 -2.685 -3.434 1.760 636 2HG1 ILE 84 1HG1 ILE 84 -1.327 -3.097 2.834 637 1HG2 ILE 84 1HG2 ILE 84 -1.038 -5.975 -0.269 638 2HG2 ILE 84 3HG2 ILE 84 -2.581 -5.208 0.107 639 3HG2 ILE 84 2HG2 ILE 84 -1.316 -4.291 -0.710 640 1HD1 ILE 84 2HD1 ILE 84 -0.162 -2.195 0.748 641 2HD1 ILE 84 1HD1 ILE 84 -1.773 -2.161 0.035 642 3HD1 ILE 84 3HD1 ILE 84 -1.427 -1.220 1.490 643 H CYS 85 HN CYS 85 -2.546 -7.529 1.537 644 HA CYS 85 HA CYS 85 -0.323 -9.339 1.090 645 1HB CYS 85 HB2 CYS 85 -2.575 -10.131 1.918 646 2HB CYS 85 HB1 CYS 85 -3.250 -9.669 0.366 647 HG CYS 85 HG CYS 85 -3.074 -12.324 0.059 648 H LEU 86 HN LEU 86 0.881 -8.364 -0.455 649 HA LEU 86 HA LEU 86 -0.376 -7.933 -3.104 650 1HB LEU 86 HB2 LEU 86 0.357 -5.833 -2.106 651 2HB LEU 86 HB1 LEU 86 1.956 -6.497 -1.836 652 HG LEU 86 HG LEU 86 2.348 -6.584 -4.251 653 1HD1 LEU 86 1HD1 LEU 86 -0.355 -5.285 -4.484 654 2HD1 LEU 86 3HD1 LEU 86 0.800 -5.513 -5.794 655 3HD1 LEU 86 2HD1 LEU 86 0.061 -6.912 -5.017 656 1HD2 LEU 86 3HD2 LEU 86 2.950 -4.586 -2.963 657 2HD2 LEU 86 2HD2 LEU 86 2.524 -4.202 -4.630 658 3HD2 LEU 86 1HD2 LEU 86 1.373 -3.890 -3.330 659 H ASP 87 HN ASP 87 0.246 -9.380 -4.569 660 HA ASP 87 HA ASP 87 1.902 -11.511 -4.155 661 1HB ASP 87 HB2 ASP 87 1.600 -10.243 -6.878 662 2HB ASP 87 HB1 ASP 87 1.809 -11.948 -6.488 663 H ILE 88 HN ILE 88 2.917 -8.654 -6.049 664 HA ILE 88 HA ILE 88 5.578 -9.405 -6.337 665 HB ILE 88 HB ILE 88 5.835 -6.703 -6.260 666 1HG1 ILE 88 2HG1 ILE 88 3.081 -7.203 -5.989 667 2HG1 ILE 88 1HG1 ILE 88 3.876 -5.663 -6.278 668 1HG2 ILE 88 1HG2 ILE 88 4.876 -8.402 -8.543 669 2HG2 ILE 88 3HG2 ILE 88 5.598 -6.797 -8.677 670 3HG2 ILE 88 2HG2 ILE 88 6.552 -8.141 -8.052 671 1HD1 ILE 88 2HD1 ILE 88 3.058 -7.589 -8.425 672 2HD1 ILE 88 1HD1 ILE 88 2.141 -6.147 -7.935 673 3HD1 ILE 88 3HD1 ILE 88 3.752 -5.974 -8.639 674 H LEU 89 HN LEU 89 4.217 -8.784 -3.382 675 HA LEU 89 HA LEU 89 6.885 -8.126 -2.313 676 1HB LEU 89 HB2 LEU 89 4.196 -7.428 -1.152 677 2HB LEU 89 HB1 LEU 89 5.755 -7.034 -0.455 678 HG LEU 89 HG LEU 89 4.579 -5.975 -3.009 679 1HD1 LEU 89 1HD1 LEU 89 3.789 -4.908 -0.954 680 2HD1 LEU 89 3HD1 LEU 89 5.459 -4.555 -0.509 681 3HD1 LEU 89 2HD1 LEU 89 4.752 -3.810 -1.948 682 1HD2 LEU 89 1HD2 LEU 89 7.368 -5.699 -1.949 683 2HD2 LEU 89 3HD2 LEU 89 6.851 -6.297 -3.527 684 3HD2 LEU 89 2HD2 LEU 89 6.665 -4.590 -3.124 685 H ARG 90 HN ARG 90 4.457 -10.379 -2.498 686 HA ARG 90 HA ARG 90 5.443 -11.789 -0.093 687 1HB ARG 90 HB2 ARG 90 3.198 -13.000 -0.190 688 2HB ARG 90 HB1 ARG 90 3.169 -11.313 0.320 689 1HG ARG 90 HG2 ARG 90 2.392 -10.602 -1.805 690 2HG ARG 90 HG1 ARG 90 2.670 -12.194 -2.504 691 1HD ARG 90 HD2 ARG 90 0.761 -11.814 -0.230 692 2HD ARG 90 HD1 ARG 90 0.269 -11.499 -1.896 693 HE ARG 90 HE ARG 90 1.458 -14.100 -1.212 694 1HH1 ARG 90 1HH1 ARG 90 -1.333 -12.246 -2.221 695 2HH1 ARG 90 2HH1 ARG 90 -2.230 -13.639 -2.732 696 1HH2 ARG 90 1HH2 ARG 90 0.307 -15.922 -1.929 697 2HH2 ARG 90 2HH2 ARG 90 -1.281 -15.727 -2.594 698 H SER 91 HN SER 91 4.624 -12.077 -3.484 699 HA SER 91 HA SER 91 5.529 -14.866 -3.455 700 1HB SER 91 HB2 SER 91 3.399 -13.775 -5.284 701 2HB SER 91 HB1 SER 91 3.829 -15.464 -5.012 702 HG SER 91 HG SER 91 2.873 -15.415 -3.054 703 H GLN 92 HN GLN 92 5.371 -11.835 -5.227 704 HA GLN 92 HA GLN 92 7.084 -12.994 -7.319 705 1HB GLN 92 HB2 GLN 92 5.222 -10.593 -7.541 706 2HB GLN 92 HB1 GLN 92 6.244 -11.238 -8.822 707 1HG GLN 92 HG2 GLN 92 5.000 -13.369 -8.689 708 2HG GLN 92 HG1 GLN 92 3.932 -12.630 -7.500 709 1HE2 GLN 92 1HE2 GLN 92 4.040 -10.024 -8.859 710 2HE2 GLN 92 2HE2 GLN 92 3.040 -10.175 -10.256 711 H TRP 93 HN TRP 93 7.735 -11.559 -4.642 712 HA TRP 93 HA TRP 93 8.986 -9.159 -5.533 713 1HB TRP 93 HB2 TRP 93 8.269 -9.032 -3.302 714 2HB TRP 93 HB1 TRP 93 9.079 -10.523 -2.868 715 HD1 TRP 93 HD1 TRP 93 11.685 -10.387 -2.262 716 HE1 TRP 93 HE1 TRP 93 13.289 -8.407 -1.828 717 HE3 TRP 93 HE3 TRP 93 8.752 -6.601 -3.978 718 HZ2 TRP 93 HZ2 TRP 93 13.282 -5.621 -2.157 719 HZ3 TRP 93 HZ3 TRP 93 9.616 -4.306 -3.885 720 HH2 TRP 93 HH2 TRP 93 11.831 -3.824 -2.991 721 H SER 94 HN SER 94 10.969 -8.687 -6.001 722 HA SER 94 HA SER 94 13.158 -10.442 -5.388 723 1HB SER 94 HB2 SER 94 14.001 -10.247 -7.774 724 2HB SER 94 HB1 SER 94 12.589 -11.277 -7.574 725 HG SER 94 HG SER 94 11.304 -9.697 -8.427 726 HA PRO 95 HA PRO 95 15.125 -6.529 -4.688 727 1HB PRO 95 HB2 PRO 95 17.525 -7.325 -6.209 728 2HB PRO 95 HB1 PRO 95 17.358 -6.947 -4.493 729 1HG PRO 95 HG2 PRO 95 17.761 -9.457 -5.323 730 2HG PRO 95 HG1 PRO 95 16.701 -9.100 -3.945 731 1HD PRO 95 HD2 PRO 95 15.967 -9.729 -6.783 732 2HD PRO 95 HD1 PRO 95 15.235 -10.321 -5.276 733 H ALA 96 HN ALA 96 13.783 -7.042 -7.410 734 HA ALA 96 HA ALA 96 15.038 -4.811 -8.860 735 1HB ALA 96 HB3 ALA 96 15.163 -6.963 -10.029 736 2HB ALA 96 HB2 ALA 96 13.402 -7.075 -9.989 737 3HB ALA 96 HB1 ALA 96 14.185 -5.788 -10.910 738 H LEU 97 HN LEU 97 12.453 -5.453 -6.929 739 HA LEU 97 HA LEU 97 10.598 -3.794 -8.491 740 1HB LEU 97 HB2 LEU 97 10.109 -5.380 -5.997 741 2HB LEU 97 HB1 LEU 97 8.903 -4.510 -6.927 742 HG LEU 97 HG LEU 97 10.539 -6.662 -8.187 743 1HD1 LEU 97 1HD1 LEU 97 9.590 -7.488 -6.127 744 2HD1 LEU 97 3HD1 LEU 97 7.986 -7.006 -6.677 745 3HD1 LEU 97 2HD1 LEU 97 8.879 -8.257 -7.552 746 1HD2 LEU 97 3HD2 LEU 97 9.032 -5.057 -9.498 747 2HD2 LEU 97 2HD2 LEU 97 8.808 -6.782 -9.774 748 3HD2 LEU 97 1HD2 LEU 97 7.684 -5.902 -8.739 749 H THR 98 HN THR 98 11.069 -1.670 -8.100 750 HA THR 98 HA THR 98 11.948 -0.701 -5.586 751 HB THR 98 HB THR 98 11.261 1.551 -6.544 752 HG1 THR 98 HG1 THR 98 10.892 1.271 -8.964 753 1HG2 THR 98 3HG2 THR 98 13.532 0.659 -6.814 754 2HG2 THR 98 2HG2 THR 98 13.024 -0.183 -8.278 755 3HG2 THR 98 1HG2 THR 98 13.025 1.581 -8.235 756 H ILE 99 HN ILE 99 10.653 0.784 -4.201 757 HA ILE 99 HA ILE 99 7.926 -0.050 -3.819 758 HB ILE 99 HB ILE 99 8.690 2.563 -2.656 759 1HG1 ILE 99 2HG1 ILE 99 10.801 1.206 -2.554 760 2HG1 ILE 99 1HG1 ILE 99 10.144 1.590 -0.976 761 1HG2 ILE 99 3HG2 ILE 99 7.469 0.042 -1.563 762 2HG2 ILE 99 2HG2 ILE 99 7.646 1.556 -0.679 763 3HG2 ILE 99 1HG2 ILE 99 6.608 1.480 -2.100 764 1HD1 ILE 99 2HD1 ILE 99 9.152 -0.680 -0.882 765 2HD1 ILE 99 1HD1 ILE 99 9.932 -1.043 -2.420 766 3HD1 ILE 99 3HD1 ILE 99 10.910 -0.691 -0.997 767 H SER 100 HN SER 100 9.673 2.511 -5.335 768 HA SER 100 HA SER 100 7.752 4.019 -6.509 769 1HB SER 100 HB2 SER 100 10.247 4.151 -6.812 770 2HB SER 100 HB1 SER 100 10.130 2.783 -7.920 771 HG SER 100 HG SER 100 10.069 5.121 -8.726 772 H LYS 101 HN LYS 101 8.592 0.654 -7.297 773 HA LYS 101 HA LYS 101 6.572 0.305 -9.236 774 1HB LYS 101 HB2 LYS 101 8.767 -0.936 -8.893 775 2HB LYS 101 HB1 LYS 101 8.012 -1.738 -7.539 776 1HG LYS 101 HG2 LYS 101 7.014 -1.875 -10.339 777 2HG LYS 101 HG1 LYS 101 8.129 -3.036 -9.634 778 1HD LYS 101 HD2 LYS 101 5.294 -2.474 -8.802 779 2HD LYS 101 HD1 LYS 101 5.913 -3.959 -9.517 780 1HE LYS 101 HE2 LYS 101 7.072 -4.548 -7.547 781 2HE LYS 101 HE1 LYS 101 6.843 -2.941 -6.850 782 1HZ LYS 101 HZ3 LYS 101 4.410 -3.389 -6.975 783 2HZ LYS 101 HZ2 LYS 101 4.788 -4.985 -7.369 784 3HZ LYS 101 HZ1 LYS 101 5.258 -4.361 -5.870 785 H VAL 102 HN VAL 102 6.879 -0.698 -5.784 786 HA VAL 102 HA VAL 102 4.464 -2.218 -5.856 787 HB VAL 102 HB VAL 102 4.905 -2.916 -3.777 788 1HG1 VAL 102 1HG1 VAL 102 7.495 -1.797 -4.694 789 2HG1 VAL 102 3HG1 VAL 102 7.356 -2.796 -3.249 790 3HG1 VAL 102 2HG1 VAL 102 6.885 -3.448 -4.824 791 1HG2 VAL 102 2HG2 VAL 102 5.888 -0.181 -3.052 792 2HG2 VAL 102 1HG2 VAL 102 4.396 -0.961 -2.535 793 3HG2 VAL 102 3HG2 VAL 102 5.951 -1.564 -1.959 794 H LEU 103 HN LEU 103 5.165 1.089 -5.093 795 HA LEU 103 HA LEU 103 2.909 1.597 -3.483 796 1HB LEU 103 HB2 LEU 103 4.650 3.408 -5.138 797 2HB LEU 103 HB1 LEU 103 3.332 4.006 -4.153 798 HG LEU 103 HG LEU 103 5.982 2.845 -3.284 799 1HD1 LEU 103 3HD1 LEU 103 4.337 5.251 -2.521 800 2HD1 LEU 103 2HD1 LEU 103 5.872 4.797 -1.788 801 3HD1 LEU 103 1HD1 LEU 103 5.803 5.222 -3.495 802 1HD2 LEU 103 2HD2 LEU 103 3.493 2.983 -1.551 803 2HD2 LEU 103 1HD2 LEU 103 4.300 1.511 -2.083 804 3HD2 LEU 103 3HD2 LEU 103 5.125 2.628 -0.999 805 H LEU 104 HN LEU 104 3.474 1.753 -6.948 806 HA LEU 104 HA LEU 104 0.869 2.693 -7.556 807 1HB LEU 104 HB2 LEU 104 3.058 1.413 -9.140 808 2HB LEU 104 HB1 LEU 104 1.475 1.692 -9.855 809 HG LEU 104 HG LEU 104 1.770 4.123 -9.102 810 1HD1 LEU 104 2HD1 LEU 104 3.663 3.709 -7.615 811 2HD1 LEU 104 1HD1 LEU 104 4.645 3.271 -9.011 812 3HD1 LEU 104 3HD1 LEU 104 4.021 4.915 -8.852 813 1HD2 LEU 104 2HD2 LEU 104 3.499 2.934 -11.249 814 2HD2 LEU 104 1HD2 LEU 104 1.830 3.473 -11.418 815 3HD2 LEU 104 3HD2 LEU 104 3.110 4.649 -11.108 816 H SER 105 HN SER 105 2.298 -0.507 -7.188 817 HA SER 105 HA SER 105 0.064 -1.962 -8.124 818 1HB SER 105 HB2 SER 105 1.987 -2.893 -6.008 819 2HB SER 105 HB1 SER 105 1.073 -3.870 -7.149 820 HG SER 105 HG SER 105 2.325 -2.759 -8.823 821 H ILE 106 HN ILE 106 0.987 -0.771 -4.908 822 HA ILE 106 HA ILE 106 -1.254 -1.887 -3.577 823 HB ILE 106 HB ILE 106 0.633 0.331 -2.847 824 1HG1 ILE 106 2HG1 ILE 106 0.163 -2.435 -1.689 825 2HG1 ILE 106 1HG1 ILE 106 1.490 -1.971 -2.752 826 1HG2 ILE 106 3HG2 ILE 106 -1.747 -0.666 -1.298 827 2HG2 ILE 106 2HG2 ILE 106 -0.443 0.285 -0.589 828 3HG2 ILE 106 1HG2 ILE 106 -1.449 0.974 -1.866 829 1HD1 ILE 106 3HD1 ILE 106 0.986 -0.785 -0.035 830 2HD1 ILE 106 2HD1 ILE 106 2.126 -2.084 -0.382 831 3HD1 ILE 106 1HD1 ILE 106 2.373 -0.485 -1.085 832 H CYS 107 HN CYS 107 -0.536 1.249 -4.997 833 HA CYS 107 HA CYS 107 -2.960 2.530 -4.622 834 1HB CYS 107 HB2 CYS 107 -1.062 3.617 -5.681 835 2HB CYS 107 HB1 CYS 107 -1.161 2.506 -7.043 836 HG CYS 107 HG CYS 107 -3.746 4.613 -6.285 837 H SER 108 HN SER 108 -2.066 -0.099 -6.733 838 HA SER 108 HA SER 108 -4.385 0.006 -8.363 839 1HB SER 108 HB2 SER 108 -2.480 -2.287 -7.928 840 2HB SER 108 HB1 SER 108 -3.695 -2.176 -9.198 841 HG SER 108 HG SER 108 -1.697 -0.194 -8.895 842 H LEU 109 HN LEU 109 -3.867 -1.198 -5.154 843 HA LEU 109 HA LEU 109 -6.094 -3.003 -5.413 844 1HB LEU 109 HB2 LEU 109 -4.604 -2.022 -2.970 845 2HB LEU 109 HB1 LEU 109 -6.012 -3.056 -2.849 846 HG LEU 109 HG LEU 109 -4.433 -4.674 -2.746 847 1HD1 LEU 109 2HD1 LEU 109 -5.687 -5.139 -4.784 848 2HD1 LEU 109 1HD1 LEU 109 -4.484 -4.258 -5.727 849 3HD1 LEU 109 3HD1 LEU 109 -4.032 -5.740 -4.885 850 1HD2 LEU 109 3HD2 LEU 109 -2.563 -3.128 -2.738 851 2HD2 LEU 109 2HD2 LEU 109 -2.209 -4.552 -3.716 852 3HD2 LEU 109 1HD2 LEU 109 -2.628 -3.029 -4.498 853 H LEU 110 HN LEU 110 -5.626 0.323 -4.553 854 HA LEU 110 HA LEU 110 -8.380 0.685 -3.851 855 1HB LEU 110 HB2 LEU 110 -6.367 2.832 -4.515 856 2HB LEU 110 HB1 LEU 110 -7.755 2.905 -3.475 857 HG LEU 110 HG LEU 110 -5.384 1.230 -2.809 858 1HD1 LEU 110 3HD1 LEU 110 -4.747 3.593 -2.950 859 2HD1 LEU 110 2HD1 LEU 110 -6.040 3.976 -1.817 860 3HD1 LEU 110 1HD1 LEU 110 -4.685 2.977 -1.299 861 1HD2 LEU 110 2HD2 LEU 110 -7.431 0.551 -1.749 862 2HD2 LEU 110 1HD2 LEU 110 -6.269 1.203 -0.595 863 3HD2 LEU 110 3HD2 LEU 110 -7.636 2.187 -1.113 864 H CYS 111 HN CYS 111 -6.249 0.976 -6.569 865 HA CYS 111 HA CYS 111 -8.113 2.496 -8.154 866 1HB CYS 111 HB2 CYS 111 -5.598 2.841 -8.109 867 2HB CYS 111 HB1 CYS 111 -5.463 1.331 -9.006 868 HG CYS 111 HG CYS 111 -7.284 2.485 -11.042 869 H ASP 112 HN ASP 112 -6.581 -0.722 -8.268 870 HA ASP 112 HA ASP 112 -8.054 -1.368 -10.710 871 1HB ASP 112 HB2 ASP 112 -5.561 -1.634 -10.548 872 2HB ASP 112 HB1 ASP 112 -5.837 -2.950 -9.419 873 HA PRO 113 HA PRO 113 -9.144 -3.660 -6.118 874 1HB PRO 113 HB2 PRO 113 -11.626 -3.319 -7.786 875 2HB PRO 113 HB1 PRO 113 -11.500 -3.546 -6.032 876 1HG PRO 113 HG2 PRO 113 -11.535 -1.077 -7.262 877 2HG PRO 113 HG1 PRO 113 -10.818 -1.390 -5.671 878 1HD PRO 113 HD2 PRO 113 -9.437 -0.556 -8.005 879 2HD PRO 113 HD1 PRO 113 -8.705 -1.142 -6.494 880 H ASN 114 HN ASN 114 -8.033 -5.470 -6.453 881 HA ASN 114 HA ASN 114 -8.807 -7.436 -8.404 882 1HB ASN 114 HB2 ASN 114 -6.982 -8.688 -7.608 883 2HB ASN 114 HB1 ASN 114 -6.468 -7.022 -7.339 884 1HD2 ASN 114 1HD2 ASN 114 -7.296 -10.017 -5.874 885 2HD2 ASN 114 2HD2 ASN 114 -7.021 -9.551 -4.230 886 HA PRO 115 HA PRO 115 -11.643 -9.374 -5.486 887 1HB PRO 115 HB2 PRO 115 -13.007 -10.801 -7.267 888 2HB PRO 115 HB1 PRO 115 -13.088 -9.035 -7.282 889 1HG PRO 115 HG2 PRO 115 -11.688 -10.872 -9.143 890 2HG PRO 115 HG1 PRO 115 -12.330 -9.250 -9.438 891 1HD PRO 115 HD2 PRO 115 -9.620 -10.005 -8.813 892 2HD PRO 115 HD1 PRO 115 -10.265 -8.380 -9.131 893 H ASP 116 HN ASP 116 -9.040 -10.518 -5.353 894 HA ASP 116 HA ASP 116 -9.582 -13.371 -5.868 895 1HB ASP 116 HB2 ASP 116 -7.948 -12.594 -7.468 896 2HB ASP 116 HB1 ASP 116 -6.964 -11.904 -6.181 897 H ASP 117 HN ASP 117 -7.090 -11.569 -4.064 898 HA ASP 117 HA ASP 117 -6.833 -13.932 -2.408 899 1HB ASP 117 HB2 ASP 117 -4.922 -12.599 -3.526 900 2HB ASP 117 HB1 ASP 117 -5.101 -11.499 -2.157 901 HA PRO 118 HA PRO 118 -8.865 -11.880 1.004 902 1HB PRO 118 HB2 PRO 118 -9.531 -14.122 2.306 903 2HB PRO 118 HB1 PRO 118 -10.351 -13.648 0.818 904 1HG PRO 118 HG2 PRO 118 -8.332 -15.768 1.271 905 2HG PRO 118 HG1 PRO 118 -9.659 -15.708 0.098 906 1HD PRO 118 HD2 PRO 118 -6.926 -15.112 -0.367 907 2HD PRO 118 HD1 PRO 118 -8.282 -14.872 -1.485 908 H LEU 119 HN LEU 119 -7.394 -10.862 2.321 909 HA LEU 119 HA LEU 119 -5.465 -12.485 3.803 910 1HB LEU 119 HB2 LEU 119 -4.913 -10.218 2.726 911 2HB LEU 119 HB1 LEU 119 -5.829 -9.507 4.030 912 HG LEU 119 HG LEU 119 -4.272 -10.427 5.664 913 1HD1 LEU 119 1HD1 LEU 119 -2.842 -11.551 3.260 914 2HD1 LEU 119 3HD1 LEU 119 -2.199 -11.520 4.900 915 3HD1 LEU 119 2HD1 LEU 119 -3.635 -12.474 4.534 916 1HD2 LEU 119 2HD2 LEU 119 -3.036 -8.899 3.384 917 2HD2 LEU 119 1HD2 LEU 119 -3.764 -8.246 4.847 918 3HD2 LEU 119 3HD2 LEU 119 -2.247 -9.143 4.940 919 H VAL 120 HN VAL 120 -8.164 -10.242 4.393 920 HA VAL 120 HA VAL 120 -8.038 -10.825 7.248 921 HB VAL 120 HB VAL 120 -10.118 -9.028 6.224 922 1HG1 VAL 120 2HG1 VAL 120 -9.603 -9.360 8.608 923 2HG1 VAL 120 1HG1 VAL 120 -7.999 -8.679 8.345 924 3HG1 VAL 120 3HG1 VAL 120 -9.432 -7.679 8.117 925 1HG2 VAL 120 3HG2 VAL 120 -7.210 -8.472 5.740 926 2HG2 VAL 120 2HG2 VAL 120 -8.566 -8.315 4.633 927 3HG2 VAL 120 1HG2 VAL 120 -8.373 -7.168 5.954 928 HA PRO 121 HA PRO 121 -11.286 -13.854 7.065 929 1HB PRO 121 HB2 PRO 121 -12.041 -12.521 9.629 930 2HB PRO 121 HB1 PRO 121 -11.869 -14.241 9.268 931 1HG PRO 121 HG2 PRO 121 -9.974 -12.946 10.613 932 2HG PRO 121 HG1 PRO 121 -9.556 -14.177 9.409 933 1HD PRO 121 HD2 PRO 121 -9.351 -11.216 9.239 934 2HD PRO 121 HD1 PRO 121 -8.343 -12.464 8.481 935 H GLU 122 HN GLU 122 -12.173 -10.621 8.290 936 HA GLU 122 HA GLU 122 -14.805 -10.927 7.122 937 1HB GLU 122 HB2 GLU 122 -15.317 -8.782 8.188 938 2HB GLU 122 HB1 GLU 122 -14.836 -10.044 9.324 939 1HG GLU 122 HG2 GLU 122 -12.926 -8.976 9.908 940 2HG GLU 122 HG1 GLU 122 -12.681 -8.291 8.292 941 H ILE 123 HN ILE 123 -12.017 -8.812 6.745 942 HA ILE 123 HA ILE 123 -13.420 -6.897 5.219 943 HB ILE 123 HB ILE 123 -10.462 -7.369 5.381 944 1HG1 ILE 123 2HG1 ILE 123 -12.231 -5.456 6.901 945 2HG1 ILE 123 1HG1 ILE 123 -11.568 -6.953 7.552 946 1HG2 ILE 123 1HG2 ILE 123 -11.091 -6.020 3.448 947 2HG2 ILE 123 3HG2 ILE 123 -12.001 -4.939 4.506 948 3HG2 ILE 123 2HG2 ILE 123 -10.250 -5.065 4.670 949 1HD1 ILE 123 1HD1 ILE 123 -9.339 -6.130 7.155 950 2HD1 ILE 123 3HD1 ILE 123 -10.004 -4.611 6.559 951 3HD1 ILE 123 2HD1 ILE 123 -10.249 -5.083 8.246 952 H ALA 124 HN ALA 124 -11.383 -9.617 4.353 953 HA ALA 124 HA ALA 124 -11.554 -9.335 1.570 954 1HB ALA 124 HB1 ALA 124 -11.575 -11.911 3.134 955 2HB ALA 124 HB3 ALA 124 -11.194 -11.733 1.422 956 3HB ALA 124 HB2 ALA 124 -10.136 -11.017 2.638 957 H ARG 125 HN ARG 125 -13.822 -10.523 3.914 958 HA ARG 125 HA ARG 125 -15.685 -11.712 2.134 959 1HB ARG 125 HB2 ARG 125 -15.529 -12.263 4.523 960 2HB ARG 125 HB1 ARG 125 -16.041 -10.635 4.935 961 1HG ARG 125 HG2 ARG 125 -17.755 -12.331 3.221 962 2HG ARG 125 HG1 ARG 125 -17.709 -12.586 4.962 963 1HD ARG 125 HD2 ARG 125 -18.380 -10.236 5.293 964 2HD ARG 125 HD1 ARG 125 -18.489 -10.046 3.540 965 HE ARG 125 HE ARG 125 -20.052 -12.243 4.257 966 1HH1 ARG 125 1HH1 ARG 125 -20.066 -8.792 4.860 967 2HH1 ARG 125 2HH1 ARG 125 -21.797 -8.677 4.903 968 1HH2 ARG 125 1HH2 ARG 125 -22.315 -12.112 4.347 969 2HH2 ARG 125 2HH2 ARG 125 -23.076 -10.574 4.613 970 H ILE 126 HN ILE 126 -15.885 -8.793 4.082 971 HA ILE 126 HA ILE 126 -18.177 -7.638 3.035 972 HB ILE 126 HB ILE 126 -17.322 -5.552 3.943 973 1HG1 ILE 126 2HG1 ILE 126 -15.000 -5.753 5.118 974 2HG1 ILE 126 1HG1 ILE 126 -14.702 -7.003 3.908 975 1HG2 ILE 126 1HG2 ILE 126 -16.685 -7.936 5.658 976 2HG2 ILE 126 3HG2 ILE 126 -16.905 -6.289 6.250 977 3HG2 ILE 126 2HG2 ILE 126 -18.252 -7.141 5.494 978 1HD1 ILE 126 3HD1 ILE 126 -15.236 -5.303 2.152 979 2HD1 ILE 126 2HD1 ILE 126 -15.269 -4.086 3.427 980 3HD1 ILE 126 1HD1 ILE 126 -13.783 -4.972 3.097 981 H TYR 127 HN TYR 127 -15.226 -8.136 1.470 982 HA TYR 127 HA TYR 127 -15.528 -5.820 -0.287 983 1HB TYR 127 HB2 TYR 127 -13.252 -6.414 0.241 984 2HB TYR 127 HB1 TYR 127 -13.522 -8.075 -0.275 985 HD1 TYR 127 HD1 TYR 127 -13.463 -8.673 -2.599 986 HD2 TYR 127 HD2 TYR 127 -13.118 -4.602 -1.426 987 HE1 TYR 127 HE1 TYR 127 -12.781 -8.080 -4.879 988 HE2 TYR 127 HE2 TYR 127 -12.427 -4.000 -3.706 989 HH TYR 127 HH TYR 127 -12.716 -6.158 -6.336 990 H LYS 128 HN LYS 128 -15.385 -9.286 -0.554 991 HA LYS 128 HA LYS 128 -16.323 -9.234 -3.289 992 1HB LYS 128 HB2 LYS 128 -15.719 -11.595 -3.256 993 2HB LYS 128 HB1 LYS 128 -14.405 -10.626 -2.585 994 1HG LYS 128 HG2 LYS 128 -15.507 -11.173 -0.306 995 2HG LYS 128 HG1 LYS 128 -16.297 -12.473 -1.189 996 1HD LYS 128 HD2 LYS 128 -13.327 -12.023 -0.879 997 2HD LYS 128 HD1 LYS 128 -14.290 -13.311 -0.152 998 1HE LYS 128 HE2 LYS 128 -13.912 -12.916 -3.125 999 2HE LYS 128 HE1 LYS 128 -12.986 -14.047 -2.142 1000 1HZ LYS 128 HZ2 LYS 128 -15.942 -14.135 -2.410 1001 2HZ LYS 128 HZ1 LYS 128 -14.882 -15.059 -3.349 1002 3HZ LYS 128 HZ3 LYS 128 -14.950 -15.286 -1.677 1003 H THR 129 HN THR 129 -17.976 -8.665 -0.736 1004 HA THR 129 HA THR 129 -20.238 -10.275 -1.424 1005 HB THR 129 HB THR 129 -18.970 -10.523 1.300 1006 HG1 THR 129 HG1 THR 129 -18.802 -11.980 -0.984 1007 1HG2 THR 129 2HG2 THR 129 -21.574 -11.642 0.243 1008 2HG2 THR 129 1HG2 THR 129 -20.830 -12.088 1.780 1009 3HG2 THR 129 3HG2 THR 129 -21.387 -10.436 1.517 1010 H ASP 130 HN ASP 130 -19.130 -8.287 1.346 1011 HA ASP 130 HA ASP 130 -21.711 -6.944 1.333 1012 1HB ASP 130 HB2 ASP 130 -20.209 -7.561 3.422 1013 2HB ASP 130 HB1 ASP 130 -19.446 -6.030 3.058 1014 H ARG 131 HN ARG 131 -21.001 -6.331 -0.953 1015 HA ARG 131 HA ARG 131 -19.102 -4.677 -1.815 1016 1HB ARG 131 HB2 ARG 131 -20.870 -5.541 -3.217 1017 2HB ARG 131 HB1 ARG 131 -22.054 -4.524 -2.422 1018 1HG ARG 131 HG2 ARG 131 -21.087 -2.549 -3.392 1019 2HG ARG 131 HG1 ARG 131 -19.762 -3.496 -4.081 1020 1HD ARG 131 HD2 ARG 131 -21.271 -4.692 -5.501 1021 2HD ARG 131 HD1 ARG 131 -22.669 -3.976 -4.706 1022 HE ARG 131 HE ARG 131 -21.084 -1.932 -5.815 1023 1HH1 ARG 131 1HH1 ARG 131 -23.113 -4.593 -6.815 1024 2HH1 ARG 131 2HH1 ARG 131 -23.672 -3.805 -8.252 1025 1HH2 ARG 131 1HH2 ARG 131 -21.807 -0.884 -7.744 1026 2HH2 ARG 131 2HH2 ARG 131 -22.932 -1.702 -8.776 1027 H GLU 132 HN GLU 132 -21.713 -3.728 0.257 1028 HA GLU 132 HA GLU 132 -21.599 -0.948 0.185 1029 1HB GLU 132 HB2 GLU 132 -21.975 -2.204 2.831 1030 2HB GLU 132 HB1 GLU 132 -22.975 -1.022 2.006 1031 1HG GLU 132 HG2 GLU 132 -22.966 -4.020 1.678 1032 2HG GLU 132 HG1 GLU 132 -24.253 -2.984 2.305 1033 H LYS 133 HN LYS 133 -19.950 -3.265 2.284 1034 HA LYS 133 HA LYS 133 -18.678 -1.501 4.030 1035 1HB LYS 133 HB2 LYS 133 -18.331 -4.315 3.142 1036 2HB LYS 133 HB1 LYS 133 -17.040 -3.588 4.106 1037 1HG LYS 133 HG2 LYS 133 -19.927 -3.634 4.958 1038 2HG LYS 133 HG1 LYS 133 -18.761 -4.881 5.396 1039 1HD LYS 133 HD2 LYS 133 -17.338 -3.034 6.368 1040 2HD LYS 133 HD1 LYS 133 -18.725 -1.966 6.146 1041 1HE LYS 133 HE2 LYS 133 -20.075 -3.357 7.589 1042 2HE LYS 133 HE1 LYS 133 -18.764 -4.523 7.749 1043 1HZ LYS 133 HZ1 LYS 133 -17.429 -2.680 8.749 1044 2HZ LYS 133 HZ3 LYS 133 -18.843 -1.748 8.785 1045 3HZ LYS 133 HZ2 LYS 133 -18.754 -3.182 9.675 1046 H TYR 134 HN TYR 134 -17.658 -2.779 0.938 1047 HA TYR 134 HA TYR 134 -14.970 -1.930 1.302 1048 1HB TYR 134 HB2 TYR 134 -14.771 -3.675 -0.034 1049 2HB TYR 134 HB1 TYR 134 -16.474 -3.684 -0.396 1050 HD1 TYR 134 HD1 TYR 134 -13.551 -1.524 -1.413 1051 HD2 TYR 134 HD2 TYR 134 -16.888 -3.872 -2.619 1052 HE1 TYR 134 HE1 TYR 134 -13.046 -1.036 -3.771 1053 HE2 TYR 134 HE2 TYR 134 -16.394 -3.381 -4.969 1054 HH TYR 134 HH TYR 134 -13.499 -2.064 -6.010 1055 H ASN 135 HN ASN 135 -17.401 -0.976 -1.147 1056 HA ASN 135 HA ASN 135 -15.942 1.201 -2.097 1057 1HB ASN 135 HB2 ASN 135 -18.923 0.734 -2.104 1058 2HB ASN 135 HB1 ASN 135 -18.100 1.962 -3.046 1059 1HD2 ASN 135 1HD2 ASN 135 -18.725 -1.402 -2.681 1060 2HD2 ASN 135 2HD2 ASN 135 -18.136 -1.892 -4.234 1061 H ARG 136 HN ARG 136 -18.812 1.255 -0.001 1062 HA ARG 136 HA ARG 136 -19.040 4.036 0.034 1063 1HB ARG 136 HB2 ARG 136 -20.849 2.475 0.639 1064 2HB ARG 136 HB1 ARG 136 -19.988 2.062 2.116 1065 1HG ARG 136 HG2 ARG 136 -20.133 4.486 2.765 1066 2HG ARG 136 HG1 ARG 136 -21.215 4.700 1.383 1067 1HD ARG 136 HD2 ARG 136 -21.655 2.995 3.829 1068 2HD ARG 136 HD1 ARG 136 -22.619 4.356 3.261 1069 HE ARG 136 HE ARG 136 -22.627 2.349 1.291 1070 1HH1 ARG 136 1HH1 ARG 136 -23.932 3.014 4.467 1071 2HH1 ARG 136 2HH1 ARG 136 -25.277 1.934 4.280 1072 1HH2 ARG 136 1HH2 ARG 136 -24.407 0.907 1.051 1073 2HH2 ARG 136 2HH2 ARG 136 -25.541 0.738 2.354 1074 H ILE 137 HN ILE 137 -17.185 1.896 2.075 1075 HA ILE 137 HA ILE 137 -17.023 3.867 4.187 1076 HB ILE 137 HB ILE 137 -15.686 1.179 4.239 1077 1HG1 ILE 137 2HG1 ILE 137 -17.933 0.611 3.614 1078 2HG1 ILE 137 1HG1 ILE 137 -17.786 0.325 5.342 1079 1HG2 ILE 137 3HG2 ILE 137 -16.866 2.990 6.346 1080 2HG2 ILE 137 2HG2 ILE 137 -16.171 1.400 6.659 1081 3HG2 ILE 137 1HG2 ILE 137 -15.154 2.702 6.037 1082 1HD1 ILE 137 1HD1 ILE 137 -18.921 2.460 5.775 1083 2HD1 ILE 137 3HD1 ILE 137 -19.106 2.690 4.034 1084 3HD1 ILE 137 2HD1 ILE 137 -19.910 1.340 4.835 1085 H ALA 138 HN ALA 138 -14.792 1.924 2.204 1086 HA ALA 138 HA ALA 138 -12.484 3.287 3.061 1087 1HB ALA 138 HB1 ALA 138 -11.367 2.114 1.291 1088 2HB ALA 138 HB3 ALA 138 -12.523 1.044 2.085 1089 3HB ALA 138 HB2 ALA 138 -12.917 1.754 0.515 1090 H ARG 139 HN ARG 139 -14.812 3.919 0.496 1091 HA ARG 139 HA ARG 139 -13.245 6.041 -0.678 1092 1HB ARG 139 HB2 ARG 139 -15.002 4.871 -1.985 1093 2HB ARG 139 HB1 ARG 139 -16.232 5.510 -0.901 1094 1HG ARG 139 HG2 ARG 139 -15.095 7.809 -1.625 1095 2HG ARG 139 HG1 ARG 139 -14.708 6.854 -3.055 1096 1HD ARG 139 HD2 ARG 139 -17.451 7.308 -1.891 1097 2HD ARG 139 HD1 ARG 139 -16.803 8.056 -3.346 1098 HE ARG 139 HE ARG 139 -16.703 5.243 -3.590 1099 1HH1 ARG 139 1HH1 ARG 139 -18.976 7.906 -3.591 1100 2HH1 ARG 139 2HH1 ARG 139 -20.133 7.092 -4.590 1101 1HH2 ARG 139 1HH2 ARG 139 -18.252 4.158 -4.893 1102 2HH2 ARG 139 2HH2 ARG 139 -19.728 4.960 -5.319 1103 H GLU 140 HN GLU 140 -15.726 5.767 1.865 1104 HA GLU 140 HA GLU 140 -16.151 8.519 2.228 1105 1HB GLU 140 HB2 GLU 140 -17.574 7.795 3.810 1106 2HB GLU 140 HB1 GLU 140 -17.236 6.217 3.176 1107 1HG GLU 140 HG2 GLU 140 -15.695 5.745 4.910 1108 2HG GLU 140 HG1 GLU 140 -15.762 7.399 5.507 1109 H TRP 141 HN TRP 141 -13.917 6.205 3.731 1110 HA TRP 141 HA TRP 141 -12.563 8.043 5.357 1111 1HB TRP 141 HB2 TRP 141 -11.592 5.523 4.007 1112 2HB TRP 141 HB1 TRP 141 -10.680 6.400 5.232 1113 HD1 TRP 141 HD1 TRP 141 -13.379 7.013 7.032 1114 HE1 TRP 141 HE1 TRP 141 -14.259 5.097 8.502 1115 HE3 TRP 141 HE3 TRP 141 -11.202 3.089 4.623 1116 HZ2 TRP 141 HZ2 TRP 141 -14.051 2.290 8.603 1117 HZ3 TRP 141 HZ3 TRP 141 -11.596 0.818 5.477 1118 HH2 TRP 141 HH2 TRP 141 -12.990 0.436 7.433 1119 H THR 142 HN THR 142 -12.193 7.101 2.021 1120 HA THR 142 HA THR 142 -9.982 8.567 1.250 1121 HB THR 142 HB THR 142 -12.546 7.827 -0.085 1122 HG1 THR 142 HG1 THR 142 -10.967 6.248 0.187 1123 1HG2 THR 142 3HG2 THR 142 -10.360 9.471 -1.350 1124 2HG2 THR 142 2HG2 THR 142 -11.625 8.623 -2.242 1125 3HG2 THR 142 1HG2 THR 142 -12.048 9.931 -1.136 1126 H GLN 143 HN GLN 143 -13.320 9.626 1.577 1127 HA GLN 143 HA GLN 143 -12.924 12.307 0.793 1128 1HB GLN 143 HB2 GLN 143 -15.028 10.822 2.307 1129 2HB GLN 143 HB1 GLN 143 -15.166 12.547 2.016 1130 1HG GLN 143 HG2 GLN 143 -14.961 12.065 -0.412 1131 2HG GLN 143 HG1 GLN 143 -15.003 10.349 -0.022 1132 1HE2 GLN 143 1HE2 GLN 143 -16.912 9.430 0.705 1133 2HE2 GLN 143 2HE2 GLN 143 -18.442 10.214 0.530 1134 H LYS 144 HN LYS 144 -12.928 10.688 3.894 1135 HA LYS 144 HA LYS 144 -13.090 13.153 5.400 1136 1HB LYS 144 HB2 LYS 144 -12.972 10.235 6.037 1137 2HB LYS 144 HB1 LYS 144 -12.893 11.449 7.311 1138 1HG LYS 144 HG2 LYS 144 -15.096 12.003 7.057 1139 2HG LYS 144 HG1 LYS 144 -15.108 11.570 5.339 1140 1HD LYS 144 HD2 LYS 144 -14.808 9.193 6.024 1141 2HD LYS 144 HD1 LYS 144 -15.071 9.699 7.694 1142 1HE LYS 144 HE2 LYS 144 -16.995 10.190 5.453 1143 2HE LYS 144 HE1 LYS 144 -17.072 8.796 6.528 1144 1HZ LYS 144 HZ3 LYS 144 -17.303 10.340 8.409 1145 2HZ LYS 144 HZ2 LYS 144 -17.322 11.646 7.329 1146 3HZ LYS 144 HZ1 LYS 144 -18.567 10.506 7.295 1147 H TYR 145 HN TYR 145 -10.684 10.568 4.957 1148 HA TYR 145 HA TYR 145 -8.891 12.010 6.768 1149 1HB TYR 145 HB2 TYR 145 -8.824 9.079 5.994 1150 2HB TYR 145 HB1 TYR 145 -7.767 9.877 7.142 1151 HD1 TYR 145 HD1 TYR 145 -8.446 10.274 9.395 1152 HD2 TYR 145 HD2 TYR 145 -11.234 8.758 6.567 1153 HE1 TYR 145 HE1 TYR 145 -10.001 9.746 11.227 1154 HE2 TYR 145 HE2 TYR 145 -12.805 8.234 8.385 1155 HH TYR 145 HH TYR 145 -12.660 7.755 10.863 1156 H ALA 146 HN ALA 146 -9.285 10.814 3.551 1157 HA ALA 146 HA ALA 146 -6.451 11.275 3.150 1158 1HB ALA 146 HB2 ALA 146 -7.203 9.159 2.352 1159 2HB ALA 146 HB1 ALA 146 -8.507 9.903 1.434 1160 3HB ALA 146 HB3 ALA 146 -6.831 10.156 0.946 1161 H MET 147 HN MET 147 -8.697 11.577 0.553 1162 HA MET 147 HA MET 147 -8.736 13.159 -1.101 1163 1HB MET 147 HB2 MET 147 -10.035 14.147 1.353 1164 2HB MET 147 HB1 MET 147 -9.788 15.335 0.073 1165 1HG MET 147 HG2 MET 147 -11.245 12.719 -0.160 1166 2HG MET 147 HG1 MET 147 -11.971 14.323 -0.105 1167 1HE MET 147 HE2 MET 147 -11.521 16.171 -1.935 1168 2HE MET 147 HE1 MET 147 -9.780 15.916 -2.051 1169 3HE MET 147 HE3 MET 147 -10.778 15.867 -3.504 No H/Q in entry = 1169 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 21.888 -4.979 4.900 2 H2 MET 1 HT3 MET 1 22.879 -4.103 5.951 3 H3 MET 1 HT2 MET 1 21.221 -3.799 5.912 4 HA MET 1 HA MET 1 22.393 -2.056 4.756 5 1HB MET 1 HB2 MET 1 24.184 -3.947 4.090 6 2HB MET 1 HB1 MET 1 23.237 -3.934 2.609 7 1HG MET 1 HG2 MET 1 23.569 -1.416 2.603 8 2HG MET 1 HG1 MET 1 24.787 -1.689 3.845 9 1HE MET 1 HE2 MET 1 25.568 -0.145 1.383 10 2HE MET 1 HE1 MET 1 26.822 -0.681 2.498 11 3HE MET 1 HE3 MET 1 27.015 -0.937 0.764 12 H ALA 2 HN ALA 2 19.791 -3.528 4.768 13 HA ALA 2 HA ALA 2 18.867 -3.732 2.086 14 1HB ALA 2 HB1 ALA 2 16.771 -4.189 2.993 15 2HB ALA 2 HB2 ALA 2 17.083 -3.220 4.431 16 3HB ALA 2 HB3 ALA 2 17.883 -4.777 4.233 17 H LEU 3 HN LEU 3 19.383 -1.146 4.218 18 HA LEU 3 HA LEU 3 17.288 0.554 3.322 19 1HB LEU 3 HB2 LEU 3 18.743 2.315 4.451 20 2HB LEU 3 HB1 LEU 3 18.103 1.021 5.441 21 HG LEU 3 HG LEU 3 20.397 -0.113 4.971 22 1HD1 LEU 3 2HD1 LEU 3 21.184 1.531 3.351 23 2HD1 LEU 3 1HD1 LEU 3 21.117 2.786 4.588 24 3HD1 LEU 3 3HD1 LEU 3 22.246 1.441 4.759 25 1HD2 LEU 3 2HD2 LEU 3 19.972 2.181 6.869 26 2HD2 LEU 3 1HD2 LEU 3 19.667 0.470 7.165 27 3HD2 LEU 3 3HD2 LEU 3 21.322 1.048 6.972 28 H LYS 4 HN LYS 4 20.387 -0.316 2.140 29 HA LYS 4 HA LYS 4 20.639 2.093 0.583 30 1HB LYS 4 HB2 LYS 4 22.799 1.442 0.108 31 2HB LYS 4 HB1 LYS 4 22.515 0.793 1.710 32 1HG LYS 4 HG2 LYS 4 23.569 -0.976 0.705 33 2HG LYS 4 HG1 LYS 4 21.877 -1.381 0.426 34 1HD LYS 4 HD2 LYS 4 22.054 -0.384 -1.836 35 2HD LYS 4 HD1 LYS 4 23.765 -0.083 -1.543 36 1HE LYS 4 HE2 LYS 4 22.485 -2.811 -1.469 37 2HE LYS 4 HE1 LYS 4 23.292 -2.135 -2.881 38 1HZ LYS 4 HZ1 LYS 4 24.581 -2.616 -0.245 39 2HZ LYS 4 HZ3 LYS 4 24.753 -3.592 -1.616 40 3HZ LYS 4 HZ2 LYS 4 25.337 -2.009 -1.628 41 H ARG 5 HN ARG 5 19.354 -0.923 0.404 42 HA ARG 5 HA ARG 5 19.145 -1.097 -2.477 43 1HB ARG 5 HB2 ARG 5 19.226 -3.189 -1.481 44 2HB ARG 5 HB1 ARG 5 18.213 -2.700 -0.129 45 1HG ARG 5 HG2 ARG 5 16.560 -3.745 -1.184 46 2HG ARG 5 HG1 ARG 5 16.548 -2.337 -2.248 47 1HD ARG 5 HD2 ARG 5 18.252 -4.760 -2.786 48 2HD ARG 5 HD1 ARG 5 16.593 -4.624 -3.360 49 HE ARG 5 HE ARG 5 18.913 -3.146 -4.319 50 1HH1 ARG 5 1HH1 ARG 5 15.417 -3.410 -4.263 51 2HH1 ARG 5 2HH1 ARG 5 15.213 -2.709 -5.840 52 1HH2 ARG 5 1HH2 ARG 5 18.659 -2.202 -6.388 53 2HH2 ARG 5 2HH2 ARG 5 17.068 -1.986 -7.040 54 H ILE 6 HN ILE 6 17.078 -0.670 0.325 55 HA ILE 6 HA ILE 6 14.759 0.121 -0.975 56 HB ILE 6 HB ILE 6 15.677 1.196 1.704 57 1HG1 ILE 6 2HG1 ILE 6 14.512 -1.488 0.968 58 2HG1 ILE 6 1HG1 ILE 6 15.973 -1.141 1.895 59 1HG2 ILE 6 3HG2 ILE 6 13.038 0.885 0.313 60 2HG2 ILE 6 2HG2 ILE 6 13.128 0.956 2.076 61 3HG2 ILE 6 1HG2 ILE 6 13.727 2.300 1.106 62 1HD1 ILE 6 1HD1 ILE 6 14.603 -0.256 3.706 63 2HD1 ILE 6 3HD1 ILE 6 13.146 -0.640 2.786 64 3HD1 ILE 6 2HD1 ILE 6 14.211 -1.936 3.335 65 H HIS 7 HN HIS 7 17.707 1.674 -0.285 66 HA HIS 7 HA HIS 7 17.249 4.356 -0.632 67 1HB HIS 7 HB2 HIS 7 19.373 3.429 -0.017 68 2HB HIS 7 HB1 HIS 7 19.488 2.569 -1.557 69 HD1 HIS 7 HD1 HIS 7 19.869 5.969 0.000 70 HD2 HIS 7 HD2 HIS 7 20.496 4.111 -3.662 71 HE1 HIS 7 HE1 HIS 7 21.184 7.610 -1.369 72 HE2 HIS 7 HE2 HIS 7 21.520 6.484 -3.597 73 H LYS 8 HN LYS 8 17.112 1.802 -3.019 74 HA LYS 8 HA LYS 8 16.879 3.751 -5.185 75 1HB LYS 8 HB2 LYS 8 16.489 0.760 -5.320 76 2HB LYS 8 HB1 LYS 8 16.698 1.865 -6.672 77 1HG LYS 8 HG2 LYS 8 18.771 1.083 -4.624 78 2HG LYS 8 HG1 LYS 8 18.755 0.671 -6.340 79 1HD LYS 8 HD2 LYS 8 18.897 3.502 -5.309 80 2HD LYS 8 HD1 LYS 8 20.321 2.534 -5.684 81 1HE LYS 8 HE2 LYS 8 18.150 2.946 -7.707 82 2HE LYS 8 HE1 LYS 8 19.413 4.151 -7.476 83 1HZ LYS 8 HZ1 LYS 8 19.945 1.298 -8.096 84 2HZ LYS 8 HZ3 LYS 8 19.877 2.522 -9.260 85 3HZ LYS 8 HZ2 LYS 8 21.070 2.567 -8.064 86 H GLU 9 HN GLU 9 15.070 1.114 -3.796 87 HA GLU 9 HA GLU 9 12.678 1.297 -5.113 88 1HB GLU 9 HB2 GLU 9 13.115 0.566 -2.207 89 2HB GLU 9 HB1 GLU 9 11.879 -0.070 -3.270 90 1HG GLU 9 HG2 GLU 9 13.443 -1.305 -4.528 91 2HG GLU 9 HG1 GLU 9 14.800 -0.493 -3.750 92 H LEU 10 HN LEU 10 13.401 2.558 -1.938 93 HA LEU 10 HA LEU 10 11.035 4.072 -1.635 94 1HB LEU 10 HB2 LEU 10 11.933 3.356 0.340 95 2HB LEU 10 HB1 LEU 10 13.570 3.605 -0.208 96 HG LEU 10 HG LEU 10 11.903 5.994 0.395 97 1HD1 LEU 10 1HD1 LEU 10 13.372 4.308 2.402 98 2HD1 LEU 10 3HD1 LEU 10 12.723 5.918 2.707 99 3HD1 LEU 10 2HD1 LEU 10 11.632 4.582 2.342 100 1HD2 LEU 10 1HD2 LEU 10 14.121 6.302 -0.618 101 2HD2 LEU 10 3HD2 LEU 10 14.057 6.948 1.023 102 3HD2 LEU 10 2HD2 LEU 10 14.840 5.398 0.714 103 H ASN 11 HN ASN 11 14.409 4.984 -2.431 104 HA ASN 11 HA ASN 11 13.800 7.777 -2.253 105 1HB ASN 11 HB2 ASN 11 16.114 6.514 -2.068 106 2HB ASN 11 HB1 ASN 11 16.152 6.820 -3.797 107 1HD2 ASN 11 1HD2 ASN 11 14.711 9.370 -3.549 108 2HD2 ASN 11 2HD2 ASN 11 15.853 10.493 -2.890 109 H ASP 12 HN ASP 12 13.746 5.415 -4.804 110 HA ASP 12 HA ASP 12 13.808 7.134 -7.028 111 1HB ASP 12 HB2 ASP 12 13.987 4.656 -7.156 112 2HB ASP 12 HB1 ASP 12 12.279 4.509 -6.742 113 H LEU 13 HN LEU 13 11.323 6.287 -4.782 114 HA LEU 13 HA LEU 13 9.143 7.564 -6.041 115 1HB LEU 13 HB2 LEU 13 9.755 6.969 -3.159 116 2HB LEU 13 HB1 LEU 13 8.230 7.630 -3.707 117 HG LEU 13 HG LEU 13 9.203 5.035 -4.838 118 1HD1 LEU 13 3HD1 LEU 13 7.898 5.492 -2.179 119 2HD1 LEU 13 2HD1 LEU 13 7.841 3.954 -3.032 120 3HD1 LEU 13 1HD1 LEU 13 9.392 4.618 -2.517 121 1HD2 LEU 13 1HD2 LEU 13 6.529 6.308 -4.331 122 2HD2 LEU 13 3HD2 LEU 13 7.292 6.012 -5.893 123 3HD2 LEU 13 2HD2 LEU 13 6.743 4.659 -4.903 124 H ALA 14 HN ALA 14 11.687 8.621 -3.907 125 HA ALA 14 HA ALA 14 10.564 11.214 -3.423 126 1HB ALA 14 HB3 ALA 14 11.946 10.057 -1.751 127 2HB ALA 14 HB1 ALA 14 12.592 11.644 -2.176 128 3HB ALA 14 HB2 ALA 14 13.331 10.186 -2.838 129 H ARG 15 HN ARG 15 12.818 9.826 -5.677 130 HA ARG 15 HA ARG 15 13.831 12.407 -6.506 131 1HB ARG 15 HB2 ARG 15 14.273 9.853 -8.027 132 2HB ARG 15 HB1 ARG 15 15.320 11.261 -7.913 133 1HG ARG 15 HG2 ARG 15 15.470 10.614 -5.401 134 2HG ARG 15 HG1 ARG 15 14.914 9.038 -5.961 135 1HD ARG 15 HD2 ARG 15 17.224 8.852 -5.972 136 2HD ARG 15 HD1 ARG 15 16.820 9.182 -7.658 137 HE ARG 15 HE ARG 15 17.415 11.536 -6.123 138 1HH1 ARG 15 1HH1 ARG 15 18.768 8.970 -8.084 139 2HH1 ARG 15 2HH1 ARG 15 20.230 9.832 -8.427 140 1HH2 ARG 15 1HH2 ARG 15 19.333 12.666 -6.560 141 2HH2 ARG 15 2HH2 ARG 15 20.551 11.946 -7.562 142 H ASP 16 HN ASP 16 11.759 9.845 -7.844 143 HA ASP 16 HA ASP 16 10.732 11.869 -9.724 144 1HB ASP 16 HB2 ASP 16 12.150 9.948 -10.728 145 2HB ASP 16 HB1 ASP 16 10.752 8.935 -10.381 146 HA PRO 17 HA PRO 17 7.062 10.311 -7.558 147 1HB PRO 17 HB2 PRO 17 6.178 12.772 -6.754 148 2HB PRO 17 HB1 PRO 17 7.304 11.785 -5.824 149 1HG PRO 17 HG2 PRO 17 7.795 14.287 -7.191 150 2HG PRO 17 HG1 PRO 17 8.875 13.382 -6.120 151 1HD PRO 17 HD2 PRO 17 8.803 13.473 -9.054 152 2HD PRO 17 HD1 PRO 17 10.098 12.913 -7.977 153 HA PRO 18 HA PRO 18 4.988 11.588 -11.439 154 1HB PRO 18 HB2 PRO 18 3.541 9.072 -11.161 155 2HB PRO 18 HB1 PRO 18 4.617 9.595 -12.455 156 1HG PRO 18 HG2 PRO 18 5.262 7.618 -10.703 157 2HG PRO 18 HG1 PRO 18 6.470 8.668 -11.470 158 1HD PRO 18 HD2 PRO 18 5.322 8.792 -8.711 159 2HD PRO 18 HD1 PRO 18 6.991 9.070 -9.258 160 H ALA 19 HN ALA 19 3.036 9.476 -9.391 161 HA ALA 19 HA ALA 19 1.550 11.500 -8.106 162 1HB ALA 19 HB2 ALA 19 0.158 10.140 -10.418 163 2HB ALA 19 HB1 ALA 19 -0.633 11.137 -9.192 164 3HB ALA 19 HB3 ALA 19 0.543 11.858 -10.296 165 H GLN 20 HN GLN 20 -0.404 10.496 -7.057 166 HA GLN 20 HA GLN 20 -1.326 9.104 -5.620 167 1HB GLN 20 HB2 GLN 20 -1.472 6.628 -6.203 168 2HB GLN 20 HB1 GLN 20 -2.331 7.778 -7.176 169 1HG GLN 20 HG2 GLN 20 0.337 6.699 -8.005 170 2HG GLN 20 HG1 GLN 20 -1.148 5.812 -8.300 171 1HE2 GLN 20 1HE2 GLN 20 -2.734 8.201 -8.901 172 2HE2 GLN 20 2HE2 GLN 20 -2.207 8.751 -10.443 173 H CYS 21 HN CYS 21 1.949 8.340 -6.370 174 HA CYS 21 HA CYS 21 2.137 7.062 -3.742 175 1HB CYS 21 HB2 CYS 21 3.251 5.869 -6.284 176 2HB CYS 21 HB1 CYS 21 3.493 5.233 -4.656 177 HG CYS 21 HG CYS 21 0.387 5.378 -4.661 178 H SER 22 HN SER 22 3.713 7.784 -2.578 179 HA SER 22 HA SER 22 6.294 8.397 -3.674 180 1HB SER 22 HB2 SER 22 4.623 10.611 -2.450 181 2HB SER 22 HB1 SER 22 6.342 10.730 -2.819 182 HG SER 22 HG SER 22 4.992 9.868 -4.983 183 H ALA 23 HN ALA 23 7.711 7.712 -2.237 184 HA ALA 23 HA ALA 23 7.203 8.138 0.631 185 1HB ALA 23 HB1 ALA 23 6.925 5.725 -0.131 186 2HB ALA 23 HB3 ALA 23 8.670 5.725 -0.412 187 3HB ALA 23 HB2 ALA 23 8.031 6.028 1.205 188 H GLY 24 HN GLY 24 9.562 7.504 1.678 189 1HA GLY 24 HA1 GLY 24 11.352 9.497 0.610 190 2HA GLY 24 HA2 GLY 24 11.963 7.858 0.438 191 HA PRO 25 HA PRO 25 13.583 8.100 4.532 192 1HB PRO 25 HB2 PRO 25 14.983 10.672 4.238 193 2HB PRO 25 HB1 PRO 25 15.649 9.055 4.498 194 1HG PRO 25 HG2 PRO 25 15.892 10.332 2.139 195 2HG PRO 25 HG1 PRO 25 15.705 8.572 2.244 196 1HD PRO 25 HD2 PRO 25 13.669 10.656 1.552 197 2HD PRO 25 HD1 PRO 25 13.926 9.050 0.839 198 H VAL 26 HN VAL 26 12.104 8.442 6.116 199 HA VAL 26 HA VAL 26 10.999 11.174 6.358 200 HB VAL 26 HB VAL 26 9.872 8.511 7.201 201 1HG1 VAL 26 1HG1 VAL 26 8.788 11.286 7.760 202 2HG1 VAL 26 3HG1 VAL 26 7.906 9.781 8.019 203 3HG1 VAL 26 2HG1 VAL 26 9.357 10.125 8.960 204 1HG2 VAL 26 2HG2 VAL 26 8.943 10.649 5.277 205 2HG2 VAL 26 1HG2 VAL 26 9.629 9.083 4.845 206 3HG2 VAL 26 3HG2 VAL 26 8.071 9.171 5.665 207 H GLY 27 HN GLY 27 11.567 8.442 8.587 208 1HA GLY 27 HA1 GLY 27 12.431 8.515 10.758 209 2HA GLY 27 HA2 GLY 27 12.446 10.276 10.653 210 H ASP 28 HN ASP 28 13.732 9.848 7.957 211 HA ASP 28 HA ASP 28 15.795 10.039 7.035 212 1HB ASP 28 HB2 ASP 28 16.840 9.953 9.877 213 2HB ASP 28 HB1 ASP 28 17.804 10.328 8.454 214 H ASP 29 HN ASP 29 14.899 7.514 9.062 215 HA ASP 29 HA ASP 29 16.935 5.680 8.177 216 1HB ASP 29 HB2 ASP 29 14.263 5.015 9.405 217 2HB ASP 29 HB1 ASP 29 15.682 3.995 9.348 218 H MET 30 HN MET 30 16.671 4.124 6.572 219 HA MET 30 HA MET 30 14.516 4.506 4.679 220 1HB MET 30 HB2 MET 30 17.140 3.400 4.668 221 2HB MET 30 HB1 MET 30 16.019 2.154 4.155 222 1HG MET 30 HG2 MET 30 16.092 3.019 2.143 223 2HG MET 30 HG1 MET 30 15.325 4.453 2.733 224 1HE MET 30 HE1 MET 30 17.426 5.713 4.676 225 2HE MET 30 HE3 MET 30 18.352 6.769 3.610 226 3HE MET 30 HE2 MET 30 16.596 6.684 3.461 227 H PHE 31 HN PHE 31 14.363 3.355 7.569 228 HA PHE 31 HA PHE 31 12.569 1.141 6.862 229 1HB PHE 31 HB2 PHE 31 13.009 0.421 9.284 230 2HB PHE 31 HB1 PHE 31 14.141 -0.054 8.056 231 HD1 PHE 31 HD1 PHE 31 13.613 1.630 11.162 232 HD2 PHE 31 HD2 PHE 31 16.354 1.181 7.935 233 HE1 PHE 31 HE1 PHE 31 15.428 2.477 12.588 234 HE2 PHE 31 HE2 PHE 31 18.169 2.036 9.356 235 HZ PHE 31 HZ PHE 31 17.707 2.678 11.685 236 H HIS 32 HN HIS 32 12.535 4.131 7.547 237 HA HIS 32 HA HIS 32 10.058 3.845 9.021 238 1HB HIS 32 HB2 HIS 32 12.521 5.305 9.822 239 2HB HIS 32 HB1 HIS 32 10.995 6.141 10.135 240 HD1 HIS 32 HD1 HIS 32 13.260 4.773 12.110 241 HD2 HIS 32 HD2 HIS 32 9.360 3.533 11.342 242 HE1 HIS 32 HE1 HIS 32 12.573 3.399 14.105 243 HE2 HIS 32 HE2 HIS 32 10.138 2.880 13.713 244 H TRP 33 HN TRP 33 9.086 4.280 7.006 245 HA TRP 33 HA TRP 33 9.511 6.957 5.997 246 1HB TRP 33 HB2 TRP 33 9.538 5.863 3.640 247 2HB TRP 33 HB1 TRP 33 10.993 6.055 4.567 248 HD1 TRP 33 HD1 TRP 33 11.452 3.527 6.116 249 HE1 TRP 33 HE1 TRP 33 11.614 1.238 4.980 250 HE3 TRP 33 HE3 TRP 33 9.002 4.600 1.783 251 HZ2 TRP 33 HZ2 TRP 33 10.842 0.046 2.565 252 HZ3 TRP 33 HZ3 TRP 33 8.797 2.842 0.087 253 HH2 TRP 33 HH2 TRP 33 9.709 0.625 0.475 254 H GLN 34 HN GLN 34 8.056 7.675 4.486 255 HA GLN 34 HA GLN 34 5.361 6.725 5.156 256 1HB GLN 34 HB2 GLN 34 6.285 9.028 6.002 257 2HB GLN 34 HB1 GLN 34 6.009 9.541 4.341 258 1HG GLN 34 HG2 GLN 34 3.859 8.328 6.056 259 2HG GLN 34 HG1 GLN 34 4.172 10.059 5.986 260 1HE2 GLN 34 1HE2 GLN 34 1.790 8.523 5.226 261 2HE2 GLN 34 2HE2 GLN 34 1.487 8.921 3.573 262 H ALA 35 HN ALA 35 4.499 5.768 3.510 263 HA ALA 35 HA ALA 35 5.115 6.698 0.789 264 1HB ALA 35 HB2 ALA 35 4.300 4.447 0.108 265 2HB ALA 35 HB1 ALA 35 5.708 4.383 1.171 266 3HB ALA 35 HB3 ALA 35 4.101 4.038 1.811 267 H THR 36 HN THR 36 3.539 7.854 -0.150 268 HA THR 36 HA THR 36 0.844 7.724 0.979 269 HB THR 36 HB THR 36 1.879 9.629 -1.126 270 HG1 THR 36 HG1 THR 36 2.846 9.470 1.251 271 1HG2 THR 36 2HG2 THR 36 -0.571 9.469 -0.827 272 2HG2 THR 36 1HG2 THR 36 -0.363 9.880 0.875 273 3HG2 THR 36 3HG2 THR 36 0.065 11.049 -0.373 274 H ILE 37 HN ILE 37 -0.886 6.995 -0.149 275 HA ILE 37 HA ILE 37 -0.550 6.192 -2.969 276 HB ILE 37 HB ILE 37 -1.305 4.381 -0.699 277 1HG1 ILE 37 2HG1 ILE 37 0.591 4.084 -3.037 278 2HG1 ILE 37 1HG1 ILE 37 1.057 4.531 -1.396 279 1HG2 ILE 37 2HG2 ILE 37 -1.896 3.942 -3.615 280 2HG2 ILE 37 1HG2 ILE 37 -2.019 2.710 -2.361 281 3HG2 ILE 37 3HG2 ILE 37 -3.073 4.122 -2.322 282 1HD1 ILE 37 3HD1 ILE 37 -0.207 1.935 -2.213 283 2HD1 ILE 37 2HD1 ILE 37 1.502 2.191 -1.855 284 3HD1 ILE 37 1HD1 ILE 37 0.292 2.380 -0.583 285 H MET 38 HN MET 38 -2.289 6.717 -4.201 286 HA MET 38 HA MET 38 -4.683 7.655 -2.794 287 1HB MET 38 HB2 MET 38 -3.662 8.372 -5.544 288 2HB MET 38 HB1 MET 38 -5.128 8.992 -4.806 289 1HG MET 38 HG2 MET 38 -4.013 10.192 -3.252 290 2HG MET 38 HG1 MET 38 -2.530 9.253 -3.448 291 1HE MET 38 HE2 MET 38 -4.874 10.832 -6.206 292 2HE MET 38 HE1 MET 38 -4.858 12.038 -4.919 293 3HE MET 38 HE3 MET 38 -4.089 12.388 -6.471 294 H GLY 39 HN GLY 39 -6.725 7.135 -3.509 295 1HA GLY 39 HA1 GLY 39 -8.328 6.373 -4.895 296 2HA GLY 39 HA2 GLY 39 -7.204 5.113 -5.403 297 HA PRO 40 HA PRO 40 -5.991 7.994 -8.730 298 1HB PRO 40 HB2 PRO 40 -4.579 6.348 -10.197 299 2HB PRO 40 HB1 PRO 40 -4.049 6.702 -8.545 300 1HG PRO 40 HG2 PRO 40 -5.463 4.289 -9.600 301 2HG PRO 40 HG1 PRO 40 -4.156 4.388 -8.408 302 1HD PRO 40 HD2 PRO 40 -6.927 4.219 -7.858 303 2HD PRO 40 HD1 PRO 40 -5.640 4.601 -6.694 304 H ASN 41 HN ASN 41 -6.789 8.582 -10.659 305 HA ASN 41 HA ASN 41 -8.013 8.700 -12.546 306 1HB ASN 41 HB2 ASN 41 -7.441 5.731 -12.682 307 2HB ASN 41 HB1 ASN 41 -8.090 6.692 -14.006 308 1HD2 ASN 41 1HD2 ASN 41 -5.296 6.077 -12.013 309 2HD2 ASN 41 2HD2 ASN 41 -4.142 6.833 -13.060 310 H ASP 42 HN ASP 42 -9.124 5.452 -11.679 311 HA ASP 42 HA ASP 42 -11.674 6.551 -10.834 312 1HB ASP 42 HB2 ASP 42 -11.762 6.094 -13.360 313 2HB ASP 42 HB1 ASP 42 -11.667 4.388 -12.938 314 H SER 43 HN SER 43 -11.105 5.793 -8.845 315 HA SER 43 HA SER 43 -11.305 2.873 -8.548 316 1HB SER 43 HB2 SER 43 -9.961 3.015 -6.569 317 2HB SER 43 HB1 SER 43 -9.122 3.978 -7.782 318 HG SER 43 HG SER 43 -9.809 5.814 -6.823 319 HA PRO 44 HA PRO 44 -14.950 3.519 -6.027 320 1HB PRO 44 HB2 PRO 44 -13.540 2.060 -3.849 321 2HB PRO 44 HB1 PRO 44 -15.135 1.762 -4.553 322 1HG PRO 44 HG2 PRO 44 -13.085 0.181 -5.146 323 2HG PRO 44 HG1 PRO 44 -14.258 0.646 -6.393 324 1HD PRO 44 HD2 PRO 44 -11.491 1.679 -5.906 325 2HD PRO 44 HD1 PRO 44 -12.316 1.353 -7.443 326 H TYR 45 HN TYR 45 -11.735 4.078 -4.599 327 HA TYR 45 HA TYR 45 -12.928 6.124 -2.873 328 1HB TYR 45 HB2 TYR 45 -10.141 5.458 -2.306 329 2HB TYR 45 HB1 TYR 45 -11.516 5.537 -1.242 330 HD1 TYR 45 HD1 TYR 45 -13.249 3.407 -1.828 331 HD2 TYR 45 HD2 TYR 45 -9.012 3.502 -2.138 332 HE1 TYR 45 HE1 TYR 45 -13.180 0.968 -1.524 333 HE2 TYR 45 HE2 TYR 45 -8.922 1.068 -1.847 334 HH TYR 45 HH TYR 45 -10.301 -0.716 -0.879 335 H GLN 46 HN GLN 46 -12.368 6.454 -5.675 336 HA GLN 46 HA GLN 46 -10.087 7.583 -6.496 337 1HB GLN 46 HB2 GLN 46 -12.216 7.312 -7.804 338 2HB GLN 46 HB1 GLN 46 -12.764 8.829 -7.101 339 1HG GLN 46 HG2 GLN 46 -11.727 8.998 -9.386 340 2HG GLN 46 HG1 GLN 46 -11.022 10.044 -8.147 341 1HE2 GLN 46 1HE2 GLN 46 -9.050 10.197 -9.074 342 2HE2 GLN 46 2HE2 GLN 46 -7.965 8.865 -9.191 343 H GLY 47 HN GLY 47 -8.850 9.232 -6.110 344 1HA GLY 47 HA1 GLY 47 -9.922 11.658 -4.901 345 2HA GLY 47 HA2 GLY 47 -8.322 11.464 -5.598 346 H GLY 48 HN GLY 48 -9.087 8.878 -3.618 347 1HA GLY 48 HA1 GLY 48 -8.798 8.385 -1.383 348 2HA GLY 48 HA2 GLY 48 -8.624 10.092 -1.056 349 H VAL 49 HN VAL 49 -6.643 11.051 -1.102 350 HA VAL 49 HA VAL 49 -4.258 9.592 -1.608 351 HB VAL 49 HB VAL 49 -4.792 12.001 0.126 352 1HG1 VAL 49 1HG1 VAL 49 -2.188 10.958 -0.941 353 2HG1 VAL 49 3HG1 VAL 49 -2.402 12.521 -0.154 354 3HG1 VAL 49 2HG1 VAL 49 -2.688 11.032 0.749 355 1HG2 VAL 49 2HG2 VAL 49 -5.407 12.264 -2.266 356 2HG2 VAL 49 1HG2 VAL 49 -4.164 13.383 -1.704 357 3HG2 VAL 49 3HG2 VAL 49 -3.714 11.983 -2.674 358 H PHE 50 HN PHE 50 -4.326 7.629 -0.551 359 HA PHE 50 HA PHE 50 -4.796 7.596 2.301 360 1HB PHE 50 HB2 PHE 50 -4.240 5.468 0.254 361 2HB PHE 50 HB1 PHE 50 -4.283 5.125 1.977 362 HD1 PHE 50 HD1 PHE 50 -6.349 5.770 3.251 363 HD2 PHE 50 HD2 PHE 50 -6.160 5.531 -1.006 364 HE1 PHE 50 HE1 PHE 50 -8.809 5.631 3.148 365 HE2 PHE 50 HE2 PHE 50 -8.602 5.408 -1.092 366 HZ PHE 50 HZ PHE 50 -9.896 5.483 0.967 367 H PHE 51 HN PHE 51 -3.210 6.190 3.614 368 HA PHE 51 HA PHE 51 -0.579 7.432 3.213 369 1HB PHE 51 HB2 PHE 51 -1.907 7.232 5.906 370 2HB PHE 51 HB1 PHE 51 -0.612 8.311 5.396 371 HD1 PHE 51 HD1 PHE 51 -4.243 7.640 5.071 372 HD2 PHE 51 HD2 PHE 51 -1.087 10.450 4.534 373 HE1 PHE 51 HE1 PHE 51 -5.911 9.401 4.674 374 HE2 PHE 51 HE2 PHE 51 -2.733 12.220 4.114 375 HZ PHE 51 HZ PHE 51 -5.143 11.708 4.194 376 H LEU 52 HN LEU 52 1.091 6.039 3.586 377 HA LEU 52 HA LEU 52 0.626 3.685 5.276 378 1HB LEU 52 HB2 LEU 52 1.953 3.547 2.550 379 2HB LEU 52 HB1 LEU 52 1.776 2.224 3.686 380 HG LEU 52 HG LEU 52 -0.789 2.672 3.387 381 1HD1 LEU 52 1HD1 LEU 52 -0.556 4.709 2.078 382 2HD1 LEU 52 3HD1 LEU 52 0.331 3.818 0.839 383 3HD1 LEU 52 2HD1 LEU 52 -1.365 3.442 1.153 384 1HD2 LEU 52 3HD2 LEU 52 0.903 1.363 1.267 385 2HD2 LEU 52 2HD2 LEU 52 0.336 0.621 2.763 386 3HD2 LEU 52 1HD2 LEU 52 -0.820 1.094 1.521 387 H THR 53 HN THR 53 2.327 2.885 6.259 388 HA THR 53 HA THR 53 4.846 4.352 5.949 389 HB THR 53 HB THR 53 5.010 3.597 8.477 390 HG1 THR 53 HG1 THR 53 2.761 2.762 8.259 391 1HG2 THR 53 1HG2 THR 53 5.316 5.878 7.650 392 2HG2 THR 53 3HG2 THR 53 3.565 6.071 7.547 393 3HG2 THR 53 2HG2 THR 53 4.337 5.867 9.119 394 H ILE 54 HN ILE 54 6.662 3.138 5.892 395 HA ILE 54 HA ILE 54 6.256 0.228 6.047 396 HB ILE 54 HB ILE 54 8.377 1.342 4.298 397 1HG1 ILE 54 2HG1 ILE 54 5.424 1.565 3.789 398 2HG1 ILE 54 1HG1 ILE 54 6.701 2.740 3.486 399 1HG2 ILE 54 3HG2 ILE 54 6.526 -1.025 4.094 400 2HG2 ILE 54 2HG2 ILE 54 7.787 -0.621 2.928 401 3HG2 ILE 54 1HG2 ILE 54 8.219 -1.044 4.585 402 1HD1 ILE 54 3HD1 ILE 54 6.293 0.210 1.911 403 2HD1 ILE 54 2HD1 ILE 54 5.738 1.813 1.432 404 3HD1 ILE 54 1HD1 ILE 54 7.465 1.485 1.586 405 H HIS 55 HN HIS 55 7.749 -0.946 7.076 406 HA HIS 55 HA HIS 55 10.235 0.357 7.854 407 1HB HIS 55 HB2 HIS 55 10.162 -0.828 10.046 408 2HB HIS 55 HB1 HIS 55 9.044 0.516 9.845 409 HD1 HIS 55 HD1 HIS 55 7.163 -0.118 11.284 410 HD2 HIS 55 HD2 HIS 55 8.343 -3.192 8.768 411 HE1 HIS 55 HE1 HIS 55 5.472 -1.899 11.565 412 HE2 HIS 55 HE2 HIS 55 6.375 -3.882 10.317 413 H PHE 56 HN PHE 56 12.029 -1.077 8.154 414 HA PHE 56 HA PHE 56 11.572 -3.843 7.271 415 1HB PHE 56 HB2 PHE 56 13.172 -3.779 5.612 416 2HB PHE 56 HB1 PHE 56 12.435 -2.197 5.444 417 HD1 PHE 56 HD1 PHE 56 15.409 -4.015 6.664 418 HD2 PHE 56 HD2 PHE 56 13.682 -0.228 5.812 419 HE1 PHE 56 HE1 PHE 56 17.615 -2.963 6.887 420 HE2 PHE 56 HE2 PHE 56 15.872 0.835 6.034 421 HZ PHE 56 HZ PHE 56 17.856 -0.537 6.577 422 HA PRO 57 HA PRO 57 15.032 -4.520 10.118 423 1HB PRO 57 HB2 PRO 57 14.430 -7.059 10.740 424 2HB PRO 57 HB1 PRO 57 13.484 -5.708 11.373 425 1HG PRO 57 HG2 PRO 57 12.721 -7.729 9.389 426 2HG PRO 57 HG1 PRO 57 11.689 -6.610 10.294 427 1HD PRO 57 HD2 PRO 57 12.768 -6.356 7.573 428 2HD PRO 57 HD1 PRO 57 11.469 -5.431 8.362 429 H THR 58 HN THR 58 16.665 -4.437 8.504 430 HA THR 58 HA THR 58 18.125 -5.173 6.883 431 HB THR 58 HB THR 58 19.493 -7.110 7.781 432 HG1 THR 58 HG1 THR 58 17.364 -7.625 9.135 433 1HG2 THR 58 2HG2 THR 58 20.047 -4.772 8.239 434 2HG2 THR 58 1HG2 THR 58 18.933 -4.772 9.609 435 3HG2 THR 58 3HG2 THR 58 20.378 -5.783 9.649 436 H ASP 59 HN ASP 59 16.274 -5.730 5.385 437 HA ASP 59 HA ASP 59 15.404 -8.449 5.157 438 1HB ASP 59 HB2 ASP 59 15.176 -6.483 2.953 439 2HB ASP 59 HB1 ASP 59 14.019 -7.699 3.477 440 H TYR 60 HN TYR 60 17.512 -6.361 3.280 441 HA TYR 60 HA TYR 60 17.896 -7.829 0.990 442 1HB TYR 60 HB2 TYR 60 18.638 -5.513 1.336 443 2HB TYR 60 HB1 TYR 60 19.861 -6.064 2.481 444 HD1 TYR 60 HD1 TYR 60 18.866 -6.046 -1.072 445 HD2 TYR 60 HD2 TYR 60 21.988 -6.824 1.710 446 HE1 TYR 60 HE1 TYR 60 20.482 -6.150 -2.923 447 HE2 TYR 60 HE2 TYR 60 23.612 -6.938 -0.130 448 HH TYR 60 HH TYR 60 23.697 -7.296 -2.505 449 HA PRO 61 HA PRO 61 19.463 -8.484 -0.477 450 1HB PRO 61 HB2 PRO 61 20.050 -10.727 -1.780 451 2HB PRO 61 HB1 PRO 61 21.308 -9.750 -1.011 452 1HG PRO 61 HG2 PRO 61 19.991 -12.254 -0.028 453 2HG PRO 61 HG1 PRO 61 21.709 -11.815 -0.011 454 1HD PRO 61 HD2 PRO 61 20.025 -11.552 2.151 455 2HD PRO 61 HD1 PRO 61 21.496 -10.591 1.912 456 H PHE 62 HN PHE 62 17.308 -10.095 1.339 457 HA PHE 62 HA PHE 62 15.640 -10.913 -0.926 458 1HB PHE 62 HB2 PHE 62 15.547 -12.146 1.291 459 2HB PHE 62 HB1 PHE 62 14.760 -10.729 1.970 460 HD1 PHE 62 HD1 PHE 62 14.176 -13.853 0.661 461 HD2 PHE 62 HD2 PHE 62 12.715 -9.857 0.387 462 HE1 PHE 62 HE1 PHE 62 12.007 -14.700 -0.137 463 HE2 PHE 62 HE2 PHE 62 10.547 -10.707 -0.401 464 HZ PHE 62 HZ PHE 62 10.190 -13.126 -0.665 465 H LYS 63 HN LYS 63 14.665 -8.860 1.802 466 HA LYS 63 HA LYS 63 13.691 -6.868 1.904 467 1HB LYS 63 HB2 LYS 63 15.093 -6.521 -0.365 468 2HB LYS 63 HB1 LYS 63 13.448 -6.348 -0.921 469 1HG LYS 63 HG2 LYS 63 14.408 -4.888 1.492 470 2HG LYS 63 HG1 LYS 63 14.675 -4.239 -0.124 471 1HD LYS 63 HD2 LYS 63 12.448 -3.813 -0.455 472 2HD LYS 63 HD1 LYS 63 11.933 -5.152 0.577 473 1HE LYS 63 HE2 LYS 63 13.317 -2.780 1.715 474 2HE LYS 63 HE1 LYS 63 11.583 -2.728 1.400 475 1HZ LYS 63 HZ3 LYS 63 11.508 -4.836 2.799 476 2HZ LYS 63 HZ2 LYS 63 13.087 -4.457 3.284 477 3HZ LYS 63 HZ1 LYS 63 11.822 -3.392 3.619 478 HA PRO 64 HA PRO 64 9.508 -8.004 0.963 479 1HB PRO 64 HB2 PRO 64 8.857 -9.061 3.416 480 2HB PRO 64 HB1 PRO 64 9.329 -10.033 2.022 481 1HG PRO 64 HG2 PRO 64 10.761 -9.641 4.485 482 2HG PRO 64 HG1 PRO 64 11.210 -10.657 3.106 483 1HD PRO 64 HD2 PRO 64 12.131 -7.942 3.821 484 2HD PRO 64 HD1 PRO 64 12.915 -9.167 2.798 485 HA PRO 65 HA PRO 65 9.531 -4.049 3.304 486 1HB PRO 65 HB2 PRO 65 7.506 -3.223 1.363 487 2HB PRO 65 HB1 PRO 65 9.099 -2.530 1.673 488 1HG PRO 65 HG2 PRO 65 8.516 -3.891 -0.599 489 2HG PRO 65 HG1 PRO 65 10.134 -3.869 0.125 490 1HD PRO 65 HD2 PRO 65 8.030 -5.996 0.244 491 2HD PRO 65 HD1 PRO 65 9.790 -6.157 0.070 492 H LYS 66 HN LYS 66 8.363 -4.090 5.194 493 HA LYS 66 HA LYS 66 5.655 -5.125 5.097 494 1HB LYS 66 HB2 LYS 66 7.362 -5.421 7.045 495 2HB LYS 66 HB1 LYS 66 6.820 -3.820 7.537 496 1HG LYS 66 HG2 LYS 66 4.886 -6.053 7.019 497 2HG LYS 66 HG1 LYS 66 5.679 -5.855 8.578 498 1HD LYS 66 HD2 LYS 66 4.682 -3.707 8.888 499 2HD LYS 66 HD1 LYS 66 4.058 -3.708 7.234 500 1HE LYS 66 HE2 LYS 66 2.319 -4.256 8.880 501 2HE LYS 66 HE1 LYS 66 2.606 -5.571 7.740 502 1HZ LYS 66 HZ2 LYS 66 3.943 -6.683 9.431 503 2HZ LYS 66 HZ1 LYS 66 3.652 -5.423 10.521 504 3HZ LYS 66 HZ3 LYS 66 2.377 -6.400 9.994 505 H VAL 67 HN VAL 67 4.699 -3.727 3.768 506 HA VAL 67 HA VAL 67 4.586 -0.899 4.445 507 HB VAL 67 HB VAL 67 4.940 -1.281 2.120 508 1HG1 VAL 67 3HG1 VAL 67 4.256 -3.612 2.005 509 2HG1 VAL 67 2HG1 VAL 67 2.565 -3.139 2.164 510 3HG1 VAL 67 1HG1 VAL 67 3.484 -2.668 0.733 511 1HG2 VAL 67 1HG2 VAL 67 3.332 0.487 2.647 512 2HG2 VAL 67 3HG2 VAL 67 2.979 -0.268 1.092 513 3HG2 VAL 67 2HG2 VAL 67 2.013 -0.679 2.510 514 H ALA 68 HN ALA 68 2.961 -0.048 5.534 515 HA ALA 68 HA ALA 68 0.411 -1.481 5.618 516 1HB ALA 68 HB1 ALA 68 1.761 -2.227 7.539 517 2HB ALA 68 HB2 ALA 68 0.286 -1.387 8.024 518 3HB ALA 68 HB3 ALA 68 1.840 -0.554 8.098 519 H PHE 69 HN PHE 69 -1.359 -0.274 5.745 520 HA PHE 69 HA PHE 69 -1.327 2.456 5.250 521 1HB PHE 69 HB2 PHE 69 -3.451 0.514 6.010 522 2HB PHE 69 HB1 PHE 69 -3.822 2.232 6.023 523 HD1 PHE 69 HD1 PHE 69 -4.514 3.265 4.072 524 HD2 PHE 69 HD2 PHE 69 -2.452 -0.449 3.841 525 HE1 PHE 69 HE1 PHE 69 -5.004 3.145 1.659 526 HE2 PHE 69 HE2 PHE 69 -2.931 -0.558 1.429 527 HZ PHE 69 HZ PHE 69 -4.187 1.234 0.343 528 H THR 70 HN THR 70 -1.693 4.236 6.429 529 HA THR 70 HA THR 70 -1.420 4.061 9.327 530 HB THR 70 HB THR 70 -1.699 6.594 7.712 531 HG1 THR 70 HG1 THR 70 0.684 5.066 8.142 532 1HG2 THR 70 3HG2 THR 70 -0.264 5.915 10.280 533 2HG2 THR 70 2HG2 THR 70 -0.238 7.492 9.490 534 3HG2 THR 70 1HG2 THR 70 -1.756 6.845 10.116 535 H THR 71 HN THR 71 -3.752 4.816 6.849 536 HA THR 71 HA THR 71 -5.574 5.942 8.843 537 HB THR 71 HB THR 71 -5.015 7.263 6.745 538 HG1 THR 71 HG1 THR 71 -6.824 8.186 7.312 539 1HG2 THR 71 3HG2 THR 71 -6.802 5.201 5.480 540 2HG2 THR 71 2HG2 THR 71 -6.285 6.715 4.736 541 3HG2 THR 71 1HG2 THR 71 -5.094 5.468 5.119 542 H ARG 72 HN ARG 72 -7.967 5.590 7.783 543 HA ARG 72 HA ARG 72 -8.382 2.749 8.105 544 1HB ARG 72 HB2 ARG 72 -10.871 3.544 8.022 545 2HB ARG 72 HB1 ARG 72 -9.902 3.807 9.457 546 1HG ARG 72 HG2 ARG 72 -9.852 6.008 7.514 547 2HG ARG 72 HG1 ARG 72 -11.413 5.693 8.262 548 1HD ARG 72 HD2 ARG 72 -10.007 7.355 9.494 549 2HD ARG 72 HD1 ARG 72 -10.520 5.969 10.455 550 HE ARG 72 HE ARG 72 -8.134 5.136 9.696 551 1HH1 ARG 72 1HH1 ARG 72 -9.089 8.290 10.884 552 2HH1 ARG 72 2HH1 ARG 72 -7.534 8.637 11.567 553 1HH2 ARG 72 1HH2 ARG 72 -6.096 5.593 10.646 554 2HH2 ARG 72 2HH2 ARG 72 -5.852 7.108 11.447 555 H ILE 73 HN ILE 73 -9.185 1.429 6.645 556 HA ILE 73 HA ILE 73 -10.056 2.275 4.025 557 HB ILE 73 HB ILE 73 -7.764 2.541 3.567 558 1HG1 ILE 73 2HG1 ILE 73 -7.019 0.554 2.213 559 2HG1 ILE 73 1HG1 ILE 73 -8.453 -0.299 2.769 560 1HG2 ILE 73 1HG2 ILE 73 -6.974 1.515 5.700 561 2HG2 ILE 73 3HG2 ILE 73 -7.126 -0.074 4.938 562 3HG2 ILE 73 2HG2 ILE 73 -5.978 1.107 4.303 563 1HD1 ILE 73 3HD1 ILE 73 -8.432 2.280 1.184 564 2HD1 ILE 73 2HD1 ILE 73 -8.695 0.671 0.513 565 3HD1 ILE 73 1HD1 ILE 73 -9.860 1.354 1.652 566 H TYR 74 HN TYR 74 -11.619 0.774 3.526 567 HA TYR 74 HA TYR 74 -11.731 -1.759 4.808 568 1HB TYR 74 HB2 TYR 74 -13.361 -0.308 2.884 569 2HB TYR 74 HB1 TYR 74 -13.229 -2.027 2.497 570 HD1 TYR 74 HD1 TYR 74 -14.378 0.412 5.016 571 HD2 TYR 74 HD2 TYR 74 -14.125 -3.699 3.943 572 HE1 TYR 74 HE1 TYR 74 -16.010 -0.165 6.783 573 HE2 TYR 74 HE2 TYR 74 -15.735 -4.291 5.685 574 HH TYR 74 HH TYR 74 -17.600 -1.932 7.332 575 H HIS 75 HN HIS 75 -10.400 -3.058 4.663 576 HA HIS 75 HA HIS 75 -8.079 -2.670 3.282 577 1HB HIS 75 HB2 HIS 75 -9.012 -5.200 4.626 578 2HB HIS 75 HB1 HIS 75 -7.345 -4.707 4.384 579 HD1 HIS 75 HD1 HIS 75 -9.939 -4.670 6.870 580 HD2 HIS 75 HD2 HIS 75 -6.796 -2.144 5.891 581 HE1 HIS 75 HE1 HIS 75 -9.529 -3.290 8.920 582 HE2 HIS 75 HE2 HIS 75 -7.470 -1.942 8.379 583 HA PRO 76 HA PRO 76 -9.389 -4.952 -0.474 584 1HB PRO 76 HB2 PRO 76 -7.984 -3.477 -2.238 585 2HB PRO 76 HB1 PRO 76 -9.544 -2.938 -1.603 586 1HG PRO 76 HG2 PRO 76 -6.787 -2.107 -0.821 587 2HG PRO 76 HG1 PRO 76 -8.249 -1.119 -0.999 588 1HD PRO 76 HD2 PRO 76 -7.274 -2.008 1.412 589 2HD PRO 76 HD1 PRO 76 -8.969 -1.598 1.111 590 H ASN 77 HN ASN 77 -8.040 -6.482 0.807 591 HA ASN 77 HA ASN 77 -6.421 -8.090 0.818 592 1HB ASN 77 HB2 ASN 77 -5.251 -6.554 -1.516 593 2HB ASN 77 HB1 ASN 77 -4.472 -7.965 -0.806 594 1HD2 ASN 77 1HD2 ASN 77 -5.563 -7.526 -3.482 595 2HD2 ASN 77 2HD2 ASN 77 -6.733 -8.774 -3.723 596 H ILE 78 HN ILE 78 -6.549 -5.359 1.993 597 HA ILE 78 HA ILE 78 -3.940 -5.289 3.202 598 HB ILE 78 HB ILE 78 -6.336 -3.424 3.345 599 1HG1 ILE 78 2HG1 ILE 78 -4.721 -1.747 2.642 600 2HG1 ILE 78 1HG1 ILE 78 -3.488 -2.961 2.654 601 1HG2 ILE 78 1HG2 ILE 78 -5.393 -3.664 5.594 602 2HG2 ILE 78 3HG2 ILE 78 -3.801 -3.255 4.945 603 3HG2 ILE 78 2HG2 ILE 78 -5.100 -2.060 4.915 604 1HD1 ILE 78 1HD1 ILE 78 -5.844 -2.981 0.813 605 2HD1 ILE 78 3HD1 ILE 78 -4.233 -2.402 0.395 606 3HD1 ILE 78 2HD1 ILE 78 -4.486 -4.100 0.800 607 H ASN 79 HN ASN 79 -4.020 -5.371 5.566 608 HA ASN 79 HA ASN 79 -6.102 -7.223 6.486 609 1HB ASN 79 HB2 ASN 79 -4.449 -8.317 7.746 610 2HB ASN 79 HB1 ASN 79 -3.656 -7.884 6.225 611 1HD2 ASN 79 1HD2 ASN 79 -2.164 -6.281 6.216 612 2HD2 ASN 79 2HD2 ASN 79 -1.421 -5.676 7.659 613 H SER 80 HN SER 80 -6.247 -7.176 8.989 614 HA SER 80 HA SER 80 -7.726 -5.196 9.883 615 1HB SER 80 HB2 SER 80 -5.583 -6.452 11.599 616 2HB SER 80 HB1 SER 80 -7.134 -5.798 12.140 617 HG SER 80 HG SER 80 -8.191 -7.444 11.137 618 H ASN 81 HN ASN 81 -4.152 -4.974 10.030 619 HA ASN 81 HA ASN 81 -4.332 -2.292 11.092 620 1HB ASN 81 HB2 ASN 81 -2.514 -3.790 11.795 621 2HB ASN 81 HB1 ASN 81 -1.934 -3.873 10.144 622 1HD2 ASN 81 1HD2 ASN 81 -0.541 -2.366 9.448 623 2HD2 ASN 81 2HD2 ASN 81 -0.072 -0.963 10.343 624 H GLY 82 HN GLY 82 -1.988 -2.824 8.515 625 1HA GLY 82 HA1 GLY 82 -2.495 -0.722 6.994 626 2HA GLY 82 HA2 GLY 82 -3.754 -1.830 6.469 627 H SER 83 HN SER 83 -1.703 -4.053 7.105 628 HA SER 83 HA SER 83 0.289 -3.614 5.033 629 1HB SER 83 HB2 SER 83 0.817 -4.812 7.203 630 2HB SER 83 HB1 SER 83 -0.159 -6.159 6.603 631 HG SER 83 HG SER 83 1.951 -5.068 5.071 632 H ILE 84 HN ILE 84 0.491 -5.984 3.634 633 HA ILE 84 HA ILE 84 -2.074 -6.055 2.301 634 HB ILE 84 HB ILE 84 0.311 -4.654 1.110 635 1HG1 ILE 84 2HG1 ILE 84 -2.473 -3.620 1.530 636 2HG1 ILE 84 1HG1 ILE 84 -1.259 -3.516 2.794 637 1HG2 ILE 84 1HG2 ILE 84 -2.343 -5.319 -0.166 638 2HG2 ILE 84 3HG2 ILE 84 -1.095 -4.297 -0.871 639 3HG2 ILE 84 2HG2 ILE 84 -0.779 -6.008 -0.599 640 1HD1 ILE 84 1HD1 ILE 84 0.181 -2.254 1.242 641 2HD1 ILE 84 3HD1 ILE 84 -1.150 -2.242 0.086 642 3HD1 ILE 84 2HD1 ILE 84 -1.328 -1.444 1.648 643 H CYS 85 HN CYS 85 -2.364 -7.725 0.954 644 HA CYS 85 HA CYS 85 -0.169 -9.597 0.610 645 1HB CYS 85 HB2 CYS 85 -3.143 -9.727 0.393 646 2HB CYS 85 HB1 CYS 85 -2.210 -10.835 -0.614 647 HG CYS 85 HG CYS 85 -2.883 -12.354 1.505 648 H LEU 86 HN LEU 86 1.138 -8.542 -0.881 649 HA LEU 86 HA LEU 86 0.036 -8.464 -3.603 650 1HB LEU 86 HB2 LEU 86 2.135 -6.878 -2.249 651 2HB LEU 86 HB1 LEU 86 2.376 -7.255 -3.937 652 HG LEU 86 HG LEU 86 0.076 -5.712 -2.742 653 1HD1 LEU 86 3HD1 LEU 86 2.171 -4.480 -2.996 654 2HD1 LEU 86 2HD1 LEU 86 2.221 -4.937 -4.700 655 3HD1 LEU 86 1HD1 LEU 86 0.924 -3.899 -4.103 656 1HD2 LEU 86 1HD2 LEU 86 0.513 -6.689 -5.558 657 2HD2 LEU 86 3HD2 LEU 86 -0.857 -7.030 -4.499 658 3HD2 LEU 86 2HD2 LEU 86 -0.611 -5.403 -5.126 659 H ASP 87 HN ASP 87 0.956 -9.589 -5.208 660 HA ASP 87 HA ASP 87 2.363 -11.954 -4.417 661 1HB ASP 87 HB2 ASP 87 0.652 -11.630 -6.340 662 2HB ASP 87 HB1 ASP 87 2.029 -11.041 -7.261 663 H ILE 88 HN ILE 88 3.236 -8.943 -6.077 664 HA ILE 88 HA ILE 88 5.854 -9.658 -6.768 665 HB ILE 88 HB ILE 88 6.366 -7.172 -6.559 666 1HG1 ILE 88 2HG1 ILE 88 3.426 -6.732 -6.551 667 2HG1 ILE 88 1HG1 ILE 88 4.228 -7.005 -5.008 668 1HG2 ILE 88 2HG2 ILE 88 5.934 -8.236 -8.680 669 2HG2 ILE 88 1HG2 ILE 88 4.193 -8.077 -8.429 670 3HG2 ILE 88 3HG2 ILE 88 5.194 -6.638 -8.629 671 1HD1 ILE 88 1HD1 ILE 88 5.824 -5.174 -5.748 672 2HD1 ILE 88 3HD1 ILE 88 4.616 -4.807 -6.983 673 3HD1 ILE 88 2HD1 ILE 88 4.189 -4.707 -5.275 674 H LEU 89 HN LEU 89 4.542 -9.236 -3.699 675 HA LEU 89 HA LEU 89 7.185 -8.563 -2.601 676 1HB LEU 89 HB2 LEU 89 4.498 -8.220 -1.272 677 2HB LEU 89 HB1 LEU 89 6.047 -7.647 -0.679 678 HG LEU 89 HG LEU 89 4.555 -6.647 -3.099 679 1HD1 LEU 89 1HD1 LEU 89 5.266 -5.322 -0.486 680 2HD1 LEU 89 3HD1 LEU 89 4.466 -4.543 -1.850 681 3HD1 LEU 89 2HD1 LEU 89 3.659 -5.850 -0.986 682 1HD2 LEU 89 2HD2 LEU 89 7.283 -5.881 -2.066 683 2HD2 LEU 89 1HD2 LEU 89 6.903 -6.626 -3.621 684 3HD2 LEU 89 3HD2 LEU 89 6.373 -4.981 -3.281 685 H ARG 90 HN ARG 90 4.397 -10.694 -2.304 686 HA ARG 90 HA ARG 90 5.730 -12.159 -0.158 687 1HB ARG 90 HB2 ARG 90 3.619 -13.300 0.173 688 2HB ARG 90 HB1 ARG 90 3.348 -11.565 0.105 689 1HG ARG 90 HG2 ARG 90 2.791 -11.938 -2.364 690 2HG ARG 90 HG1 ARG 90 2.682 -13.646 -1.941 691 1HD ARG 90 HD2 ARG 90 1.144 -11.472 -0.533 692 2HD ARG 90 HD1 ARG 90 0.514 -12.377 -1.906 693 HE ARG 90 HE ARG 90 1.404 -13.848 0.475 694 1HH1 ARG 90 1HH1 ARG 90 -1.170 -12.843 -1.666 695 2HH1 ARG 90 2HH1 ARG 90 -2.362 -13.890 -0.963 696 1HH2 ARG 90 1HH2 ARG 90 -0.161 -15.254 1.406 697 2HH2 ARG 90 2HH2 ARG 90 -1.773 -15.275 0.771 698 H SER 91 HN SER 91 5.152 -12.418 -3.559 699 HA SER 91 HA SER 91 5.923 -15.253 -3.438 700 1HB SER 91 HB2 SER 91 4.258 -14.040 -5.626 701 2HB SER 91 HB1 SER 91 4.496 -15.747 -5.256 702 HG SER 91 HG SER 91 2.455 -14.667 -4.549 703 H GLN 92 HN GLN 92 6.298 -12.222 -5.245 704 HA GLN 92 HA GLN 92 8.146 -13.628 -7.057 705 1HB GLN 92 HB2 GLN 92 6.295 -11.315 -7.568 706 2HB GLN 92 HB1 GLN 92 7.471 -11.927 -8.731 707 1HG GLN 92 HG2 GLN 92 6.332 -14.186 -8.245 708 2HG GLN 92 HG1 GLN 92 4.995 -13.175 -7.695 709 1HE2 GLN 92 1HE2 GLN 92 3.922 -11.867 -9.134 710 2HE2 GLN 92 2HE2 GLN 92 4.020 -12.082 -10.850 711 H TRP 93 HN TRP 93 8.491 -11.617 -4.570 712 HA TRP 93 HA TRP 93 9.875 -9.460 -5.739 713 1HB TRP 93 HB2 TRP 93 9.078 -9.249 -3.502 714 2HB TRP 93 HB1 TRP 93 10.054 -10.617 -2.976 715 HD1 TRP 93 HD1 TRP 93 12.773 -10.121 -2.877 716 HE1 TRP 93 HE1 TRP 93 14.072 -7.919 -2.594 717 HE3 TRP 93 HE3 TRP 93 9.023 -6.804 -3.896 718 HZ2 TRP 93 HZ2 TRP 93 13.587 -5.175 -2.762 719 HZ3 TRP 93 HZ3 TRP 93 9.547 -4.402 -3.812 720 HH2 TRP 93 HH2 TRP 93 11.774 -3.603 -3.243 721 H SER 94 HN SER 94 11.937 -9.107 -6.127 722 HA SER 94 HA SER 94 14.036 -10.959 -5.508 723 1HB SER 94 HB2 SER 94 13.338 -10.326 -8.398 724 2HB SER 94 HB1 SER 94 14.683 -11.309 -7.841 725 HG SER 94 HG SER 94 12.396 -12.261 -6.809 726 HA PRO 95 HA PRO 95 16.367 -7.072 -5.873 727 1HB PRO 95 HB2 PRO 95 18.239 -8.286 -7.825 728 2HB PRO 95 HB1 PRO 95 18.578 -7.549 -6.254 729 1HG PRO 95 HG2 PRO 95 18.723 -10.197 -6.597 730 2HG PRO 95 HG1 PRO 95 18.093 -9.500 -5.093 731 1HD PRO 95 HD2 PRO 95 16.596 -10.683 -7.405 732 2HD PRO 95 HD1 PRO 95 16.297 -10.862 -5.663 733 H ALA 96 HN ALA 96 14.301 -6.583 -7.183 734 HA ALA 96 HA ALA 96 14.964 -5.440 -9.730 735 1HB ALA 96 HB2 ALA 96 13.124 -7.829 -9.751 736 2HB ALA 96 HB1 ALA 96 13.522 -6.805 -11.130 737 3HB ALA 96 HB3 ALA 96 14.771 -7.796 -10.377 738 H LEU 97 HN LEU 97 12.697 -5.987 -7.139 739 HA LEU 97 HA LEU 97 10.649 -4.368 -8.443 740 1HB LEU 97 HB2 LEU 97 10.753 -5.877 -5.847 741 2HB LEU 97 HB1 LEU 97 9.455 -4.769 -6.226 742 HG LEU 97 HG LEU 97 8.737 -7.027 -6.629 743 1HD1 LEU 97 1HD1 LEU 97 7.922 -5.266 -8.087 744 2HD1 LEU 97 3HD1 LEU 97 9.208 -5.621 -9.238 745 3HD1 LEU 97 2HD1 LEU 97 7.973 -6.832 -8.894 746 1HD2 LEU 97 3HD2 LEU 97 10.927 -8.054 -7.022 747 2HD2 LEU 97 2HD2 LEU 97 9.770 -8.467 -8.287 748 3HD2 LEU 97 1HD2 LEU 97 11.013 -7.254 -8.588 749 H THR 98 HN THR 98 9.905 -2.387 -7.551 750 HA THR 98 HA THR 98 11.539 -1.241 -5.388 751 HB THR 98 HB THR 98 11.275 0.997 -6.565 752 HG1 THR 98 HG1 THR 98 10.973 0.780 -8.894 753 1HG2 THR 98 3HG2 THR 98 13.414 -0.206 -6.549 754 2HG2 THR 98 2HG2 THR 98 12.921 -1.099 -7.989 755 3HG2 THR 98 1HG2 THR 98 13.169 0.645 -8.078 756 H ILE 99 HN ILE 99 10.390 0.354 -4.134 757 HA ILE 99 HA ILE 99 7.646 -0.297 -3.733 758 HB ILE 99 HB ILE 99 8.354 2.294 -2.613 759 1HG1 ILE 99 2HG1 ILE 99 10.626 1.232 -2.719 760 2HG1 ILE 99 1HG1 ILE 99 10.065 1.547 -1.094 761 1HG2 ILE 99 2HG2 ILE 99 6.475 0.951 -1.866 762 2HG2 ILE 99 1HG2 ILE 99 7.564 -0.339 -1.367 763 3HG2 ILE 99 3HG2 ILE 99 7.607 1.221 -0.546 764 1HD1 ILE 99 3HD1 ILE 99 9.415 -0.813 -0.865 765 2HD1 ILE 99 2HD1 ILE 99 10.061 -1.117 -2.475 766 3HD1 ILE 99 1HD1 ILE 99 11.137 -0.604 -1.178 767 H SER 100 HN SER 100 9.436 2.207 -5.285 768 HA SER 100 HA SER 100 7.650 3.899 -6.335 769 1HB SER 100 HB2 SER 100 10.071 3.760 -6.892 770 2HB SER 100 HB1 SER 100 9.731 2.359 -7.908 771 HG SER 100 HG SER 100 9.831 4.661 -8.833 772 H LYS 101 HN LYS 101 8.130 0.524 -7.404 773 HA LYS 101 HA LYS 101 5.748 0.651 -9.025 774 1HB LYS 101 HB2 LYS 101 6.384 -1.332 -9.984 775 2HB LYS 101 HB1 LYS 101 7.941 -0.689 -9.501 776 1HG LYS 101 HG2 LYS 101 8.080 -2.911 -8.901 777 2HG LYS 101 HG1 LYS 101 7.628 -2.128 -7.385 778 1HD LYS 101 HD2 LYS 101 6.157 -3.886 -7.420 779 2HD LYS 101 HD1 LYS 101 5.200 -2.618 -8.188 780 1HE LYS 101 HE2 LYS 101 6.369 -3.679 -10.354 781 2HE LYS 101 HE1 LYS 101 6.346 -5.103 -9.306 782 1HZ LYS 101 HZ2 LYS 101 3.944 -4.730 -8.995 783 2HZ LYS 101 HZ1 LYS 101 3.999 -3.460 -10.107 784 3HZ LYS 101 HZ3 LYS 101 4.346 -5.037 -10.606 785 H VAL 102 HN VAL 102 6.632 -0.822 -5.869 786 HA VAL 102 HA VAL 102 4.293 -2.443 -5.843 787 HB VAL 102 HB VAL 102 4.960 -3.340 -3.898 788 1HG1 VAL 102 1HG1 VAL 102 7.465 -1.963 -4.783 789 2HG1 VAL 102 3HG1 VAL 102 7.410 -3.265 -3.598 790 3HG1 VAL 102 2HG1 VAL 102 6.882 -3.557 -5.253 791 1HG2 VAL 102 3HG2 VAL 102 5.811 -0.618 -2.971 792 2HG2 VAL 102 2HG2 VAL 102 4.488 -1.617 -2.376 793 3HG2 VAL 102 1HG2 VAL 102 6.155 -2.092 -2.063 794 H LEU 103 HN LEU 103 5.004 0.765 -4.598 795 HA LEU 103 HA LEU 103 2.658 1.105 -3.089 796 1HB LEU 103 HB2 LEU 103 4.344 3.120 -4.581 797 2HB LEU 103 HB1 LEU 103 3.006 3.564 -3.540 798 HG LEU 103 HG LEU 103 5.667 2.356 -2.755 799 1HD1 LEU 103 2HD1 LEU 103 5.585 4.750 -3.071 800 2HD1 LEU 103 1HD1 LEU 103 4.212 4.876 -1.974 801 3HD1 LEU 103 3HD1 LEU 103 5.784 4.355 -1.365 802 1HD2 LEU 103 1HD2 LEU 103 3.888 1.179 -1.500 803 2HD2 LEU 103 3HD2 LEU 103 4.840 2.233 -0.456 804 3HD2 LEU 103 2HD2 LEU 103 3.232 2.734 -0.974 805 H LEU 104 HN LEU 104 3.408 1.629 -6.488 806 HA LEU 104 HA LEU 104 0.890 2.746 -7.148 807 1HB LEU 104 HB2 LEU 104 3.050 1.521 -8.830 808 2HB LEU 104 HB1 LEU 104 1.564 2.166 -9.507 809 HG LEU 104 HG LEU 104 3.397 3.844 -7.808 810 1HD1 LEU 104 1HD1 LEU 104 3.346 3.529 -10.800 811 2HD1 LEU 104 3HD1 LEU 104 4.256 4.752 -9.914 812 3HD1 LEU 104 2HD1 LEU 104 4.656 3.045 -9.723 813 1HD2 LEU 104 2HD2 LEU 104 1.250 4.525 -9.806 814 2HD2 LEU 104 1HD2 LEU 104 1.110 4.640 -8.052 815 3HD2 LEU 104 3HD2 LEU 104 2.242 5.679 -8.916 816 H SER 105 HN SER 105 2.176 -0.526 -7.089 817 HA SER 105 HA SER 105 -0.119 -1.731 -8.258 818 1HB SER 105 HB2 SER 105 1.885 -3.014 -6.401 819 2HB SER 105 HB1 SER 105 0.791 -3.836 -7.509 820 HG SER 105 HG SER 105 2.090 -2.160 -9.005 821 H ILE 106 HN ILE 106 0.822 -0.997 -4.911 822 HA ILE 106 HA ILE 106 -1.460 -2.182 -3.702 823 HB ILE 106 HB ILE 106 0.338 0.062 -2.799 824 1HG1 ILE 106 2HG1 ILE 106 0.040 -2.744 -1.696 825 2HG1 ILE 106 1HG1 ILE 106 1.252 -2.277 -2.885 826 1HG2 ILE 106 1HG2 ILE 106 -1.974 -1.191 -1.331 827 2HG2 ILE 106 3HG2 ILE 106 -0.749 -0.166 -0.581 828 3HG2 ILE 106 2HG2 ILE 106 -1.805 0.492 -1.831 829 1HD1 ILE 106 1HD1 ILE 106 0.995 -1.075 -0.130 830 2HD1 ILE 106 3HD1 ILE 106 2.135 -2.337 -0.594 831 3HD1 ILE 106 2HD1 ILE 106 2.254 -0.735 -1.318 832 H CYS 107 HN CYS 107 -0.694 1.046 -4.831 833 HA CYS 107 HA CYS 107 -3.119 2.342 -4.498 834 1HB CYS 107 HB2 CYS 107 -1.175 3.504 -5.236 835 2HB CYS 107 HB1 CYS 107 -1.022 2.487 -6.659 836 HG CYS 107 HG CYS 107 -2.168 4.176 -8.178 837 H SER 108 HN SER 108 -2.119 -0.059 -6.847 838 HA SER 108 HA SER 108 -4.438 0.222 -8.494 839 1HB SER 108 HB2 SER 108 -2.417 -2.012 -8.375 840 2HB SER 108 HB1 SER 108 -3.652 -1.811 -9.618 841 HG SER 108 HG SER 108 -1.631 0.103 -9.019 842 H LEU 109 HN LEU 109 -3.827 -1.294 -5.509 843 HA LEU 109 HA LEU 109 -5.933 -3.277 -5.848 844 1HB LEU 109 HB2 LEU 109 -4.491 -2.494 -3.303 845 2HB LEU 109 HB1 LEU 109 -5.381 -3.976 -3.599 846 HG LEU 109 HG LEU 109 -2.854 -3.241 -5.078 847 1HD1 LEU 109 2HD1 LEU 109 -2.494 -3.509 -2.626 848 2HD1 LEU 109 1HD1 LEU 109 -3.115 -5.153 -2.769 849 3HD1 LEU 109 3HD1 LEU 109 -1.643 -4.687 -3.625 850 1HD2 LEU 109 1HD2 LEU 109 -4.379 -5.830 -4.812 851 2HD2 LEU 109 3HD2 LEU 109 -4.281 -4.817 -6.253 852 3HD2 LEU 109 2HD2 LEU 109 -2.839 -5.630 -5.645 853 H LEU 110 HN LEU 110 -5.295 -0.176 -4.500 854 HA LEU 110 HA LEU 110 -7.879 0.273 -3.368 855 1HB LEU 110 HB2 LEU 110 -5.421 1.824 -3.917 856 2HB LEU 110 HB1 LEU 110 -6.881 2.787 -3.830 857 HG LEU 110 HG LEU 110 -7.262 1.967 -1.562 858 1HD1 LEU 110 1HD1 LEU 110 -6.316 -0.295 -1.921 859 2HD1 LEU 110 3HD1 LEU 110 -4.703 0.415 -1.839 860 3HD1 LEU 110 2HD1 LEU 110 -5.771 0.477 -0.436 861 1HD2 LEU 110 2HD2 LEU 110 -5.735 3.898 -1.989 862 2HD2 LEU 110 1HD2 LEU 110 -5.450 3.056 -0.464 863 3HD2 LEU 110 3HD2 LEU 110 -4.385 2.773 -1.838 864 H CYS 111 HN CYS 111 -6.422 0.463 -6.460 865 HA CYS 111 HA CYS 111 -8.463 2.156 -7.574 866 1HB CYS 111 HB2 CYS 111 -6.096 2.499 -8.100 867 2HB CYS 111 HB1 CYS 111 -6.045 0.900 -8.845 868 HG CYS 111 HG CYS 111 -7.757 3.641 -9.989 869 H ASP 112 HN ASP 112 -7.111 -1.049 -8.298 870 HA ASP 112 HA ASP 112 -9.117 -1.470 -10.366 871 1HB ASP 112 HB2 ASP 112 -6.653 -1.725 -10.778 872 2HB ASP 112 HB1 ASP 112 -6.702 -3.162 -9.768 873 HA PRO 113 HA PRO 113 -9.132 -4.314 -5.978 874 1HB PRO 113 HB2 PRO 113 -11.938 -4.096 -7.034 875 2HB PRO 113 HB1 PRO 113 -11.397 -4.435 -5.381 876 1HG PRO 113 HG2 PRO 113 -11.929 -1.894 -6.370 877 2HG PRO 113 HG1 PRO 113 -10.903 -2.238 -4.965 878 1HD PRO 113 HD2 PRO 113 -10.063 -1.073 -7.399 879 2HD PRO 113 HD1 PRO 113 -9.005 -1.729 -6.130 880 H ASN 114 HN ASN 114 -8.095 -6.051 -6.563 881 HA ASN 114 HA ASN 114 -9.041 -7.791 -8.698 882 1HB ASN 114 HB2 ASN 114 -6.973 -9.018 -8.356 883 2HB ASN 114 HB1 ASN 114 -6.612 -7.295 -8.428 884 1HD2 ASN 114 1HD2 ASN 114 -6.238 -10.147 -6.652 885 2HD2 ASN 114 2HD2 ASN 114 -5.569 -9.442 -5.216 886 HA PRO 115 HA PRO 115 -11.290 -10.167 -5.685 887 1HB PRO 115 HB2 PRO 115 -12.526 -11.833 -7.351 888 2HB PRO 115 HB1 PRO 115 -12.867 -10.096 -7.391 889 1HG PRO 115 HG2 PRO 115 -11.153 -11.735 -9.216 890 2HG PRO 115 HG1 PRO 115 -12.271 -10.418 -9.610 891 1HD PRO 115 HD2 PRO 115 -9.516 -10.153 -9.344 892 2HD PRO 115 HD1 PRO 115 -10.689 -8.825 -9.251 893 H ASP 116 HN ASP 116 -8.435 -10.987 -6.506 894 HA ASP 116 HA ASP 116 -8.534 -13.841 -6.802 895 1HB ASP 116 HB2 ASP 116 -6.160 -12.062 -6.231 896 2HB ASP 116 HB1 ASP 116 -6.095 -13.745 -6.743 897 H ASP 117 HN ASP 117 -6.887 -11.861 -4.347 898 HA ASP 117 HA ASP 117 -6.559 -14.306 -2.801 899 1HB ASP 117 HB2 ASP 117 -4.700 -12.617 -3.505 900 2HB ASP 117 HB1 ASP 117 -5.277 -11.685 -2.125 901 HA PRO 118 HA PRO 118 -9.000 -12.499 0.528 902 1HB PRO 118 HB2 PRO 118 -9.309 -14.789 1.924 903 2HB PRO 118 HB1 PRO 118 -10.174 -14.484 0.416 904 1HG PRO 118 HG2 PRO 118 -8.034 -16.393 0.950 905 2HG PRO 118 HG1 PRO 118 -9.102 -16.282 -0.458 906 1HD PRO 118 HD2 PRO 118 -6.365 -15.260 -0.110 907 2HD PRO 118 HD1 PRO 118 -7.295 -15.502 -1.605 908 H LEU 119 HN LEU 119 -7.429 -11.147 1.593 909 HA LEU 119 HA LEU 119 -5.424 -12.354 3.272 910 1HB LEU 119 HB2 LEU 119 -5.511 -9.915 2.155 911 2HB LEU 119 HB1 LEU 119 -6.202 -9.518 3.718 912 HG LEU 119 HG LEU 119 -3.500 -10.792 3.263 913 1HD1 LEU 119 1HD1 LEU 119 -3.558 -8.450 2.618 914 2HD1 LEU 119 3HD1 LEU 119 -4.230 -8.024 4.191 915 3HD1 LEU 119 2HD1 LEU 119 -2.599 -8.686 4.079 916 1HD2 LEU 119 3HD2 LEU 119 -4.520 -11.549 5.354 917 2HD2 LEU 119 2HD2 LEU 119 -3.142 -10.491 5.649 918 3HD2 LEU 119 1HD2 LEU 119 -4.782 -9.872 5.830 919 H VAL 120 HN VAL 120 -8.081 -10.135 4.104 920 HA VAL 120 HA VAL 120 -8.237 -11.378 6.752 921 HB VAL 120 HB VAL 120 -9.848 -9.030 5.739 922 1HG1 VAL 120 3HG1 VAL 120 -9.094 -10.013 8.503 923 2HG1 VAL 120 2HG1 VAL 120 -9.930 -8.494 8.180 924 3HG1 VAL 120 1HG1 VAL 120 -10.699 -10.030 7.772 925 1HG2 VAL 120 3HG2 VAL 120 -7.152 -9.000 7.101 926 2HG2 VAL 120 2HG2 VAL 120 -7.510 -8.478 5.452 927 3HG2 VAL 120 1HG2 VAL 120 -8.174 -7.588 6.825 928 HA PRO 121 HA PRO 121 -11.597 -14.138 5.712 929 1HB PRO 121 HB2 PRO 121 -12.477 -13.221 8.431 930 2HB PRO 121 HB1 PRO 121 -12.444 -14.855 7.753 931 1HG PRO 121 HG2 PRO 121 -10.538 -14.051 9.422 932 2HG PRO 121 HG1 PRO 121 -10.152 -15.066 8.019 933 1HD PRO 121 HD2 PRO 121 -9.616 -12.180 8.466 934 2HD PRO 121 HD1 PRO 121 -8.726 -13.354 7.480 935 H GLU 122 HN GLU 122 -12.494 -11.120 7.448 936 HA GLU 122 HA GLU 122 -15.040 -11.083 6.067 937 1HB GLU 122 HB2 GLU 122 -15.171 -8.758 7.258 938 2HB GLU 122 HB1 GLU 122 -15.418 -10.251 8.160 939 1HG GLU 122 HG2 GLU 122 -12.691 -9.043 7.987 940 2HG GLU 122 HG1 GLU 122 -13.881 -8.400 9.125 941 H ILE 123 HN ILE 123 -12.047 -9.120 6.001 942 HA ILE 123 HA ILE 123 -13.358 -7.170 4.367 943 HB ILE 123 HB ILE 123 -10.401 -7.224 4.273 944 1HG1 ILE 123 2HG1 ILE 123 -10.847 -7.804 6.638 945 2HG1 ILE 123 1HG1 ILE 123 -10.148 -6.202 6.451 946 1HG2 ILE 123 2HG2 ILE 123 -12.554 -5.168 4.601 947 2HG2 ILE 123 1HG2 ILE 123 -10.832 -4.810 4.642 948 3HG2 ILE 123 3HG2 ILE 123 -11.544 -5.482 3.185 949 1HD1 ILE 123 1HD1 ILE 123 -13.040 -6.835 6.860 950 2HD1 ILE 123 3HD1 ILE 123 -11.924 -6.233 8.088 951 3HD1 ILE 123 2HD1 ILE 123 -12.336 -5.220 6.699 952 H ALA 124 HN ALA 124 -11.698 -10.097 3.822 953 HA ALA 124 HA ALA 124 -11.175 -9.718 1.054 954 1HB ALA 124 HB2 ALA 124 -11.744 -12.262 2.572 955 2HB ALA 124 HB1 ALA 124 -11.139 -12.179 0.916 956 3HB ALA 124 HB3 ALA 124 -10.156 -11.567 2.246 957 H ARG 125 HN ARG 125 -14.000 -10.713 2.924 958 HA ARG 125 HA ARG 125 -15.430 -11.707 0.656 959 1HB ARG 125 HB2 ARG 125 -17.205 -12.131 2.079 960 2HB ARG 125 HB1 ARG 125 -15.858 -12.167 3.204 961 1HG ARG 125 HG2 ARG 125 -16.789 -10.562 4.398 962 2HG ARG 125 HG1 ARG 125 -16.801 -9.497 3.012 963 1HD ARG 125 HD2 ARG 125 -19.025 -9.682 3.826 964 2HD ARG 125 HD1 ARG 125 -18.910 -10.488 2.266 965 HE ARG 125 HE ARG 125 -18.531 -12.400 4.260 966 1HH1 ARG 125 1HH1 ARG 125 -21.026 -10.308 2.986 967 2HH1 ARG 125 2HH1 ARG 125 -22.331 -11.318 3.538 968 1HH2 ARG 125 1HH2 ARG 125 -20.246 -13.729 4.999 969 2HH2 ARG 125 2HH2 ARG 125 -21.886 -13.261 4.679 970 H ILE 126 HN ILE 126 -15.476 -8.741 2.546 971 HA ILE 126 HA ILE 126 -17.538 -7.547 1.044 972 HB ILE 126 HB ILE 126 -16.895 -5.464 2.164 973 1HG1 ILE 126 2HG1 ILE 126 -15.056 -5.857 4.018 974 2HG1 ILE 126 1HG1 ILE 126 -14.479 -7.065 2.871 975 1HG2 ILE 126 1HG2 ILE 126 -18.310 -7.139 3.313 976 2HG2 ILE 126 3HG2 ILE 126 -16.859 -7.789 4.077 977 3HG2 ILE 126 2HG2 ILE 126 -17.374 -6.140 4.423 978 1HD1 ILE 126 2HD1 ILE 126 -14.885 -4.151 2.255 979 2HD1 ILE 126 1HD1 ILE 126 -13.337 -4.923 2.608 980 3HD1 ILE 126 3HD1 ILE 126 -14.239 -5.376 1.163 981 H TYR 127 HN TYR 127 -14.265 -8.045 0.554 982 HA TYR 127 HA TYR 127 -13.857 -5.788 -1.172 983 1HB TYR 127 HB2 TYR 127 -12.024 -6.570 0.186 984 2HB TYR 127 HB1 TYR 127 -12.147 -8.175 -0.510 985 HD1 TYR 127 HD1 TYR 127 -10.178 -8.602 -1.575 986 HD2 TYR 127 HD2 TYR 127 -12.009 -4.806 -2.128 987 HE1 TYR 127 HE1 TYR 127 -8.443 -8.012 -3.205 988 HE2 TYR 127 HE2 TYR 127 -10.274 -4.207 -3.765 989 HH TYR 127 HH TYR 127 -7.891 -6.552 -4.845 990 H LYS 128 HN LYS 128 -14.499 -9.179 -1.508 991 HA LYS 128 HA LYS 128 -14.469 -8.875 -4.428 992 1HB LYS 128 HB2 LYS 128 -14.028 -11.269 -4.536 993 2HB LYS 128 HB1 LYS 128 -12.812 -10.447 -3.570 994 1HG LYS 128 HG2 LYS 128 -14.462 -11.156 -1.608 995 2HG LYS 128 HG1 LYS 128 -14.856 -12.430 -2.766 996 1HD LYS 128 HD2 LYS 128 -12.120 -11.748 -1.675 997 2HD LYS 128 HD1 LYS 128 -13.084 -13.176 -1.293 998 1HE LYS 128 HE2 LYS 128 -12.906 -13.947 -3.586 999 2HE LYS 128 HE1 LYS 128 -12.034 -12.484 -4.040 1000 1HZ LYS 128 HZ1 LYS 128 -10.284 -13.172 -2.442 1001 2HZ LYS 128 HZ3 LYS 128 -11.103 -14.638 -2.222 1002 3HZ LYS 128 HZ2 LYS 128 -10.469 -14.241 -3.739 1003 H THR 129 HN THR 129 -16.646 -8.444 -2.273 1004 HA THR 129 HA THR 129 -18.751 -9.872 -3.620 1005 HB THR 129 HB THR 129 -18.073 -10.430 -0.752 1006 HG1 THR 129 HG1 THR 129 -17.389 -11.645 -2.984 1007 1HG2 THR 129 1HG2 THR 129 -20.509 -10.160 -0.996 1008 2HG2 THR 129 3HG2 THR 129 -20.514 -11.332 -2.308 1009 3HG2 THR 129 2HG2 THR 129 -20.088 -11.842 -0.673 1010 H ASP 130 HN ASP 130 -18.549 -8.432 -0.340 1011 HA ASP 130 HA ASP 130 -20.878 -6.845 -0.979 1012 1HB ASP 130 HB2 ASP 130 -19.147 -6.961 1.503 1013 2HB ASP 130 HB1 ASP 130 -20.431 -5.789 1.294 1014 H ARG 131 HN ARG 131 -19.603 -5.982 -2.867 1015 HA ARG 131 HA ARG 131 -17.383 -4.422 -2.678 1016 1HB ARG 131 HB2 ARG 131 -18.116 -3.256 -4.716 1017 2HB ARG 131 HB1 ARG 131 -18.372 -4.990 -4.830 1018 1HG ARG 131 HG2 ARG 131 -20.715 -4.744 -4.524 1019 2HG ARG 131 HG1 ARG 131 -20.539 -3.043 -4.087 1020 1HD ARG 131 HD2 ARG 131 -19.925 -4.253 -6.784 1021 2HD ARG 131 HD1 ARG 131 -21.352 -3.300 -6.378 1022 HE ARG 131 HE ARG 131 -19.133 -1.751 -5.745 1023 1HH1 ARG 131 1HH1 ARG 131 -20.611 -3.141 -8.580 1024 2HH1 ARG 131 2HH1 ARG 131 -19.975 -1.949 -9.667 1025 1HH2 ARG 131 1HH2 ARG 131 -18.337 -0.127 -7.143 1026 2HH2 ARG 131 2HH2 ARG 131 -18.699 -0.207 -8.838 1027 H GLU 132 HN GLU 132 -20.696 -3.472 -2.074 1028 HA GLU 132 HA GLU 132 -20.472 -0.768 -1.728 1029 1HB GLU 132 HB2 GLU 132 -22.282 -1.098 0.051 1030 2HB GLU 132 HB1 GLU 132 -22.636 -1.689 -1.569 1031 1HG GLU 132 HG2 GLU 132 -22.220 -3.945 -0.908 1032 2HG GLU 132 HG1 GLU 132 -21.555 -3.431 0.639 1033 H LYS 133 HN LYS 133 -19.719 -3.302 0.549 1034 HA LYS 133 HA LYS 133 -19.359 -1.784 2.833 1035 1HB LYS 133 HB2 LYS 133 -18.932 -4.492 2.052 1036 2HB LYS 133 HB1 LYS 133 -17.500 -3.904 2.904 1037 1HG LYS 133 HG2 LYS 133 -19.095 -4.928 4.447 1038 2HG LYS 133 HG1 LYS 133 -18.845 -3.220 4.801 1039 1HD LYS 133 HD2 LYS 133 -21.107 -3.211 4.917 1040 2HD LYS 133 HD1 LYS 133 -20.979 -3.043 3.165 1041 1HE LYS 133 HE2 LYS 133 -21.228 -5.459 2.911 1042 2HE LYS 133 HE1 LYS 133 -21.312 -5.647 4.659 1043 1HZ LYS 133 HZ1 LYS 133 -23.266 -4.136 2.992 1044 2HZ LYS 133 HZ3 LYS 133 -23.501 -5.691 3.627 1045 3HZ LYS 133 HZ2 LYS 133 -23.351 -4.373 4.669 1046 H TYR 134 HN TYR 134 -16.901 -2.687 0.370 1047 HA TYR 134 HA TYR 134 -15.029 -1.031 1.755 1048 1HB TYR 134 HB2 TYR 134 -13.407 -1.939 0.408 1049 2HB TYR 134 HB1 TYR 134 -14.517 -3.241 0.638 1050 HD1 TYR 134 HD1 TYR 134 -13.024 -0.975 -1.794 1051 HD2 TYR 134 HD2 TYR 134 -15.790 -4.147 -1.215 1052 HE1 TYR 134 HE1 TYR 134 -13.012 -1.419 -4.209 1053 HE2 TYR 134 HE2 TYR 134 -15.790 -4.591 -3.635 1054 HH TYR 134 HH TYR 134 -13.517 -3.391 -5.733 1055 H ASN 135 HN ASN 135 -17.056 -0.816 -1.083 1056 HA ASN 135 HA ASN 135 -15.730 1.221 -2.414 1057 1HB ASN 135 HB2 ASN 135 -18.600 0.370 -2.340 1058 2HB ASN 135 HB1 ASN 135 -18.144 1.809 -3.221 1059 1HD2 ASN 135 1HD2 ASN 135 -16.371 -1.205 -2.876 1060 2HD2 ASN 135 2HD2 ASN 135 -16.350 -1.585 -4.574 1061 H ARG 136 HN ARG 136 -18.590 1.684 -0.288 1062 HA ARG 136 HA ARG 136 -18.265 4.520 -0.732 1063 1HB ARG 136 HB2 ARG 136 -20.525 3.515 -0.681 1064 2HB ARG 136 HB1 ARG 136 -20.292 3.137 1.023 1065 1HG ARG 136 HG2 ARG 136 -20.196 5.425 1.620 1066 2HG ARG 136 HG1 ARG 136 -20.102 5.933 -0.064 1067 1HD ARG 136 HD2 ARG 136 -22.320 6.292 0.225 1068 2HD ARG 136 HD1 ARG 136 -22.422 4.564 -0.107 1069 HE ARG 136 HE ARG 136 -22.089 5.316 2.676 1070 1HH1 ARG 136 1HH1 ARG 136 -24.300 4.408 0.115 1071 2HH1 ARG 136 2HH1 ARG 136 -25.588 3.989 1.199 1072 1HH2 ARG 136 1HH2 ARG 136 -23.784 4.766 4.113 1073 2HH2 ARG 136 2HH2 ARG 136 -25.300 4.207 3.480 1074 H ILE 137 HN ILE 137 -17.217 2.311 1.633 1075 HA ILE 137 HA ILE 137 -17.395 4.207 3.812 1076 HB ILE 137 HB ILE 137 -16.056 1.503 3.922 1077 1HG1 ILE 137 2HG1 ILE 137 -18.248 0.998 3.088 1078 2HG1 ILE 137 1HG1 ILE 137 -18.276 0.677 4.817 1079 1HG2 ILE 137 2HG2 ILE 137 -15.690 3.041 5.797 1080 2HG2 ILE 137 1HG2 ILE 137 -17.434 3.194 6.015 1081 3HG2 ILE 137 3HG2 ILE 137 -16.644 1.643 6.286 1082 1HD1 ILE 137 2HD1 ILE 137 -19.405 2.815 5.189 1083 2HD1 ILE 137 1HD1 ILE 137 -19.397 3.113 3.450 1084 3HD1 ILE 137 3HD1 ILE 137 -20.316 1.761 4.110 1085 H ALA 138 HN ALA 138 -14.879 2.356 2.122 1086 HA ALA 138 HA ALA 138 -12.722 3.878 3.039 1087 1HB ALA 138 HB2 ALA 138 -12.527 1.671 2.056 1088 2HB ALA 138 HB1 ALA 138 -13.056 2.306 0.490 1089 3HB ALA 138 HB3 ALA 138 -11.519 2.838 1.193 1090 H ARG 139 HN ARG 139 -15.081 4.419 0.515 1091 HA ARG 139 HA ARG 139 -13.665 6.553 -0.778 1092 1HB ARG 139 HB2 ARG 139 -15.295 5.394 -2.086 1093 2HB ARG 139 HB1 ARG 139 -16.545 5.627 -0.876 1094 1HG ARG 139 HG2 ARG 139 -16.942 7.055 -2.777 1095 2HG ARG 139 HG1 ARG 139 -16.553 8.037 -1.362 1096 1HD ARG 139 HD2 ARG 139 -14.307 8.377 -2.159 1097 2HD ARG 139 HD1 ARG 139 -14.567 7.252 -3.492 1098 HE ARG 139 HE ARG 139 -15.894 9.880 -3.237 1099 1HH1 ARG 139 1HH1 ARG 139 -14.693 7.230 -5.164 1100 2HH1 ARG 139 2HH1 ARG 139 -14.917 8.049 -6.678 1101 1HH2 ARG 139 1HH2 ARG 139 -16.221 10.971 -5.248 1102 2HH2 ARG 139 2HH2 ARG 139 -15.785 10.172 -6.726 1103 H GLU 140 HN GLU 140 -16.011 6.333 1.915 1104 HA GLU 140 HA GLU 140 -16.210 9.203 2.042 1105 1HB GLU 140 HB2 GLU 140 -17.246 8.905 4.212 1106 2HB GLU 140 HB1 GLU 140 -18.033 7.901 3.022 1107 1HG GLU 140 HG2 GLU 140 -16.855 5.972 3.900 1108 2HG GLU 140 HG1 GLU 140 -16.022 7.009 5.059 1109 H TRP 141 HN TRP 141 -14.427 6.653 3.660 1110 HA TRP 141 HA TRP 141 -12.902 8.176 5.355 1111 1HB TRP 141 HB2 TRP 141 -12.139 5.708 3.805 1112 2HB TRP 141 HB1 TRP 141 -11.085 6.448 5.010 1113 HD1 TRP 141 HD1 TRP 141 -13.795 7.177 6.882 1114 HE1 TRP 141 HE1 TRP 141 -14.693 5.270 8.357 1115 HE3 TRP 141 HE3 TRP 141 -11.628 3.232 4.503 1116 HZ2 TRP 141 HZ2 TRP 141 -14.502 2.441 8.464 1117 HZ3 TRP 141 HZ3 TRP 141 -12.034 0.973 5.360 1118 HH2 TRP 141 HH2 TRP 141 -13.437 0.589 7.307 1119 H THR 142 HN THR 142 -12.575 7.851 1.842 1120 HA THR 142 HA THR 142 -10.194 9.396 1.798 1121 HB THR 142 HB THR 142 -10.527 9.799 -0.546 1122 HG1 THR 142 HG1 THR 142 -12.450 9.853 -1.416 1123 1HG2 THR 142 2HG2 THR 142 -9.797 7.586 0.116 1124 2HG2 THR 142 1HG2 THR 142 -11.475 7.051 0.160 1125 3HG2 THR 142 3HG2 THR 142 -10.752 7.548 -1.367 1126 H GLN 143 HN GLN 143 -13.583 10.205 1.353 1127 HA GLN 143 HA GLN 143 -13.305 12.931 0.819 1128 1HB GLN 143 HB2 GLN 143 -15.454 11.265 2.067 1129 2HB GLN 143 HB1 GLN 143 -15.693 12.975 1.708 1130 1HG GLN 143 HG2 GLN 143 -15.301 12.540 -0.645 1131 2HG GLN 143 HG1 GLN 143 -14.953 10.852 -0.293 1132 1HE2 GLN 143 1HE2 GLN 143 -16.612 9.461 0.187 1133 2HE2 GLN 143 2HE2 GLN 143 -18.273 9.849 -0.110 1134 H LYS 144 HN LYS 144 -13.089 11.162 3.713 1135 HA LYS 144 HA LYS 144 -13.590 13.507 5.387 1136 1HB LYS 144 HB2 LYS 144 -13.864 10.539 5.759 1137 2HB LYS 144 HB1 LYS 144 -13.879 11.636 7.135 1138 1HG LYS 144 HG2 LYS 144 -15.892 12.606 6.467 1139 2HG LYS 144 HG1 LYS 144 -15.719 12.026 4.808 1140 1HD LYS 144 HD2 LYS 144 -17.430 10.775 6.041 1141 2HD LYS 144 HD1 LYS 144 -16.074 9.754 5.533 1142 1HE LYS 144 HE2 LYS 144 -15.218 9.622 7.704 1143 2HE LYS 144 HE1 LYS 144 -16.173 10.991 8.264 1144 1HZ LYS 144 HZ1 LYS 144 -17.295 8.357 7.455 1145 2HZ LYS 144 HZ3 LYS 144 -17.029 8.856 9.055 1146 3HZ LYS 144 HZ2 LYS 144 -18.154 9.670 8.095 1147 H TYR 145 HN TYR 145 -11.021 11.469 4.324 1148 HA TYR 145 HA TYR 145 -9.351 12.326 6.569 1149 1HB TYR 145 HB2 TYR 145 -9.754 9.412 5.910 1150 2HB TYR 145 HB1 TYR 145 -8.535 10.030 7.019 1151 HD1 TYR 145 HD1 TYR 145 -9.351 11.208 9.144 1152 HD2 TYR 145 HD2 TYR 145 -11.926 8.980 6.612 1153 HE1 TYR 145 HE1 TYR 145 -10.999 11.038 10.968 1154 HE2 TYR 145 HE2 TYR 145 -13.583 8.805 8.408 1155 HH TYR 145 HH TYR 145 -13.398 10.644 11.266 1156 H ALA 146 HN ALA 146 -9.597 11.520 3.264 1157 HA ALA 146 HA ALA 146 -6.700 11.262 3.241 1158 1HB ALA 146 HB3 ALA 146 -7.900 9.081 2.954 1159 2HB ALA 146 HB2 ALA 146 -8.525 9.694 1.430 1160 3HB ALA 146 HB1 ALA 146 -6.791 9.493 1.647 1161 H MET 147 HN MET 147 -9.091 11.250 0.675 1162 HA MET 147 HA MET 147 -8.040 12.647 -1.281 1163 1HB MET 147 HB2 MET 147 -10.172 12.999 -2.105 1164 2HB MET 147 HB1 MET 147 -10.442 11.736 -0.905 1165 1HG MET 147 HG2 MET 147 -11.412 13.171 0.600 1166 2HG MET 147 HG1 MET 147 -10.819 14.615 -0.228 1167 1HE MET 147 HE1 MET 147 -13.629 14.845 0.593 1168 2HE MET 147 HE3 MET 147 -13.000 15.971 -0.607 1169 3HE MET 147 HE2 MET 147 -14.557 15.186 -0.865 No H/Q in entry = 1169 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 21.282 -6.017 4.744 2 H2 MET 1 HT3 MET 1 22.489 -5.311 5.689 3 H3 MET 1 HT2 MET 1 20.902 -4.761 5.812 4 HA MET 1 HA MET 1 22.170 -3.198 4.532 5 1HB MET 1 HB2 MET 1 23.403 -5.552 3.589 6 2HB MET 1 HB1 MET 1 22.608 -4.834 2.195 7 1HG MET 1 HG2 MET 1 23.747 -2.703 2.709 8 2HG MET 1 HG1 MET 1 24.625 -3.522 3.996 9 1HE MET 1 HE3 MET 1 26.195 -1.944 1.871 10 2HE MET 1 HE2 MET 1 27.022 -2.945 3.064 11 3HE MET 1 HE1 MET 1 27.446 -3.076 1.358 12 H ALA 2 HN ALA 2 19.449 -4.108 4.836 13 HA ALA 2 HA ALA 2 18.248 -4.357 2.258 14 1HB ALA 2 HB3 ALA 2 16.154 -4.329 3.437 15 2HB ALA 2 HB1 ALA 2 16.939 -3.709 4.887 16 3HB ALA 2 HB2 ALA 2 17.297 -5.340 4.323 17 H LEU 3 HN LEU 3 19.006 -1.745 4.399 18 HA LEU 3 HA LEU 3 17.059 0.103 3.453 19 1HB LEU 3 HB2 LEU 3 18.628 1.773 4.559 20 2HB LEU 3 HB1 LEU 3 17.947 0.527 5.583 21 HG LEU 3 HG LEU 3 20.192 -0.723 5.002 22 1HD1 LEU 3 2HD1 LEU 3 21.022 0.933 3.449 23 2HD1 LEU 3 1HD1 LEU 3 20.959 2.171 4.702 24 3HD1 LEU 3 3HD1 LEU 3 22.076 0.815 4.856 25 1HD2 LEU 3 1HD2 LEU 3 19.932 1.512 7.008 26 2HD2 LEU 3 3HD2 LEU 3 19.522 -0.187 7.246 27 3HD2 LEU 3 2HD2 LEU 3 21.204 0.292 7.026 28 H LYS 4 HN LYS 4 20.069 -1.028 2.316 29 HA LYS 4 HA LYS 4 20.596 1.343 0.791 30 1HB LYS 4 HB2 LYS 4 22.714 0.532 0.435 31 2HB LYS 4 HB1 LYS 4 22.291 -0.106 2.010 32 1HG LYS 4 HG2 LYS 4 23.206 -1.968 1.087 33 2HG LYS 4 HG1 LYS 4 21.528 -2.185 0.592 34 1HD LYS 4 HD2 LYS 4 22.067 -1.188 -1.599 35 2HD LYS 4 HD1 LYS 4 23.747 -1.013 -1.093 36 1HE LYS 4 HE2 LYS 4 23.898 -3.448 -0.804 37 2HE LYS 4 HE1 LYS 4 22.232 -3.605 -1.357 38 1HZ LYS 4 HZ2 LYS 4 24.471 -2.495 -2.964 39 2HZ LYS 4 HZ1 LYS 4 23.831 -4.052 -3.123 40 3HZ LYS 4 HZ3 LYS 4 22.880 -2.706 -3.492 41 H ARG 5 HN ARG 5 19.033 -1.567 0.442 42 HA ARG 5 HA ARG 5 19.077 -1.562 -2.468 43 1HB ARG 5 HB2 ARG 5 18.884 -3.741 -1.523 44 2HB ARG 5 HB1 ARG 5 17.610 -3.224 -0.422 45 1HG ARG 5 HG2 ARG 5 16.555 -4.443 -2.151 46 2HG ARG 5 HG1 ARG 5 16.202 -2.726 -2.405 47 1HD ARG 5 HD2 ARG 5 16.727 -3.822 -4.514 48 2HD ARG 5 HD1 ARG 5 17.933 -2.605 -4.106 49 HE ARG 5 HE ARG 5 18.874 -5.049 -3.175 50 1HH1 ARG 5 1HH1 ARG 5 18.043 -3.594 -6.225 51 2HH1 ARG 5 2HH1 ARG 5 19.224 -4.476 -7.136 52 1HH2 ARG 5 1HH2 ARG 5 20.462 -6.252 -4.375 53 2HH2 ARG 5 2HH2 ARG 5 20.608 -5.974 -6.084 54 H ILE 6 HN ILE 6 16.946 -0.990 0.234 55 HA ILE 6 HA ILE 6 14.739 0.097 -1.017 56 HB ILE 6 HB ILE 6 15.902 1.065 1.598 57 1HG1 ILE 6 2HG1 ILE 6 14.226 -1.365 1.011 58 2HG1 ILE 6 1HG1 ILE 6 15.842 -1.324 1.715 59 1HG2 ILE 6 2HG2 ILE 6 13.203 1.169 0.326 60 2HG2 ILE 6 1HG2 ILE 6 13.355 1.152 2.088 61 3HG2 ILE 6 3HG2 ILE 6 14.110 2.436 1.154 62 1HD1 ILE 6 3HD1 ILE 6 14.927 -0.181 3.681 63 2HD1 ILE 6 2HD1 ILE 6 13.312 -0.325 2.988 64 3HD1 ILE 6 1HD1 ILE 6 14.218 -1.774 3.420 65 H HIS 7 HN HIS 7 17.907 1.315 -0.566 66 HA HIS 7 HA HIS 7 17.753 4.022 -0.967 67 1HB HIS 7 HB2 HIS 7 19.627 1.884 -1.485 68 2HB HIS 7 HB1 HIS 7 19.799 3.210 -2.637 69 HD1 HIS 7 HD1 HIS 7 19.570 2.868 1.165 70 HD2 HIS 7 HD2 HIS 7 21.427 5.177 -1.754 71 HE1 HIS 7 HE1 HIS 7 21.095 4.432 2.407 72 HE2 HIS 7 HE2 HIS 7 22.137 5.887 0.627 73 H LYS 8 HN LYS 8 17.231 1.462 -3.347 74 HA LYS 8 HA LYS 8 16.764 3.497 -5.392 75 1HB LYS 8 HB2 LYS 8 16.412 0.512 -5.613 76 2HB LYS 8 HB1 LYS 8 16.368 1.683 -6.925 77 1HG LYS 8 HG2 LYS 8 18.790 1.193 -5.210 78 2HG LYS 8 HG1 LYS 8 18.497 0.382 -6.746 79 1HD LYS 8 HD2 LYS 8 18.476 2.530 -7.893 80 2HD LYS 8 HD1 LYS 8 18.710 3.367 -6.355 81 1HE LYS 8 HE2 LYS 8 20.887 2.461 -6.094 82 2HE LYS 8 HE1 LYS 8 20.640 1.304 -7.397 83 1HZ LYS 8 HZ2 LYS 8 20.806 4.250 -7.732 84 2HZ LYS 8 HZ1 LYS 8 22.043 3.151 -8.083 85 3HZ LYS 8 HZ3 LYS 8 20.603 3.124 -8.976 86 H GLU 9 HN GLU 9 15.088 0.766 -3.944 87 HA GLU 9 HA GLU 9 12.604 1.020 -4.984 88 1HB GLU 9 HB2 GLU 9 13.094 0.411 -2.070 89 2HB GLU 9 HB1 GLU 9 11.883 -0.290 -3.125 90 1HG GLU 9 HG2 GLU 9 13.541 -1.542 -4.313 91 2HG GLU 9 HG1 GLU 9 14.833 -0.747 -3.414 92 H LEU 10 HN LEU 10 13.611 2.434 -1.919 93 HA LEU 10 HA LEU 10 11.312 4.080 -1.644 94 1HB LEU 10 HB2 LEU 10 12.230 3.327 0.337 95 2HB LEU 10 HB1 LEU 10 13.867 3.624 -0.203 96 HG LEU 10 HG LEU 10 12.156 5.996 0.262 97 1HD1 LEU 10 1HD1 LEU 10 11.723 4.592 2.216 98 2HD1 LEU 10 3HD1 LEU 10 13.460 4.405 2.459 99 3HD1 LEU 10 2HD1 LEU 10 12.712 5.992 2.634 100 1HD2 LEU 10 2HD2 LEU 10 15.054 5.339 0.756 101 2HD2 LEU 10 1HD2 LEU 10 14.410 6.304 -0.573 102 3HD2 LEU 10 3HD2 LEU 10 14.301 6.899 1.084 103 H ASN 11 HN ASN 11 14.760 4.802 -2.398 104 HA ASN 11 HA ASN 11 14.237 7.622 -2.379 105 1HB ASN 11 HB2 ASN 11 16.492 6.262 -2.021 106 2HB ASN 11 HB1 ASN 11 16.640 6.574 -3.747 107 1HD2 ASN 11 1HD2 ASN 11 15.424 9.138 -3.777 108 2HD2 ASN 11 2HD2 ASN 11 16.482 10.236 -2.954 109 H ASP 12 HN ASP 12 13.988 5.175 -4.768 110 HA ASP 12 HA ASP 12 14.246 6.788 -7.062 111 1HB ASP 12 HB2 ASP 12 14.277 4.327 -7.161 112 2HB ASP 12 HB1 ASP 12 12.575 4.272 -6.702 113 H LEU 13 HN LEU 13 11.741 6.233 -4.779 114 HA LEU 13 HA LEU 13 9.615 7.475 -6.131 115 1HB LEU 13 HB2 LEU 13 10.190 7.272 -3.175 116 2HB LEU 13 HB1 LEU 13 8.654 7.754 -3.869 117 HG LEU 13 HG LEU 13 9.822 5.087 -4.574 118 1HD1 LEU 13 3HD1 LEU 13 9.807 5.397 -2.073 119 2HD1 LEU 13 2HD1 LEU 13 8.056 5.555 -2.198 120 3HD1 LEU 13 1HD1 LEU 13 8.842 4.062 -2.695 121 1HD2 LEU 13 2HD2 LEU 13 7.058 6.262 -4.378 122 2HD2 LEU 13 1HD2 LEU 13 7.931 5.825 -5.848 123 3HD2 LEU 13 3HD2 LEU 13 7.399 4.569 -4.729 124 H ALA 14 HN ALA 14 12.312 8.642 -4.273 125 HA ALA 14 HA ALA 14 11.392 11.364 -4.188 126 1HB ALA 14 HB1 ALA 14 12.780 10.483 -2.389 127 2HB ALA 14 HB2 ALA 14 13.554 11.858 -3.176 128 3HB ALA 14 HB3 ALA 14 14.094 10.217 -3.534 129 H ARG 15 HN ARG 15 13.507 9.377 -6.135 130 HA ARG 15 HA ARG 15 14.708 11.373 -7.701 131 1HB ARG 15 HB2 ARG 15 13.932 8.551 -8.453 132 2HB ARG 15 HB1 ARG 15 15.105 9.552 -9.295 133 1HG ARG 15 HG2 ARG 15 15.430 8.854 -6.405 134 2HG ARG 15 HG1 ARG 15 15.966 7.772 -7.678 135 1HD ARG 15 HD2 ARG 15 16.932 10.537 -7.030 136 2HD ARG 15 HD1 ARG 15 17.863 9.038 -7.115 137 HE ARG 15 HE ARG 15 16.965 9.310 -9.647 138 1HH1 ARG 15 1HH1 ARG 15 18.594 11.530 -7.482 139 2HH1 ARG 15 2HH1 ARG 15 19.377 12.402 -8.757 140 1HH2 ARG 15 1HH2 ARG 15 17.972 10.474 -11.330 141 2HH2 ARG 15 2HH2 ARG 15 19.024 11.803 -10.950 142 H ASP 16 HN ASP 16 11.764 9.430 -8.255 143 HA ASP 16 HA ASP 16 10.895 11.457 -10.200 144 1HB ASP 16 HB2 ASP 16 11.946 9.395 -11.288 145 2HB ASP 16 HB1 ASP 16 10.557 8.500 -10.684 146 HA PRO 17 HA PRO 17 7.245 10.435 -7.649 147 1HB PRO 17 HB2 PRO 17 6.914 12.927 -6.575 148 2HB PRO 17 HB1 PRO 17 7.924 11.675 -5.853 149 1HG PRO 17 HG2 PRO 17 8.730 14.173 -7.090 150 2HG PRO 17 HG1 PRO 17 9.726 13.005 -6.208 151 1HD PRO 17 HD2 PRO 17 9.387 13.360 -9.103 152 2HD PRO 17 HD1 PRO 17 10.660 12.495 -8.217 153 HA PRO 18 HA PRO 18 4.937 12.522 -10.996 154 1HB PRO 18 HB2 PRO 18 3.313 10.202 -11.293 155 2HB PRO 18 HB1 PRO 18 4.617 10.745 -12.349 156 1HG PRO 18 HG2 PRO 18 4.655 8.439 -10.789 157 2HG PRO 18 HG1 PRO 18 6.075 9.230 -11.491 158 1HD PRO 18 HD2 PRO 18 5.006 9.373 -8.705 159 2HD PRO 18 HD1 PRO 18 6.691 9.374 -9.275 160 H ALA 19 HN ALA 19 2.993 10.119 -9.241 161 HA ALA 19 HA ALA 19 1.555 11.957 -7.644 162 1HB ALA 19 HB3 ALA 19 0.120 10.949 -10.103 163 2HB ALA 19 HB2 ALA 19 -0.619 11.831 -8.765 164 3HB ALA 19 HB1 ALA 19 0.577 12.623 -9.792 165 H GLN 20 HN GLN 20 -0.502 10.799 -6.805 166 HA GLN 20 HA GLN 20 -1.431 9.134 -5.613 167 1HB GLN 20 HB2 GLN 20 -1.817 6.990 -6.724 168 2HB GLN 20 HB1 GLN 20 -2.240 8.367 -7.739 169 1HG GLN 20 HG2 GLN 20 0.214 7.988 -8.648 170 2HG GLN 20 HG1 GLN 20 -0.038 6.371 -8.007 171 1HE2 GLN 20 1HE2 GLN 20 -2.901 6.430 -8.586 172 2HE2 GLN 20 2HE2 GLN 20 -3.042 6.227 -10.298 173 H CYS 21 HN CYS 21 1.795 9.104 -5.901 174 HA CYS 21 HA CYS 21 2.120 7.284 -3.742 175 1HB CYS 21 HB2 CYS 21 2.187 5.486 -5.157 176 2HB CYS 21 HB1 CYS 21 2.688 6.458 -6.536 177 HG CYS 21 HG CYS 21 5.200 5.949 -6.394 178 H SER 22 HN SER 22 3.786 7.927 -2.579 179 HA SER 22 HA SER 22 6.297 8.543 -3.708 180 1HB SER 22 HB2 SER 22 6.408 10.927 -2.795 181 2HB SER 22 HB1 SER 22 5.450 10.706 -4.258 182 HG SER 22 HG SER 22 4.326 10.687 -1.651 183 H ALA 23 HN ALA 23 7.671 7.756 -2.287 184 HA ALA 23 HA ALA 23 7.258 8.410 0.548 185 1HB ALA 23 HB2 ALA 23 6.867 5.951 -0.094 186 2HB ALA 23 HB3 ALA 23 7.934 6.298 1.267 187 3HB ALA 23 HB1 ALA 23 8.615 5.869 -0.302 188 H GLY 24 HN GLY 24 9.657 7.552 1.529 189 1HA GLY 24 HA1 GLY 24 11.454 9.529 0.429 190 2HA GLY 24 HA2 GLY 24 12.029 7.871 0.250 191 HA PRO 25 HA PRO 25 13.640 8.244 4.416 192 1HB PRO 25 HB2 PRO 25 15.034 10.806 3.937 193 2HB PRO 25 HB1 PRO 25 15.700 9.237 4.399 194 1HG PRO 25 HG2 PRO 25 16.052 10.229 1.940 195 2HG PRO 25 HG1 PRO 25 15.820 8.493 2.216 196 1HD PRO 25 HD2 PRO 25 13.861 10.534 1.227 197 2HD PRO 25 HD1 PRO 25 14.108 8.858 0.695 198 H VAL 26 HN VAL 26 11.955 8.670 5.811 199 HA VAL 26 HA VAL 26 10.836 11.376 5.812 200 HB VAL 26 HB VAL 26 9.845 8.666 6.456 201 1HG1 VAL 26 2HG1 VAL 26 9.397 9.848 8.492 202 2HG1 VAL 26 1HG1 VAL 26 8.628 11.153 7.590 203 3HG1 VAL 26 3HG1 VAL 26 7.901 9.546 7.603 204 1HG2 VAL 26 2HG2 VAL 26 8.716 11.055 5.030 205 2HG2 VAL 26 1HG2 VAL 26 9.430 9.627 4.283 206 3HG2 VAL 26 3HG2 VAL 26 7.915 9.493 5.172 207 H GLY 27 HN GLY 27 11.637 8.814 8.180 208 1HA GLY 27 HA1 GLY 27 12.470 9.113 10.346 209 2HA GLY 27 HA2 GLY 27 12.353 10.861 10.123 210 H ASP 28 HN ASP 28 13.581 10.113 7.393 211 HA ASP 28 HA ASP 28 15.590 10.177 6.353 212 1HB ASP 28 HB2 ASP 28 16.304 11.816 8.105 213 2HB ASP 28 HB1 ASP 28 16.868 10.466 9.082 214 H ASP 29 HN ASP 29 14.662 8.032 8.713 215 HA ASP 29 HA ASP 29 16.626 5.992 8.257 216 1HB ASP 29 HB2 ASP 29 13.826 5.767 9.404 217 2HB ASP 29 HB1 ASP 29 15.093 4.551 9.526 218 H MET 30 HN MET 30 16.533 4.359 6.762 219 HA MET 30 HA MET 30 14.561 4.496 4.669 220 1HB MET 30 HB2 MET 30 17.176 3.467 4.968 221 2HB MET 30 HB1 MET 30 16.140 2.097 4.604 222 1HG MET 30 HG2 MET 30 16.084 2.653 2.476 223 2HG MET 30 HG1 MET 30 15.516 4.252 2.844 224 1HE MET 30 HE1 MET 30 17.058 6.360 3.294 225 2HE MET 30 HE3 MET 30 17.859 5.480 4.598 226 3HE MET 30 HE2 MET 30 18.819 6.273 3.349 227 H PHE 31 HN PHE 31 14.042 3.620 7.618 228 HA PHE 31 HA PHE 31 12.439 1.276 6.911 229 1HB PHE 31 HB2 PHE 31 12.818 0.633 9.369 230 2HB PHE 31 HB1 PHE 31 13.997 0.176 8.175 231 HD1 PHE 31 HD1 PHE 31 13.288 2.112 11.151 232 HD2 PHE 31 HD2 PHE 31 16.198 1.368 8.131 233 HE1 PHE 31 HE1 PHE 31 15.016 3.154 12.556 234 HE2 PHE 31 HE2 PHE 31 17.922 2.412 9.532 235 HZ PHE 31 HZ PHE 31 17.332 3.301 11.749 236 H HIS 32 HN HIS 32 12.230 4.318 7.642 237 HA HIS 32 HA HIS 32 9.595 3.830 8.737 238 1HB HIS 32 HB2 HIS 32 11.796 5.343 10.039 239 2HB HIS 32 HB1 HIS 32 10.187 6.089 10.098 240 HD1 HIS 32 HD1 HIS 32 12.079 4.639 12.405 241 HD2 HIS 32 HD2 HIS 32 8.449 3.399 10.806 242 HE1 HIS 32 HE1 HIS 32 11.070 3.124 14.129 243 HE2 HIS 32 HE2 HIS 32 8.782 2.574 13.232 244 H TRP 33 HN TRP 33 8.806 4.340 6.727 245 HA TRP 33 HA TRP 33 9.303 7.042 5.852 246 1HB TRP 33 HB2 TRP 33 9.423 5.938 3.451 247 2HB TRP 33 HB1 TRP 33 10.832 6.242 4.437 248 HD1 TRP 33 HD1 TRP 33 11.370 3.779 6.069 249 HE1 TRP 33 HE1 TRP 33 11.680 1.474 5.006 250 HE3 TRP 33 HE3 TRP 33 8.979 4.604 1.646 251 HZ2 TRP 33 HZ2 TRP 33 11.043 0.179 2.615 252 HZ3 TRP 33 HZ3 TRP 33 8.911 2.784 0.005 253 HH2 TRP 33 HH2 TRP 33 9.937 0.635 0.490 254 H GLN 34 HN GLN 34 7.872 7.945 4.450 255 HA GLN 34 HA GLN 34 5.171 6.878 4.932 256 1HB GLN 34 HB2 GLN 34 6.147 9.159 5.947 257 2HB GLN 34 HB1 GLN 34 5.627 9.759 4.371 258 1HG GLN 34 HG2 GLN 34 3.789 8.229 6.189 259 2HG GLN 34 HG1 GLN 34 3.978 9.977 6.281 260 1HE2 GLN 34 1HE2 GLN 34 1.658 8.319 5.589 261 2HE2 GLN 34 2HE2 GLN 34 1.148 8.859 4.030 262 H ALA 35 HN ALA 35 4.217 6.200 3.210 263 HA ALA 35 HA ALA 35 4.760 7.519 0.627 264 1HB ALA 35 HB2 ALA 35 3.716 4.719 1.064 265 2HB ALA 35 HB3 ALA 35 5.419 5.107 0.839 266 3HB ALA 35 HB1 ALA 35 4.259 5.432 -0.449 267 H THR 36 HN THR 36 3.028 8.560 -0.315 268 HA THR 36 HA THR 36 0.378 8.141 0.886 269 HB THR 36 HB THR 36 -0.107 10.335 -0.400 270 HG1 THR 36 HG1 THR 36 1.726 10.508 -1.649 271 1HG2 THR 36 3HG2 THR 36 1.782 10.276 1.956 272 2HG2 THR 36 2HG2 THR 36 0.844 11.678 1.445 273 3HG2 THR 36 1HG2 THR 36 0.022 10.230 2.027 274 H ILE 37 HN ILE 37 -0.502 6.451 -0.247 275 HA ILE 37 HA ILE 37 -0.464 6.511 -3.166 276 HB ILE 37 HB ILE 37 -0.872 4.407 -1.103 277 1HG1 ILE 37 2HG1 ILE 37 0.752 3.241 -2.506 278 2HG1 ILE 37 1HG1 ILE 37 0.726 4.576 -3.659 279 1HG2 ILE 37 3HG2 ILE 37 -1.915 4.313 -3.903 280 2HG2 ILE 37 2HG2 ILE 37 -1.517 2.857 -2.992 281 3HG2 ILE 37 1HG2 ILE 37 -2.764 3.960 -2.403 282 1HD1 ILE 37 2HD1 ILE 37 1.586 4.795 -0.782 283 2HD1 ILE 37 1HD1 ILE 37 2.685 4.579 -2.144 284 3HD1 ILE 37 3HD1 ILE 37 1.702 6.036 -2.027 285 H MET 38 HN MET 38 -2.272 6.809 -4.425 286 HA MET 38 HA MET 38 -4.657 7.661 -2.952 287 1HB MET 38 HB2 MET 38 -3.712 8.430 -5.709 288 2HB MET 38 HB1 MET 38 -5.191 8.996 -4.930 289 1HG MET 38 HG2 MET 38 -4.037 10.150 -3.319 290 2HG MET 38 HG1 MET 38 -2.513 9.354 -3.710 291 1HE MET 38 HE3 MET 38 -5.156 10.775 -6.255 292 2HE MET 38 HE2 MET 38 -5.234 11.935 -4.928 293 3HE MET 38 HE1 MET 38 -4.572 12.422 -6.490 294 H GLY 39 HN GLY 39 -6.709 7.168 -3.653 295 1HA GLY 39 HA1 GLY 39 -8.360 6.299 -4.964 296 2HA GLY 39 HA2 GLY 39 -7.164 5.179 -5.643 297 HA PRO 40 HA PRO 40 -6.209 8.387 -8.789 298 1HB PRO 40 HB2 PRO 40 -5.995 6.660 -10.890 299 2HB PRO 40 HB1 PRO 40 -4.667 7.036 -9.787 300 1HG PRO 40 HG2 PRO 40 -6.477 4.667 -9.839 301 2HG PRO 40 HG1 PRO 40 -4.742 4.747 -9.493 302 1HD PRO 40 HD2 PRO 40 -6.638 4.515 -7.559 303 2HD PRO 40 HD1 PRO 40 -5.080 5.328 -7.297 304 H ASN 41 HN ASN 41 -7.150 8.709 -11.033 305 HA ASN 41 HA ASN 41 -9.731 9.261 -11.146 306 1HB ASN 41 HB2 ASN 41 -8.018 8.233 -13.396 307 2HB ASN 41 HB1 ASN 41 -9.636 8.883 -13.644 308 1HD2 ASN 41 1HD2 ASN 41 -10.008 11.063 -13.347 309 2HD2 ASN 41 2HD2 ASN 41 -8.724 12.215 -13.258 310 H ASP 42 HN ASP 42 -11.433 8.279 -10.727 311 HA ASP 42 HA ASP 42 -13.093 6.824 -10.481 312 1HB ASP 42 HB2 ASP 42 -12.941 6.981 -13.026 313 2HB ASP 42 HB1 ASP 42 -12.077 5.445 -12.973 314 H SER 43 HN SER 43 -11.234 6.245 -8.850 315 HA SER 43 HA SER 43 -11.169 3.317 -8.776 316 1HB SER 43 HB2 SER 43 -9.790 5.427 -7.092 317 2HB SER 43 HB1 SER 43 -9.589 3.693 -6.866 318 HG SER 43 HG SER 43 -8.833 5.294 -9.071 319 HA PRO 44 HA PRO 44 -14.548 3.294 -5.820 320 1HB PRO 44 HB2 PRO 44 -13.431 1.587 -3.918 321 2HB PRO 44 HB1 PRO 44 -14.381 1.076 -5.317 322 1HG PRO 44 HG2 PRO 44 -11.418 1.160 -4.957 323 2HG PRO 44 HG1 PRO 44 -12.415 -0.030 -5.817 324 1HD PRO 44 HD2 PRO 44 -11.001 1.821 -7.140 325 2HD PRO 44 HD1 PRO 44 -12.609 1.312 -7.700 326 H TYR 45 HN TYR 45 -11.325 4.137 -5.169 327 HA TYR 45 HA TYR 45 -12.058 5.608 -2.727 328 1HB TYR 45 HB2 TYR 45 -9.304 4.538 -3.337 329 2HB TYR 45 HB1 TYR 45 -9.900 5.133 -1.806 330 HD1 TYR 45 HD1 TYR 45 -12.602 3.388 -2.051 331 HD2 TYR 45 HD2 TYR 45 -8.445 2.551 -2.392 332 HE1 TYR 45 HE1 TYR 45 -13.019 1.045 -1.441 333 HE2 TYR 45 HE2 TYR 45 -8.849 0.212 -1.778 334 HH TYR 45 HH TYR 45 -10.973 -0.966 -0.328 335 H GLN 46 HN GLN 46 -12.163 6.450 -5.515 336 HA GLN 46 HA GLN 46 -10.036 7.784 -6.577 337 1HB GLN 46 HB2 GLN 46 -11.977 7.683 -7.882 338 2HB GLN 46 HB1 GLN 46 -12.978 8.371 -6.615 339 1HG GLN 46 HG2 GLN 46 -12.800 10.077 -8.129 340 2HG GLN 46 HG1 GLN 46 -11.572 10.489 -6.946 341 1HE2 GLN 46 1HE2 GLN 46 -9.398 10.214 -7.479 342 2HE2 GLN 46 2HE2 GLN 46 -8.893 10.130 -9.124 343 H GLY 47 HN GLY 47 -8.750 9.314 -5.909 344 1HA GLY 47 HA1 GLY 47 -9.862 11.636 -4.514 345 2HA GLY 47 HA2 GLY 47 -8.273 11.544 -5.269 346 H GLY 48 HN GLY 48 -9.097 8.850 -3.446 347 1HA GLY 48 HA1 GLY 48 -8.720 8.176 -1.276 348 2HA GLY 48 HA2 GLY 48 -8.483 9.853 -0.827 349 H VAL 49 HN VAL 49 -6.493 10.795 -0.993 350 HA VAL 49 HA VAL 49 -4.164 9.287 -1.675 351 HB VAL 49 HB VAL 49 -4.367 11.636 0.187 352 1HG1 VAL 49 2HG1 VAL 49 -2.096 10.602 -1.491 353 2HG1 VAL 49 1HG1 VAL 49 -2.060 12.107 -0.572 354 3HG1 VAL 49 3HG1 VAL 49 -2.217 10.565 0.269 355 1HG2 VAL 49 3HG2 VAL 49 -5.432 11.964 -2.125 356 2HG2 VAL 49 2HG2 VAL 49 -4.269 13.164 -1.560 357 3HG2 VAL 49 1HG2 VAL 49 -3.776 11.941 -2.728 358 H PHE 50 HN PHE 50 -4.133 7.383 -0.579 359 HA PHE 50 HA PHE 50 -4.677 7.328 2.236 360 1HB PHE 50 HB2 PHE 50 -3.877 5.222 0.248 361 2HB PHE 50 HB1 PHE 50 -4.038 4.905 1.970 362 HD1 PHE 50 HD1 PHE 50 -6.353 5.900 3.006 363 HD2 PHE 50 HD2 PHE 50 -5.621 4.730 -1.050 364 HE1 PHE 50 HE1 PHE 50 -8.736 5.502 2.668 365 HE2 PHE 50 HE2 PHE 50 -8.032 4.352 -1.372 366 HZ PHE 50 HZ PHE 50 -9.606 4.932 0.597 367 H PHE 51 HN PHE 51 -3.053 5.879 3.538 368 HA PHE 51 HA PHE 51 -0.518 7.338 3.355 369 1HB PHE 51 HB2 PHE 51 -1.920 6.799 5.957 370 2HB PHE 51 HB1 PHE 51 -0.694 8.011 5.611 371 HD1 PHE 51 HD1 PHE 51 -4.250 7.107 4.962 372 HD2 PHE 51 HD2 PHE 51 -1.320 10.204 5.062 373 HE1 PHE 51 HE1 PHE 51 -6.022 8.775 4.639 374 HE2 PHE 51 HE2 PHE 51 -3.093 11.880 4.734 375 HZ PHE 51 HZ PHE 51 -5.438 11.167 4.522 376 H LEU 52 HN LEU 52 1.098 5.929 3.272 377 HA LEU 52 HA LEU 52 0.800 3.383 4.708 378 1HB LEU 52 HB2 LEU 52 2.489 3.909 2.257 379 2HB LEU 52 HB1 LEU 52 2.202 2.362 3.027 380 HG LEU 52 HG LEU 52 0.098 4.018 1.626 381 1HD1 LEU 52 1HD1 LEU 52 1.690 3.001 0.058 382 2HD1 LEU 52 3HD1 LEU 52 1.409 1.428 0.804 383 3HD1 LEU 52 2HD1 LEU 52 0.097 2.251 -0.040 384 1HD2 LEU 52 2HD2 LEU 52 0.009 1.345 2.960 385 2HD2 LEU 52 1HD2 LEU 52 -0.837 2.830 3.417 386 3HD2 LEU 52 3HD2 LEU 52 -1.257 2.002 1.918 387 H THR 53 HN THR 53 2.198 3.088 6.332 388 HA THR 53 HA THR 53 4.740 4.570 6.201 389 HB THR 53 HB THR 53 3.857 3.126 8.678 390 HG1 THR 53 HG1 THR 53 2.618 5.296 7.525 391 1HG2 THR 53 3HG2 THR 53 5.509 5.590 8.137 392 2HG2 THR 53 2HG2 THR 53 5.125 4.973 9.744 393 3HG2 THR 53 1HG2 THR 53 6.104 4.004 8.639 394 H ILE 54 HN ILE 54 6.416 3.417 5.570 395 HA ILE 54 HA ILE 54 6.148 0.497 5.598 396 HB ILE 54 HB ILE 54 8.400 1.760 4.162 397 1HG1 ILE 54 2HG1 ILE 54 6.491 3.308 3.660 398 2HG1 ILE 54 1HG1 ILE 54 7.107 2.464 2.244 399 1HG2 ILE 54 3HG2 ILE 54 6.440 -0.430 3.492 400 2HG2 ILE 54 2HG2 ILE 54 7.810 0.046 2.486 401 3HG2 ILE 54 1HG2 ILE 54 8.087 -0.624 4.096 402 1HD1 ILE 54 3HD1 ILE 54 4.635 1.741 3.783 403 2HD1 ILE 54 2HD1 ILE 54 4.690 2.602 2.245 404 3HD1 ILE 54 1HD1 ILE 54 5.238 0.928 2.340 405 H HIS 55 HN HIS 55 7.445 -0.693 6.878 406 HA HIS 55 HA HIS 55 9.996 0.483 7.629 407 1HB HIS 55 HB2 HIS 55 9.858 -0.584 9.873 408 2HB HIS 55 HB1 HIS 55 8.816 0.814 9.612 409 HD1 HIS 55 HD1 HIS 55 6.618 0.479 10.596 410 HD2 HIS 55 HD2 HIS 55 8.221 -3.047 9.145 411 HE1 HIS 55 HE1 HIS 55 4.900 -1.257 11.020 412 HE2 HIS 55 HE2 HIS 55 6.009 -3.441 10.444 413 H PHE 56 HN PHE 56 11.716 -0.977 8.019 414 HA PHE 56 HA PHE 56 11.186 -3.694 7.035 415 1HB PHE 56 HB2 PHE 56 12.976 -3.635 5.549 416 2HB PHE 56 HB1 PHE 56 12.300 -2.037 5.365 417 HD1 PHE 56 HD1 PHE 56 15.094 -3.987 6.787 418 HD2 PHE 56 HD2 PHE 56 13.550 -0.135 5.910 419 HE1 PHE 56 HE1 PHE 56 17.301 -3.004 7.253 420 HE2 PHE 56 HE2 PHE 56 15.731 0.865 6.369 421 HZ PHE 56 HZ PHE 56 17.621 -0.575 7.057 422 HA PRO 57 HA PRO 57 14.243 -4.679 10.194 423 1HB PRO 57 HB2 PRO 57 13.381 -7.188 10.675 424 2HB PRO 57 HB1 PRO 57 12.538 -5.775 11.316 425 1HG PRO 57 HG2 PRO 57 11.685 -7.642 9.229 426 2HG PRO 57 HG1 PRO 57 10.726 -6.442 10.110 427 1HD PRO 57 HD2 PRO 57 11.960 -6.247 7.461 428 2HD PRO 57 HD1 PRO 57 10.739 -5.195 8.211 429 H THR 58 HN THR 58 15.991 -4.676 8.722 430 HA THR 58 HA THR 58 17.433 -5.479 7.096 431 HB THR 58 HB THR 58 18.678 -7.480 8.083 432 HG1 THR 58 HG1 THR 58 16.668 -8.035 9.351 433 1HG2 THR 58 2HG2 THR 58 19.377 -5.154 8.396 434 2HG2 THR 58 1HG2 THR 58 18.279 -5.001 9.767 435 3HG2 THR 58 3HG2 THR 58 19.656 -6.099 9.860 436 H ASP 59 HN ASP 59 15.454 -6.027 5.656 437 HA ASP 59 HA ASP 59 14.658 -8.752 5.459 438 1HB ASP 59 HB2 ASP 59 14.360 -7.149 3.040 439 2HB ASP 59 HB1 ASP 59 13.142 -8.014 3.963 440 H TYR 60 HN TYR 60 16.446 -6.679 3.217 441 HA TYR 60 HA TYR 60 17.004 -8.367 1.192 442 1HB TYR 60 HB2 TYR 60 17.608 -5.943 1.341 443 2HB TYR 60 HB1 TYR 60 18.998 -6.397 2.322 444 HD1 TYR 60 HD1 TYR 60 17.449 -7.020 -1.020 445 HD2 TYR 60 HD2 TYR 60 21.014 -6.838 1.296 446 HE1 TYR 60 HE1 TYR 60 18.785 -7.344 -3.062 447 HE2 TYR 60 HE2 TYR 60 22.358 -7.157 -0.737 448 HH TYR 60 HH TYR 60 21.048 -6.909 -3.874 449 HA PRO 61 HA PRO 61 18.752 -9.569 -0.402 450 1HB PRO 61 HB2 PRO 61 17.978 -12.250 -0.521 451 2HB PRO 61 HB1 PRO 61 19.597 -11.609 -0.822 452 1HG PRO 61 HG2 PRO 61 18.461 -12.801 1.671 453 2HG PRO 61 HG1 PRO 61 20.078 -12.999 0.968 454 1HD PRO 61 HD2 PRO 61 19.710 -11.404 3.057 455 2HD PRO 61 HD1 PRO 61 20.794 -10.913 1.738 456 H PHE 62 HN PHE 62 16.423 -11.317 1.744 457 HA PHE 62 HA PHE 62 14.478 -10.959 -0.358 458 1HB PHE 62 HB2 PHE 62 14.576 -13.185 0.742 459 2HB PHE 62 HB1 PHE 62 14.055 -12.427 2.247 460 HD1 PHE 62 HD1 PHE 62 12.272 -14.375 1.794 461 HD2 PHE 62 HD2 PHE 62 12.535 -10.710 -0.389 462 HE1 PHE 62 HE1 PHE 62 9.907 -14.592 1.118 463 HE2 PHE 62 HE2 PHE 62 10.182 -10.944 -1.066 464 HZ PHE 62 HZ PHE 62 8.881 -12.901 -0.353 465 H LYS 63 HN LYS 63 13.849 -9.066 -0.408 466 HA LYS 63 HA LYS 63 13.103 -7.530 1.894 467 1HB LYS 63 HB2 LYS 63 14.382 -7.082 -0.422 468 2HB LYS 63 HB1 LYS 63 12.770 -6.537 -0.851 469 1HG LYS 63 HG2 LYS 63 14.071 -5.561 1.652 470 2HG LYS 63 HG1 LYS 63 14.452 -4.836 0.088 471 1HD LYS 63 HD2 LYS 63 12.200 -4.197 -0.258 472 2HD LYS 63 HD1 LYS 63 11.649 -5.159 1.119 473 1HE LYS 63 HE2 LYS 63 13.692 -3.084 1.545 474 2HE LYS 63 HE1 LYS 63 12.023 -2.552 1.315 475 1HZ LYS 63 HZ1 LYS 63 11.500 -4.228 3.140 476 2HZ LYS 63 HZ3 LYS 63 13.161 -4.256 3.460 477 3HZ LYS 63 HZ2 LYS 63 12.295 -2.814 3.606 478 HA PRO 64 HA PRO 64 8.729 -7.890 0.848 479 1HB PRO 64 HB2 PRO 64 7.843 -9.309 2.984 480 2HB PRO 64 HB1 PRO 64 8.450 -10.088 1.517 481 1HG PRO 64 HG2 PRO 64 9.640 -10.045 4.166 482 2HG PRO 64 HG1 PRO 64 10.141 -10.971 2.742 483 1HD PRO 64 HD2 PRO 64 11.171 -8.394 3.763 484 2HD PRO 64 HD1 PRO 64 11.950 -9.574 2.685 485 HA PRO 65 HA PRO 65 9.378 -4.573 3.990 486 1HB PRO 65 HB2 PRO 65 8.276 -2.541 2.572 487 2HB PRO 65 HB1 PRO 65 9.942 -3.082 2.335 488 1HG PRO 65 HG2 PRO 65 7.504 -3.685 0.717 489 2HG PRO 65 HG1 PRO 65 9.156 -3.341 0.173 490 1HD PRO 65 HD2 PRO 65 8.104 -5.857 0.321 491 2HD PRO 65 HD1 PRO 65 9.834 -5.510 0.479 492 H LYS 66 HN LYS 66 7.978 -4.084 5.615 493 HA LYS 66 HA LYS 66 5.244 -4.901 5.330 494 1HB LYS 66 HB2 LYS 66 6.586 -5.117 7.473 495 2HB LYS 66 HB1 LYS 66 6.421 -3.375 7.654 496 1HG LYS 66 HG2 LYS 66 4.580 -3.853 8.814 497 2HG LYS 66 HG1 LYS 66 3.837 -4.130 7.241 498 1HD LYS 66 HD2 LYS 66 5.123 -6.236 8.983 499 2HD LYS 66 HD1 LYS 66 3.390 -5.979 8.783 500 1HE LYS 66 HE2 LYS 66 3.578 -6.514 6.413 501 2HE LYS 66 HE1 LYS 66 5.316 -6.754 6.593 502 1HZ LYS 66 HZ2 LYS 66 4.795 -8.529 8.215 503 2HZ LYS 66 HZ1 LYS 66 3.157 -8.364 7.843 504 3HZ LYS 66 HZ3 LYS 66 4.247 -8.874 6.653 505 H VAL 67 HN VAL 67 4.721 -3.527 3.591 506 HA VAL 67 HA VAL 67 4.370 -0.715 4.075 507 HB VAL 67 HB VAL 67 4.754 -1.324 1.800 508 1HG1 VAL 67 1HG1 VAL 67 2.389 -3.187 2.031 509 2HG1 VAL 67 3HG1 VAL 67 3.279 -2.844 0.547 510 3HG1 VAL 67 2HG1 VAL 67 4.083 -3.656 1.889 511 1HG2 VAL 67 2HG2 VAL 67 3.072 0.457 2.212 512 2HG2 VAL 67 1HG2 VAL 67 2.881 -0.360 0.660 513 3HG2 VAL 67 3HG2 VAL 67 1.802 -0.748 2.002 514 H ALA 68 HN ALA 68 2.891 -0.003 5.416 515 HA ALA 68 HA ALA 68 0.330 -1.437 5.587 516 1HB ALA 68 HB1 ALA 68 1.724 -2.156 7.451 517 2HB ALA 68 HB2 ALA 68 0.343 -1.215 8.017 518 3HB ALA 68 HB3 ALA 68 1.945 -0.476 7.943 519 H PHE 69 HN PHE 69 -1.438 -0.240 5.706 520 HA PHE 69 HA PHE 69 -1.382 2.516 5.243 521 1HB PHE 69 HB2 PHE 69 -3.577 0.639 6.037 522 2HB PHE 69 HB1 PHE 69 -3.864 2.362 5.910 523 HD1 PHE 69 HD1 PHE 69 -3.137 3.427 3.578 524 HD2 PHE 69 HD2 PHE 69 -3.978 -0.700 4.231 525 HE1 PHE 69 HE1 PHE 69 -3.730 3.153 1.208 526 HE2 PHE 69 HE2 PHE 69 -4.554 -0.948 1.852 527 HZ PHE 69 HZ PHE 69 -4.408 0.968 0.354 528 H THR 70 HN THR 70 -1.485 4.231 6.513 529 HA THR 70 HA THR 70 -1.312 4.028 9.378 530 HB THR 70 HB THR 70 -1.896 6.513 7.763 531 HG1 THR 70 HG1 THR 70 0.661 5.336 8.320 532 1HG2 THR 70 3HG2 THR 70 -2.034 6.698 10.202 533 2HG2 THR 70 2HG2 THR 70 -0.383 6.091 10.341 534 3HG2 THR 70 1HG2 THR 70 -0.693 7.639 9.551 535 H THR 71 HN THR 71 -3.718 4.719 6.964 536 HA THR 71 HA THR 71 -5.643 5.635 8.945 537 HB THR 71 HB THR 71 -5.267 6.845 6.724 538 HG1 THR 71 HG1 THR 71 -7.539 7.227 6.504 539 1HG2 THR 71 1HG2 THR 71 -6.760 4.438 5.697 540 2HG2 THR 71 3HG2 THR 71 -6.560 5.951 4.813 541 3HG2 THR 71 2HG2 THR 71 -5.148 4.978 5.223 542 H ARG 72 HN ARG 72 -7.964 4.902 8.194 543 HA ARG 72 HA ARG 72 -8.045 2.019 8.352 544 1HB ARG 72 HB2 ARG 72 -10.607 2.520 8.381 545 2HB ARG 72 HB1 ARG 72 -9.641 2.870 9.801 546 1HG ARG 72 HG2 ARG 72 -9.861 5.118 7.934 547 2HG ARG 72 HG1 ARG 72 -11.390 4.588 8.609 548 1HD ARG 72 HD2 ARG 72 -10.304 6.347 9.958 549 2HD ARG 72 HD1 ARG 72 -10.570 4.848 10.847 550 HE ARG 72 HE ARG 72 -8.038 4.565 9.973 551 1HH1 ARG 72 1HH1 ARG 72 -9.691 7.128 11.704 552 2HH1 ARG 72 2HH1 ARG 72 -8.262 7.645 12.546 553 1HH2 ARG 72 1HH2 ARG 72 -6.152 5.262 11.089 554 2HH2 ARG 72 2HH2 ARG 72 -6.257 6.611 12.175 555 H ILE 73 HN ILE 73 -8.910 0.687 6.767 556 HA ILE 73 HA ILE 73 -9.829 1.786 4.263 557 HB ILE 73 HB ILE 73 -7.690 2.167 3.636 558 1HG1 ILE 73 2HG1 ILE 73 -6.736 0.031 2.455 559 2HG1 ILE 73 1HG1 ILE 73 -8.273 -0.692 2.905 560 1HG2 ILE 73 1HG2 ILE 73 -6.676 1.474 5.716 561 2HG2 ILE 73 3HG2 ILE 73 -6.825 -0.220 5.261 562 3HG2 ILE 73 2HG2 ILE 73 -5.742 0.842 4.362 563 1HD1 ILE 73 1HD1 ILE 73 -9.444 1.063 1.645 564 2HD1 ILE 73 3HD1 ILE 73 -7.888 1.762 1.194 565 3HD1 ILE 73 2HD1 ILE 73 -8.321 0.152 0.629 566 H TYR 74 HN TYR 74 -11.339 0.486 3.626 567 HA TYR 74 HA TYR 74 -11.353 -2.340 4.287 568 1HB TYR 74 HB2 TYR 74 -13.319 -0.388 3.224 569 2HB TYR 74 HB1 TYR 74 -13.495 -2.054 2.684 570 HD1 TYR 74 HD1 TYR 74 -14.076 0.271 5.334 571 HD2 TYR 74 HD2 TYR 74 -13.655 -3.848 4.416 572 HE1 TYR 74 HE1 TYR 74 -15.231 -0.322 7.439 573 HE2 TYR 74 HE2 TYR 74 -14.773 -4.460 6.507 574 HH TYR 74 HH TYR 74 -16.500 -2.220 8.373 575 H HIS 75 HN HIS 75 -10.827 -3.904 2.984 576 HA HIS 75 HA HIS 75 -10.834 -4.156 0.265 577 1HB HIS 75 HB2 HIS 75 -9.406 -2.049 0.394 578 2HB HIS 75 HB1 HIS 75 -8.150 -3.047 1.091 579 HD1 HIS 75 HD1 HIS 75 -6.808 -4.534 -0.501 580 HD2 HIS 75 HD2 HIS 75 -9.875 -2.425 -2.342 581 HE1 HIS 75 HE1 HIS 75 -6.418 -4.796 -2.968 582 HE2 HIS 75 HE2 HIS 75 -8.157 -3.314 -4.052 583 HA PRO 76 HA PRO 76 -10.008 -7.878 2.384 584 1HB PRO 76 HB2 PRO 76 -10.100 -9.638 0.360 585 2HB PRO 76 HB1 PRO 76 -11.521 -8.727 0.886 586 1HG PRO 76 HG2 PRO 76 -9.656 -8.141 -1.385 587 2HG PRO 76 HG1 PRO 76 -11.432 -8.193 -1.389 588 1HD PRO 76 HD2 PRO 76 -10.084 -5.877 -1.196 589 2HD PRO 76 HD1 PRO 76 -11.616 -6.138 -0.338 590 H ASN 77 HN ASN 77 -7.556 -6.418 1.094 591 HA ASN 77 HA ASN 77 -5.778 -8.745 1.301 592 1HB ASN 77 HB2 ASN 77 -5.413 -6.298 -0.459 593 2HB ASN 77 HB1 ASN 77 -4.169 -7.515 -0.187 594 1HD2 ASN 77 1HD2 ASN 77 -5.205 -6.813 -2.708 595 2HD2 ASN 77 2HD2 ASN 77 -5.994 -8.206 -3.363 596 H ILE 78 HN ILE 78 -6.879 -6.000 2.667 597 HA ILE 78 HA ILE 78 -4.416 -5.369 4.061 598 HB ILE 78 HB ILE 78 -7.050 -3.872 3.869 599 1HG1 ILE 78 2HG1 ILE 78 -5.488 -2.087 3.075 600 2HG1 ILE 78 1HG1 ILE 78 -4.241 -3.299 3.084 601 1HG2 ILE 78 3HG2 ILE 78 -6.062 -3.760 6.164 602 2HG2 ILE 78 2HG2 ILE 78 -4.595 -3.111 5.417 603 3HG2 ILE 78 1HG2 ILE 78 -6.106 -2.208 5.321 604 1HD1 ILE 78 1HD1 ILE 78 -6.618 -4.019 1.555 605 2HD1 ILE 78 3HD1 ILE 78 -5.701 -2.659 0.913 606 3HD1 ILE 78 2HD1 ILE 78 -4.918 -4.223 1.158 607 H ASN 79 HN ASN 79 -4.308 -5.547 6.206 608 HA ASN 79 HA ASN 79 -6.321 -7.240 7.492 609 1HB ASN 79 HB2 ASN 79 -4.535 -8.282 8.622 610 2HB ASN 79 HB1 ASN 79 -3.916 -7.980 6.996 611 1HD2 ASN 79 1HD2 ASN 79 -2.522 -6.259 6.680 612 2HD2 ASN 79 2HD2 ASN 79 -1.610 -5.580 7.985 613 H SER 80 HN SER 80 -6.140 -6.999 9.987 614 HA SER 80 HA SER 80 -7.444 -4.958 10.945 615 1HB SER 80 HB2 SER 80 -5.063 -6.086 12.412 616 2HB SER 80 HB1 SER 80 -6.507 -5.366 13.129 617 HG SER 80 HG SER 80 -7.690 -7.082 12.528 618 H ASN 81 HN ASN 81 -3.860 -4.662 10.592 619 HA ASN 81 HA ASN 81 -4.060 -1.897 11.417 620 1HB ASN 81 HB2 ASN 81 -1.577 -1.859 10.693 621 2HB ASN 81 HB1 ASN 81 -2.032 -2.748 12.136 622 1HD2 ASN 81 1HD2 ASN 81 -1.703 -4.889 12.230 623 2HD2 ASN 81 2HD2 ASN 81 -0.939 -5.809 10.979 624 H GLY 82 HN GLY 82 -2.003 -2.597 8.668 625 1HA GLY 82 HA1 GLY 82 -2.773 -0.620 7.033 626 2HA GLY 82 HA2 GLY 82 -3.999 -1.843 6.731 627 H SER 83 HN SER 83 -1.850 -3.903 7.373 628 HA SER 83 HA SER 83 0.115 -3.557 5.277 629 1HB SER 83 HB2 SER 83 0.634 -4.708 7.461 630 2HB SER 83 HB1 SER 83 -0.436 -6.023 6.948 631 HG SER 83 HG SER 83 1.553 -5.257 5.151 632 H ILE 84 HN ILE 84 0.032 -4.420 3.293 633 HA ILE 84 HA ILE 84 -2.468 -5.709 2.556 634 HB ILE 84 HB ILE 84 -0.464 -4.218 0.879 635 1HG1 ILE 84 2HG1 ILE 84 -3.244 -3.455 1.791 636 2HG1 ILE 84 1HG1 ILE 84 -1.750 -2.858 2.510 637 1HG2 ILE 84 3HG2 ILE 84 -3.163 -5.341 0.133 638 2HG2 ILE 84 2HG2 ILE 84 -2.170 -4.303 -0.888 639 3HG2 ILE 84 1HG2 ILE 84 -1.597 -5.911 -0.447 640 1HD1 ILE 84 3HD1 ILE 84 -1.133 -1.833 0.389 641 2HD1 ILE 84 2HD1 ILE 84 -2.638 -2.417 -0.325 642 3HD1 ILE 84 1HD1 ILE 84 -2.683 -1.234 0.986 643 H CYS 85 HN CYS 85 -2.540 -7.682 1.720 644 HA CYS 85 HA CYS 85 -0.133 -9.181 1.293 645 1HB CYS 85 HB2 CYS 85 -3.084 -9.774 1.094 646 2HB CYS 85 HB1 CYS 85 -1.903 -10.887 0.393 647 HG CYS 85 HG CYS 85 -2.979 -10.798 3.412 648 H LEU 86 HN LEU 86 0.974 -8.203 -0.294 649 HA LEU 86 HA LEU 86 -0.269 -8.059 -2.963 650 1HB LEU 86 HB2 LEU 86 0.484 -5.912 -2.008 651 2HB LEU 86 HB1 LEU 86 2.108 -6.557 -1.879 652 HG LEU 86 HG LEU 86 2.261 -6.718 -4.316 653 1HD1 LEU 86 3HD1 LEU 86 -0.150 -7.054 -4.782 654 2HD1 LEU 86 2HD1 LEU 86 -0.428 -5.359 -4.376 655 3HD1 LEU 86 1HD1 LEU 86 0.576 -5.779 -5.761 656 1HD2 LEU 86 2HD2 LEU 86 1.397 -4.035 -3.266 657 2HD2 LEU 86 1HD2 LEU 86 3.029 -4.706 -3.247 658 3HD2 LEU 86 3HD2 LEU 86 2.261 -4.301 -4.782 659 H ASP 87 HN ASP 87 0.393 -9.421 -4.429 660 HA ASP 87 HA ASP 87 2.063 -11.582 -4.002 661 1HB ASP 87 HB2 ASP 87 0.327 -11.238 -5.807 662 2HB ASP 87 HB1 ASP 87 1.531 -10.306 -6.690 663 H ILE 88 HN ILE 88 2.959 -8.652 -5.870 664 HA ILE 88 HA ILE 88 5.543 -9.463 -6.455 665 HB ILE 88 HB ILE 88 5.953 -6.784 -6.216 666 1HG1 ILE 88 2HG1 ILE 88 3.169 -7.201 -5.901 667 2HG1 ILE 88 1HG1 ILE 88 4.040 -5.677 -6.021 668 1HG2 ILE 88 1HG2 ILE 88 6.493 -8.152 -8.137 669 2HG2 ILE 88 3HG2 ILE 88 4.781 -8.294 -8.540 670 3HG2 ILE 88 2HG2 ILE 88 5.584 -6.725 -8.631 671 1HD1 ILE 88 1HD1 ILE 88 3.249 -7.267 -8.424 672 2HD1 ILE 88 3HD1 ILE 88 2.199 -6.035 -7.698 673 3HD1 ILE 88 2HD1 ILE 88 3.783 -5.576 -8.336 674 H LEU 89 HN LEU 89 4.484 -8.857 -3.351 675 HA LEU 89 HA LEU 89 7.259 -8.288 -2.545 676 1HB LEU 89 HB2 LEU 89 4.747 -7.853 -0.954 677 2HB LEU 89 HB1 LEU 89 6.369 -7.409 -0.475 678 HG LEU 89 HG LEU 89 4.581 -6.125 -2.503 679 1HD1 LEU 89 2HD1 LEU 89 6.124 -5.230 -0.094 680 2HD1 LEU 89 1HD1 LEU 89 5.388 -4.106 -1.231 681 3HD1 LEU 89 3HD1 LEU 89 4.378 -5.238 -0.340 682 1HD2 LEU 89 1HD2 LEU 89 6.746 -6.458 -3.644 683 2HD2 LEU 89 3HD2 LEU 89 6.410 -4.760 -3.309 684 3HD2 LEU 89 2HD2 LEU 89 7.556 -5.643 -2.303 685 H ARG 90 HN ARG 90 4.709 -10.514 -2.526 686 HA ARG 90 HA ARG 90 5.943 -12.019 -0.299 687 1HB ARG 90 HB2 ARG 90 3.734 -13.163 -0.077 688 2HB ARG 90 HB1 ARG 90 3.700 -11.442 0.273 689 1HG ARG 90 HG2 ARG 90 2.841 -11.049 -2.016 690 2HG ARG 90 HG1 ARG 90 2.731 -12.798 -2.234 691 1HD ARG 90 HD2 ARG 90 1.353 -11.202 -0.075 692 2HD ARG 90 HD1 ARG 90 0.587 -11.764 -1.558 693 HE ARG 90 HE ARG 90 1.012 -14.057 -0.758 694 1HH1 ARG 90 1HH1 ARG 90 1.091 -11.461 1.607 695 2HH1 ARG 90 2HH1 ARG 90 0.651 -12.486 2.929 696 1HH2 ARG 90 1HH2 ARG 90 0.442 -15.405 0.987 697 2HH2 ARG 90 2HH2 ARG 90 0.266 -14.727 2.576 698 H SER 91 HN SER 91 4.828 -12.264 -3.616 699 HA SER 91 HA SER 91 6.009 -14.922 -3.711 700 1HB SER 91 HB2 SER 91 3.454 -14.092 -5.056 701 2HB SER 91 HB1 SER 91 4.245 -15.663 -5.247 702 HG SER 91 HG SER 91 4.078 -15.451 -2.713 703 H GLN 92 HN GLN 92 5.349 -11.930 -5.339 704 HA GLN 92 HA GLN 92 6.911 -12.835 -7.634 705 1HB GLN 92 HB2 GLN 92 4.472 -11.428 -7.419 706 2HB GLN 92 HB1 GLN 92 5.633 -10.314 -8.159 707 1HG GLN 92 HG2 GLN 92 6.269 -12.227 -9.667 708 2HG GLN 92 HG1 GLN 92 4.859 -13.078 -9.027 709 1HE2 GLN 92 1HE2 GLN 92 3.193 -10.764 -8.837 710 2HE2 GLN 92 2HE2 GLN 92 2.758 -10.314 -10.449 711 H TRP 93 HN TRP 93 7.915 -11.730 -5.014 712 HA TRP 93 HA TRP 93 9.162 -9.283 -5.800 713 1HB TRP 93 HB2 TRP 93 8.702 -9.662 -3.448 714 2HB TRP 93 HB1 TRP 93 9.763 -11.064 -3.466 715 HD1 TRP 93 HD1 TRP 93 12.333 -10.610 -3.092 716 HE1 TRP 93 HE1 TRP 93 13.770 -8.485 -2.726 717 HE3 TRP 93 HE3 TRP 93 8.830 -7.058 -4.174 718 HZ2 TRP 93 HZ2 TRP 93 13.451 -5.707 -2.892 719 HZ3 TRP 93 HZ3 TRP 93 9.482 -4.690 -4.059 720 HH2 TRP 93 HH2 TRP 93 11.746 -4.028 -3.425 721 H SER 94 HN SER 94 11.256 -8.921 -6.295 722 HA SER 94 HA SER 94 13.223 -10.976 -6.458 723 1HB SER 94 HB2 SER 94 11.990 -9.824 -8.960 724 2HB SER 94 HB1 SER 94 13.553 -10.627 -8.951 725 HG SER 94 HG SER 94 11.462 -12.025 -7.777 726 HA PRO 95 HA PRO 95 15.780 -7.328 -6.104 727 1HB PRO 95 HB2 PRO 95 18.012 -8.106 -7.502 728 2HB PRO 95 HB1 PRO 95 17.663 -8.609 -5.845 729 1HG PRO 95 HG2 PRO 95 17.240 -10.085 -8.407 730 2HG PRO 95 HG1 PRO 95 17.809 -10.695 -6.841 731 1HD PRO 95 HD2 PRO 95 15.270 -11.055 -7.706 732 2HD PRO 95 HD1 PRO 95 15.673 -10.860 -5.989 733 H ALA 96 HN ALA 96 14.267 -6.179 -7.435 734 HA ALA 96 HA ALA 96 15.273 -4.953 -9.750 735 1HB ALA 96 HB1 ALA 96 13.191 -7.075 -10.275 736 2HB ALA 96 HB3 ALA 96 13.764 -5.893 -11.453 737 3HB ALA 96 HB2 ALA 96 14.869 -7.112 -10.811 738 H LEU 97 HN LEU 97 12.462 -5.990 -7.903 739 HA LEU 97 HA LEU 97 10.719 -3.923 -8.801 740 1HB LEU 97 HB2 LEU 97 10.616 -5.650 -6.357 741 2HB LEU 97 HB1 LEU 97 9.313 -4.617 -6.926 742 HG LEU 97 HG LEU 97 10.478 -6.835 -8.594 743 1HD1 LEU 97 1HD1 LEU 97 9.589 -7.583 -6.420 744 2HD1 LEU 97 3HD1 LEU 97 8.022 -6.943 -6.904 745 3HD1 LEU 97 2HD1 LEU 97 8.763 -8.249 -7.832 746 1HD2 LEU 97 1HD2 LEU 97 9.173 -5.028 -9.736 747 2HD2 LEU 97 3HD2 LEU 97 8.464 -6.637 -9.875 748 3HD2 LEU 97 2HD2 LEU 97 7.787 -5.476 -8.734 749 H THR 98 HN THR 98 10.319 -1.959 -7.936 750 HA THR 98 HA THR 98 11.829 -1.174 -5.539 751 HB THR 98 HB THR 98 11.291 1.183 -6.389 752 HG1 THR 98 HG1 THR 98 11.050 0.944 -8.865 753 1HG2 THR 98 3HG2 THR 98 13.530 0.144 -6.605 754 2HG2 THR 98 2HG2 THR 98 13.036 -0.547 -8.151 755 3HG2 THR 98 1HG2 THR 98 13.147 1.202 -7.964 756 H ILE 99 HN ILE 99 10.597 0.558 -4.246 757 HA ILE 99 HA ILE 99 7.874 -0.258 -3.830 758 HB ILE 99 HB ILE 99 8.509 2.336 -2.643 759 1HG1 ILE 99 2HG1 ILE 99 10.765 1.153 -2.654 760 2HG1 ILE 99 1HG1 ILE 99 10.160 1.564 -1.061 761 1HG2 ILE 99 2HG2 ILE 99 6.574 0.969 -2.040 762 2HG2 ILE 99 1HG2 ILE 99 7.636 -0.320 -1.510 763 3HG2 ILE 99 3HG2 ILE 99 7.624 1.215 -0.648 764 1HD1 ILE 99 3HD1 ILE 99 9.365 -0.740 -0.778 765 2HD1 ILE 99 2HD1 ILE 99 10.029 -1.142 -2.360 766 3HD1 ILE 99 1HD1 ILE 99 11.106 -0.656 -1.052 767 H SER 100 HN SER 100 9.628 2.276 -5.320 768 HA SER 100 HA SER 100 7.803 3.914 -6.404 769 1HB SER 100 HB2 SER 100 10.248 3.907 -6.855 770 2HB SER 100 HB1 SER 100 10.023 2.517 -7.918 771 HG SER 100 HG SER 100 10.090 4.712 -8.896 772 H LYS 101 HN LYS 101 8.375 0.549 -7.420 773 HA LYS 101 HA LYS 101 6.130 0.630 -9.197 774 1HB LYS 101 HB2 LYS 101 6.755 -1.435 -9.945 775 2HB LYS 101 HB1 LYS 101 8.283 -0.792 -9.377 776 1HG LYS 101 HG2 LYS 101 8.392 -2.880 -8.507 777 2HG LYS 101 HG1 LYS 101 7.582 -2.059 -7.168 778 1HD LYS 101 HD2 LYS 101 5.447 -2.692 -8.592 779 2HD LYS 101 HD1 LYS 101 6.510 -3.994 -9.138 780 1HE LYS 101 HE2 LYS 101 5.583 -3.392 -6.355 781 2HE LYS 101 HE1 LYS 101 5.348 -4.865 -7.283 782 1HZ LYS 101 HZ1 LYS 101 7.730 -5.273 -7.119 783 2HZ LYS 101 HZ3 LYS 101 7.921 -3.870 -6.192 784 3HZ LYS 101 HZ2 LYS 101 7.017 -5.169 -5.592 785 H VAL 102 HN VAL 102 6.597 -0.962 -5.966 786 HA VAL 102 HA VAL 102 4.038 -2.224 -6.137 787 HB VAL 102 HB VAL 102 5.066 -3.473 -4.574 788 1HG1 VAL 102 3HG1 VAL 102 7.137 -1.992 -4.782 789 2HG1 VAL 102 2HG1 VAL 102 6.521 -1.199 -3.319 790 3HG1 VAL 102 1HG1 VAL 102 6.925 -2.909 -3.285 791 1HG2 VAL 102 3HG2 VAL 102 4.224 -1.226 -2.762 792 2HG2 VAL 102 2HG2 VAL 102 3.216 -2.567 -3.302 793 3HG2 VAL 102 1HG2 VAL 102 4.597 -2.869 -2.253 794 H LEU 103 HN LEU 103 5.088 0.839 -4.766 795 HA LEU 103 HA LEU 103 2.813 1.376 -3.248 796 1HB LEU 103 HB2 LEU 103 4.657 3.235 -4.735 797 2HB LEU 103 HB1 LEU 103 3.379 3.801 -3.683 798 HG LEU 103 HG LEU 103 5.886 2.301 -2.930 799 1HD1 LEU 103 3HD1 LEU 103 4.754 4.994 -2.248 800 2HD1 LEU 103 2HD1 LEU 103 6.121 4.263 -1.404 801 3HD1 LEU 103 1HD1 LEU 103 6.233 4.621 -3.126 802 1HD2 LEU 103 3HD2 LEU 103 3.472 2.865 -1.193 803 2HD2 LEU 103 2HD2 LEU 103 4.088 1.279 -1.657 804 3HD2 LEU 103 1HD2 LEU 103 5.043 2.320 -0.603 805 H LEU 104 HN LEU 104 3.466 1.918 -6.695 806 HA LEU 104 HA LEU 104 0.890 2.966 -7.200 807 1HB LEU 104 HB2 LEU 104 3.087 1.945 -8.927 808 2HB LEU 104 HB1 LEU 104 1.517 2.314 -9.614 809 HG LEU 104 HG LEU 104 1.791 4.615 -8.499 810 1HD1 LEU 104 2HD1 LEU 104 3.677 4.044 -7.085 811 2HD1 LEU 104 1HD1 LEU 104 4.655 3.708 -8.512 812 3HD1 LEU 104 3HD1 LEU 104 4.083 5.348 -8.201 813 1HD2 LEU 104 1HD2 LEU 104 1.852 4.189 -10.893 814 2HD2 LEU 104 3HD2 LEU 104 3.021 5.428 -10.432 815 3HD2 LEU 104 2HD2 LEU 104 3.563 3.785 -10.774 816 H SER 105 HN SER 105 2.229 -0.307 -7.219 817 HA SER 105 HA SER 105 0.017 -1.564 -8.419 818 1HB SER 105 HB2 SER 105 1.634 -2.804 -6.210 819 2HB SER 105 HB1 SER 105 0.841 -3.596 -7.572 820 HG SER 105 HG SER 105 2.382 -2.242 -8.875 821 H ILE 106 HN ILE 106 0.741 -0.786 -5.025 822 HA ILE 106 HA ILE 106 -1.645 -1.823 -3.928 823 HB ILE 106 HB ILE 106 0.333 0.239 -2.996 824 1HG1 ILE 106 2HG1 ILE 106 -0.446 -2.482 -1.888 825 2HG1 ILE 106 1HG1 ILE 106 0.976 -2.150 -2.878 826 1HG2 ILE 106 1HG2 ILE 106 -2.168 -0.585 -1.532 827 2HG2 ILE 106 3HG2 ILE 106 -0.852 0.370 -0.851 828 3HG2 ILE 106 2HG2 ILE 106 -1.811 1.013 -2.184 829 1HD1 ILE 106 1HD1 ILE 106 0.456 -0.895 -0.187 830 2HD1 ILE 106 3HD1 ILE 106 1.450 -2.327 -0.457 831 3HD1 ILE 106 2HD1 ILE 106 1.925 -0.783 -1.158 832 H CYS 107 HN CYS 107 -0.712 1.362 -5.111 833 HA CYS 107 HA CYS 107 -3.112 2.733 -4.798 834 1HB CYS 107 HB2 CYS 107 -1.170 3.903 -5.513 835 2HB CYS 107 HB1 CYS 107 -0.966 2.854 -6.904 836 HG CYS 107 HG CYS 107 -2.136 4.443 -8.522 837 H SER 108 HN SER 108 -2.059 0.455 -7.283 838 HA SER 108 HA SER 108 -4.360 0.825 -8.932 839 1HB SER 108 HB2 SER 108 -2.370 -1.434 -8.885 840 2HB SER 108 HB1 SER 108 -3.552 -1.120 -10.151 841 HG SER 108 HG SER 108 -1.483 0.668 -9.372 842 H LEU 109 HN LEU 109 -3.724 -0.950 -6.063 843 HA LEU 109 HA LEU 109 -5.824 -2.895 -6.573 844 1HB LEU 109 HB2 LEU 109 -4.063 -2.362 -4.175 845 2HB LEU 109 HB1 LEU 109 -5.327 -3.576 -4.184 846 HG LEU 109 HG LEU 109 -2.951 -3.574 -6.043 847 1HD1 LEU 109 2HD1 LEU 109 -3.473 -4.960 -3.432 848 2HD1 LEU 109 1HD1 LEU 109 -2.300 -5.552 -4.609 849 3HD1 LEU 109 3HD1 LEU 109 -2.093 -3.956 -3.889 850 1HD2 LEU 109 2HD2 LEU 109 -4.919 -4.709 -6.946 851 2HD2 LEU 109 1HD2 LEU 109 -3.653 -5.866 -6.530 852 3HD2 LEU 109 3HD2 LEU 109 -5.048 -5.667 -5.470 853 H LEU 110 HN LEU 110 -5.123 -0.038 -4.769 854 HA LEU 110 HA LEU 110 -7.670 0.356 -3.625 855 1HB LEU 110 HB2 LEU 110 -5.259 2.006 -4.204 856 2HB LEU 110 HB1 LEU 110 -6.746 2.880 -3.944 857 HG LEU 110 HG LEU 110 -6.817 2.236 -1.704 858 1HD1 LEU 110 1HD1 LEU 110 -6.621 -0.213 -2.176 859 2HD1 LEU 110 3HD1 LEU 110 -4.871 -0.001 -2.200 860 3HD1 LEU 110 2HD1 LEU 110 -5.783 0.321 -0.727 861 1HD2 LEU 110 1HD2 LEU 110 -4.808 3.609 -2.308 862 2HD2 LEU 110 3HD2 LEU 110 -4.704 2.731 -0.785 863 3HD2 LEU 110 2HD2 LEU 110 -3.870 2.118 -2.213 864 H CYS 111 HN CYS 111 -6.403 0.576 -6.796 865 HA CYS 111 HA CYS 111 -8.513 2.319 -7.689 866 1HB CYS 111 HB2 CYS 111 -6.281 2.756 -8.476 867 2HB CYS 111 HB1 CYS 111 -6.156 1.127 -9.132 868 HG CYS 111 HG CYS 111 -8.480 3.365 -10.261 869 H ASP 112 HN ASP 112 -7.215 -0.788 -9.045 870 HA ASP 112 HA ASP 112 -9.738 -0.889 -10.529 871 1HB ASP 112 HB2 ASP 112 -8.005 -0.787 -12.055 872 2HB ASP 112 HB1 ASP 112 -6.994 -1.910 -11.161 873 HA PRO 113 HA PRO 113 -9.934 -5.272 -8.986 874 1HB PRO 113 HB2 PRO 113 -7.763 -6.791 -9.024 875 2HB PRO 113 HB1 PRO 113 -8.292 -5.976 -10.500 876 1HG PRO 113 HG2 PRO 113 -5.952 -5.405 -8.799 877 2HG PRO 113 HG1 PRO 113 -6.253 -4.946 -10.483 878 1HD PRO 113 HD2 PRO 113 -6.773 -3.419 -8.027 879 2HD PRO 113 HD1 PRO 113 -6.702 -2.850 -9.701 880 H ASN 114 HN ASN 114 -8.468 -7.201 -7.617 881 HA ASN 114 HA ASN 114 -7.291 -6.972 -5.305 882 1HB ASN 114 HB2 ASN 114 -8.738 -6.494 -3.504 883 2HB ASN 114 HB1 ASN 114 -9.014 -5.219 -4.680 884 1HD2 ASN 114 1HD2 ASN 114 -10.251 -8.166 -3.337 885 2HD2 ASN 114 2HD2 ASN 114 -11.903 -7.910 -3.763 886 HA PRO 115 HA PRO 115 -10.505 -10.745 -5.420 887 1HB PRO 115 HB2 PRO 115 -9.656 -11.743 -8.067 888 2HB PRO 115 HB1 PRO 115 -11.270 -11.665 -7.355 889 1HG PRO 115 HG2 PRO 115 -10.544 -10.007 -9.318 890 2HG PRO 115 HG1 PRO 115 -11.587 -9.464 -7.989 891 1HD PRO 115 HD2 PRO 115 -8.653 -9.020 -8.397 892 2HD PRO 115 HD1 PRO 115 -9.899 -7.883 -7.844 893 H ASP 116 HN ASP 116 -8.827 -11.081 -3.927 894 HA ASP 116 HA ASP 116 -7.277 -13.444 -4.559 895 1HB ASP 116 HB2 ASP 116 -6.130 -10.900 -3.400 896 2HB ASP 116 HB1 ASP 116 -5.347 -12.459 -3.193 897 H ASP 117 HN ASP 117 -8.175 -11.040 -2.191 898 HA ASP 117 HA ASP 117 -8.651 -11.181 0.043 899 1HB ASP 117 HB2 ASP 117 -10.881 -12.210 0.322 900 2HB ASP 117 HB1 ASP 117 -10.742 -11.194 -1.106 901 HA PRO 118 HA PRO 118 -7.065 -15.321 1.292 902 1HB PRO 118 HB2 PRO 118 -4.405 -15.086 1.132 903 2HB PRO 118 HB1 PRO 118 -5.378 -15.389 -0.310 904 1HG PRO 118 HG2 PRO 118 -3.959 -12.942 0.506 905 2HG PRO 118 HG1 PRO 118 -4.504 -13.440 -1.103 906 1HD PRO 118 HD2 PRO 118 -5.806 -11.655 0.789 907 2HD PRO 118 HD1 PRO 118 -6.258 -12.013 -0.890 908 H LEU 119 HN LEU 119 -7.148 -12.335 2.545 909 HA LEU 119 HA LEU 119 -5.286 -12.886 4.741 910 1HB LEU 119 HB2 LEU 119 -4.947 -10.854 3.276 911 2HB LEU 119 HB1 LEU 119 -6.383 -10.185 4.025 912 HG LEU 119 HG LEU 119 -5.334 -10.049 6.151 913 1HD1 LEU 119 3HD1 LEU 119 -3.109 -11.705 4.964 914 2HD1 LEU 119 2HD1 LEU 119 -3.034 -10.911 6.538 915 3HD1 LEU 119 1HD1 LEU 119 -4.222 -12.182 6.245 916 1HD2 LEU 119 3HD2 LEU 119 -3.568 -9.204 3.880 917 2HD2 LEU 119 2HD2 LEU 119 -4.660 -8.223 4.856 918 3HD2 LEU 119 1HD2 LEU 119 -3.162 -8.837 5.554 919 H VAL 120 HN VAL 120 -8.133 -10.661 4.673 920 HA VAL 120 HA VAL 120 -8.747 -11.845 7.315 921 HB VAL 120 HB VAL 120 -9.649 -9.165 6.268 922 1HG1 VAL 120 2HG1 VAL 120 -10.992 -10.122 8.092 923 2HG1 VAL 120 1HG1 VAL 120 -9.537 -10.287 9.073 924 3HG1 VAL 120 3HG1 VAL 120 -10.112 -8.688 8.612 925 1HG2 VAL 120 1HG2 VAL 120 -7.218 -9.904 7.888 926 2HG2 VAL 120 3HG2 VAL 120 -7.285 -9.023 6.357 927 3HG2 VAL 120 2HG2 VAL 120 -7.884 -8.273 7.838 928 HA PRO 121 HA PRO 121 -12.386 -13.756 5.569 929 1HB PRO 121 HB2 PRO 121 -13.354 -13.415 8.367 930 2HB PRO 121 HB1 PRO 121 -13.349 -14.858 7.345 931 1HG PRO 121 HG2 PRO 121 -11.572 -14.578 9.302 932 2HG PRO 121 HG1 PRO 121 -11.112 -15.296 7.748 933 1HD PRO 121 HD2 PRO 121 -10.525 -12.579 8.829 934 2HD PRO 121 HD1 PRO 121 -9.530 -13.629 7.800 935 H GLU 122 HN GLU 122 -12.891 -11.128 7.949 936 HA GLU 122 HA GLU 122 -15.460 -10.462 6.980 937 1HB GLU 122 HB2 GLU 122 -14.896 -8.191 8.107 938 2HB GLU 122 HB1 GLU 122 -15.184 -9.626 9.096 939 1HG GLU 122 HG2 GLU 122 -12.758 -9.962 9.264 940 2HG GLU 122 HG1 GLU 122 -12.501 -8.492 8.326 941 H ILE 123 HN ILE 123 -12.274 -9.112 6.326 942 HA ILE 123 HA ILE 123 -13.423 -7.034 4.745 943 HB ILE 123 HB ILE 123 -10.525 -7.776 4.666 944 1HG1 ILE 123 2HG1 ILE 123 -11.890 -5.991 6.681 945 2HG1 ILE 123 1HG1 ILE 123 -11.344 -7.632 7.031 946 1HG2 ILE 123 2HG2 ILE 123 -12.029 -5.182 4.420 947 2HG2 ILE 123 1HG2 ILE 123 -10.275 -5.378 4.310 948 3HG2 ILE 123 3HG2 ILE 123 -11.322 -6.104 3.087 949 1HD1 ILE 123 1HD1 ILE 123 -9.609 -5.381 6.104 950 2HD1 ILE 123 3HD1 ILE 123 -9.756 -5.959 7.771 951 3HD1 ILE 123 2HD1 ILE 123 -9.095 -7.023 6.524 952 H ALA 124 HN ALA 124 -12.021 -10.161 4.196 953 HA ALA 124 HA ALA 124 -12.221 -10.309 1.427 954 1HB ALA 124 HB2 ALA 124 -13.107 -12.422 3.387 955 2HB ALA 124 HB1 ALA 124 -12.707 -12.674 1.687 956 3HB ALA 124 HB3 ALA 124 -11.453 -12.177 2.826 957 H ARG 125 HN ARG 125 -14.807 -10.634 3.865 958 HA ARG 125 HA ARG 125 -16.830 -11.301 1.998 959 1HB ARG 125 HB2 ARG 125 -18.298 -11.356 3.752 960 2HB ARG 125 HB1 ARG 125 -16.799 -11.435 4.666 961 1HG ARG 125 HG2 ARG 125 -17.158 -9.459 5.629 962 2HG ARG 125 HG1 ARG 125 -17.651 -8.692 4.136 963 1HD ARG 125 HD2 ARG 125 -19.450 -8.655 5.753 964 2HD ARG 125 HD1 ARG 125 -19.862 -9.613 4.338 965 HE ARG 125 HE ARG 125 -18.847 -11.207 6.493 966 1HH1 ARG 125 1HH1 ARG 125 -21.675 -9.582 5.212 967 2HH1 ARG 125 2HH1 ARG 125 -22.802 -10.639 6.017 968 1HH2 ARG 125 1HH2 ARG 125 -20.330 -12.619 7.540 969 2HH2 ARG 125 2HH2 ARG 125 -22.034 -12.366 7.345 970 H ILE 126 HN ILE 126 -15.935 -8.289 3.602 971 HA ILE 126 HA ILE 126 -18.035 -6.784 2.636 972 HB ILE 126 HB ILE 126 -16.627 -4.816 3.160 973 1HG1 ILE 126 2HG1 ILE 126 -14.474 -5.598 4.477 974 2HG1 ILE 126 1HG1 ILE 126 -14.530 -6.931 3.318 975 1HG2 ILE 126 1HG2 ILE 126 -17.972 -5.891 4.872 976 2HG2 ILE 126 3HG2 ILE 126 -16.654 -7.010 5.220 977 3HG2 ILE 126 2HG2 ILE 126 -16.465 -5.290 5.562 978 1HD1 ILE 126 2HD1 ILE 126 -14.463 -4.000 2.584 979 2HD1 ILE 126 1HD1 ILE 126 -13.083 -5.098 2.558 980 3HD1 ILE 126 3HD1 ILE 126 -14.442 -5.365 1.468 981 H TYR 127 HN TYR 127 -15.288 -7.916 1.050 982 HA TYR 127 HA TYR 127 -15.700 -6.137 -1.186 983 1HB TYR 127 HB2 TYR 127 -13.462 -6.633 -1.151 984 2HB TYR 127 HB1 TYR 127 -13.733 -8.284 -0.582 985 HD1 TYR 127 HD1 TYR 127 -13.434 -10.034 -2.085 986 HD2 TYR 127 HD2 TYR 127 -14.394 -6.179 -3.619 987 HE1 TYR 127 HE1 TYR 127 -13.253 -10.906 -4.377 988 HE2 TYR 127 HE2 TYR 127 -14.207 -7.047 -5.915 989 HH TYR 127 HH TYR 127 -13.239 -8.848 -7.139 990 H LYS 128 HN LYS 128 -16.147 -9.560 -0.464 991 HA LYS 128 HA LYS 128 -17.310 -9.976 -3.122 992 1HB LYS 128 HB2 LYS 128 -16.931 -12.332 -2.698 993 2HB LYS 128 HB1 LYS 128 -15.465 -11.423 -2.348 994 1HG LYS 128 HG2 LYS 128 -16.575 -11.425 0.088 995 2HG LYS 128 HG1 LYS 128 -17.237 -12.933 -0.536 996 1HD LYS 128 HD2 LYS 128 -14.333 -12.165 -0.276 997 2HD LYS 128 HD1 LYS 128 -15.196 -13.418 0.612 998 1HE LYS 128 HE2 LYS 128 -14.787 -13.444 -2.376 999 2HE LYS 128 HE1 LYS 128 -13.723 -14.257 -1.232 1000 1HZ LYS 128 HZ2 LYS 128 -16.631 -14.811 -1.452 1001 2HZ LYS 128 HZ1 LYS 128 -15.433 -15.702 -2.249 1002 3HZ LYS 128 HZ3 LYS 128 -15.486 -15.680 -0.560 1003 H THR 129 HN THR 129 -18.625 -8.814 -0.569 1004 HA THR 129 HA THR 129 -21.071 -10.340 -0.679 1005 HB THR 129 HB THR 129 -19.464 -9.997 1.853 1006 HG1 THR 129 HG1 THR 129 -19.561 -11.978 0.047 1007 1HG2 THR 129 1HG2 THR 129 -21.855 -9.667 2.293 1008 2HG2 THR 129 3HG2 THR 129 -22.230 -11.194 1.489 1009 3HG2 THR 129 2HG2 THR 129 -21.300 -11.189 2.988 1010 H ASP 130 HN ASP 130 -19.698 -8.107 1.706 1011 HA ASP 130 HA ASP 130 -21.985 -6.348 1.331 1012 1HB ASP 130 HB2 ASP 130 -19.700 -6.364 3.315 1013 2HB ASP 130 HB1 ASP 130 -20.822 -5.030 3.181 1014 H ARG 131 HN ARG 131 -20.932 -6.189 -0.950 1015 HA ARG 131 HA ARG 131 -18.673 -4.909 -1.633 1016 1HB ARG 131 HB2 ARG 131 -20.362 -5.781 -3.198 1017 2HB ARG 131 HB1 ARG 131 -21.382 -4.390 -2.870 1018 1HG ARG 131 HG2 ARG 131 -20.263 -4.063 -4.951 1019 2HG ARG 131 HG1 ARG 131 -19.592 -2.937 -3.772 1020 1HD ARG 131 HD2 ARG 131 -17.650 -4.333 -3.473 1021 2HD ARG 131 HD1 ARG 131 -18.342 -5.580 -4.512 1022 HE ARG 131 HE ARG 131 -18.307 -3.406 -6.119 1023 1HH1 ARG 131 1HH1 ARG 131 -15.845 -4.979 -4.196 1024 2HH1 ARG 131 2HH1 ARG 131 -14.549 -4.516 -5.249 1025 1HH2 ARG 131 1HH2 ARG 131 -16.627 -2.803 -7.510 1026 2HH2 ARG 131 2HH2 ARG 131 -14.997 -3.271 -7.151 1027 H GLU 132 HN GLU 132 -21.539 -3.332 -0.341 1028 HA GLU 132 HA GLU 132 -20.792 -0.662 -0.690 1029 1HB GLU 132 HB2 GLU 132 -22.190 -0.314 1.433 1030 2HB GLU 132 HB1 GLU 132 -22.992 -0.948 0.006 1031 1HG GLU 132 HG2 GLU 132 -23.059 -3.133 0.921 1032 2HG GLU 132 HG1 GLU 132 -21.947 -2.700 2.215 1033 H LYS 133 HN LYS 133 -19.998 -2.946 1.838 1034 HA LYS 133 HA LYS 133 -18.769 -1.193 3.651 1035 1HB LYS 133 HB2 LYS 133 -18.815 -4.117 3.211 1036 2HB LYS 133 HB1 LYS 133 -17.460 -3.472 4.142 1037 1HG LYS 133 HG2 LYS 133 -19.317 -4.208 5.572 1038 2HG LYS 133 HG1 LYS 133 -18.974 -2.490 5.755 1039 1HD LYS 133 HD2 LYS 133 -20.900 -1.867 4.564 1040 2HD LYS 133 HD1 LYS 133 -21.122 -3.481 3.905 1041 1HE LYS 133 HE2 LYS 133 -21.325 -4.121 6.455 1042 2HE LYS 133 HE1 LYS 133 -21.772 -2.420 6.606 1043 1HZ LYS 133 HZ3 LYS 133 -23.453 -2.848 4.821 1044 2HZ LYS 133 HZ2 LYS 133 -23.109 -4.509 4.971 1045 3HZ LYS 133 HZ1 LYS 133 -23.754 -3.658 6.285 1046 H TYR 134 HN TYR 134 -17.726 -2.591 0.706 1047 HA TYR 134 HA TYR 134 -14.898 -2.211 1.155 1048 1HB TYR 134 HB2 TYR 134 -15.728 -4.054 -0.207 1049 2HB TYR 134 HB1 TYR 134 -16.558 -2.933 -1.267 1050 HD1 TYR 134 HD1 TYR 134 -15.220 -1.500 -2.830 1051 HD2 TYR 134 HD2 TYR 134 -13.446 -4.621 -0.545 1052 HE1 TYR 134 HE1 TYR 134 -13.310 -1.532 -4.372 1053 HE2 TYR 134 HE2 TYR 134 -11.524 -4.652 -2.082 1054 HH TYR 134 HH TYR 134 -11.200 -3.987 -4.625 1055 H ASN 135 HN ASN 135 -17.137 -0.980 -1.295 1056 HA ASN 135 HA ASN 135 -15.476 1.100 -2.125 1057 1HB ASN 135 HB2 ASN 135 -18.423 0.653 -2.504 1058 2HB ASN 135 HB1 ASN 135 -17.503 1.893 -3.335 1059 1HD2 ASN 135 1HD2 ASN 135 -17.946 -1.530 -2.928 1060 2HD2 ASN 135 2HD2 ASN 135 -17.253 -1.996 -4.441 1061 H ARG 136 HN ARG 136 -18.585 1.345 -0.421 1062 HA ARG 136 HA ARG 136 -18.544 4.133 -0.358 1063 1HB ARG 136 HB2 ARG 136 -20.639 3.129 -0.125 1064 2HB ARG 136 HB1 ARG 136 -20.099 2.070 1.170 1065 1HG ARG 136 HG2 ARG 136 -20.121 3.819 2.747 1066 2HG ARG 136 HG1 ARG 136 -20.247 5.051 1.488 1067 1HD ARG 136 HD2 ARG 136 -22.484 4.450 1.004 1068 2HD ARG 136 HD1 ARG 136 -22.363 2.957 1.932 1069 HE ARG 136 HE ARG 136 -22.173 4.429 3.937 1070 1HH1 ARG 136 1HH1 ARG 136 -23.720 5.643 1.029 1071 2HH1 ARG 136 2HH1 ARG 136 -24.760 6.727 1.894 1072 1HH2 ARG 136 1HH2 ARG 136 -23.549 5.852 5.058 1073 2HH2 ARG 136 2HH2 ARG 136 -24.665 6.843 4.172 1074 H ILE 137 HN ILE 137 -17.118 1.839 1.881 1075 HA ILE 137 HA ILE 137 -17.064 3.774 4.022 1076 HB ILE 137 HB ILE 137 -15.797 1.056 4.045 1077 1HG1 ILE 137 2HG1 ILE 137 -18.152 0.992 3.163 1078 2HG1 ILE 137 1HG1 ILE 137 -17.901 0.102 4.646 1079 1HG2 ILE 137 2HG2 ILE 137 -17.039 2.810 6.173 1080 2HG2 ILE 137 1HG2 ILE 137 -16.382 1.196 6.442 1081 3HG2 ILE 137 3HG2 ILE 137 -15.316 2.508 5.939 1082 1HD1 ILE 137 3HD1 ILE 137 -19.137 2.831 4.423 1083 2HD1 ILE 137 2HD1 ILE 137 -20.007 1.318 4.673 1084 3HD1 ILE 137 1HD1 ILE 137 -18.914 1.925 5.920 1085 H ALA 138 HN ALA 138 -14.708 1.952 2.053 1086 HA ALA 138 HA ALA 138 -12.512 3.447 3.073 1087 1HB ALA 138 HB1 ALA 138 -11.190 2.291 1.467 1088 2HB ALA 138 HB3 ALA 138 -12.369 1.160 2.140 1089 3HB ALA 138 HB2 ALA 138 -12.621 1.845 0.536 1090 H ARG 139 HN ARG 139 -14.881 3.985 0.612 1091 HA ARG 139 HA ARG 139 -13.421 6.060 -0.735 1092 1HB ARG 139 HB2 ARG 139 -15.149 4.967 -1.979 1093 2HB ARG 139 HB1 ARG 139 -16.349 5.320 -0.745 1094 1HG ARG 139 HG2 ARG 139 -16.204 7.699 -1.272 1095 2HG ARG 139 HG1 ARG 139 -14.975 7.360 -2.491 1096 1HD ARG 139 HD2 ARG 139 -17.725 6.146 -2.548 1097 2HD ARG 139 HD1 ARG 139 -17.339 7.673 -3.337 1098 HE ARG 139 HE ARG 139 -15.560 6.242 -4.521 1099 1HH1 ARG 139 1HH1 ARG 139 -18.748 5.130 -3.594 1100 2HH1 ARG 139 2HH1 ARG 139 -18.847 3.962 -4.872 1101 1HH2 ARG 139 1HH2 ARG 139 -15.707 4.742 -6.228 1102 2HH2 ARG 139 2HH2 ARG 139 -17.109 3.733 -6.369 1103 H GLU 140 HN GLU 140 -15.702 5.952 1.999 1104 HA GLU 140 HA GLU 140 -15.812 8.809 2.139 1105 1HB GLU 140 HB2 GLU 140 -16.571 8.433 4.502 1106 2HB GLU 140 HB1 GLU 140 -17.607 7.793 3.253 1107 1HG GLU 140 HG2 GLU 140 -16.689 5.574 3.672 1108 2HG GLU 140 HG1 GLU 140 -15.650 6.264 4.920 1109 H TRP 141 HN TRP 141 -13.902 6.311 3.797 1110 HA TRP 141 HA TRP 141 -12.302 8.056 5.271 1111 1HB TRP 141 HB2 TRP 141 -11.516 5.452 3.952 1112 2HB TRP 141 HB1 TRP 141 -10.576 6.285 5.192 1113 HD1 TRP 141 HD1 TRP 141 -13.329 7.069 6.896 1114 HE1 TRP 141 HE1 TRP 141 -14.325 5.217 8.372 1115 HE3 TRP 141 HE3 TRP 141 -11.158 3.014 4.656 1116 HZ2 TRP 141 HZ2 TRP 141 -14.190 2.416 8.553 1117 HZ3 TRP 141 HZ3 TRP 141 -11.663 0.787 5.565 1118 HH2 TRP 141 HH2 TRP 141 -13.139 0.496 7.475 1119 H THR 142 HN THR 142 -12.122 6.984 1.947 1120 HA THR 142 HA THR 142 -9.922 8.350 1.016 1121 HB THR 142 HB THR 142 -12.612 7.802 -0.193 1122 HG1 THR 142 HG1 THR 142 -11.100 6.094 0.008 1123 1HG2 THR 142 1HG2 THR 142 -10.341 9.273 -1.522 1124 2HG2 THR 142 3HG2 THR 142 -11.720 8.571 -2.371 1125 3HG2 THR 142 2HG2 THR 142 -11.967 9.885 -1.215 1126 H GLN 143 HN GLN 143 -13.160 9.618 1.684 1127 HA GLN 143 HA GLN 143 -12.539 12.268 0.726 1128 1HB GLN 143 HB2 GLN 143 -14.835 11.056 2.231 1129 2HB GLN 143 HB1 GLN 143 -14.799 12.737 1.758 1130 1HG GLN 143 HG2 GLN 143 -14.617 12.039 -0.553 1131 2HG GLN 143 HG1 GLN 143 -14.711 10.372 -0.041 1132 1HE2 GLN 143 1HE2 GLN 143 -16.647 9.521 0.616 1133 2HE2 GLN 143 2HE2 GLN 143 -18.157 10.327 0.389 1134 H LYS 144 HN LYS 144 -13.472 10.916 3.755 1135 HA LYS 144 HA LYS 144 -13.341 13.126 5.390 1136 1HB LYS 144 HB2 LYS 144 -13.085 10.184 5.850 1137 2HB LYS 144 HB1 LYS 144 -13.112 11.328 7.192 1138 1HG LYS 144 HG2 LYS 144 -15.311 11.973 6.673 1139 2HG LYS 144 HG1 LYS 144 -15.238 11.171 5.097 1140 1HD LYS 144 HD2 LYS 144 -15.019 9.016 6.193 1141 2HD LYS 144 HD1 LYS 144 -15.138 9.807 7.781 1142 1HE LYS 144 HE2 LYS 144 -17.304 10.763 6.991 1143 2HE LYS 144 HE1 LYS 144 -17.176 9.695 5.601 1144 1HZ LYS 144 HZ1 LYS 144 -17.261 8.796 8.430 1145 2HZ LYS 144 HZ3 LYS 144 -18.576 8.774 7.375 1146 3HZ LYS 144 HZ2 LYS 144 -17.235 7.791 7.068 1147 H TYR 145 HN TYR 145 -10.795 10.728 4.736 1148 HA TYR 145 HA TYR 145 -9.136 12.213 6.645 1149 1HB TYR 145 HB2 TYR 145 -8.953 9.267 5.948 1150 2HB TYR 145 HB1 TYR 145 -7.924 10.133 7.073 1151 HD1 TYR 145 HD1 TYR 145 -8.637 10.634 9.298 1152 HD2 TYR 145 HD2 TYR 145 -11.362 8.945 6.514 1153 HE1 TYR 145 HE1 TYR 145 -10.181 10.137 11.146 1154 HE2 TYR 145 HE2 TYR 145 -12.935 8.460 8.340 1155 HH TYR 145 HH TYR 145 -12.634 9.770 11.441 1156 H ALA 146 HN ALA 146 -9.454 11.222 3.403 1157 HA ALA 146 HA ALA 146 -6.627 11.951 3.079 1158 1HB ALA 146 HB3 ALA 146 -6.850 9.658 2.577 1159 2HB ALA 146 HB1 ALA 146 -6.689 10.489 1.031 1160 3HB ALA 146 HB2 ALA 146 -8.276 9.936 1.579 1161 H MET 147 HN MET 147 -8.632 11.383 0.389 1162 HA MET 147 HA MET 147 -8.843 12.534 -1.534 1163 1HB MET 147 HB2 MET 147 -10.750 13.919 -1.434 1164 2HB MET 147 HB1 MET 147 -10.912 12.728 -0.144 1165 1HG MET 147 HG2 MET 147 -10.479 14.279 1.523 1166 2HG MET 147 HG1 MET 147 -9.850 15.470 0.385 1167 1HE MET 147 HE1 MET 147 -11.982 16.117 2.669 1168 2HE MET 147 HE3 MET 147 -11.366 17.336 1.554 1169 3HE MET 147 HE2 MET 147 -13.104 17.160 1.797 No H/Q in entry = 1169 Start of MODEL 4 1 H1 MET 1 HT2 MET 1 21.305 -3.088 5.249 2 H2 MET 1 HT1 MET 1 21.327 -4.778 5.170 3 H3 MET 1 HT3 MET 1 22.774 -3.918 5.291 4 HA MET 1 HA MET 1 22.485 -2.964 3.152 5 1HB MET 1 HB2 MET 1 23.625 -5.111 3.288 6 2HB MET 1 HB1 MET 1 22.088 -5.957 3.195 7 1HG MET 1 HG2 MET 1 21.787 -5.396 0.945 8 2HG MET 1 HG1 MET 1 23.034 -4.151 0.995 9 1HE MET 1 HE1 MET 1 23.268 -7.723 2.601 10 2HE MET 1 HE3 MET 1 22.358 -8.063 1.130 11 3HE MET 1 HE2 MET 1 24.005 -8.666 1.306 12 H ALA 2 HN ALA 2 19.610 -4.402 4.403 13 HA ALA 2 HA ALA 2 18.025 -4.543 2.114 14 1HB ALA 2 HB1 ALA 2 16.135 -4.435 3.656 15 2HB ALA 2 HB2 ALA 2 17.221 -3.924 4.947 16 3HB ALA 2 HB3 ALA 2 17.386 -5.532 4.241 17 H LEU 3 HN LEU 3 18.915 -1.829 4.154 18 HA LEU 3 HA LEU 3 16.779 -0.127 3.257 19 1HB LEU 3 HB2 LEU 3 17.987 1.631 4.496 20 2HB LEU 3 HB1 LEU 3 17.665 0.211 5.463 21 HG LEU 3 HG LEU 3 20.111 -0.417 4.645 22 1HD1 LEU 3 1HD1 LEU 3 20.410 1.590 3.303 23 2HD1 LEU 3 3HD1 LEU 3 20.117 2.597 4.721 24 3HD1 LEU 3 2HD1 LEU 3 21.544 1.564 4.653 25 1HD2 LEU 3 1HD2 LEU 3 19.403 1.421 6.924 26 2HD2 LEU 3 3HD2 LEU 3 19.446 -0.341 6.955 27 3HD2 LEU 3 2HD2 LEU 3 20.940 0.573 6.766 28 H LYS 4 HN LYS 4 20.035 -0.820 2.351 29 HA LYS 4 HA LYS 4 20.421 1.567 0.833 30 1HB LYS 4 HB2 LYS 4 22.548 0.933 0.912 31 2HB LYS 4 HB1 LYS 4 22.019 -0.445 1.865 32 1HG LYS 4 HG2 LYS 4 21.655 -1.661 -0.305 33 2HG LYS 4 HG1 LYS 4 22.503 -0.332 -1.096 34 1HD LYS 4 HD2 LYS 4 24.446 -0.770 0.400 35 2HD LYS 4 HD1 LYS 4 23.582 -2.176 1.027 36 1HE LYS 4 HE2 LYS 4 25.130 -2.920 -0.657 37 2HE LYS 4 HE1 LYS 4 23.487 -3.088 -1.276 38 1HZ LYS 4 HZ1 LYS 4 23.788 -1.017 -2.504 39 2HZ LYS 4 HZ3 LYS 4 25.371 -0.881 -1.923 40 3HZ LYS 4 HZ2 LYS 4 24.955 -2.156 -2.947 41 H ARG 5 HN ARG 5 18.872 -1.344 0.403 42 HA ARG 5 HA ARG 5 18.917 -1.332 -2.498 43 1HB ARG 5 HB2 ARG 5 18.699 -3.496 -1.707 44 2HB ARG 5 HB1 ARG 5 17.681 -3.024 -0.351 45 1HG ARG 5 HG2 ARG 5 16.225 -4.128 -1.794 46 2HG ARG 5 HG1 ARG 5 15.945 -2.406 -2.091 47 1HD ARG 5 HD2 ARG 5 17.431 -2.532 -4.054 48 2HD ARG 5 HD1 ARG 5 17.607 -4.267 -3.791 49 HE ARG 5 HE ARG 5 14.950 -4.009 -3.948 50 1HH1 ARG 5 1HH1 ARG 5 17.507 -2.780 -6.002 51 2HH1 ARG 5 2HH1 ARG 5 16.508 -2.722 -7.414 52 1HH2 ARG 5 1HH2 ARG 5 13.657 -3.955 -5.805 53 2HH2 ARG 5 2HH2 ARG 5 14.318 -3.381 -7.302 54 H ILE 6 HN ILE 6 16.747 -0.904 0.175 55 HA ILE 6 HA ILE 6 14.527 0.232 -1.017 56 HB ILE 6 HB ILE 6 15.713 0.974 1.669 57 1HG1 ILE 6 2HG1 ILE 6 13.958 -1.337 0.852 58 2HG1 ILE 6 1HG1 ILE 6 15.558 -1.395 1.601 59 1HG2 ILE 6 2HG2 ILE 6 12.932 1.156 0.523 60 2HG2 ILE 6 1HG2 ILE 6 13.286 1.316 2.246 61 3HG2 ILE 6 3HG2 ILE 6 13.951 2.472 1.095 62 1HD1 ILE 6 2HD1 ILE 6 14.591 -0.360 3.623 63 2HD1 ILE 6 1HD1 ILE 6 12.999 -0.468 2.877 64 3HD1 ILE 6 3HD1 ILE 6 13.904 -1.937 3.238 65 H HIS 7 HN HIS 7 17.661 1.373 -0.783 66 HA HIS 7 HA HIS 7 17.751 3.976 -0.160 67 1HB HIS 7 HB2 HIS 7 19.339 2.134 -1.340 68 2HB HIS 7 HB1 HIS 7 19.178 3.319 -2.626 69 HD1 HIS 7 HD1 HIS 7 19.884 3.597 1.118 70 HD2 HIS 7 HD2 HIS 7 21.173 5.112 -2.532 71 HE1 HIS 7 HE1 HIS 7 21.745 5.196 1.669 72 HE2 HIS 7 HE2 HIS 7 22.580 6.019 -0.562 73 H LYS 8 HN LYS 8 17.488 3.037 -3.624 74 HA LYS 8 HA LYS 8 16.221 5.614 -4.058 75 1HB LYS 8 HB2 LYS 8 16.351 5.039 -6.498 76 2HB LYS 8 HB1 LYS 8 17.859 5.424 -5.687 77 1HG LYS 8 HG2 LYS 8 18.285 3.589 -7.136 78 2HG LYS 8 HG1 LYS 8 18.277 2.950 -5.494 79 1HD LYS 8 HD2 LYS 8 17.073 1.428 -6.901 80 2HD LYS 8 HD1 LYS 8 15.920 2.251 -5.844 81 1HE LYS 8 HE2 LYS 8 15.313 3.759 -7.658 82 2HE LYS 8 HE1 LYS 8 16.483 2.978 -8.719 83 1HZ LYS 8 HZ1 LYS 8 15.219 0.912 -8.479 84 2HZ LYS 8 HZ3 LYS 8 14.071 1.708 -7.528 85 3HZ LYS 8 HZ2 LYS 8 14.276 2.145 -9.149 86 H GLU 9 HN GLU 9 15.470 2.358 -3.705 87 HA GLU 9 HA GLU 9 13.233 2.218 -5.384 88 1HB GLU 9 HB2 GLU 9 13.816 0.883 -2.737 89 2HB GLU 9 HB1 GLU 9 12.463 0.470 -3.775 90 1HG GLU 9 HG2 GLU 9 15.391 0.075 -4.290 91 2HG GLU 9 HG1 GLU 9 14.126 -1.145 -4.205 92 H LEU 10 HN LEU 10 13.627 3.100 -2.033 93 HA LEU 10 HA LEU 10 11.096 4.355 -1.762 94 1HB LEU 10 HB2 LEU 10 11.763 3.852 0.316 95 2HB LEU 10 HB1 LEU 10 13.406 3.638 -0.215 96 HG LEU 10 HG LEU 10 12.482 6.411 0.206 97 1HD1 LEU 10 2HD1 LEU 10 13.235 4.537 2.424 98 2HD1 LEU 10 1HD1 LEU 10 13.061 6.285 2.570 99 3HD1 LEU 10 3HD1 LEU 10 11.659 5.288 2.188 100 1HD2 LEU 10 3HD2 LEU 10 15.052 4.902 0.571 101 2HD2 LEU 10 2HD2 LEU 10 14.688 6.147 -0.623 102 3HD2 LEU 10 1HD2 LEU 10 14.833 6.575 1.081 103 H ASN 11 HN ASN 11 14.454 5.512 -2.419 104 HA ASN 11 HA ASN 11 13.587 8.231 -2.060 105 1HB ASN 11 HB2 ASN 11 15.957 7.352 -1.664 106 2HB ASN 11 HB1 ASN 11 16.139 7.491 -3.414 107 1HD2 ASN 11 1HD2 ASN 11 16.012 9.516 -4.365 108 2HD2 ASN 11 2HD2 ASN 11 16.229 10.972 -3.480 109 H ASP 12 HN ASP 12 13.637 6.128 -4.763 110 HA ASP 12 HA ASP 12 13.829 8.114 -6.759 111 1HB ASP 12 HB2 ASP 12 14.204 5.752 -7.286 112 2HB ASP 12 HB1 ASP 12 12.536 5.371 -6.871 113 H LEU 13 HN LEU 13 11.429 7.091 -4.643 114 HA LEU 13 HA LEU 13 9.189 8.245 -5.903 115 1HB LEU 13 HB2 LEU 13 9.821 7.575 -3.041 116 2HB LEU 13 HB1 LEU 13 8.304 8.296 -3.516 117 HG LEU 13 HG LEU 13 8.163 5.840 -3.144 118 1HD1 LEU 13 2HD1 LEU 13 6.596 6.955 -4.652 119 2HD1 LEU 13 1HD1 LEU 13 7.695 6.667 -6.000 120 3HD1 LEU 13 3HD1 LEU 13 6.955 5.307 -5.161 121 1HD2 LEU 13 2HD2 LEU 13 10.388 5.256 -3.882 122 2HD2 LEU 13 1HD2 LEU 13 9.144 4.325 -4.725 123 3HD2 LEU 13 3HD2 LEU 13 9.950 5.667 -5.545 124 H ALA 14 HN ALA 14 11.766 9.388 -3.901 125 HA ALA 14 HA ALA 14 10.728 12.038 -3.538 126 1HB ALA 14 HB3 ALA 14 12.311 11.015 -1.948 127 2HB ALA 14 HB1 ALA 14 12.919 12.539 -2.600 128 3HB ALA 14 HB2 ALA 14 13.545 11.002 -3.211 129 H ARG 15 HN ARG 15 13.194 10.504 -5.544 130 HA ARG 15 HA ARG 15 14.057 12.606 -7.090 131 1HB ARG 15 HB2 ARG 15 13.474 9.783 -7.999 132 2HB ARG 15 HB1 ARG 15 14.551 10.919 -8.804 133 1HG ARG 15 HG2 ARG 15 15.022 10.211 -5.947 134 2HG ARG 15 HG1 ARG 15 15.512 9.087 -7.204 135 1HD ARG 15 HD2 ARG 15 17.382 10.459 -6.661 136 2HD ARG 15 HD1 ARG 15 16.804 10.935 -8.254 137 HE ARG 15 HE ARG 15 15.762 12.508 -6.070 138 1HH1 ARG 15 1HH1 ARG 15 18.207 12.179 -8.541 139 2HH1 ARG 15 2HH1 ARG 15 18.756 13.818 -8.408 140 1HH2 ARG 15 1HH2 ARG 15 16.448 14.695 -5.907 141 2HH2 ARG 15 2HH2 ARG 15 17.737 15.258 -6.920 142 H ASP 16 HN ASP 16 11.162 10.581 -7.663 143 HA ASP 16 HA ASP 16 9.996 12.858 -9.091 144 1HB ASP 16 HB2 ASP 16 11.036 11.217 -10.754 145 2HB ASP 16 HB1 ASP 16 9.790 10.082 -10.249 146 HA PRO 17 HA PRO 17 6.728 11.044 -6.532 147 1HB PRO 17 HB2 PRO 17 6.085 13.325 -5.233 148 2HB PRO 17 HB1 PRO 17 7.459 12.324 -4.762 149 1HG PRO 17 HG2 PRO 17 7.438 14.966 -6.016 150 2HG PRO 17 HG1 PRO 17 8.767 14.121 -5.207 151 1HD PRO 17 HD2 PRO 17 8.198 14.344 -8.057 152 2HD PRO 17 HD1 PRO 17 9.647 13.705 -7.255 153 HA PRO 18 HA PRO 18 3.863 12.811 -9.663 154 1HB PRO 18 HB2 PRO 18 2.554 10.204 -9.494 155 2HB PRO 18 HB1 PRO 18 3.284 10.996 -10.891 156 1HG PRO 18 HG2 PRO 18 4.384 8.817 -9.731 157 2HG PRO 18 HG1 PRO 18 5.358 10.085 -10.499 158 1HD PRO 18 HD2 PRO 18 4.783 9.635 -7.591 159 2HD PRO 18 HD1 PRO 18 6.316 10.071 -8.384 160 H ALA 19 HN ALA 19 2.180 10.311 -7.791 161 HA ALA 19 HA ALA 19 0.904 12.203 -6.048 162 1HB ALA 19 HB3 ALA 19 -0.756 10.969 -8.243 163 2HB ALA 19 HB2 ALA 19 -1.367 11.928 -6.893 164 3HB ALA 19 HB1 ALA 19 -0.323 12.676 -8.103 165 H GLN 20 HN GLN 20 -0.179 9.172 -7.548 166 HA GLN 20 HA GLN 20 -0.949 8.047 -5.066 167 1HB GLN 20 HB2 GLN 20 -1.165 5.907 -6.441 168 2HB GLN 20 HB1 GLN 20 -2.196 7.246 -6.883 169 1HG GLN 20 HG2 GLN 20 0.403 6.628 -8.268 170 2HG GLN 20 HG1 GLN 20 -1.147 5.967 -8.775 171 1HE2 GLN 20 1HE2 GLN 20 -2.635 8.438 -8.199 172 2HE2 GLN 20 2HE2 GLN 20 -2.204 9.548 -9.445 173 H CYS 21 HN CYS 21 1.989 8.705 -5.558 174 HA CYS 21 HA CYS 21 3.001 6.445 -4.172 175 1HB CYS 21 HB2 CYS 21 4.665 5.786 -5.902 176 2HB CYS 21 HB1 CYS 21 3.001 5.454 -6.367 177 HG CYS 21 HG CYS 21 2.839 7.087 -8.406 178 H SER 22 HN SER 22 3.987 7.657 -2.670 179 HA SER 22 HA SER 22 6.534 8.618 -3.524 180 1HB SER 22 HB2 SER 22 5.052 10.646 -3.712 181 2HB SER 22 HB1 SER 22 4.807 10.538 -1.971 182 HG SER 22 HG SER 22 7.264 10.944 -3.341 183 H ALA 23 HN ALA 23 7.836 7.704 -2.204 184 HA ALA 23 HA ALA 23 7.345 7.770 0.709 185 1HB ALA 23 HB3 ALA 23 7.349 5.506 0.265 186 2HB ALA 23 HB1 ALA 23 9.064 5.800 0.537 187 3HB ALA 23 HB2 ALA 23 8.446 5.666 -1.107 188 H GLY 24 HN GLY 24 9.722 7.352 1.661 189 1HA GLY 24 HA1 GLY 24 11.239 9.657 0.870 190 2HA GLY 24 HA2 GLY 24 12.068 8.144 0.526 191 HA PRO 25 HA PRO 25 13.254 7.577 4.688 192 1HB PRO 25 HB2 PRO 25 15.390 9.217 5.055 193 2HB PRO 25 HB1 PRO 25 15.461 7.749 4.084 194 1HG PRO 25 HG2 PRO 25 15.148 10.591 3.205 195 2HG PRO 25 HG1 PRO 25 16.155 9.305 2.511 196 1HD PRO 25 HD2 PRO 25 13.772 10.021 1.446 197 2HD PRO 25 HD1 PRO 25 14.384 8.359 1.382 198 H VAL 26 HN VAL 26 11.926 8.191 6.299 199 HA VAL 26 HA VAL 26 11.220 11.042 6.420 200 HB VAL 26 HB VAL 26 9.609 8.821 6.307 201 1HG1 VAL 26 2HG1 VAL 26 9.476 9.857 9.127 202 2HG1 VAL 26 1HG1 VAL 26 8.296 8.788 8.366 203 3HG1 VAL 26 3HG1 VAL 26 9.952 8.236 8.624 204 1HG2 VAL 26 3HG2 VAL 26 8.987 11.624 7.210 205 2HG2 VAL 26 2HG2 VAL 26 8.979 11.007 5.559 206 3HG2 VAL 26 1HG2 VAL 26 7.772 10.448 6.714 207 H GLY 27 HN GLY 27 12.229 8.341 8.485 208 1HA GLY 27 HA1 GLY 27 13.168 8.515 10.635 209 2HA GLY 27 HA2 GLY 27 12.945 10.267 10.571 210 H ASP 28 HN ASP 28 13.952 9.964 7.729 211 HA ASP 28 HA ASP 28 15.843 10.115 6.503 212 1HB ASP 28 HB2 ASP 28 16.691 11.580 8.389 213 2HB ASP 28 HB1 ASP 28 17.469 10.143 9.049 214 H ASP 29 HN ASP 29 15.045 7.760 8.561 215 HA ASP 29 HA ASP 29 17.040 5.834 7.737 216 1HB ASP 29 HB2 ASP 29 15.307 4.309 9.054 217 2HB ASP 29 HB1 ASP 29 16.472 5.320 9.905 218 H MET 30 HN MET 30 16.634 4.078 6.481 219 HA MET 30 HA MET 30 14.433 4.310 4.580 220 1HB MET 30 HB2 MET 30 17.118 3.384 4.524 221 2HB MET 30 HB1 MET 30 16.086 2.013 4.158 222 1HG MET 30 HG2 MET 30 15.650 2.774 2.106 223 2HG MET 30 HG1 MET 30 15.329 4.392 2.699 224 1HE MET 30 HE1 MET 30 17.927 5.262 4.142 225 2HE MET 30 HE3 MET 30 18.888 5.994 2.859 226 3HE MET 30 HE2 MET 30 17.158 6.321 2.960 227 H PHE 31 HN PHE 31 14.365 3.332 7.545 228 HA PHE 31 HA PHE 31 12.742 0.968 6.955 229 1HB PHE 31 HB2 PHE 31 13.216 0.436 9.433 230 2HB PHE 31 HB1 PHE 31 14.354 -0.047 8.216 231 HD1 PHE 31 HD1 PHE 31 13.765 1.925 11.172 232 HD2 PHE 31 HD2 PHE 31 16.489 1.239 7.970 233 HE1 PHE 31 HE1 PHE 31 15.548 3.034 12.454 234 HE2 PHE 31 HE2 PHE 31 18.274 2.350 9.246 235 HZ PHE 31 HZ PHE 31 17.805 3.245 11.493 236 H HIS 32 HN HIS 32 12.438 4.083 7.703 237 HA HIS 32 HA HIS 32 9.876 3.456 8.834 238 1HB HIS 32 HB2 HIS 32 10.935 3.664 10.894 239 2HB HIS 32 HB1 HIS 32 12.072 4.875 10.314 240 HD1 HIS 32 HD1 HIS 32 8.543 4.464 11.580 241 HD2 HIS 32 HD2 HIS 32 11.245 7.499 10.709 242 HE1 HIS 32 HE1 HIS 32 7.519 6.566 12.503 243 HE2 HIS 32 HE2 HIS 32 9.231 8.368 12.077 244 H TRP 33 HN TRP 33 8.949 4.257 7.026 245 HA TRP 33 HA TRP 33 9.507 7.001 6.341 246 1HB TRP 33 HB2 TRP 33 9.566 6.067 3.883 247 2HB TRP 33 HB1 TRP 33 10.994 6.280 4.858 248 HD1 TRP 33 HD1 TRP 33 11.484 3.709 6.331 249 HE1 TRP 33 HE1 TRP 33 11.747 1.456 5.152 250 HE3 TRP 33 HE3 TRP 33 9.110 4.840 2.017 251 HZ2 TRP 33 HZ2 TRP 33 11.070 0.323 2.673 252 HZ3 TRP 33 HZ3 TRP 33 8.984 3.136 0.271 253 HH2 TRP 33 HH2 TRP 33 9.957 0.939 0.592 254 H GLN 34 HN GLN 34 8.114 7.982 4.890 255 HA GLN 34 HA GLN 34 5.384 7.010 5.372 256 1HB GLN 34 HB2 GLN 34 6.264 9.204 6.425 257 2HB GLN 34 HB1 GLN 34 6.141 9.875 4.804 258 1HG GLN 34 HG2 GLN 34 3.817 8.551 6.169 259 2HG GLN 34 HG1 GLN 34 4.174 10.261 6.375 260 1HE2 GLN 34 1HE2 GLN 34 1.885 8.837 5.173 261 2HE2 GLN 34 2HE2 GLN 34 1.728 9.491 3.581 262 H ALA 35 HN ALA 35 4.306 6.359 3.702 263 HA ALA 35 HA ALA 35 4.920 7.473 1.040 264 1HB ALA 35 HB1 ALA 35 3.904 4.713 1.721 265 2HB ALA 35 HB2 ALA 35 5.551 5.119 1.243 266 3HB ALA 35 HB3 ALA 35 4.227 5.327 0.098 267 H THR 36 HN THR 36 3.248 8.362 -0.101 268 HA THR 36 HA THR 36 0.544 8.008 1.004 269 HB THR 36 HB THR 36 0.013 10.108 -0.344 270 HG1 THR 36 HG1 THR 36 1.919 10.112 -1.624 271 1HG2 THR 36 2HG2 THR 36 0.260 10.083 2.107 272 2HG2 THR 36 1HG2 THR 36 1.991 10.368 1.920 273 3HG2 THR 36 3HG2 THR 36 0.836 11.591 1.397 274 H ILE 37 HN ILE 37 -0.681 6.678 -0.079 275 HA ILE 37 HA ILE 37 -0.383 6.443 -3.017 276 HB ILE 37 HB ILE 37 -1.229 4.364 -0.997 277 1HG1 ILE 37 2HG1 ILE 37 1.183 4.485 -2.809 278 2HG1 ILE 37 1HG1 ILE 37 1.204 4.818 -1.077 279 1HG2 ILE 37 3HG2 ILE 37 -2.463 4.206 -3.124 280 2HG2 ILE 37 2HG2 ILE 37 -0.919 4.078 -3.963 281 3HG2 ILE 37 1HG2 ILE 37 -1.407 2.822 -2.832 282 1HD1 ILE 37 1HD1 ILE 37 0.433 2.214 -2.353 283 2HD1 ILE 37 3HD1 ILE 37 1.981 2.566 -1.595 284 3HD1 ILE 37 2HD1 ILE 37 0.509 2.537 -0.623 285 H MET 38 HN MET 38 -2.181 7.062 -4.149 286 HA MET 38 HA MET 38 -4.643 7.437 -2.635 287 1HB MET 38 HB2 MET 38 -5.229 9.148 -4.197 288 2HB MET 38 HB1 MET 38 -3.614 9.474 -3.562 289 1HG MET 38 HG2 MET 38 -2.699 8.507 -5.598 290 2HG MET 38 HG1 MET 38 -4.329 8.371 -6.219 291 1HE MET 38 HE2 MET 38 -5.896 10.445 -6.770 292 2HE MET 38 HE1 MET 38 -5.696 11.036 -5.122 293 3HE MET 38 HE3 MET 38 -5.428 12.122 -6.484 294 H GLY 39 HN GLY 39 -6.616 6.939 -3.459 295 1HA GLY 39 HA1 GLY 39 -8.188 6.386 -4.978 296 2HA GLY 39 HA2 GLY 39 -7.021 5.239 -5.645 297 HA PRO 40 HA PRO 40 -5.730 8.369 -8.663 298 1HB PRO 40 HB2 PRO 40 -5.724 6.786 -10.847 299 2HB PRO 40 HB1 PRO 40 -4.439 6.729 -9.635 300 1HG PRO 40 HG2 PRO 40 -6.796 4.919 -9.982 301 2HG PRO 40 HG1 PRO 40 -5.112 4.504 -9.621 302 1HD PRO 40 HD2 PRO 40 -7.056 4.614 -7.722 303 2HD PRO 40 HD1 PRO 40 -5.350 4.966 -7.384 304 H ASN 41 HN ASN 41 -6.634 8.204 -11.322 305 HA ASN 41 HA ASN 41 -9.004 9.652 -11.175 306 1HB ASN 41 HB2 ASN 41 -7.511 8.373 -13.421 307 2HB ASN 41 HB1 ASN 41 -9.125 9.002 -13.725 308 1HD2 ASN 41 1HD2 ASN 41 -9.047 11.216 -11.991 309 2HD2 ASN 41 2HD2 ASN 41 -7.912 12.358 -12.625 310 H ASP 42 HN ASP 42 -8.554 6.186 -11.531 311 HA ASP 42 HA ASP 42 -11.458 5.999 -11.189 312 1HB ASP 42 HB2 ASP 42 -10.855 5.297 -13.496 313 2HB ASP 42 HB1 ASP 42 -9.836 4.034 -12.811 314 H SER 43 HN SER 43 -11.899 5.249 -9.332 315 HA SER 43 HA SER 43 -10.928 2.821 -8.285 316 1HB SER 43 HB2 SER 43 -8.928 4.070 -7.658 317 2HB SER 43 HB1 SER 43 -9.899 5.380 -7.018 318 HG SER 43 HG SER 43 -9.463 2.802 -5.952 319 HA PRO 44 HA PRO 44 -14.813 3.381 -6.089 320 1HB PRO 44 HB2 PRO 44 -13.418 1.889 -3.926 321 2HB PRO 44 HB1 PRO 44 -14.989 1.577 -4.673 322 1HG PRO 44 HG2 PRO 44 -12.873 0.061 -5.237 323 2HG PRO 44 HG1 PRO 44 -14.056 0.485 -6.488 324 1HD PRO 44 HD2 PRO 44 -11.316 1.567 -6.018 325 2HD PRO 44 HD1 PRO 44 -12.172 1.280 -7.548 326 H TYR 45 HN TYR 45 -11.650 3.762 -4.539 327 HA TYR 45 HA TYR 45 -12.738 5.952 -2.947 328 1HB TYR 45 HB2 TYR 45 -10.025 5.268 -2.230 329 2HB TYR 45 HB1 TYR 45 -11.477 5.274 -1.257 330 HD1 TYR 45 HD1 TYR 45 -13.060 3.115 -1.744 331 HD2 TYR 45 HD2 TYR 45 -8.852 3.351 -2.272 332 HE1 TYR 45 HE1 TYR 45 -12.899 0.676 -1.461 333 HE2 TYR 45 HE2 TYR 45 -8.667 0.919 -2.001 334 HH TYR 45 HH TYR 45 -11.499 -1.123 -1.828 335 H GLN 46 HN GLN 46 -12.308 6.400 -5.657 336 HA GLN 46 HA GLN 46 -9.922 7.503 -6.477 337 1HB GLN 46 HB2 GLN 46 -11.792 7.254 -7.967 338 2HB GLN 46 HB1 GLN 46 -12.762 8.357 -7.007 339 1HG GLN 46 HG2 GLN 46 -10.847 10.048 -7.589 340 2HG GLN 46 HG1 GLN 46 -10.572 8.939 -8.923 341 1HE2 GLN 46 1HE2 GLN 46 -12.068 8.730 -10.475 342 2HE2 GLN 46 2HE2 GLN 46 -13.398 9.812 -10.675 343 H GLY 47 HN GLY 47 -8.810 9.289 -6.063 344 1HA GLY 47 HA1 GLY 47 -10.043 11.539 -4.675 345 2HA GLY 47 HA2 GLY 47 -8.414 11.490 -5.344 346 H GLY 48 HN GLY 48 -9.049 8.720 -3.605 347 1HA GLY 48 HA1 GLY 48 -8.818 8.108 -1.382 348 2HA GLY 48 HA2 GLY 48 -8.562 9.787 -0.956 349 H VAL 49 HN VAL 49 -6.505 10.705 -1.226 350 HA VAL 49 HA VAL 49 -4.297 8.988 -1.815 351 HB VAL 49 HB VAL 49 -4.193 11.541 -0.277 352 1HG1 VAL 49 1HG1 VAL 49 -2.128 10.243 -0.352 353 2HG1 VAL 49 3HG1 VAL 49 -2.203 10.204 -2.118 354 3HG1 VAL 49 2HG1 VAL 49 -1.948 11.737 -1.273 355 1HG2 VAL 49 1HG2 VAL 49 -4.332 11.228 -3.268 356 2HG2 VAL 49 3HG2 VAL 49 -5.471 12.079 -2.225 357 3HG2 VAL 49 2HG2 VAL 49 -3.841 12.709 -2.448 358 H PHE 50 HN PHE 50 -4.201 7.268 -0.536 359 HA PHE 50 HA PHE 50 -4.684 7.510 2.287 360 1HB PHE 50 HB2 PHE 50 -4.069 5.210 0.460 361 2HB PHE 50 HB1 PHE 50 -4.160 5.025 2.205 362 HD1 PHE 50 HD1 PHE 50 -6.287 5.679 3.364 363 HD2 PHE 50 HD2 PHE 50 -5.948 5.234 -0.871 364 HE1 PHE 50 HE1 PHE 50 -8.744 5.506 3.178 365 HE2 PHE 50 HE2 PHE 50 -8.381 5.085 -1.042 366 HZ PHE 50 HZ PHE 50 -9.761 5.237 0.964 367 H PHE 51 HN PHE 51 -3.097 6.099 3.688 368 HA PHE 51 HA PHE 51 -0.480 7.398 3.359 369 1HB PHE 51 HB2 PHE 51 -1.864 7.142 6.021 370 2HB PHE 51 HB1 PHE 51 -0.591 8.262 5.549 371 HD1 PHE 51 HD1 PHE 51 -4.187 7.488 5.107 372 HD2 PHE 51 HD2 PHE 51 -1.107 10.418 4.749 373 HE1 PHE 51 HE1 PHE 51 -5.879 9.228 4.692 374 HE2 PHE 51 HE2 PHE 51 -2.791 12.162 4.334 375 HZ PHE 51 HZ PHE 51 -5.193 11.532 4.228 376 H LEU 52 HN LEU 52 1.185 5.990 3.668 377 HA LEU 52 HA LEU 52 0.696 3.591 5.273 378 1HB LEU 52 HB2 LEU 52 1.963 3.516 2.519 379 2HB LEU 52 HB1 LEU 52 1.775 2.156 3.609 380 HG LEU 52 HG LEU 52 -0.788 2.724 3.408 381 1HD1 LEU 52 3HD1 LEU 52 -0.487 4.781 2.125 382 2HD1 LEU 52 2HD1 LEU 52 0.301 3.863 0.841 383 3HD1 LEU 52 1HD1 LEU 52 -1.398 3.575 1.214 384 1HD2 LEU 52 1HD2 LEU 52 0.768 1.384 1.207 385 2HD2 LEU 52 3HD2 LEU 52 0.235 0.634 2.714 386 3HD2 LEU 52 2HD2 LEU 52 -0.956 1.180 1.529 387 H THR 53 HN THR 53 2.329 3.160 6.632 388 HA THR 53 HA THR 53 4.910 4.507 6.178 389 HB THR 53 HB THR 53 4.223 3.025 8.704 390 HG1 THR 53 HG1 THR 53 3.138 5.428 7.766 391 1HG2 THR 53 2HG2 THR 53 6.517 3.804 8.381 392 2HG2 THR 53 1HG2 THR 53 5.929 5.450 8.137 393 3HG2 THR 53 3HG2 THR 53 5.730 4.665 9.705 394 H ILE 54 HN ILE 54 6.760 3.305 5.870 395 HA ILE 54 HA ILE 54 6.322 0.399 5.663 396 HB ILE 54 HB ILE 54 8.393 1.779 4.017 397 1HG1 ILE 54 2HG1 ILE 54 5.415 1.904 3.597 398 2HG1 ILE 54 1HG1 ILE 54 6.601 3.205 3.504 399 1HG2 ILE 54 1HG2 ILE 54 6.612 -0.614 3.578 400 2HG2 ILE 54 3HG2 ILE 54 7.811 -0.016 2.431 401 3HG2 ILE 54 2HG2 ILE 54 8.325 -0.635 4.001 402 1HD1 ILE 54 2HD1 ILE 54 6.359 0.955 1.525 403 2HD1 ILE 54 1HD1 ILE 54 5.695 2.575 1.319 404 3HD1 ILE 54 3HD1 ILE 54 7.438 2.340 1.424 405 H HIS 55 HN HIS 55 7.678 -0.885 6.745 406 HA HIS 55 HA HIS 55 10.295 0.134 7.432 407 1HB HIS 55 HB2 HIS 55 10.151 -1.046 9.659 408 2HB HIS 55 HB1 HIS 55 9.364 0.504 9.453 409 HD1 HIS 55 HD1 HIS 55 7.189 0.587 10.514 410 HD2 HIS 55 HD2 HIS 55 8.065 -3.171 9.019 411 HE1 HIS 55 HE1 HIS 55 5.179 -0.795 10.992 412 HE2 HIS 55 HE2 HIS 55 5.832 -3.143 10.357 413 H PHE 56 HN PHE 56 11.909 -1.373 7.844 414 HA PHE 56 HA PHE 56 11.302 -4.156 7.037 415 1HB PHE 56 HB2 PHE 56 13.262 -4.305 5.769 416 2HB PHE 56 HB1 PHE 56 12.519 -2.823 5.260 417 HD1 PHE 56 HD1 PHE 56 15.346 -4.332 6.926 418 HD2 PHE 56 HD2 PHE 56 13.499 -0.671 5.828 419 HE1 PHE 56 HE1 PHE 56 17.451 -3.155 7.361 420 HE2 PHE 56 HE2 PHE 56 15.600 0.527 6.247 421 HZ PHE 56 HZ PHE 56 17.571 -0.719 7.083 422 HA PRO 57 HA PRO 57 14.447 -5.002 10.161 423 1HB PRO 57 HB2 PRO 57 13.705 -7.546 10.696 424 2HB PRO 57 HB1 PRO 57 12.860 -6.161 11.392 425 1HG PRO 57 HG2 PRO 57 11.926 -8.058 9.373 426 2HG PRO 57 HG1 PRO 57 10.995 -6.867 10.297 427 1HD PRO 57 HD2 PRO 57 12.072 -6.670 7.571 428 2HD PRO 57 HD1 PRO 57 10.865 -5.648 8.381 429 H THR 58 HN THR 58 16.049 -4.909 8.520 430 HA THR 58 HA THR 58 17.407 -5.640 6.806 431 HB THR 58 HB THR 58 18.504 -7.928 7.858 432 HG1 THR 58 HG1 THR 58 16.955 -7.652 9.634 433 1HG2 THR 58 2HG2 THR 58 19.080 -5.049 8.572 434 2HG2 THR 58 1HG2 THR 58 20.190 -6.401 8.798 435 3HG2 THR 58 3HG2 THR 58 19.707 -5.918 7.170 436 H ASP 59 HN ASP 59 15.411 -6.207 5.474 437 HA ASP 59 HA ASP 59 14.655 -8.955 5.267 438 1HB ASP 59 HB2 ASP 59 14.112 -7.370 2.927 439 2HB ASP 59 HB1 ASP 59 12.973 -8.159 4.012 440 H TYR 60 HN TYR 60 16.288 -6.765 3.004 441 HA TYR 60 HA TYR 60 16.552 -8.305 0.806 442 1HB TYR 60 HB2 TYR 60 17.238 -5.937 1.030 443 2HB TYR 60 HB1 TYR 60 18.704 -6.465 1.851 444 HD1 TYR 60 HD1 TYR 60 16.874 -6.614 -1.376 445 HD2 TYR 60 HD2 TYR 60 20.614 -7.080 0.598 446 HE1 TYR 60 HE1 TYR 60 18.003 -6.752 -3.558 447 HE2 TYR 60 HE2 TYR 60 21.750 -7.223 -1.579 448 HH TYR 60 HH TYR 60 20.238 -6.391 -4.498 449 HA PRO 61 HA PRO 61 18.092 -9.108 -1.062 450 1HB PRO 61 HB2 PRO 61 17.681 -12.036 -1.192 451 2HB PRO 61 HB1 PRO 61 18.587 -10.971 -2.271 452 1HG PRO 61 HG2 PRO 61 19.865 -12.589 -0.594 453 2HG PRO 61 HG1 PRO 61 20.451 -10.941 -0.886 454 1HD PRO 61 HD2 PRO 61 18.893 -12.011 1.440 455 2HD PRO 61 HD1 PRO 61 20.278 -10.898 1.432 456 H PHE 62 HN PHE 62 16.208 -11.219 1.100 457 HA PHE 62 HA PHE 62 13.940 -10.897 -0.653 458 1HB PHE 62 HB2 PHE 62 14.206 -13.173 0.203 459 2HB PHE 62 HB1 PHE 62 14.088 -12.573 1.859 460 HD1 PHE 62 HD1 PHE 62 12.209 -14.415 1.824 461 HD2 PHE 62 HD2 PHE 62 11.997 -10.694 -0.278 462 HE1 PHE 62 HE1 PHE 62 9.757 -14.609 1.702 463 HE2 PHE 62 HE2 PHE 62 9.548 -10.915 -0.407 464 HZ PHE 62 HZ PHE 62 8.423 -12.765 0.674 465 H LYS 63 HN LYS 63 13.663 -8.896 -0.418 466 HA LYS 63 HA LYS 63 12.801 -7.628 1.971 467 1HB LYS 63 HB2 LYS 63 13.958 -6.933 -0.329 468 2HB LYS 63 HB1 LYS 63 12.299 -6.484 -0.660 469 1HG LYS 63 HG2 LYS 63 13.518 -5.601 1.889 470 2HG LYS 63 HG1 LYS 63 13.940 -4.761 0.393 471 1HD LYS 63 HD2 LYS 63 11.673 -4.210 -0.030 472 2HD LYS 63 HD1 LYS 63 11.108 -5.276 1.262 473 1HE LYS 63 HE2 LYS 63 12.984 -3.053 1.821 474 2HE LYS 63 HE1 LYS 63 11.253 -2.725 1.691 475 1HZ LYS 63 HZ1 LYS 63 11.049 -4.622 3.384 476 2HZ LYS 63 HZ3 LYS 63 12.702 -4.385 3.673 477 3HZ LYS 63 HZ2 LYS 63 11.597 -3.129 3.940 478 HA PRO 64 HA PRO 64 8.424 -8.190 1.079 479 1HB PRO 64 HB2 PRO 64 7.744 -9.165 3.561 480 2HB PRO 64 HB1 PRO 64 8.156 -10.194 2.185 481 1HG PRO 64 HG2 PRO 64 9.626 -9.825 4.626 482 2HG PRO 64 HG1 PRO 64 10.028 -10.874 3.257 483 1HD PRO 64 HD2 PRO 64 11.022 -8.156 3.914 484 2HD PRO 64 HD1 PRO 64 11.796 -9.444 2.962 485 HA PRO 65 HA PRO 65 9.007 -4.243 3.367 486 1HB PRO 65 HB2 PRO 65 7.225 -3.052 1.409 487 2HB PRO 65 HB1 PRO 65 8.932 -2.722 1.696 488 1HG PRO 65 HG2 PRO 65 7.947 -3.981 -0.540 489 2HG PRO 65 HG1 PRO 65 9.603 -4.162 0.064 490 1HD PRO 65 HD2 PRO 65 7.285 -6.007 0.299 491 2HD PRO 65 HD1 PRO 65 9.013 -6.374 0.159 492 H LYS 66 HN LYS 66 7.798 -4.055 5.204 493 HA LYS 66 HA LYS 66 4.942 -4.462 5.088 494 1HB LYS 66 HB2 LYS 66 6.845 -3.732 7.265 495 2HB LYS 66 HB1 LYS 66 5.172 -3.257 7.450 496 1HG LYS 66 HG2 LYS 66 5.533 -5.344 8.570 497 2HG LYS 66 HG1 LYS 66 4.490 -5.598 7.170 498 1HD LYS 66 HD2 LYS 66 7.382 -5.951 6.701 499 2HD LYS 66 HD1 LYS 66 6.629 -7.139 7.765 500 1HE LYS 66 HE2 LYS 66 5.725 -6.430 4.972 501 2HE LYS 66 HE1 LYS 66 6.607 -7.882 5.437 502 1HZ LYS 66 HZ2 LYS 66 4.707 -8.434 6.907 503 2HZ LYS 66 HZ1 LYS 66 3.855 -7.132 6.256 504 3HZ LYS 66 HZ3 LYS 66 4.311 -8.423 5.265 505 H VAL 67 HN VAL 67 4.666 -2.982 3.350 506 HA VAL 67 HA VAL 67 4.622 -0.176 4.073 507 HB VAL 67 HB VAL 67 5.179 -0.524 1.781 508 1HG1 VAL 67 2HG1 VAL 67 2.751 -2.311 1.559 509 2HG1 VAL 67 1HG1 VAL 67 3.816 -1.850 0.232 510 3HG1 VAL 67 3HG1 VAL 67 4.435 -2.831 1.558 511 1HG2 VAL 67 3HG2 VAL 67 3.583 1.291 2.146 512 2HG2 VAL 67 2HG2 VAL 67 3.384 0.558 0.552 513 3HG2 VAL 67 1HG2 VAL 67 2.247 0.177 1.849 514 H ALA 68 HN ALA 68 3.110 0.421 5.428 515 HA ALA 68 HA ALA 68 0.637 -1.177 5.520 516 1HB ALA 68 HB2 ALA 68 2.164 -1.929 7.246 517 2HB ALA 68 HB3 ALA 68 0.774 -1.122 7.968 518 3HB ALA 68 HB1 ALA 68 2.318 -0.280 7.855 519 H PHE 69 HN PHE 69 -1.177 -0.126 5.565 520 HA PHE 69 HA PHE 69 -1.449 2.598 5.339 521 1HB PHE 69 HB2 PHE 69 -3.360 0.450 6.090 522 2HB PHE 69 HB1 PHE 69 -3.869 2.131 6.135 523 HD1 PHE 69 HD1 PHE 69 -4.295 3.347 4.120 524 HD2 PHE 69 HD2 PHE 69 -2.738 -0.610 3.957 525 HE1 PHE 69 HE1 PHE 69 -4.839 3.228 1.714 526 HE2 PHE 69 HE2 PHE 69 -3.274 -0.711 1.555 527 HZ PHE 69 HZ PHE 69 -4.310 1.206 0.443 528 H THR 70 HN THR 70 -1.325 4.228 6.653 529 HA THR 70 HA THR 70 -1.221 3.963 9.517 530 HB THR 70 HB THR 70 -1.478 6.449 7.806 531 HG1 THR 70 HG1 THR 70 0.796 4.952 8.650 532 1HG2 THR 70 1HG2 THR 70 -0.486 6.077 10.634 533 2HG2 THR 70 3HG2 THR 70 -0.424 7.582 9.719 534 3HG2 THR 70 2HG2 THR 70 -1.984 6.869 10.137 535 H THR 71 HN THR 71 -3.558 4.593 7.064 536 HA THR 71 HA THR 71 -5.514 5.494 9.055 537 HB THR 71 HB THR 71 -4.977 6.922 6.975 538 HG1 THR 71 HG1 THR 71 -6.836 7.770 7.526 539 1HG2 THR 71 2HG2 THR 71 -6.649 4.761 5.716 540 2HG2 THR 71 1HG2 THR 71 -6.360 6.349 5.006 541 3HG2 THR 71 3HG2 THR 71 -5.012 5.246 5.271 542 H ARG 72 HN ARG 72 -7.846 4.909 7.983 543 HA ARG 72 HA ARG 72 -7.876 2.007 8.116 544 1HB ARG 72 HB2 ARG 72 -10.383 2.358 8.375 545 2HB ARG 72 HB1 ARG 72 -9.376 2.955 9.683 546 1HG ARG 72 HG2 ARG 72 -9.792 4.991 7.691 547 2HG ARG 72 HG1 ARG 72 -11.318 4.344 8.288 548 1HD ARG 72 HD2 ARG 72 -10.494 6.287 9.584 549 2HD ARG 72 HD1 ARG 72 -10.721 4.832 10.551 550 HE ARG 72 HE ARG 72 -8.089 4.752 9.857 551 1HH1 ARG 72 1HH1 ARG 72 -10.146 7.095 11.432 552 2HH1 ARG 72 2HH1 ARG 72 -8.869 7.784 12.379 553 1HH2 ARG 72 1HH2 ARG 72 -6.390 5.649 11.122 554 2HH2 ARG 72 2HH2 ARG 72 -6.738 6.952 12.210 555 H ILE 73 HN ILE 73 -8.858 0.714 6.561 556 HA ILE 73 HA ILE 73 -9.900 1.848 4.121 557 HB ILE 73 HB ILE 73 -7.750 2.200 3.421 558 1HG1 ILE 73 2HG1 ILE 73 -6.972 0.116 2.058 559 2HG1 ILE 73 1HG1 ILE 73 -8.501 -0.583 2.576 560 1HG2 ILE 73 2HG2 ILE 73 -6.964 -0.248 4.971 561 2HG2 ILE 73 1HG2 ILE 73 -5.857 0.605 3.895 562 3HG2 ILE 73 3HG2 ILE 73 -6.540 1.430 5.295 563 1HD1 ILE 73 3HD1 ILE 73 -8.170 1.984 1.032 564 2HD1 ILE 73 2HD1 ILE 73 -8.637 0.427 0.353 565 3HD1 ILE 73 1HD1 ILE 73 -9.697 1.242 1.507 566 H TYR 74 HN TYR 74 -11.573 0.508 3.752 567 HA TYR 74 HA TYR 74 -11.380 -2.298 4.314 568 1HB TYR 74 HB2 TYR 74 -13.480 -0.450 3.335 569 2HB TYR 74 HB1 TYR 74 -13.633 -2.147 2.894 570 HD1 TYR 74 HD1 TYR 74 -14.238 0.278 5.363 571 HD2 TYR 74 HD2 TYR 74 -13.452 -3.860 4.834 572 HE1 TYR 74 HE1 TYR 74 -15.202 -0.150 7.567 573 HE2 TYR 74 HE2 TYR 74 -14.406 -4.313 7.075 574 HH TYR 74 HH TYR 74 -16.155 -1.919 8.852 575 H HIS 75 HN HIS 75 -9.874 -3.236 3.073 576 HA HIS 75 HA HIS 75 -10.775 -3.862 0.421 577 1HB HIS 75 HB2 HIS 75 -9.313 -1.935 -0.030 578 2HB HIS 75 HB1 HIS 75 -8.014 -2.710 0.863 579 HD1 HIS 75 HD1 HIS 75 -10.067 -3.240 -2.298 580 HD2 HIS 75 HD2 HIS 75 -6.393 -4.279 -0.648 581 HE1 HIS 75 HE1 HIS 75 -8.878 -4.570 -4.068 582 HE2 HIS 75 HE2 HIS 75 -6.755 -5.350 -2.972 583 HA PRO 76 HA PRO 76 -10.096 -7.828 1.972 584 1HB PRO 76 HB2 PRO 76 -9.379 -9.156 -0.365 585 2HB PRO 76 HB1 PRO 76 -11.027 -8.789 0.133 586 1HG PRO 76 HG2 PRO 76 -9.250 -7.299 -1.739 587 2HG PRO 76 HG1 PRO 76 -10.980 -7.674 -1.890 588 1HD PRO 76 HD2 PRO 76 -10.204 -5.249 -1.151 589 2HD PRO 76 HD1 PRO 76 -11.586 -6.020 -0.350 590 H ASN 77 HN ASN 77 -7.459 -6.139 0.734 591 HA ASN 77 HA ASN 77 -5.635 -8.398 1.127 592 1HB ASN 77 HB2 ASN 77 -5.025 -5.859 -0.403 593 2HB ASN 77 HB1 ASN 77 -4.086 -7.342 -0.389 594 1HD2 ASN 77 1HD2 ASN 77 -4.143 -7.931 -2.493 595 2HD2 ASN 77 2HD2 ASN 77 -5.583 -8.244 -3.376 596 H ILE 78 HN ILE 78 -6.683 -5.470 2.408 597 HA ILE 78 HA ILE 78 -4.243 -5.015 3.889 598 HB ILE 78 HB ILE 78 -6.711 -3.312 3.491 599 1HG1 ILE 78 2HG1 ILE 78 -4.789 -1.700 2.968 600 2HG1 ILE 78 1HG1 ILE 78 -3.828 -3.143 2.936 601 1HG2 ILE 78 2HG2 ILE 78 -6.016 -3.216 5.877 602 2HG2 ILE 78 1HG2 ILE 78 -4.399 -2.755 5.334 603 3HG2 ILE 78 3HG2 ILE 78 -5.768 -1.695 5.021 604 1HD1 ILE 78 1HD1 ILE 78 -5.265 -4.056 1.160 605 2HD1 ILE 78 3HD1 ILE 78 -6.139 -2.526 1.139 606 3HD1 ILE 78 2HD1 ILE 78 -4.436 -2.573 0.684 607 H ASN 79 HN ASN 79 -4.221 -5.047 6.026 608 HA ASN 79 HA ASN 79 -6.474 -6.309 7.393 609 1HB ASN 79 HB2 ASN 79 -4.936 -7.638 8.571 610 2HB ASN 79 HB1 ASN 79 -4.216 -7.524 6.963 611 1HD2 ASN 79 1HD2 ASN 79 -2.483 -6.136 6.665 612 2HD2 ASN 79 2HD2 ASN 79 -1.511 -5.619 7.994 613 H SER 80 HN SER 80 -6.297 -5.753 9.877 614 HA SER 80 HA SER 80 -6.834 -3.029 10.066 615 1HB SER 80 HB2 SER 80 -6.682 -3.541 12.613 616 2HB SER 80 HB1 SER 80 -7.912 -4.350 11.642 617 HG SER 80 HG SER 80 -7.010 -6.002 12.683 618 H ASN 81 HN ASN 81 -3.781 -4.393 9.886 619 HA ASN 81 HA ASN 81 -2.560 -2.137 11.325 620 1HB ASN 81 HB2 ASN 81 -1.316 -4.755 10.450 621 2HB ASN 81 HB1 ASN 81 -0.490 -3.480 11.336 622 1HD2 ASN 81 1HD2 ASN 81 -2.800 -6.062 11.506 623 2HD2 ASN 81 2HD2 ASN 81 -2.938 -6.097 13.233 624 H GLY 82 HN GLY 82 -3.638 -2.550 8.382 625 1HA GLY 82 HA1 GLY 82 -1.852 -0.662 7.241 626 2HA GLY 82 HA2 GLY 82 -3.252 -1.387 6.469 627 H SER 83 HN SER 83 -1.542 -3.971 7.399 628 HA SER 83 HA SER 83 0.546 -3.892 5.390 629 1HB SER 83 HB2 SER 83 0.852 -5.050 7.599 630 2HB SER 83 HB1 SER 83 -0.355 -6.227 7.073 631 HG SER 83 HG SER 83 1.398 -7.209 6.372 632 H ILE 84 HN ILE 84 0.340 -4.602 3.382 633 HA ILE 84 HA ILE 84 -2.276 -5.574 2.581 634 HB ILE 84 HB ILE 84 -0.062 -4.336 0.969 635 1HG1 ILE 84 2HG1 ILE 84 -2.694 -3.171 1.839 636 2HG1 ILE 84 1HG1 ILE 84 -1.180 -2.908 2.705 637 1HG2 ILE 84 3HG2 ILE 84 -2.902 -4.982 0.183 638 2HG2 ILE 84 2HG2 ILE 84 -1.753 -4.066 -0.790 639 3HG2 ILE 84 1HG2 ILE 84 -1.444 -5.763 -0.429 640 1HD1 ILE 84 3HD1 ILE 84 -0.283 -2.047 0.476 641 2HD1 ILE 84 2HD1 ILE 84 -1.974 -1.973 -0.016 642 3HD1 ILE 84 1HD1 ILE 84 -1.416 -1.028 1.364 643 H CYS 85 HN CYS 85 -2.651 -7.406 1.490 644 HA CYS 85 HA CYS 85 -0.542 -9.245 0.882 645 1HB CYS 85 HB2 CYS 85 -3.022 -9.768 1.466 646 2HB CYS 85 HB1 CYS 85 -3.349 -9.345 -0.210 647 HG CYS 85 HG CYS 85 -2.419 -11.496 -1.353 648 H LEU 86 HN LEU 86 0.823 -8.173 -0.462 649 HA LEU 86 HA LEU 86 -0.220 -7.563 -3.146 650 1HB LEU 86 HB2 LEU 86 0.646 -5.579 -2.020 651 2HB LEU 86 HB1 LEU 86 2.175 -6.382 -1.737 652 HG LEU 86 HG LEU 86 2.669 -6.378 -4.122 653 1HD1 LEU 86 2HD1 LEU 86 0.343 -6.600 -4.944 654 2HD1 LEU 86 1HD1 LEU 86 0.059 -4.914 -4.504 655 3HD1 LEU 86 3HD1 LEU 86 1.244 -5.314 -5.745 656 1HD2 LEU 86 1HD2 LEU 86 1.754 -3.709 -3.070 657 2HD2 LEU 86 3HD2 LEU 86 3.343 -4.442 -2.855 658 3HD2 LEU 86 2HD2 LEU 86 2.815 -3.937 -4.461 659 H ASP 87 HN ASP 87 0.266 -8.972 -4.573 660 HA ASP 87 HA ASP 87 1.648 -11.316 -4.170 661 1HB ASP 87 HB2 ASP 87 -0.049 -10.747 -5.950 662 2HB ASP 87 HB1 ASP 87 1.258 -9.984 -6.848 663 H ILE 88 HN ILE 88 2.913 -8.472 -5.955 664 HA ILE 88 HA ILE 88 5.394 -9.700 -6.485 665 HB ILE 88 HB ILE 88 6.198 -7.294 -6.791 666 1HG1 ILE 88 2HG1 ILE 88 3.475 -6.944 -5.834 667 2HG1 ILE 88 1HG1 ILE 88 4.816 -5.800 -5.880 668 1HG2 ILE 88 3HG2 ILE 88 5.648 -8.837 -8.616 669 2HG2 ILE 88 2HG2 ILE 88 3.963 -8.323 -8.520 670 3HG2 ILE 88 1HG2 ILE 88 5.213 -7.167 -8.987 671 1HD1 ILE 88 2HD1 ILE 88 4.373 -5.471 -8.288 672 2HD1 ILE 88 1HD1 ILE 88 2.922 -6.457 -8.108 673 3HD1 ILE 88 3HD1 ILE 88 3.068 -4.932 -7.227 674 H LEU 89 HN LEU 89 4.297 -8.878 -3.519 675 HA LEU 89 HA LEU 89 7.028 -8.293 -2.570 676 1HB LEU 89 HB2 LEU 89 4.400 -7.864 -1.161 677 2HB LEU 89 HB1 LEU 89 5.979 -7.452 -0.531 678 HG LEU 89 HG LEU 89 4.515 -6.164 -2.825 679 1HD1 LEU 89 1HD1 LEU 89 5.497 -5.165 -0.158 680 2HD1 LEU 89 3HD1 LEU 89 4.824 -4.141 -1.424 681 3HD1 LEU 89 2HD1 LEU 89 3.823 -5.379 -0.665 682 1HD2 LEU 89 3HD2 LEU 89 7.362 -5.720 -1.938 683 2HD2 LEU 89 2HD2 LEU 89 6.825 -6.361 -3.493 684 3HD2 LEU 89 1HD2 LEU 89 6.466 -4.693 -3.057 685 H ARG 90 HN ARG 90 4.583 -10.586 -2.749 686 HA ARG 90 HA ARG 90 5.751 -12.121 -0.511 687 1HB ARG 90 HB2 ARG 90 3.485 -13.097 -0.169 688 2HB ARG 90 HB1 ARG 90 3.581 -11.372 0.164 689 1HG ARG 90 HG2 ARG 90 2.648 -10.936 -2.091 690 2HG ARG 90 HG1 ARG 90 2.424 -12.679 -2.298 691 1HD ARG 90 HD2 ARG 90 1.194 -10.951 -0.135 692 2HD ARG 90 HD1 ARG 90 0.359 -11.567 -1.558 693 HE ARG 90 HE ARG 90 0.845 -13.839 -0.635 694 1HH1 ARG 90 1HH1 ARG 90 0.655 -11.075 1.519 695 2HH1 ARG 90 2HH1 ARG 90 0.190 -12.025 2.891 696 1HH2 ARG 90 1HH2 ARG 90 0.207 -15.070 1.158 697 2HH2 ARG 90 2HH2 ARG 90 -0.067 -14.295 2.687 698 H SER 91 HN SER 91 4.474 -12.220 -3.756 699 HA SER 91 HA SER 91 5.021 -15.089 -3.871 700 1HB SER 91 HB2 SER 91 2.668 -14.475 -4.250 701 2HB SER 91 HB1 SER 91 3.163 -13.464 -5.607 702 HG SER 91 HG SER 91 2.630 -15.340 -6.544 703 H GLN 92 HN GLN 92 5.348 -12.056 -5.687 704 HA GLN 92 HA GLN 92 7.175 -13.443 -7.544 705 1HB GLN 92 HB2 GLN 92 5.384 -11.073 -8.085 706 2HB GLN 92 HB1 GLN 92 6.453 -11.852 -9.258 707 1HG GLN 92 HG2 GLN 92 5.160 -13.977 -8.784 708 2HG GLN 92 HG1 GLN 92 4.010 -12.950 -7.944 709 1HE2 GLN 92 1HE2 GLN 92 2.776 -11.487 -9.095 710 2HE2 GLN 92 2HE2 GLN 92 2.573 -11.606 -10.814 711 H TRP 93 HN TRP 93 7.670 -11.801 -5.021 712 HA TRP 93 HA TRP 93 8.980 -9.462 -5.855 713 1HB TRP 93 HB2 TRP 93 8.339 -9.578 -3.616 714 2HB TRP 93 HB1 TRP 93 9.212 -11.093 -3.345 715 HD1 TRP 93 HD1 TRP 93 11.898 -10.847 -2.927 716 HE1 TRP 93 HE1 TRP 93 13.408 -8.793 -2.440 717 HE3 TRP 93 HE3 TRP 93 8.590 -7.164 -4.079 718 HZ2 TRP 93 HZ2 TRP 93 13.172 -5.987 -2.545 719 HZ3 TRP 93 HZ3 TRP 93 9.294 -4.826 -3.862 720 HH2 TRP 93 HH2 TRP 93 11.532 -4.261 -3.118 721 H SER 94 HN SER 94 11.021 -8.943 -6.156 722 HA SER 94 HA SER 94 13.257 -10.667 -6.102 723 1HB SER 94 HB2 SER 94 11.994 -9.987 -8.774 724 2HB SER 94 HB1 SER 94 13.643 -10.576 -8.607 725 HG SER 94 HG SER 94 11.647 -12.067 -7.368 726 HA PRO 95 HA PRO 95 15.235 -6.686 -6.065 727 1HB PRO 95 HB2 PRO 95 17.131 -7.249 -8.239 728 2HB PRO 95 HB1 PRO 95 17.441 -6.994 -6.521 729 1HG PRO 95 HG2 PRO 95 17.701 -9.415 -7.652 730 2HG PRO 95 HG1 PRO 95 17.105 -9.219 -5.992 731 1HD PRO 95 HD2 PRO 95 15.558 -9.720 -8.515 732 2HD PRO 95 HD1 PRO 95 15.361 -10.458 -6.909 733 H ALA 96 HN ALA 96 13.044 -6.914 -8.061 734 HA ALA 96 HA ALA 96 13.902 -4.798 -9.938 735 1HB ALA 96 HB2 ALA 96 11.857 -6.964 -10.410 736 2HB ALA 96 HB1 ALA 96 12.257 -5.666 -11.540 737 3HB ALA 96 HB3 ALA 96 13.473 -6.871 -11.114 738 H LEU 97 HN LEU 97 11.604 -5.678 -7.527 739 HA LEU 97 HA LEU 97 9.613 -3.727 -8.377 740 1HB LEU 97 HB2 LEU 97 9.644 -5.501 -5.933 741 2HB LEU 97 HB1 LEU 97 8.271 -4.610 -6.554 742 HG LEU 97 HG LEU 97 7.765 -6.677 -7.286 743 1HD1 LEU 97 3HD1 LEU 97 8.048 -5.080 -9.208 744 2HD1 LEU 97 2HD1 LEU 97 9.550 -5.921 -9.570 745 3HD1 LEU 97 1HD1 LEU 97 8.019 -6.794 -9.616 746 1HD2 LEU 97 2HD2 LEU 97 9.800 -7.722 -6.415 747 2HD2 LEU 97 1HD2 LEU 97 9.312 -8.390 -7.972 748 3HD2 LEU 97 3HD2 LEU 97 10.653 -7.246 -7.881 749 H THR 98 HN THR 98 8.888 -3.212 -5.537 750 HA THR 98 HA THR 98 9.569 -2.359 -3.536 751 HB THR 98 HB THR 98 12.062 -1.079 -4.452 752 HG1 THR 98 HG1 THR 98 12.376 -3.007 -5.475 753 1HG2 THR 98 1HG2 THR 98 11.157 -2.642 -2.052 754 2HG2 THR 98 3HG2 THR 98 12.818 -2.091 -2.267 755 3HG2 THR 98 2HG2 THR 98 11.508 -0.918 -2.156 756 H ILE 99 HN ILE 99 7.888 -0.823 -3.591 757 HA ILE 99 HA ILE 99 7.200 1.186 -3.038 758 HB ILE 99 HB ILE 99 9.810 2.541 -3.402 759 1HG1 ILE 99 2HG1 ILE 99 9.248 0.896 -0.970 760 2HG1 ILE 99 1HG1 ILE 99 9.897 0.078 -2.373 761 1HG2 ILE 99 2HG2 ILE 99 7.745 3.639 -2.592 762 2HG2 ILE 99 1HG2 ILE 99 7.789 2.555 -1.200 763 3HG2 ILE 99 3HG2 ILE 99 9.103 3.700 -1.469 764 1HD1 ILE 99 1HD1 ILE 99 11.817 1.600 -2.270 765 2HD1 ILE 99 3HD1 ILE 99 11.142 2.288 -0.797 766 3HD1 ILE 99 2HD1 ILE 99 11.625 0.594 -0.837 767 H SER 100 HN SER 100 9.620 2.340 -5.343 768 HA SER 100 HA SER 100 7.951 4.011 -6.745 769 1HB SER 100 HB2 SER 100 10.442 3.891 -6.971 770 2HB SER 100 HB1 SER 100 10.258 2.389 -7.881 771 HG SER 100 HG SER 100 10.326 4.738 -8.909 772 H LYS 101 HN LYS 101 8.530 0.547 -7.202 773 HA LYS 101 HA LYS 101 6.412 0.286 -9.107 774 1HB LYS 101 HB2 LYS 101 7.601 -1.553 -9.540 775 2HB LYS 101 HB1 LYS 101 8.537 -1.337 -8.072 776 1HG LYS 101 HG2 LYS 101 7.640 -3.495 -7.948 777 2HG LYS 101 HG1 LYS 101 6.662 -2.520 -6.857 778 1HD LYS 101 HD2 LYS 101 5.033 -3.681 -7.950 779 2HD LYS 101 HD1 LYS 101 5.145 -2.260 -8.987 780 1HE LYS 101 HE2 LYS 101 6.920 -3.732 -10.242 781 2HE LYS 101 HE1 LYS 101 6.057 -5.059 -9.454 782 1HZ LYS 101 HZ1 LYS 101 3.983 -4.104 -10.445 783 2HZ LYS 101 HZ3 LYS 101 4.957 -3.048 -11.342 784 3HZ LYS 101 HZ2 LYS 101 5.084 -4.713 -11.574 785 H VAL 102 HN VAL 102 6.660 -0.339 -5.569 786 HA VAL 102 HA VAL 102 4.282 -1.965 -5.762 787 HB VAL 102 HB VAL 102 4.703 -2.816 -3.713 788 1HG1 VAL 102 1HG1 VAL 102 7.321 -1.882 -4.774 789 2HG1 VAL 102 3HG1 VAL 102 7.194 -2.958 -3.385 790 3HG1 VAL 102 2HG1 VAL 102 6.547 -3.461 -4.948 791 1HG2 VAL 102 2HG2 VAL 102 4.522 -0.692 -2.465 792 2HG2 VAL 102 1HG2 VAL 102 5.771 -1.769 -1.838 793 3HG2 VAL 102 3HG2 VAL 102 6.214 -0.389 -2.828 794 H LEU 103 HN LEU 103 5.040 1.276 -4.753 795 HA LEU 103 HA LEU 103 2.682 1.683 -3.230 796 1HB LEU 103 HB2 LEU 103 4.390 3.677 -4.735 797 2HB LEU 103 HB1 LEU 103 3.114 4.108 -3.614 798 HG LEU 103 HG LEU 103 5.762 2.787 -2.984 799 1HD1 LEU 103 2HD1 LEU 103 5.826 5.193 -3.297 800 2HD1 LEU 103 1HD1 LEU 103 4.517 5.398 -2.133 801 3HD1 LEU 103 3HD1 LEU 103 6.080 4.779 -1.602 802 1HD2 LEU 103 3HD2 LEU 103 3.926 1.768 -1.632 803 2HD2 LEU 103 2HD2 LEU 103 5.100 2.661 -0.670 804 3HD2 LEU 103 1HD2 LEU 103 3.530 3.378 -1.025 805 H LEU 104 HN LEU 104 3.475 1.719 -6.597 806 HA LEU 104 HA LEU 104 1.005 2.887 -7.461 807 1HB LEU 104 HB2 LEU 104 3.164 1.402 -8.931 808 2HB LEU 104 HB1 LEU 104 1.749 2.094 -9.707 809 HG LEU 104 HG LEU 104 3.845 3.636 -8.177 810 1HD1 LEU 104 1HD1 LEU 104 3.226 3.439 -11.121 811 2HD1 LEU 104 3HD1 LEU 104 4.384 4.551 -10.395 812 3HD1 LEU 104 2HD1 LEU 104 4.662 2.811 -10.312 813 1HD2 LEU 104 2HD2 LEU 104 1.366 4.512 -9.665 814 2HD2 LEU 104 1HD2 LEU 104 1.702 4.706 -7.945 815 3HD2 LEU 104 3HD2 LEU 104 2.646 5.605 -9.136 816 H SER 105 HN SER 105 2.329 -0.395 -7.214 817 HA SER 105 HA SER 105 0.077 -1.689 -8.315 818 1HB SER 105 HB2 SER 105 1.920 -2.826 -6.224 819 2HB SER 105 HB1 SER 105 0.959 -3.705 -7.412 820 HG SER 105 HG SER 105 2.252 -2.531 -9.025 821 H ILE 106 HN ILE 106 0.893 -0.727 -5.003 822 HA ILE 106 HA ILE 106 -1.375 -1.877 -3.785 823 HB ILE 106 HB ILE 106 0.384 0.426 -2.995 824 1HG1 ILE 106 2HG1 ILE 106 -0.019 -2.309 -1.747 825 2HG1 ILE 106 1HG1 ILE 106 1.282 -1.898 -2.862 826 1HG2 ILE 106 2HG2 ILE 106 -2.013 -0.667 -1.537 827 2HG2 ILE 106 1HG2 ILE 106 -0.779 0.343 -0.783 828 3HG2 ILE 106 3HG2 ILE 106 -1.755 0.979 -2.105 829 1HD1 ILE 106 2HD1 ILE 106 0.837 -0.530 -0.218 830 2HD1 ILE 106 1HD1 ILE 106 1.947 -1.874 -0.480 831 3HD1 ILE 106 3HD1 ILE 106 2.211 -0.341 -1.304 832 H CYS 107 HN CYS 107 -0.735 1.332 -5.087 833 HA CYS 107 HA CYS 107 -3.241 2.470 -4.738 834 1HB CYS 107 HB2 CYS 107 -1.453 3.781 -5.596 835 2HB CYS 107 HB1 CYS 107 -1.238 2.722 -6.988 836 HG CYS 107 HG CYS 107 -4.033 4.608 -6.416 837 H SER 108 HN SER 108 -2.092 0.081 -6.999 838 HA SER 108 HA SER 108 -4.379 0.233 -8.704 839 1HB SER 108 HB2 SER 108 -2.311 -0.327 -9.688 840 2HB SER 108 HB1 SER 108 -2.075 -1.669 -8.574 841 HG SER 108 HG SER 108 -4.308 -2.241 -9.667 842 H LEU 109 HN LEU 109 -3.597 -1.413 -5.798 843 HA LEU 109 HA LEU 109 -5.621 -3.448 -6.183 844 1HB LEU 109 HB2 LEU 109 -4.092 -2.604 -3.701 845 2HB LEU 109 HB1 LEU 109 -5.142 -4.005 -3.801 846 HG LEU 109 HG LEU 109 -2.649 -3.649 -5.471 847 1HD1 LEU 109 3HD1 LEU 109 -3.078 -5.137 -2.892 848 2HD1 LEU 109 2HD1 LEU 109 -1.713 -5.417 -3.970 849 3HD1 LEU 109 1HD1 LEU 109 -1.928 -3.841 -3.206 850 1HD2 LEU 109 1HD2 LEU 109 -4.334 -5.098 -6.469 851 2HD2 LEU 109 3HD2 LEU 109 -2.937 -6.030 -5.924 852 3HD2 LEU 109 2HD2 LEU 109 -4.425 -6.035 -4.977 853 H LEU 110 HN LEU 110 -5.168 -0.365 -4.689 854 HA LEU 110 HA LEU 110 -7.774 -0.064 -3.567 855 1HB LEU 110 HB2 LEU 110 -5.469 1.715 -4.226 856 2HB LEU 110 HB1 LEU 110 -7.008 2.469 -3.908 857 HG LEU 110 HG LEU 110 -7.019 1.570 -1.666 858 1HD1 LEU 110 1HD1 LEU 110 -5.945 -0.605 -2.210 859 2HD1 LEU 110 3HD1 LEU 110 -4.396 0.236 -2.270 860 3HD1 LEU 110 2HD1 LEU 110 -5.310 0.172 -0.764 861 1HD2 LEU 110 2HD2 LEU 110 -5.753 3.633 -2.118 862 2HD2 LEU 110 1HD2 LEU 110 -5.135 2.735 -0.732 863 3HD2 LEU 110 3HD2 LEU 110 -4.289 2.663 -2.279 864 H CYS 111 HN CYS 111 -6.357 0.341 -6.664 865 HA CYS 111 HA CYS 111 -8.437 2.072 -7.663 866 1HB CYS 111 HB2 CYS 111 -6.305 2.769 -8.254 867 2HB CYS 111 HB1 CYS 111 -5.794 1.131 -8.651 868 HG CYS 111 HG CYS 111 -8.169 2.695 -10.538 869 H ASP 112 HN ASP 112 -7.125 -1.135 -8.325 870 HA ASP 112 HA ASP 112 -9.040 -1.641 -10.461 871 1HB ASP 112 HB2 ASP 112 -6.661 -2.117 -10.791 872 2HB ASP 112 HB1 ASP 112 -6.711 -3.291 -9.484 873 HA PRO 113 HA PRO 113 -9.596 -3.573 -5.697 874 1HB PRO 113 HB2 PRO 113 -12.167 -3.992 -7.177 875 2HB PRO 113 HB1 PRO 113 -11.897 -3.806 -5.436 876 1HG PRO 113 HG2 PRO 113 -12.435 -1.714 -7.248 877 2HG PRO 113 HG1 PRO 113 -11.822 -1.534 -5.596 878 1HD PRO 113 HD2 PRO 113 -10.418 -0.816 -7.895 879 2HD PRO 113 HD1 PRO 113 -9.663 -1.165 -6.318 880 H ASN 114 HN ASN 114 -8.039 -5.076 -6.138 881 HA ASN 114 HA ASN 114 -8.072 -7.346 -7.637 882 1HB ASN 114 HB2 ASN 114 -6.160 -7.148 -6.382 883 2HB ASN 114 HB1 ASN 114 -7.028 -6.668 -4.929 884 1HD2 ASN 114 1HD2 ASN 114 -7.742 -8.245 -3.498 885 2HD2 ASN 114 2HD2 ASN 114 -7.268 -9.901 -3.649 886 HA PRO 115 HA PRO 115 -11.670 -9.404 -6.006 887 1HB PRO 115 HB2 PRO 115 -12.061 -11.053 -8.045 888 2HB PRO 115 HB1 PRO 115 -12.256 -9.306 -8.246 889 1HG PRO 115 HG2 PRO 115 -10.014 -11.075 -9.113 890 2HG PRO 115 HG1 PRO 115 -10.692 -9.646 -9.910 891 1HD PRO 115 HD2 PRO 115 -8.385 -9.734 -8.282 892 2HD PRO 115 HD1 PRO 115 -9.220 -8.279 -8.862 893 H ASP 116 HN ASP 116 -8.714 -10.490 -5.434 894 HA ASP 116 HA ASP 116 -9.674 -13.182 -4.848 895 1HB ASP 116 HB2 ASP 116 -8.523 -13.448 -6.958 896 2HB ASP 116 HB1 ASP 116 -7.086 -12.672 -6.291 897 H ASP 117 HN ASP 117 -6.492 -11.730 -4.667 898 HA ASP 117 HA ASP 117 -5.470 -12.956 -2.504 899 1HB ASP 117 HB2 ASP 117 -5.148 -10.309 -3.721 900 2HB ASP 117 HB1 ASP 117 -4.452 -10.486 -2.106 901 HA PRO 118 HA PRO 118 -8.130 -11.307 0.764 902 1HB PRO 118 HB2 PRO 118 -8.650 -13.650 1.953 903 2HB PRO 118 HB1 PRO 118 -9.428 -13.185 0.436 904 1HG PRO 118 HG2 PRO 118 -7.373 -15.227 0.926 905 2HG PRO 118 HG1 PRO 118 -8.477 -15.052 -0.446 906 1HD PRO 118 HD2 PRO 118 -5.697 -14.219 -0.227 907 2HD PRO 118 HD1 PRO 118 -6.753 -14.220 -1.656 908 H LEU 119 HN LEU 119 -7.701 -10.759 2.856 909 HA LEU 119 HA LEU 119 -5.423 -12.059 4.180 910 1HB LEU 119 HB2 LEU 119 -5.139 -9.627 3.184 911 2HB LEU 119 HB1 LEU 119 -5.996 -9.157 4.636 912 HG LEU 119 HG LEU 119 -3.604 -8.908 4.937 913 1HD1 LEU 119 2HD1 LEU 119 -4.728 -11.196 6.535 914 2HD1 LEU 119 1HD1 LEU 119 -3.278 -10.280 6.952 915 3HD1 LEU 119 3HD1 LEU 119 -4.848 -9.477 6.912 916 1HD2 LEU 119 3HD2 LEU 119 -3.429 -11.860 4.365 917 2HD2 LEU 119 2HD2 LEU 119 -2.835 -10.557 3.337 918 3HD2 LEU 119 1HD2 LEU 119 -2.103 -10.836 4.915 919 H VAL 120 HN VAL 120 -8.150 -9.812 4.788 920 HA VAL 120 HA VAL 120 -8.426 -11.030 7.460 921 HB VAL 120 HB VAL 120 -9.549 -8.440 6.403 922 1HG1 VAL 120 1HG1 VAL 120 -10.865 -9.391 8.245 923 2HG1 VAL 120 3HG1 VAL 120 -9.410 -9.519 9.228 924 3HG1 VAL 120 2HG1 VAL 120 -10.021 -7.934 8.761 925 1HG2 VAL 120 1HG2 VAL 120 -7.088 -9.051 8.024 926 2HG2 VAL 120 3HG2 VAL 120 -7.207 -8.159 6.505 927 3HG2 VAL 120 2HG2 VAL 120 -7.834 -7.456 7.999 928 HA PRO 121 HA PRO 121 -12.137 -13.202 6.261 929 1HB PRO 121 HB2 PRO 121 -12.885 -12.472 9.067 930 2HB PRO 121 HB1 PRO 121 -12.999 -14.031 8.241 931 1HG PRO 121 HG2 PRO 121 -11.039 -13.582 9.963 932 2HG PRO 121 HG1 PRO 121 -10.725 -14.460 8.454 933 1HD PRO 121 HD2 PRO 121 -10.048 -11.651 9.193 934 2HD PRO 121 HD1 PRO 121 -9.147 -12.802 8.189 935 H GLU 122 HN GLU 122 -12.561 -10.234 8.257 936 HA GLU 122 HA GLU 122 -15.198 -9.831 7.250 937 1HB GLU 122 HB2 GLU 122 -15.036 -7.571 8.292 938 2HB GLU 122 HB1 GLU 122 -14.864 -8.935 9.401 939 1HG GLU 122 HG2 GLU 122 -12.511 -8.597 9.547 940 2HG GLU 122 HG1 GLU 122 -12.539 -7.425 8.233 941 H ILE 123 HN ILE 123 -12.082 -8.423 6.504 942 HA ILE 123 HA ILE 123 -13.263 -6.390 4.852 943 HB ILE 123 HB ILE 123 -10.354 -7.149 4.808 944 1HG1 ILE 123 2HG1 ILE 123 -11.690 -5.283 6.775 945 2HG1 ILE 123 1HG1 ILE 123 -11.147 -6.914 7.166 946 1HG2 ILE 123 1HG2 ILE 123 -11.274 -5.500 3.189 947 2HG2 ILE 123 3HG2 ILE 123 -11.734 -4.491 4.562 948 3HG2 ILE 123 2HG2 ILE 123 -10.035 -4.851 4.259 949 1HD1 ILE 123 1HD1 ILE 123 -8.890 -6.306 6.600 950 2HD1 ILE 123 3HD1 ILE 123 -9.411 -4.664 6.216 951 3HD1 ILE 123 2HD1 ILE 123 -9.538 -5.270 7.874 952 H ALA 124 HN ALA 124 -11.578 -9.446 4.313 953 HA ALA 124 HA ALA 124 -11.824 -9.502 1.526 954 1HB ALA 124 HB1 ALA 124 -12.172 -11.809 3.440 955 2HB ALA 124 HB3 ALA 124 -11.877 -11.945 1.707 956 3HB ALA 124 HB2 ALA 124 -10.641 -11.256 2.763 957 H ARG 125 HN ARG 125 -14.095 -10.120 4.091 958 HA ARG 125 HA ARG 125 -16.201 -11.250 2.630 959 1HB ARG 125 HB2 ARG 125 -16.293 -11.539 4.937 960 2HB ARG 125 HB1 ARG 125 -15.912 -9.854 5.257 961 1HG ARG 125 HG2 ARG 125 -18.159 -10.186 5.851 962 2HG ARG 125 HG1 ARG 125 -18.162 -9.261 4.360 963 1HD ARG 125 HD2 ARG 125 -19.848 -11.032 4.360 964 2HD ARG 125 HD1 ARG 125 -18.646 -11.233 3.086 965 HE ARG 125 HE ARG 125 -17.571 -12.866 4.711 966 1HH1 ARG 125 1HH1 ARG 125 -21.027 -12.290 4.657 967 2HH1 ARG 125 2HH1 ARG 125 -21.419 -13.893 5.185 968 1HH2 ARG 125 1HH2 ARG 125 -18.091 -14.963 5.429 969 2HH2 ARG 125 2HH2 ARG 125 -19.758 -15.407 5.644 970 H ILE 126 HN ILE 126 -15.901 -7.984 3.951 971 HA ILE 126 HA ILE 126 -18.164 -6.919 2.801 972 HB ILE 126 HB ILE 126 -17.037 -4.717 3.156 973 1HG1 ILE 126 2HG1 ILE 126 -14.906 -5.140 4.687 974 2HG1 ILE 126 1HG1 ILE 126 -14.739 -6.545 3.632 975 1HG2 ILE 126 3HG2 ILE 126 -18.391 -5.777 4.876 976 2HG2 ILE 126 2HG2 ILE 126 -16.978 -6.669 5.443 977 3HG2 ILE 126 1HG2 ILE 126 -17.029 -4.912 5.589 978 1HD1 ILE 126 1HD1 ILE 126 -14.769 -5.070 1.682 979 2HD1 ILE 126 3HD1 ILE 126 -14.894 -3.672 2.745 980 3HD1 ILE 126 2HD1 ILE 126 -13.449 -4.680 2.784 981 H TYR 127 HN TYR 127 -15.104 -7.499 1.277 982 HA TYR 127 HA TYR 127 -15.699 -5.766 -0.939 983 1HB TYR 127 HB2 TYR 127 -13.390 -6.170 -0.648 984 2HB TYR 127 HB1 TYR 127 -13.626 -7.907 -0.536 985 HD1 TYR 127 HD1 TYR 127 -13.542 -9.257 -2.475 986 HD2 TYR 127 HD2 TYR 127 -13.769 -5.030 -2.891 987 HE1 TYR 127 HE1 TYR 127 -13.164 -9.481 -4.892 988 HE2 TYR 127 HE2 TYR 127 -13.385 -5.242 -5.309 989 HH TYR 127 HH TYR 127 -12.289 -6.930 -6.866 990 H LYS 128 HN LYS 128 -15.662 -9.227 -0.425 991 HA LYS 128 HA LYS 128 -16.772 -9.635 -3.074 992 1HB LYS 128 HB2 LYS 128 -16.106 -11.957 -2.749 993 2HB LYS 128 HB1 LYS 128 -14.766 -10.861 -2.414 994 1HG LYS 128 HG2 LYS 128 -15.689 -11.110 0.061 995 2HG LYS 128 HG1 LYS 128 -16.265 -12.648 -0.586 996 1HD LYS 128 HD2 LYS 128 -13.413 -11.633 -0.585 997 2HD LYS 128 HD1 LYS 128 -14.064 -12.946 0.396 998 1HE LYS 128 HE2 LYS 128 -14.456 -14.294 -1.567 999 2HE LYS 128 HE1 LYS 128 -14.013 -12.959 -2.625 1000 1HZ LYS 128 HZ2 LYS 128 -11.759 -13.063 -1.675 1001 2HZ LYS 128 HZ1 LYS 128 -12.206 -14.420 -0.779 1002 3HZ LYS 128 HZ3 LYS 128 -12.189 -14.491 -2.471 1003 H THR 129 HN THR 129 -18.191 -8.677 -0.550 1004 HA THR 129 HA THR 129 -20.545 -10.294 -0.859 1005 HB THR 129 HB THR 129 -19.218 -9.980 1.811 1006 HG1 THR 129 HG1 THR 129 -19.068 -11.893 -0.078 1007 1HG2 THR 129 1HG2 THR 129 -21.865 -11.238 1.068 1008 2HG2 THR 129 3HG2 THR 129 -21.108 -11.347 2.658 1009 3HG2 THR 129 2HG2 THR 129 -21.626 -9.782 2.033 1010 H ASP 130 HN ASP 130 -19.448 -7.980 1.633 1011 HA ASP 130 HA ASP 130 -21.933 -6.537 1.201 1012 1HB ASP 130 HB2 ASP 130 -19.687 -5.954 3.152 1013 2HB ASP 130 HB1 ASP 130 -21.257 -5.171 3.118 1014 H ARG 131 HN ARG 131 -20.918 -6.226 -1.065 1015 HA ARG 131 HA ARG 131 -18.721 -4.801 -1.703 1016 1HB ARG 131 HB2 ARG 131 -20.308 -5.862 -3.286 1017 2HB ARG 131 HB1 ARG 131 -21.396 -4.501 -3.071 1018 1HG ARG 131 HG2 ARG 131 -20.197 -4.221 -5.119 1019 2HG ARG 131 HG1 ARG 131 -19.629 -3.013 -3.966 1020 1HD ARG 131 HD2 ARG 131 -17.772 -4.010 -5.197 1021 2HD ARG 131 HD1 ARG 131 -17.676 -4.379 -3.477 1022 HE ARG 131 HE ARG 131 -18.554 -6.608 -4.033 1023 1HH1 ARG 131 1HH1 ARG 131 -17.106 -4.728 -6.617 1024 2HH1 ARG 131 2HH1 ARG 131 -16.699 -6.121 -7.562 1025 1HH2 ARG 131 1HH2 ARG 131 -18.022 -8.425 -5.274 1026 2HH2 ARG 131 2HH2 ARG 131 -17.218 -8.226 -6.801 1027 H GLU 132 HN GLU 132 -21.768 -3.436 -0.621 1028 HA GLU 132 HA GLU 132 -21.243 -0.709 -1.024 1029 1HB GLU 132 HB2 GLU 132 -22.839 -0.408 0.919 1030 2HB GLU 132 HB1 GLU 132 -23.450 -1.300 -0.466 1031 1HG GLU 132 HG2 GLU 132 -23.244 -3.372 0.689 1032 2HG GLU 132 HG1 GLU 132 -22.330 -2.628 1.996 1033 H LYS 133 HN LYS 133 -20.537 -2.827 1.657 1034 HA LYS 133 HA LYS 133 -19.490 -0.847 3.411 1035 1HB LYS 133 HB2 LYS 133 -19.446 -3.867 3.380 1036 2HB LYS 133 HB1 LYS 133 -18.664 -2.908 4.650 1037 1HG LYS 133 HG2 LYS 133 -20.798 -1.871 5.212 1038 2HG LYS 133 HG1 LYS 133 -21.583 -2.753 3.907 1039 1HD LYS 133 HD2 LYS 133 -22.087 -3.866 5.952 1040 2HD LYS 133 HD1 LYS 133 -20.954 -4.874 5.056 1041 1HE LYS 133 HE2 LYS 133 -19.135 -4.187 6.446 1042 2HE LYS 133 HE1 LYS 133 -20.133 -2.970 7.242 1043 1HZ LYS 133 HZ3 LYS 133 -20.558 -5.905 7.372 1044 2HZ LYS 133 HZ2 LYS 133 -19.893 -4.956 8.599 1045 3HZ LYS 133 HZ1 LYS 133 -21.506 -4.733 8.142 1046 H TYR 134 HN TYR 134 -18.287 -2.585 0.770 1047 HA TYR 134 HA TYR 134 -15.505 -2.240 1.428 1048 1HB TYR 134 HB2 TYR 134 -16.158 -4.108 0.015 1049 2HB TYR 134 HB1 TYR 134 -16.970 -3.023 -1.103 1050 HD1 TYR 134 HD1 TYR 134 -15.829 -2.112 -2.926 1051 HD2 TYR 134 HD2 TYR 134 -13.623 -3.893 0.239 1052 HE1 TYR 134 HE1 TYR 134 -13.778 -1.950 -4.257 1053 HE2 TYR 134 HE2 TYR 134 -11.565 -3.739 -1.099 1054 HH TYR 134 HH TYR 134 -10.903 -3.557 -3.438 1055 H ASN 135 HN ASN 135 -17.578 -1.044 -1.167 1056 HA ASN 135 HA ASN 135 -15.828 0.901 -2.073 1057 1HB ASN 135 HB2 ASN 135 -18.771 0.460 -2.456 1058 2HB ASN 135 HB1 ASN 135 -17.937 1.799 -3.221 1059 1HD2 ASN 135 1HD2 ASN 135 -18.171 -1.677 -3.017 1060 2HD2 ASN 135 2HD2 ASN 135 -17.410 -1.997 -4.539 1061 H ARG 136 HN ARG 136 -18.868 1.472 -0.271 1062 HA ARG 136 HA ARG 136 -18.481 4.285 -0.485 1063 1HB ARG 136 HB2 ARG 136 -20.734 3.275 -0.312 1064 2HB ARG 136 HB1 ARG 136 -20.384 2.839 1.359 1065 1HG ARG 136 HG2 ARG 136 -20.126 5.163 1.955 1066 2HG ARG 136 HG1 ARG 136 -20.367 5.643 0.278 1067 1HD ARG 136 HD2 ARG 136 -22.642 4.592 0.401 1068 2HD ARG 136 HD1 ARG 136 -22.378 4.377 2.130 1069 HE ARG 136 HE ARG 136 -21.941 7.080 1.375 1070 1HH1 ARG 136 1HH1 ARG 136 -24.464 4.766 2.061 1071 2HH1 ARG 136 2HH1 ARG 136 -25.666 5.977 2.368 1072 1HH2 ARG 136 1HH2 ARG 136 -23.512 8.683 1.783 1073 2HH2 ARG 136 2HH2 ARG 136 -25.122 8.204 2.224 1074 H ILE 137 HN ILE 137 -17.311 1.981 1.723 1075 HA ILE 137 HA ILE 137 -17.288 3.785 3.984 1076 HB ILE 137 HB ILE 137 -16.131 0.992 3.792 1077 1HG1 ILE 137 2HG1 ILE 137 -18.501 0.859 3.321 1078 2HG1 ILE 137 1HG1 ILE 137 -18.234 0.303 4.968 1079 1HG2 ILE 137 1HG2 ILE 137 -15.246 2.310 5.636 1080 2HG2 ILE 137 3HG2 ILE 137 -16.881 2.700 6.171 1081 3HG2 ILE 137 2HG2 ILE 137 -16.303 1.034 6.238 1082 1HD1 ILE 137 3HD1 ILE 137 -18.979 2.482 5.808 1083 2HD1 ILE 137 2HD1 ILE 137 -19.280 3.001 4.150 1084 3HD1 ILE 137 1HD1 ILE 137 -20.214 1.675 4.840 1085 H ALA 138 HN ALA 138 -14.855 1.863 2.214 1086 HA ALA 138 HA ALA 138 -12.657 3.325 3.152 1087 1HB ALA 138 HB3 ALA 138 -11.428 2.237 1.375 1088 2HB ALA 138 HB2 ALA 138 -12.524 1.094 2.155 1089 3HB ALA 138 HB1 ALA 138 -12.938 1.778 0.582 1090 H ARG 139 HN ARG 139 -14.908 3.850 0.511 1091 HA ARG 139 HA ARG 139 -13.479 5.979 -0.724 1092 1HB ARG 139 HB2 ARG 139 -15.220 4.879 -1.966 1093 2HB ARG 139 HB1 ARG 139 -16.415 5.252 -0.734 1094 1HG ARG 139 HG2 ARG 139 -16.267 7.613 -1.268 1095 2HG ARG 139 HG1 ARG 139 -15.010 7.278 -2.463 1096 1HD ARG 139 HD2 ARG 139 -16.570 5.923 -3.745 1097 2HD ARG 139 HD1 ARG 139 -17.825 6.200 -2.541 1098 HE ARG 139 HE ARG 139 -17.661 8.601 -3.172 1099 1HH1 ARG 139 1HH1 ARG 139 -16.603 6.134 -5.428 1100 2HH1 ARG 139 2HH1 ARG 139 -16.929 7.099 -6.830 1101 1HH2 ARG 139 1HH2 ARG 139 -18.061 9.880 -4.999 1102 2HH2 ARG 139 2HH2 ARG 139 -17.763 9.242 -6.585 1103 H GLU 140 HN GLU 140 -15.893 5.821 1.891 1104 HA GLU 140 HA GLU 140 -16.226 8.577 2.183 1105 1HB GLU 140 HB2 GLU 140 -17.631 7.943 3.825 1106 2HB GLU 140 HB1 GLU 140 -17.319 6.325 3.267 1107 1HG GLU 140 HG2 GLU 140 -16.041 5.773 5.036 1108 2HG GLU 140 HG1 GLU 140 -15.452 7.413 5.282 1109 H TRP 141 HN TRP 141 -13.944 6.265 3.559 1110 HA TRP 141 HA TRP 141 -12.606 8.163 5.138 1111 1HB TRP 141 HB2 TRP 141 -11.560 5.590 3.952 1112 2HB TRP 141 HB1 TRP 141 -10.737 6.540 5.188 1113 HD1 TRP 141 HD1 TRP 141 -13.473 7.195 6.845 1114 HE1 TRP 141 HE1 TRP 141 -14.434 5.327 8.328 1115 HE3 TRP 141 HE3 TRP 141 -11.229 3.185 4.652 1116 HZ2 TRP 141 HZ2 TRP 141 -14.253 2.538 8.533 1117 HZ3 TRP 141 HZ3 TRP 141 -11.673 0.948 5.565 1118 HH2 TRP 141 HH2 TRP 141 -13.152 0.637 7.468 1119 H THR 142 HN THR 142 -12.209 7.089 1.847 1120 HA THR 142 HA THR 142 -9.977 8.607 1.165 1121 HB THR 142 HB THR 142 -12.221 7.365 -0.245 1122 HG1 THR 142 HG1 THR 142 -10.189 7.068 -1.667 1123 1HG2 THR 142 3HG2 THR 142 -10.726 9.619 -1.581 1124 2HG2 THR 142 2HG2 THR 142 -11.783 8.462 -2.391 1125 3HG2 THR 142 1HG2 THR 142 -12.450 9.592 -1.213 1126 H GLN 143 HN GLN 143 -13.342 9.558 1.549 1127 HA GLN 143 HA GLN 143 -12.995 12.073 0.205 1128 1HB GLN 143 HB2 GLN 143 -15.260 12.137 0.258 1129 2HB GLN 143 HB1 GLN 143 -15.039 10.421 0.529 1130 1HG GLN 143 HG2 GLN 143 -15.488 10.616 2.788 1131 2HG GLN 143 HG1 GLN 143 -15.279 12.367 2.745 1132 1HE2 GLN 143 1HE2 GLN 143 -17.386 9.707 1.989 1133 2HE2 GLN 143 2HE2 GLN 143 -18.817 10.638 1.748 1134 H LYS 144 HN LYS 144 -12.717 10.865 3.344 1135 HA LYS 144 HA LYS 144 -13.215 13.456 4.622 1136 1HB LYS 144 HB2 LYS 144 -13.703 10.629 5.199 1137 2HB LYS 144 HB1 LYS 144 -13.283 11.614 6.609 1138 1HG LYS 144 HG2 LYS 144 -15.190 12.978 6.287 1139 2HG LYS 144 HG1 LYS 144 -15.437 12.352 4.656 1140 1HD LYS 144 HD2 LYS 144 -17.073 11.326 6.043 1141 2HD LYS 144 HD1 LYS 144 -15.853 10.102 5.677 1142 1HE LYS 144 HE2 LYS 144 -14.899 10.277 7.839 1143 2HE LYS 144 HE1 LYS 144 -15.816 11.740 8.200 1144 1HZ LYS 144 HZ2 LYS 144 -17.121 9.120 7.674 1145 2HZ LYS 144 HZ1 LYS 144 -16.681 9.634 9.231 1146 3HZ LYS 144 HZ3 LYS 144 -17.811 10.515 8.342 1147 H TYR 145 HN TYR 145 -10.905 10.792 4.454 1148 HA TYR 145 HA TYR 145 -9.193 12.184 6.394 1149 1HB TYR 145 HB2 TYR 145 -9.292 9.277 5.589 1150 2HB TYR 145 HB1 TYR 145 -8.069 9.945 6.665 1151 HD1 TYR 145 HD1 TYR 145 -8.581 10.416 8.954 1152 HD2 TYR 145 HD2 TYR 145 -11.663 9.162 6.312 1153 HE1 TYR 145 HE1 TYR 145 -10.056 10.037 10.880 1154 HE2 TYR 145 HE2 TYR 145 -13.157 8.785 8.227 1155 HH TYR 145 HH TYR 145 -12.526 9.941 11.321 1156 H ALA 146 HN ALA 146 -9.361 11.054 3.147 1157 HA ALA 146 HA ALA 146 -6.566 11.745 2.867 1158 1HB ALA 146 HB1 ALA 146 -6.980 9.502 2.214 1159 2HB ALA 146 HB2 ALA 146 -6.728 10.425 0.733 1160 3HB ALA 146 HB3 ALA 146 -8.362 9.973 1.227 1161 H MET 147 HN MET 147 -8.703 11.545 0.161 1162 HA MET 147 HA MET 147 -9.082 12.935 -1.560 1163 1HB MET 147 HB2 MET 147 -10.058 14.296 0.886 1164 2HB MET 147 HB1 MET 147 -10.005 15.258 -0.591 1165 1HG MET 147 HG2 MET 147 -11.335 12.586 -0.353 1166 2HG MET 147 HG1 MET 147 -12.171 14.127 -0.158 1167 1HE MET 147 HE2 MET 147 -13.904 13.314 -2.005 1168 2HE MET 147 HE1 MET 147 -13.443 12.805 -3.629 1169 3HE MET 147 HE3 MET 147 -13.019 11.809 -2.240 No H/Q in entry = 1169 Start of MODEL 5 1 H1 MET 1 HT2 MET 1 21.253 -2.268 5.579 2 H2 MET 1 HT1 MET 1 21.506 -3.887 5.174 3 H3 MET 1 HT3 MET 1 22.781 -2.955 5.763 4 HA MET 1 HA MET 1 22.710 -1.555 3.832 5 1HB MET 1 HB2 MET 1 24.203 -3.484 3.846 6 2HB MET 1 HB1 MET 1 22.911 -4.507 3.235 7 1HG MET 1 HG2 MET 1 22.905 -3.367 1.142 8 2HG MET 1 HG1 MET 1 24.041 -2.155 1.737 9 1HE MET 1 HE1 MET 1 24.438 -3.781 -0.981 10 2HE MET 1 HE3 MET 1 25.635 -2.620 -0.420 11 3HE MET 1 HE2 MET 1 26.140 -4.242 -0.898 12 H ALA 2 HN ALA 2 20.014 -3.688 4.135 13 HA ALA 2 HA ALA 2 18.772 -3.583 1.696 14 1HB ALA 2 HB3 ALA 2 16.728 -3.927 2.799 15 2HB ALA 2 HB1 ALA 2 17.270 -3.066 4.240 16 3HB ALA 2 HB2 ALA 2 17.943 -4.645 3.858 17 H LEU 3 HN LEU 3 19.273 -0.972 3.943 18 HA LEU 3 HA LEU 3 17.136 0.690 3.102 19 1HB LEU 3 HB2 LEU 3 18.465 2.486 4.232 20 2HB LEU 3 HB1 LEU 3 18.102 1.097 5.233 21 HG LEU 3 HG LEU 3 20.519 0.364 4.307 22 1HD1 LEU 3 2HD1 LEU 3 20.853 2.418 3.040 23 2HD1 LEU 3 1HD1 LEU 3 20.613 3.374 4.503 24 3HD1 LEU 3 3HD1 LEU 3 22.009 2.308 4.370 25 1HD2 LEU 3 2HD2 LEU 3 19.925 2.134 6.673 26 2HD2 LEU 3 1HD2 LEU 3 19.878 0.372 6.629 27 3HD2 LEU 3 3HD2 LEU 3 21.413 1.217 6.447 28 H LYS 4 HN LYS 4 20.279 0.013 1.901 29 HA LYS 4 HA LYS 4 20.391 2.474 0.408 30 1HB LYS 4 HB2 LYS 4 22.611 2.117 0.249 31 2HB LYS 4 HB1 LYS 4 22.285 1.044 1.598 32 1HG LYS 4 HG2 LYS 4 23.359 -0.500 0.411 33 2HG LYS 4 HG1 LYS 4 21.880 -0.590 -0.549 34 1HD LYS 4 HD2 LYS 4 22.772 1.076 -2.092 35 2HD LYS 4 HD1 LYS 4 24.246 1.194 -1.127 36 1HE LYS 4 HE2 LYS 4 24.700 -1.185 -1.580 37 2HE LYS 4 HE1 LYS 4 23.256 -1.256 -2.585 38 1HZ LYS 4 HZ2 LYS 4 24.244 0.412 -4.035 39 2HZ LYS 4 HZ1 LYS 4 25.637 0.443 -3.082 40 3HZ LYS 4 HZ3 LYS 4 25.226 -0.961 -3.926 41 H ARG 5 HN ARG 5 19.398 -0.718 0.023 42 HA ARG 5 HA ARG 5 19.184 -0.531 -2.874 43 1HB ARG 5 HB2 ARG 5 19.458 -2.757 -2.182 44 2HB ARG 5 HB1 ARG 5 18.324 -2.576 -0.848 45 1HG ARG 5 HG2 ARG 5 16.478 -2.725 -2.211 46 2HG ARG 5 HG1 ARG 5 17.370 -2.231 -3.647 47 1HD ARG 5 HD2 ARG 5 17.949 -4.832 -2.263 48 2HD ARG 5 HD1 ARG 5 16.643 -4.696 -3.441 49 HE ARG 5 HE ARG 5 18.877 -3.632 -4.660 50 1HH1 ARG 5 1HH1 ARG 5 17.915 -6.725 -3.350 51 2HH1 ARG 5 2HH1 ARG 5 18.947 -7.637 -4.401 52 1HH2 ARG 5 1HH2 ARG 5 20.216 -4.827 -6.074 53 2HH2 ARG 5 2HH2 ARG 5 20.249 -6.557 -5.965 54 H ILE 6 HN ILE 6 17.219 -0.476 0.007 55 HA ILE 6 HA ILE 6 14.828 0.317 -1.090 56 HB ILE 6 HB ILE 6 15.936 1.287 1.561 57 1HG1 ILE 6 2HG1 ILE 6 14.446 -1.233 0.810 58 2HG1 ILE 6 1HG1 ILE 6 16.044 -1.100 1.541 59 1HG2 ILE 6 3HG2 ILE 6 13.124 1.094 0.480 60 2HG2 ILE 6 2HG2 ILE 6 13.507 1.354 2.184 61 3HG2 ILE 6 1HG2 ILE 6 13.989 2.543 0.978 62 1HD1 ILE 6 3HD1 ILE 6 13.457 -0.324 2.862 63 2HD1 ILE 6 2HD1 ILE 6 14.375 -1.802 3.159 64 3HD1 ILE 6 1HD1 ILE 6 15.066 -0.235 3.578 65 H HIS 7 HN HIS 7 17.821 1.968 -0.848 66 HA HIS 7 HA HIS 7 17.153 4.626 -1.220 67 1HB HIS 7 HB2 HIS 7 19.410 2.874 -1.872 68 2HB HIS 7 HB1 HIS 7 19.238 4.253 -2.972 69 HD1 HIS 7 HD1 HIS 7 19.151 3.827 0.832 70 HD2 HIS 7 HD2 HIS 7 20.611 6.381 -2.107 71 HE1 HIS 7 HE1 HIS 7 20.466 5.590 2.061 72 HE2 HIS 7 HE2 HIS 7 21.290 7.156 0.269 73 H LYS 8 HN LYS 8 17.145 1.999 -3.605 74 HA LYS 8 HA LYS 8 16.286 3.843 -5.696 75 1HB LYS 8 HB2 LYS 8 16.772 0.883 -5.787 76 2HB LYS 8 HB1 LYS 8 16.265 1.862 -7.156 77 1HG LYS 8 HG2 LYS 8 18.873 2.029 -5.655 78 2HG LYS 8 HG1 LYS 8 18.627 1.506 -7.321 79 1HD LYS 8 HD2 LYS 8 18.228 4.297 -6.221 80 2HD LYS 8 HD1 LYS 8 19.509 3.762 -7.308 81 1HE LYS 8 HE2 LYS 8 16.573 3.703 -7.979 82 2HE LYS 8 HE1 LYS 8 17.663 5.011 -8.431 83 1HZ LYS 8 HZ3 LYS 8 18.980 3.404 -9.687 84 2HZ LYS 8 HZ2 LYS 8 17.893 2.177 -9.285 85 3HZ LYS 8 HZ1 LYS 8 17.386 3.468 -10.247 86 H GLU 9 HN GLU 9 14.958 1.834 -3.365 87 HA GLU 9 HA GLU 9 12.485 1.403 -4.798 88 1HB GLU 9 HB2 GLU 9 13.198 0.981 -1.884 89 2HB GLU 9 HB1 GLU 9 11.808 0.330 -2.699 90 1HG GLU 9 HG2 GLU 9 13.202 -1.120 -4.030 91 2HG GLU 9 HG1 GLU 9 14.644 -0.441 -3.265 92 H LEU 10 HN LEU 10 13.347 2.811 -1.734 93 HA LEU 10 HA LEU 10 11.043 4.395 -1.388 94 1HB LEU 10 HB2 LEU 10 12.055 3.482 0.495 95 2HB LEU 10 HB1 LEU 10 13.646 3.992 -0.022 96 HG LEU 10 HG LEU 10 11.712 6.124 0.689 97 1HD1 LEU 10 2HD1 LEU 10 13.129 4.334 2.635 98 2HD1 LEU 10 1HD1 LEU 10 12.512 5.931 3.052 99 3HD1 LEU 10 3HD1 LEU 10 11.403 4.663 2.536 100 1HD2 LEU 10 2HD2 LEU 10 14.673 5.769 1.134 101 2HD2 LEU 10 1HD2 LEU 10 13.930 6.712 -0.156 102 3HD2 LEU 10 3HD2 LEU 10 13.738 7.211 1.524 103 H ASN 11 HN ASN 11 14.453 5.251 -1.964 104 HA ASN 11 HA ASN 11 13.842 8.043 -1.876 105 1HB ASN 11 HB2 ASN 11 16.102 6.720 -1.399 106 2HB ASN 11 HB1 ASN 11 16.344 7.045 -3.111 107 1HD2 ASN 11 1HD2 ASN 11 15.037 9.627 -3.104 108 2HD2 ASN 11 2HD2 ASN 11 16.081 10.711 -2.247 109 H ASP 12 HN ASP 12 13.921 5.618 -4.294 110 HA ASP 12 HA ASP 12 14.133 7.358 -6.509 111 1HB ASP 12 HB2 ASP 12 14.581 4.968 -6.735 112 2HB ASP 12 HB1 ASP 12 12.905 4.590 -6.334 113 H LEU 13 HN LEU 13 11.535 6.182 -4.530 114 HA LEU 13 HA LEU 13 9.380 7.327 -5.897 115 1HB LEU 13 HB2 LEU 13 9.885 6.741 -3.002 116 2HB LEU 13 HB1 LEU 13 8.387 7.466 -3.548 117 HG LEU 13 HG LEU 13 9.315 4.847 -4.698 118 1HD1 LEU 13 3HD1 LEU 13 9.289 4.743 -2.228 119 2HD1 LEU 13 2HD1 LEU 13 7.583 5.172 -2.285 120 3HD1 LEU 13 1HD1 LEU 13 8.139 3.680 -3.038 121 1HD2 LEU 13 3HD2 LEU 13 6.672 6.237 -4.359 122 2HD2 LEU 13 2HD2 LEU 13 7.525 5.924 -5.868 123 3HD2 LEU 13 1HD2 LEU 13 6.857 4.586 -4.938 124 H ALA 14 HN ALA 14 11.804 8.644 -3.797 125 HA ALA 14 HA ALA 14 10.626 11.250 -3.619 126 1HB ALA 14 HB2 ALA 14 12.129 10.381 -1.876 127 2HB ALA 14 HB3 ALA 14 12.690 11.916 -2.536 128 3HB ALA 14 HB1 ALA 14 13.459 10.404 -3.031 129 H ARG 15 HN ARG 15 12.939 9.627 -5.691 130 HA ARG 15 HA ARG 15 13.946 11.899 -7.024 131 1HB ARG 15 HB2 ARG 15 13.674 9.050 -7.993 132 2HB ARG 15 HB1 ARG 15 14.702 10.281 -8.716 133 1HG ARG 15 HG2 ARG 15 15.017 9.581 -5.839 134 2HG ARG 15 HG1 ARG 15 15.699 8.527 -7.069 135 1HD ARG 15 HD2 ARG 15 17.368 10.113 -6.310 136 2HD ARG 15 HD1 ARG 15 16.939 10.465 -7.983 137 HE ARG 15 HE ARG 15 15.580 11.967 -5.873 138 1HH1 ARG 15 1HH1 ARG 15 17.981 11.898 -8.420 139 2HH1 ARG 15 2HH1 ARG 15 18.133 13.621 -8.507 140 1HH2 ARG 15 1HH2 ARG 15 15.758 14.243 -5.989 141 2HH2 ARG 15 2HH2 ARG 15 16.863 14.963 -7.116 142 H ASP 16 HN ASP 16 11.412 9.567 -7.970 143 HA ASP 16 HA ASP 16 10.315 11.633 -9.768 144 1HB ASP 16 HB2 ASP 16 11.713 9.869 -10.958 145 2HB ASP 16 HB1 ASP 16 10.479 8.704 -10.497 146 HA PRO 17 HA PRO 17 6.766 9.873 -7.520 147 1HB PRO 17 HB2 PRO 17 6.009 12.273 -6.369 148 2HB PRO 17 HB1 PRO 17 7.053 11.069 -5.608 149 1HG PRO 17 HG2 PRO 17 7.764 13.701 -6.477 150 2HG PRO 17 HG1 PRO 17 8.827 12.473 -5.773 151 1HD PRO 17 HD2 PRO 17 8.405 13.202 -8.622 152 2HD PRO 17 HD1 PRO 17 9.829 12.487 -7.832 153 HA PRO 18 HA PRO 18 4.361 11.616 -11.015 154 1HB PRO 18 HB2 PRO 18 2.580 9.524 -11.039 155 2HB PRO 18 HB1 PRO 18 4.091 9.555 -11.956 156 1HG PRO 18 HG2 PRO 18 3.469 8.208 -9.365 157 2HG PRO 18 HG1 PRO 18 4.472 7.650 -10.714 158 1HD PRO 18 HD2 PRO 18 5.522 8.665 -8.435 159 2HD PRO 18 HD1 PRO 18 6.303 8.843 -10.017 160 H ALA 19 HN ALA 19 2.607 9.706 -8.562 161 HA ALA 19 HA ALA 19 1.488 11.953 -7.270 162 1HB ALA 19 HB3 ALA 19 0.205 12.130 -9.346 163 2HB ALA 19 HB2 ALA 19 -0.394 10.491 -9.109 164 3HB ALA 19 HB1 ALA 19 -0.833 11.762 -7.970 165 H GLN 20 HN GLN 20 0.226 8.740 -8.136 166 HA GLN 20 HA GLN 20 -0.831 8.376 -5.499 167 1HB GLN 20 HB2 GLN 20 -1.408 6.067 -6.458 168 2HB GLN 20 HB1 GLN 20 -2.180 7.469 -7.166 169 1HG GLN 20 HG2 GLN 20 0.318 6.307 -8.339 170 2HG GLN 20 HG1 GLN 20 -1.262 5.645 -8.734 171 1HE2 GLN 20 1HE2 GLN 20 -2.696 8.082 -8.850 172 2HE2 GLN 20 2HE2 GLN 20 -2.127 8.970 -10.211 173 H CYS 21 HN CYS 21 2.208 8.360 -6.038 174 HA CYS 21 HA CYS 21 2.729 6.287 -4.118 175 1HB CYS 21 HB2 CYS 21 4.374 5.086 -5.458 176 2HB CYS 21 HB1 CYS 21 2.809 5.054 -6.256 177 HG CYS 21 HG CYS 21 5.459 5.582 -7.751 178 H SER 22 HN SER 22 3.908 7.349 -2.664 179 HA SER 22 HA SER 22 6.496 8.227 -3.503 180 1HB SER 22 HB2 SER 22 5.043 10.255 -3.879 181 2HB SER 22 HB1 SER 22 4.756 10.284 -2.141 182 HG SER 22 HG SER 22 7.305 10.420 -3.386 183 H ALA 23 HN ALA 23 7.825 7.550 -2.071 184 HA ALA 23 HA ALA 23 7.207 7.782 0.809 185 1HB ALA 23 HB3 ALA 23 7.194 5.440 0.298 186 2HB ALA 23 HB1 ALA 23 8.710 5.822 1.110 187 3HB ALA 23 HB2 ALA 23 8.685 5.582 -0.631 188 H GLY 24 HN GLY 24 9.641 7.345 1.823 189 1HA GLY 24 HA1 GLY 24 11.130 9.645 0.906 190 2HA GLY 24 HA2 GLY 24 11.971 8.113 0.659 191 HA PRO 25 HA PRO 25 13.407 8.280 4.827 192 1HB PRO 25 HB2 PRO 25 14.683 10.919 4.705 193 2HB PRO 25 HB1 PRO 25 15.421 9.324 4.852 194 1HG PRO 25 HG2 PRO 25 15.613 10.787 2.597 195 2HG PRO 25 HG1 PRO 25 15.538 9.014 2.577 196 1HD PRO 25 HD2 PRO 25 13.372 11.009 2.014 197 2HD PRO 25 HD1 PRO 25 13.747 9.486 1.180 198 H VAL 26 HN VAL 26 11.704 8.445 6.243 199 HA VAL 26 HA VAL 26 10.535 11.094 6.741 200 HB VAL 26 HB VAL 26 9.708 8.366 7.734 201 1HG1 VAL 26 1HG1 VAL 26 9.216 10.070 9.425 202 2HG1 VAL 26 3HG1 VAL 26 8.394 11.043 8.204 203 3HG1 VAL 26 2HG1 VAL 26 7.738 9.475 8.670 204 1HG2 VAL 26 2HG2 VAL 26 9.299 8.872 5.357 205 2HG2 VAL 26 1HG2 VAL 26 7.811 8.675 6.287 206 3HG2 VAL 26 3HG2 VAL 26 8.368 10.288 5.842 207 H GLY 27 HN GLY 27 11.607 8.386 8.835 208 1HA GLY 27 HA1 GLY 27 12.766 8.513 10.845 209 2HA GLY 27 HA2 GLY 27 12.500 10.263 10.847 210 H ASP 28 HN ASP 28 13.466 9.958 7.914 211 HA ASP 28 HA ASP 28 15.345 10.174 6.679 212 1HB ASP 28 HB2 ASP 28 16.663 10.676 9.353 213 2HB ASP 28 HB1 ASP 28 17.514 10.794 7.816 214 H ASP 29 HN ASP 29 14.571 7.826 8.610 215 HA ASP 29 HA ASP 29 16.753 6.023 7.969 216 1HB ASP 29 HB2 ASP 29 15.092 4.382 9.164 217 2HB ASP 29 HB1 ASP 29 15.968 5.568 10.131 218 H MET 30 HN MET 30 16.380 4.144 6.697 219 HA MET 30 HA MET 30 14.233 4.448 4.758 220 1HB MET 30 HB2 MET 30 16.929 3.571 4.647 221 2HB MET 30 HB1 MET 30 15.923 2.201 4.234 222 1HG MET 30 HG2 MET 30 15.645 2.998 2.180 223 2HG MET 30 HG1 MET 30 14.992 4.480 2.827 224 1HE MET 30 HE1 MET 30 17.251 5.862 4.418 225 2HE MET 30 HE3 MET 30 18.039 6.829 3.171 226 3HE MET 30 HE2 MET 30 16.279 6.707 3.213 227 H PHE 31 HN PHE 31 13.970 3.443 7.621 228 HA PHE 31 HA PHE 31 12.508 0.996 6.924 229 1HB PHE 31 HB2 PHE 31 13.014 0.372 9.374 230 2HB PHE 31 HB1 PHE 31 14.169 -0.026 8.126 231 HD1 PHE 31 HD1 PHE 31 13.464 1.975 11.100 232 HD2 PHE 31 HD2 PHE 31 16.281 1.214 7.999 233 HE1 PHE 31 HE1 PHE 31 15.182 3.204 12.364 234 HE2 PHE 31 HE2 PHE 31 18.005 2.434 9.262 235 HZ PHE 31 HZ PHE 31 17.437 3.350 11.546 236 H HIS 32 HN HIS 32 12.231 4.061 8.038 237 HA HIS 32 HA HIS 32 9.621 3.308 9.069 238 1HB HIS 32 HB2 HIS 32 10.680 3.587 11.120 239 2HB HIS 32 HB1 HIS 32 11.829 4.763 10.476 240 HD1 HIS 32 HD1 HIS 32 11.518 6.937 11.500 241 HD2 HIS 32 HD2 HIS 32 7.899 4.927 11.186 242 HE1 HIS 32 HE1 HIS 32 9.810 8.467 12.525 243 HE2 HIS 32 HE2 HIS 32 7.654 7.155 12.477 244 H TRP 33 HN TRP 33 8.684 4.075 7.177 245 HA TRP 33 HA TRP 33 9.037 6.892 6.547 246 1HB TRP 33 HB2 TRP 33 9.303 6.007 4.092 247 2HB TRP 33 HB1 TRP 33 10.660 6.281 5.143 248 HD1 TRP 33 HD1 TRP 33 11.514 3.832 6.428 249 HE1 TRP 33 HE1 TRP 33 11.864 1.598 5.233 250 HE3 TRP 33 HE3 TRP 33 8.563 4.639 2.413 251 HZ2 TRP 33 HZ2 TRP 33 11.036 0.350 2.881 252 HZ3 TRP 33 HZ3 TRP 33 8.407 2.910 0.709 253 HH2 TRP 33 HH2 TRP 33 9.657 0.818 0.934 254 H GLN 34 HN GLN 34 7.780 7.552 4.666 255 HA GLN 34 HA GLN 34 5.035 6.649 5.182 256 1HB GLN 34 HB2 GLN 34 5.956 9.001 5.937 257 2HB GLN 34 HB1 GLN 34 5.750 9.399 4.232 258 1HG GLN 34 HG2 GLN 34 3.501 8.267 5.872 259 2HG GLN 34 HG1 GLN 34 3.838 9.996 5.806 260 1HE2 GLN 34 1HE2 GLN 34 1.495 8.479 4.896 261 2HE2 GLN 34 2HE2 GLN 34 1.313 8.854 3.221 262 H ALA 35 HN ALA 35 4.167 5.694 3.503 263 HA ALA 35 HA ALA 35 4.934 6.572 0.811 264 1HB ALA 35 HB2 ALA 35 3.599 4.009 1.693 265 2HB ALA 35 HB3 ALA 35 5.307 4.198 1.300 266 3HB ALA 35 HB1 ALA 35 4.083 4.415 0.050 267 H THR 36 HN THR 36 3.473 7.669 -0.339 268 HA THR 36 HA THR 36 0.739 7.884 0.710 269 HB THR 36 HB THR 36 2.018 9.584 -1.446 270 HG1 THR 36 HG1 THR 36 2.814 9.447 1.026 271 1HG2 THR 36 2HG2 THR 36 -0.443 9.682 -1.258 272 2HG2 THR 36 1HG2 THR 36 -0.283 10.135 0.440 273 3HG2 THR 36 3HG2 THR 36 0.319 11.210 -0.823 274 H ILE 37 HN ILE 37 -0.714 6.629 -0.210 275 HA ILE 37 HA ILE 37 -0.446 5.930 -3.062 276 HB ILE 37 HB ILE 37 -1.164 4.189 -0.728 277 1HG1 ILE 37 2HG1 ILE 37 0.786 3.912 -3.024 278 2HG1 ILE 37 1HG1 ILE 37 1.201 4.485 -1.411 279 1HG2 ILE 37 1HG2 ILE 37 -2.861 3.876 -2.500 280 2HG2 ILE 37 3HG2 ILE 37 -1.563 3.496 -3.632 281 3HG2 ILE 37 2HG2 ILE 37 -1.857 2.450 -2.247 282 1HD1 ILE 37 3HD1 ILE 37 -0.024 1.805 -1.855 283 2HD1 ILE 37 2HD1 ILE 37 1.713 2.079 -1.982 284 3HD1 ILE 37 1HD1 ILE 37 0.876 2.395 -0.464 285 H MET 38 HN MET 38 -2.265 6.153 -4.315 286 HA MET 38 HA MET 38 -4.439 7.461 -2.839 287 1HB MET 38 HB2 MET 38 -2.947 8.395 -5.255 288 2HB MET 38 HB1 MET 38 -4.460 9.103 -4.704 289 1HG MET 38 HG2 MET 38 -3.532 10.088 -2.941 290 2HG MET 38 HG1 MET 38 -2.421 8.747 -2.656 291 1HE MET 38 HE1 MET 38 -3.077 12.172 -4.312 292 2HE MET 38 HE3 MET 38 -1.746 12.356 -5.448 293 3HE MET 38 HE2 MET 38 -3.029 11.196 -5.779 294 H GLY 39 HN GLY 39 -6.432 7.614 -3.611 295 1HA GLY 39 HA1 GLY 39 -8.284 7.340 -4.876 296 2HA GLY 39 HA2 GLY 39 -7.627 5.741 -5.167 297 HA PRO 40 HA PRO 40 -7.181 9.602 -8.757 298 1HB PRO 40 HB2 PRO 40 -4.322 8.807 -8.340 299 2HB PRO 40 HB1 PRO 40 -4.982 10.308 -9.006 300 1HG PRO 40 HG2 PRO 40 -4.288 9.906 -6.339 301 2HG PRO 40 HG1 PRO 40 -5.347 11.189 -6.939 302 1HD PRO 40 HD2 PRO 40 -6.112 9.086 -5.211 303 2HD PRO 40 HD1 PRO 40 -7.202 10.168 -6.090 304 H ASN 41 HN ASN 41 -7.181 9.059 -10.868 305 HA ASN 41 HA ASN 41 -7.770 7.679 -12.559 306 1HB ASN 41 HB2 ASN 41 -6.140 5.599 -11.083 307 2HB ASN 41 HB1 ASN 41 -6.966 5.289 -12.603 308 1HD2 ASN 41 1HD2 ASN 41 -4.461 7.114 -11.039 309 2HD2 ASN 41 2HD2 ASN 41 -3.529 7.444 -12.464 310 H ASP 42 HN ASP 42 -9.226 5.693 -12.881 311 HA ASP 42 HA ASP 42 -11.414 6.167 -11.203 312 1HB ASP 42 HB2 ASP 42 -10.961 4.058 -13.315 313 2HB ASP 42 HB1 ASP 42 -12.477 4.220 -12.438 314 H SER 43 HN SER 43 -10.648 5.783 -9.175 315 HA SER 43 HA SER 43 -10.755 2.970 -8.344 316 1HB SER 43 HB2 SER 43 -8.713 4.111 -7.552 317 2HB SER 43 HB1 SER 43 -9.685 5.437 -6.920 318 HG SER 43 HG SER 43 -9.361 2.833 -5.920 319 HA PRO 44 HA PRO 44 -14.682 3.973 -6.287 320 1HB PRO 44 HB2 PRO 44 -13.566 2.147 -4.208 321 2HB PRO 44 HB1 PRO 44 -15.154 2.120 -4.988 322 1HG PRO 44 HG2 PRO 44 -13.334 0.334 -5.679 323 2HG PRO 44 HG1 PRO 44 -14.319 1.118 -6.931 324 1HD PRO 44 HD2 PRO 44 -11.490 1.702 -6.108 325 2HD PRO 44 HD1 PRO 44 -12.187 1.580 -7.740 326 H TYR 45 HN TYR 45 -11.475 3.967 -4.920 327 HA TYR 45 HA TYR 45 -12.179 5.899 -2.849 328 1HB TYR 45 HB2 TYR 45 -9.448 4.778 -3.477 329 2HB TYR 45 HB1 TYR 45 -9.959 5.512 -1.982 330 HD1 TYR 45 HD1 TYR 45 -12.708 3.657 -2.287 331 HD2 TYR 45 HD2 TYR 45 -8.505 3.013 -2.062 332 HE1 TYR 45 HE1 TYR 45 -13.103 1.381 -1.444 333 HE2 TYR 45 HE2 TYR 45 -8.894 0.742 -1.218 334 HH TYR 45 HH TYR 45 -10.747 -0.488 0.000 335 H GLN 46 HN GLN 46 -12.165 6.486 -5.833 336 HA GLN 46 HA GLN 46 -9.877 7.768 -6.692 337 1HB GLN 46 HB2 GLN 46 -12.287 7.358 -7.821 338 2HB GLN 46 HB1 GLN 46 -12.428 9.075 -7.466 339 1HG GLN 46 HG2 GLN 46 -10.201 7.812 -9.035 340 2HG GLN 46 HG1 GLN 46 -11.606 8.586 -9.746 341 1HE2 GLN 46 1HE2 GLN 46 -8.735 9.078 -9.903 342 2HE2 GLN 46 2HE2 GLN 46 -8.536 10.737 -9.477 343 H GLY 47 HN GLY 47 -8.818 9.498 -6.121 344 1HA GLY 47 HA1 GLY 47 -10.148 11.690 -4.724 345 2HA GLY 47 HA2 GLY 47 -8.511 11.706 -5.360 346 H GLY 48 HN GLY 48 -8.799 8.842 -3.834 347 1HA GLY 48 HA1 GLY 48 -8.677 8.122 -1.636 348 2HA GLY 48 HA2 GLY 48 -8.621 9.759 -1.094 349 H VAL 49 HN VAL 49 -6.707 10.718 -0.835 350 HA VAL 49 HA VAL 49 -4.211 9.426 -1.455 351 HB VAL 49 HB VAL 49 -4.885 11.800 0.281 352 1HG1 VAL 49 1HG1 VAL 49 -2.807 10.731 1.026 353 2HG1 VAL 49 3HG1 VAL 49 -2.158 10.884 -0.605 354 3HG1 VAL 49 2HG1 VAL 49 -2.522 12.325 0.336 355 1HG2 VAL 49 2HG2 VAL 49 -5.206 11.915 -2.264 356 2HG2 VAL 49 1HG2 VAL 49 -4.275 13.195 -1.482 357 3HG2 VAL 49 3HG2 VAL 49 -3.443 11.906 -2.340 358 H PHE 50 HN PHE 50 -3.980 7.497 -0.431 359 HA PHE 50 HA PHE 50 -4.546 7.382 2.419 360 1HB PHE 50 HB2 PHE 50 -3.943 5.273 0.376 361 2HB PHE 50 HB1 PHE 50 -4.053 4.916 2.101 362 HD1 PHE 50 HD1 PHE 50 -6.212 5.391 3.276 363 HD2 PHE 50 HD2 PHE 50 -5.747 5.610 -0.952 364 HE1 PHE 50 HE1 PHE 50 -8.666 5.329 2.994 365 HE2 PHE 50 HE2 PHE 50 -8.169 5.554 -1.231 366 HZ PHE 50 HZ PHE 50 -9.606 5.440 0.725 367 H PHE 51 HN PHE 51 -3.023 5.958 3.697 368 HA PHE 51 HA PHE 51 -0.360 7.162 3.441 369 1HB PHE 51 HB2 PHE 51 -1.838 6.969 6.058 370 2HB PHE 51 HB1 PHE 51 -0.498 8.029 5.624 371 HD1 PHE 51 HD1 PHE 51 -4.112 7.457 5.233 372 HD2 PHE 51 HD2 PHE 51 -0.866 10.151 4.617 373 HE1 PHE 51 HE1 PHE 51 -5.703 9.259 4.722 374 HE2 PHE 51 HE2 PHE 51 -2.437 11.955 4.077 375 HZ PHE 51 HZ PHE 51 -4.888 11.479 4.109 376 H LEU 52 HN LEU 52 1.207 5.681 3.714 377 HA LEU 52 HA LEU 52 0.597 3.294 5.305 378 1HB LEU 52 HB2 LEU 52 1.932 3.237 2.585 379 2HB LEU 52 HB1 LEU 52 1.656 1.855 3.626 380 HG LEU 52 HG LEU 52 -0.871 2.525 3.377 381 1HD1 LEU 52 1HD1 LEU 52 -0.461 4.618 2.176 382 2HD1 LEU 52 3HD1 LEU 52 0.315 3.718 0.876 383 3HD1 LEU 52 2HD1 LEU 52 -1.398 3.486 1.208 384 1HD2 LEU 52 1HD2 LEU 52 0.745 1.187 1.221 385 2HD2 LEU 52 3HD2 LEU 52 -0.006 0.425 2.623 386 3HD2 LEU 52 2HD2 LEU 52 -1.012 1.114 1.349 387 H THR 53 HN THR 53 2.254 2.575 6.556 388 HA THR 53 HA THR 53 4.810 4.020 6.291 389 HB THR 53 HB THR 53 4.209 2.367 8.701 390 HG1 THR 53 HG1 THR 53 2.939 4.799 7.977 391 1HG2 THR 53 3HG2 THR 53 5.614 5.000 8.249 392 2HG2 THR 53 2HG2 THR 53 5.457 4.190 9.810 393 3HG2 THR 53 1HG2 THR 53 6.373 3.430 8.507 394 H ILE 54 HN ILE 54 6.720 2.854 6.083 395 HA ILE 54 HA ILE 54 6.385 -0.061 5.823 396 HB ILE 54 HB ILE 54 8.341 1.329 4.062 397 1HG1 ILE 54 2HG1 ILE 54 5.362 1.549 3.845 398 2HG1 ILE 54 1HG1 ILE 54 6.605 2.749 3.494 399 1HG2 ILE 54 2HG2 ILE 54 6.552 -1.079 3.761 400 2HG2 ILE 54 1HG2 ILE 54 7.660 -0.493 2.521 401 3HG2 ILE 54 3HG2 ILE 54 8.291 -1.074 4.061 402 1HD1 ILE 54 1HD1 ILE 54 7.175 1.548 1.445 403 2HD1 ILE 54 3HD1 ILE 54 5.927 0.358 1.790 404 3HD1 ILE 54 2HD1 ILE 54 5.480 2.030 1.465 405 H HIS 55 HN HIS 55 7.975 -1.295 6.652 406 HA HIS 55 HA HIS 55 10.342 0.044 7.712 407 1HB HIS 55 HB2 HIS 55 10.144 -1.327 9.800 408 2HB HIS 55 HB1 HIS 55 8.999 -0.006 9.608 409 HD1 HIS 55 HD1 HIS 55 6.786 -0.628 10.362 410 HD2 HIS 55 HD2 HIS 55 8.774 -3.781 8.572 411 HE1 HIS 55 HE1 HIS 55 5.181 -2.516 10.381 412 HE2 HIS 55 HE2 HIS 55 6.502 -4.511 9.603 413 H PHE 56 HN PHE 56 12.193 -1.264 8.033 414 HA PHE 56 HA PHE 56 11.969 -4.059 7.181 415 1HB PHE 56 HB2 PHE 56 13.608 -3.937 5.557 416 2HB PHE 56 HB1 PHE 56 12.742 -2.443 5.288 417 HD1 PHE 56 HD1 PHE 56 15.849 -3.970 6.339 418 HD2 PHE 56 HD2 PHE 56 13.766 -0.297 5.929 419 HE1 PHE 56 HE1 PHE 56 17.967 -2.767 6.552 420 HE2 PHE 56 HE2 PHE 56 15.888 0.935 6.139 421 HZ PHE 56 HZ PHE 56 17.957 -0.260 6.533 422 HA PRO 57 HA PRO 57 15.527 -4.369 9.957 423 1HB PRO 57 HB2 PRO 57 15.107 -6.902 10.777 424 2HB PRO 57 HB1 PRO 57 14.165 -5.550 11.413 425 1HG PRO 57 HG2 PRO 57 13.324 -7.714 9.628 426 2HG PRO 57 HG1 PRO 57 12.325 -6.596 10.568 427 1HD PRO 57 HD2 PRO 57 13.102 -6.465 7.750 428 2HD PRO 57 HD1 PRO 57 11.872 -5.521 8.619 429 H THR 58 HN THR 58 17.043 -4.293 8.236 430 HA THR 58 HA THR 58 18.396 -5.029 6.525 431 HB THR 58 HB THR 58 19.909 -6.909 7.427 432 HG1 THR 58 HG1 THR 58 18.189 -7.563 8.977 433 1HG2 THR 58 1HG2 THR 58 19.533 -4.329 8.951 434 2HG2 THR 58 3HG2 THR 58 20.987 -5.328 8.964 435 3HG2 THR 58 2HG2 THR 58 20.473 -4.538 7.471 436 H ASP 59 HN ASP 59 16.670 -5.774 5.056 437 HA ASP 59 HA ASP 59 16.264 -8.670 5.025 438 1HB ASP 59 HB2 ASP 59 14.827 -6.428 3.628 439 2HB ASP 59 HB1 ASP 59 14.448 -8.136 3.417 440 H TYR 60 HN TYR 60 18.120 -6.388 3.334 441 HA TYR 60 HA TYR 60 18.005 -7.386 0.707 442 1HB TYR 60 HB2 TYR 60 19.004 -5.285 0.880 443 2HB TYR 60 HB1 TYR 60 19.983 -5.746 2.272 444 HD1 TYR 60 HD1 TYR 60 19.815 -5.492 -1.332 445 HD2 TYR 60 HD2 TYR 60 22.066 -7.089 1.909 446 HE1 TYR 60 HE1 TYR 60 21.739 -5.816 -2.831 447 HE2 TYR 60 HE2 TYR 60 23.990 -7.419 0.415 448 HH TYR 60 HH TYR 60 24.155 -6.074 -2.713 449 HA PRO 61 HA PRO 61 19.638 -7.759 -0.998 450 1HB PRO 61 HB2 PRO 61 20.014 -9.740 -2.753 451 2HB PRO 61 HB1 PRO 61 21.360 -8.994 -1.882 452 1HG PRO 61 HG2 PRO 61 19.953 -11.577 -1.349 453 2HG PRO 61 HG1 PRO 61 21.688 -11.214 -1.299 454 1HD PRO 61 HD2 PRO 61 20.063 -11.334 0.914 455 2HD PRO 61 HD1 PRO 61 21.572 -10.408 0.831 456 H PHE 62 HN PHE 62 17.610 -10.075 0.368 457 HA PHE 62 HA PHE 62 15.755 -10.210 -1.844 458 1HB PHE 62 HB2 PHE 62 15.808 -11.970 -0.090 459 2HB PHE 62 HB1 PHE 62 15.279 -10.803 1.106 460 HD1 PHE 62 HD1 PHE 62 14.248 -13.408 -0.854 461 HD2 PHE 62 HD2 PHE 62 13.016 -9.477 0.256 462 HE1 PHE 62 HE1 PHE 62 11.920 -13.999 -1.378 463 HE2 PHE 62 HE2 PHE 62 10.681 -10.086 -0.265 464 HZ PHE 62 HZ PHE 62 10.132 -12.333 -1.080 465 H LYS 63 HN LYS 63 14.808 -9.017 1.336 466 HA LYS 63 HA LYS 63 13.939 -7.071 2.022 467 1HB LYS 63 HB2 LYS 63 15.467 -5.785 0.798 468 2HB LYS 63 HB1 LYS 63 14.687 -6.155 -0.728 469 1HG LYS 63 HG2 LYS 63 14.248 -3.879 -0.040 470 2HG LYS 63 HG1 LYS 63 12.766 -4.846 -0.091 471 1HD LYS 63 HD2 LYS 63 13.273 -5.194 2.450 472 2HD LYS 63 HD1 LYS 63 14.239 -3.727 2.252 473 1HE LYS 63 HE2 LYS 63 11.307 -4.088 1.699 474 2HE LYS 63 HE1 LYS 63 12.046 -3.070 2.934 475 1HZ LYS 63 HZ1 LYS 63 12.366 -2.663 -0.004 476 2HZ LYS 63 HZ3 LYS 63 11.279 -1.819 0.978 477 3HZ LYS 63 HZ2 LYS 63 12.936 -1.655 1.229 478 HA PRO 64 HA PRO 64 9.773 -7.771 0.493 479 1HB PRO 64 HB2 PRO 64 8.828 -8.796 2.861 480 2HB PRO 64 HB1 PRO 64 9.420 -9.776 1.520 481 1HG PRO 64 HG2 PRO 64 10.598 -9.388 4.126 482 2HG PRO 64 HG1 PRO 64 11.113 -10.477 2.830 483 1HD PRO 64 HD2 PRO 64 12.190 -7.859 3.591 484 2HD PRO 64 HD1 PRO 64 12.903 -9.118 2.563 485 HA PRO 65 HA PRO 65 9.453 -3.777 2.698 486 1HB PRO 65 HB2 PRO 65 7.440 -3.236 0.625 487 2HB PRO 65 HB1 PRO 65 8.901 -2.330 1.027 488 1HG PRO 65 HG2 PRO 65 8.677 -3.780 -1.239 489 2HG PRO 65 HG1 PRO 65 10.222 -3.592 -0.388 490 1HD PRO 65 HD2 PRO 65 8.328 -5.905 -0.403 491 2HD PRO 65 HD1 PRO 65 10.103 -5.902 -0.414 492 H LYS 66 HN LYS 66 8.376 -4.607 4.537 493 HA LYS 66 HA LYS 66 5.616 -5.297 4.413 494 1HB LYS 66 HB2 LYS 66 7.442 -5.708 6.331 495 2HB LYS 66 HB1 LYS 66 6.698 -4.244 6.983 496 1HG LYS 66 HG2 LYS 66 5.597 -6.139 7.918 497 2HG LYS 66 HG1 LYS 66 4.487 -5.378 6.769 498 1HD LYS 66 HD2 LYS 66 5.124 -7.030 5.072 499 2HD LYS 66 HD1 LYS 66 6.221 -7.790 6.223 500 1HE LYS 66 HE2 LYS 66 3.257 -7.491 6.645 501 2HE LYS 66 HE1 LYS 66 4.011 -8.937 5.971 502 1HZ LYS 66 HZ3 LYS 66 5.284 -9.175 8.022 503 2HZ LYS 66 HZ2 LYS 66 4.533 -7.807 8.668 504 3HZ LYS 66 HZ1 LYS 66 3.620 -9.187 8.333 505 H VAL 67 HN VAL 67 4.390 -3.857 3.522 506 HA VAL 67 HA VAL 67 4.579 -1.061 4.382 507 HB VAL 67 HB VAL 67 4.946 -1.200 2.031 508 1HG1 VAL 67 3HG1 VAL 67 4.075 -3.486 1.728 509 2HG1 VAL 67 2HG1 VAL 67 2.434 -2.837 1.770 510 3HG1 VAL 67 1HG1 VAL 67 3.536 -2.366 0.474 511 1HG2 VAL 67 2HG2 VAL 67 2.085 -0.415 2.537 512 2HG2 VAL 67 1HG2 VAL 67 3.503 0.627 2.643 513 3HG2 VAL 67 3HG2 VAL 67 2.996 -0.022 1.080 514 H ALA 68 HN ALA 68 2.907 -0.154 5.433 515 HA ALA 68 HA ALA 68 0.450 -1.724 5.628 516 1HB ALA 68 HB2 ALA 68 1.913 -2.476 7.432 517 2HB ALA 68 HB3 ALA 68 0.502 -1.629 8.069 518 3HB ALA 68 HB1 ALA 68 2.062 -0.815 8.009 519 H PHE 69 HN PHE 69 -1.357 -0.627 5.857 520 HA PHE 69 HA PHE 69 -1.500 2.108 5.421 521 1HB PHE 69 HB2 PHE 69 -3.474 0.035 6.187 522 2HB PHE 69 HB1 PHE 69 -3.943 1.734 6.260 523 HD1 PHE 69 HD1 PHE 69 -4.268 3.019 4.263 524 HD2 PHE 69 HD2 PHE 69 -2.886 -1.002 4.064 525 HE1 PHE 69 HE1 PHE 69 -4.716 2.980 1.843 526 HE2 PHE 69 HE2 PHE 69 -3.320 -1.039 1.646 527 HZ PHE 69 HZ PHE 69 -4.269 0.999 0.547 528 H THR 70 HN THR 70 -1.710 3.850 6.618 529 HA THR 70 HA THR 70 -1.494 3.663 9.519 530 HB THR 70 HB THR 70 -1.671 6.172 7.845 531 HG1 THR 70 HG1 THR 70 0.629 4.586 8.474 532 1HG2 THR 70 1HG2 THR 70 -1.872 6.408 10.287 533 2HG2 THR 70 3HG2 THR 70 -0.316 5.602 10.486 534 3HG2 THR 70 2HG2 THR 70 -0.404 7.162 9.665 535 H THR 71 HN THR 71 -3.773 4.517 7.019 536 HA THR 71 HA THR 71 -5.559 5.782 8.953 537 HB THR 71 HB THR 71 -4.951 6.980 6.822 538 HG1 THR 71 HG1 THR 71 -6.850 7.931 6.937 539 1HG2 THR 71 1HG2 THR 71 -4.971 5.076 5.300 540 2HG2 THR 71 3HG2 THR 71 -6.709 4.897 5.552 541 3HG2 THR 71 2HG2 THR 71 -6.075 6.344 4.773 542 H ARG 72 HN ARG 72 -7.965 5.464 7.723 543 HA ARG 72 HA ARG 72 -8.500 2.658 8.189 544 1HB ARG 72 HB2 ARG 72 -10.958 3.596 8.050 545 2HB ARG 72 HB1 ARG 72 -9.993 3.762 9.500 546 1HG ARG 72 HG2 ARG 72 -9.944 5.975 7.524 547 2HG ARG 72 HG1 ARG 72 -11.357 5.781 8.561 548 1HD ARG 72 HD2 ARG 72 -8.512 6.346 9.343 549 2HD ARG 72 HD1 ARG 72 -9.969 7.244 9.756 550 HE ARG 72 HE ARG 72 -10.562 5.302 11.191 551 1HH1 ARG 72 1HH1 ARG 72 -7.207 5.973 10.390 552 2HH1 ARG 72 2HH1 ARG 72 -6.573 4.977 11.663 553 1HH2 ARG 72 1HH2 ARG 72 -9.714 4.031 12.907 554 2HH2 ARG 72 2HH2 ARG 72 -7.995 3.894 13.104 555 H ILE 73 HN ILE 73 -9.264 1.336 6.669 556 HA ILE 73 HA ILE 73 -10.060 2.253 4.051 557 HB ILE 73 HB ILE 73 -7.876 2.483 3.446 558 1HG1 ILE 73 2HG1 ILE 73 -6.899 0.366 2.473 559 2HG1 ILE 73 1HG1 ILE 73 -8.268 -0.506 3.149 560 1HG2 ILE 73 2HG2 ILE 73 -6.967 2.053 5.652 561 2HG2 ILE 73 1HG2 ILE 73 -7.112 0.315 5.396 562 3HG2 ILE 73 3HG2 ILE 73 -5.983 1.259 4.425 563 1HD1 ILE 73 1HD1 ILE 73 -9.741 1.042 1.808 564 2HD1 ILE 73 3HD1 ILE 73 -8.270 1.608 1.005 565 3HD1 ILE 73 2HD1 ILE 73 -8.750 -0.086 0.880 566 H TYR 74 HN TYR 74 -11.748 0.873 3.667 567 HA TYR 74 HA TYR 74 -11.906 -1.743 4.706 568 1HB TYR 74 HB2 TYR 74 -13.452 -0.128 2.814 569 2HB TYR 74 HB1 TYR 74 -13.397 -1.835 2.372 570 HD1 TYR 74 HD1 TYR 74 -14.361 0.540 5.080 571 HD2 TYR 74 HD2 TYR 74 -14.558 -3.467 3.622 572 HE1 TYR 74 HE1 TYR 74 -16.046 -0.028 6.791 573 HE2 TYR 74 HE2 TYR 74 -16.219 -4.037 5.312 574 HH TYR 74 HH TYR 74 -17.821 -1.667 7.174 575 H HIS 75 HN HIS 75 -10.927 -3.390 4.281 576 HA HIS 75 HA HIS 75 -8.458 -2.934 2.911 577 1HB HIS 75 HB2 HIS 75 -9.353 -5.240 4.621 578 2HB HIS 75 HB1 HIS 75 -7.701 -4.769 4.283 579 HD1 HIS 75 HD1 HIS 75 -6.701 -2.879 5.744 580 HD2 HIS 75 HD2 HIS 75 -10.691 -3.638 6.555 581 HE1 HIS 75 HE1 HIS 75 -7.178 -1.701 7.904 582 HE2 HIS 75 HE2 HIS 75 -9.632 -2.088 8.326 583 HA PRO 76 HA PRO 76 -10.027 -5.446 -0.692 584 1HB PRO 76 HB2 PRO 76 -7.174 -4.892 -1.362 585 2HB PRO 76 HB1 PRO 76 -8.606 -4.801 -2.388 586 1HG PRO 76 HG2 PRO 76 -7.441 -2.598 -1.403 587 2HG PRO 76 HG1 PRO 76 -9.194 -2.712 -1.623 588 1HD PRO 76 HD2 PRO 76 -7.611 -2.740 0.866 589 2HD PRO 76 HD1 PRO 76 -9.296 -2.273 0.604 590 H ASN 77 HN ASN 77 -7.095 -5.647 1.136 591 HA ASN 77 HA ASN 77 -7.211 -8.347 1.760 592 1HB ASN 77 HB2 ASN 77 -5.222 -9.149 0.410 593 2HB ASN 77 HB1 ASN 77 -6.683 -8.897 -0.532 594 1HD2 ASN 77 1HD2 ASN 77 -5.794 -8.475 -2.522 595 2HD2 ASN 77 2HD2 ASN 77 -4.715 -7.145 -2.804 596 H ILE 78 HN ILE 78 -6.902 -5.831 2.807 597 HA ILE 78 HA ILE 78 -4.223 -5.888 3.959 598 HB ILE 78 HB ILE 78 -6.277 -3.663 3.812 599 1HG1 ILE 78 2HG1 ILE 78 -4.167 -2.469 2.993 600 2HG1 ILE 78 1HG1 ILE 78 -3.515 -4.087 2.849 601 1HG2 ILE 78 3HG2 ILE 78 -5.334 -3.710 6.086 602 2HG2 ILE 78 2HG2 ILE 78 -3.714 -3.622 5.389 603 3HG2 ILE 78 1HG2 ILE 78 -4.844 -2.280 5.171 604 1HD1 ILE 78 2HD1 ILE 78 -5.307 -4.670 1.284 605 2HD1 ILE 78 1HD1 ILE 78 -5.923 -3.025 1.419 606 3HD1 ILE 78 3HD1 ILE 78 -4.337 -3.311 0.713 607 H ASN 79 HN ASN 79 -4.199 -5.494 6.301 608 HA ASN 79 HA ASN 79 -6.443 -6.869 7.593 609 1HB ASN 79 HB2 ASN 79 -4.931 -8.238 8.738 610 2HB ASN 79 HB1 ASN 79 -4.205 -8.086 7.139 611 1HD2 ASN 79 1HD2 ASN 79 -2.377 -6.855 6.911 612 2HD2 ASN 79 2HD2 ASN 79 -1.430 -6.345 8.264 613 H SER 80 HN SER 80 -6.180 -6.554 10.086 614 HA SER 80 HA SER 80 -6.952 -4.096 10.807 615 1HB SER 80 HB2 SER 80 -5.232 -5.859 12.551 616 2HB SER 80 HB1 SER 80 -6.448 -4.695 13.084 617 HG SER 80 HG SER 80 -6.817 -7.240 12.516 618 H ASN 81 HN ASN 81 -3.483 -5.055 10.658 619 HA ASN 81 HA ASN 81 -2.840 -2.235 11.226 620 1HB ASN 81 HB2 ASN 81 -0.517 -3.049 11.680 621 2HB ASN 81 HB1 ASN 81 -1.736 -3.637 12.801 622 1HD2 ASN 81 1HD2 ASN 81 0.484 -4.460 10.275 623 2HD2 ASN 81 2HD2 ASN 81 0.387 -6.178 10.480 624 H GLY 82 HN GLY 82 -3.760 -2.720 8.732 625 1HA GLY 82 HA1 GLY 82 -2.051 -1.194 7.246 626 2HA GLY 82 HA2 GLY 82 -3.378 -2.120 6.571 627 H SER 83 HN SER 83 -1.539 -4.556 7.648 628 HA SER 83 HA SER 83 0.561 -4.407 5.671 629 1HB SER 83 HB2 SER 83 0.827 -5.677 7.812 630 2HB SER 83 HB1 SER 83 -0.358 -6.834 7.207 631 HG SER 83 HG SER 83 1.086 -7.192 5.421 632 H ILE 84 HN ILE 84 0.309 -4.804 3.654 633 HA ILE 84 HA ILE 84 -2.266 -5.652 2.683 634 HB ILE 84 HB ILE 84 0.091 -4.597 1.137 635 1HG1 ILE 84 2HG1 ILE 84 -2.209 -3.062 2.346 636 2HG1 ILE 84 1HG1 ILE 84 -0.577 -3.090 2.994 637 1HG2 ILE 84 3HG2 ILE 84 -2.855 -4.703 0.502 638 2HG2 ILE 84 2HG2 ILE 84 -1.650 -3.850 -0.457 639 3HG2 ILE 84 1HG2 ILE 84 -1.566 -5.602 -0.298 640 1HD1 ILE 84 2HD1 ILE 84 -1.342 -2.096 0.275 641 2HD1 ILE 84 1HD1 ILE 84 -1.046 -1.090 1.694 642 3HD1 ILE 84 3HD1 ILE 84 0.258 -2.052 1.011 643 H CYS 85 HN CYS 85 -2.634 -7.255 1.136 644 HA CYS 85 HA CYS 85 -0.548 -9.253 0.786 645 1HB CYS 85 HB2 CYS 85 -2.958 -9.887 1.214 646 2HB CYS 85 HB1 CYS 85 -3.345 -9.196 -0.358 647 HG CYS 85 HG CYS 85 -2.898 -12.204 0.069 648 H LEU 86 HN LEU 86 0.933 -8.236 -0.487 649 HA LEU 86 HA LEU 86 0.064 -7.526 -3.215 650 1HB LEU 86 HB2 LEU 86 0.916 -5.609 -1.873 651 2HB LEU 86 HB1 LEU 86 2.456 -6.435 -1.743 652 HG LEU 86 HG LEU 86 2.857 -6.218 -4.112 653 1HD1 LEU 86 2HD1 LEU 86 0.500 -6.483 -4.853 654 2HD1 LEU 86 1HD1 LEU 86 0.190 -4.831 -4.320 655 3HD1 LEU 86 3HD1 LEU 86 1.338 -5.135 -5.623 656 1HD2 LEU 86 3HD2 LEU 86 1.870 -3.680 -2.842 657 2HD2 LEU 86 2HD2 LEU 86 3.511 -4.327 -2.800 658 3HD2 LEU 86 1HD2 LEU 86 2.831 -3.745 -4.319 659 H ASP 87 HN ASP 87 0.676 -8.904 -4.685 660 HA ASP 87 HA ASP 87 2.072 -11.238 -4.113 661 1HB ASP 87 HB2 ASP 87 0.473 -10.490 -6.109 662 2HB ASP 87 HB1 ASP 87 2.016 -10.260 -6.925 663 H ILE 88 HN ILE 88 3.305 -8.316 -5.743 664 HA ILE 88 HA ILE 88 5.829 -9.462 -6.304 665 HB ILE 88 HB ILE 88 6.587 -7.036 -6.486 666 1HG1 ILE 88 2HG1 ILE 88 3.769 -6.771 -5.670 667 2HG1 ILE 88 1HG1 ILE 88 5.129 -5.681 -5.420 668 1HG2 ILE 88 1HG2 ILE 88 6.092 -8.499 -8.382 669 2HG2 ILE 88 3HG2 ILE 88 4.401 -7.992 -8.318 670 3HG2 ILE 88 2HG2 ILE 88 5.669 -6.815 -8.687 671 1HD1 ILE 88 3HD1 ILE 88 4.959 -5.119 -7.866 672 2HD1 ILE 88 2HD1 ILE 88 3.399 -5.946 -7.845 673 3HD1 ILE 88 1HD1 ILE 88 3.656 -4.527 -6.824 674 H LEU 89 HN LEU 89 4.597 -8.681 -3.355 675 HA LEU 89 HA LEU 89 7.309 -8.150 -2.336 676 1HB LEU 89 HB2 LEU 89 4.728 -7.616 -0.882 677 2HB LEU 89 HB1 LEU 89 6.339 -7.108 -0.414 678 HG LEU 89 HG LEU 89 4.634 -6.042 -2.648 679 1HD1 LEU 89 1HD1 LEU 89 5.931 -4.768 -0.249 680 2HD1 LEU 89 3HD1 LEU 89 4.994 -3.920 -1.478 681 3HD1 LEU 89 2HD1 LEU 89 4.216 -5.123 -0.450 682 1HD2 LEU 89 1HD2 LEU 89 7.558 -5.501 -2.153 683 2HD2 LEU 89 3HD2 LEU 89 6.851 -6.272 -3.575 684 3HD2 LEU 89 2HD2 LEU 89 6.517 -4.575 -3.231 685 H ARG 90 HN ARG 90 4.515 -10.178 -2.231 686 HA ARG 90 HA ARG 90 5.712 -11.705 -0.013 687 1HB ARG 90 HB2 ARG 90 3.476 -12.622 0.391 688 2HB ARG 90 HB1 ARG 90 3.494 -10.869 0.489 689 1HG ARG 90 HG2 ARG 90 2.458 -10.694 -1.681 690 2HG ARG 90 HG1 ARG 90 2.562 -12.443 -1.906 691 1HD ARG 90 HD2 ARG 90 1.003 -11.066 0.288 692 2HD ARG 90 HD1 ARG 90 0.304 -11.685 -1.211 693 HE ARG 90 HE ARG 90 1.509 -13.876 -0.286 694 1HH1 ARG 90 1HH1 ARG 90 -0.574 -11.589 1.368 695 2HH1 ARG 90 2HH1 ARG 90 -1.153 -12.754 2.508 696 1HH2 ARG 90 1HH2 ARG 90 0.770 -15.398 1.233 697 2HH2 ARG 90 2HH2 ARG 90 -0.381 -14.923 2.442 698 H SER 91 HN SER 91 4.986 -11.890 -3.359 699 HA SER 91 HA SER 91 5.509 -14.771 -3.277 700 1HB SER 91 HB2 SER 91 3.174 -14.382 -3.863 701 2HB SER 91 HB1 SER 91 3.674 -13.332 -5.189 702 HG SER 91 HG SER 91 3.194 -15.457 -5.900 703 H GLN 92 HN GLN 92 5.752 -11.871 -5.333 704 HA GLN 92 HA GLN 92 7.474 -13.401 -7.142 705 1HB GLN 92 HB2 GLN 92 6.118 -10.748 -7.606 706 2HB GLN 92 HB1 GLN 92 6.945 -11.725 -8.808 707 1HG GLN 92 HG2 GLN 92 5.251 -13.525 -8.307 708 2HG GLN 92 HG1 GLN 92 4.389 -12.294 -7.384 709 1HE2 GLN 92 1HE2 GLN 92 3.339 -10.643 -8.460 710 2HE2 GLN 92 2HE2 GLN 92 3.114 -10.625 -10.171 711 H TRP 93 HN TRP 93 8.019 -11.345 -4.612 712 HA TRP 93 HA TRP 93 9.620 -9.387 -5.806 713 1HB TRP 93 HB2 TRP 93 8.909 -9.063 -3.540 714 2HB TRP 93 HB1 TRP 93 9.837 -10.446 -2.998 715 HD1 TRP 93 HD1 TRP 93 12.586 -10.075 -3.044 716 HE1 TRP 93 HE1 TRP 93 13.989 -7.916 -2.820 717 HE3 TRP 93 HE3 TRP 93 8.948 -6.612 -4.034 718 HZ2 TRP 93 HZ2 TRP 93 13.611 -5.159 -3.041 719 HZ3 TRP 93 HZ3 TRP 93 9.570 -4.232 -4.003 720 HH2 TRP 93 HH2 TRP 93 11.853 -3.517 -3.508 721 H SER 94 HN SER 94 11.217 -9.707 -7.009 722 HA SER 94 HA SER 94 13.351 -11.486 -6.140 723 1HB SER 94 HB2 SER 94 12.835 -10.261 -8.858 724 2HB SER 94 HB1 SER 94 14.096 -11.408 -8.456 725 HG SER 94 HG SER 94 11.430 -12.096 -7.935 726 HA PRO 95 HA PRO 95 15.855 -7.812 -5.469 727 1HB PRO 95 HB2 PRO 95 18.185 -8.453 -6.796 728 2HB PRO 95 HB1 PRO 95 17.774 -9.018 -5.173 729 1HG PRO 95 HG2 PRO 95 17.502 -10.421 -7.796 730 2HG PRO 95 HG1 PRO 95 18.053 -11.059 -6.237 731 1HD PRO 95 HD2 PRO 95 15.573 -11.529 -7.156 732 2HD PRO 95 HD1 PRO 95 15.895 -11.289 -5.428 733 H ALA 96 HN ALA 96 14.206 -6.838 -6.998 734 HA ALA 96 HA ALA 96 15.446 -5.470 -9.144 735 1HB ALA 96 HB1 ALA 96 13.550 -7.669 -9.938 736 2HB ALA 96 HB3 ALA 96 14.167 -6.420 -11.018 737 3HB ALA 96 HB2 ALA 96 15.275 -7.580 -10.292 738 H LEU 97 HN LEU 97 12.496 -6.338 -7.433 739 HA LEU 97 HA LEU 97 10.858 -4.357 -8.704 740 1HB LEU 97 HB2 LEU 97 10.541 -5.915 -6.155 741 2HB LEU 97 HB1 LEU 97 9.411 -4.663 -6.624 742 HG LEU 97 HG LEU 97 8.354 -6.599 -7.320 743 1HD1 LEU 97 3HD1 LEU 97 8.661 -4.876 -9.134 744 2HD1 LEU 97 2HD1 LEU 97 9.919 -5.913 -9.797 745 3HD1 LEU 97 1HD1 LEU 97 8.266 -6.505 -9.678 746 1HD2 LEU 97 2HD2 LEU 97 10.401 -8.026 -6.916 747 2HD2 LEU 97 1HD2 LEU 97 9.394 -8.515 -8.284 748 3HD2 LEU 97 3HD2 LEU 97 10.900 -7.640 -8.562 749 H THR 98 HN THR 98 10.088 -2.377 -7.731 750 HA THR 98 HA THR 98 11.599 -1.449 -5.387 751 HB THR 98 HB THR 98 11.535 0.867 -6.410 752 HG1 THR 98 HG1 THR 98 11.419 0.818 -8.781 753 1HG2 THR 98 2HG2 THR 98 13.199 -1.259 -7.761 754 2HG2 THR 98 1HG2 THR 98 13.501 0.474 -7.887 755 3HG2 THR 98 3HG2 THR 98 13.625 -0.330 -6.324 756 H ILE 99 HN ILE 99 10.403 -0.040 -4.020 757 HA ILE 99 HA ILE 99 7.590 -0.356 -3.961 758 HB ILE 99 HB ILE 99 7.991 2.028 -2.625 759 1HG1 ILE 99 2HG1 ILE 99 10.261 0.246 -1.857 760 2HG1 ILE 99 1HG1 ILE 99 10.449 1.499 -3.107 761 1HG2 ILE 99 1HG2 ILE 99 8.055 -0.814 -1.608 762 2HG2 ILE 99 3HG2 ILE 99 7.893 0.613 -0.581 763 3HG2 ILE 99 2HG2 ILE 99 6.644 0.233 -1.765 764 1HD1 ILE 99 1HD1 ILE 99 9.386 1.987 -0.387 765 2HD1 ILE 99 3HD1 ILE 99 11.079 2.149 -0.815 766 3HD1 ILE 99 2HD1 ILE 99 9.860 3.158 -1.584 767 H SER 100 HN SER 100 9.647 1.745 -5.608 768 HA SER 100 HA SER 100 7.946 3.842 -6.264 769 1HB SER 100 HB2 SER 100 10.344 3.844 -6.754 770 2HB SER 100 HB1 SER 100 10.127 2.498 -7.875 771 HG SER 100 HG SER 100 10.206 4.849 -8.644 772 H LYS 101 HN LYS 101 8.310 0.594 -7.590 773 HA LYS 101 HA LYS 101 6.019 0.916 -9.323 774 1HB LYS 101 HB2 LYS 101 6.615 -1.074 -10.315 775 2HB LYS 101 HB1 LYS 101 8.170 -0.544 -9.702 776 1HG LYS 101 HG2 LYS 101 8.112 -2.794 -9.186 777 2HG LYS 101 HG1 LYS 101 7.657 -2.011 -7.672 778 1HD LYS 101 HD2 LYS 101 5.977 -3.493 -7.705 779 2HD LYS 101 HD1 LYS 101 5.238 -2.318 -8.792 780 1HE LYS 101 HE2 LYS 101 6.755 -4.810 -9.562 781 2HE LYS 101 HE1 LYS 101 5.027 -4.541 -9.715 782 1HZ LYS 101 HZ1 LYS 101 7.125 -3.045 -11.184 783 2HZ LYS 101 HZ3 LYS 101 6.164 -4.278 -11.825 784 3HZ LYS 101 HZ2 LYS 101 5.461 -2.820 -11.342 785 H VAL 102 HN VAL 102 6.646 -0.600 -6.158 786 HA VAL 102 HA VAL 102 4.259 -2.173 -6.335 787 HB VAL 102 HB VAL 102 4.816 -3.221 -4.426 788 1HG1 VAL 102 2HG1 VAL 102 7.341 -2.101 -5.520 789 2HG1 VAL 102 1HG1 VAL 102 7.342 -3.256 -4.189 790 3HG1 VAL 102 3HG1 VAL 102 6.624 -3.700 -5.737 791 1HG2 VAL 102 1HG2 VAL 102 5.688 -0.589 -3.397 792 2HG2 VAL 102 3HG2 VAL 102 4.644 -1.805 -2.667 793 3HG2 VAL 102 2HG2 VAL 102 6.391 -2.037 -2.678 794 H LEU 103 HN LEU 103 4.988 0.953 -4.911 795 HA LEU 103 HA LEU 103 2.622 1.096 -3.347 796 1HB LEU 103 HB2 LEU 103 4.272 3.303 -4.587 797 2HB LEU 103 HB1 LEU 103 2.962 3.574 -3.458 798 HG LEU 103 HG LEU 103 5.601 2.219 -2.902 799 1HD1 LEU 103 1HD1 LEU 103 4.352 4.783 -1.936 800 2HD1 LEU 103 3HD1 LEU 103 5.848 4.093 -1.311 801 3HD1 LEU 103 2HD1 LEU 103 5.752 4.611 -2.993 802 1HD2 LEU 103 1HD2 LEU 103 3.765 1.080 -1.693 803 2HD2 LEU 103 3HD2 LEU 103 4.869 1.925 -0.612 804 3HD2 LEU 103 2HD2 LEU 103 3.296 2.629 -0.983 805 H LEU 104 HN LEU 104 3.424 1.653 -6.663 806 HA LEU 104 HA LEU 104 0.991 2.853 -7.475 807 1HB LEU 104 HB2 LEU 104 3.127 1.363 -8.954 808 2HB LEU 104 HB1 LEU 104 1.685 1.959 -9.755 809 HG LEU 104 HG LEU 104 3.662 3.673 -8.262 810 1HD1 LEU 104 3HD1 LEU 104 3.222 3.234 -11.206 811 2HD1 LEU 104 2HD1 LEU 104 4.259 4.480 -10.515 812 3HD1 LEU 104 1HD1 LEU 104 4.646 2.777 -10.278 813 1HD2 LEU 104 2HD2 LEU 104 1.250 4.363 -9.924 814 2HD2 LEU 104 1HD2 LEU 104 1.464 4.620 -8.193 815 3HD2 LEU 104 3HD2 LEU 104 2.445 5.526 -9.345 816 H SER 105 HN SER 105 2.131 -0.496 -7.318 817 HA SER 105 HA SER 105 -0.261 -1.551 -8.424 818 1HB SER 105 HB2 SER 105 0.579 -3.732 -7.412 819 2HB SER 105 HB1 SER 105 1.608 -2.960 -8.617 820 HG SER 105 HG SER 105 1.971 -2.401 -5.881 821 H ILE 106 HN ILE 106 0.767 -0.762 -5.135 822 HA ILE 106 HA ILE 106 -1.482 -1.978 -3.864 823 HB ILE 106 HB ILE 106 0.227 0.340 -2.961 824 1HG1 ILE 106 2HG1 ILE 106 0.156 -2.528 -1.988 825 2HG1 ILE 106 1HG1 ILE 106 1.370 -1.859 -3.080 826 1HG2 ILE 106 1HG2 ILE 106 -1.999 0.488 -1.985 827 2HG2 ILE 106 3HG2 ILE 106 -1.882 -1.185 -1.437 828 3HG2 ILE 106 2HG2 ILE 106 -0.811 0.044 -0.756 829 1HD1 ILE 106 3HD1 ILE 106 0.861 -0.872 -0.275 830 2HD1 ILE 106 2HD1 ILE 106 2.130 -2.005 -0.739 831 3HD1 ILE 106 1HD1 ILE 106 2.153 -0.356 -1.362 832 H CYS 107 HN CYS 107 -0.740 1.258 -5.050 833 HA CYS 107 HA CYS 107 -3.206 2.474 -4.654 834 1HB CYS 107 HB2 CYS 107 -1.507 3.857 -5.483 835 2HB CYS 107 HB1 CYS 107 -1.114 2.750 -6.798 836 HG CYS 107 HG CYS 107 -3.932 4.702 -6.601 837 H SER 108 HN SER 108 -2.161 0.120 -7.073 838 HA SER 108 HA SER 108 -4.530 0.395 -8.652 839 1HB SER 108 HB2 SER 108 -2.525 -1.858 -8.596 840 2HB SER 108 HB1 SER 108 -3.763 -1.598 -9.822 841 HG SER 108 HG SER 108 -2.330 0.642 -9.531 842 H LEU 109 HN LEU 109 -3.773 -1.210 -5.712 843 HA LEU 109 HA LEU 109 -5.825 -3.235 -6.103 844 1HB LEU 109 HB2 LEU 109 -4.224 -2.664 -3.586 845 2HB LEU 109 HB1 LEU 109 -5.137 -4.119 -3.941 846 HG LEU 109 HG LEU 109 -2.640 -3.234 -5.391 847 1HD1 LEU 109 2HD1 LEU 109 -3.066 -5.360 -3.309 848 2HD1 LEU 109 1HD1 LEU 109 -1.627 -5.220 -4.313 849 3HD1 LEU 109 3HD1 LEU 109 -2.039 -3.929 -3.188 850 1HD2 LEU 109 1HD2 LEU 109 -4.228 -4.508 -6.786 851 2HD2 LEU 109 3HD2 LEU 109 -2.715 -5.365 -6.497 852 3HD2 LEU 109 2HD2 LEU 109 -4.164 -5.814 -5.607 853 H LEU 110 HN LEU 110 -5.160 -0.297 -4.397 854 HA LEU 110 HA LEU 110 -7.712 -0.009 -3.190 855 1HB LEU 110 HB2 LEU 110 -5.342 1.682 -3.705 856 2HB LEU 110 HB1 LEU 110 -6.855 2.580 -3.536 857 HG LEU 110 HG LEU 110 -7.169 1.642 -1.338 858 1HD1 LEU 110 1HD1 LEU 110 -6.195 -0.602 -1.837 859 2HD1 LEU 110 3HD1 LEU 110 -4.595 0.124 -1.681 860 3HD1 LEU 110 2HD1 LEU 110 -5.686 0.085 -0.298 861 1HD2 LEU 110 3HD2 LEU 110 -5.732 3.612 -1.572 862 2HD2 LEU 110 2HD2 LEU 110 -5.285 2.621 -0.186 863 3HD2 LEU 110 1HD2 LEU 110 -4.325 2.552 -1.664 864 H CYS 111 HN CYS 111 -6.411 0.422 -6.353 865 HA CYS 111 HA CYS 111 -8.653 2.030 -7.165 866 1HB CYS 111 HB2 CYS 111 -6.439 2.694 -7.883 867 2HB CYS 111 HB1 CYS 111 -6.212 1.133 -8.665 868 HG CYS 111 HG CYS 111 -8.927 2.381 -9.947 869 H ASP 112 HN ASP 112 -7.136 -0.950 -8.640 870 HA ASP 112 HA ASP 112 -9.697 -1.096 -10.072 871 1HB ASP 112 HB2 ASP 112 -7.983 -0.604 -11.592 872 2HB ASP 112 HB1 ASP 112 -6.951 -1.884 -11.004 873 HA PRO 113 HA PRO 113 -9.541 -5.362 -8.234 874 1HB PRO 113 HB2 PRO 113 -7.777 -7.094 -9.087 875 2HB PRO 113 HB1 PRO 113 -8.673 -6.153 -10.291 876 1HG PRO 113 HG2 PRO 113 -5.832 -5.910 -9.452 877 2HG PRO 113 HG1 PRO 113 -6.591 -5.451 -10.987 878 1HD PRO 113 HD2 PRO 113 -6.111 -3.806 -8.601 879 2HD PRO 113 HD1 PRO 113 -6.578 -3.310 -10.236 880 H ASN 114 HN ASN 114 -8.144 -7.416 -7.227 881 HA ASN 114 HA ASN 114 -5.770 -6.683 -5.825 882 1HB ASN 114 HB2 ASN 114 -6.516 -7.300 -3.658 883 2HB ASN 114 HB1 ASN 114 -7.765 -6.234 -4.281 884 1HD2 ASN 114 1HD2 ASN 114 -7.625 -8.621 -2.310 885 2HD2 ASN 114 2HD2 ASN 114 -8.993 -9.566 -2.773 886 HA PRO 115 HA PRO 115 -4.700 -10.861 -7.026 887 1HB PRO 115 HB2 PRO 115 -3.822 -11.386 -4.236 888 2HB PRO 115 HB1 PRO 115 -2.936 -11.585 -5.754 889 1HG PRO 115 HG2 PRO 115 -2.385 -9.548 -4.152 890 2HG PRO 115 HG1 PRO 115 -2.440 -9.314 -5.908 891 1HD PRO 115 HD2 PRO 115 -4.478 -8.582 -3.844 892 2HD PRO 115 HD1 PRO 115 -3.949 -7.675 -5.273 893 H ASP 116 HN ASP 116 -7.161 -10.253 -4.936 894 HA ASP 116 HA ASP 116 -8.849 -11.403 -3.962 895 1HB ASP 116 HB2 ASP 116 -9.027 -12.054 -6.400 896 2HB ASP 116 HB1 ASP 116 -8.257 -13.578 -5.969 897 H ASP 117 HN ASP 117 -7.488 -11.578 -2.115 898 HA ASP 117 HA ASP 117 -6.798 -14.357 -1.485 899 1HB ASP 117 HB2 ASP 117 -4.745 -13.117 -2.037 900 2HB ASP 117 HB1 ASP 117 -5.163 -11.898 -0.832 901 HA PRO 118 HA PRO 118 -9.398 -13.364 2.049 902 1HB PRO 118 HB2 PRO 118 -8.414 -15.966 3.014 903 2HB PRO 118 HB1 PRO 118 -10.071 -15.432 2.720 904 1HG PRO 118 HG2 PRO 118 -8.855 -17.204 1.120 905 2HG PRO 118 HG1 PRO 118 -10.002 -16.007 0.490 906 1HD PRO 118 HD2 PRO 118 -7.011 -16.009 0.391 907 2HD PRO 118 HD1 PRO 118 -8.183 -15.516 -0.848 908 H LEU 119 HN LEU 119 -7.412 -11.823 2.327 909 HA LEU 119 HA LEU 119 -5.351 -12.638 4.127 910 1HB LEU 119 HB2 LEU 119 -5.388 -10.737 2.350 911 2HB LEU 119 HB1 LEU 119 -6.128 -9.781 3.615 912 HG LEU 119 HG LEU 119 -3.658 -9.465 3.341 913 1HD1 LEU 119 1HD1 LEU 119 -4.588 -10.470 6.023 914 2HD1 LEU 119 3HD1 LEU 119 -3.163 -9.472 5.727 915 3HD1 LEU 119 2HD1 LEU 119 -4.773 -8.831 5.394 916 1HD2 LEU 119 2HD2 LEU 119 -3.058 -11.787 2.874 917 2HD2 LEU 119 1HD2 LEU 119 -2.152 -11.148 4.245 918 3HD2 LEU 119 3HD2 LEU 119 -3.511 -12.235 4.516 919 H VAL 120 HN VAL 120 -8.129 -10.365 4.528 920 HA VAL 120 HA VAL 120 -8.173 -10.998 7.393 921 HB VAL 120 HB VAL 120 -9.828 -9.087 5.704 922 1HG1 VAL 120 2HG1 VAL 120 -11.344 -10.284 7.215 923 2HG1 VAL 120 1HG1 VAL 120 -10.374 -9.761 8.592 924 3HG1 VAL 120 3HG1 VAL 120 -11.211 -8.572 7.592 925 1HG2 VAL 120 1HG2 VAL 120 -7.547 -8.460 6.735 926 2HG2 VAL 120 3HG2 VAL 120 -8.902 -7.394 7.093 927 3HG2 VAL 120 2HG2 VAL 120 -8.367 -8.566 8.298 928 HA PRO 121 HA PRO 121 -11.046 -14.417 7.163 929 1HB PRO 121 HB2 PRO 121 -12.661 -12.568 8.862 930 2HB PRO 121 HB1 PRO 121 -12.298 -14.274 9.105 931 1HG PRO 121 HG2 PRO 121 -11.007 -12.166 10.360 932 2HG PRO 121 HG1 PRO 121 -10.388 -13.809 10.225 933 1HD PRO 121 HD2 PRO 121 -9.329 -11.457 9.027 934 2HD PRO 121 HD1 PRO 121 -8.774 -13.126 8.799 935 H GLU 122 HN GLU 122 -12.814 -11.289 7.440 936 HA GLU 122 HA GLU 122 -14.398 -12.116 5.148 937 1HB GLU 122 HB2 GLU 122 -15.070 -10.243 7.359 938 2HB GLU 122 HB1 GLU 122 -16.039 -10.432 5.893 939 1HG GLU 122 HG2 GLU 122 -15.197 -12.910 7.219 940 2HG GLU 122 HG1 GLU 122 -16.326 -11.910 8.125 941 H ILE 123 HN ILE 123 -12.485 -9.322 6.103 942 HA ILE 123 HA ILE 123 -13.890 -7.500 4.456 943 HB ILE 123 HB ILE 123 -11.027 -7.251 5.376 944 1HG1 ILE 123 2HG1 ILE 123 -13.404 -6.045 6.732 945 2HG1 ILE 123 1HG1 ILE 123 -12.883 -7.681 7.132 946 1HG2 ILE 123 1HG2 ILE 123 -13.020 -5.162 4.568 947 2HG2 ILE 123 3HG2 ILE 123 -11.426 -4.874 5.255 948 3HG2 ILE 123 2HG2 ILE 123 -11.572 -5.641 3.674 949 1HD1 ILE 123 2HD1 ILE 123 -10.652 -6.806 7.603 950 2HD1 ILE 123 1HD1 ILE 123 -11.257 -5.178 7.327 951 3HD1 ILE 123 3HD1 ILE 123 -11.894 -6.137 8.664 952 H ALA 124 HN ALA 124 -11.327 -9.717 3.830 953 HA ALA 124 HA ALA 124 -10.545 -8.954 1.271 954 1HB ALA 124 HB2 ALA 124 -11.035 -11.766 2.242 955 2HB ALA 124 HB3 ALA 124 -9.565 -10.830 2.504 956 3HB ALA 124 HB1 ALA 124 -10.033 -11.293 0.870 957 H ARG 125 HN ARG 125 -13.648 -10.127 2.304 958 HA ARG 125 HA ARG 125 -14.509 -10.929 -0.353 959 1HB ARG 125 HB2 ARG 125 -16.558 -11.561 0.608 960 2HB ARG 125 HB1 ARG 125 -15.401 -11.899 1.886 961 1HG ARG 125 HG2 ARG 125 -16.258 -10.335 3.256 962 2HG ARG 125 HG1 ARG 125 -16.581 -9.190 1.960 963 1HD ARG 125 HD2 ARG 125 -18.633 -9.898 2.975 964 2HD ARG 125 HD1 ARG 125 -18.540 -10.456 1.310 965 HE ARG 125 HE ARG 125 -17.787 -12.341 3.427 966 1HH1 ARG 125 1HH1 ARG 125 -20.167 -11.186 1.108 967 2HH1 ARG 125 2HH1 ARG 125 -21.083 -12.667 1.122 968 1HH2 ARG 125 1HH2 ARG 125 -19.002 -14.283 3.455 969 2HH2 ARG 125 2HH2 ARG 125 -20.415 -14.433 2.460 970 H ILE 126 HN ILE 126 -15.084 -8.333 1.941 971 HA ILE 126 HA ILE 126 -17.225 -7.132 0.607 972 HB ILE 126 HB ILE 126 -16.708 -5.117 1.965 973 1HG1 ILE 126 2HG1 ILE 126 -14.948 -5.476 3.771 974 2HG1 ILE 126 1HG1 ILE 126 -14.287 -6.745 2.739 975 1HG2 ILE 126 3HG2 ILE 126 -18.076 -6.967 2.822 976 2HG2 ILE 126 2HG2 ILE 126 -16.628 -7.712 3.492 977 3HG2 ILE 126 1HG2 ILE 126 -17.179 -6.156 4.105 978 1HD1 ILE 126 1HD1 ILE 126 -14.637 -3.886 1.835 979 2HD1 ILE 126 3HD1 ILE 126 -13.157 -4.513 2.562 980 3HD1 ILE 126 2HD1 ILE 126 -13.738 -5.175 1.036 981 H TYR 127 HN TYR 127 -13.966 -7.206 -0.134 982 HA TYR 127 HA TYR 127 -13.980 -4.789 -1.619 983 1HB TYR 127 HB2 TYR 127 -11.880 -5.619 -0.719 984 2HB TYR 127 HB1 TYR 127 -12.009 -7.062 -1.722 985 HD1 TYR 127 HD1 TYR 127 -11.258 -7.042 -3.968 986 HD2 TYR 127 HD2 TYR 127 -11.671 -3.377 -1.851 987 HE1 TYR 127 HE1 TYR 127 -10.166 -5.854 -5.821 988 HE2 TYR 127 HE2 TYR 127 -10.575 -2.180 -3.698 989 HH TYR 127 HH TYR 127 -8.946 -2.778 -5.553 990 H LYS 128 HN LYS 128 -13.751 -8.202 -2.632 991 HA LYS 128 HA LYS 128 -14.552 -7.323 -5.316 992 1HB LYS 128 HB2 LYS 128 -13.512 -9.182 -6.231 993 2HB LYS 128 HB1 LYS 128 -12.445 -8.720 -4.918 994 1HG LYS 128 HG2 LYS 128 -14.504 -10.890 -4.721 995 2HG LYS 128 HG1 LYS 128 -12.833 -11.166 -5.201 996 1HD LYS 128 HD2 LYS 128 -12.488 -9.789 -2.874 997 2HD LYS 128 HD1 LYS 128 -13.984 -10.669 -2.530 998 1HE LYS 128 HE2 LYS 128 -11.313 -11.782 -3.344 999 2HE LYS 128 HE1 LYS 128 -12.180 -12.050 -1.835 1000 1HZ LYS 128 HZ3 LYS 128 -13.866 -13.271 -3.082 1001 2HZ LYS 128 HZ2 LYS 128 -13.008 -13.009 -4.521 1002 3HZ LYS 128 HZ1 LYS 128 -12.332 -13.953 -3.302 1003 H THR 129 HN THR 129 -16.322 -7.937 -2.881 1004 HA THR 129 HA THR 129 -18.131 -9.750 -4.263 1005 HB THR 129 HB THR 129 -17.309 -10.012 -1.385 1006 HG1 THR 129 HG1 THR 129 -16.774 -11.462 -3.751 1007 1HG2 THR 129 2HG2 THR 129 -19.716 -10.502 -1.712 1008 2HG2 THR 129 1HG2 THR 129 -19.291 -11.681 -2.952 1009 3HG2 THR 129 3HG2 THR 129 -18.797 -11.945 -1.283 1010 H ASP 130 HN ASP 130 -18.266 -8.336 -0.995 1011 HA ASP 130 HA ASP 130 -20.854 -7.224 -1.599 1012 1HB ASP 130 HB2 ASP 130 -19.124 -6.929 0.872 1013 2HB ASP 130 HB1 ASP 130 -20.750 -6.289 0.701 1014 H ARG 131 HN ARG 131 -19.947 -6.066 -3.395 1015 HA ARG 131 HA ARG 131 -18.037 -4.285 -3.664 1016 1HB ARG 131 HB2 ARG 131 -19.648 -4.812 -5.401 1017 2HB ARG 131 HB1 ARG 131 -20.894 -3.906 -4.560 1018 1HG ARG 131 HG2 ARG 131 -19.727 -1.840 -4.962 1019 2HG ARG 131 HG1 ARG 131 -18.379 -2.713 -5.690 1020 1HD ARG 131 HD2 ARG 131 -21.192 -2.799 -6.757 1021 2HD ARG 131 HD1 ARG 131 -19.977 -1.649 -7.308 1022 HE ARG 131 HE ARG 131 -19.553 -4.558 -7.513 1023 1HH1 ARG 131 1HH1 ARG 131 -19.697 -1.382 -9.007 1024 2HH1 ARG 131 2HH1 ARG 131 -19.007 -1.921 -10.505 1025 1HH2 ARG 131 1HH2 ARG 131 -18.657 -5.253 -9.496 1026 2HH2 ARG 131 2HH2 ARG 131 -18.428 -4.108 -10.783 1027 H GLU 132 HN GLU 132 -21.163 -3.372 -2.204 1028 HA GLU 132 HA GLU 132 -20.621 -0.620 -1.989 1029 1HB GLU 132 HB2 GLU 132 -22.394 -0.699 -0.192 1030 2HB GLU 132 HB1 GLU 132 -22.872 -1.299 -1.776 1031 1HG GLU 132 HG2 GLU 132 -21.790 -3.261 0.141 1032 2HG GLU 132 HG1 GLU 132 -23.354 -2.575 0.505 1033 H LYS 133 HN LYS 133 -20.047 -3.267 0.167 1034 HA LYS 133 HA LYS 133 -19.543 -2.072 2.579 1035 1HB LYS 133 HB2 LYS 133 -18.337 -4.492 1.280 1036 2HB LYS 133 HB1 LYS 133 -17.989 -4.028 2.951 1037 1HG LYS 133 HG2 LYS 133 -20.732 -4.581 1.843 1038 2HG LYS 133 HG1 LYS 133 -19.754 -5.743 2.736 1039 1HD LYS 133 HD2 LYS 133 -19.801 -4.294 4.697 1040 2HD LYS 133 HD1 LYS 133 -20.729 -3.089 3.803 1041 1HE LYS 133 HE2 LYS 133 -22.535 -4.723 3.499 1042 2HE LYS 133 HE1 LYS 133 -21.617 -5.903 4.432 1043 1HZ LYS 133 HZ2 LYS 133 -22.549 -3.283 5.479 1044 2HZ LYS 133 HZ1 LYS 133 -23.334 -4.757 5.738 1045 3HZ LYS 133 HZ3 LYS 133 -21.781 -4.504 6.360 1046 H TYR 134 HN TYR 134 -17.249 -2.581 -0.070 1047 HA TYR 134 HA TYR 134 -15.190 -1.258 1.398 1048 1HB TYR 134 HB2 TYR 134 -13.840 -2.413 0.056 1049 2HB TYR 134 HB1 TYR 134 -15.273 -3.323 -0.287 1050 HD1 TYR 134 HD1 TYR 134 -12.997 -0.760 -1.615 1051 HD2 TYR 134 HD2 TYR 134 -16.207 -3.408 -2.472 1052 HE1 TYR 134 HE1 TYR 134 -12.765 -0.255 -4.006 1053 HE2 TYR 134 HE2 TYR 134 -15.975 -2.918 -4.867 1054 HH TYR 134 HH TYR 134 -15.101 -1.055 -6.281 1055 H ASN 135 HN ASN 135 -17.150 -0.619 -1.470 1056 HA ASN 135 HA ASN 135 -15.890 1.658 -2.382 1057 1HB ASN 135 HB2 ASN 135 -18.732 0.724 -2.486 1058 2HB ASN 135 HB1 ASN 135 -18.273 2.270 -3.170 1059 1HD2 ASN 135 1HD2 ASN 135 -17.841 -1.179 -3.345 1060 2HD2 ASN 135 2HD2 ASN 135 -17.224 -1.190 -4.985 1061 H ARG 136 HN ARG 136 -18.815 1.600 -0.342 1062 HA ARG 136 HA ARG 136 -19.056 4.404 -0.402 1063 1HB ARG 136 HB2 ARG 136 -20.980 2.989 0.045 1064 2HB ARG 136 HB1 ARG 136 -20.243 2.414 1.535 1065 1HG ARG 136 HG2 ARG 136 -20.260 4.781 2.363 1066 2HG ARG 136 HG1 ARG 136 -21.218 5.190 0.934 1067 1HD ARG 136 HD2 ARG 136 -22.912 3.530 1.621 1068 2HD ARG 136 HD1 ARG 136 -21.981 3.217 3.084 1069 HE ARG 136 HE ARG 136 -22.521 5.974 2.890 1070 1HH1 ARG 136 1HH1 ARG 136 -24.142 2.938 3.549 1071 2HH1 ARG 136 2HH1 ARG 136 -25.385 3.668 4.514 1072 1HH2 ARG 136 1HH2 ARG 136 -24.158 6.935 4.164 1073 2HH2 ARG 136 2HH2 ARG 136 -25.390 5.936 4.872 1074 H ILE 137 HN ILE 137 -17.290 2.305 1.724 1075 HA ILE 137 HA ILE 137 -17.413 4.234 3.892 1076 HB ILE 137 HB ILE 137 -15.903 1.661 4.101 1077 1HG1 ILE 137 2HG1 ILE 137 -18.010 0.943 3.111 1078 2HG1 ILE 137 1HG1 ILE 137 -18.001 0.520 4.818 1079 1HG2 ILE 137 3HG2 ILE 137 -15.841 3.285 5.928 1080 2HG2 ILE 137 2HG2 ILE 137 -17.601 3.262 6.024 1081 3HG2 ILE 137 1HG2 ILE 137 -16.678 1.816 6.429 1082 1HD1 ILE 137 3HD1 ILE 137 -19.408 2.897 3.627 1083 2HD1 ILE 137 2HD1 ILE 137 -20.166 1.371 4.083 1084 3HD1 ILE 137 1HD1 ILE 137 -19.439 2.398 5.319 1085 H ALA 138 HN ALA 138 -14.978 2.355 2.109 1086 HA ALA 138 HA ALA 138 -12.778 3.796 3.040 1087 1HB ALA 138 HB1 ALA 138 -11.569 2.765 1.212 1088 2HB ALA 138 HB3 ALA 138 -12.616 1.600 2.025 1089 3HB ALA 138 HB2 ALA 138 -13.097 2.277 0.465 1090 H ARG 139 HN ARG 139 -14.989 4.368 0.325 1091 HA ARG 139 HA ARG 139 -13.507 6.601 -0.680 1092 1HB ARG 139 HB2 ARG 139 -15.074 5.505 -2.160 1093 2HB ARG 139 HB1 ARG 139 -16.410 5.806 -1.055 1094 1HG ARG 139 HG2 ARG 139 -16.197 8.204 -1.436 1095 2HG ARG 139 HG1 ARG 139 -14.839 7.918 -2.525 1096 1HD ARG 139 HD2 ARG 139 -16.272 6.730 -4.063 1097 2HD ARG 139 HD1 ARG 139 -17.629 6.849 -2.941 1098 HE ARG 139 HE ARG 139 -17.063 9.419 -3.296 1099 1HH1 ARG 139 1HH1 ARG 139 -17.314 6.842 -5.657 1100 2HH1 ARG 139 2HH1 ARG 139 -17.863 7.889 -6.927 1101 1HH2 ARG 139 1HH2 ARG 139 -17.789 10.804 -4.958 1102 2HH2 ARG 139 2HH2 ARG 139 -18.124 10.150 -6.533 1103 H GLU 140 HN GLU 140 -16.164 6.226 1.698 1104 HA GLU 140 HA GLU 140 -16.534 8.957 2.157 1105 1HB GLU 140 HB2 GLU 140 -17.991 8.186 3.682 1106 2HB GLU 140 HB1 GLU 140 -17.586 6.600 3.094 1107 1HG GLU 140 HG2 GLU 140 -16.165 6.145 4.856 1108 2HG GLU 140 HG1 GLU 140 -16.017 7.838 5.313 1109 H TRP 141 HN TRP 141 -14.252 6.586 3.370 1110 HA TRP 141 HA TRP 141 -12.899 8.297 5.131 1111 1HB TRP 141 HB2 TRP 141 -12.005 5.806 3.689 1112 2HB TRP 141 HB1 TRP 141 -11.025 6.646 4.897 1113 HD1 TRP 141 HD1 TRP 141 -13.729 7.367 6.690 1114 HE1 TRP 141 HE1 TRP 141 -14.662 5.514 8.207 1115 HE3 TRP 141 HE3 TRP 141 -11.578 3.323 4.443 1116 HZ2 TRP 141 HZ2 TRP 141 -14.507 2.705 8.403 1117 HZ3 TRP 141 HZ3 TRP 141 -12.030 1.096 5.371 1118 HH2 TRP 141 HH2 TRP 141 -13.457 0.796 7.314 1119 H THR 142 HN THR 142 -12.485 7.678 1.657 1120 HA THR 142 HA THR 142 -10.150 9.227 1.480 1121 HB THR 142 HB THR 142 -10.499 9.452 -0.879 1122 HG1 THR 142 HG1 THR 142 -12.415 9.612 -1.722 1123 1HG2 THR 142 3HG2 THR 142 -11.553 6.805 0.092 1124 2HG2 THR 142 2HG2 THR 142 -10.996 7.133 -1.546 1125 3HG2 THR 142 1HG2 THR 142 -9.868 7.235 -0.195 1126 H GLN 143 HN GLN 143 -13.550 10.073 1.280 1127 HA GLN 143 HA GLN 143 -13.292 12.762 0.520 1128 1HB GLN 143 HB2 GLN 143 -15.405 11.296 2.081 1129 2HB GLN 143 HB1 GLN 143 -15.615 12.936 1.482 1130 1HG GLN 143 HG2 GLN 143 -15.234 12.086 -0.798 1131 2HG GLN 143 HG1 GLN 143 -15.158 10.455 -0.145 1132 1HE2 GLN 143 1HE2 GLN 143 -17.047 9.467 0.554 1133 2HE2 GLN 143 2HE2 GLN 143 -18.616 10.093 0.188 1134 H LYS 144 HN LYS 144 -12.743 11.237 3.523 1135 HA LYS 144 HA LYS 144 -13.053 13.776 4.981 1136 1HB LYS 144 HB2 LYS 144 -13.628 10.931 5.719 1137 2HB LYS 144 HB1 LYS 144 -13.451 12.181 6.947 1138 1HG LYS 144 HG2 LYS 144 -15.404 13.240 6.315 1139 2HG LYS 144 HG1 LYS 144 -15.326 12.609 4.667 1140 1HD LYS 144 HD2 LYS 144 -17.131 11.569 5.975 1141 2HD LYS 144 HD1 LYS 144 -15.914 10.403 5.437 1142 1HE LYS 144 HE2 LYS 144 -14.959 10.281 7.601 1143 2HE LYS 144 HE1 LYS 144 -15.874 11.676 8.169 1144 1HZ LYS 144 HZ2 LYS 144 -17.067 9.066 7.375 1145 2HZ LYS 144 HZ1 LYS 144 -16.775 9.558 8.969 1146 3HZ LYS 144 HZ3 LYS 144 -17.884 10.399 8.020 1147 H TYR 145 HN TYR 145 -10.856 11.304 4.125 1148 HA TYR 145 HA TYR 145 -8.929 12.233 6.135 1149 1HB TYR 145 HB2 TYR 145 -9.546 9.336 5.540 1150 2HB TYR 145 HB1 TYR 145 -8.242 9.892 6.586 1151 HD1 TYR 145 HD1 TYR 145 -8.802 10.925 8.780 1152 HD2 TYR 145 HD2 TYR 145 -11.798 9.244 6.278 1153 HE1 TYR 145 HE1 TYR 145 -10.366 10.892 10.679 1154 HE2 TYR 145 HE2 TYR 145 -13.374 9.207 8.157 1155 HH TYR 145 HH TYR 145 -13.388 9.237 10.556 1156 H ALA 146 HN ALA 146 -9.407 12.097 2.967 1157 HA ALA 146 HA ALA 146 -6.659 11.371 2.477 1158 1HB ALA 146 HB2 ALA 146 -8.219 9.296 2.428 1159 2HB ALA 146 HB1 ALA 146 -8.654 9.907 0.832 1160 3HB ALA 146 HB3 ALA 146 -6.974 9.502 1.190 1161 H MET 147 HN MET 147 -9.248 13.323 1.659 1162 HA MET 147 HA MET 147 -8.346 13.546 -1.132 1163 1HB MET 147 HB2 MET 147 -10.931 14.432 0.155 1164 2HB MET 147 HB1 MET 147 -10.465 14.848 -1.492 1165 1HG MET 147 HG2 MET 147 -10.352 12.450 -2.029 1166 2HG MET 147 HG1 MET 147 -10.916 12.088 -0.400 1167 1HE MET 147 HE3 MET 147 -11.763 13.580 -3.878 1168 2HE MET 147 HE2 MET 147 -13.410 14.181 -3.663 1169 3HE MET 147 HE1 MET 147 -12.061 14.992 -2.861 No H/Q in entry = 1169 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 22.266 -4.176 4.825 2 H2 MET 1 HT3 MET 1 23.519 -3.084 5.120 3 H3 MET 1 HT2 MET 1 21.926 -2.641 5.444 4 HA MET 1 HA MET 1 22.597 -1.583 3.445 5 1HB MET 1 HB2 MET 1 23.647 -4.298 2.851 6 2HB MET 1 HB1 MET 1 23.055 -3.350 1.494 7 1HG MET 1 HG2 MET 1 25.433 -3.043 1.758 8 2HG MET 1 HG1 MET 1 24.579 -1.535 2.092 9 1HE MET 1 HE3 MET 1 26.595 -4.524 3.506 10 2HE MET 1 HE2 MET 1 26.552 -4.261 5.249 11 3HE MET 1 HE1 MET 1 25.086 -4.741 4.391 12 H ALA 2 HN ALA 2 20.198 -3.206 4.611 13 HA ALA 2 HA ALA 2 18.635 -3.863 2.331 14 1HB ALA 2 HB1 ALA 2 16.774 -4.003 3.907 15 2HB ALA 2 HB2 ALA 2 17.787 -3.285 5.160 16 3HB ALA 2 HB3 ALA 2 18.187 -4.873 4.504 17 H LEU 3 HN LEU 3 19.221 -1.027 4.208 18 HA LEU 3 HA LEU 3 16.925 0.412 3.308 19 1HB LEU 3 HB2 LEU 3 18.144 2.366 4.330 20 2HB LEU 3 HB1 LEU 3 17.773 1.037 5.403 21 HG LEU 3 HG LEU 3 20.225 0.290 4.849 22 1HD1 LEU 3 1HD1 LEU 3 20.650 1.999 3.168 23 2HD1 LEU 3 3HD1 LEU 3 20.345 3.263 4.359 24 3HD1 LEU 3 2HD1 LEU 3 21.731 2.189 4.548 25 1HD2 LEU 3 1HD2 LEU 3 19.496 2.551 6.706 26 2HD2 LEU 3 3HD2 LEU 3 19.466 0.825 7.072 27 3HD2 LEU 3 2HD2 LEU 3 21.003 1.637 6.783 28 H LYS 4 HN LYS 4 20.259 0.124 2.371 29 HA LYS 4 HA LYS 4 20.146 2.266 0.478 30 1HB LYS 4 HB2 LYS 4 22.355 1.656 -0.106 31 2HB LYS 4 HB1 LYS 4 22.202 1.513 1.635 32 1HG LYS 4 HG2 LYS 4 22.610 -0.673 1.622 33 2HG LYS 4 HG1 LYS 4 21.613 -0.943 0.195 34 1HD LYS 4 HD2 LYS 4 24.373 0.274 0.096 35 2HD LYS 4 HD1 LYS 4 24.066 -1.452 -0.093 36 1HE LYS 4 HE2 LYS 4 22.775 0.652 -1.815 37 2HE LYS 4 HE1 LYS 4 24.298 -0.133 -2.235 38 1HZ LYS 4 HZ2 LYS 4 23.115 -2.268 -2.166 39 2HZ LYS 4 HZ1 LYS 4 21.668 -1.455 -1.858 40 3HZ LYS 4 HZ3 LYS 4 22.473 -1.222 -3.325 41 H ARG 5 HN ARG 5 19.211 -0.935 0.513 42 HA ARG 5 HA ARG 5 19.120 -1.275 -2.359 43 1HB ARG 5 HB2 ARG 5 19.110 -3.329 -1.298 44 2HB ARG 5 HB1 ARG 5 18.066 -2.774 0.007 45 1HG ARG 5 HG2 ARG 5 16.705 -4.181 -1.273 46 2HG ARG 5 HG1 ARG 5 16.263 -2.540 -1.755 47 1HD ARG 5 HD2 ARG 5 17.971 -2.845 -3.637 48 2HD ARG 5 HD1 ARG 5 17.873 -4.566 -3.263 49 HE ARG 5 HE ARG 5 15.263 -3.636 -3.533 50 1HH1 ARG 5 1HH1 ARG 5 18.131 -4.081 -5.496 51 2HH1 ARG 5 2HH1 ARG 5 17.260 -4.171 -6.991 52 1HH2 ARG 5 1HH2 ARG 5 14.089 -3.794 -5.505 53 2HH2 ARG 5 2HH2 ARG 5 14.948 -4.015 -6.994 54 H ILE 6 HN ILE 6 16.968 -0.623 0.307 55 HA ILE 6 HA ILE 6 14.696 0.220 -1.013 56 HB ILE 6 HB ILE 6 15.796 1.470 1.517 57 1HG1 ILE 6 2HG1 ILE 6 14.209 -1.060 1.114 58 2HG1 ILE 6 1HG1 ILE 6 15.844 -0.921 1.772 59 1HG2 ILE 6 1HG2 ILE 6 13.057 1.235 0.298 60 2HG2 ILE 6 3HG2 ILE 6 13.289 1.537 2.020 61 3HG2 ILE 6 2HG2 ILE 6 13.908 2.681 0.838 62 1HD1 ILE 6 2HD1 ILE 6 14.833 0.461 3.620 63 2HD1 ILE 6 1HD1 ILE 6 13.263 -0.069 3.027 64 3HD1 ILE 6 3HD1 ILE 6 14.432 -1.254 3.610 65 H HIS 7 HN HIS 7 17.786 1.694 -0.758 66 HA HIS 7 HA HIS 7 17.411 4.323 -1.434 67 1HB HIS 7 HB2 HIS 7 19.439 2.297 -1.732 68 2HB HIS 7 HB1 HIS 7 19.428 3.381 -3.137 69 HD1 HIS 7 HD1 HIS 7 21.549 4.675 -2.612 70 HD2 HIS 7 HD2 HIS 7 18.818 4.701 0.519 71 HE1 HIS 7 HE1 HIS 7 22.428 6.357 -0.968 72 HE2 HIS 7 HE2 HIS 7 20.637 6.521 0.794 73 H LYS 8 HN LYS 8 17.144 1.492 -3.533 74 HA LYS 8 HA LYS 8 16.666 3.152 -5.883 75 1HB LYS 8 HB2 LYS 8 16.612 0.152 -5.632 76 2HB LYS 8 HB1 LYS 8 16.674 1.087 -7.122 77 1HG LYS 8 HG2 LYS 8 18.831 0.875 -5.025 78 2HG LYS 8 HG1 LYS 8 18.879 0.237 -6.670 79 1HD LYS 8 HD2 LYS 8 18.661 3.166 -5.968 80 2HD LYS 8 HD1 LYS 8 20.169 2.346 -6.385 81 1HE LYS 8 HE2 LYS 8 17.747 2.574 -8.174 82 2HE LYS 8 HE1 LYS 8 19.202 3.562 -8.296 83 1HZ LYS 8 HZ3 LYS 8 19.124 0.613 -8.596 84 2HZ LYS 8 HZ2 LYS 8 19.189 1.714 -9.875 85 3HZ LYS 8 HZ1 LYS 8 20.481 1.599 -8.791 86 H GLU 9 HN GLU 9 15.032 1.369 -3.525 87 HA GLU 9 HA GLU 9 12.565 1.119 -5.004 88 1HB GLU 9 HB2 GLU 9 13.124 0.707 -2.049 89 2HB GLU 9 HB1 GLU 9 11.778 0.067 -2.967 90 1HG GLU 9 HG2 GLU 9 13.243 -1.358 -4.235 91 2HG GLU 9 HG1 GLU 9 14.648 -0.670 -3.422 92 H LEU 10 HN LEU 10 13.462 2.626 -1.970 93 HA LEU 10 HA LEU 10 11.156 4.241 -1.760 94 1HB LEU 10 HB2 LEU 10 12.144 3.470 0.207 95 2HB LEU 10 HB1 LEU 10 13.737 4.010 -0.296 96 HG LEU 10 HG LEU 10 11.727 6.138 0.097 97 1HD1 LEU 10 3HD1 LEU 10 12.999 4.641 2.365 98 2HD1 LEU 10 2HD1 LEU 10 12.114 6.156 2.494 99 3HD1 LEU 10 1HD1 LEU 10 11.276 4.691 1.990 100 1HD2 LEU 10 2HD2 LEU 10 14.621 5.833 0.895 101 2HD2 LEU 10 1HD2 LEU 10 14.028 6.664 -0.543 102 3HD2 LEU 10 3HD2 LEU 10 13.650 7.297 1.058 103 H ASN 11 HN ASN 11 14.569 5.032 -2.371 104 HA ASN 11 HA ASN 11 14.079 7.826 -2.396 105 1HB ASN 11 HB2 ASN 11 16.330 6.417 -2.126 106 2HB ASN 11 HB1 ASN 11 16.400 6.720 -3.859 107 1HD2 ASN 11 1HD2 ASN 11 15.143 9.314 -3.745 108 2HD2 ASN 11 2HD2 ASN 11 16.287 10.392 -3.024 109 H ASP 12 HN ASP 12 13.662 5.339 -4.650 110 HA ASP 12 HA ASP 12 13.861 6.963 -6.979 111 1HB ASP 12 HB2 ASP 12 14.163 4.502 -7.055 112 2HB ASP 12 HB1 ASP 12 12.460 4.292 -6.647 113 H LEU 13 HN LEU 13 11.391 6.126 -4.715 114 HA LEU 13 HA LEU 13 9.179 7.282 -5.988 115 1HB LEU 13 HB2 LEU 13 9.970 6.942 -3.106 116 2HB LEU 13 HB1 LEU 13 8.526 7.844 -3.523 117 HG LEU 13 HG LEU 13 7.966 5.537 -2.886 118 1HD1 LEU 13 2HD1 LEU 13 6.587 6.622 -4.581 119 2HD1 LEU 13 1HD1 LEU 13 7.632 5.985 -5.844 120 3HD1 LEU 13 3HD1 LEU 13 6.692 4.887 -4.840 121 1HD2 LEU 13 2HD2 LEU 13 10.074 4.521 -3.501 122 2HD2 LEU 13 1HD2 LEU 13 8.686 3.664 -4.172 123 3HD2 LEU 13 3HD2 LEU 13 9.660 4.709 -5.206 124 H ALA 14 HN ALA 14 11.939 8.580 -4.339 125 HA ALA 14 HA ALA 14 10.961 11.287 -4.346 126 1HB ALA 14 HB1 ALA 14 12.321 10.537 -2.494 127 2HB ALA 14 HB2 ALA 14 13.128 11.847 -3.356 128 3HB ALA 14 HB3 ALA 14 13.653 10.180 -3.594 129 H ARG 15 HN ARG 15 13.228 9.322 -6.224 130 HA ARG 15 HA ARG 15 14.527 11.304 -7.670 131 1HB ARG 15 HB2 ARG 15 13.639 8.595 -8.663 132 2HB ARG 15 HB1 ARG 15 14.892 9.593 -9.381 133 1HG ARG 15 HG2 ARG 15 15.083 8.696 -6.538 134 2HG ARG 15 HG1 ARG 15 15.559 7.632 -7.847 135 1HD ARG 15 HD2 ARG 15 16.745 10.264 -7.020 136 2HD ARG 15 HD1 ARG 15 17.538 8.695 -7.164 137 HE ARG 15 HE ARG 15 16.545 10.127 -9.546 138 1HH1 ARG 15 1HH1 ARG 15 19.156 8.558 -7.802 139 2HH1 ARG 15 2HH1 ARG 15 20.272 8.679 -9.120 140 1HH2 ARG 15 1HH2 ARG 15 18.015 10.298 -11.265 141 2HH2 ARG 15 2HH2 ARG 15 19.626 9.676 -11.092 142 H ASP 16 HN ASP 16 11.529 9.582 -8.520 143 HA ASP 16 HA ASP 16 10.714 11.935 -10.055 144 1HB ASP 16 HB2 ASP 16 11.810 10.303 -11.628 145 2HB ASP 16 HB1 ASP 16 10.541 9.152 -11.225 146 HA PRO 17 HA PRO 17 7.117 10.356 -7.773 147 1HB PRO 17 HB2 PRO 17 6.585 12.868 -6.670 148 2HB PRO 17 HB1 PRO 17 7.488 11.569 -5.890 149 1HG PRO 17 HG2 PRO 17 8.499 14.074 -6.736 150 2HG PRO 17 HG1 PRO 17 9.430 12.695 -6.132 151 1HD PRO 17 HD2 PRO 17 8.939 13.572 -8.932 152 2HD PRO 17 HD1 PRO 17 10.338 12.725 -8.236 153 HA PRO 18 HA PRO 18 4.659 12.315 -11.059 154 1HB PRO 18 HB2 PRO 18 3.127 10.146 -11.600 155 2HB PRO 18 HB1 PRO 18 4.741 10.372 -12.270 156 1HG PRO 18 HG2 PRO 18 3.831 8.565 -10.116 157 2HG PRO 18 HG1 PRO 18 5.191 8.388 -11.235 158 1HD PRO 18 HD2 PRO 18 5.304 9.226 -8.539 159 2HD PRO 18 HD1 PRO 18 6.619 9.284 -9.727 160 H ALA 19 HN ALA 19 2.944 9.879 -9.113 161 HA ALA 19 HA ALA 19 1.497 11.629 -7.472 162 1HB ALA 19 HB1 ALA 19 -0.023 10.705 -9.917 163 2HB ALA 19 HB3 ALA 19 -0.727 11.500 -8.510 164 3HB ALA 19 HB2 ALA 19 0.411 12.371 -9.538 165 H GLN 20 HN GLN 20 -0.538 10.415 -6.630 166 HA GLN 20 HA GLN 20 -1.391 8.695 -5.458 167 1HB GLN 20 HB2 GLN 20 -1.829 6.613 -6.720 168 2HB GLN 20 HB1 GLN 20 -2.379 8.083 -7.515 169 1HG GLN 20 HG2 GLN 20 -0.139 7.940 -8.794 170 2HG GLN 20 HG1 GLN 20 -0.123 6.275 -8.225 171 1HE2 GLN 20 1HE2 GLN 20 -1.889 8.617 -10.124 172 2HE2 GLN 20 2HE2 GLN 20 -2.738 7.477 -11.102 173 H CYS 21 HN CYS 21 1.771 8.719 -5.650 174 HA CYS 21 HA CYS 21 2.172 6.630 -3.830 175 1HB CYS 21 HB2 CYS 21 1.901 5.041 -5.465 176 2HB CYS 21 HB1 CYS 21 2.626 6.031 -6.724 177 HG CYS 21 HG CYS 21 4.793 4.676 -6.679 178 H SER 22 HN SER 22 3.618 7.514 -2.657 179 HA SER 22 HA SER 22 6.203 8.134 -3.717 180 1HB SER 22 HB2 SER 22 6.175 10.493 -2.767 181 2HB SER 22 HB1 SER 22 5.282 10.240 -4.266 182 HG SER 22 HG SER 22 4.320 10.673 -1.661 183 H ALA 23 HN ALA 23 7.548 7.332 -2.326 184 HA ALA 23 HA ALA 23 7.219 7.922 0.546 185 1HB ALA 23 HB1 ALA 23 7.417 5.520 0.076 186 2HB ALA 23 HB2 ALA 23 8.855 6.104 0.912 187 3HB ALA 23 HB3 ALA 23 8.903 5.808 -0.826 188 H GLY 24 HN GLY 24 9.911 7.896 1.319 189 1HA GLY 24 HA1 GLY 24 10.979 9.984 -0.488 190 2HA GLY 24 HA2 GLY 24 12.031 8.732 0.145 191 HA PRO 25 HA PRO 25 11.615 12.608 3.026 192 1HB PRO 25 HB2 PRO 25 9.171 13.448 3.817 193 2HB PRO 25 HB1 PRO 25 9.906 13.953 2.292 194 1HG PRO 25 HG2 PRO 25 7.868 11.814 2.790 195 2HG PRO 25 HG1 PRO 25 7.899 13.048 1.517 196 1HD PRO 25 HD2 PRO 25 8.680 10.498 1.078 197 2HD PRO 25 HD1 PRO 25 9.428 11.875 0.245 198 H VAL 26 HN VAL 26 11.829 10.061 3.852 199 HA VAL 26 HA VAL 26 10.343 9.235 6.052 200 HB VAL 26 HB VAL 26 13.115 8.647 5.020 201 1HG1 VAL 26 2HG1 VAL 26 11.343 6.950 6.734 202 2HG1 VAL 26 1HG1 VAL 26 12.827 6.420 5.945 203 3HG1 VAL 26 3HG1 VAL 26 12.891 7.663 7.188 204 1HG2 VAL 26 3HG2 VAL 26 10.397 8.024 4.148 205 2HG2 VAL 26 2HG2 VAL 26 11.898 8.170 3.219 206 3HG2 VAL 26 1HG2 VAL 26 11.559 6.687 4.111 207 H GLY 27 HN GLY 27 11.551 8.763 8.183 208 1HA GLY 27 HA1 GLY 27 12.795 9.315 10.006 209 2HA GLY 27 HA2 GLY 27 12.616 11.004 9.500 210 H ASP 28 HN ASP 28 13.884 9.612 6.926 211 HA ASP 28 HA ASP 28 15.857 9.709 5.840 212 1HB ASP 28 HB2 ASP 28 16.551 11.630 7.313 213 2HB ASP 28 HB1 ASP 28 17.219 10.462 8.443 214 H ASP 29 HN ASP 29 15.233 8.078 8.728 215 HA ASP 29 HA ASP 29 17.015 5.858 8.264 216 1HB ASP 29 HB2 ASP 29 15.112 4.788 9.829 217 2HB ASP 29 HB1 ASP 29 16.405 5.801 10.488 218 H MET 30 HN MET 30 16.691 4.905 6.332 219 HA MET 30 HA MET 30 14.341 4.793 4.864 220 1HB MET 30 HB2 MET 30 16.973 3.941 4.578 221 2HB MET 30 HB1 MET 30 16.019 2.480 4.416 222 1HG MET 30 HG2 MET 30 15.194 3.084 2.421 223 2HG MET 30 HG1 MET 30 15.007 4.759 2.899 224 1HE MET 30 HE1 MET 30 16.850 6.584 2.830 225 2HE MET 30 HE3 MET 30 17.910 5.610 3.851 226 3HE MET 30 HE2 MET 30 18.517 6.289 2.342 227 H PHE 31 HN PHE 31 14.145 3.686 7.751 228 HA PHE 31 HA PHE 31 12.562 1.344 6.999 229 1HB PHE 31 HB2 PHE 31 12.908 0.756 9.471 230 2HB PHE 31 HB1 PHE 31 14.150 0.337 8.317 231 HD1 PHE 31 HD1 PHE 31 13.250 2.123 11.291 232 HD2 PHE 31 HD2 PHE 31 16.253 1.757 8.294 233 HE1 PHE 31 HE1 PHE 31 14.869 3.215 12.784 234 HE2 PHE 31 HE2 PHE 31 17.875 2.852 9.781 235 HZ PHE 31 HZ PHE 31 17.186 3.579 12.030 236 H HIS 32 HN HIS 32 12.122 4.421 7.638 237 HA HIS 32 HA HIS 32 9.561 3.796 8.845 238 1HB HIS 32 HB2 HIS 32 10.755 4.110 10.852 239 2HB HIS 32 HB1 HIS 32 11.740 5.406 10.177 240 HD1 HIS 32 HD1 HIS 32 11.217 7.466 11.407 241 HD2 HIS 32 HD2 HIS 32 7.809 5.173 10.783 242 HE1 HIS 32 HE1 HIS 32 9.324 8.769 12.441 243 HE2 HIS 32 HE2 HIS 32 7.327 7.244 12.256 244 H TRP 33 HN TRP 33 8.674 4.493 6.908 245 HA TRP 33 HA TRP 33 9.515 7.164 5.924 246 1HB TRP 33 HB2 TRP 33 8.301 5.498 3.915 247 2HB TRP 33 HB1 TRP 33 9.786 6.382 3.889 248 HD1 TRP 33 HD1 TRP 33 11.313 4.370 6.070 249 HE1 TRP 33 HE1 TRP 33 12.009 2.069 5.122 250 HE3 TRP 33 HE3 TRP 33 8.273 4.282 2.044 251 HZ2 TRP 33 HZ2 TRP 33 11.406 0.503 2.830 252 HZ3 TRP 33 HZ3 TRP 33 8.402 2.421 0.487 253 HH2 TRP 33 HH2 TRP 33 9.975 0.600 0.843 254 H GLN 34 HN GLN 34 7.986 8.045 4.340 255 HA GLN 34 HA GLN 34 5.190 7.684 5.183 256 1HB GLN 34 HB2 GLN 34 6.748 9.962 5.350 257 2HB GLN 34 HB1 GLN 34 5.879 10.187 3.833 258 1HG GLN 34 HG2 GLN 34 4.392 9.404 6.290 259 2HG GLN 34 HG1 GLN 34 4.902 11.069 6.059 260 1HE2 GLN 34 1HE2 GLN 34 2.796 8.538 4.942 261 2HE2 GLN 34 2HE2 GLN 34 1.827 9.525 3.911 262 H ALA 35 HN ALA 35 4.250 6.494 3.622 263 HA ALA 35 HA ALA 35 4.789 7.258 0.829 264 1HB ALA 35 HB3 ALA 35 3.617 4.703 1.929 265 2HB ALA 35 HB1 ALA 35 5.263 4.918 1.335 266 3HB ALA 35 HB2 ALA 35 3.896 5.056 0.225 267 H THR 36 HN THR 36 3.258 8.444 -0.117 268 HA THR 36 HA THR 36 0.515 8.307 0.930 269 HB THR 36 HB THR 36 0.263 10.495 -0.406 270 HG1 THR 36 HG1 THR 36 2.346 10.146 -1.504 271 1HG2 THR 36 2HG2 THR 36 2.094 10.400 1.997 272 2HG2 THR 36 1HG2 THR 36 1.222 11.821 1.425 273 3HG2 THR 36 3HG2 THR 36 0.330 10.427 2.034 274 H ILE 37 HN ILE 37 -0.383 6.676 -0.185 275 HA ILE 37 HA ILE 37 -0.202 6.589 -3.104 276 HB ILE 37 HB ILE 37 -0.967 4.682 -0.936 277 1HG1 ILE 37 2HG1 ILE 37 0.514 3.198 -2.181 278 2HG1 ILE 37 1HG1 ILE 37 0.716 4.432 -3.427 279 1HG2 ILE 37 1HG2 ILE 37 -1.892 4.442 -3.774 280 2HG2 ILE 37 3HG2 ILE 37 -1.809 3.091 -2.647 281 3HG2 ILE 37 2HG2 ILE 37 -2.876 4.455 -2.313 282 1HD1 ILE 37 1HD1 ILE 37 1.561 4.637 -0.542 283 2HD1 ILE 37 3HD1 ILE 37 2.626 4.355 -1.910 284 3HD1 ILE 37 2HD1 ILE 37 1.771 5.886 -1.765 285 H MET 38 HN MET 38 -2.210 6.493 -4.396 286 HA MET 38 HA MET 38 -4.452 7.724 -2.942 287 1HB MET 38 HB2 MET 38 -3.475 8.498 -5.683 288 2HB MET 38 HB1 MET 38 -4.937 9.098 -4.905 289 1HG MET 38 HG2 MET 38 -3.756 10.188 -3.254 290 2HG MET 38 HG1 MET 38 -2.252 9.352 -3.645 291 1HE MET 38 HE2 MET 38 -0.724 11.419 -3.850 292 2HE MET 38 HE1 MET 38 -1.132 12.891 -4.731 293 3HE MET 38 HE3 MET 38 -2.038 12.450 -3.285 294 H GLY 39 HN GLY 39 -6.536 7.290 -3.585 295 1HA GLY 39 HA1 GLY 39 -8.226 6.648 -4.966 296 2HA GLY 39 HA2 GLY 39 -7.147 5.369 -5.559 297 HA PRO 40 HA PRO 40 -5.533 8.291 -8.698 298 1HB PRO 40 HB2 PRO 40 -5.416 6.503 -10.754 299 2HB PRO 40 HB1 PRO 40 -4.155 6.668 -9.529 300 1HG PRO 40 HG2 PRO 40 -6.332 4.645 -9.749 301 2HG PRO 40 HG1 PRO 40 -4.647 4.435 -9.240 302 1HD PRO 40 HD2 PRO 40 -6.728 4.570 -7.489 303 2HD PRO 40 HD1 PRO 40 -5.084 5.108 -7.091 304 H ASN 41 HN ASN 41 -6.221 8.146 -11.328 305 HA ASN 41 HA ASN 41 -8.804 9.249 -11.341 306 1HB ASN 41 HB2 ASN 41 -7.042 8.293 -13.597 307 2HB ASN 41 HB1 ASN 41 -8.600 9.071 -13.857 308 1HD2 ASN 41 1HD2 ASN 41 -8.336 10.895 -11.628 309 2HD2 ASN 41 2HD2 ASN 41 -7.169 12.078 -12.093 310 H ASP 42 HN ASP 42 -10.644 8.309 -11.180 311 HA ASP 42 HA ASP 42 -12.274 6.782 -11.026 312 1HB ASP 42 HB2 ASP 42 -12.117 6.760 -13.493 313 2HB ASP 42 HB1 ASP 42 -10.920 5.471 -13.398 314 H SER 43 HN SER 43 -11.997 5.932 -9.155 315 HA SER 43 HA SER 43 -10.973 3.264 -8.899 316 1HB SER 43 HB2 SER 43 -9.643 5.602 -7.490 317 2HB SER 43 HB1 SER 43 -9.357 3.917 -7.072 318 HG SER 43 HG SER 43 -9.053 4.665 -9.746 319 HA PRO 44 HA PRO 44 -14.368 3.230 -5.995 320 1HB PRO 44 HB2 PRO 44 -12.551 1.431 -4.448 321 2HB PRO 44 HB1 PRO 44 -14.251 1.209 -4.883 322 1HG PRO 44 HG2 PRO 44 -12.364 -0.100 -6.203 323 2HG PRO 44 HG1 PRO 44 -13.748 0.593 -7.069 324 1HD PRO 44 HD2 PRO 44 -10.930 1.575 -6.905 325 2HD PRO 44 HD1 PRO 44 -12.064 1.623 -8.270 326 H TYR 45 HN TYR 45 -11.106 3.993 -5.179 327 HA TYR 45 HA TYR 45 -11.958 5.444 -2.763 328 1HB TYR 45 HB2 TYR 45 -9.269 4.179 -3.355 329 2HB TYR 45 HB1 TYR 45 -9.663 5.043 -1.898 330 HD1 TYR 45 HD1 TYR 45 -12.618 3.470 -2.275 331 HD2 TYR 45 HD2 TYR 45 -8.539 2.446 -1.663 332 HE1 TYR 45 HE1 TYR 45 -13.301 1.295 -1.373 333 HE2 TYR 45 HE2 TYR 45 -9.209 0.276 -0.756 334 HH TYR 45 HH TYR 45 -11.411 -0.623 0.410 335 H GLN 46 HN GLN 46 -12.095 6.439 -5.391 336 HA GLN 46 HA GLN 46 -9.867 7.676 -6.463 337 1HB GLN 46 HB2 GLN 46 -12.366 7.386 -7.269 338 2HB GLN 46 HB1 GLN 46 -12.525 9.016 -6.642 339 1HG GLN 46 HG2 GLN 46 -10.520 8.183 -8.724 340 2HG GLN 46 HG1 GLN 46 -12.086 8.895 -9.064 341 1HE2 GLN 46 1HE2 GLN 46 -8.861 9.388 -8.141 342 2HE2 GLN 46 2HE2 GLN 46 -8.913 11.110 -8.082 343 H GLY 47 HN GLY 47 -8.665 9.331 -5.932 344 1HA GLY 47 HA1 GLY 47 -9.722 11.536 -4.349 345 2HA GLY 47 HA2 GLY 47 -8.143 11.471 -5.126 346 H GLY 48 HN GLY 48 -8.881 8.662 -3.505 347 1HA GLY 48 HA1 GLY 48 -8.470 7.801 -1.409 348 2HA GLY 48 HA2 GLY 48 -8.350 9.437 -0.817 349 H VAL 49 HN VAL 49 -6.417 10.527 -0.855 350 HA VAL 49 HA VAL 49 -3.980 9.102 -1.443 351 HB VAL 49 HB VAL 49 -4.283 11.477 0.375 352 1HG1 VAL 49 2HG1 VAL 49 -2.001 10.530 -1.332 353 2HG1 VAL 49 1HG1 VAL 49 -2.006 12.008 -0.365 354 3HG1 VAL 49 3HG1 VAL 49 -2.119 10.434 0.425 355 1HG2 VAL 49 3HG2 VAL 49 -5.348 11.732 -1.992 356 2HG2 VAL 49 2HG2 VAL 49 -4.346 13.016 -1.320 357 3HG2 VAL 49 1HG2 VAL 49 -3.673 11.903 -2.502 358 H PHE 50 HN PHE 50 -3.954 7.229 -0.271 359 HA PHE 50 HA PHE 50 -4.603 7.266 2.534 360 1HB PHE 50 HB2 PHE 50 -3.765 5.106 0.626 361 2HB PHE 50 HB1 PHE 50 -4.000 4.813 2.344 362 HD1 PHE 50 HD1 PHE 50 -6.323 5.709 3.293 363 HD2 PHE 50 HD2 PHE 50 -5.485 4.780 -0.798 364 HE1 PHE 50 HE1 PHE 50 -8.702 5.358 2.872 365 HE2 PHE 50 HE2 PHE 50 -7.888 4.444 -1.207 366 HZ PHE 50 HZ PHE 50 -9.501 4.965 0.671 367 H PHE 51 HN PHE 51 -3.129 6.161 4.066 368 HA PHE 51 HA PHE 51 -0.498 7.431 3.759 369 1HB PHE 51 HB2 PHE 51 -2.167 7.087 6.263 370 2HB PHE 51 HB1 PHE 51 -0.625 7.932 6.149 371 HD1 PHE 51 HD1 PHE 51 -4.104 7.983 4.850 372 HD2 PHE 51 HD2 PHE 51 -0.578 10.241 5.747 373 HE1 PHE 51 HE1 PHE 51 -5.302 10.072 4.345 374 HE2 PHE 51 HE2 PHE 51 -1.782 12.316 5.236 375 HZ PHE 51 HZ PHE 51 -4.116 12.264 4.571 376 H LEU 52 HN LEU 52 1.176 6.044 3.920 377 HA LEU 52 HA LEU 52 0.733 3.559 5.411 378 1HB LEU 52 HB2 LEU 52 2.124 3.686 2.726 379 2HB LEU 52 HB1 LEU 52 1.840 2.256 3.694 380 HG LEU 52 HG LEU 52 -0.687 2.846 3.373 381 1HD1 LEU 52 1HD1 LEU 52 -0.316 5.035 2.340 382 2HD1 LEU 52 3HD1 LEU 52 0.525 4.250 1.002 383 3HD1 LEU 52 2HD1 LEU 52 -1.189 3.938 1.269 384 1HD2 LEU 52 1HD2 LEU 52 1.032 1.757 1.158 385 2HD2 LEU 52 3HD2 LEU 52 0.338 0.849 2.500 386 3HD2 LEU 52 2HD2 LEU 52 -0.717 1.562 1.279 387 H THR 53 HN THR 53 2.211 3.370 6.948 388 HA THR 53 HA THR 53 4.840 4.618 6.564 389 HB THR 53 HB THR 53 4.014 3.201 9.086 390 HG1 THR 53 HG1 THR 53 2.678 5.234 8.136 391 1HG2 THR 53 3HG2 THR 53 6.361 3.835 8.805 392 2HG2 THR 53 2HG2 THR 53 5.879 5.511 8.540 393 3HG2 THR 53 1HG2 THR 53 5.602 4.750 10.107 394 H ILE 54 HN ILE 54 6.515 3.392 5.999 395 HA ILE 54 HA ILE 54 6.083 0.486 5.990 396 HB ILE 54 HB ILE 54 7.855 1.970 4.064 397 1HG1 ILE 54 2HG1 ILE 54 4.897 1.367 3.777 398 2HG1 ILE 54 1HG1 ILE 54 5.621 2.969 3.900 399 1HG2 ILE 54 1HG2 ILE 54 8.145 -0.457 4.246 400 2HG2 ILE 54 3HG2 ILE 54 6.433 -0.690 3.882 401 3HG2 ILE 54 2HG2 ILE 54 7.508 0.003 2.668 402 1HD1 ILE 54 1HD1 ILE 54 6.751 2.596 1.760 403 2HD1 ILE 54 3HD1 ILE 54 5.976 1.019 1.634 404 3HD1 ILE 54 2HD1 ILE 54 4.997 2.485 1.624 405 H HIS 55 HN HIS 55 7.607 -0.760 6.912 406 HA HIS 55 HA HIS 55 10.145 0.514 7.610 407 1HB HIS 55 HB2 HIS 55 10.113 -0.645 9.821 408 2HB HIS 55 HB1 HIS 55 8.975 0.682 9.627 409 HD1 HIS 55 HD1 HIS 55 6.996 0.083 10.929 410 HD2 HIS 55 HD2 HIS 55 8.491 -3.103 8.752 411 HE1 HIS 55 HE1 HIS 55 5.346 -1.742 11.213 412 HE2 HIS 55 HE2 HIS 55 6.443 -3.774 10.211 413 H PHE 56 HN PHE 56 11.957 -0.869 7.887 414 HA PHE 56 HA PHE 56 11.588 -3.599 6.816 415 1HB PHE 56 HB2 PHE 56 13.426 -3.383 5.390 416 2HB PHE 56 HB1 PHE 56 12.622 -1.844 5.209 417 HD1 PHE 56 HD1 PHE 56 15.570 -3.589 6.537 418 HD2 PHE 56 HD2 PHE 56 13.632 0.136 5.977 419 HE1 PHE 56 HE1 PHE 56 17.659 -2.424 7.116 420 HE2 PHE 56 HE2 PHE 56 15.683 1.322 6.540 421 HZ PHE 56 HZ PHE 56 17.720 0.038 7.127 422 HA PRO 57 HA PRO 57 14.802 -4.519 9.890 423 1HB PRO 57 HB2 PRO 57 14.142 -7.082 10.314 424 2HB PRO 57 HB1 PRO 57 13.153 -5.765 10.954 425 1HG PRO 57 HG2 PRO 57 12.552 -7.650 8.781 426 2HG PRO 57 HG1 PRO 57 11.447 -6.613 9.698 427 1HD PRO 57 HD2 PRO 57 12.684 -6.143 7.084 428 2HD PRO 57 HD1 PRO 57 11.350 -5.267 7.866 429 H THR 58 HN THR 58 16.559 -4.359 8.436 430 HA THR 58 HA THR 58 18.029 -4.993 6.738 431 HB THR 58 HB THR 58 19.081 -7.267 7.967 432 HG1 THR 58 HG1 THR 58 17.803 -7.107 9.766 433 1HG2 THR 58 1HG2 THR 58 19.673 -4.337 8.407 434 2HG2 THR 58 3HG2 THR 58 20.752 -5.667 8.819 435 3HG2 THR 58 2HG2 THR 58 20.344 -5.355 7.133 436 H ASP 59 HN ASP 59 16.142 -5.701 5.288 437 HA ASP 59 HA ASP 59 15.605 -8.500 5.047 438 1HB ASP 59 HB2 ASP 59 15.001 -6.633 2.835 439 2HB ASP 59 HB1 ASP 59 14.009 -7.913 3.505 440 H TYR 60 HN TYR 60 17.502 -6.169 3.179 441 HA TYR 60 HA TYR 60 17.598 -7.200 0.718 442 1HB TYR 60 HB2 TYR 60 18.752 -5.203 1.013 443 2HB TYR 60 HB1 TYR 60 19.793 -5.873 2.270 444 HD1 TYR 60 HD1 TYR 60 19.181 -5.610 -1.336 445 HD2 TYR 60 HD2 TYR 60 21.807 -7.091 1.665 446 HE1 TYR 60 HE1 TYR 60 20.909 -5.988 -3.043 447 HE2 TYR 60 HE2 TYR 60 23.544 -7.476 -0.035 448 HH TYR 60 HH TYR 60 23.372 -6.200 -3.171 449 HA PRO 61 HA PRO 61 18.429 -7.747 -1.058 450 1HB PRO 61 HB2 PRO 61 18.219 -9.745 -2.821 451 2HB PRO 61 HB1 PRO 61 19.789 -9.070 -2.369 452 1HG PRO 61 HG2 PRO 61 18.472 -11.586 -1.439 453 2HG PRO 61 HG1 PRO 61 20.171 -11.302 -1.855 454 1HD PRO 61 HD2 PRO 61 19.161 -11.341 0.717 455 2HD PRO 61 HD1 PRO 61 20.661 -10.529 0.237 456 H PHE 62 HN PHE 62 16.853 -10.102 0.795 457 HA PHE 62 HA PHE 62 14.469 -10.134 -0.871 458 1HB PHE 62 HB2 PHE 62 15.375 -12.225 0.416 459 2HB PHE 62 HB1 PHE 62 14.606 -11.445 1.814 460 HD1 PHE 62 HD1 PHE 62 13.953 -14.128 0.165 461 HD2 PHE 62 HD2 PHE 62 12.254 -10.222 0.379 462 HE1 PHE 62 HE1 PHE 62 11.767 -15.047 -0.469 463 HE2 PHE 62 HE2 PHE 62 10.059 -11.147 -0.257 464 HZ PHE 62 HZ PHE 62 9.836 -13.518 -0.793 465 H LYS 63 HN LYS 63 14.271 -7.887 -0.502 466 HA LYS 63 HA LYS 63 13.268 -6.939 2.000 467 1HB LYS 63 HB2 LYS 63 13.109 -5.814 -0.786 468 2HB LYS 63 HB1 LYS 63 12.536 -4.994 0.648 469 1HG LYS 63 HG2 LYS 63 15.361 -5.874 0.621 470 2HG LYS 63 HG1 LYS 63 14.906 -4.516 -0.402 471 1HD LYS 63 HD2 LYS 63 14.899 -4.740 2.575 472 2HD LYS 63 HD1 LYS 63 15.530 -3.459 1.551 473 1HE LYS 63 HE2 LYS 63 13.681 -2.419 2.369 474 2HE LYS 63 HE1 LYS 63 12.969 -3.171 0.949 475 1HZ LYS 63 HZ3 LYS 63 12.926 -4.320 3.691 476 2HZ LYS 63 HZ2 LYS 63 11.642 -3.481 2.975 477 3HZ LYS 63 HZ1 LYS 63 12.150 -4.955 2.328 478 HA PRO 64 HA PRO 64 8.956 -7.681 1.063 479 1HB PRO 64 HB2 PRO 64 8.257 -8.947 3.349 480 2HB PRO 64 HB1 PRO 64 8.945 -9.819 1.973 481 1HG PRO 64 HG2 PRO 64 10.130 -9.275 4.582 482 2HG PRO 64 HG1 PRO 64 10.688 -10.376 3.315 483 1HD PRO 64 HD2 PRO 64 11.565 -7.640 3.919 484 2HD PRO 64 HD1 PRO 64 12.355 -8.881 2.921 485 HA PRO 65 HA PRO 65 9.460 -3.992 3.946 486 1HB PRO 65 HB2 PRO 65 7.935 -2.616 1.826 487 2HB PRO 65 HB1 PRO 65 9.463 -2.156 2.584 488 1HG PRO 65 HG2 PRO 65 9.364 -3.063 0.061 489 2HG PRO 65 HG1 PRO 65 10.720 -3.442 1.139 490 1HD PRO 65 HD2 PRO 65 8.396 -5.154 0.350 491 2HD PRO 65 HD1 PRO 65 10.103 -5.596 0.556 492 H LYS 66 HN LYS 66 8.010 -3.966 5.574 493 HA LYS 66 HA LYS 66 5.324 -4.839 5.103 494 1HB LYS 66 HB2 LYS 66 6.170 -3.445 7.622 495 2HB LYS 66 HB1 LYS 66 4.951 -4.689 7.403 496 1HG LYS 66 HG2 LYS 66 7.407 -5.800 6.584 497 2HG LYS 66 HG1 LYS 66 7.677 -4.970 8.115 498 1HD LYS 66 HD2 LYS 66 7.057 -7.255 8.565 499 2HD LYS 66 HD1 LYS 66 5.742 -6.195 9.069 500 1HE LYS 66 HE2 LYS 66 4.524 -6.701 7.020 501 2HE LYS 66 HE1 LYS 66 5.854 -7.712 6.461 502 1HZ LYS 66 HZ1 LYS 66 4.243 -8.225 8.901 503 2HZ LYS 66 HZ3 LYS 66 4.035 -9.008 7.417 504 3HZ LYS 66 HZ2 LYS 66 5.469 -9.216 8.289 505 H VAL 67 HN VAL 67 4.583 -3.453 3.602 506 HA VAL 67 HA VAL 67 4.351 -0.638 4.077 507 HB VAL 67 HB VAL 67 2.913 -2.390 2.069 508 1HG1 VAL 67 2HG1 VAL 67 3.122 0.559 2.431 509 2HG1 VAL 67 1HG1 VAL 67 2.947 -0.129 0.813 510 3HG1 VAL 67 3HG1 VAL 67 1.717 -0.444 2.038 511 1HG2 VAL 67 3HG2 VAL 67 5.514 -0.893 1.819 512 2HG2 VAL 67 2HG2 VAL 67 5.271 -2.637 1.720 513 3HG2 VAL 67 1HG2 VAL 67 4.625 -1.584 0.463 514 H ALA 68 HN ALA 68 3.101 -0.041 5.738 515 HA ALA 68 HA ALA 68 0.589 -1.518 6.126 516 1HB ALA 68 HB3 ALA 68 2.275 -1.930 7.878 517 2HB ALA 68 HB1 ALA 68 0.812 -1.178 8.510 518 3HB ALA 68 HB2 ALA 68 2.267 -0.211 8.263 519 H PHE 69 HN PHE 69 -1.223 -0.441 6.027 520 HA PHE 69 HA PHE 69 -1.410 2.297 5.599 521 1HB PHE 69 HB2 PHE 69 -3.401 0.167 6.128 522 2HB PHE 69 HB1 PHE 69 -3.911 1.849 6.246 523 HD1 PHE 69 HD1 PHE 69 -4.816 2.782 4.359 524 HD2 PHE 69 HD2 PHE 69 -1.937 -0.319 3.941 525 HE1 PHE 69 HE1 PHE 69 -5.092 2.847 1.926 526 HE2 PHE 69 HE2 PHE 69 -2.194 -0.236 1.493 527 HZ PHE 69 HZ PHE 69 -3.812 1.366 0.491 528 H THR 70 HN THR 70 -1.598 3.995 6.823 529 HA THR 70 HA THR 70 -1.557 3.723 9.731 530 HB THR 70 HB THR 70 -1.482 6.269 8.115 531 HG1 THR 70 HG1 THR 70 0.339 4.215 8.193 532 1HG2 THR 70 1HG2 THR 70 -1.711 6.482 10.549 533 2HG2 THR 70 3HG2 THR 70 -0.257 5.511 10.772 534 3HG2 THR 70 2HG2 THR 70 -0.150 7.093 9.995 535 H THR 71 HN THR 71 -3.748 4.315 7.200 536 HA THR 71 HA THR 71 -5.516 5.949 8.885 537 HB THR 71 HB THR 71 -4.676 6.989 6.767 538 HG1 THR 71 HG1 THR 71 -6.923 7.486 6.006 539 1HG2 THR 71 2HG2 THR 71 -4.757 4.776 5.503 540 2HG2 THR 71 1HG2 THR 71 -6.478 5.100 5.296 541 3HG2 THR 71 3HG2 THR 71 -5.281 6.227 4.655 542 H ARG 72 HN ARG 72 -7.877 5.699 8.198 543 HA ARG 72 HA ARG 72 -8.740 3.028 8.601 544 1HB ARG 72 HB2 ARG 72 -10.098 5.615 7.931 545 2HB ARG 72 HB1 ARG 72 -10.995 4.113 7.812 546 1HG ARG 72 HG2 ARG 72 -11.513 4.992 9.898 547 2HG ARG 72 HG1 ARG 72 -10.359 3.695 10.223 548 1HD ARG 72 HD2 ARG 72 -9.092 5.150 11.330 549 2HD ARG 72 HD1 ARG 72 -8.889 6.088 9.849 550 HE ARG 72 HE ARG 72 -11.179 7.062 10.588 551 1HH1 ARG 72 1HH1 ARG 72 -8.533 6.193 12.728 552 2HH1 ARG 72 2HH1 ARG 72 -8.966 7.373 13.927 553 1HH2 ARG 72 1HH2 ARG 72 -11.750 8.593 12.181 554 2HH2 ARG 72 2HH2 ARG 72 -10.791 8.716 13.624 555 H ILE 73 HN ILE 73 -9.098 1.444 7.101 556 HA ILE 73 HA ILE 73 -9.878 2.140 4.414 557 HB ILE 73 HB ILE 73 -7.629 2.498 4.038 558 1HG1 ILE 73 2HG1 ILE 73 -6.821 0.431 2.731 559 2HG1 ILE 73 1HG1 ILE 73 -8.367 -0.288 3.176 560 1HG2 ILE 73 2HG2 ILE 73 -7.072 -0.014 5.617 561 2HG2 ILE 73 1HG2 ILE 73 -5.844 0.903 4.745 562 3HG2 ILE 73 3HG2 ILE 73 -6.710 1.645 6.089 563 1HD1 ILE 73 1HD1 ILE 73 -8.019 2.295 1.680 564 2HD1 ILE 73 3HD1 ILE 73 -8.389 0.734 0.954 565 3HD1 ILE 73 2HD1 ILE 73 -9.542 1.487 2.054 566 H TYR 74 HN TYR 74 -11.343 0.745 3.867 567 HA TYR 74 HA TYR 74 -11.258 -2.053 4.676 568 1HB TYR 74 HB2 TYR 74 -13.260 -0.258 3.398 569 2HB TYR 74 HB1 TYR 74 -13.283 -1.940 2.883 570 HD1 TYR 74 HD1 TYR 74 -13.767 0.351 5.707 571 HD2 TYR 74 HD2 TYR 74 -14.020 -3.674 4.349 572 HE1 TYR 74 HE1 TYR 74 -15.075 -0.255 7.713 573 HE2 TYR 74 HE2 TYR 74 -15.316 -4.284 6.342 574 HH TYR 74 HH TYR 74 -15.626 -3.437 8.670 575 H HIS 75 HN HIS 75 -10.801 -3.703 3.290 576 HA HIS 75 HA HIS 75 -10.769 -3.639 0.529 577 1HB HIS 75 HB2 HIS 75 -8.750 -2.043 1.271 578 2HB HIS 75 HB1 HIS 75 -7.907 -3.589 1.319 579 HD1 HIS 75 HD1 HIS 75 -10.095 -1.633 -1.088 580 HD2 HIS 75 HD2 HIS 75 -6.942 -4.351 -1.105 581 HE1 HIS 75 HE1 HIS 75 -9.470 -1.932 -3.500 582 HE2 HIS 75 HE2 HIS 75 -7.505 -3.499 -3.489 583 HA PRO 76 HA PRO 76 -10.927 -7.838 1.508 584 1HB PRO 76 HB2 PRO 76 -10.017 -8.904 -0.883 585 2HB PRO 76 HB1 PRO 76 -11.665 -8.352 -0.571 586 1HG PRO 76 HG2 PRO 76 -9.414 -6.912 -1.910 587 2HG PRO 76 HG1 PRO 76 -11.131 -6.969 -2.352 588 1HD PRO 76 HD2 PRO 76 -10.118 -4.844 -1.111 589 2HD PRO 76 HD1 PRO 76 -11.732 -5.452 -0.690 590 H ASN 77 HN ASN 77 -7.885 -6.503 0.544 591 HA ASN 77 HA ASN 77 -6.529 -8.923 1.503 592 1HB ASN 77 HB2 ASN 77 -5.427 -6.917 -0.471 593 2HB ASN 77 HB1 ASN 77 -4.636 -8.364 0.116 594 1HD2 ASN 77 1HD2 ASN 77 -5.126 -7.632 -2.583 595 2HD2 ASN 77 2HD2 ASN 77 -6.116 -8.873 -3.274 596 H ILE 78 HN ILE 78 -7.368 -5.977 2.476 597 HA ILE 78 HA ILE 78 -4.886 -5.444 3.850 598 HB ILE 78 HB ILE 78 -7.285 -3.663 3.399 599 1HG1 ILE 78 2HG1 ILE 78 -4.391 -3.533 2.734 600 2HG1 ILE 78 1HG1 ILE 78 -5.636 -3.997 1.594 601 1HG2 ILE 78 1HG2 ILE 78 -6.260 -3.454 5.718 602 2HG2 ILE 78 3HG2 ILE 78 -4.755 -3.012 4.902 603 3HG2 ILE 78 2HG2 ILE 78 -6.187 -1.998 4.722 604 1HD1 ILE 78 3HD1 ILE 78 -5.323 -1.317 2.906 605 2HD1 ILE 78 2HD1 ILE 78 -4.884 -1.725 1.248 606 3HD1 ILE 78 1HD1 ILE 78 -6.577 -1.758 1.745 607 H ASN 79 HN ASN 79 -4.686 -5.692 5.819 608 HA ASN 79 HA ASN 79 -6.904 -6.739 7.417 609 1HB ASN 79 HB2 ASN 79 -5.086 -7.986 8.611 610 2HB ASN 79 HB1 ASN 79 -5.196 -8.395 6.885 611 1HD2 ASN 79 1HD2 ASN 79 -3.657 -7.555 5.507 612 2HD2 ASN 79 2HD2 ASN 79 -2.118 -7.037 6.053 613 H SER 80 HN SER 80 -6.329 -6.317 9.905 614 HA SER 80 HA SER 80 -6.474 -3.501 10.136 615 1HB SER 80 HB2 SER 80 -7.609 -5.122 11.654 616 2HB SER 80 HB1 SER 80 -6.039 -5.499 12.365 617 HG SER 80 HG SER 80 -5.901 -3.178 12.820 618 H ASN 81 HN ASN 81 -3.818 -5.057 9.360 619 HA ASN 81 HA ASN 81 -2.050 -3.339 10.981 620 1HB ASN 81 HB2 ASN 81 -1.571 -5.733 11.170 621 2HB ASN 81 HB1 ASN 81 -1.452 -5.876 9.427 622 1HD2 ASN 81 1HD2 ASN 81 0.425 -5.384 8.428 623 2HD2 ASN 81 2HD2 ASN 81 1.866 -4.911 9.258 624 H GLY 82 HN GLY 82 -3.718 -3.015 8.321 625 1HA GLY 82 HA1 GLY 82 -2.188 -1.093 7.078 626 2HA GLY 82 HA2 GLY 82 -3.558 -1.914 6.343 627 H SER 83 HN SER 83 -2.117 -4.507 6.663 628 HA SER 83 HA SER 83 0.057 -4.196 4.741 629 1HB SER 83 HB2 SER 83 0.671 -5.504 6.634 630 2HB SER 83 HB1 SER 83 -0.819 -6.433 6.562 631 HG SER 83 HG SER 83 0.959 -7.602 5.739 632 H ILE 84 HN ILE 84 -0.024 -5.162 2.724 633 HA ILE 84 HA ILE 84 -2.642 -6.204 1.943 634 HB ILE 84 HB ILE 84 -0.788 -4.496 0.302 635 1HG1 ILE 84 2HG1 ILE 84 -3.520 -3.807 1.357 636 2HG1 ILE 84 1HG1 ILE 84 -2.024 -3.402 2.207 637 1HG2 ILE 84 2HG2 ILE 84 -2.056 -6.104 -1.059 638 2HG2 ILE 84 1HG2 ILE 84 -3.552 -5.493 -0.352 639 3HG2 ILE 84 3HG2 ILE 84 -2.555 -4.439 -1.356 640 1HD1 ILE 84 2HD1 ILE 84 -2.415 -2.591 -0.640 641 2HD1 ILE 84 1HD1 ILE 84 -3.083 -1.639 0.685 642 3HD1 ILE 84 3HD1 ILE 84 -1.342 -1.904 0.587 643 H CYS 85 HN CYS 85 -2.794 -7.916 0.642 644 HA CYS 85 HA CYS 85 -0.547 -9.577 0.142 645 1HB CYS 85 HB2 CYS 85 -2.539 -10.759 0.448 646 2HB CYS 85 HB1 CYS 85 -3.460 -9.682 -0.593 647 HG CYS 85 HG CYS 85 -3.396 -12.107 -1.912 648 H LEU 86 HN LEU 86 0.925 -8.486 -1.126 649 HA LEU 86 HA LEU 86 0.145 -8.146 -3.936 650 1HB LEU 86 HB2 LEU 86 2.270 -6.936 -2.239 651 2HB LEU 86 HB1 LEU 86 2.623 -7.200 -3.937 652 HG LEU 86 HG LEU 86 0.205 -5.640 -3.010 653 1HD1 LEU 86 1HD1 LEU 86 3.014 -4.711 -3.521 654 2HD1 LEU 86 3HD1 LEU 86 1.620 -3.645 -3.635 655 3HD1 LEU 86 2HD1 LEU 86 2.005 -4.426 -2.102 656 1HD2 LEU 86 2HD2 LEU 86 0.175 -6.472 -5.323 657 2HD2 LEU 86 1HD2 LEU 86 0.287 -4.710 -5.258 658 3HD2 LEU 86 3HD2 LEU 86 1.723 -5.674 -5.618 659 H ASP 87 HN ASP 87 0.680 -9.770 -5.235 660 HA ASP 87 HA ASP 87 2.245 -11.985 -4.495 661 1HB ASP 87 HB2 ASP 87 2.235 -12.560 -6.886 662 2HB ASP 87 HB1 ASP 87 0.636 -12.053 -6.354 663 H ILE 88 HN ILE 88 3.106 -8.937 -6.048 664 HA ILE 88 HA ILE 88 5.702 -9.652 -6.753 665 HB ILE 88 HB ILE 88 6.199 -7.161 -6.620 666 1HG1 ILE 88 2HG1 ILE 88 3.236 -6.816 -6.570 667 2HG1 ILE 88 1HG1 ILE 88 4.112 -6.947 -5.046 668 1HG2 ILE 88 1HG2 ILE 88 5.725 -8.345 -8.688 669 2HG2 ILE 88 3HG2 ILE 88 3.994 -8.146 -8.418 670 3HG2 ILE 88 2HG2 ILE 88 5.016 -6.736 -8.697 671 1HD1 ILE 88 1HD1 ILE 88 5.547 -5.082 -5.834 672 2HD1 ILE 88 3HD1 ILE 88 4.451 -4.899 -7.201 673 3HD1 ILE 88 2HD1 ILE 88 3.857 -4.661 -5.558 674 H LEU 89 HN LEU 89 4.465 -9.245 -3.659 675 HA LEU 89 HA LEU 89 7.205 -8.924 -2.633 676 1HB LEU 89 HB2 LEU 89 4.605 -7.888 -1.671 677 2HB LEU 89 HB1 LEU 89 5.750 -8.409 -0.450 678 HG LEU 89 HG LEU 89 7.438 -6.865 -1.459 679 1HD1 LEU 89 3HD1 LEU 89 6.480 -6.680 -3.693 680 2HD1 LEU 89 2HD1 LEU 89 5.077 -5.841 -3.030 681 3HD1 LEU 89 1HD1 LEU 89 6.675 -5.099 -2.944 682 1HD2 LEU 89 2HD2 LEU 89 4.863 -5.637 -0.479 683 2HD2 LEU 89 1HD2 LEU 89 6.187 -6.231 0.521 684 3HD2 LEU 89 3HD2 LEU 89 6.430 -4.828 -0.521 685 H ARG 90 HN ARG 90 4.174 -10.686 -2.269 686 HA ARG 90 HA ARG 90 5.297 -12.329 -0.143 687 1HB ARG 90 HB2 ARG 90 3.069 -13.279 0.058 688 2HB ARG 90 HB1 ARG 90 2.958 -11.524 -0.002 689 1HG ARG 90 HG2 ARG 90 2.483 -11.761 -2.460 690 2HG ARG 90 HG1 ARG 90 2.323 -13.493 -2.176 691 1HD ARG 90 HD2 ARG 90 0.721 -11.357 -0.771 692 2HD ARG 90 HD1 ARG 90 0.165 -12.258 -2.178 693 HE ARG 90 HE ARG 90 0.685 -13.423 0.480 694 1HH1 ARG 90 1HH1 ARG 90 -0.844 -13.600 -2.679 695 2HH1 ARG 90 2HH1 ARG 90 -1.932 -14.864 -2.209 696 1HH2 ARG 90 1HH2 ARG 90 -0.729 -15.127 1.053 697 2HH2 ARG 90 2HH2 ARG 90 -1.842 -15.751 -0.120 698 H SER 91 HN SER 91 5.325 -12.428 -3.487 699 HA SER 91 HA SER 91 5.810 -15.300 -3.431 700 1HB SER 91 HB2 SER 91 3.950 -13.948 -5.384 701 2HB SER 91 HB1 SER 91 4.466 -15.634 -5.476 702 HG SER 91 HG SER 91 3.603 -15.387 -3.060 703 H GLN 92 HN GLN 92 6.141 -12.269 -5.252 704 HA GLN 92 HA GLN 92 7.939 -13.685 -7.098 705 1HB GLN 92 HB2 GLN 92 6.102 -11.354 -7.643 706 2HB GLN 92 HB1 GLN 92 7.149 -12.143 -8.826 707 1HG GLN 92 HG2 GLN 92 5.905 -14.279 -8.086 708 2HG GLN 92 HG1 GLN 92 4.686 -13.156 -7.495 709 1HE2 GLN 92 1HE2 GLN 92 5.262 -11.220 -9.604 710 2HE2 GLN 92 2HE2 GLN 92 4.531 -11.845 -11.037 711 H TRP 93 HN TRP 93 8.338 -11.765 -4.622 712 HA TRP 93 HA TRP 93 9.674 -9.542 -5.747 713 1HB TRP 93 HB2 TRP 93 8.872 -9.298 -3.550 714 2HB TRP 93 HB1 TRP 93 9.763 -10.712 -2.985 715 HD1 TRP 93 HD1 TRP 93 12.520 -10.320 -2.693 716 HE1 TRP 93 HE1 TRP 93 13.893 -8.150 -2.390 717 HE3 TRP 93 HE3 TRP 93 8.947 -6.919 -4.003 718 HZ2 TRP 93 HZ2 TRP 93 13.485 -5.374 -2.647 719 HZ3 TRP 93 HZ3 TRP 93 9.510 -4.523 -3.930 720 HH2 TRP 93 HH2 TRP 93 11.735 -3.770 -3.258 721 H SER 94 HN SER 94 11.738 -9.101 -6.058 722 HA SER 94 HA SER 94 13.912 -10.851 -5.483 723 1HB SER 94 HB2 SER 94 12.946 -10.473 -8.335 724 2HB SER 94 HB1 SER 94 14.540 -11.084 -7.920 725 HG SER 94 HG SER 94 12.158 -12.284 -6.981 726 HA PRO 95 HA PRO 95 16.022 -6.865 -5.996 727 1HB PRO 95 HB2 PRO 95 18.196 -7.462 -7.582 728 2HB PRO 95 HB1 PRO 95 18.132 -7.722 -5.835 729 1HG PRO 95 HG2 PRO 95 17.701 -9.669 -8.062 730 2HG PRO 95 HG1 PRO 95 18.561 -9.892 -6.527 731 1HD PRO 95 HD2 PRO 95 16.082 -10.850 -6.904 732 2HD PRO 95 HD1 PRO 95 16.605 -10.215 -5.333 733 H ALA 96 HN ALA 96 13.981 -6.623 -7.398 734 HA ALA 96 HA ALA 96 14.713 -5.481 -9.950 735 1HB ALA 96 HB2 ALA 96 12.795 -7.813 -9.858 736 2HB ALA 96 HB1 ALA 96 13.123 -6.807 -11.271 737 3HB ALA 96 HB3 ALA 96 14.401 -7.813 -10.589 738 H LEU 97 HN LEU 97 12.143 -6.429 -7.714 739 HA LEU 97 HA LEU 97 10.304 -4.451 -8.651 740 1HB LEU 97 HB2 LEU 97 10.377 -6.050 -6.100 741 2HB LEU 97 HB1 LEU 97 9.085 -4.949 -6.522 742 HG LEU 97 HG LEU 97 8.293 -7.107 -7.005 743 1HD1 LEU 97 3HD1 LEU 97 7.891 -5.380 -8.736 744 2HD1 LEU 97 2HD1 LEU 97 9.245 -6.041 -9.651 745 3HD1 LEU 97 1HD1 LEU 97 7.825 -7.036 -9.339 746 1HD2 LEU 97 1HD2 LEU 97 10.459 -8.267 -6.985 747 2HD2 LEU 97 3HD2 LEU 97 9.462 -8.743 -8.357 748 3HD2 LEU 97 2HD2 LEU 97 10.802 -7.622 -8.587 749 H THR 98 HN THR 98 9.879 -2.448 -7.845 750 HA THR 98 HA THR 98 11.433 -1.608 -5.488 751 HB THR 98 HB THR 98 11.351 0.717 -6.489 752 HG1 THR 98 HG1 THR 98 11.113 0.672 -8.856 753 1HG2 THR 98 2HG2 THR 98 13.419 -0.609 -6.511 754 2HG2 THR 98 1HG2 THR 98 12.918 -1.366 -8.024 755 3HG2 THR 98 3HG2 THR 98 13.274 0.362 -7.977 756 H ILE 99 HN ILE 99 10.314 -0.134 -4.121 757 HA ILE 99 HA ILE 99 7.524 -0.507 -3.887 758 HB ILE 99 HB ILE 99 7.891 1.925 -2.656 759 1HG1 ILE 99 2HG1 ILE 99 10.308 0.320 -2.014 760 2HG1 ILE 99 1HG1 ILE 99 10.375 1.491 -3.332 761 1HG2 ILE 99 2HG2 ILE 99 8.305 -0.853 -1.540 762 2HG2 ILE 99 1HG2 ILE 99 8.014 0.598 -0.582 763 3HG2 ILE 99 3HG2 ILE 99 6.771 0.002 -1.678 764 1HD1 ILE 99 3HD1 ILE 99 9.564 3.162 -1.702 765 2HD1 ILE 99 2HD1 ILE 99 9.753 1.936 -0.459 766 3HD1 ILE 99 1HD1 ILE 99 11.155 2.483 -1.357 767 H SER 100 HN SER 100 9.485 1.868 -5.431 768 HA SER 100 HA SER 100 7.774 3.694 -6.414 769 1HB SER 100 HB2 SER 100 10.180 3.581 -6.930 770 2HB SER 100 HB1 SER 100 9.901 2.168 -7.946 771 HG SER 100 HG SER 100 10.030 4.431 -8.900 772 H LYS 101 HN LYS 101 8.134 0.343 -7.577 773 HA LYS 101 HA LYS 101 5.732 0.617 -9.146 774 1HB LYS 101 HB2 LYS 101 6.192 -1.420 -10.137 775 2HB LYS 101 HB1 LYS 101 7.780 -0.738 -9.850 776 1HG LYS 101 HG2 LYS 101 7.985 -2.984 -9.318 777 2HG LYS 101 HG1 LYS 101 7.845 -2.173 -7.760 778 1HD LYS 101 HD2 LYS 101 6.416 -3.960 -7.505 779 2HD LYS 101 HD1 LYS 101 5.330 -2.662 -8.001 780 1HE LYS 101 HE2 LYS 101 6.481 -4.714 -9.885 781 2HE LYS 101 HE1 LYS 101 4.912 -4.858 -9.105 782 1HZ LYS 101 HZ3 LYS 101 4.327 -2.693 -10.161 783 2HZ LYS 101 HZ2 LYS 101 5.757 -2.801 -11.059 784 3HZ LYS 101 HZ1 LYS 101 4.553 -3.967 -11.247 785 H VAL 102 HN VAL 102 6.606 -0.973 -6.062 786 HA VAL 102 HA VAL 102 4.221 -2.536 -6.017 787 HB VAL 102 HB VAL 102 4.919 -3.497 -4.114 788 1HG1 VAL 102 1HG1 VAL 102 7.437 -2.121 -4.955 789 2HG1 VAL 102 3HG1 VAL 102 7.353 -3.487 -3.844 790 3HG1 VAL 102 2HG1 VAL 102 6.817 -3.674 -5.511 791 1HG2 VAL 102 1HG2 VAL 102 5.719 -0.793 -3.127 792 2HG2 VAL 102 3HG2 VAL 102 4.477 -1.879 -2.511 793 3HG2 VAL 102 2HG2 VAL 102 6.180 -2.265 -2.275 794 H LEU 103 HN LEU 103 4.992 0.637 -4.775 795 HA LEU 103 HA LEU 103 2.661 0.819 -3.138 796 1HB LEU 103 HB2 LEU 103 4.585 2.863 -4.210 797 2HB LEU 103 HB1 LEU 103 3.207 3.297 -3.229 798 HG LEU 103 HG LEU 103 5.471 1.496 -2.348 799 1HD1 LEU 103 2HD1 LEU 103 4.841 4.364 -1.664 800 2HD1 LEU 103 1HD1 LEU 103 6.089 3.380 -0.900 801 3HD1 LEU 103 3HD1 LEU 103 6.215 3.787 -2.612 802 1HD2 LEU 103 3HD2 LEU 103 3.283 1.005 -1.277 803 2HD2 LEU 103 2HD2 LEU 103 4.479 1.630 -0.144 804 3HD2 LEU 103 1HD2 LEU 103 3.198 2.685 -0.742 805 H LEU 104 HN LEU 104 3.470 1.471 -6.443 806 HA LEU 104 HA LEU 104 1.000 2.800 -7.035 807 1HB LEU 104 HB2 LEU 104 3.344 1.881 -8.593 808 2HB LEU 104 HB1 LEU 104 1.825 2.083 -9.451 809 HG LEU 104 HG LEU 104 2.816 4.307 -7.717 810 1HD1 LEU 104 3HD1 LEU 104 4.709 3.669 -9.142 811 2HD1 LEU 104 2HD1 LEU 104 3.675 3.809 -10.562 812 3HD1 LEU 104 1HD1 LEU 104 4.037 5.236 -9.590 813 1HD2 LEU 104 3HD2 LEU 104 0.567 4.359 -8.657 814 2HD2 LEU 104 2HD2 LEU 104 1.588 5.634 -9.327 815 3HD2 LEU 104 1HD2 LEU 104 1.240 4.191 -10.278 816 H SER 105 HN SER 105 2.227 -0.476 -7.056 817 HA SER 105 HA SER 105 -0.085 -1.631 -8.216 818 1HB SER 105 HB2 SER 105 1.813 -2.925 -6.262 819 2HB SER 105 HB1 SER 105 0.709 -3.735 -7.374 820 HG SER 105 HG SER 105 1.916 -2.664 -9.089 821 H ILE 106 HN ILE 106 0.863 -0.921 -4.851 822 HA ILE 106 HA ILE 106 -1.501 -1.906 -3.664 823 HB ILE 106 HB ILE 106 0.544 0.113 -2.817 824 1HG1 ILE 106 2HG1 ILE 106 -0.449 -2.505 -1.665 825 2HG1 ILE 106 1HG1 ILE 106 1.057 -2.244 -2.528 826 1HG2 ILE 106 1HG2 ILE 106 -1.574 1.067 -2.081 827 2HG2 ILE 106 3HG2 ILE 106 -2.005 -0.461 -1.314 828 3HG2 ILE 106 2HG2 ILE 106 -0.639 0.475 -0.708 829 1HD1 ILE 106 3HD1 ILE 106 0.363 -1.007 0.123 830 2HD1 ILE 106 2HD1 ILE 106 1.377 -2.430 -0.112 831 3HD1 ILE 106 1HD1 ILE 106 1.894 -0.864 -0.737 832 H CYS 107 HN CYS 107 -0.574 1.281 -4.826 833 HA CYS 107 HA CYS 107 -2.953 2.667 -4.529 834 1HB CYS 107 HB2 CYS 107 -0.939 3.751 -5.276 835 2HB CYS 107 HB1 CYS 107 -0.890 2.745 -6.722 836 HG CYS 107 HG CYS 107 -3.519 4.840 -6.173 837 H SER 108 HN SER 108 -1.956 0.405 -7.075 838 HA SER 108 HA SER 108 -4.256 0.917 -8.693 839 1HB SER 108 HB2 SER 108 -3.487 -0.894 -10.101 840 2HB SER 108 HB1 SER 108 -2.128 0.135 -9.671 841 HG SER 108 HG SER 108 -2.324 -1.795 -7.849 842 H LEU 109 HN LEU 109 -3.659 -0.878 -5.904 843 HA LEU 109 HA LEU 109 -5.706 -2.836 -6.448 844 1HB LEU 109 HB2 LEU 109 -4.034 -2.318 -3.994 845 2HB LEU 109 HB1 LEU 109 -5.265 -3.563 -4.079 846 HG LEU 109 HG LEU 109 -2.840 -3.431 -5.878 847 1HD1 LEU 109 3HD1 LEU 109 -3.383 -5.128 -3.454 848 2HD1 LEU 109 2HD1 LEU 109 -2.067 -5.399 -4.599 849 3HD1 LEU 109 1HD1 LEU 109 -2.112 -3.917 -3.640 850 1HD2 LEU 109 2HD2 LEU 109 -4.939 -5.561 -5.506 851 2HD2 LEU 109 1HD2 LEU 109 -4.722 -4.538 -6.926 852 3HD2 LEU 109 3HD2 LEU 109 -3.485 -5.715 -6.490 853 H LEU 110 HN LEU 110 -5.383 0.130 -4.477 854 HA LEU 110 HA LEU 110 -8.034 0.110 -3.543 855 1HB LEU 110 HB2 LEU 110 -6.412 2.579 -4.286 856 2HB LEU 110 HB1 LEU 110 -7.797 2.479 -3.288 857 HG LEU 110 HG LEU 110 -6.334 2.644 -1.642 858 1HD1 LEU 110 3HD1 LEU 110 -6.121 -0.292 -2.231 859 2HD1 LEU 110 2HD1 LEU 110 -5.627 0.473 -0.722 860 3HD1 LEU 110 1HD1 LEU 110 -7.320 0.506 -1.214 861 1HD2 LEU 110 2HD2 LEU 110 -4.300 1.267 -3.361 862 2HD2 LEU 110 1HD2 LEU 110 -4.436 2.999 -3.063 863 3HD2 LEU 110 3HD2 LEU 110 -4.004 1.910 -1.746 864 H CYS 111 HN CYS 111 -6.605 0.393 -6.568 865 HA CYS 111 HA CYS 111 -8.636 2.137 -7.660 866 1HB CYS 111 HB2 CYS 111 -6.352 2.651 -8.161 867 2HB CYS 111 HB1 CYS 111 -6.065 1.007 -8.728 868 HG CYS 111 HG CYS 111 -7.980 3.379 -10.305 869 H ASP 112 HN ASP 112 -7.063 -0.838 -8.974 870 HA ASP 112 HA ASP 112 -9.553 -1.196 -10.459 871 1HB ASP 112 HB2 ASP 112 -7.866 -0.864 -11.989 872 2HB ASP 112 HB1 ASP 112 -6.712 -1.854 -11.114 873 HA PRO 113 HA PRO 113 -9.357 -5.528 -8.829 874 1HB PRO 113 HB2 PRO 113 -7.233 -6.961 -9.341 875 2HB PRO 113 HB1 PRO 113 -7.929 -5.992 -10.650 876 1HG PRO 113 HG2 PRO 113 -5.427 -5.548 -9.112 877 2HG PRO 113 HG1 PRO 113 -5.848 -5.000 -10.743 878 1HD PRO 113 HD2 PRO 113 -6.176 -3.601 -8.180 879 2HD PRO 113 HD1 PRO 113 -6.300 -2.951 -9.826 880 H ASN 114 HN ASN 114 -8.355 -7.490 -7.648 881 HA ASN 114 HA ASN 114 -6.116 -7.241 -5.969 882 1HB ASN 114 HB2 ASN 114 -7.042 -7.317 -3.826 883 2HB ASN 114 HB1 ASN 114 -8.125 -6.189 -4.635 884 1HD2 ASN 114 1HD2 ASN 114 -7.818 -9.206 -3.049 885 2HD2 ASN 114 2HD2 ASN 114 -9.468 -9.694 -3.162 886 HA PRO 115 HA PRO 115 -6.110 -11.417 -7.359 887 1HB PRO 115 HB2 PRO 115 -4.564 -12.599 -5.413 888 2HB PRO 115 HB1 PRO 115 -3.933 -11.636 -6.752 889 1HG PRO 115 HG2 PRO 115 -4.486 -10.819 -3.926 890 2HG PRO 115 HG1 PRO 115 -3.088 -10.434 -4.950 891 1HD PRO 115 HD2 PRO 115 -5.035 -8.649 -4.561 892 2HD PRO 115 HD1 PRO 115 -4.254 -8.812 -6.147 893 H ASP 116 HN ASP 116 -8.091 -10.610 -4.963 894 HA ASP 116 HA ASP 116 -9.524 -11.592 -3.536 895 1HB ASP 116 HB2 ASP 116 -10.448 -12.334 -5.688 896 2HB ASP 116 HB1 ASP 116 -9.483 -13.805 -5.589 897 H ASP 117 HN ASP 117 -7.740 -11.771 -2.038 898 HA ASP 117 HA ASP 117 -7.226 -14.585 -1.354 899 1HB ASP 117 HB2 ASP 117 -5.642 -12.091 -1.027 900 2HB ASP 117 HB1 ASP 117 -5.527 -13.284 0.266 901 HA PRO 118 HA PRO 118 -10.153 -13.747 1.959 902 1HB PRO 118 HB2 PRO 118 -9.365 -16.417 2.902 903 2HB PRO 118 HB1 PRO 118 -10.954 -15.831 2.402 904 1HG PRO 118 HG2 PRO 118 -9.549 -17.565 0.902 905 2HG PRO 118 HG1 PRO 118 -10.595 -16.330 0.182 906 1HD PRO 118 HD2 PRO 118 -7.613 -16.350 0.484 907 2HD PRO 118 HD1 PRO 118 -8.609 -15.814 -0.886 908 H LEU 119 HN LEU 119 -8.095 -12.298 2.473 909 HA LEU 119 HA LEU 119 -6.368 -13.277 4.528 910 1HB LEU 119 HB2 LEU 119 -5.977 -11.292 2.903 911 2HB LEU 119 HB1 LEU 119 -6.927 -10.367 4.039 912 HG LEU 119 HG LEU 119 -5.317 -10.821 5.808 913 1HD1 LEU 119 2HD1 LEU 119 -3.814 -12.363 3.697 914 2HD1 LEU 119 1HD1 LEU 119 -3.167 -11.910 5.275 915 3HD1 LEU 119 3HD1 LEU 119 -4.537 -13.013 5.170 916 1HD2 LEU 119 3HD2 LEU 119 -4.067 -9.801 3.268 917 2HD2 LEU 119 2HD2 LEU 119 -4.977 -8.861 4.450 918 3HD2 LEU 119 1HD2 LEU 119 -3.420 -9.566 4.893 919 H VAL 120 HN VAL 120 -9.012 -10.868 4.533 920 HA VAL 120 HA VAL 120 -9.342 -11.485 7.386 921 HB VAL 120 HB VAL 120 -10.336 -9.071 5.862 922 1HG1 VAL 120 1HG1 VAL 120 -11.670 -9.634 7.844 923 2HG1 VAL 120 3HG1 VAL 120 -10.205 -9.667 8.827 924 3HG1 VAL 120 2HG1 VAL 120 -10.751 -8.155 8.108 925 1HG2 VAL 120 2HG2 VAL 120 -7.887 -9.103 5.965 926 2HG2 VAL 120 1HG2 VAL 120 -8.561 -7.825 6.974 927 3HG2 VAL 120 3HG2 VAL 120 -7.962 -9.308 7.716 928 HA PRO 121 HA PRO 121 -12.744 -14.050 6.394 929 1HB PRO 121 HB2 PRO 121 -14.302 -13.196 8.615 930 2HB PRO 121 HB1 PRO 121 -13.273 -14.627 8.507 931 1HG PRO 121 HG2 PRO 121 -12.697 -11.963 9.683 932 2HG PRO 121 HG1 PRO 121 -12.064 -13.556 10.135 933 1HD PRO 121 HD2 PRO 121 -10.552 -11.781 8.837 934 2HD PRO 121 HD1 PRO 121 -10.440 -13.515 8.472 935 H GLU 122 HN GLU 122 -13.640 -10.783 7.532 936 HA GLU 122 HA GLU 122 -16.046 -10.920 5.924 937 1HB GLU 122 HB2 GLU 122 -15.056 -8.716 7.701 938 2HB GLU 122 HB1 GLU 122 -16.595 -8.773 6.836 939 1HG GLU 122 HG2 GLU 122 -15.889 -10.980 8.700 940 2HG GLU 122 HG1 GLU 122 -16.442 -9.440 9.362 941 H ILE 123 HN ILE 123 -13.036 -9.092 5.959 942 HA ILE 123 HA ILE 123 -14.118 -7.065 4.304 943 HB ILE 123 HB ILE 123 -11.200 -7.549 4.803 944 1HG1 ILE 123 2HG1 ILE 123 -13.092 -5.843 6.415 945 2HG1 ILE 123 1HG1 ILE 123 -12.597 -7.468 6.896 946 1HG2 ILE 123 3HG2 ILE 123 -12.812 -5.122 4.080 947 2HG2 ILE 123 2HG2 ILE 123 -11.111 -5.101 4.542 948 3HG2 ILE 123 1HG2 ILE 123 -11.617 -5.942 3.073 949 1HD1 ILE 123 1HD1 ILE 123 -10.267 -6.721 6.822 950 2HD1 ILE 123 3HD1 ILE 123 -10.833 -5.078 6.516 951 3HD1 ILE 123 2HD1 ILE 123 -11.241 -5.887 8.034 952 H ALA 124 HN ALA 124 -12.087 -9.874 3.730 953 HA ALA 124 HA ALA 124 -11.785 -9.530 0.938 954 1HB ALA 124 HB1 ALA 124 -12.033 -12.115 2.485 955 2HB ALA 124 HB3 ALA 124 -11.422 -11.951 0.837 956 3HB ALA 124 HB2 ALA 124 -10.537 -11.232 2.182 957 H ARG 125 HN ARG 125 -14.450 -10.405 2.875 958 HA ARG 125 HA ARG 125 -16.054 -11.437 0.717 959 1HB ARG 125 HB2 ARG 125 -16.496 -12.377 2.837 960 2HB ARG 125 HB1 ARG 125 -16.558 -10.803 3.610 961 1HG ARG 125 HG2 ARG 125 -18.563 -11.315 1.512 962 2HG ARG 125 HG1 ARG 125 -18.696 -12.220 3.012 963 1HD ARG 125 HD2 ARG 125 -18.292 -9.286 3.154 964 2HD ARG 125 HD1 ARG 125 -19.894 -9.914 2.757 965 HE ARG 125 HE ARG 125 -18.512 -10.902 5.155 966 1HH1 ARG 125 1HH1 ARG 125 -21.062 -8.951 3.768 967 2HH1 ARG 125 2HH1 ARG 125 -22.058 -9.020 5.192 968 1HH2 ARG 125 1HH2 ARG 125 -19.789 -10.977 7.030 969 2HH2 ARG 125 2HH2 ARG 125 -21.333 -10.175 7.052 970 H ILE 126 HN ILE 126 -16.203 -8.575 2.810 971 HA ILE 126 HA ILE 126 -18.421 -7.329 1.725 972 HB ILE 126 HB ILE 126 -17.557 -5.258 2.715 973 1HG1 ILE 126 2HG1 ILE 126 -15.369 -5.702 4.135 974 2HG1 ILE 126 1HG1 ILE 126 -15.010 -6.821 2.813 975 1HG2 ILE 126 1HG2 ILE 126 -18.714 -6.877 4.103 976 2HG2 ILE 126 3HG2 ILE 126 -17.183 -7.686 4.449 977 3HG2 ILE 126 2HG2 ILE 126 -17.464 -6.042 5.023 978 1HD1 ILE 126 1HD1 ILE 126 -15.221 -4.974 1.224 979 2HD1 ILE 126 3HD1 ILE 126 -15.552 -3.864 2.552 980 3HD1 ILE 126 2HD1 ILE 126 -13.983 -4.660 2.438 981 H TYR 127 HN TYR 127 -15.353 -7.705 0.372 982 HA TYR 127 HA TYR 127 -15.330 -5.448 -1.372 983 1HB TYR 127 HB2 TYR 127 -13.241 -6.502 -1.107 984 2HB TYR 127 HB1 TYR 127 -13.917 -8.103 -1.356 985 HD1 TYR 127 HD1 TYR 127 -13.627 -9.123 -3.426 986 HD2 TYR 127 HD2 TYR 127 -13.414 -4.882 -3.186 987 HE1 TYR 127 HE1 TYR 127 -13.028 -9.025 -5.810 988 HE2 TYR 127 HE2 TYR 127 -12.812 -4.770 -5.567 989 HH TYR 127 HH TYR 127 -11.840 -6.198 -7.290 990 H LYS 128 HN LYS 128 -16.071 -8.856 -1.803 991 HA LYS 128 HA LYS 128 -17.160 -8.329 -4.459 992 1HB LYS 128 HB2 LYS 128 -16.937 -10.638 -4.849 993 2HB LYS 128 HB1 LYS 128 -15.536 -10.225 -3.861 994 1HG LYS 128 HG2 LYS 128 -17.829 -10.996 -2.252 995 2HG LYS 128 HG1 LYS 128 -17.345 -12.262 -3.379 996 1HD LYS 128 HD2 LYS 128 -15.494 -10.858 -1.456 997 2HD LYS 128 HD1 LYS 128 -16.246 -12.428 -1.167 998 1HE LYS 128 HE2 LYS 128 -15.160 -13.251 -3.259 999 2HE LYS 128 HE1 LYS 128 -14.305 -11.716 -3.358 1000 1HZ LYS 128 HZ3 LYS 128 -13.458 -12.234 -1.066 1001 2HZ LYS 128 HZ2 LYS 128 -14.051 -13.804 -1.287 1002 3HZ LYS 128 HZ1 LYS 128 -12.849 -13.203 -2.321 1003 H THR 129 HN THR 129 -18.593 -7.764 -1.709 1004 HA THR 129 HA THR 129 -20.986 -9.298 -2.312 1005 HB THR 129 HB THR 129 -19.715 -9.267 0.419 1006 HG1 THR 129 HG1 THR 129 -19.895 -11.205 -1.641 1007 1HG2 THR 129 1HG2 THR 129 -22.165 -9.226 0.521 1008 2HG2 THR 129 3HG2 THR 129 -22.239 -10.618 -0.560 1009 3HG2 THR 129 2HG2 THR 129 -21.536 -10.785 1.050 1010 H ASP 130 HN ASP 130 -20.095 -7.424 0.535 1011 HA ASP 130 HA ASP 130 -22.500 -6.003 0.598 1012 1HB ASP 130 HB2 ASP 130 -19.788 -5.281 1.747 1013 2HB ASP 130 HB1 ASP 130 -21.295 -4.462 2.151 1014 H ARG 131 HN ARG 131 -19.305 -4.780 -0.178 1015 HA ARG 131 HA ARG 131 -18.530 -3.647 -2.019 1016 1HB ARG 131 HB2 ARG 131 -19.829 -4.448 -3.718 1017 2HB ARG 131 HB1 ARG 131 -21.329 -4.157 -2.860 1018 1HG ARG 131 HG2 ARG 131 -19.835 -1.800 -3.866 1019 2HG ARG 131 HG1 ARG 131 -20.662 -2.818 -5.041 1020 1HD ARG 131 HD2 ARG 131 -21.913 -1.489 -2.635 1021 2HD ARG 131 HD1 ARG 131 -22.092 -0.975 -4.312 1022 HE ARG 131 HE ARG 131 -22.923 -3.610 -4.212 1023 1HH1 ARG 131 1HH1 ARG 131 -23.922 -0.540 -2.843 1024 2HH1 ARG 131 2HH1 ARG 131 -25.574 -1.024 -2.649 1025 1HH2 ARG 131 1HH2 ARG 131 -25.089 -4.251 -3.938 1026 2HH2 ARG 131 2HH2 ARG 131 -26.237 -3.145 -3.249 1027 H GLU 132 HN GLU 132 -21.465 -2.537 -0.460 1028 HA GLU 132 HA GLU 132 -20.910 0.236 -0.399 1029 1HB GLU 132 HB2 GLU 132 -22.300 0.140 1.736 1030 2HB GLU 132 HB1 GLU 132 -23.091 -0.432 0.270 1031 1HG GLU 132 HG2 GLU 132 -22.886 -2.683 0.926 1032 2HG GLU 132 HG1 GLU 132 -21.707 -2.299 2.175 1033 H LYS 133 HN LYS 133 -20.116 -2.446 1.673 1034 HA LYS 133 HA LYS 133 -18.795 -1.086 3.741 1035 1HB LYS 133 HB2 LYS 133 -18.694 -3.902 2.683 1036 2HB LYS 133 HB1 LYS 133 -17.740 -3.397 4.077 1037 1HG LYS 133 HG2 LYS 133 -20.735 -3.171 3.899 1038 2HG LYS 133 HG1 LYS 133 -19.887 -4.537 4.615 1039 1HD LYS 133 HD2 LYS 133 -18.889 -3.057 6.279 1040 2HD LYS 133 HD1 LYS 133 -19.699 -1.671 5.544 1041 1HE LYS 133 HE2 LYS 133 -21.858 -2.573 6.087 1042 2HE LYS 133 HE1 LYS 133 -21.137 -4.076 6.650 1043 1HZ LYS 133 HZ2 LYS 133 -20.676 -1.427 7.907 1044 2HZ LYS 133 HZ1 LYS 133 -21.791 -2.569 8.456 1045 3HZ LYS 133 HZ3 LYS 133 -20.143 -2.927 8.480 1046 H TYR 134 HN TYR 134 -17.822 -2.186 0.615 1047 HA TYR 134 HA TYR 134 -14.997 -1.840 1.120 1048 1HB TYR 134 HB2 TYR 134 -15.645 -3.665 -0.270 1049 2HB TYR 134 HB1 TYR 134 -16.659 -2.644 -1.267 1050 HD1 TYR 134 HD1 TYR 134 -15.761 -1.473 -3.133 1051 HD2 TYR 134 HD2 TYR 134 -13.176 -3.550 -0.475 1052 HE1 TYR 134 HE1 TYR 134 -13.933 -1.253 -4.759 1053 HE2 TYR 134 HE2 TYR 134 -11.335 -3.329 -2.090 1054 HH TYR 134 HH TYR 134 -11.572 -1.315 -4.894 1055 H ASN 135 HN ASN 135 -17.216 -0.519 -1.338 1056 HA ASN 135 HA ASN 135 -15.512 1.601 -2.033 1057 1HB ASN 135 HB2 ASN 135 -18.468 1.195 -2.471 1058 2HB ASN 135 HB1 ASN 135 -17.532 2.479 -3.216 1059 1HD2 ASN 135 1HD2 ASN 135 -18.207 -0.906 -3.142 1060 2HD2 ASN 135 2HD2 ASN 135 -17.410 -1.308 -4.631 1061 H ARG 136 HN ARG 136 -18.695 1.767 -0.405 1062 HA ARG 136 HA ARG 136 -18.647 4.553 -0.207 1063 1HB ARG 136 HB2 ARG 136 -20.732 3.315 0.071 1064 2HB ARG 136 HB1 ARG 136 -20.131 2.608 1.567 1065 1HG ARG 136 HG2 ARG 136 -19.903 4.981 2.444 1066 2HG ARG 136 HG1 ARG 136 -20.821 5.471 1.023 1067 1HD ARG 136 HD2 ARG 136 -22.688 4.080 1.698 1068 2HD ARG 136 HD1 ARG 136 -21.772 3.490 3.086 1069 HE ARG 136 HE ARG 136 -22.005 6.344 3.055 1070 1HH1 ARG 136 1HH1 ARG 136 -23.633 3.387 3.975 1071 2HH1 ARG 136 2HH1 ARG 136 -24.626 4.160 5.167 1072 1HH2 ARG 136 1HH2 ARG 136 -23.307 7.363 4.623 1073 2HH2 ARG 136 2HH2 ARG 136 -24.450 6.422 5.529 1074 H ILE 137 HN ILE 137 -17.156 2.158 1.784 1075 HA ILE 137 HA ILE 137 -17.173 3.895 4.106 1076 HB ILE 137 HB ILE 137 -15.906 1.155 3.892 1077 1HG1 ILE 137 2HG1 ILE 137 -18.172 0.747 3.357 1078 2HG1 ILE 137 1HG1 ILE 137 -18.033 0.409 5.076 1079 1HG2 ILE 137 3HG2 ILE 137 -16.853 2.804 6.237 1080 2HG2 ILE 137 2HG2 ILE 137 -16.210 1.165 6.338 1081 3HG2 ILE 137 1HG2 ILE 137 -15.178 2.486 5.791 1082 1HD1 ILE 137 3HD1 ILE 137 -18.985 2.630 5.561 1083 2HD1 ILE 137 2HD1 ILE 137 -19.196 2.880 3.827 1084 3HD1 ILE 137 1HD1 ILE 137 -20.074 1.588 4.642 1085 H ALA 138 HN ALA 138 -14.703 2.111 2.227 1086 HA ALA 138 HA ALA 138 -12.583 3.635 3.279 1087 1HB ALA 138 HB2 ALA 138 -11.221 2.476 1.693 1088 2HB ALA 138 HB1 ALA 138 -12.395 1.361 2.393 1089 3HB ALA 138 HB3 ALA 138 -12.648 1.996 0.767 1090 H ARG 139 HN ARG 139 -14.783 4.178 0.623 1091 HA ARG 139 HA ARG 139 -13.122 6.206 -0.606 1092 1HB ARG 139 HB2 ARG 139 -14.793 4.926 -1.925 1093 2HB ARG 139 HB1 ARG 139 -16.080 5.681 -0.996 1094 1HG ARG 139 HG2 ARG 139 -15.252 7.898 -1.817 1095 2HG ARG 139 HG1 ARG 139 -14.160 7.019 -2.887 1096 1HD ARG 139 HD2 ARG 139 -17.173 6.855 -2.872 1097 2HD ARG 139 HD1 ARG 139 -16.177 7.674 -4.072 1098 HE ARG 139 HE ARG 139 -15.428 4.956 -3.881 1099 1HH1 ARG 139 1HH1 ARG 139 -17.962 7.025 -5.124 1100 2HH1 ARG 139 2HH1 ARG 139 -18.447 5.920 -6.369 1101 1HH2 ARG 139 1HH2 ARG 139 -16.097 3.458 -5.499 1102 2HH2 ARG 139 2HH2 ARG 139 -17.399 3.873 -6.570 1103 H GLU 140 HN GLU 140 -15.786 6.102 1.756 1104 HA GLU 140 HA GLU 140 -16.062 8.889 1.933 1105 1HB GLU 140 HB2 GLU 140 -17.544 8.400 3.605 1106 2HB GLU 140 HB1 GLU 140 -17.496 6.872 2.803 1107 1HG GLU 140 HG2 GLU 140 -16.327 5.843 4.473 1108 2HG GLU 140 HG1 GLU 140 -15.712 7.354 5.133 1109 H TRP 141 HN TRP 141 -14.118 6.482 3.613 1110 HA TRP 141 HA TRP 141 -12.670 8.208 5.270 1111 1HB TRP 141 HB2 TRP 141 -11.882 5.630 3.909 1112 2HB TRP 141 HB1 TRP 141 -10.870 6.455 5.104 1113 HD1 TRP 141 HD1 TRP 141 -13.660 7.308 6.819 1114 HE1 TRP 141 HE1 TRP 141 -14.583 5.509 8.408 1115 HE3 TRP 141 HE3 TRP 141 -11.395 3.216 4.804 1116 HZ2 TRP 141 HZ2 TRP 141 -14.356 2.723 8.757 1117 HZ3 TRP 141 HZ3 TRP 141 -11.793 1.026 5.835 1118 HH2 TRP 141 HH2 TRP 141 -13.242 0.789 7.774 1119 H THR 142 HN THR 142 -12.181 7.205 1.970 1120 HA THR 142 HA THR 142 -9.945 8.611 1.216 1121 HB THR 142 HB THR 142 -12.542 8.017 -0.163 1122 HG1 THR 142 HG1 THR 142 -10.987 6.332 0.295 1123 1HG2 THR 142 3HG2 THR 142 -10.163 9.357 -1.398 1124 2HG2 THR 142 2HG2 THR 142 -11.494 8.641 -2.298 1125 3HG2 THR 142 1HG2 THR 142 -11.783 10.022 -1.235 1126 H GLN 143 HN GLN 143 -13.282 9.784 1.125 1127 HA GLN 143 HA GLN 143 -12.861 12.438 0.480 1128 1HB GLN 143 HB2 GLN 143 -14.893 11.059 2.188 1129 2HB GLN 143 HB1 GLN 143 -15.063 12.744 1.701 1130 1HG GLN 143 HG2 GLN 143 -14.826 11.856 -0.680 1131 2HG GLN 143 HG1 GLN 143 -15.091 10.266 0.014 1132 1HE2 GLN 143 1HE2 GLN 143 -17.005 9.949 -1.075 1133 2HE2 GLN 143 2HE2 GLN 143 -18.459 10.795 -0.679 1134 H LYS 144 HN LYS 144 -13.230 11.044 3.707 1135 HA LYS 144 HA LYS 144 -13.063 13.562 5.035 1136 1HB LYS 144 HB2 LYS 144 -13.050 10.713 5.963 1137 2HB LYS 144 HB1 LYS 144 -13.063 12.072 7.069 1138 1HG LYS 144 HG2 LYS 144 -15.256 12.410 6.774 1139 2HG LYS 144 HG1 LYS 144 -15.155 12.141 5.028 1140 1HD LYS 144 HD2 LYS 144 -14.903 9.721 5.468 1141 2HD LYS 144 HD1 LYS 144 -15.190 10.038 7.184 1142 1HE LYS 144 HE2 LYS 144 -17.090 10.767 4.986 1143 2HE LYS 144 HE1 LYS 144 -17.159 9.251 5.876 1144 1HZ LYS 144 HZ1 LYS 144 -17.485 10.514 7.918 1145 2HZ LYS 144 HZ3 LYS 144 -17.443 11.964 7.048 1146 3HZ LYS 144 HZ2 LYS 144 -18.695 10.863 6.789 1147 H TYR 145 HN TYR 145 -10.832 10.816 4.683 1148 HA TYR 145 HA TYR 145 -8.942 12.223 6.452 1149 1HB TYR 145 HB2 TYR 145 -9.199 9.271 5.867 1150 2HB TYR 145 HB1 TYR 145 -8.015 9.982 6.959 1151 HD1 TYR 145 HD1 TYR 145 -8.700 10.807 9.131 1152 HD2 TYR 145 HD2 TYR 145 -11.532 9.053 6.498 1153 HE1 TYR 145 HE1 TYR 145 -10.275 10.592 11.006 1154 HE2 TYR 145 HE2 TYR 145 -13.129 8.830 8.353 1155 HH TYR 145 HH TYR 145 -13.019 8.678 10.879 1156 H ALA 146 HN ALA 146 -9.393 10.917 3.281 1157 HA ALA 146 HA ALA 146 -6.501 11.036 2.958 1158 1HB ALA 146 HB2 ALA 146 -8.317 8.842 1.977 1159 2HB ALA 146 HB3 ALA 146 -7.238 8.717 3.368 1160 3HB ALA 146 HB1 ALA 146 -6.570 8.931 1.748 1161 H MET 147 HN MET 147 -7.605 13.167 1.959 1162 HA MET 147 HA MET 147 -7.457 12.658 -0.889 1163 1HB MET 147 HB2 MET 147 -9.578 13.411 -1.536 1164 2HB MET 147 HB1 MET 147 -9.884 12.345 -0.172 1165 1HG MET 147 HG2 MET 147 -11.299 14.102 0.198 1166 2HG MET 147 HG1 MET 147 -9.931 14.453 1.247 1167 1HE MET 147 HE2 MET 147 -11.817 15.358 -2.056 1168 2HE MET 147 HE1 MET 147 -10.803 16.631 -2.734 1169 3HE MET 147 HE3 MET 147 -10.213 14.971 -2.677 No H/Q in entry = 1169 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 20.859 -1.614 6.599 2 H2 MET 1 HT3 MET 1 21.685 -3.076 6.367 3 H3 MET 1 HT2 MET 1 22.478 -1.755 7.055 4 HA MET 1 HA MET 1 22.359 -0.515 5.052 5 1HB MET 1 HB2 MET 1 24.232 -2.113 5.438 6 2HB MET 1 HB1 MET 1 23.371 -3.299 4.467 7 1HG MET 1 HG2 MET 1 25.099 -2.186 3.172 8 2HG MET 1 HG1 MET 1 23.494 -1.834 2.532 9 1HE MET 1 HE2 MET 1 25.327 -0.321 5.684 10 2HE MET 1 HE1 MET 1 26.612 -0.396 4.482 11 3HE MET 1 HE3 MET 1 25.992 1.166 5.012 12 H ALA 2 HN ALA 2 20.220 -3.307 4.939 13 HA ALA 2 HA ALA 2 19.415 -3.395 2.336 14 1HB ALA 2 HB2 ALA 2 17.178 -3.949 3.142 15 2HB ALA 2 HB1 ALA 2 18.415 -4.766 4.095 16 3HB ALA 2 HB3 ALA 2 17.596 -3.343 4.745 17 H LEU 3 HN LEU 3 19.034 -0.789 4.563 18 HA LEU 3 HA LEU 3 16.981 0.732 3.424 19 1HB LEU 3 HB2 LEU 3 18.126 2.660 4.444 20 2HB LEU 3 HB1 LEU 3 17.932 1.312 5.546 21 HG LEU 3 HG LEU 3 20.406 0.805 4.587 22 1HD1 LEU 3 3HD1 LEU 3 20.480 2.851 3.258 23 2HD1 LEU 3 2HD1 LEU 3 20.172 3.809 4.706 24 3HD1 LEU 3 1HD1 LEU 3 21.669 2.891 4.555 25 1HD2 LEU 3 3HD2 LEU 3 19.648 2.574 6.902 26 2HD2 LEU 3 2HD2 LEU 3 19.765 0.814 6.913 27 3HD2 LEU 3 1HD2 LEU 3 21.215 1.795 6.689 28 H LYS 4 HN LYS 4 20.295 0.264 2.390 29 HA LYS 4 HA LYS 4 20.289 2.598 0.713 30 1HB LYS 4 HB2 LYS 4 22.521 2.074 0.200 31 2HB LYS 4 HB1 LYS 4 22.289 1.711 1.898 32 1HG LYS 4 HG2 LYS 4 23.255 -0.232 1.475 33 2HG LYS 4 HG1 LYS 4 21.750 -0.679 0.672 34 1HD LYS 4 HD2 LYS 4 22.652 0.155 -1.451 35 2HD LYS 4 HD1 LYS 4 24.163 0.572 -0.640 36 1HE LYS 4 HE2 LYS 4 24.436 -1.811 -0.023 37 2HE LYS 4 HE1 LYS 4 22.985 -2.187 -0.948 38 1HZ LYS 4 HZ2 LYS 4 24.107 -1.295 -2.927 39 2HZ LYS 4 HZ1 LYS 4 25.511 -1.059 -2.018 40 3HZ LYS 4 HZ3 LYS 4 24.921 -2.626 -2.266 41 H ARG 5 HN ARG 5 19.363 -0.613 0.400 42 HA ARG 5 HA ARG 5 19.402 -0.615 -2.514 43 1HB ARG 5 HB2 ARG 5 19.568 -2.793 -1.641 44 2HB ARG 5 HB1 ARG 5 18.294 -2.528 -0.454 45 1HG ARG 5 HG2 ARG 5 16.661 -3.042 -1.892 46 2HG ARG 5 HG1 ARG 5 17.419 -2.148 -3.217 47 1HD ARG 5 HD2 ARG 5 18.253 -4.887 -2.250 48 2HD ARG 5 HD1 ARG 5 17.265 -4.573 -3.677 49 HE ARG 5 HE ARG 5 19.680 -3.117 -3.859 50 1HH1 ARG 5 1HH1 ARG 5 18.483 -6.389 -4.030 51 2HH1 ARG 5 2HH1 ARG 5 19.729 -6.926 -5.116 52 1HH2 ARG 5 1HH2 ARG 5 21.345 -3.822 -5.272 53 2HH2 ARG 5 2HH2 ARG 5 21.365 -5.473 -5.815 54 H ILE 6 HN ILE 6 17.331 -0.340 0.195 55 HA ILE 6 HA ILE 6 14.920 0.249 -0.991 56 HB ILE 6 HB ILE 6 16.065 1.344 1.587 57 1HG1 ILE 6 2HG1 ILE 6 14.640 -1.187 0.837 58 2HG1 ILE 6 1HG1 ILE 6 16.152 -0.986 1.722 59 1HG2 ILE 6 2HG2 ILE 6 13.280 1.270 0.470 60 2HG2 ILE 6 1HG2 ILE 6 13.594 1.366 2.209 61 3HG2 ILE 6 3HG2 ILE 6 14.176 2.636 1.139 62 1HD1 ILE 6 2HD1 ILE 6 14.894 -0.064 3.605 63 2HD1 ILE 6 1HD1 ILE 6 13.398 -0.346 2.717 64 3HD1 ILE 6 3HD1 ILE 6 14.406 -1.709 3.196 65 H HIS 7 HN HIS 7 17.832 2.038 -0.817 66 HA HIS 7 HA HIS 7 17.149 4.629 -1.354 67 1HB HIS 7 HB2 HIS 7 19.405 2.909 -1.766 68 2HB HIS 7 HB1 HIS 7 19.173 3.906 -3.211 69 HD1 HIS 7 HD1 HIS 7 20.527 5.974 -3.114 70 HD2 HIS 7 HD2 HIS 7 19.182 4.842 0.654 71 HE1 HIS 7 HE1 HIS 7 21.392 7.725 -1.534 72 HE2 HIS 7 HE2 HIS 7 20.366 7.138 0.684 73 H LYS 8 HN LYS 8 17.099 1.906 -3.645 74 HA LYS 8 HA LYS 8 16.093 3.705 -5.710 75 1HB LYS 8 HB2 LYS 8 16.701 0.775 -5.928 76 2HB LYS 8 HB1 LYS 8 16.224 1.850 -7.237 77 1HG LYS 8 HG2 LYS 8 18.794 1.920 -5.665 78 2HG LYS 8 HG1 LYS 8 18.583 1.541 -7.375 79 1HD LYS 8 HD2 LYS 8 18.160 4.213 -6.032 80 2HD LYS 8 HD1 LYS 8 19.428 3.787 -7.181 81 1HE LYS 8 HE2 LYS 8 16.474 3.832 -7.800 82 2HE LYS 8 HE1 LYS 8 17.611 5.117 -8.197 83 1HZ LYS 8 HZ2 LYS 8 17.888 2.332 -9.166 84 2HZ LYS 8 HZ1 LYS 8 17.117 3.553 -10.042 85 3HZ LYS 8 HZ3 LYS 8 18.759 3.688 -9.675 86 H GLU 9 HN GLU 9 14.927 1.605 -3.381 87 HA GLU 9 HA GLU 9 12.472 1.057 -4.808 88 1HB GLU 9 HB2 GLU 9 13.022 0.533 -1.897 89 2HB GLU 9 HB1 GLU 9 11.940 -0.335 -2.975 90 1HG GLU 9 HG2 GLU 9 13.716 -1.401 -4.077 91 2HG GLU 9 HG1 GLU 9 14.912 -0.355 -3.305 92 H LEU 10 HN LEU 10 13.276 2.494 -1.713 93 HA LEU 10 HA LEU 10 10.879 4.017 -1.427 94 1HB LEU 10 HB2 LEU 10 12.044 3.012 0.425 95 2HB LEU 10 HB1 LEU 10 13.504 3.872 0.004 96 HG LEU 10 HG LEU 10 11.987 4.618 2.026 97 1HD1 LEU 10 2HD1 LEU 10 14.118 5.641 1.337 98 2HD1 LEU 10 1HD1 LEU 10 13.243 6.616 0.157 99 3HD1 LEU 10 3HD1 LEU 10 12.934 6.830 1.881 100 1HD2 LEU 10 2HD2 LEU 10 9.994 4.931 0.670 101 2HD2 LEU 10 1HD2 LEU 10 10.514 6.433 1.434 102 3HD2 LEU 10 3HD2 LEU 10 10.836 6.156 -0.277 103 H ASN 11 HN ASN 11 14.311 4.904 -1.704 104 HA ASN 11 HA ASN 11 13.768 7.693 -1.732 105 1HB ASN 11 HB2 ASN 11 15.927 6.383 -1.060 106 2HB ASN 11 HB1 ASN 11 16.288 6.489 -2.779 107 1HD2 ASN 11 1HD2 ASN 11 15.160 9.149 -3.117 108 2HD2 ASN 11 2HD2 ASN 11 16.249 10.240 -2.332 109 H ASP 12 HN ASP 12 13.849 5.265 -4.147 110 HA ASP 12 HA ASP 12 14.342 6.873 -6.407 111 1HB ASP 12 HB2 ASP 12 14.421 4.463 -6.576 112 2HB ASP 12 HB1 ASP 12 12.720 4.330 -6.151 113 H LEU 13 HN LEU 13 11.485 6.020 -4.615 114 HA LEU 13 HA LEU 13 9.559 7.381 -6.111 115 1HB LEU 13 HB2 LEU 13 9.768 6.774 -3.163 116 2HB LEU 13 HB1 LEU 13 8.347 7.487 -3.896 117 HG LEU 13 HG LEU 13 9.321 4.900 -5.012 118 1HD1 LEU 13 1HD1 LEU 13 7.827 5.153 -2.425 119 2HD1 LEU 13 3HD1 LEU 13 8.024 3.673 -3.356 120 3HD1 LEU 13 2HD1 LEU 13 9.435 4.462 -2.648 121 1HD2 LEU 13 2HD2 LEU 13 6.696 6.282 -4.575 122 2HD2 LEU 13 1HD2 LEU 13 7.469 5.870 -6.105 123 3HD2 LEU 13 3HD2 LEU 13 6.807 4.598 -5.076 124 H ALA 14 HN ALA 14 11.984 8.417 -3.876 125 HA ALA 14 HA ALA 14 10.914 11.066 -3.504 126 1HB ALA 14 HB1 ALA 14 12.128 9.811 -1.725 127 2HB ALA 14 HB2 ALA 14 12.747 11.435 -2.026 128 3HB ALA 14 HB3 ALA 14 13.602 10.027 -2.659 129 H ARG 15 HN ARG 15 12.995 9.505 -5.743 130 HA ARG 15 HA ARG 15 14.575 11.722 -6.505 131 1HB ARG 15 HB2 ARG 15 13.676 9.391 -8.209 132 2HB ARG 15 HB1 ARG 15 15.063 10.433 -8.504 133 1HG ARG 15 HG2 ARG 15 14.825 8.836 -5.990 134 2HG ARG 15 HG1 ARG 15 15.459 8.128 -7.465 135 1HD ARG 15 HD2 ARG 15 16.539 10.597 -6.115 136 2HD ARG 15 HD1 ARG 15 17.228 8.983 -5.951 137 HE ARG 15 HE ARG 15 17.251 9.364 -8.621 138 1HH1 ARG 15 1HH1 ARG 15 18.360 11.353 -5.956 139 2HH1 ARG 15 2HH1 ARG 15 19.651 12.074 -6.861 140 1HH2 ARG 15 1HH2 ARG 15 18.978 10.303 -9.813 141 2HH2 ARG 15 2HH2 ARG 15 19.991 11.484 -9.048 142 H ASP 16 HN ASP 16 11.869 10.274 -8.349 143 HA ASP 16 HA ASP 16 10.549 12.816 -8.383 144 1HB ASP 16 HB2 ASP 16 10.342 13.011 -10.732 145 2HB ASP 16 HB1 ASP 16 12.046 12.871 -10.384 146 HA PRO 17 HA PRO 17 7.424 9.651 -7.777 147 1HB PRO 17 HB2 PRO 17 5.657 11.909 -7.206 148 2HB PRO 17 HB1 PRO 17 6.175 10.602 -6.140 149 1HG PRO 17 HG2 PRO 17 7.010 13.156 -5.837 150 2HG PRO 17 HG1 PRO 17 8.005 11.758 -5.396 151 1HD PRO 17 HD2 PRO 17 8.151 13.502 -7.824 152 2HD PRO 17 HD1 PRO 17 9.465 12.802 -6.854 153 HA PRO 18 HA PRO 18 5.279 10.104 -11.665 154 1HB PRO 18 HB2 PRO 18 3.531 8.031 -11.345 155 2HB PRO 18 HB1 PRO 18 5.204 7.842 -11.875 156 1HG PRO 18 HG2 PRO 18 3.990 7.329 -9.214 157 2HG PRO 18 HG1 PRO 18 5.335 6.505 -10.017 158 1HD PRO 18 HD2 PRO 18 5.607 8.364 -7.992 159 2HD PRO 18 HD1 PRO 18 6.872 7.946 -9.161 160 H ALA 19 HN ALA 19 2.899 8.931 -9.274 161 HA ALA 19 HA ALA 19 1.679 11.477 -8.964 162 1HB ALA 19 HB1 ALA 19 0.887 10.970 -11.235 163 2HB ALA 19 HB2 ALA 19 -0.436 11.073 -10.072 164 3HB ALA 19 HB3 ALA 19 0.132 9.499 -10.627 165 H GLN 20 HN GLN 20 0.317 8.185 -9.087 166 HA GLN 20 HA GLN 20 -1.229 8.593 -6.771 167 1HB GLN 20 HB2 GLN 20 -0.751 5.795 -7.198 168 2HB GLN 20 HB1 GLN 20 -2.237 6.701 -7.366 169 1HG GLN 20 HG2 GLN 20 -0.124 6.417 -9.505 170 2HG GLN 20 HG1 GLN 20 -1.594 5.460 -9.392 171 1HE2 GLN 20 1HE2 GLN 20 -3.347 7.586 -8.622 172 2HE2 GLN 20 2HE2 GLN 20 -3.546 8.605 -9.996 173 H CYS 21 HN CYS 21 2.065 8.054 -6.911 174 HA CYS 21 HA CYS 21 2.030 6.908 -4.233 175 1HB CYS 21 HB2 CYS 21 3.549 5.153 -4.765 176 2HB CYS 21 HB1 CYS 21 2.240 5.077 -5.938 177 HG CYS 21 HG CYS 21 4.805 4.484 -7.092 178 H SER 22 HN SER 22 3.553 7.663 -2.928 179 HA SER 22 HA SER 22 6.124 8.426 -3.928 180 1HB SER 22 HB2 SER 22 4.832 10.510 -4.311 181 2HB SER 22 HB1 SER 22 4.442 10.555 -2.595 182 HG SER 22 HG SER 22 7.013 10.742 -3.779 183 H ALA 23 HN ALA 23 7.474 7.683 -2.544 184 HA ALA 23 HA ALA 23 7.068 8.174 0.330 185 1HB ALA 23 HB1 ALA 23 6.748 5.746 -0.310 186 2HB ALA 23 HB3 ALA 23 8.458 5.731 -0.746 187 3HB ALA 23 HB2 ALA 23 7.974 6.075 0.912 188 H GLY 24 HN GLY 24 9.290 8.111 1.438 189 1HA GLY 24 HA1 GLY 24 10.959 9.802 -0.275 190 2HA GLY 24 HA2 GLY 24 11.748 8.492 0.585 191 HA PRO 25 HA PRO 25 10.867 12.376 3.446 192 1HB PRO 25 HB2 PRO 25 7.926 12.519 3.504 193 2HB PRO 25 HB1 PRO 25 9.102 13.811 3.252 194 1HG PRO 25 HG2 PRO 25 7.552 12.913 1.253 195 2HG PRO 25 HG1 PRO 25 9.225 13.432 0.970 196 1HD PRO 25 HD2 PRO 25 8.119 10.657 1.245 197 2HD PRO 25 HD1 PRO 25 9.309 11.283 0.082 198 H VAL 26 HN VAL 26 11.181 9.825 4.120 199 HA VAL 26 HA VAL 26 9.379 8.574 5.760 200 HB VAL 26 HB VAL 26 11.218 7.620 4.516 201 1HG1 VAL 26 3HG1 VAL 26 12.745 9.719 5.736 202 2HG1 VAL 26 2HG1 VAL 26 13.510 8.150 6.007 203 3HG1 VAL 26 1HG1 VAL 26 13.143 8.685 4.365 204 1HG2 VAL 26 3HG2 VAL 26 10.426 6.724 6.751 205 2HG2 VAL 26 2HG2 VAL 26 11.882 6.068 6.009 206 3HG2 VAL 26 1HG2 VAL 26 12.006 7.236 7.325 207 H GLY 27 HN GLY 27 10.030 8.075 8.173 208 1HA GLY 27 HA1 GLY 27 10.536 8.677 10.317 209 2HA GLY 27 HA2 GLY 27 10.198 10.340 9.832 210 H ASP 28 HN ASP 28 12.404 9.383 7.771 211 HA ASP 28 HA ASP 28 14.468 10.111 7.289 212 1HB ASP 28 HB2 ASP 28 14.072 11.976 8.984 213 2HB ASP 28 HB1 ASP 28 14.871 10.950 10.170 214 H ASP 29 HN ASP 29 13.627 7.637 8.046 215 HA ASP 29 HA ASP 29 16.118 6.299 8.591 216 1HB ASP 29 HB2 ASP 29 14.423 4.633 9.927 217 2HB ASP 29 HB1 ASP 29 15.439 5.841 10.718 218 H MET 30 HN MET 30 16.294 4.973 6.849 219 HA MET 30 HA MET 30 14.208 4.808 4.957 220 1HB MET 30 HB2 MET 30 16.928 4.336 4.930 221 2HB MET 30 HB1 MET 30 16.247 2.749 4.664 222 1HG MET 30 HG2 MET 30 15.542 3.241 2.604 223 2HG MET 30 HG1 MET 30 15.072 4.874 3.026 224 1HE MET 30 HE2 MET 30 17.690 6.101 4.290 225 2HE MET 30 HE1 MET 30 18.445 6.822 2.869 226 3HE MET 30 HE3 MET 30 16.701 6.948 3.099 227 H PHE 31 HN PHE 31 13.904 3.423 7.748 228 HA PHE 31 HA PHE 31 12.661 1.008 6.672 229 1HB PHE 31 HB2 PHE 31 12.679 0.451 9.242 230 2HB PHE 31 HB1 PHE 31 13.987 -0.008 8.166 231 HD1 PHE 31 HD1 PHE 31 13.094 1.542 11.201 232 HD2 PHE 31 HD2 PHE 31 16.000 1.745 8.103 233 HE1 PHE 31 HE1 PHE 31 14.629 2.704 12.725 234 HE2 PHE 31 HE2 PHE 31 17.539 2.909 9.617 235 HZ PHE 31 HZ PHE 31 16.856 3.388 11.934 236 H HIS 32 HN HIS 32 11.853 4.040 7.791 237 HA HIS 32 HA HIS 32 9.165 2.994 8.423 238 1HB HIS 32 HB2 HIS 32 10.936 4.744 10.081 239 2HB HIS 32 HB1 HIS 32 9.191 5.024 10.145 240 HD1 HIS 32 HD1 HIS 32 8.232 3.936 12.142 241 HD2 HIS 32 HD2 HIS 32 11.397 1.752 10.596 242 HE1 HIS 32 HE1 HIS 32 8.536 1.998 13.706 243 HE2 HIS 32 HE2 HIS 32 10.635 0.863 12.905 244 H TRP 33 HN TRP 33 8.505 3.766 6.314 245 HA TRP 33 HA TRP 33 9.003 6.645 5.822 246 1HB TRP 33 HB2 TRP 33 8.761 5.473 3.332 247 2HB TRP 33 HB1 TRP 33 10.196 6.143 4.065 248 HD1 TRP 33 HD1 TRP 33 11.326 3.964 5.860 249 HE1 TRP 33 HE1 TRP 33 11.939 1.631 4.947 250 HE3 TRP 33 HE3 TRP 33 8.527 4.019 1.625 251 HZ2 TRP 33 HZ2 TRP 33 11.367 0.070 2.663 252 HZ3 TRP 33 HZ3 TRP 33 8.655 2.120 0.105 253 HH2 TRP 33 HH2 TRP 33 10.049 0.196 0.603 254 H GLN 34 HN GLN 34 7.777 7.766 4.590 255 HA GLN 34 HA GLN 34 4.968 7.115 5.008 256 1HB GLN 34 HB2 GLN 34 6.529 9.361 5.583 257 2HB GLN 34 HB1 GLN 34 5.552 9.841 4.200 258 1HG GLN 34 HG2 GLN 34 4.202 8.472 6.447 259 2HG GLN 34 HG1 GLN 34 4.735 10.132 6.684 260 1HE2 GLN 34 1HE2 GLN 34 2.596 8.021 4.932 261 2HE2 GLN 34 2HE2 GLN 34 1.578 9.256 4.285 262 H ALA 35 HN ALA 35 4.412 6.005 3.300 263 HA ALA 35 HA ALA 35 4.895 7.118 0.627 264 1HB ALA 35 HB1 ALA 35 3.880 4.390 1.435 265 2HB ALA 35 HB2 ALA 35 5.554 4.778 1.035 266 3HB ALA 35 HB3 ALA 35 4.300 4.906 -0.199 267 H THR 36 HN THR 36 3.321 8.317 -0.226 268 HA THR 36 HA THR 36 0.579 8.001 0.728 269 HB THR 36 HB THR 36 0.184 10.092 -0.640 270 HG1 THR 36 HG1 THR 36 2.011 9.919 -2.004 271 1HG2 THR 36 2HG2 THR 36 2.262 10.219 1.552 272 2HG2 THR 36 1HG2 THR 36 1.282 11.577 0.991 273 3HG2 THR 36 3HG2 THR 36 0.513 10.197 1.775 274 H ILE 37 HN ILE 37 -0.642 6.638 -0.302 275 HA ILE 37 HA ILE 37 -0.322 6.267 -3.206 276 HB ILE 37 HB ILE 37 -1.072 4.382 -1.008 277 1HG1 ILE 37 2HG1 ILE 37 0.810 3.984 -3.321 278 2HG1 ILE 37 1HG1 ILE 37 1.306 4.865 -1.878 279 1HG2 ILE 37 3HG2 ILE 37 -1.570 4.019 -3.944 280 2HG2 ILE 37 2HG2 ILE 37 -1.615 2.717 -2.761 281 3HG2 ILE 37 1HG2 ILE 37 -2.774 4.044 -2.662 282 1HD1 ILE 37 1HD1 ILE 37 0.170 2.109 -1.725 283 2HD1 ILE 37 3HD1 ILE 37 1.879 2.403 -2.022 284 3HD1 ILE 37 2HD1 ILE 37 1.134 2.975 -0.531 285 H MET 38 HN MET 38 -2.184 6.366 -4.542 286 HA MET 38 HA MET 38 -4.297 7.832 -3.143 287 1HB MET 38 HB2 MET 38 -2.761 8.551 -5.611 288 2HB MET 38 HB1 MET 38 -4.233 9.372 -5.123 289 1HG MET 38 HG2 MET 38 -3.331 10.241 -3.259 290 2HG MET 38 HG1 MET 38 -2.078 9.007 -3.157 291 1HE MET 38 HE2 MET 38 -3.282 12.255 -5.052 292 2HE MET 38 HE1 MET 38 -1.970 12.493 -6.207 293 3HE MET 38 HE3 MET 38 -3.043 11.104 -6.367 294 H GLY 39 HN GLY 39 -6.290 7.571 -3.623 295 1HA GLY 39 HA1 GLY 39 -8.191 7.018 -4.677 296 2HA GLY 39 HA2 GLY 39 -7.270 5.871 -5.635 297 HA PRO 40 HA PRO 40 -8.205 10.668 -7.480 298 1HB PRO 40 HB2 PRO 40 -5.216 10.622 -7.698 299 2HB PRO 40 HB1 PRO 40 -6.314 12.007 -7.706 300 1HG PRO 40 HG2 PRO 40 -5.021 11.166 -5.475 301 2HG PRO 40 HG1 PRO 40 -6.601 11.962 -5.435 302 1HD PRO 40 HD2 PRO 40 -5.949 9.231 -4.739 303 2HD PRO 40 HD1 PRO 40 -7.499 10.068 -4.599 304 H ASN 41 HN ASN 41 -8.540 10.908 -9.543 305 HA ASN 41 HA ASN 41 -8.304 10.857 -11.792 306 1HB ASN 41 HB2 ASN 41 -6.111 8.875 -11.263 307 2HB ASN 41 HB1 ASN 41 -6.714 9.183 -12.890 308 1HD2 ASN 41 1HD2 ASN 41 -6.775 11.730 -10.576 309 2HD2 ASN 41 2HD2 ASN 41 -5.455 12.648 -11.222 310 H ASP 42 HN ASP 42 -8.081 7.480 -10.572 311 HA ASP 42 HA ASP 42 -10.841 7.118 -11.269 312 1HB ASP 42 HB2 ASP 42 -9.605 6.818 -13.468 313 2HB ASP 42 HB1 ASP 42 -8.867 5.384 -12.760 314 H SER 43 HN SER 43 -11.434 6.288 -9.438 315 HA SER 43 HA SER 43 -10.737 3.647 -8.684 316 1HB SER 43 HB2 SER 43 -8.718 4.588 -7.775 317 2HB SER 43 HB1 SER 43 -9.593 5.945 -7.085 318 HG SER 43 HG SER 43 -9.274 3.365 -6.128 319 HA PRO 44 HA PRO 44 -14.630 4.237 -6.426 320 1HB PRO 44 HB2 PRO 44 -13.553 2.163 -4.597 321 2HB PRO 44 HB1 PRO 44 -15.072 2.188 -5.499 322 1HG PRO 44 HG2 PRO 44 -13.074 0.596 -6.239 323 2HG PRO 44 HG1 PRO 44 -14.093 1.408 -7.439 324 1HD PRO 44 HD2 PRO 44 -11.329 2.108 -6.518 325 2HD PRO 44 HD1 PRO 44 -12.014 2.135 -8.157 326 H TYR 45 HN TYR 45 -11.421 4.256 -5.114 327 HA TYR 45 HA TYR 45 -12.258 5.872 -2.807 328 1HB TYR 45 HB2 TYR 45 -9.512 4.781 -3.412 329 2HB TYR 45 HB1 TYR 45 -10.070 5.405 -1.884 330 HD1 TYR 45 HD1 TYR 45 -12.844 3.619 -2.243 331 HD2 TYR 45 HD2 TYR 45 -8.639 2.895 -2.284 332 HE1 TYR 45 HE1 TYR 45 -13.230 1.281 -1.604 333 HE2 TYR 45 HE2 TYR 45 -9.020 0.560 -1.639 334 HH TYR 45 HH TYR 45 -11.271 -0.644 -0.299 335 H GLN 46 HN GLN 46 -12.168 6.742 -5.660 336 HA GLN 46 HA GLN 46 -9.933 8.176 -6.380 337 1HB GLN 46 HB2 GLN 46 -12.442 7.818 -7.424 338 2HB GLN 46 HB1 GLN 46 -12.464 9.529 -7.014 339 1HG GLN 46 HG2 GLN 46 -10.096 8.517 -8.473 340 2HG GLN 46 HG1 GLN 46 -11.611 8.607 -9.339 341 1HE2 GLN 46 1HE2 GLN 46 -10.951 10.844 -6.844 342 2HE2 GLN 46 2HE2 GLN 46 -10.670 12.219 -7.848 343 H GLY 47 HN GLY 47 -9.062 10.055 -5.889 344 1HA GLY 47 HA1 GLY 47 -10.433 12.047 -4.312 345 2HA GLY 47 HA2 GLY 47 -8.788 12.146 -4.920 346 H GLY 48 HN GLY 48 -8.708 9.252 -3.523 347 1HA GLY 48 HA1 GLY 48 -8.574 8.606 -1.212 348 2HA GLY 48 HA2 GLY 48 -8.329 10.284 -0.784 349 H VAL 49 HN VAL 49 -6.334 11.169 -0.847 350 HA VAL 49 HA VAL 49 -4.093 9.608 -1.741 351 HB VAL 49 HB VAL 49 -4.177 12.012 0.062 352 1HG1 VAL 49 2HG1 VAL 49 -2.066 10.808 0.213 353 2HG1 VAL 49 1HG1 VAL 49 -1.898 10.861 -1.542 354 3HG1 VAL 49 3HG1 VAL 49 -1.837 12.354 -0.602 355 1HG2 VAL 49 3HG2 VAL 49 -5.216 12.395 -2.174 356 2HG2 VAL 49 2HG2 VAL 49 -3.822 13.415 -1.832 357 3HG2 VAL 49 1HG2 VAL 49 -3.657 12.028 -2.900 358 H PHE 50 HN PHE 50 -3.981 7.700 -0.669 359 HA PHE 50 HA PHE 50 -4.447 7.597 2.173 360 1HB PHE 50 HB2 PHE 50 -3.832 5.545 0.089 361 2HB PHE 50 HB1 PHE 50 -3.903 5.152 1.791 362 HD1 PHE 50 HD1 PHE 50 -6.013 5.290 2.999 363 HD2 PHE 50 HD2 PHE 50 -5.748 6.046 -1.187 364 HE1 PHE 50 HE1 PHE 50 -8.466 5.080 2.803 365 HE2 PHE 50 HE2 PHE 50 -8.183 5.860 -1.375 366 HZ PHE 50 HZ PHE 50 -9.512 5.387 0.609 367 H PHE 51 HN PHE 51 -2.908 6.020 3.392 368 HA PHE 51 HA PHE 51 -0.223 7.198 3.194 369 1HB PHE 51 HB2 PHE 51 -1.655 6.803 5.812 370 2HB PHE 51 HB1 PHE 51 -0.261 7.820 5.475 371 HD1 PHE 51 HD1 PHE 51 -3.885 7.474 4.678 372 HD2 PHE 51 HD2 PHE 51 -0.543 10.082 5.151 373 HE1 PHE 51 HE1 PHE 51 -5.361 9.429 4.419 374 HE2 PHE 51 HE2 PHE 51 -1.994 12.024 4.897 375 HZ PHE 51 HZ PHE 51 -4.497 11.646 4.489 376 H LEU 52 HN LEU 52 1.237 5.618 3.128 377 HA LEU 52 HA LEU 52 0.673 3.115 4.571 378 1HB LEU 52 HB2 LEU 52 1.942 3.558 1.869 379 2HB LEU 52 HB1 LEU 52 2.255 2.107 2.791 380 HG LEU 52 HG LEU 52 0.578 1.722 1.067 381 1HD1 LEU 52 3HD1 LEU 52 0.471 0.397 3.081 382 2HD1 LEU 52 2HD1 LEU 52 -0.565 1.600 3.838 383 3HD1 LEU 52 1HD1 LEU 52 -1.145 0.692 2.445 384 1HD2 LEU 52 3HD2 LEU 52 -1.085 3.773 2.503 385 2HD2 LEU 52 2HD2 LEU 52 -0.381 3.932 0.895 386 3HD2 LEU 52 1HD2 LEU 52 -1.638 2.732 1.191 387 H THR 53 HN THR 53 2.125 2.739 6.158 388 HA THR 53 HA THR 53 4.760 4.042 5.937 389 HB THR 53 HB THR 53 3.662 2.732 8.427 390 HG1 THR 53 HG1 THR 53 2.748 4.928 7.265 391 1HG2 THR 53 3HG2 THR 53 5.867 4.766 7.955 392 2HG2 THR 53 2HG2 THR 53 5.340 4.178 9.536 393 3HG2 THR 53 1HG2 THR 53 6.087 3.068 8.384 394 H ILE 54 HN ILE 54 6.452 2.829 5.454 395 HA ILE 54 HA ILE 54 6.026 -0.085 5.386 396 HB ILE 54 HB ILE 54 8.156 1.198 3.753 397 1HG1 ILE 54 2HG1 ILE 54 6.204 2.693 3.391 398 2HG1 ILE 54 1HG1 ILE 54 6.620 1.783 1.943 399 1HG2 ILE 54 2HG2 ILE 54 6.212 -1.047 3.251 400 2HG2 ILE 54 1HG2 ILE 54 7.509 -0.550 2.161 401 3HG2 ILE 54 3HG2 ILE 54 7.896 -1.206 3.754 402 1HD1 ILE 54 2HD1 ILE 54 4.373 1.141 3.835 403 2HD1 ILE 54 1HD1 ILE 54 4.221 1.928 2.263 404 3HD1 ILE 54 3HD1 ILE 54 4.779 0.261 2.366 405 H HIS 55 HN HIS 55 7.535 -1.410 6.324 406 HA HIS 55 HA HIS 55 9.991 -0.147 7.262 407 1HB HIS 55 HB2 HIS 55 10.000 -1.539 9.272 408 2HB HIS 55 HB1 HIS 55 8.665 -0.405 9.206 409 HD1 HIS 55 HD1 HIS 55 6.762 -1.450 10.265 410 HD2 HIS 55 HD2 HIS 55 8.850 -4.086 7.853 411 HE1 HIS 55 HE1 HIS 55 5.475 -3.565 10.322 412 HE2 HIS 55 HE2 HIS 55 6.924 -5.255 9.150 413 H PHE 56 HN PHE 56 11.885 -1.415 7.366 414 HA PHE 56 HA PHE 56 11.671 -3.939 5.857 415 1HB PHE 56 HB2 PHE 56 13.708 -3.549 4.790 416 2HB PHE 56 HB1 PHE 56 12.835 -2.042 4.640 417 HD1 PHE 56 HD1 PHE 56 15.671 -3.783 6.219 418 HD2 PHE 56 HD2 PHE 56 13.707 -0.071 5.634 419 HE1 PHE 56 HE1 PHE 56 17.670 -2.607 7.033 420 HE2 PHE 56 HE2 PHE 56 15.674 1.122 6.444 421 HZ PHE 56 HZ PHE 56 17.680 -0.144 7.156 422 HA PRO 57 HA PRO 57 14.632 -5.524 8.823 423 1HB PRO 57 HB2 PRO 57 14.577 -8.080 7.837 424 2HB PRO 57 HB1 PRO 57 13.463 -7.485 9.067 425 1HG PRO 57 HG2 PRO 57 12.919 -8.198 6.307 426 2HG PRO 57 HG1 PRO 57 11.776 -7.826 7.604 427 1HD PRO 57 HD2 PRO 57 12.707 -6.122 5.429 428 2HD PRO 57 HD1 PRO 57 11.374 -5.855 6.566 429 H THR 58 HN THR 58 16.792 -5.655 8.424 430 HA THR 58 HA THR 58 18.073 -5.265 6.039 431 HB THR 58 HB THR 58 19.885 -6.739 7.499 432 HG1 THR 58 HG1 THR 58 18.749 -7.069 9.310 433 1HG2 THR 58 1HG2 THR 58 19.161 -3.824 7.792 434 2HG2 THR 58 3HG2 THR 58 20.681 -4.553 8.305 435 3HG2 THR 58 2HG2 THR 58 20.257 -4.509 6.594 436 H ASP 59 HN ASP 59 16.567 -6.788 4.865 437 HA ASP 59 HA ASP 59 17.520 -9.571 4.864 438 1HB ASP 59 HB2 ASP 59 14.906 -8.343 4.462 439 2HB ASP 59 HB1 ASP 59 15.338 -9.430 3.147 440 H TYR 60 HN TYR 60 18.212 -6.797 3.303 441 HA TYR 60 HA TYR 60 18.055 -7.305 0.608 442 1HB TYR 60 HB2 TYR 60 19.630 -5.601 0.308 443 2HB TYR 60 HB1 TYR 60 18.764 -5.163 1.762 444 HD1 TYR 60 HD1 TYR 60 21.877 -5.184 0.324 445 HD2 TYR 60 HD2 TYR 60 19.984 -6.312 3.964 446 HE1 TYR 60 HE1 TYR 60 24.029 -4.997 1.494 447 HE2 TYR 60 HE2 TYR 60 22.130 -6.124 5.142 448 HH TYR 60 HH TYR 60 24.548 -6.200 4.615 449 HA PRO 61 HA PRO 61 19.839 -6.818 -1.303 450 1HB PRO 61 HB2 PRO 61 19.990 -9.074 -3.174 451 2HB PRO 61 HB1 PRO 61 20.893 -7.558 -3.165 452 1HG PRO 61 HG2 PRO 61 22.058 -9.899 -2.553 453 2HG PRO 61 HG1 PRO 61 22.527 -8.387 -1.755 454 1HD PRO 61 HD2 PRO 61 20.742 -10.580 -0.761 455 2HD PRO 61 HD1 PRO 61 22.011 -9.682 0.100 456 H PHE 62 HN PHE 62 18.197 -9.744 -0.491 457 HA PHE 62 HA PHE 62 15.929 -9.414 -2.175 458 1HB PHE 62 HB2 PHE 62 16.352 -11.529 -1.023 459 2HB PHE 62 HB1 PHE 62 16.185 -10.750 0.541 460 HD1 PHE 62 HD1 PHE 62 14.473 -12.361 -2.189 461 HD2 PHE 62 HD2 PHE 62 13.930 -9.865 1.229 462 HE1 PHE 62 HE1 PHE 62 12.075 -12.940 -2.146 463 HE2 PHE 62 HE2 PHE 62 11.539 -10.457 1.264 464 HZ PHE 62 HZ PHE 62 10.618 -11.982 -0.402 465 H LYS 63 HN LYS 63 15.442 -9.215 1.275 466 HA LYS 63 HA LYS 63 14.538 -7.696 2.637 467 1HB LYS 63 HB2 LYS 63 16.200 -6.193 1.947 468 2HB LYS 63 HB1 LYS 63 15.346 -5.826 0.447 469 1HG LYS 63 HG2 LYS 63 13.718 -5.300 2.772 470 2HG LYS 63 HG1 LYS 63 15.228 -4.373 2.799 471 1HD LYS 63 HD2 LYS 63 14.651 -3.149 0.998 472 2HD LYS 63 HD1 LYS 63 13.892 -4.516 0.189 473 1HE LYS 63 HE2 LYS 63 11.995 -4.274 1.827 474 2HE LYS 63 HE1 LYS 63 12.722 -2.737 2.306 475 1HZ LYS 63 HZ3 LYS 63 12.631 -2.086 -0.072 476 2HZ LYS 63 HZ2 LYS 63 11.733 -3.483 -0.381 477 3HZ LYS 63 HZ1 LYS 63 11.108 -2.292 0.644 478 HA PRO 64 HA PRO 64 10.364 -7.557 0.971 479 1HB PRO 64 HB2 PRO 64 9.162 -8.686 3.105 480 2HB PRO 64 HB1 PRO 64 9.956 -9.643 1.855 481 1HG PRO 64 HG2 PRO 64 10.803 -9.091 4.619 482 2HG PRO 64 HG1 PRO 64 11.272 -10.415 3.544 483 1HD PRO 64 HD2 PRO 64 12.727 -8.018 4.147 484 2HD PRO 64 HD1 PRO 64 13.198 -9.339 3.064 485 HA PRO 65 HA PRO 65 9.473 -3.965 3.549 486 1HB PRO 65 HB2 PRO 65 8.097 -2.590 1.694 487 2HB PRO 65 HB1 PRO 65 9.859 -2.690 1.673 488 1HG PRO 65 HG2 PRO 65 7.873 -4.019 -0.070 489 2HG PRO 65 HG1 PRO 65 9.552 -3.572 -0.410 490 1HD PRO 65 HD2 PRO 65 8.554 -6.142 0.306 491 2HD PRO 65 HD1 PRO 65 10.250 -5.661 0.102 492 H LYS 66 HN LYS 66 7.979 -4.626 5.062 493 HA LYS 66 HA LYS 66 5.344 -5.482 4.241 494 1HB LYS 66 HB2 LYS 66 6.644 -6.162 6.415 495 2HB LYS 66 HB1 LYS 66 5.989 -4.665 7.069 496 1HG LYS 66 HG2 LYS 66 4.385 -6.957 5.924 497 2HG LYS 66 HG1 LYS 66 4.644 -6.643 7.635 498 1HD LYS 66 HD2 LYS 66 3.481 -4.490 5.946 499 2HD LYS 66 HD1 LYS 66 2.456 -5.846 6.418 500 1HE LYS 66 HE2 LYS 66 4.050 -4.178 8.356 501 2HE LYS 66 HE1 LYS 66 2.366 -3.865 7.941 502 1HZ LYS 66 HZ3 LYS 66 3.347 -6.426 9.083 503 2HZ LYS 66 HZ2 LYS 66 2.668 -5.182 10.002 504 3HZ LYS 66 HZ1 LYS 66 1.735 -5.976 8.838 505 H VAL 67 HN VAL 67 4.082 -4.063 3.393 506 HA VAL 67 HA VAL 67 4.196 -1.270 4.019 507 HB VAL 67 HB VAL 67 2.569 -1.034 2.266 508 1HG1 VAL 67 2HG1 VAL 67 4.891 -1.462 1.579 509 2HG1 VAL 67 1HG1 VAL 67 4.529 -3.179 1.477 510 3HG1 VAL 67 3HG1 VAL 67 3.731 -2.046 0.389 511 1HG2 VAL 67 2HG2 VAL 67 2.252 -4.021 2.440 512 2HG2 VAL 67 1HG2 VAL 67 1.028 -2.791 2.751 513 3HG2 VAL 67 3HG2 VAL 67 1.627 -3.046 1.112 514 H ALA 68 HN ALA 68 2.842 -0.207 5.421 515 HA ALA 68 HA ALA 68 0.504 -1.715 6.345 516 1HB ALA 68 HB2 ALA 68 2.334 -1.815 8.011 517 2HB ALA 68 HB3 ALA 68 0.879 -1.032 8.627 518 3HB ALA 68 HB1 ALA 68 2.269 -0.060 8.142 519 H PHE 69 HN PHE 69 -1.299 -0.736 6.048 520 HA PHE 69 HA PHE 69 -1.629 1.918 5.335 521 1HB PHE 69 HB2 PHE 69 -3.355 -0.314 5.888 522 2HB PHE 69 HB1 PHE 69 -4.057 1.213 6.404 523 HD1 PHE 69 HD1 PHE 69 -4.058 3.110 4.673 524 HD2 PHE 69 HD2 PHE 69 -3.509 -0.989 3.687 525 HE1 PHE 69 HE1 PHE 69 -4.790 3.564 2.369 526 HE2 PHE 69 HE2 PHE 69 -4.240 -0.525 1.375 527 HZ PHE 69 HZ PHE 69 -4.862 1.747 0.723 528 H THR 70 HN THR 70 -1.237 3.636 6.484 529 HA THR 70 HA THR 70 -1.336 3.721 9.342 530 HB THR 70 HB THR 70 -1.453 6.105 7.498 531 HG1 THR 70 HG1 THR 70 0.954 4.858 8.393 532 1HG2 THR 70 1HG2 THR 70 -1.715 6.539 9.894 533 2HG2 THR 70 3HG2 THR 70 -0.195 5.709 10.216 534 3HG2 THR 70 2HG2 THR 70 -0.203 7.206 9.282 535 H THR 71 HN THR 71 -3.476 4.703 6.723 536 HA THR 71 HA THR 71 -5.366 5.866 8.605 537 HB THR 71 HB THR 71 -4.717 7.005 6.418 538 HG1 THR 71 HG1 THR 71 -6.711 7.922 6.315 539 1HG2 THR 71 2HG2 THR 71 -6.534 4.891 5.286 540 2HG2 THR 71 1HG2 THR 71 -5.992 6.345 4.446 541 3HG2 THR 71 3HG2 THR 71 -4.821 5.120 4.926 542 H ARG 72 HN ARG 72 -7.733 5.471 7.463 543 HA ARG 72 HA ARG 72 -8.289 2.703 8.090 544 1HB ARG 72 HB2 ARG 72 -9.931 5.192 7.794 545 2HB ARG 72 HB1 ARG 72 -10.710 3.619 7.764 546 1HG ARG 72 HG2 ARG 72 -10.779 4.697 9.962 547 2HG ARG 72 HG1 ARG 72 -9.948 3.140 9.995 548 1HD ARG 72 HD2 ARG 72 -7.804 4.544 9.719 549 2HD ARG 72 HD1 ARG 72 -8.808 5.908 10.215 550 HE ARG 72 HE ARG 72 -8.844 3.567 11.945 551 1HH1 ARG 72 1HH1 ARG 72 -7.606 6.794 11.364 552 2HH1 ARG 72 2HH1 ARG 72 -7.002 6.992 12.976 553 1HH2 ARG 72 1HH2 ARG 72 -8.024 3.809 14.058 554 2HH2 ARG 72 2HH2 ARG 72 -7.234 5.288 14.510 555 H ILE 73 HN ILE 73 -9.027 1.191 6.614 556 HA ILE 73 HA ILE 73 -9.950 2.001 4.000 557 HB ILE 73 HB ILE 73 -7.745 2.181 3.397 558 1HG1 ILE 73 2HG1 ILE 73 -7.047 -0.043 2.272 559 2HG1 ILE 73 1HG1 ILE 73 -8.603 -0.648 2.824 560 1HG2 ILE 73 2HG2 ILE 73 -7.157 -0.235 5.108 561 2HG2 ILE 73 1HG2 ILE 73 -5.960 0.643 4.156 562 3HG2 ILE 73 3HG2 ILE 73 -6.783 1.445 5.492 563 1HD1 ILE 73 1HD1 ILE 73 -9.675 1.239 1.586 564 2HD1 ILE 73 3HD1 ILE 73 -8.084 1.643 0.936 565 3HD1 ILE 73 2HD1 ILE 73 -8.820 0.082 0.565 566 H TYR 74 HN TYR 74 -11.214 0.532 3.101 567 HA TYR 74 HA TYR 74 -11.358 -2.192 4.212 568 1HB TYR 74 HB2 TYR 74 -13.426 -0.215 3.507 569 2HB TYR 74 HB1 TYR 74 -13.715 -1.829 2.864 570 HD1 TYR 74 HD1 TYR 74 -13.673 0.248 5.806 571 HD2 TYR 74 HD2 TYR 74 -13.872 -3.730 4.372 572 HE1 TYR 74 HE1 TYR 74 -14.514 -0.512 8.014 573 HE2 TYR 74 HE2 TYR 74 -14.680 -4.514 6.541 574 HH TYR 74 HH TYR 74 -15.757 -2.362 8.985 575 H HIS 75 HN HIS 75 -10.369 -3.535 2.880 576 HA HIS 75 HA HIS 75 -11.303 -3.908 0.230 577 1HB HIS 75 HB2 HIS 75 -9.938 -1.967 -0.304 578 2HB HIS 75 HB1 HIS 75 -8.545 -2.690 0.499 579 HD1 HIS 75 HD1 HIS 75 -10.755 -3.191 -2.520 580 HD2 HIS 75 HD2 HIS 75 -7.047 -4.371 -1.071 581 HE1 HIS 75 HE1 HIS 75 -9.732 -4.583 -4.344 582 HE2 HIS 75 HE2 HIS 75 -7.608 -5.478 -3.336 583 HA PRO 76 HA PRO 76 -9.725 -7.929 1.319 584 1HB PRO 76 HB2 PRO 76 -9.911 -9.025 -1.197 585 2HB PRO 76 HB1 PRO 76 -11.263 -8.884 -0.074 586 1HG PRO 76 HG2 PRO 76 -10.519 -7.120 -2.367 587 2HG PRO 76 HG1 PRO 76 -12.120 -7.691 -1.862 588 1HD PRO 76 HD2 PRO 76 -11.278 -5.214 -1.294 589 2HD PRO 76 HD1 PRO 76 -12.276 -6.136 -0.153 590 H ASN 77 HN ASN 77 -7.683 -7.249 1.758 591 HA ASN 77 HA ASN 77 -5.550 -8.438 0.772 592 1HB ASN 77 HB2 ASN 77 -6.111 -6.120 -1.002 593 2HB ASN 77 HB1 ASN 77 -4.446 -6.280 -0.452 594 1HD2 ASN 77 1HD2 ASN 77 -5.432 -6.554 -3.145 595 2HD2 ASN 77 2HD2 ASN 77 -5.068 -8.160 -3.654 596 H ILE 78 HN ILE 78 -7.017 -5.800 2.297 597 HA ILE 78 HA ILE 78 -4.611 -5.248 3.832 598 HB ILE 78 HB ILE 78 -7.175 -3.655 3.555 599 1HG1 ILE 78 2HG1 ILE 78 -5.386 -1.902 3.036 600 2HG1 ILE 78 1HG1 ILE 78 -4.322 -3.256 2.889 601 1HG2 ILE 78 3HG2 ILE 78 -6.324 -3.698 5.918 602 2HG2 ILE 78 2HG2 ILE 78 -4.811 -3.025 5.299 603 3HG2 ILE 78 1HG2 ILE 78 -6.306 -2.102 5.160 604 1HD1 ILE 78 3HD1 ILE 78 -5.732 -4.175 1.097 605 2HD1 ILE 78 2HD1 ILE 78 -6.738 -2.730 1.206 606 3HD1 ILE 78 1HD1 ILE 78 -5.053 -2.592 0.705 607 H ASN 79 HN ASN 79 -4.544 -5.606 5.911 608 HA ASN 79 HA ASN 79 -6.872 -6.801 7.244 609 1HB ASN 79 HB2 ASN 79 -5.451 -8.280 8.434 610 2HB ASN 79 HB1 ASN 79 -4.883 -8.328 6.771 611 1HD2 ASN 79 1HD2 ASN 79 -3.540 -5.781 6.955 612 2HD2 ASN 79 2HD2 ASN 79 -2.131 -6.056 7.899 613 H SER 80 HN SER 80 -6.562 -6.571 9.739 614 HA SER 80 HA SER 80 -7.222 -4.083 10.448 615 1HB SER 80 HB2 SER 80 -5.584 -5.819 12.281 616 2HB SER 80 HB1 SER 80 -6.893 -4.714 12.706 617 HG SER 80 HG SER 80 -7.165 -7.227 12.319 618 H ASN 81 HN ASN 81 -3.813 -5.163 10.302 619 HA ASN 81 HA ASN 81 -2.972 -2.570 11.370 620 1HB ASN 81 HB2 ASN 81 -0.689 -3.618 11.436 621 2HB ASN 81 HB1 ASN 81 -1.897 -4.414 12.444 622 1HD2 ASN 81 1HD2 ASN 81 -2.520 -6.481 11.985 623 2HD2 ASN 81 2HD2 ASN 81 -1.744 -7.462 10.791 624 H GLY 82 HN GLY 82 -3.983 -3.022 8.575 625 1HA GLY 82 HA1 GLY 82 -2.320 -1.132 7.350 626 2HA GLY 82 HA2 GLY 82 -3.651 -1.997 6.596 627 H SER 83 HN SER 83 -1.827 -4.423 7.578 628 HA SER 83 HA SER 83 0.293 -4.415 5.662 629 1HB SER 83 HB2 SER 83 0.231 -5.873 7.725 630 2HB SER 83 HB1 SER 83 -1.017 -6.822 6.917 631 HG SER 83 HG SER 83 0.452 -7.406 5.352 632 H ILE 84 HN ILE 84 0.123 -4.743 3.565 633 HA ILE 84 HA ILE 84 -2.410 -5.708 2.518 634 HB ILE 84 HB ILE 84 -0.238 -4.065 1.261 635 1HG1 ILE 84 2HG1 ILE 84 -3.143 -3.555 1.845 636 2HG1 ILE 84 1HG1 ILE 84 -1.788 -2.930 2.782 637 1HG2 ILE 84 2HG2 ILE 84 -1.060 -5.620 -0.427 638 2HG2 ILE 84 1HG2 ILE 84 -2.719 -5.147 -0.059 639 3HG2 ILE 84 3HG2 ILE 84 -1.605 -3.978 -0.763 640 1HD1 ILE 84 3HD1 ILE 84 -1.029 -1.802 0.654 641 2HD1 ILE 84 2HD1 ILE 84 -2.613 -2.212 -0.004 642 3HD1 ILE 84 1HD1 ILE 84 -2.486 -1.170 1.412 643 H CYS 85 HN CYS 85 -2.619 -7.428 1.286 644 HA CYS 85 HA CYS 85 -0.450 -9.283 1.018 645 1HB CYS 85 HB2 CYS 85 -3.049 -9.701 1.332 646 2HB CYS 85 HB1 CYS 85 -3.073 -9.523 -0.422 647 HG CYS 85 HG CYS 85 -3.030 -12.153 -0.337 648 H LEU 86 HN LEU 86 1.086 -8.297 -0.303 649 HA LEU 86 HA LEU 86 0.297 -7.935 -3.119 650 1HB LEU 86 HB2 LEU 86 2.141 -6.438 -1.362 651 2HB LEU 86 HB1 LEU 86 2.708 -6.732 -2.987 652 HG LEU 86 HG LEU 86 0.132 -5.327 -2.285 653 1HD1 LEU 86 1HD1 LEU 86 2.778 -4.274 -3.262 654 2HD1 LEU 86 3HD1 LEU 86 1.295 -3.334 -3.118 655 3HD1 LEU 86 2HD1 LEU 86 2.061 -3.998 -1.674 656 1HD2 LEU 86 1HD2 LEU 86 1.531 -5.729 -4.923 657 2HD2 LEU 86 3HD2 LEU 86 0.026 -6.504 -4.425 658 3HD2 LEU 86 2HD2 LEU 86 0.082 -4.758 -4.662 659 H ASP 87 HN ASP 87 0.951 -9.539 -4.357 660 HA ASP 87 HA ASP 87 2.660 -11.595 -3.617 661 1HB ASP 87 HB2 ASP 87 2.821 -12.095 -6.041 662 2HB ASP 87 HB1 ASP 87 1.164 -11.809 -5.519 663 H ILE 88 HN ILE 88 3.428 -8.618 -5.400 664 HA ILE 88 HA ILE 88 6.086 -9.152 -5.944 665 HB ILE 88 HB ILE 88 6.207 -6.492 -5.555 666 1HG1 ILE 88 2HG1 ILE 88 3.617 -6.998 -4.905 667 2HG1 ILE 88 1HG1 ILE 88 4.194 -5.454 -5.524 668 1HG2 ILE 88 1HG2 ILE 88 6.768 -7.690 -7.586 669 2HG2 ILE 88 3HG2 ILE 88 5.053 -7.932 -7.928 670 3HG2 ILE 88 2HG2 ILE 88 5.735 -6.307 -7.937 671 1HD1 ILE 88 3HD1 ILE 88 3.201 -7.686 -7.260 672 2HD1 ILE 88 2HD1 ILE 88 2.177 -6.363 -6.668 673 3HD1 ILE 88 1HD1 ILE 88 3.548 -6.016 -7.725 674 H LEU 89 HN LEU 89 4.807 -8.798 -2.863 675 HA LEU 89 HA LEU 89 7.488 -8.146 -1.852 676 1HB LEU 89 HB2 LEU 89 4.850 -7.686 -0.484 677 2HB LEU 89 HB1 LEU 89 6.424 -7.118 0.047 678 HG LEU 89 HG LEU 89 4.882 -6.196 -2.380 679 1HD1 LEU 89 3HD1 LEU 89 5.662 -4.803 0.170 680 2HD1 LEU 89 2HD1 LEU 89 4.954 -4.009 -1.236 681 3HD1 LEU 89 1HD1 LEU 89 4.031 -5.229 -0.356 682 1HD2 LEU 89 3HD2 LEU 89 7.681 -5.555 -1.502 683 2HD2 LEU 89 2HD2 LEU 89 7.133 -6.143 -3.074 684 3HD2 LEU 89 1HD2 LEU 89 6.744 -4.504 -2.558 685 H ARG 90 HN ARG 90 4.796 -10.323 -1.746 686 HA ARG 90 HA ARG 90 6.021 -11.823 0.473 687 1HB ARG 90 HB2 ARG 90 3.804 -12.920 0.690 688 2HB ARG 90 HB1 ARG 90 3.738 -11.175 0.914 689 1HG ARG 90 HG2 ARG 90 2.891 -10.888 -1.336 690 2HG ARG 90 HG1 ARG 90 3.027 -12.620 -1.630 691 1HD ARG 90 HD2 ARG 90 1.296 -11.385 0.504 692 2HD ARG 90 HD1 ARG 90 0.720 -11.832 -1.103 693 HE ARG 90 HE ARG 90 1.895 -13.799 0.766 694 1HH1 ARG 90 1HH1 ARG 90 -0.663 -12.853 -1.444 695 2HH1 ARG 90 2HH1 ARG 90 -1.428 -14.406 -1.411 696 1HH2 ARG 90 1HH2 ARG 90 0.895 -15.834 0.786 697 2HH2 ARG 90 2HH2 ARG 90 -0.544 -16.095 -0.151 698 H SER 91 HN SER 91 5.750 -11.941 -2.886 699 HA SER 91 HA SER 91 6.358 -14.787 -2.939 700 1HB SER 91 HB2 SER 91 3.901 -14.636 -3.096 701 2HB SER 91 HB1 SER 91 4.067 -13.607 -4.515 702 HG SER 91 HG SER 91 4.548 -16.348 -4.228 703 H GLN 92 HN GLN 92 6.068 -11.756 -4.731 704 HA GLN 92 HA GLN 92 7.648 -12.922 -6.909 705 1HB GLN 92 HB2 GLN 92 5.671 -10.611 -6.977 706 2HB GLN 92 HB1 GLN 92 6.633 -11.175 -8.347 707 1HG GLN 92 HG2 GLN 92 4.902 -13.096 -6.873 708 2HG GLN 92 HG1 GLN 92 4.176 -11.985 -8.029 709 1HE2 GLN 92 1HE2 GLN 92 7.401 -13.186 -8.516 710 2HE2 GLN 92 2HE2 GLN 92 7.025 -14.252 -9.820 711 H TRP 93 HN TRP 93 8.108 -11.085 -4.288 712 HA TRP 93 HA TRP 93 9.697 -8.979 -5.292 713 1HB TRP 93 HB2 TRP 93 8.901 -8.960 -2.984 714 2HB TRP 93 HB1 TRP 93 9.877 -10.367 -2.605 715 HD1 TRP 93 HD1 TRP 93 12.456 -9.905 -2.118 716 HE1 TRP 93 HE1 TRP 93 13.829 -7.740 -1.794 717 HE3 TRP 93 HE3 TRP 93 9.044 -6.489 -3.771 718 HZ2 TRP 93 HZ2 TRP 93 13.518 -5.000 -2.177 719 HZ3 TRP 93 HZ3 TRP 93 9.684 -4.113 -3.769 720 HH2 TRP 93 HH2 TRP 93 11.860 -3.379 -2.979 721 H SER 94 HN SER 94 11.919 -8.781 -5.270 722 HA SER 94 HA SER 94 13.672 -10.996 -5.026 723 1HB SER 94 HB2 SER 94 14.360 -11.005 -7.424 724 2HB SER 94 HB1 SER 94 12.704 -11.540 -7.212 725 HG SER 94 HG SER 94 11.970 -9.694 -8.065 726 HA PRO 95 HA PRO 95 16.545 -7.515 -4.776 727 1HB PRO 95 HB2 PRO 95 18.642 -8.390 -6.324 728 2HB PRO 95 HB1 PRO 95 18.389 -8.855 -4.641 729 1HG PRO 95 HG2 PRO 95 17.712 -10.340 -7.146 730 2HG PRO 95 HG1 PRO 95 18.387 -10.955 -5.625 731 1HD PRO 95 HD2 PRO 95 15.800 -11.260 -6.241 732 2HD PRO 95 HD1 PRO 95 16.328 -10.968 -4.574 733 H ALA 96 HN ALA 96 14.573 -6.930 -6.449 734 HA ALA 96 HA ALA 96 15.738 -5.442 -8.609 735 1HB ALA 96 HB3 ALA 96 14.156 -7.884 -9.369 736 2HB ALA 96 HB2 ALA 96 14.713 -6.638 -10.484 737 3HB ALA 96 HB1 ALA 96 15.881 -7.637 -9.620 738 H LEU 97 HN LEU 97 13.253 -5.796 -6.449 739 HA LEU 97 HA LEU 97 11.315 -4.475 -8.212 740 1HB LEU 97 HB2 LEU 97 11.072 -5.907 -5.602 741 2HB LEU 97 HB1 LEU 97 9.872 -4.716 -6.046 742 HG LEU 97 HG LEU 97 9.050 -6.904 -6.555 743 1HD1 LEU 97 1HD1 LEU 97 8.486 -5.076 -8.102 744 2HD1 LEU 97 3HD1 LEU 97 9.849 -5.531 -9.123 745 3HD1 LEU 97 2HD1 LEU 97 8.505 -6.649 -8.895 746 1HD2 LEU 97 1HD2 LEU 97 11.196 -8.061 -6.776 747 2HD2 LEU 97 3HD2 LEU 97 10.133 -8.392 -8.143 748 3HD2 LEU 97 2HD2 LEU 97 11.472 -7.256 -8.321 749 H THR 98 HN THR 98 10.247 -2.552 -7.467 750 HA THR 98 HA THR 98 11.754 -1.101 -5.401 751 HB THR 98 HB THR 98 11.331 0.986 -6.684 752 HG1 THR 98 HG1 THR 98 10.776 -0.495 -8.993 753 1HG2 THR 98 3HG2 THR 98 13.476 -0.214 -6.905 754 2HG2 THR 98 2HG2 THR 98 12.813 -1.130 -8.256 755 3HG2 THR 98 1HG2 THR 98 13.032 0.614 -8.398 756 H ILE 99 HN ILE 99 10.523 0.321 -4.133 757 HA ILE 99 HA ILE 99 7.765 -0.381 -3.797 758 HB ILE 99 HB ILE 99 8.497 2.196 -2.596 759 1HG1 ILE 99 2HG1 ILE 99 10.699 0.955 -2.590 760 2HG1 ILE 99 1HG1 ILE 99 10.083 1.266 -0.978 761 1HG2 ILE 99 1HG2 ILE 99 6.492 0.795 -2.112 762 2HG2 ILE 99 3HG2 ILE 99 7.549 -0.415 -1.401 763 3HG2 ILE 99 2HG2 ILE 99 7.427 1.184 -0.681 764 1HD1 ILE 99 1HD1 ILE 99 9.834 -1.341 -2.450 765 2HD1 ILE 99 3HD1 ILE 99 10.994 -0.979 -1.174 766 3HD1 ILE 99 2HD1 ILE 99 9.272 -1.016 -0.810 767 H SER 100 HN SER 100 9.594 2.074 -5.310 768 HA SER 100 HA SER 100 7.816 3.783 -6.372 769 1HB SER 100 HB2 SER 100 10.301 3.643 -6.763 770 2HB SER 100 HB1 SER 100 9.988 2.347 -7.922 771 HG SER 100 HG SER 100 10.173 4.723 -8.602 772 H LYS 101 HN LYS 101 8.334 0.393 -7.437 773 HA LYS 101 HA LYS 101 6.061 0.541 -9.199 774 1HB LYS 101 HB2 LYS 101 6.720 -1.475 -10.079 775 2HB LYS 101 HB1 LYS 101 8.248 -0.854 -9.487 776 1HG LYS 101 HG2 LYS 101 8.268 -3.090 -8.891 777 2HG LYS 101 HG1 LYS 101 7.818 -2.259 -7.403 778 1HD LYS 101 HD2 LYS 101 6.268 -3.933 -7.391 779 2HD LYS 101 HD1 LYS 101 5.386 -2.703 -8.309 780 1HE LYS 101 HE2 LYS 101 6.985 -4.971 -9.505 781 2HE LYS 101 HE1 LYS 101 5.238 -4.966 -9.302 782 1HZ LYS 101 HZ1 LYS 101 5.142 -3.017 -10.771 783 2HZ LYS 101 HZ3 LYS 101 6.810 -3.124 -11.015 784 3HZ LYS 101 HZ2 LYS 101 5.798 -4.370 -11.538 785 H VAL 102 HN VAL 102 6.665 -0.920 -5.988 786 HA VAL 102 HA VAL 102 4.239 -2.449 -6.116 787 HB VAL 102 HB VAL 102 4.772 -3.392 -4.125 788 1HG1 VAL 102 3HG1 VAL 102 7.305 -2.429 -5.326 789 2HG1 VAL 102 2HG1 VAL 102 7.310 -3.466 -3.906 790 3HG1 VAL 102 1HG1 VAL 102 6.560 -4.026 -5.403 791 1HG2 VAL 102 3HG2 VAL 102 5.892 -0.761 -3.298 792 2HG2 VAL 102 2HG2 VAL 102 4.618 -1.716 -2.551 793 3HG2 VAL 102 1HG2 VAL 102 6.297 -2.230 -2.411 794 H LEU 103 HN LEU 103 5.038 0.748 -4.965 795 HA LEU 103 HA LEU 103 2.762 1.073 -3.295 796 1HB LEU 103 HB2 LEU 103 4.432 3.122 -4.755 797 2HB LEU 103 HB1 LEU 103 3.158 3.526 -3.624 798 HG LEU 103 HG LEU 103 5.832 2.238 -3.033 799 1HD1 LEU 103 3HD1 LEU 103 4.425 4.741 -2.133 800 2HD1 LEU 103 2HD1 LEU 103 5.947 4.143 -1.468 801 3HD1 LEU 103 1HD1 LEU 103 5.849 4.619 -3.164 802 1HD2 LEU 103 3HD2 LEU 103 4.016 1.046 -1.792 803 2HD2 LEU 103 2HD2 LEU 103 5.123 1.934 -0.745 804 3HD2 LEU 103 1HD2 LEU 103 3.526 2.592 -1.099 805 H LEU 104 HN LEU 104 3.385 1.390 -6.694 806 HA LEU 104 HA LEU 104 0.869 2.561 -7.343 807 1HB LEU 104 HB2 LEU 104 2.839 1.080 -9.069 808 2HB LEU 104 HB1 LEU 104 1.404 1.907 -9.661 809 HG LEU 104 HG LEU 104 3.653 3.284 -8.196 810 1HD1 LEU 104 3HD1 LEU 104 4.369 2.375 -10.364 811 2HD1 LEU 104 2HD1 LEU 104 3.025 3.211 -11.139 812 3HD1 LEU 104 1HD1 LEU 104 4.307 4.138 -10.361 813 1HD2 LEU 104 2HD2 LEU 104 1.263 4.312 -9.729 814 2HD2 LEU 104 1HD2 LEU 104 1.507 4.410 -7.987 815 3HD2 LEU 104 3HD2 LEU 104 2.559 5.312 -9.076 816 H SER 105 HN SER 105 2.115 -0.667 -6.888 817 HA SER 105 HA SER 105 -0.221 -1.991 -7.834 818 1HB SER 105 HB2 SER 105 1.793 -3.077 -5.882 819 2HB SER 105 HB1 SER 105 0.716 -3.982 -6.944 820 HG SER 105 HG SER 105 1.865 -2.866 -8.709 821 H ILE 106 HN ILE 106 0.849 -0.915 -4.573 822 HA ILE 106 HA ILE 106 -1.471 -1.844 -3.253 823 HB ILE 106 HB ILE 106 0.288 0.528 -2.661 824 1HG1 ILE 106 2HG1 ILE 106 -0.042 -2.160 -1.295 825 2HG1 ILE 106 1HG1 ILE 106 1.349 -1.612 -2.228 826 1HG2 ILE 106 1HG2 ILE 106 -1.974 1.038 -1.881 827 2HG2 ILE 106 3HG2 ILE 106 -2.026 -0.493 -1.012 828 3HG2 ILE 106 2HG2 ILE 106 -0.890 0.758 -0.519 829 1HD1 ILE 106 2HD1 ILE 106 1.743 0.156 -0.551 830 2HD1 ILE 106 1HD1 ILE 106 0.409 -0.487 0.407 831 3HD1 ILE 106 3HD1 ILE 106 1.845 -1.467 0.123 832 H CYS 107 HN CYS 107 -0.675 1.136 -4.911 833 HA CYS 107 HA CYS 107 -3.089 2.479 -4.723 834 1HB CYS 107 HB2 CYS 107 -1.226 3.601 -5.688 835 2HB CYS 107 HB1 CYS 107 -1.048 2.368 -6.931 836 HG CYS 107 HG CYS 107 -3.732 4.483 -6.715 837 H SER 108 HN SER 108 -2.118 -0.148 -6.923 838 HA SER 108 HA SER 108 -4.411 0.182 -8.571 839 1HB SER 108 HB2 SER 108 -3.723 -1.863 -9.685 840 2HB SER 108 HB1 SER 108 -2.366 -0.759 -9.489 841 HG SER 108 HG SER 108 -1.810 -2.900 -8.957 842 H LEU 109 HN LEU 109 -3.841 -1.346 -5.600 843 HA LEU 109 HA LEU 109 -6.113 -3.124 -5.876 844 1HB LEU 109 HB2 LEU 109 -4.525 -2.444 -3.385 845 2HB LEU 109 HB1 LEU 109 -5.604 -3.813 -3.596 846 HG LEU 109 HG LEU 109 -3.085 -3.437 -5.209 847 1HD1 LEU 109 2HD1 LEU 109 -3.485 -5.063 -2.707 848 2HD1 LEU 109 1HD1 LEU 109 -2.060 -5.108 -3.747 849 3HD1 LEU 109 3HD1 LEU 109 -2.469 -3.632 -2.876 850 1HD2 LEU 109 3HD2 LEU 109 -4.811 -4.881 -6.191 851 2HD2 LEU 109 2HD2 LEU 109 -3.363 -5.781 -5.740 852 3HD2 LEU 109 1HD2 LEU 109 -4.804 -5.864 -4.727 853 H LEU 110 HN LEU 110 -5.311 -0.010 -4.730 854 HA LEU 110 HA LEU 110 -7.879 0.542 -3.526 855 1HB LEU 110 HB2 LEU 110 -5.358 2.018 -4.097 856 2HB LEU 110 HB1 LEU 110 -6.799 2.996 -3.872 857 HG LEU 110 HG LEU 110 -7.069 2.037 -1.630 858 1HD1 LEU 110 3HD1 LEU 110 -6.070 -0.184 -2.156 859 2HD1 LEU 110 2HD1 LEU 110 -4.480 0.579 -2.082 860 3HD1 LEU 110 1HD1 LEU 110 -5.504 0.532 -0.648 861 1HD2 LEU 110 2HD2 LEU 110 -5.624 4.030 -2.056 862 2HD2 LEU 110 1HD2 LEU 110 -5.239 3.143 -0.581 863 3HD2 LEU 110 3HD2 LEU 110 -4.235 2.944 -2.014 864 H CYS 111 HN CYS 111 -6.297 0.797 -6.561 865 HA CYS 111 HA CYS 111 -8.183 2.651 -7.712 866 1HB CYS 111 HB2 CYS 111 -5.783 2.873 -8.133 867 2HB CYS 111 HB1 CYS 111 -5.751 1.256 -8.826 868 HG CYS 111 HG CYS 111 -7.709 3.663 -10.252 869 H ASP 112 HN ASP 112 -7.017 -0.636 -8.380 870 HA ASP 112 HA ASP 112 -9.095 -1.089 -10.378 871 1HB ASP 112 HB2 ASP 112 -6.693 -1.589 -10.844 872 2HB ASP 112 HB1 ASP 112 -6.761 -2.849 -9.623 873 HA PRO 113 HA PRO 113 -9.126 -3.141 -5.630 874 1HB PRO 113 HB2 PRO 113 -11.961 -3.184 -6.583 875 2HB PRO 113 HB1 PRO 113 -11.335 -3.088 -4.928 876 1HG PRO 113 HG2 PRO 113 -11.976 -0.913 -6.590 877 2HG PRO 113 HG1 PRO 113 -11.052 -0.840 -5.080 878 1HD PRO 113 HD2 PRO 113 -10.048 -0.222 -7.604 879 2HD PRO 113 HD1 PRO 113 -9.056 -0.664 -6.195 880 H ASN 114 HN ASN 114 -8.055 -4.880 -6.011 881 HA ASN 114 HA ASN 114 -8.766 -7.051 -7.696 882 1HB ASN 114 HB2 ASN 114 -6.485 -6.865 -7.164 883 2HB ASN 114 HB1 ASN 114 -6.810 -6.611 -5.457 884 1HD2 ASN 114 1HD2 ASN 114 -7.499 -8.458 -4.186 885 2HD2 ASN 114 2HD2 ASN 114 -6.931 -10.020 -4.655 886 HA PRO 115 HA PRO 115 -11.412 -9.052 -4.618 887 1HB PRO 115 HB2 PRO 115 -13.046 -10.231 -6.329 888 2HB PRO 115 HB1 PRO 115 -13.037 -8.472 -6.178 889 1HG PRO 115 HG2 PRO 115 -11.933 -10.178 -8.345 890 2HG PRO 115 HG1 PRO 115 -12.602 -8.540 -8.435 891 1HD PRO 115 HD2 PRO 115 -9.843 -9.307 -8.241 892 2HD PRO 115 HD1 PRO 115 -10.518 -7.666 -8.284 893 H ASP 116 HN ASP 116 -8.858 -10.279 -6.148 894 HA ASP 116 HA ASP 116 -9.793 -13.013 -6.529 895 1HB ASP 116 HB2 ASP 116 -8.340 -11.837 -8.209 896 2HB ASP 116 HB1 ASP 116 -7.024 -11.939 -7.043 897 H ASP 117 HN ASP 117 -7.720 -11.262 -4.320 898 HA ASP 117 HA ASP 117 -7.181 -13.803 -2.954 899 1HB ASP 117 HB2 ASP 117 -5.210 -12.530 -4.079 900 2HB ASP 117 HB1 ASP 117 -5.347 -11.442 -2.700 901 HA PRO 118 HA PRO 118 -9.432 -11.435 0.160 902 1HB PRO 118 HB2 PRO 118 -10.338 -13.903 1.271 903 2HB PRO 118 HB1 PRO 118 -11.250 -12.764 0.281 904 1HG PRO 118 HG2 PRO 118 -10.527 -15.322 -0.498 905 2HG PRO 118 HG1 PRO 118 -10.980 -14.011 -1.598 906 1HD PRO 118 HD2 PRO 118 -8.264 -15.002 -0.847 907 2HD PRO 118 HD1 PRO 118 -8.868 -14.421 -2.416 908 H LEU 119 HN LEU 119 -7.654 -10.739 1.357 909 HA LEU 119 HA LEU 119 -6.031 -12.407 2.947 910 1HB LEU 119 HB2 LEU 119 -5.479 -10.074 2.239 911 2HB LEU 119 HB1 LEU 119 -6.657 -9.499 3.410 912 HG LEU 119 HG LEU 119 -5.340 -10.480 5.234 913 1HD1 LEU 119 2HD1 LEU 119 -3.414 -11.255 3.050 914 2HD1 LEU 119 1HD1 LEU 119 -3.069 -11.320 4.777 915 3HD1 LEU 119 3HD1 LEU 119 -4.328 -12.345 4.089 916 1HD2 LEU 119 1HD2 LEU 119 -4.935 -8.169 4.548 917 2HD2 LEU 119 3HD2 LEU 119 -3.469 -8.939 5.154 918 3HD2 LEU 119 2HD2 LEU 119 -3.698 -8.725 3.419 919 H VAL 120 HN VAL 120 -8.663 -10.206 3.904 920 HA VAL 120 HA VAL 120 -8.999 -11.777 6.380 921 HB VAL 120 HB VAL 120 -10.168 -9.069 5.727 922 1HG1 VAL 120 1HG1 VAL 120 -11.353 -10.294 7.475 923 2HG1 VAL 120 3HG1 VAL 120 -9.846 -10.519 8.359 924 3HG1 VAL 120 2HG1 VAL 120 -10.512 -8.902 8.147 925 1HG2 VAL 120 3HG2 VAL 120 -7.669 -9.713 7.290 926 2HG2 VAL 120 2HG2 VAL 120 -7.746 -8.904 5.724 927 3HG2 VAL 120 1HG2 VAL 120 -8.413 -8.119 7.158 928 HA PRO 121 HA PRO 121 -12.716 -13.681 4.773 929 1HB PRO 121 HB2 PRO 121 -13.599 -13.312 7.602 930 2HB PRO 121 HB1 PRO 121 -13.687 -14.748 6.575 931 1HG PRO 121 HG2 PRO 121 -11.812 -14.563 8.441 932 2HG PRO 121 HG1 PRO 121 -11.437 -15.248 6.850 933 1HD PRO 121 HD2 PRO 121 -10.738 -12.578 7.976 934 2HD PRO 121 HD1 PRO 121 -9.817 -13.614 6.866 935 H GLU 122 HN GLU 122 -13.209 -11.010 7.126 936 HA GLU 122 HA GLU 122 -15.767 -10.373 6.018 937 1HB GLU 122 HB2 GLU 122 -15.569 -8.273 7.361 938 2HB GLU 122 HB1 GLU 122 -15.511 -9.779 8.289 939 1HG GLU 122 HG2 GLU 122 -13.073 -9.605 8.408 940 2HG GLU 122 HG1 GLU 122 -13.129 -8.104 7.488 941 H ILE 123 HN ILE 123 -12.517 -9.000 5.682 942 HA ILE 123 HA ILE 123 -13.476 -6.756 4.206 943 HB ILE 123 HB ILE 123 -10.627 -7.679 3.960 944 1HG1 ILE 123 2HG1 ILE 123 -11.266 -7.806 6.380 945 2HG1 ILE 123 1HG1 ILE 123 -10.059 -6.570 6.035 946 1HG2 ILE 123 3HG2 ILE 123 -11.411 -5.751 2.691 947 2HG2 ILE 123 2HG2 ILE 123 -11.955 -4.992 4.193 948 3HG2 ILE 123 1HG2 ILE 123 -10.233 -5.281 3.917 949 1HD1 ILE 123 3HD1 ILE 123 -11.823 -4.899 5.991 950 2HD1 ILE 123 2HD1 ILE 123 -12.994 -6.166 6.401 951 3HD1 ILE 123 1HD1 ILE 123 -11.718 -5.740 7.550 952 H ALA 124 HN ALA 124 -12.693 -9.959 3.526 953 HA ALA 124 HA ALA 124 -12.670 -9.783 0.695 954 1HB ALA 124 HB2 ALA 124 -13.678 -12.039 2.426 955 2HB ALA 124 HB1 ALA 124 -13.238 -12.140 0.722 956 3HB ALA 124 HB3 ALA 124 -11.998 -11.811 1.936 957 H ARG 125 HN ARG 125 -15.241 -10.267 3.089 958 HA ARG 125 HA ARG 125 -17.303 -10.613 1.171 959 1HB ARG 125 HB2 ARG 125 -18.733 -10.904 2.939 960 2HB ARG 125 HB1 ARG 125 -17.217 -11.142 3.789 961 1HG ARG 125 HG2 ARG 125 -17.537 -9.349 5.066 962 2HG ARG 125 HG1 ARG 125 -17.995 -8.339 3.711 963 1HD ARG 125 HD2 ARG 125 -19.785 -8.527 5.362 964 2HD ARG 125 HD1 ARG 125 -20.243 -9.138 3.777 965 HE ARG 125 HE ARG 125 -19.314 -11.207 5.528 966 1HH1 ARG 125 1HH1 ARG 125 -22.090 -9.198 4.755 967 2HH1 ARG 125 2HH1 ARG 125 -23.250 -10.373 5.281 968 1HH2 ARG 125 1HH2 ARG 125 -20.872 -12.773 6.226 969 2HH2 ARG 125 2HH2 ARG 125 -22.559 -12.396 6.107 970 H ILE 126 HN ILE 126 -16.338 -7.890 3.193 971 HA ILE 126 HA ILE 126 -18.402 -6.219 2.533 972 HB ILE 126 HB ILE 126 -16.835 -4.361 3.177 973 1HG1 ILE 126 2HG1 ILE 126 -14.682 -5.442 4.263 974 2HG1 ILE 126 1HG1 ILE 126 -14.916 -6.619 2.978 975 1HG2 ILE 126 1HG2 ILE 126 -18.173 -5.584 4.838 976 2HG2 ILE 126 3HG2 ILE 126 -16.857 -6.748 5.021 977 3HG2 ILE 126 2HG2 ILE 126 -16.622 -5.066 5.499 978 1HD1 ILE 126 1HD1 ILE 126 -14.633 -3.651 2.557 979 2HD1 ILE 126 3HD1 ILE 126 -13.348 -4.842 2.354 980 3HD1 ILE 126 2HD1 ILE 126 -14.766 -4.889 1.309 981 H TYR 127 HN TYR 127 -15.645 -7.086 0.725 982 HA TYR 127 HA TYR 127 -16.234 -5.138 -1.359 983 1HB TYR 127 HB2 TYR 127 -13.882 -5.670 -1.006 984 2HB TYR 127 HB1 TYR 127 -14.209 -7.376 -1.304 985 HD1 TYR 127 HD1 TYR 127 -15.014 -8.052 -3.625 986 HD2 TYR 127 HD2 TYR 127 -13.391 -4.216 -2.792 987 HE1 TYR 127 HE1 TYR 127 -14.542 -7.726 -6.010 988 HE2 TYR 127 HE2 TYR 127 -12.917 -3.890 -5.173 989 HH TYR 127 HH TYR 127 -14.240 -5.739 -7.592 990 H LYS 128 HN LYS 128 -16.033 -8.673 -1.160 991 HA LYS 128 HA LYS 128 -17.172 -8.844 -3.838 992 1HB LYS 128 HB2 LYS 128 -16.261 -11.039 -3.893 993 2HB LYS 128 HB1 LYS 128 -15.053 -10.056 -3.066 994 1HG LYS 128 HG2 LYS 128 -16.272 -10.858 -0.917 995 2HG LYS 128 HG1 LYS 128 -16.894 -12.135 -1.960 996 1HD LYS 128 HD2 LYS 128 -13.983 -11.487 -1.492 997 2HD LYS 128 HD1 LYS 128 -14.872 -12.827 -0.767 998 1HE LYS 128 HE2 LYS 128 -14.416 -12.427 -3.730 999 2HE LYS 128 HE1 LYS 128 -13.508 -13.531 -2.703 1000 1HZ LYS 128 HZ1 LYS 128 -15.629 -14.676 -2.229 1001 2HZ LYS 128 HZ3 LYS 128 -16.399 -13.684 -3.362 1002 3HZ LYS 128 HZ2 LYS 128 -15.183 -14.748 -3.855 1003 H THR 129 HN THR 129 -18.637 -8.351 -1.173 1004 HA THR 129 HA THR 129 -20.726 -10.364 -1.501 1005 HB THR 129 HB THR 129 -19.358 -9.695 1.125 1006 HG1 THR 129 HG1 THR 129 -19.025 -11.702 -0.745 1007 1HG2 THR 129 3HG2 THR 129 -21.775 -10.030 1.409 1008 2HG2 THR 129 2HG2 THR 129 -21.685 -11.570 0.559 1009 3HG2 THR 129 1HG2 THR 129 -20.873 -11.373 2.112 1010 H ASP 130 HN ASP 130 -19.734 -7.685 0.627 1011 HA ASP 130 HA ASP 130 -22.480 -6.747 0.676 1012 1HB ASP 130 HB2 ASP 130 -21.175 -6.703 2.743 1013 2HB ASP 130 HB1 ASP 130 -19.988 -5.613 2.027 1014 H ARG 131 HN ARG 131 -19.380 -5.222 0.005 1015 HA ARG 131 HA ARG 131 -18.619 -4.323 -1.997 1016 1HB ARG 131 HB2 ARG 131 -20.558 -5.386 -3.208 1017 2HB ARG 131 HB1 ARG 131 -21.500 -3.954 -2.829 1018 1HG ARG 131 HG2 ARG 131 -20.754 -3.648 -5.028 1019 2HG ARG 131 HG1 ARG 131 -19.729 -2.619 -4.026 1020 1HD ARG 131 HD2 ARG 131 -17.977 -4.321 -4.056 1021 2HD ARG 131 HD1 ARG 131 -18.999 -5.356 -5.054 1022 HE ARG 131 HE ARG 131 -18.561 -2.767 -6.207 1023 1HH1 ARG 131 1HH1 ARG 131 -17.320 -6.019 -5.913 1024 2HH1 ARG 131 2HH1 ARG 131 -16.287 -5.893 -7.299 1025 1HH2 ARG 131 1HH2 ARG 131 -17.206 -2.585 -8.048 1026 2HH2 ARG 131 2HH2 ARG 131 -16.236 -3.939 -8.528 1027 H GLU 132 HN GLU 132 -21.405 -3.053 -0.300 1028 HA GLU 132 HA GLU 132 -20.755 -0.299 -0.734 1029 1HB GLU 132 HB2 GLU 132 -22.859 -0.097 -0.014 1030 2HB GLU 132 HB1 GLU 132 -22.894 -1.811 0.392 1031 1HG GLU 132 HG2 GLU 132 -22.036 -1.345 2.597 1032 2HG GLU 132 HG1 GLU 132 -21.892 0.372 2.207 1033 H LYS 133 HN LYS 133 -20.145 -2.714 1.755 1034 HA LYS 133 HA LYS 133 -19.082 -0.950 3.681 1035 1HB LYS 133 HB2 LYS 133 -18.611 -3.882 3.253 1036 2HB LYS 133 HB1 LYS 133 -18.042 -2.976 4.653 1037 1HG LYS 133 HG2 LYS 133 -20.852 -3.663 3.867 1038 2HG LYS 133 HG1 LYS 133 -19.999 -4.060 5.356 1039 1HD LYS 133 HD2 LYS 133 -20.055 -1.738 6.039 1040 2HD LYS 133 HD1 LYS 133 -20.813 -1.281 4.511 1041 1HE LYS 133 HE2 LYS 133 -22.000 -3.123 6.590 1042 2HE LYS 133 HE1 LYS 133 -22.453 -1.441 6.332 1043 1HZ LYS 133 HZ1 LYS 133 -22.731 -3.579 4.271 1044 2HZ LYS 133 HZ3 LYS 133 -23.980 -3.060 5.289 1045 3HZ LYS 133 HZ2 LYS 133 -23.309 -1.987 4.168 1046 H TYR 134 HN TYR 134 -17.763 -2.389 0.834 1047 HA TYR 134 HA TYR 134 -15.118 -1.498 1.458 1048 1HB TYR 134 HB2 TYR 134 -14.689 -3.173 0.096 1049 2HB TYR 134 HB1 TYR 134 -16.373 -3.337 -0.306 1050 HD1 TYR 134 HD1 TYR 134 -13.430 -1.201 -1.291 1051 HD2 TYR 134 HD2 TYR 134 -16.943 -3.266 -2.502 1052 HE1 TYR 134 HE1 TYR 134 -12.943 -0.652 -3.642 1053 HE2 TYR 134 HE2 TYR 134 -16.476 -2.709 -4.842 1054 HH TYR 134 HH TYR 134 -13.496 -1.495 -5.888 1055 H ASN 135 HN ASN 135 -17.555 -0.605 -1.030 1056 HA ASN 135 HA ASN 135 -16.113 1.580 -2.012 1057 1HB ASN 135 HB2 ASN 135 -19.009 0.826 -2.093 1058 2HB ASN 135 HB1 ASN 135 -18.504 2.392 -2.689 1059 1HD2 ASN 135 1HD2 ASN 135 -18.451 -0.979 -3.165 1060 2HD2 ASN 135 2HD2 ASN 135 -17.856 -0.974 -4.785 1061 H ARG 136 HN ARG 136 -19.016 1.736 0.057 1062 HA ARG 136 HA ARG 136 -18.966 4.551 0.155 1063 1HB ARG 136 HB2 ARG 136 -21.058 3.593 0.591 1064 2HB ARG 136 HB1 ARG 136 -20.398 2.441 1.745 1065 1HG ARG 136 HG2 ARG 136 -21.660 4.056 2.957 1066 2HG ARG 136 HG1 ARG 136 -19.951 4.348 3.285 1067 1HD ARG 136 HD2 ARG 136 -20.096 6.061 1.374 1068 2HD ARG 136 HD1 ARG 136 -21.842 5.947 1.602 1069 HE ARG 136 HE ARG 136 -20.070 6.584 3.877 1070 1HH1 ARG 136 1HH1 ARG 136 -22.704 7.468 1.730 1071 2HH1 ARG 136 2HH1 ARG 136 -23.184 8.838 2.675 1072 1HH2 ARG 136 1HH2 ARG 136 -20.678 8.380 5.104 1073 2HH2 ARG 136 2HH2 ARG 136 -22.031 9.357 4.618 1074 H ILE 137 HN ILE 137 -17.232 2.200 1.978 1075 HA ILE 137 HA ILE 137 -17.180 3.878 4.359 1076 HB ILE 137 HB ILE 137 -15.914 1.153 3.945 1077 1HG1 ILE 137 2HG1 ILE 137 -18.242 0.795 3.618 1078 2HG1 ILE 137 1HG1 ILE 137 -17.904 0.324 5.275 1079 1HG2 ILE 137 2HG2 ILE 137 -16.589 2.718 6.438 1080 2HG2 ILE 137 1HG2 ILE 137 -15.992 1.059 6.414 1081 3HG2 ILE 137 3HG2 ILE 137 -14.978 2.374 5.810 1082 1HD1 ILE 137 1HD1 ILE 137 -18.790 2.473 6.056 1083 2HD1 ILE 137 3HD1 ILE 137 -19.174 2.898 4.387 1084 3HD1 ILE 137 2HD1 ILE 137 -19.981 1.532 5.155 1085 H ALA 138 HN ALA 138 -14.909 2.174 2.255 1086 HA ALA 138 HA ALA 138 -12.651 3.618 3.126 1087 1HB ALA 138 HB1 ALA 138 -11.496 2.410 1.419 1088 2HB ALA 138 HB3 ALA 138 -12.666 1.336 2.201 1089 3HB ALA 138 HB2 ALA 138 -13.020 2.019 0.604 1090 H ARG 139 HN ARG 139 -15.135 4.277 0.783 1091 HA ARG 139 HA ARG 139 -13.581 6.249 -0.651 1092 1HB ARG 139 HB2 ARG 139 -15.487 5.056 -1.733 1093 2HB ARG 139 HB1 ARG 139 -16.588 5.885 -0.641 1094 1HG ARG 139 HG2 ARG 139 -15.786 8.050 -1.570 1095 2HG ARG 139 HG1 ARG 139 -14.837 7.138 -2.744 1096 1HD ARG 139 HD2 ARG 139 -17.834 7.109 -2.431 1097 2HD ARG 139 HD1 ARG 139 -16.921 7.845 -3.745 1098 HE ARG 139 HE ARG 139 -16.283 5.107 -3.586 1099 1HH1 ARG 139 1HH1 ARG 139 -18.876 7.250 -4.518 1100 2HH1 ARG 139 2HH1 ARG 139 -19.582 6.133 -5.640 1101 1HH2 ARG 139 1HH2 ARG 139 -17.207 3.608 -5.073 1102 2HH2 ARG 139 2HH2 ARG 139 -18.625 4.057 -5.961 1103 H GLU 140 HN GLU 140 -15.906 6.273 2.059 1104 HA GLU 140 HA GLU 140 -15.908 9.125 2.172 1105 1HB GLU 140 HB2 GLU 140 -16.832 8.925 4.395 1106 2HB GLU 140 HB1 GLU 140 -17.714 7.917 3.276 1107 1HG GLU 140 HG2 GLU 140 -16.505 5.971 4.181 1108 2HG GLU 140 HG1 GLU 140 -15.718 7.049 5.341 1109 H TRP 141 HN TRP 141 -14.095 6.594 3.839 1110 HA TRP 141 HA TRP 141 -12.305 8.202 5.212 1111 1HB TRP 141 HB2 TRP 141 -11.804 5.583 3.801 1112 2HB TRP 141 HB1 TRP 141 -10.673 6.345 4.923 1113 HD1 TRP 141 HD1 TRP 141 -13.263 7.297 6.865 1114 HE1 TRP 141 HE1 TRP 141 -14.118 5.507 8.498 1115 HE3 TRP 141 HE3 TRP 141 -11.376 3.157 4.587 1116 HZ2 TRP 141 HZ2 TRP 141 -13.995 2.718 8.775 1117 HZ3 TRP 141 HZ3 TRP 141 -11.781 0.965 5.618 1118 HH2 TRP 141 HH2 TRP 141 -13.065 0.759 7.678 1119 H THR 142 HN THR 142 -12.237 7.203 1.840 1120 HA THR 142 HA THR 142 -9.956 8.435 0.943 1121 HB THR 142 HB THR 142 -12.686 8.107 -0.252 1122 HG1 THR 142 HG1 THR 142 -11.248 6.305 -0.002 1123 1HG2 THR 142 2HG2 THR 142 -10.305 9.382 -1.581 1124 2HG2 THR 142 1HG2 THR 142 -11.753 8.824 -2.425 1125 3HG2 THR 142 3HG2 THR 142 -11.862 10.133 -1.248 1126 H GLN 143 HN GLN 143 -13.122 9.888 1.441 1127 HA GLN 143 HA GLN 143 -12.364 12.495 0.539 1128 1HB GLN 143 HB2 GLN 143 -14.779 11.367 1.925 1129 2HB GLN 143 HB1 GLN 143 -14.693 13.008 1.308 1130 1HG GLN 143 HG2 GLN 143 -14.435 12.177 -0.939 1131 2HG GLN 143 HG1 GLN 143 -14.369 10.521 -0.349 1132 1HE2 GLN 143 1HE2 GLN 143 -16.252 9.507 0.314 1133 2HE2 GLN 143 2HE2 GLN 143 -17.819 10.143 -0.035 1134 H LYS 144 HN LYS 144 -12.334 10.864 3.565 1135 HA LYS 144 HA LYS 144 -12.429 13.424 5.022 1136 1HB LYS 144 HB2 LYS 144 -13.515 10.700 5.710 1137 2HB LYS 144 HB1 LYS 144 -13.448 12.027 6.864 1138 1HG LYS 144 HG2 LYS 144 -15.098 13.208 5.776 1139 2HG LYS 144 HG1 LYS 144 -14.765 12.440 4.227 1140 1HD LYS 144 HD2 LYS 144 -16.894 11.668 5.131 1141 2HD LYS 144 HD1 LYS 144 -15.720 10.354 5.049 1142 1HE LYS 144 HE2 LYS 144 -16.970 10.281 7.132 1143 2HE LYS 144 HE1 LYS 144 -15.261 10.594 7.427 1144 1HZ LYS 144 HZ1 LYS 144 -15.791 12.960 7.643 1145 2HZ LYS 144 HZ3 LYS 144 -17.429 12.626 7.416 1146 3HZ LYS 144 HZ2 LYS 144 -16.627 12.035 8.780 1147 H TYR 145 HN TYR 145 -10.727 10.412 4.616 1148 HA TYR 145 HA TYR 145 -8.920 11.114 6.842 1149 1HB TYR 145 HB2 TYR 145 -9.859 8.368 5.987 1150 2HB TYR 145 HB1 TYR 145 -8.560 8.641 7.145 1151 HD1 TYR 145 HD1 TYR 145 -9.099 8.728 9.414 1152 HD2 TYR 145 HD2 TYR 145 -12.155 9.443 6.557 1153 HE1 TYR 145 HE1 TYR 145 -10.774 8.756 11.217 1154 HE2 TYR 145 HE2 TYR 145 -13.841 9.470 8.333 1155 HH TYR 145 HH TYR 145 -14.081 8.549 10.662 1156 H ALA 146 HN ALA 146 -8.987 11.377 3.758 1157 HA ALA 146 HA ALA 146 -6.197 10.720 3.541 1158 1HB ALA 146 HB3 ALA 146 -7.183 8.747 2.621 1159 2HB ALA 146 HB2 ALA 146 -8.290 9.690 1.624 1160 3HB ALA 146 HB1 ALA 146 -6.554 9.698 1.279 1161 H MET 147 HN MET 147 -8.178 11.375 0.813 1162 HA MET 147 HA MET 147 -7.730 12.986 -0.796 1163 1HB MET 147 HB2 MET 147 -9.491 14.558 -0.566 1164 2HB MET 147 HB1 MET 147 -10.005 13.048 0.173 1165 1HG MET 147 HG2 MET 147 -10.301 13.967 2.152 1166 2HG MET 147 HG1 MET 147 -8.798 14.890 2.066 1167 1HE MET 147 HE1 MET 147 -11.439 15.985 3.457 1168 2HE MET 147 HE3 MET 147 -9.962 16.948 3.341 1169 3HE MET 147 HE2 MET 147 -11.507 17.638 2.845 No H/Q in entry = 1169 Start of MODEL 8 1 H1 MET 1 HT3 MET 1 20.442 -5.978 3.439 2 H2 MET 1 HT2 MET 1 21.285 -6.144 1.985 3 H3 MET 1 HT1 MET 1 22.131 -5.911 3.426 4 HA MET 1 HA MET 1 21.179 -3.706 3.670 5 1HB MET 1 HB2 MET 1 22.351 -2.634 1.753 6 2HB MET 1 HB1 MET 1 23.324 -3.809 2.622 7 1HG MET 1 HG2 MET 1 22.865 -5.463 0.862 8 2HG MET 1 HG1 MET 1 21.927 -4.251 -0.009 9 1HE MET 1 HE3 MET 1 23.414 -4.851 -2.121 10 2HE MET 1 HE2 MET 1 25.160 -4.627 -2.205 11 3HE MET 1 HE1 MET 1 24.484 -5.934 -1.231 12 H ALA 2 HN ALA 2 18.831 -3.989 3.561 13 HA ALA 2 HA ALA 2 17.613 -3.643 0.955 14 1HB ALA 2 HB3 ALA 2 15.617 -3.125 2.769 15 2HB ALA 2 HB2 ALA 2 15.967 -4.695 2.053 16 3HB ALA 2 HB1 ALA 2 16.637 -4.275 3.633 17 H LEU 3 HN LEU 3 18.640 -1.669 3.600 18 HA LEU 3 HA LEU 3 16.909 0.538 3.026 19 1HB LEU 3 HB2 LEU 3 18.555 1.782 4.494 20 2HB LEU 3 HB1 LEU 3 17.705 0.446 5.234 21 HG LEU 3 HG LEU 3 19.840 -0.890 4.489 22 1HD1 LEU 3 2HD1 LEU 3 20.862 1.932 4.795 23 2HD1 LEU 3 1HD1 LEU 3 21.868 0.484 4.753 24 3HD1 LEU 3 3HD1 LEU 3 20.923 0.943 3.336 25 1HD2 LEU 3 2HD2 LEU 3 19.640 0.919 6.886 26 2HD2 LEU 3 1HD2 LEU 3 19.095 -0.750 6.762 27 3HD2 LEU 3 3HD2 LEU 3 20.819 -0.383 6.723 28 H LYS 4 HN LYS 4 19.788 -0.750 1.818 29 HA LYS 4 HA LYS 4 20.669 1.724 0.692 30 1HB LYS 4 HB2 LYS 4 22.663 0.770 0.649 31 2HB LYS 4 HB1 LYS 4 21.918 -0.536 1.546 32 1HG LYS 4 HG2 LYS 4 22.941 -1.724 -0.104 33 2HG LYS 4 HG1 LYS 4 21.371 -1.445 -0.858 34 1HD LYS 4 HD2 LYS 4 22.243 0.363 -2.164 35 2HD LYS 4 HD1 LYS 4 23.778 0.320 -1.292 36 1HE LYS 4 HE2 LYS 4 24.169 -1.950 -2.168 37 2HE LYS 4 HE1 LYS 4 22.673 -1.839 -3.089 38 1HZ LYS 4 HZ1 LYS 4 24.989 -0.013 -3.414 39 2HZ LYS 4 HZ3 LYS 4 24.651 -1.330 -4.414 40 3HZ LYS 4 HZ2 LYS 4 23.580 -0.028 -4.345 41 H ARG 5 HN ARG 5 18.750 -0.928 -0.130 42 HA ARG 5 HA ARG 5 18.649 -0.247 -2.949 43 1HB ARG 5 HB2 ARG 5 18.220 -2.537 -2.394 44 2HB ARG 5 HB1 ARG 5 16.943 -2.101 -1.246 45 1HG ARG 5 HG2 ARG 5 15.904 -2.840 -3.273 46 2HG ARG 5 HG1 ARG 5 15.684 -1.089 -3.109 47 1HD ARG 5 HD2 ARG 5 16.201 -1.539 -5.392 48 2HD ARG 5 HD1 ARG 5 17.593 -0.753 -4.656 49 HE ARG 5 HE ARG 5 17.977 -3.518 -4.520 50 1HH1 ARG 5 1HH1 ARG 5 17.769 -0.967 -6.910 51 2HH1 ARG 5 2HH1 ARG 5 18.777 -1.783 -8.064 52 1HH2 ARG 5 1HH2 ARG 5 19.341 -4.594 -6.048 53 2HH2 ARG 5 2HH2 ARG 5 19.669 -3.824 -7.573 54 H ILE 6 HN ILE 6 16.412 -0.322 -0.237 55 HA ILE 6 HA ILE 6 14.406 1.300 -1.104 56 HB ILE 6 HB ILE 6 15.619 1.436 1.662 57 1HG1 ILE 6 2HG1 ILE 6 13.708 -0.564 0.452 58 2HG1 ILE 6 1HG1 ILE 6 15.273 -0.865 1.215 59 1HG2 ILE 6 3HG2 ILE 6 12.898 2.093 0.581 60 2HG2 ILE 6 2HG2 ILE 6 13.225 1.864 2.300 61 3HG2 ILE 6 1HG2 ILE 6 14.032 3.156 1.413 62 1HD1 ILE 6 2HD1 ILE 6 14.356 -0.211 3.367 63 2HD1 ILE 6 1HD1 ILE 6 12.790 0.085 2.620 64 3HD1 ILE 6 3HD1 ILE 6 13.455 -1.546 2.656 65 H HIS 7 HN HIS 7 17.574 2.120 -0.035 66 HA HIS 7 HA HIS 7 17.774 4.742 0.409 67 1HB HIS 7 HB2 HIS 7 19.561 3.122 0.304 68 2HB HIS 7 HB1 HIS 7 19.394 3.017 -1.454 69 HD1 HIS 7 HD1 HIS 7 21.185 4.721 1.239 70 HD2 HIS 7 HD2 HIS 7 20.262 5.566 -2.724 71 HE1 HIS 7 HE1 HIS 7 22.776 6.533 0.548 72 HE2 HIS 7 HE2 HIS 7 22.064 7.170 -1.784 73 H LYS 8 HN LYS 8 17.863 3.384 -2.882 74 HA LYS 8 HA LYS 8 17.603 6.072 -3.971 75 1HB LYS 8 HB2 LYS 8 18.300 3.435 -5.211 76 2HB LYS 8 HB1 LYS 8 17.813 4.805 -6.192 77 1HG LYS 8 HG2 LYS 8 20.230 4.604 -4.412 78 2HG LYS 8 HG1 LYS 8 20.195 4.703 -6.170 79 1HD LYS 8 HD2 LYS 8 19.418 6.855 -4.206 80 2HD LYS 8 HD1 LYS 8 20.798 6.859 -5.300 81 1HE LYS 8 HE2 LYS 8 17.896 6.897 -6.129 82 2HE LYS 8 HE1 LYS 8 18.966 8.291 -6.103 83 1HZ LYS 8 HZ3 LYS 8 19.336 5.876 -7.789 84 2HZ LYS 8 HZ2 LYS 8 18.739 7.362 -8.322 85 3HZ LYS 8 HZ1 LYS 8 20.334 7.239 -7.782 86 H GLU 9 HN GLU 9 15.974 3.048 -3.662 87 HA GLU 9 HA GLU 9 13.990 3.471 -5.595 88 1HB GLU 9 HB2 GLU 9 13.817 1.832 -3.070 89 2HB GLU 9 HB1 GLU 9 12.817 1.645 -4.510 90 1HG GLU 9 HG2 GLU 9 15.737 1.000 -4.161 91 2HG GLU 9 HG1 GLU 9 14.426 -0.083 -4.604 92 H LEU 10 HN LEU 10 13.778 3.597 -2.094 93 HA LEU 10 HA LEU 10 11.288 4.777 -1.855 94 1HB LEU 10 HB2 LEU 10 11.864 4.290 0.256 95 2HB LEU 10 HB1 LEU 10 13.534 4.128 -0.202 96 HG LEU 10 HG LEU 10 12.486 6.859 0.279 97 1HD1 LEU 10 1HD1 LEU 10 11.766 5.580 2.226 98 2HD1 LEU 10 3HD1 LEU 10 13.406 4.963 2.417 99 3HD1 LEU 10 2HD1 LEU 10 13.084 6.686 2.627 100 1HD2 LEU 10 2HD2 LEU 10 14.735 6.496 -0.652 101 2HD2 LEU 10 1HD2 LEU 10 14.779 7.277 0.931 102 3HD2 LEU 10 3HD2 LEU 10 15.150 5.557 0.782 103 H ASN 11 HN ASN 11 14.466 6.096 -2.474 104 HA ASN 11 HA ASN 11 13.615 8.825 -2.121 105 1HB ASN 11 HB2 ASN 11 16.020 7.652 -1.937 106 2HB ASN 11 HB1 ASN 11 16.086 8.195 -3.611 107 1HD2 ASN 11 1HD2 ASN 11 15.882 10.448 -4.025 108 2HD2 ASN 11 2HD2 ASN 11 16.262 11.604 -2.800 109 H ASP 12 HN ASP 12 13.567 6.532 -4.609 110 HA ASP 12 HA ASP 12 13.794 8.339 -6.785 111 1HB ASP 12 HB2 ASP 12 14.318 5.872 -6.905 112 2HB ASP 12 HB1 ASP 12 12.589 5.550 -6.822 113 H LEU 13 HN LEU 13 11.298 7.193 -4.735 114 HA LEU 13 HA LEU 13 9.110 8.280 -6.144 115 1HB LEU 13 HB2 LEU 13 9.529 7.776 -3.211 116 2HB LEU 13 HB1 LEU 13 8.033 8.396 -3.875 117 HG LEU 13 HG LEU 13 7.720 6.066 -3.465 118 1HD1 LEU 13 1HD1 LEU 13 6.772 6.932 -5.548 119 2HD1 LEU 13 3HD1 LEU 13 8.218 6.401 -6.406 120 3HD1 LEU 13 2HD1 LEU 13 7.165 5.218 -5.634 121 1HD2 LEU 13 3HD2 LEU 13 10.073 5.425 -3.363 122 2HD2 LEU 13 2HD2 LEU 13 9.115 4.336 -4.371 123 3HD2 LEU 13 1HD2 LEU 13 10.167 5.535 -5.121 124 H ALA 14 HN ALA 14 11.413 9.556 -3.847 125 HA ALA 14 HA ALA 14 10.303 12.159 -3.649 126 1HB ALA 14 HB1 ALA 14 11.856 11.299 -1.976 127 2HB ALA 14 HB2 ALA 14 12.495 12.775 -2.704 128 3HB ALA 14 HB3 ALA 14 13.134 11.202 -3.189 129 H ARG 15 HN ARG 15 12.762 10.674 -5.672 130 HA ARG 15 HA ARG 15 13.687 12.900 -7.056 131 1HB ARG 15 HB2 ARG 15 13.366 10.025 -7.931 132 2HB ARG 15 HB1 ARG 15 14.243 11.237 -8.856 133 1HG ARG 15 HG2 ARG 15 15.051 10.985 -6.046 134 2HG ARG 15 HG1 ARG 15 15.385 9.573 -7.051 135 1HD ARG 15 HD2 ARG 15 16.221 12.415 -7.632 136 2HD ARG 15 HD1 ARG 15 17.271 11.136 -7.026 137 HE ARG 15 HE ARG 15 16.251 10.102 -9.324 138 1HH1 ARG 15 1HH1 ARG 15 17.866 13.124 -8.590 139 2HH1 ARG 15 2HH1 ARG 15 18.640 13.230 -10.137 140 1HH2 ARG 15 1HH2 ARG 15 17.241 10.251 -11.364 141 2HH2 ARG 15 2HH2 ARG 15 18.286 11.592 -11.719 142 H ASP 16 HN ASP 16 11.219 10.561 -8.155 143 HA ASP 16 HA ASP 16 9.835 12.772 -9.501 144 1HB ASP 16 HB2 ASP 16 11.237 11.636 -11.197 145 2HB ASP 16 HB1 ASP 16 10.433 10.116 -10.820 146 HA PRO 17 HA PRO 17 6.551 10.326 -7.585 147 1HB PRO 17 HB2 PRO 17 5.312 12.668 -6.641 148 2HB PRO 17 HB1 PRO 17 6.325 11.572 -5.701 149 1HG PRO 17 HG2 PRO 17 6.937 14.233 -6.380 150 2HG PRO 17 HG1 PRO 17 8.055 13.037 -5.711 151 1HD PRO 17 HD2 PRO 17 7.682 13.909 -8.536 152 2HD PRO 17 HD1 PRO 17 9.158 13.385 -7.697 153 HA PRO 18 HA PRO 18 4.489 11.419 -11.544 154 1HB PRO 18 HB2 PRO 18 3.071 8.917 -10.780 155 2HB PRO 18 HB1 PRO 18 3.771 9.388 -12.334 156 1HG PRO 18 HG2 PRO 18 4.993 7.598 -10.774 157 2HG PRO 18 HG1 PRO 18 5.921 8.794 -11.699 158 1HD PRO 18 HD2 PRO 18 5.287 8.727 -8.786 159 2HD PRO 18 HD1 PRO 18 6.754 9.293 -9.613 160 H ALA 19 HN ALA 19 2.553 9.744 -9.040 161 HA ALA 19 HA ALA 19 1.097 12.115 -8.393 162 1HB ALA 19 HB3 ALA 19 -0.393 10.050 -10.009 163 2HB ALA 19 HB1 ALA 19 0.068 11.662 -10.563 164 3HB ALA 19 HB2 ALA 19 -1.091 11.478 -9.247 165 H GLN 20 HN GLN 20 -0.001 8.752 -8.611 166 HA GLN 20 HA GLN 20 -1.099 8.934 -5.965 167 1HB GLN 20 HB2 GLN 20 -1.834 6.575 -6.438 168 2HB GLN 20 HB1 GLN 20 -2.419 7.791 -7.578 169 1HG GLN 20 HG2 GLN 20 0.058 6.197 -8.154 170 2HG GLN 20 HG1 GLN 20 -1.541 5.530 -8.468 171 1HE2 GLN 20 1HE2 GLN 20 -2.888 6.599 -9.973 172 2HE2 GLN 20 2HE2 GLN 20 -2.205 7.552 -11.243 173 H CYS 21 HN CYS 21 1.920 8.823 -6.305 174 HA CYS 21 HA CYS 21 2.366 6.806 -4.261 175 1HB CYS 21 HB2 CYS 21 4.227 5.786 -5.516 176 2HB CYS 21 HB1 CYS 21 2.686 5.594 -6.352 177 HG CYS 21 HG CYS 21 4.720 8.187 -7.162 178 H SER 22 HN SER 22 3.632 7.692 -2.729 179 HA SER 22 HA SER 22 6.093 8.934 -3.583 180 1HB SER 22 HB2 SER 22 4.571 10.860 -3.435 181 2HB SER 22 HB1 SER 22 4.185 10.423 -1.771 182 HG SER 22 HG SER 22 6.449 11.632 -2.822 183 H ALA 23 HN ALA 23 7.600 8.106 -2.439 184 HA ALA 23 HA ALA 23 7.245 7.594 0.438 185 1HB ALA 23 HB3 ALA 23 7.291 5.437 -0.514 186 2HB ALA 23 HB1 ALA 23 8.932 5.726 0.046 187 3HB ALA 23 HB2 ALA 23 8.551 5.877 -1.669 188 H GLY 24 HN GLY 24 9.252 7.694 1.581 189 1HA GLY 24 HA1 GLY 24 10.754 9.971 0.834 190 2HA GLY 24 HA2 GLY 24 11.705 8.508 0.588 191 HA PRO 25 HA PRO 25 12.730 8.016 4.784 192 1HB PRO 25 HB2 PRO 25 14.378 10.463 4.865 193 2HB PRO 25 HB1 PRO 25 14.858 8.776 5.066 194 1HG PRO 25 HG2 PRO 25 15.484 10.156 2.857 195 2HG PRO 25 HG1 PRO 25 15.090 8.429 2.799 196 1HD PRO 25 HD2 PRO 25 13.398 10.784 2.077 197 2HD PRO 25 HD1 PRO 25 13.540 9.207 1.274 198 H VAL 26 HN VAL 26 11.618 8.369 6.615 199 HA VAL 26 HA VAL 26 10.453 11.045 7.051 200 HB VAL 26 HB VAL 26 9.809 8.356 8.282 201 1HG1 VAL 26 1HG1 VAL 26 9.719 10.052 10.043 202 2HG1 VAL 26 3HG1 VAL 26 8.687 11.060 9.029 203 3HG1 VAL 26 2HG1 VAL 26 8.097 9.504 9.614 204 1HG2 VAL 26 2HG2 VAL 26 8.873 8.925 6.043 205 2HG2 VAL 26 1HG2 VAL 26 7.651 8.670 7.291 206 3HG2 VAL 26 3HG2 VAL 26 8.069 10.306 6.785 207 H GLY 27 HN GLY 27 11.998 8.470 8.948 208 1HA GLY 27 HA1 GLY 27 13.241 8.669 10.911 209 2HA GLY 27 HA2 GLY 27 13.075 10.431 10.817 210 H ASP 28 HN ASP 28 13.804 9.937 7.850 211 HA ASP 28 HA ASP 28 15.583 9.837 6.466 212 1HB ASP 28 HB2 ASP 28 17.012 10.459 9.017 213 2HB ASP 28 HB1 ASP 28 17.945 9.936 7.620 214 H ASP 29 HN ASP 29 14.745 7.687 8.711 215 HA ASP 29 HA ASP 29 16.614 5.593 8.134 216 1HB ASP 29 HB2 ASP 29 13.823 5.220 9.209 217 2HB ASP 29 HB1 ASP 29 15.242 4.222 9.505 218 H MET 30 HN MET 30 16.482 4.135 6.529 219 HA MET 30 HA MET 30 14.408 4.356 4.525 220 1HB MET 30 HB2 MET 30 17.049 3.216 4.780 221 2HB MET 30 HB1 MET 30 15.935 2.078 4.065 222 1HG MET 30 HG2 MET 30 16.266 3.085 2.138 223 2HG MET 30 HG1 MET 30 15.454 4.468 2.754 224 1HE MET 30 HE3 MET 30 16.525 6.641 3.592 225 2HE MET 30 HE2 MET 30 17.289 5.751 4.911 226 3HE MET 30 HE1 MET 30 18.248 6.843 3.912 227 H PHE 31 HN PHE 31 14.119 3.312 7.445 228 HA PHE 31 HA PHE 31 12.432 1.041 6.708 229 1HB PHE 31 HB2 PHE 31 12.946 0.329 9.171 230 2HB PHE 31 HB1 PHE 31 13.961 -0.205 7.849 231 HD1 PHE 31 HD1 PHE 31 13.737 1.761 10.901 232 HD2 PHE 31 HD2 PHE 31 16.188 0.840 7.545 233 HE1 PHE 31 HE1 PHE 31 15.681 2.732 12.056 234 HE2 PHE 31 HE2 PHE 31 18.134 1.806 8.695 235 HZ PHE 31 HZ PHE 31 17.863 2.708 11.027 236 H HIS 32 HN HIS 32 12.386 4.055 7.589 237 HA HIS 32 HA HIS 32 9.769 3.651 8.695 238 1HB HIS 32 HB2 HIS 32 10.808 3.814 10.773 239 2HB HIS 32 HB1 HIS 32 12.058 4.910 10.193 240 HD1 HIS 32 HD1 HIS 32 8.405 4.895 11.260 241 HD2 HIS 32 HD2 HIS 32 11.571 7.544 10.761 242 HE1 HIS 32 HE1 HIS 32 7.623 7.077 12.232 243 HE2 HIS 32 HE2 HIS 32 9.645 8.577 12.148 244 H TRP 33 HN TRP 33 9.018 4.421 6.815 245 HA TRP 33 HA TRP 33 9.613 7.147 6.067 246 1HB TRP 33 HB2 TRP 33 9.945 6.252 3.673 247 2HB TRP 33 HB1 TRP 33 11.270 6.251 4.798 248 HD1 TRP 33 HD1 TRP 33 11.452 3.594 6.089 249 HE1 TRP 33 HE1 TRP 33 11.536 1.390 4.803 250 HE3 TRP 33 HE3 TRP 33 9.443 5.189 1.727 251 HZ2 TRP 33 HZ2 TRP 33 10.906 0.469 2.234 252 HZ3 TRP 33 HZ3 TRP 33 9.267 3.597 -0.125 253 HH2 TRP 33 HH2 TRP 33 10.007 1.297 0.139 254 H GLN 34 HN GLN 34 8.296 7.828 4.174 255 HA GLN 34 HA GLN 34 5.560 7.058 4.959 256 1HB GLN 34 HB2 GLN 34 6.639 9.420 5.444 257 2HB GLN 34 HB1 GLN 34 6.207 9.722 3.765 258 1HG GLN 34 HG2 GLN 34 4.218 8.771 5.815 259 2HG GLN 34 HG1 GLN 34 4.533 10.474 5.498 260 1HE2 GLN 34 1HE2 GLN 34 2.108 8.826 5.153 261 2HE2 GLN 34 2HE2 GLN 34 1.647 9.035 3.501 262 H ALA 35 HN ALA 35 4.509 5.986 3.442 263 HA ALA 35 HA ALA 35 4.969 6.711 0.632 264 1HB ALA 35 HB1 ALA 35 3.867 4.194 1.861 265 2HB ALA 35 HB3 ALA 35 3.910 4.519 0.128 266 3HB ALA 35 HB2 ALA 35 5.414 4.400 1.040 267 H THR 36 HN THR 36 3.512 8.122 -0.087 268 HA THR 36 HA THR 36 0.779 8.048 0.941 269 HB THR 36 HB THR 36 1.143 10.157 -0.933 270 HG1 THR 36 HG1 THR 36 3.216 9.974 1.029 271 1HG2 THR 36 3HG2 THR 36 1.032 10.170 2.083 272 2HG2 THR 36 2HG2 THR 36 0.756 11.561 1.038 273 3HG2 THR 36 1HG2 THR 36 -0.357 10.194 0.996 274 H ILE 37 HN ILE 37 -0.385 6.609 -0.096 275 HA ILE 37 HA ILE 37 -0.181 6.347 -3.023 276 HB ILE 37 HB ILE 37 -0.787 4.477 -0.801 277 1HG1 ILE 37 2HG1 ILE 37 0.602 4.044 -3.438 278 2HG1 ILE 37 1HG1 ILE 37 1.411 4.701 -2.013 279 1HG2 ILE 37 1HG2 ILE 37 -2.011 4.254 -3.526 280 2HG2 ILE 37 3HG2 ILE 37 -1.732 2.856 -2.491 281 3HG2 ILE 37 2HG2 ILE 37 -2.798 4.153 -1.954 282 1HD1 ILE 37 3HD1 ILE 37 0.865 2.660 -0.781 283 2HD1 ILE 37 2HD1 ILE 37 0.111 2.004 -2.231 284 3HD1 ILE 37 1HD1 ILE 37 1.842 2.338 -2.214 285 H MET 38 HN MET 38 -2.064 6.533 -4.318 286 HA MET 38 HA MET 38 -4.190 7.918 -2.861 287 1HB MET 38 HB2 MET 38 -2.971 8.564 -5.536 288 2HB MET 38 HB1 MET 38 -4.387 9.347 -4.853 289 1HG MET 38 HG2 MET 38 -3.114 10.182 -3.019 290 2HG MET 38 HG1 MET 38 -1.682 9.309 -3.565 291 1HE MET 38 HE2 MET 38 -1.318 12.268 -2.886 292 2HE MET 38 HE1 MET 38 -0.059 11.319 -3.674 293 3HE MET 38 HE3 MET 38 -0.493 12.904 -4.311 294 H GLY 39 HN GLY 39 -6.251 7.681 -3.444 295 1HA GLY 39 HA1 GLY 39 -8.062 7.252 -4.690 296 2HA GLY 39 HA2 GLY 39 -7.215 5.826 -5.262 297 HA PRO 40 HA PRO 40 -7.565 10.088 -8.183 298 1HB PRO 40 HB2 PRO 40 -4.651 10.381 -7.579 299 2HB PRO 40 HB1 PRO 40 -5.821 11.605 -8.085 300 1HG PRO 40 HG2 PRO 40 -5.090 11.186 -5.479 301 2HG PRO 40 HG1 PRO 40 -6.642 11.877 -5.974 302 1HD PRO 40 HD2 PRO 40 -6.156 9.354 -4.678 303 2HD PRO 40 HD1 PRO 40 -7.702 10.070 -5.147 304 H ASN 41 HN ASN 41 -7.907 8.728 -9.810 305 HA ASN 41 HA ASN 41 -6.303 8.747 -11.966 306 1HB ASN 41 HB2 ASN 41 -4.800 7.147 -10.610 307 2HB ASN 41 HB1 ASN 41 -6.064 5.946 -10.841 308 1HD2 ASN 41 1HD2 ASN 41 -6.658 7.126 -13.564 309 2HD2 ASN 41 2HD2 ASN 41 -5.395 6.509 -14.575 310 H ASP 42 HN ASP 42 -7.781 5.820 -10.688 311 HA ASP 42 HA ASP 42 -10.433 6.547 -11.215 312 1HB ASP 42 HB2 ASP 42 -9.512 6.012 -13.603 313 2HB ASP 42 HB1 ASP 42 -9.595 4.332 -13.066 314 H SER 43 HN SER 43 -11.169 5.692 -9.424 315 HA SER 43 HA SER 43 -10.378 3.030 -8.571 316 1HB SER 43 HB2 SER 43 -8.501 4.335 -7.745 317 2HB SER 43 HB1 SER 43 -9.582 5.585 -7.149 318 HG SER 43 HG SER 43 -9.165 2.981 -6.123 319 HA PRO 44 HA PRO 44 -14.400 3.212 -6.551 320 1HB PRO 44 HB2 PRO 44 -13.643 1.795 -4.259 321 2HB PRO 44 HB1 PRO 44 -14.312 1.090 -5.732 322 1HG PRO 44 HG2 PRO 44 -11.477 1.282 -4.837 323 2HG PRO 44 HG1 PRO 44 -12.288 -0.002 -5.754 324 1HD PRO 44 HD2 PRO 44 -10.639 1.758 -6.941 325 2HD PRO 44 HD1 PRO 44 -12.084 1.132 -7.762 326 H TYR 45 HN TYR 45 -11.369 3.865 -4.825 327 HA TYR 45 HA TYR 45 -12.760 5.900 -3.250 328 1HB TYR 45 HB2 TYR 45 -9.963 5.274 -2.539 329 2HB TYR 45 HB1 TYR 45 -11.378 5.450 -1.528 330 HD1 TYR 45 HD1 TYR 45 -13.146 3.436 -2.007 331 HD2 TYR 45 HD2 TYR 45 -8.911 3.219 -2.334 332 HE1 TYR 45 HE1 TYR 45 -13.260 1.008 -1.652 333 HE2 TYR 45 HE2 TYR 45 -9.003 0.783 -1.987 334 HH TYR 45 HH TYR 45 -10.535 -0.845 -0.924 335 H GLN 46 HN GLN 46 -12.119 6.417 -6.007 336 HA GLN 46 HA GLN 46 -9.673 7.708 -6.356 337 1HB GLN 46 HB2 GLN 46 -11.021 7.133 -8.239 338 2HB GLN 46 HB1 GLN 46 -12.322 8.182 -7.695 339 1HG GLN 46 HG2 GLN 46 -10.894 10.124 -8.032 340 2HG GLN 46 HG1 GLN 46 -9.580 9.082 -8.552 341 1HE2 GLN 46 1HE2 GLN 46 -9.680 8.111 -10.474 342 2HE2 GLN 46 2HE2 GLN 46 -10.785 8.555 -11.718 343 H GLY 47 HN GLY 47 -9.134 8.996 -4.733 344 1HA GLY 47 HA1 GLY 47 -10.694 11.380 -4.171 345 2HA GLY 47 HA2 GLY 47 -9.160 11.634 -4.997 346 H GLY 48 HN GLY 48 -8.863 8.914 -3.133 347 1HA GLY 48 HA1 GLY 48 -8.598 8.627 -0.802 348 2HA GLY 48 HA2 GLY 48 -8.382 10.357 -0.630 349 H VAL 49 HN VAL 49 -6.416 11.222 -0.711 350 HA VAL 49 HA VAL 49 -4.173 9.680 -1.592 351 HB VAL 49 HB VAL 49 -4.254 12.101 0.199 352 1HG1 VAL 49 3HG1 VAL 49 -1.983 10.869 -1.349 353 2HG1 VAL 49 2HG1 VAL 49 -1.907 12.425 -0.526 354 3HG1 VAL 49 1HG1 VAL 49 -2.150 10.949 0.404 355 1HG2 VAL 49 2HG2 VAL 49 -3.920 11.946 -2.789 356 2HG2 VAL 49 1HG2 VAL 49 -5.288 12.632 -1.914 357 3HG2 VAL 49 3HG2 VAL 49 -3.705 13.401 -1.821 358 H PHE 50 HN PHE 50 -4.012 7.784 -0.528 359 HA PHE 50 HA PHE 50 -4.484 7.680 2.317 360 1HB PHE 50 HB2 PHE 50 -3.865 5.574 0.253 361 2HB PHE 50 HB1 PHE 50 -3.979 5.239 1.973 362 HD1 PHE 50 HD1 PHE 50 -6.092 5.469 3.147 363 HD2 PHE 50 HD2 PHE 50 -5.759 5.992 -1.073 364 HE1 PHE 50 HE1 PHE 50 -8.540 5.255 2.931 365 HE2 PHE 50 HE2 PHE 50 -8.189 5.808 -1.279 366 HZ PHE 50 HZ PHE 50 -9.546 5.455 0.713 367 H PHE 51 HN PHE 51 -2.908 6.165 3.527 368 HA PHE 51 HA PHE 51 -0.235 7.340 3.218 369 1HB PHE 51 HB2 PHE 51 -1.534 7.166 5.919 370 2HB PHE 51 HB1 PHE 51 -0.249 8.237 5.378 371 HD1 PHE 51 HD1 PHE 51 -3.885 7.572 4.918 372 HD2 PHE 51 HD2 PHE 51 -0.736 10.435 4.842 373 HE1 PHE 51 HE1 PHE 51 -5.549 9.355 4.621 374 HE2 PHE 51 HE2 PHE 51 -2.384 12.234 4.526 375 HZ PHE 51 HZ PHE 51 -4.779 11.702 4.418 376 H LEU 52 HN LEU 52 1.317 5.817 3.494 377 HA LEU 52 HA LEU 52 0.693 3.535 5.221 378 1HB LEU 52 HB2 LEU 52 2.027 3.259 2.510 379 2HB LEU 52 HB1 LEU 52 1.670 1.966 3.642 380 HG LEU 52 HG LEU 52 -0.818 2.789 3.310 381 1HD1 LEU 52 2HD1 LEU 52 0.520 3.684 0.773 382 2HD1 LEU 52 1HD1 LEU 52 -1.222 3.512 1.006 383 3HD1 LEU 52 3HD1 LEU 52 -0.319 4.705 1.941 384 1HD2 LEU 52 1HD2 LEU 52 0.010 0.557 2.777 385 2HD2 LEU 52 3HD2 LEU 52 -1.097 1.152 1.539 386 3HD2 LEU 52 2HD2 LEU 52 0.642 1.158 1.242 387 H THR 53 HN THR 53 2.239 3.251 6.709 388 HA THR 53 HA THR 53 4.854 4.508 6.256 389 HB THR 53 HB THR 53 3.991 3.153 8.811 390 HG1 THR 53 HG1 THR 53 3.255 5.659 7.777 391 1HG2 THR 53 2HG2 THR 53 6.012 5.309 8.201 392 2HG2 THR 53 1HG2 THR 53 5.627 4.703 9.811 393 3HG2 THR 53 3HG2 THR 53 6.358 3.629 8.618 394 H ILE 54 HN ILE 54 6.608 3.316 5.819 395 HA ILE 54 HA ILE 54 6.232 0.400 5.842 396 HB ILE 54 HB ILE 54 8.420 1.588 4.249 397 1HG1 ILE 54 2HG1 ILE 54 5.496 1.993 3.640 398 2HG1 ILE 54 1HG1 ILE 54 6.794 3.189 3.637 399 1HG2 ILE 54 2HG2 ILE 54 6.392 -0.588 3.759 400 2HG2 ILE 54 1HG2 ILE 54 7.730 -0.180 2.682 401 3HG2 ILE 54 3HG2 ILE 54 8.060 -0.802 4.297 402 1HD1 ILE 54 2HD1 ILE 54 6.498 0.944 1.658 403 2HD1 ILE 54 1HD1 ILE 54 6.023 2.621 1.393 404 3HD1 ILE 54 3HD1 ILE 54 7.718 2.218 1.645 405 H HIS 55 HN HIS 55 7.467 -0.762 7.109 406 HA HIS 55 HA HIS 55 10.124 0.276 7.715 407 1HB HIS 55 HB2 HIS 55 10.101 -0.713 9.944 408 2HB HIS 55 HB1 HIS 55 8.916 0.570 9.748 409 HD1 HIS 55 HD1 HIS 55 6.844 0.019 10.870 410 HD2 HIS 55 HD2 HIS 55 8.689 -3.328 9.299 411 HE1 HIS 55 HE1 HIS 55 5.359 -1.876 11.440 412 HE2 HIS 55 HE2 HIS 55 6.646 -3.945 10.788 413 H PHE 56 HN PHE 56 11.791 -1.262 7.917 414 HA PHE 56 HA PHE 56 11.084 -3.995 7.121 415 1HB PHE 56 HB2 PHE 56 12.475 -4.023 5.279 416 2HB PHE 56 HB1 PHE 56 11.828 -2.403 5.168 417 HD1 PHE 56 HD1 PHE 56 14.751 -4.450 5.729 418 HD2 PHE 56 HD2 PHE 56 13.222 -0.495 5.768 419 HE1 PHE 56 HE1 PHE 56 17.040 -3.582 5.690 420 HE2 PHE 56 HE2 PHE 56 15.508 0.395 5.725 421 HZ PHE 56 HZ PHE 56 17.431 -1.176 5.827 422 HA PRO 57 HA PRO 57 14.801 -4.715 9.611 423 1HB PRO 57 HB2 PRO 57 14.337 -7.298 10.154 424 2HB PRO 57 HB1 PRO 57 13.378 -6.009 10.887 425 1HG PRO 57 HG2 PRO 57 12.585 -7.981 8.869 426 2HG PRO 57 HG1 PRO 57 11.563 -6.944 9.874 427 1HD PRO 57 HD2 PRO 57 12.464 -6.534 7.112 428 2HD PRO 57 HD1 PRO 57 11.191 -5.685 8.017 429 H THR 58 HN THR 58 16.351 -4.496 7.912 430 HA THR 58 HA THR 58 17.875 -5.183 6.303 431 HB THR 58 HB THR 58 19.410 -6.910 7.313 432 HG1 THR 58 HG1 THR 58 17.786 -8.030 8.513 433 1HG2 THR 58 2HG2 THR 58 18.566 -4.584 9.051 434 2HG2 THR 58 1HG2 THR 58 20.098 -5.450 9.175 435 3HG2 THR 58 3HG2 THR 58 19.723 -4.525 7.722 436 H ASP 59 HN ASP 59 16.224 -6.035 4.680 437 HA ASP 59 HA ASP 59 16.092 -8.970 4.760 438 1HB ASP 59 HB2 ASP 59 14.092 -6.912 4.147 439 2HB ASP 59 HB1 ASP 59 14.045 -8.346 3.127 440 H TYR 60 HN TYR 60 16.689 -6.340 2.469 441 HA TYR 60 HA TYR 60 16.494 -7.708 0.069 442 1HB TYR 60 HB2 TYR 60 16.855 -5.286 0.181 443 2HB TYR 60 HB1 TYR 60 18.468 -5.541 0.843 444 HD1 TYR 60 HD1 TYR 60 16.392 -5.703 -2.176 445 HD2 TYR 60 HD2 TYR 60 20.316 -6.152 -0.596 446 HE1 TYR 60 HE1 TYR 60 17.309 -5.669 -4.454 447 HE2 TYR 60 HE2 TYR 60 21.241 -6.124 -2.875 448 HH TYR 60 HH TYR 60 20.452 -6.621 -5.178 449 HA PRO 61 HA PRO 61 18.007 -8.290 -2.287 450 1HB PRO 61 HB2 PRO 61 17.429 -10.989 -2.727 451 2HB PRO 61 HB1 PRO 61 18.868 -10.120 -3.268 452 1HG PRO 61 HG2 PRO 61 18.477 -11.820 -0.840 453 2HG PRO 61 HG1 PRO 61 19.878 -11.715 -1.925 454 1HD PRO 61 HD2 PRO 61 19.949 -10.523 0.441 455 2HD PRO 61 HD1 PRO 61 20.597 -9.691 -0.990 456 H PHE 62 HN PHE 62 16.411 -10.750 -0.170 457 HA PHE 62 HA PHE 62 13.918 -10.091 -1.467 458 1HB PHE 62 HB2 PHE 62 14.291 -12.449 -1.001 459 2HB PHE 62 HB1 PHE 62 14.521 -12.109 0.709 460 HD1 PHE 62 HD1 PHE 62 12.709 -14.030 0.809 461 HD2 PHE 62 HD2 PHE 62 11.978 -10.074 -0.645 462 HE1 PHE 62 HE1 PHE 62 10.290 -14.320 1.176 463 HE2 PHE 62 HE2 PHE 62 9.569 -10.385 -0.283 464 HZ PHE 62 HZ PHE 62 8.754 -12.583 0.722 465 H LYS 63 HN LYS 63 13.356 -8.204 -0.903 466 HA LYS 63 HA LYS 63 13.170 -7.366 1.863 467 1HB LYS 63 HB2 LYS 63 14.150 -5.865 0.249 468 2HB LYS 63 HB1 LYS 63 12.728 -6.039 -0.767 469 1HG LYS 63 HG2 LYS 63 11.431 -5.054 1.189 470 2HG LYS 63 HG1 LYS 63 13.002 -4.577 1.826 471 1HD LYS 63 HD2 LYS 63 13.446 -3.189 -0.031 472 2HD LYS 63 HD1 LYS 63 12.124 -3.894 -0.967 473 1HE LYS 63 HE2 LYS 63 10.552 -3.007 0.738 474 2HE LYS 63 HE1 LYS 63 11.898 -2.137 1.471 475 1HZ LYS 63 HZ2 LYS 63 12.231 -1.023 -0.687 476 2HZ LYS 63 HZ1 LYS 63 10.844 -1.784 -1.285 477 3HZ LYS 63 HZ3 LYS 63 10.721 -0.680 -0.006 478 HA PRO 64 HA PRO 64 8.672 -8.018 1.425 479 1HB PRO 64 HB2 PRO 64 8.376 -9.393 3.806 480 2HB PRO 64 HB1 PRO 64 8.569 -10.155 2.226 481 1HG PRO 64 HG2 PRO 64 10.399 -10.180 4.431 482 2HG PRO 64 HG1 PRO 64 10.603 -10.930 2.840 483 1HD PRO 64 HD2 PRO 64 11.667 -8.368 3.867 484 2HD PRO 64 HD1 PRO 64 12.275 -9.404 2.559 485 HA PRO 65 HA PRO 65 9.110 -4.592 4.431 486 1HB PRO 65 HB2 PRO 65 8.089 -2.630 2.945 487 2HB PRO 65 HB1 PRO 65 9.704 -3.269 2.610 488 1HG PRO 65 HG2 PRO 65 7.116 -3.819 1.209 489 2HG PRO 65 HG1 PRO 65 8.732 -3.579 0.521 490 1HD PRO 65 HD2 PRO 65 7.538 -6.044 0.980 491 2HD PRO 65 HD1 PRO 65 9.279 -5.778 0.781 492 H LYS 66 HN LYS 66 7.657 -4.019 5.961 493 HA LYS 66 HA LYS 66 4.902 -4.771 5.605 494 1HB LYS 66 HB2 LYS 66 6.194 -4.882 7.812 495 2HB LYS 66 HB1 LYS 66 6.012 -3.138 7.882 496 1HG LYS 66 HG2 LYS 66 4.158 -3.599 9.034 497 2HG LYS 66 HG1 LYS 66 3.454 -3.883 7.441 498 1HD LYS 66 HD2 LYS 66 4.694 -5.993 9.204 499 2HD LYS 66 HD1 LYS 66 2.966 -5.700 9.031 500 1HE LYS 66 HE2 LYS 66 3.137 -6.236 6.632 501 2HE LYS 66 HE1 LYS 66 4.856 -6.568 6.843 502 1HZ LYS 66 HZ2 LYS 66 2.698 -8.011 8.277 503 2HZ LYS 66 HZ1 LYS 66 3.439 -8.575 6.864 504 3HZ LYS 66 HZ3 LYS 66 4.344 -8.385 8.279 505 H VAL 67 HN VAL 67 4.398 -3.467 3.806 506 HA VAL 67 HA VAL 67 4.224 -0.599 4.157 507 HB VAL 67 HB VAL 67 2.868 -2.271 2.034 508 1HG1 VAL 67 2HG1 VAL 67 3.588 0.646 2.194 509 2HG1 VAL 67 1HG1 VAL 67 2.957 -0.155 0.753 510 3HG1 VAL 67 3HG1 VAL 67 1.971 -0.062 2.215 511 1HG2 VAL 67 2HG2 VAL 67 5.268 -2.718 1.984 512 2HG2 VAL 67 1HG2 VAL 67 4.761 -1.780 0.579 513 3HG2 VAL 67 3HG2 VAL 67 5.594 -0.986 1.915 514 H ALA 68 HN ALA 68 2.783 0.128 5.553 515 HA ALA 68 HA ALA 68 0.221 -1.299 5.754 516 1HB ALA 68 HB2 ALA 68 1.721 -1.942 7.586 517 2HB ALA 68 HB3 ALA 68 0.281 -1.107 8.168 518 3HB ALA 68 HB1 ALA 68 1.821 -0.253 8.081 519 H PHE 69 HN PHE 69 -1.500 -0.116 5.608 520 HA PHE 69 HA PHE 69 -1.572 2.626 5.262 521 1HB PHE 69 HB2 PHE 69 -3.656 0.615 5.933 522 2HB PHE 69 HB1 PHE 69 -4.055 2.325 5.937 523 HD1 PHE 69 HD1 PHE 69 -4.161 3.580 3.860 524 HD2 PHE 69 HD2 PHE 69 -3.163 -0.558 3.883 525 HE1 PHE 69 HE1 PHE 69 -4.462 3.485 1.415 526 HE2 PHE 69 HE2 PHE 69 -3.477 -0.638 1.435 527 HZ PHE 69 HZ PHE 69 -4.405 1.359 0.266 528 H THR 70 HN THR 70 -1.665 4.310 6.537 529 HA THR 70 HA THR 70 -1.775 4.111 9.422 530 HB THR 70 HB THR 70 -2.134 6.594 7.729 531 HG1 THR 70 HG1 THR 70 0.160 5.033 8.221 532 1HG2 THR 70 1HG2 THR 70 -1.004 6.105 10.496 533 2HG2 THR 70 3HG2 THR 70 -1.014 7.665 9.673 534 3HG2 THR 70 2HG2 THR 70 -2.537 6.886 10.104 535 H THR 71 HN THR 71 -3.671 5.662 6.912 536 HA THR 71 HA THR 71 -6.019 5.905 8.516 537 HB THR 71 HB THR 71 -5.236 6.571 5.722 538 HG1 THR 71 HG1 THR 71 -5.942 8.661 6.492 539 1HG2 THR 71 1HG2 THR 71 -7.498 5.638 5.469 540 2HG2 THR 71 3HG2 THR 71 -8.086 6.706 6.745 541 3HG2 THR 71 2HG2 THR 71 -7.506 7.382 5.224 542 H ARG 72 HN ARG 72 -7.582 4.538 8.701 543 HA ARG 72 HA ARG 72 -7.503 1.881 8.018 544 1HB ARG 72 HB2 ARG 72 -9.883 1.869 8.690 545 2HB ARG 72 HB1 ARG 72 -8.873 2.801 9.788 546 1HG ARG 72 HG2 ARG 72 -9.682 4.693 8.001 547 2HG ARG 72 HG1 ARG 72 -11.100 3.655 8.126 548 1HD ARG 72 HD2 ARG 72 -9.644 5.012 10.386 549 2HD ARG 72 HD1 ARG 72 -11.229 5.435 9.744 550 HE ARG 72 HE ARG 72 -11.016 2.730 10.751 551 1HH1 ARG 72 1HH1 ARG 72 -11.787 6.063 11.489 552 2HH1 ARG 72 2HH1 ARG 72 -12.725 5.681 12.892 553 1HH2 ARG 72 1HH2 ARG 72 -12.249 2.210 12.605 554 2HH2 ARG 72 2HH2 ARG 72 -12.981 3.477 13.534 555 H ILE 73 HN ILE 73 -8.637 0.593 6.504 556 HA ILE 73 HA ILE 73 -9.861 1.845 4.188 557 HB ILE 73 HB ILE 73 -7.791 2.140 3.282 558 1HG1 ILE 73 2HG1 ILE 73 -7.016 -0.019 2.026 559 2HG1 ILE 73 1HG1 ILE 73 -8.509 -0.713 2.644 560 1HG2 ILE 73 3HG2 ILE 73 -6.875 -0.223 4.903 561 2HG2 ILE 73 2HG2 ILE 73 -5.837 0.651 3.777 562 3HG2 ILE 73 1HG2 ILE 73 -6.516 1.480 5.178 563 1HD1 ILE 73 1HD1 ILE 73 -8.298 1.757 0.929 564 2HD1 ILE 73 3HD1 ILE 73 -8.721 0.141 0.363 565 3HD1 ILE 73 2HD1 ILE 73 -9.788 0.988 1.484 566 H TYR 74 HN TYR 74 -11.421 0.586 3.554 567 HA TYR 74 HA TYR 74 -11.469 -2.269 4.143 568 1HB TYR 74 HB2 TYR 74 -13.461 -0.223 3.329 569 2HB TYR 74 HB1 TYR 74 -13.722 -1.862 2.742 570 HD1 TYR 74 HD1 TYR 74 -14.179 0.361 5.403 571 HD2 TYR 74 HD2 TYR 74 -13.616 -3.737 4.507 572 HE1 TYR 74 HE1 TYR 74 -15.130 -0.203 7.580 573 HE2 TYR 74 HE2 TYR 74 -14.559 -4.349 6.715 574 HH TYR 74 HH TYR 74 -16.070 -1.998 8.785 575 H HIS 75 HN HIS 75 -11.086 -3.779 2.735 576 HA HIS 75 HA HIS 75 -11.194 -3.862 0.016 577 1HB HIS 75 HB2 HIS 75 -9.823 -1.794 0.001 578 2HB HIS 75 HB1 HIS 75 -8.539 -2.654 0.839 579 HD1 HIS 75 HD1 HIS 75 -7.345 -4.582 -0.565 580 HD2 HIS 75 HD2 HIS 75 -9.874 -2.080 -2.701 581 HE1 HIS 75 HE1 HIS 75 -6.758 -4.935 -2.984 582 HE2 HIS 75 HE2 HIS 75 -8.161 -3.248 -4.233 583 HA PRO 76 HA PRO 76 -9.670 -7.753 1.721 584 1HB PRO 76 HB2 PRO 76 -10.224 -9.233 -0.506 585 2HB PRO 76 HB1 PRO 76 -11.422 -8.812 0.714 586 1HG PRO 76 HG2 PRO 76 -10.876 -7.522 -1.919 587 2HG PRO 76 HG1 PRO 76 -12.427 -7.936 -1.173 588 1HD PRO 76 HD2 PRO 76 -11.463 -5.431 -1.126 589 2HD PRO 76 HD1 PRO 76 -12.386 -6.097 0.237 590 H ASN 77 HN ASN 77 -7.587 -7.291 1.835 591 HA ASN 77 HA ASN 77 -5.565 -8.436 0.608 592 1HB ASN 77 HB2 ASN 77 -6.410 -6.142 -1.097 593 2HB ASN 77 HB1 ASN 77 -4.684 -6.288 -0.788 594 1HD2 ASN 77 1HD2 ASN 77 -6.070 -6.551 -3.298 595 2HD2 ASN 77 2HD2 ASN 77 -5.769 -8.144 -3.885 596 H ILE 78 HN ILE 78 -6.943 -5.710 2.091 597 HA ILE 78 HA ILE 78 -4.499 -5.117 3.537 598 HB ILE 78 HB ILE 78 -7.102 -3.582 3.280 599 1HG1 ILE 78 2HG1 ILE 78 -5.479 -1.771 2.657 600 2HG1 ILE 78 1HG1 ILE 78 -4.257 -2.996 2.654 601 1HG2 ILE 78 2HG2 ILE 78 -6.281 -3.601 5.623 602 2HG2 ILE 78 1HG2 ILE 78 -4.752 -2.935 5.040 603 3HG2 ILE 78 3HG2 ILE 78 -6.240 -2.003 4.881 604 1HD1 ILE 78 2HD1 ILE 78 -5.383 -4.176 0.862 605 2HD1 ILE 78 1HD1 ILE 78 -6.637 -2.939 0.849 606 3HD1 ILE 78 3HD1 ILE 78 -4.984 -2.519 0.401 607 H ASN 79 HN ASN 79 -4.360 -5.728 5.527 608 HA ASN 79 HA ASN 79 -6.669 -6.957 6.819 609 1HB ASN 79 HB2 ASN 79 -5.157 -8.182 8.170 610 2HB ASN 79 HB1 ASN 79 -4.466 -8.184 6.549 611 1HD2 ASN 79 1HD2 ASN 79 -3.599 -5.417 6.793 612 2HD2 ASN 79 2HD2 ASN 79 -2.234 -5.434 7.837 613 H SER 80 HN SER 80 -6.537 -6.544 9.379 614 HA SER 80 HA SER 80 -7.454 -3.860 9.428 615 1HB SER 80 HB2 SER 80 -8.328 -5.964 10.655 616 2HB SER 80 HB1 SER 80 -7.127 -5.561 11.878 617 HG SER 80 HG SER 80 -9.528 -4.379 11.317 618 H ASN 81 HN ASN 81 -4.449 -4.092 9.121 619 HA ASN 81 HA ASN 81 -3.973 -1.879 10.956 620 1HB ASN 81 HB2 ASN 81 -1.942 -2.652 11.847 621 2HB ASN 81 HB1 ASN 81 -3.007 -4.045 11.953 622 1HD2 ASN 81 1HD2 ASN 81 -0.138 -4.003 11.963 623 2HD2 ASN 81 2HD2 ASN 81 0.384 -4.934 10.603 624 H GLY 82 HN GLY 82 -4.414 -2.378 8.016 625 1HA GLY 82 HA1 GLY 82 -2.494 -0.518 7.058 626 2HA GLY 82 HA2 GLY 82 -3.821 -1.229 6.154 627 H SER 83 HN SER 83 -1.993 -3.714 7.453 628 HA SER 83 HA SER 83 0.112 -3.737 5.498 629 1HB SER 83 HB2 SER 83 0.314 -4.878 7.699 630 2HB SER 83 HB1 SER 83 -0.933 -6.007 7.181 631 HG SER 83 HG SER 83 0.460 -6.725 5.542 632 H ILE 84 HN ILE 84 0.175 -4.708 3.553 633 HA ILE 84 HA ILE 84 -2.345 -5.815 2.565 634 HB ILE 84 HB ILE 84 -0.184 -4.302 1.132 635 1HG1 ILE 84 2HG1 ILE 84 -3.027 -3.544 1.746 636 2HG1 ILE 84 1HG1 ILE 84 -1.656 -3.080 2.748 637 1HG2 ILE 84 3HG2 ILE 84 -2.775 -5.420 0.082 638 2HG2 ILE 84 2HG2 ILE 84 -1.766 -4.257 -0.777 639 3HG2 ILE 84 1HG2 ILE 84 -1.145 -5.869 -0.418 640 1HD1 ILE 84 3HD1 ILE 84 -0.728 -2.112 0.524 641 2HD1 ILE 84 2HD1 ILE 84 -2.426 -2.150 0.042 642 3HD1 ILE 84 1HD1 ILE 84 -1.931 -1.228 1.461 643 H CYS 85 HN CYS 85 -2.401 -7.555 1.200 644 HA CYS 85 HA CYS 85 0.053 -9.137 1.041 645 1HB CYS 85 HB2 CYS 85 -2.831 -9.800 1.257 646 2HB CYS 85 HB1 CYS 85 -1.897 -10.813 0.147 647 HG CYS 85 HG CYS 85 -0.628 -10.281 3.239 648 H LEU 86 HN LEU 86 1.063 -8.151 -0.705 649 HA LEU 86 HA LEU 86 -0.271 -8.367 -3.319 650 1HB LEU 86 HB2 LEU 86 1.951 -6.757 -2.255 651 2HB LEU 86 HB1 LEU 86 2.234 -7.418 -3.863 652 HG LEU 86 HG LEU 86 -0.146 -5.702 -3.094 653 1HD1 LEU 86 2HD1 LEU 86 2.400 -5.003 -4.533 654 2HD1 LEU 86 1HD1 LEU 86 0.991 -3.952 -4.380 655 3HD1 LEU 86 3HD1 LEU 86 1.895 -4.429 -2.944 656 1HD2 LEU 86 2HD2 LEU 86 0.859 -6.685 -5.764 657 2HD2 LEU 86 1HD2 LEU 86 -0.639 -7.161 -4.965 658 3HD2 LEU 86 3HD2 LEU 86 -0.431 -5.502 -5.539 659 H ASP 87 HN ASP 87 0.255 -9.929 -4.717 660 HA ASP 87 HA ASP 87 1.802 -12.150 -4.075 661 1HB ASP 87 HB2 ASP 87 0.895 -10.992 -6.694 662 2HB ASP 87 HB1 ASP 87 1.883 -12.451 -6.635 663 H ILE 88 HN ILE 88 2.841 -9.127 -5.616 664 HA ILE 88 HA ILE 88 5.376 -10.207 -6.276 665 HB ILE 88 HB ILE 88 6.087 -7.915 -6.748 666 1HG1 ILE 88 2HG1 ILE 88 3.380 -7.293 -5.612 667 2HG1 ILE 88 1HG1 ILE 88 4.942 -6.600 -5.181 668 1HG2 ILE 88 1HG2 ILE 88 5.004 -9.290 -8.452 669 2HG2 ILE 88 3HG2 ILE 88 3.434 -8.650 -7.963 670 3HG2 ILE 88 2HG2 ILE 88 4.650 -7.573 -8.657 671 1HD1 ILE 88 3HD1 ILE 88 5.106 -5.562 -7.347 672 2HD1 ILE 88 2HD1 ILE 88 3.502 -6.176 -7.763 673 3HD1 ILE 88 1HD1 ILE 88 3.688 -5.011 -6.447 674 H LEU 89 HN LEU 89 4.122 -9.291 -3.350 675 HA LEU 89 HA LEU 89 6.833 -8.867 -2.277 676 1HB LEU 89 HB2 LEU 89 4.183 -7.752 -1.554 677 2HB LEU 89 HB1 LEU 89 5.282 -8.097 -0.234 678 HG LEU 89 HG LEU 89 6.971 -6.620 -1.267 679 1HD1 LEU 89 2HD1 LEU 89 6.212 -6.862 -3.609 680 2HD1 LEU 89 1HD1 LEU 89 4.808 -5.865 -3.222 681 3HD1 LEU 89 3HD1 LEU 89 6.433 -5.184 -3.112 682 1HD2 LEU 89 2HD2 LEU 89 5.451 -5.763 0.421 683 2HD2 LEU 89 1HD2 LEU 89 5.835 -4.520 -0.769 684 3HD2 LEU 89 3HD2 LEU 89 4.279 -5.348 -0.830 685 H ARG 90 HN ARG 90 4.183 -10.958 -2.433 686 HA ARG 90 HA ARG 90 5.089 -12.381 -0.002 687 1HB ARG 90 HB2 ARG 90 2.857 -13.219 0.308 688 2HB ARG 90 HB1 ARG 90 2.760 -11.476 0.093 689 1HG ARG 90 HG2 ARG 90 2.307 -11.986 -2.356 690 2HG ARG 90 HG1 ARG 90 2.010 -13.643 -1.833 691 1HD ARG 90 HD2 ARG 90 0.266 -12.826 -0.309 692 2HD ARG 90 HD1 ARG 90 0.584 -11.170 -0.847 693 HE ARG 90 HE ARG 90 -0.255 -11.774 -3.019 694 1HH1 ARG 90 1HH1 ARG 90 -0.785 -14.204 -0.565 695 2HH1 ARG 90 2HH1 ARG 90 -2.140 -14.910 -1.377 696 1HH2 ARG 90 1HH2 ARG 90 -2.042 -12.689 -4.097 697 2HH2 ARG 90 2HH2 ARG 90 -2.917 -14.001 -3.353 698 H SER 91 HN SER 91 5.042 -12.599 -3.368 699 HA SER 91 HA SER 91 5.506 -15.459 -3.230 700 1HB SER 91 HB2 SER 91 3.109 -15.293 -3.634 701 2HB SER 91 HB1 SER 91 3.403 -14.271 -5.040 702 HG SER 91 HG SER 91 3.088 -16.722 -5.249 703 H GLN 92 HN GLN 92 5.594 -12.530 -5.229 704 HA GLN 92 HA GLN 92 7.146 -14.012 -7.247 705 1HB GLN 92 HB2 GLN 92 5.714 -11.381 -7.618 706 2HB GLN 92 HB1 GLN 92 6.379 -12.419 -8.867 707 1HG GLN 92 HG2 GLN 92 4.709 -14.134 -8.247 708 2HG GLN 92 HG1 GLN 92 4.012 -12.984 -7.113 709 1HE2 GLN 92 1HE2 GLN 92 2.885 -11.220 -7.899 710 2HE2 GLN 92 2HE2 GLN 92 2.338 -11.113 -9.531 711 H TRP 93 HN TRP 93 7.871 -12.210 -4.699 712 HA TRP 93 HA TRP 93 9.256 -10.022 -5.779 713 1HB TRP 93 HB2 TRP 93 8.612 -9.926 -3.508 714 2HB TRP 93 HB1 TRP 93 9.586 -11.340 -3.092 715 HD1 TRP 93 HD1 TRP 93 12.385 -10.871 -3.275 716 HE1 TRP 93 HE1 TRP 93 13.693 -8.676 -2.864 717 HE3 TRP 93 HE3 TRP 93 8.503 -7.588 -3.508 718 HZ2 TRP 93 HZ2 TRP 93 13.119 -5.918 -2.696 719 HZ3 TRP 93 HZ3 TRP 93 8.956 -5.198 -3.222 720 HH2 TRP 93 HH2 TRP 93 11.204 -4.388 -2.832 721 H SER 94 HN SER 94 10.632 -10.559 -7.375 722 HA SER 94 HA SER 94 13.154 -11.704 -6.587 723 1HB SER 94 HB2 SER 94 12.297 -10.054 -8.976 724 2HB SER 94 HB1 SER 94 13.847 -10.859 -8.795 725 HG SER 94 HG SER 94 11.600 -12.438 -8.464 726 HA PRO 95 HA PRO 95 14.680 -8.093 -4.630 727 1HB PRO 95 HB2 PRO 95 17.177 -7.665 -5.608 728 2HB PRO 95 HB1 PRO 95 16.769 -9.012 -4.543 729 1HG PRO 95 HG2 PRO 95 17.058 -8.977 -7.521 730 2HG PRO 95 HG1 PRO 95 17.659 -10.166 -6.353 731 1HD PRO 95 HD2 PRO 95 15.426 -10.578 -7.804 732 2HD PRO 95 HD1 PRO 95 15.608 -11.197 -6.151 733 H ALA 96 HN ALA 96 13.105 -7.398 -7.044 734 HA ALA 96 HA ALA 96 14.120 -4.679 -7.327 735 1HB ALA 96 HB2 ALA 96 15.088 -5.927 -9.192 736 2HB ALA 96 HB1 ALA 96 13.472 -6.377 -9.727 737 3HB ALA 96 HB3 ALA 96 13.968 -4.684 -9.742 738 H LEU 97 HN LEU 97 11.608 -6.240 -6.284 739 HA LEU 97 HA LEU 97 9.503 -4.884 -7.814 740 1HB LEU 97 HB2 LEU 97 9.474 -6.789 -5.495 741 2HB LEU 97 HB1 LEU 97 8.045 -5.895 -5.966 742 HG LEU 97 HG LEU 97 7.909 -8.067 -6.836 743 1HD1 LEU 97 3HD1 LEU 97 8.637 -6.140 -9.018 744 2HD1 LEU 97 2HD1 LEU 97 7.723 -7.632 -9.242 745 3HD1 LEU 97 1HD1 LEU 97 7.054 -6.326 -8.264 746 1HD2 LEU 97 2HD2 LEU 97 10.273 -8.669 -6.818 747 2HD2 LEU 97 1HD2 LEU 97 9.540 -9.029 -8.382 748 3HD2 LEU 97 3HD2 LEU 97 10.553 -7.599 -8.190 749 H THR 98 HN THR 98 11.236 -3.102 -6.600 750 HA THR 98 HA THR 98 10.714 -2.716 -3.847 751 HB THR 98 HB THR 98 12.834 -2.108 -5.036 752 HG1 THR 98 HG1 THR 98 13.004 -0.070 -3.787 753 1HG2 THR 98 3HG2 THR 98 11.153 0.235 -5.904 754 2HG2 THR 98 2HG2 THR 98 12.902 0.107 -6.094 755 3HG2 THR 98 1HG2 THR 98 11.834 -1.006 -6.949 756 H ILE 99 HN ILE 99 10.488 -0.057 -3.495 757 HA ILE 99 HA ILE 99 7.653 0.001 -3.262 758 HB ILE 99 HB ILE 99 8.403 2.565 -2.662 759 1HG1 ILE 99 2HG1 ILE 99 10.385 2.269 -1.225 760 2HG1 ILE 99 1HG1 ILE 99 10.631 0.702 -1.979 761 1HG2 ILE 99 3HG2 ILE 99 6.937 1.031 -1.406 762 2HG2 ILE 99 2HG2 ILE 99 8.363 0.157 -0.848 763 3HG2 ILE 99 1HG2 ILE 99 8.114 1.835 -0.375 764 1HD1 ILE 99 3HD1 ILE 99 10.500 3.293 -3.422 765 2HD1 ILE 99 2HD1 ILE 99 11.981 2.490 -2.917 766 3HD1 ILE 99 1HD1 ILE 99 10.920 1.723 -4.095 767 H SER 100 HN SER 100 9.872 1.885 -5.252 768 HA SER 100 HA SER 100 8.042 3.599 -6.379 769 1HB SER 100 HB2 SER 100 9.679 3.802 -8.224 770 2HB SER 100 HB1 SER 100 10.493 3.802 -6.650 771 HG SER 100 HG SER 100 10.951 2.205 -8.681 772 H LYS 101 HN LYS 101 8.833 0.257 -7.244 773 HA LYS 101 HA LYS 101 6.826 -0.054 -9.183 774 1HB LYS 101 HB2 LYS 101 8.966 -1.348 -8.727 775 2HB LYS 101 HB1 LYS 101 8.091 -2.141 -7.429 776 1HG LYS 101 HG2 LYS 101 7.008 -2.136 -10.180 777 2HG LYS 101 HG1 LYS 101 8.297 -3.243 -9.725 778 1HD LYS 101 HD2 LYS 101 6.914 -4.132 -7.921 779 2HD LYS 101 HD1 LYS 101 5.622 -3.009 -8.350 780 1HE LYS 101 HE2 LYS 101 6.751 -5.173 -10.121 781 2HE LYS 101 HE1 LYS 101 5.229 -5.263 -9.240 782 1HZ LYS 101 HZ3 LYS 101 5.822 -3.189 -11.288 783 2HZ LYS 101 HZ2 LYS 101 5.008 -4.632 -11.622 784 3HZ LYS 101 HZ1 LYS 101 4.330 -3.508 -10.555 785 H VAL 102 HN VAL 102 6.914 -1.316 -5.781 786 HA VAL 102 HA VAL 102 4.349 -2.466 -6.096 787 HB VAL 102 HB VAL 102 5.457 -3.718 -4.563 788 1HG1 VAL 102 2HG1 VAL 102 7.343 -2.091 -4.364 789 2HG1 VAL 102 1HG1 VAL 102 6.433 -1.316 -3.064 790 3HG1 VAL 102 3HG1 VAL 102 6.966 -2.988 -2.897 791 1HG2 VAL 102 1HG2 VAL 102 3.320 -3.049 -3.543 792 2HG2 VAL 102 3HG2 VAL 102 4.554 -3.430 -2.346 793 3HG2 VAL 102 2HG2 VAL 102 4.163 -1.747 -2.700 794 H LEU 103 HN LEU 103 5.350 0.625 -4.748 795 HA LEU 103 HA LEU 103 3.037 1.132 -3.258 796 1HB LEU 103 HB2 LEU 103 4.912 3.024 -4.654 797 2HB LEU 103 HB1 LEU 103 3.566 3.583 -3.677 798 HG LEU 103 HG LEU 103 5.966 2.006 -2.742 799 1HD1 LEU 103 3HD1 LEU 103 4.997 4.786 -2.120 800 2HD1 LEU 103 2HD1 LEU 103 6.372 3.982 -1.368 801 3HD1 LEU 103 1HD1 LEU 103 6.404 4.352 -3.090 802 1HD2 LEU 103 2HD2 LEU 103 3.533 2.873 -1.156 803 2HD2 LEU 103 1HD2 LEU 103 3.987 1.212 -1.547 804 3HD2 LEU 103 3HD2 LEU 103 5.008 2.178 -0.486 805 H LEU 104 HN LEU 104 3.667 1.547 -6.693 806 HA LEU 104 HA LEU 104 1.160 2.779 -7.191 807 1HB LEU 104 HB2 LEU 104 3.261 1.548 -8.909 808 2HB LEU 104 HB1 LEU 104 1.709 2.019 -9.587 809 HG LEU 104 HG LEU 104 2.164 4.316 -8.534 810 1HD1 LEU 104 2HD1 LEU 104 4.016 3.654 -7.123 811 2HD1 LEU 104 1HD1 LEU 104 4.968 3.234 -8.550 812 3HD1 LEU 104 3HD1 LEU 104 4.490 4.914 -8.269 813 1HD2 LEU 104 2HD2 LEU 104 2.188 3.796 -10.938 814 2HD2 LEU 104 1HD2 LEU 104 3.378 5.025 -10.496 815 3HD2 LEU 104 3HD2 LEU 104 3.895 3.369 -10.801 816 H SER 105 HN SER 105 2.308 -0.537 -7.138 817 HA SER 105 HA SER 105 -0.043 -1.646 -8.288 818 1HB SER 105 HB2 SER 105 2.072 -2.843 -8.286 819 2HB SER 105 HB1 SER 105 2.032 -2.930 -6.528 820 HG SER 105 HG SER 105 -0.202 -3.891 -7.846 821 H ILE 106 HN ILE 106 0.992 -1.018 -4.957 822 HA ILE 106 HA ILE 106 -1.273 -2.146 -3.699 823 HB ILE 106 HB ILE 106 0.725 -0.066 -2.867 824 1HG1 ILE 106 2HG1 ILE 106 -0.012 -2.791 -1.751 825 2HG1 ILE 106 1HG1 ILE 106 1.403 -2.423 -2.735 826 1HG2 ILE 106 1HG2 ILE 106 -1.401 0.704 -1.977 827 2HG2 ILE 106 3HG2 ILE 106 -1.707 -0.888 -1.288 828 3HG2 ILE 106 2HG2 ILE 106 -0.374 0.093 -0.678 829 1HD1 ILE 106 1HD1 ILE 106 0.873 -1.217 -0.017 830 2HD1 ILE 106 3HD1 ILE 106 1.876 -2.638 -0.310 831 3HD1 ILE 106 2HD1 ILE 106 2.342 -1.079 -0.985 832 H CYS 107 HN CYS 107 -0.469 1.149 -4.691 833 HA CYS 107 HA CYS 107 -2.921 2.386 -4.325 834 1HB CYS 107 HB2 CYS 107 -1.087 3.718 -5.024 835 2HB CYS 107 HB1 CYS 107 -0.805 2.707 -6.436 836 HG CYS 107 HG CYS 107 -3.555 4.711 -6.024 837 H SER 108 HN SER 108 -1.826 0.181 -6.817 838 HA SER 108 HA SER 108 -4.032 0.711 -8.533 839 1HB SER 108 HB2 SER 108 -1.925 0.045 -9.491 840 2HB SER 108 HB1 SER 108 -1.977 -1.480 -8.610 841 HG SER 108 HG SER 108 -4.235 -1.321 -9.936 842 H LEU 109 HN LEU 109 -3.516 -1.333 -5.814 843 HA LEU 109 HA LEU 109 -5.640 -3.138 -6.571 844 1HB LEU 109 HB2 LEU 109 -4.202 -2.682 -3.942 845 2HB LEU 109 HB1 LEU 109 -5.474 -3.867 -4.145 846 HG LEU 109 HG LEU 109 -2.908 -3.898 -5.725 847 1HD1 LEU 109 2HD1 LEU 109 -3.651 -5.411 -3.226 848 2HD1 LEU 109 1HD1 LEU 109 -2.235 -5.725 -4.230 849 3HD1 LEU 109 3HD1 LEU 109 -2.385 -4.188 -3.381 850 1HD2 LEU 109 3HD2 LEU 109 -4.805 -5.048 -6.764 851 2HD2 LEU 109 2HD2 LEU 109 -3.569 -6.186 -6.234 852 3HD2 LEU 109 1HD2 LEU 109 -5.044 -5.985 -5.288 853 H LEU 110 HN LEU 110 -5.097 -0.313 -4.682 854 HA LEU 110 HA LEU 110 -7.737 0.123 -3.770 855 1HB LEU 110 HB2 LEU 110 -5.262 1.706 -4.139 856 2HB LEU 110 HB1 LEU 110 -6.742 2.644 -4.062 857 HG LEU 110 HG LEU 110 -7.209 1.647 -1.862 858 1HD1 LEU 110 2HD1 LEU 110 -6.059 -0.506 -2.254 859 2HD1 LEU 110 1HD1 LEU 110 -4.516 0.330 -2.083 860 3HD1 LEU 110 3HD1 LEU 110 -5.636 0.247 -0.720 861 1HD2 LEU 110 2HD2 LEU 110 -5.942 3.739 -2.035 862 2HD2 LEU 110 1HD2 LEU 110 -5.486 2.795 -0.617 863 3HD2 LEU 110 3HD2 LEU 110 -4.443 2.807 -2.034 864 H CYS 111 HN CYS 111 -6.088 0.522 -6.772 865 HA CYS 111 HA CYS 111 -8.102 2.315 -7.799 866 1HB CYS 111 HB2 CYS 111 -5.688 2.813 -8.013 867 2HB CYS 111 HB1 CYS 111 -5.531 1.400 -9.060 868 HG CYS 111 HG CYS 111 -7.885 3.005 -10.470 869 H ASP 112 HN ASP 112 -6.518 -0.698 -9.122 870 HA ASP 112 HA ASP 112 -8.634 -0.590 -11.153 871 1HB ASP 112 HB2 ASP 112 -6.602 -0.348 -12.225 872 2HB ASP 112 HB1 ASP 112 -5.819 -1.598 -11.284 873 HA PRO 113 HA PRO 113 -9.303 -5.036 -9.945 874 1HB PRO 113 HB2 PRO 113 -7.340 -6.741 -9.487 875 2HB PRO 113 HB1 PRO 113 -7.436 -5.934 -11.057 876 1HG PRO 113 HG2 PRO 113 -5.568 -5.454 -8.803 877 2HG PRO 113 HG1 PRO 113 -5.321 -5.208 -10.539 878 1HD PRO 113 HD2 PRO 113 -6.122 -3.268 -8.555 879 2HD PRO 113 HD1 PRO 113 -5.811 -3.021 -10.279 880 H ASN 114 HN ASN 114 -8.232 -7.015 -8.135 881 HA ASN 114 HA ASN 114 -7.860 -6.314 -5.536 882 1HB ASN 114 HB2 ASN 114 -9.969 -4.960 -5.875 883 2HB ASN 114 HB1 ASN 114 -10.843 -6.483 -5.988 884 1HD2 ASN 114 1HD2 ASN 114 -8.867 -7.599 -3.952 885 2HD2 ASN 114 2HD2 ASN 114 -9.451 -7.005 -2.439 886 HA PRO 115 HA PRO 115 -10.740 -10.374 -5.568 887 1HB PRO 115 HB2 PRO 115 -10.045 -11.172 -8.363 888 2HB PRO 115 HB1 PRO 115 -11.509 -11.496 -7.425 889 1HG PRO 115 HG2 PRO 115 -11.512 -9.596 -9.259 890 2HG PRO 115 HG1 PRO 115 -12.323 -9.338 -7.702 891 1HD PRO 115 HD2 PRO 115 -9.728 -8.258 -8.694 892 2HD PRO 115 HD1 PRO 115 -10.943 -7.498 -7.649 893 H ASP 116 HN ASP 116 -9.045 -10.967 -4.136 894 HA ASP 116 HA ASP 116 -8.246 -13.563 -4.819 895 1HB ASP 116 HB2 ASP 116 -6.314 -12.385 -5.881 896 2HB ASP 116 HB1 ASP 116 -5.899 -11.728 -4.293 897 H ASP 117 HN ASP 117 -6.817 -11.168 -2.676 898 HA ASP 117 HA ASP 117 -6.530 -11.096 -0.424 899 1HB ASP 117 HB2 ASP 117 -8.695 -10.157 -0.695 900 2HB ASP 117 HB1 ASP 117 -9.450 -11.740 -0.663 901 HA PRO 118 HA PRO 118 -6.310 -15.191 1.404 902 1HB PRO 118 HB2 PRO 118 -3.724 -15.221 1.931 903 2HB PRO 118 HB1 PRO 118 -4.263 -15.414 0.258 904 1HG PRO 118 HG2 PRO 118 -3.112 -13.020 1.612 905 2HG PRO 118 HG1 PRO 118 -2.863 -13.599 -0.044 906 1HD PRO 118 HD2 PRO 118 -4.678 -11.593 0.791 907 2HD PRO 118 HD1 PRO 118 -4.610 -12.362 -0.809 908 H LEU 119 HN LEU 119 -6.665 -12.191 2.418 909 HA LEU 119 HA LEU 119 -5.246 -12.469 4.954 910 1HB LEU 119 HB2 LEU 119 -6.186 -10.106 3.408 911 2HB LEU 119 HB1 LEU 119 -5.961 -9.965 5.141 912 HG LEU 119 HG LEU 119 -3.838 -10.773 3.156 913 1HD1 LEU 119 3HD1 LEU 119 -4.332 -8.227 4.670 914 2HD1 LEU 119 2HD1 LEU 119 -2.826 -8.607 3.833 915 3HD1 LEU 119 1HD1 LEU 119 -4.331 -8.455 2.925 916 1HD2 LEU 119 1HD2 LEU 119 -3.708 -10.342 6.137 917 2HD2 LEU 119 3HD2 LEU 119 -3.458 -11.864 5.275 918 3HD2 LEU 119 2HD2 LEU 119 -2.311 -10.541 5.080 919 H VAL 120 HN VAL 120 -8.268 -10.591 4.328 920 HA VAL 120 HA VAL 120 -8.960 -11.618 7.019 921 HB VAL 120 HB VAL 120 -10.140 -9.110 5.904 922 1HG1 VAL 120 1HG1 VAL 120 -11.056 -10.068 7.960 923 2HG1 VAL 120 3HG1 VAL 120 -9.456 -10.035 8.698 924 3HG1 VAL 120 2HG1 VAL 120 -10.263 -8.524 8.281 925 1HG2 VAL 120 3HG2 VAL 120 -7.460 -9.323 7.281 926 2HG2 VAL 120 2HG2 VAL 120 -7.735 -8.833 5.609 927 3HG2 VAL 120 1HG2 VAL 120 -8.325 -7.830 6.933 928 HA PRO 121 HA PRO 121 -12.514 -13.736 5.304 929 1HB PRO 121 HB2 PRO 121 -13.340 -13.372 8.150 930 2HB PRO 121 HB1 PRO 121 -13.390 -14.821 7.140 931 1HG PRO 121 HG2 PRO 121 -11.503 -14.524 8.986 932 2HG PRO 121 HG1 PRO 121 -11.129 -15.256 7.414 933 1HD PRO 121 HD2 PRO 121 -10.469 -12.538 8.442 934 2HD PRO 121 HD1 PRO 121 -9.559 -13.580 7.333 935 H GLU 122 HN GLU 122 -12.888 -11.006 7.598 936 HA GLU 122 HA GLU 122 -15.505 -10.387 6.627 937 1HB GLU 122 HB2 GLU 122 -15.055 -8.146 7.804 938 2HB GLU 122 HB1 GLU 122 -15.240 -9.602 8.782 939 1HG GLU 122 HG2 GLU 122 -12.848 -9.760 9.058 940 2HG GLU 122 HG1 GLU 122 -12.599 -8.396 7.965 941 H ILE 123 HN ILE 123 -12.273 -9.041 6.013 942 HA ILE 123 HA ILE 123 -13.376 -6.914 4.470 943 HB ILE 123 HB ILE 123 -10.506 -7.755 4.216 944 1HG1 ILE 123 2HG1 ILE 123 -11.024 -7.688 6.627 945 2HG1 ILE 123 1HG1 ILE 123 -10.002 -6.331 6.156 946 1HG2 ILE 123 2HG2 ILE 123 -11.377 -5.996 2.767 947 2HG2 ILE 123 1HG2 ILE 123 -11.908 -5.101 4.202 948 3HG2 ILE 123 3HG2 ILE 123 -10.182 -5.375 3.912 949 1HD1 ILE 123 2HD1 ILE 123 -11.977 -4.914 6.044 950 2HD1 ILE 123 1HD1 ILE 123 -12.962 -6.287 6.568 951 3HD1 ILE 123 3HD1 ILE 123 -11.742 -5.618 7.652 952 H ALA 124 HN ALA 124 -12.392 -10.118 3.887 953 HA ALA 124 HA ALA 124 -12.515 -10.171 1.082 954 1HB ALA 124 HB2 ALA 124 -13.456 -12.255 3.046 955 2HB ALA 124 HB1 ALA 124 -13.177 -12.518 1.327 956 3HB ALA 124 HB3 ALA 124 -11.829 -12.113 2.388 957 H ARG 125 HN ARG 125 -15.058 -10.466 3.539 958 HA ARG 125 HA ARG 125 -17.134 -10.944 1.646 959 1HB ARG 125 HB2 ARG 125 -18.544 -11.163 3.435 960 2HB ARG 125 HB1 ARG 125 -17.022 -11.321 4.302 961 1HG ARG 125 HG2 ARG 125 -17.316 -9.405 5.402 962 2HG ARG 125 HG1 ARG 125 -17.887 -8.558 3.987 963 1HD ARG 125 HD2 ARG 125 -19.627 -8.586 5.622 964 2HD ARG 125 HD1 ARG 125 -20.084 -9.581 4.247 965 HE ARG 125 HE ARG 125 -18.963 -11.283 6.133 966 1HH1 ARG 125 1HH1 ARG 125 -21.707 -9.131 5.817 967 2HH1 ARG 125 2HH1 ARG 125 -22.715 -10.041 6.903 968 1HH2 ARG 125 1HH2 ARG 125 -20.280 -12.487 7.580 969 2HH2 ARG 125 2HH2 ARG 125 -21.897 -11.952 7.912 970 H ILE 126 HN ILE 126 -16.094 -8.115 3.487 971 HA ILE 126 HA ILE 126 -18.185 -6.483 2.811 972 HB ILE 126 HB ILE 126 -16.685 -4.589 3.336 973 1HG1 ILE 126 2HG1 ILE 126 -14.424 -5.446 4.353 974 2HG1 ILE 126 1HG1 ILE 126 -14.603 -6.741 3.168 975 1HG2 ILE 126 1HG2 ILE 126 -16.541 -6.945 5.207 976 2HG2 ILE 126 3HG2 ILE 126 -16.261 -5.266 5.661 977 3HG2 ILE 126 2HG2 ILE 126 -17.856 -5.774 5.102 978 1HD1 ILE 126 1HD1 ILE 126 -14.584 -3.792 2.521 979 2HD1 ILE 126 3HD1 ILE 126 -13.216 -4.889 2.351 980 3HD1 ILE 126 2HD1 ILE 126 -14.659 -5.125 1.365 981 H TYR 127 HN TYR 127 -15.583 -7.498 0.897 982 HA TYR 127 HA TYR 127 -16.199 -5.606 -1.211 983 1HB TYR 127 HB2 TYR 127 -13.893 -6.168 -1.057 984 2HB TYR 127 HB1 TYR 127 -14.265 -7.891 -1.014 985 HD1 TYR 127 HD1 TYR 127 -14.085 -9.138 -2.964 986 HD2 TYR 127 HD2 TYR 127 -14.606 -4.922 -3.255 987 HE1 TYR 127 HE1 TYR 127 -13.797 -9.275 -5.400 988 HE2 TYR 127 HE2 TYR 127 -14.315 -5.054 -5.693 989 HH TYR 127 HH TYR 127 -14.412 -7.957 -7.406 990 H LYS 128 HN LYS 128 -16.393 -9.105 -0.741 991 HA LYS 128 HA LYS 128 -17.739 -9.341 -3.321 992 1HB LYS 128 HB2 LYS 128 -17.196 -11.683 -3.205 993 2HB LYS 128 HB1 LYS 128 -15.764 -10.742 -2.812 994 1HG LYS 128 HG2 LYS 128 -16.751 -11.148 -0.343 995 2HG LYS 128 HG1 LYS 128 -17.326 -12.605 -1.148 996 1HD LYS 128 HD2 LYS 128 -14.473 -11.640 -0.937 997 2HD LYS 128 HD1 LYS 128 -15.176 -13.052 -0.156 998 1HE LYS 128 HE2 LYS 128 -15.006 -12.718 -3.144 999 2HE LYS 128 HE1 LYS 128 -13.765 -13.518 -2.188 1000 1HZ LYS 128 HZ1 LYS 128 -16.608 -14.355 -2.369 1001 2HZ LYS 128 HZ3 LYS 128 -15.309 -15.097 -3.157 1002 3HZ LYS 128 HZ2 LYS 128 -15.407 -15.134 -1.469 1003 H THR 129 HN THR 129 -18.930 -8.452 -0.640 1004 HA THR 129 HA THR 129 -21.284 -10.137 -0.691 1005 HB THR 129 HB THR 129 -19.700 -9.631 1.828 1006 HG1 THR 129 HG1 THR 129 -19.577 -11.624 -0.026 1007 1HG2 THR 129 1HG2 THR 129 -22.229 -11.237 1.372 1008 2HG2 THR 129 3HG2 THR 129 -21.340 -11.138 2.890 1009 3HG2 THR 129 2HG2 THR 129 -22.115 -9.700 2.228 1010 H ASP 130 HN ASP 130 -19.866 -7.706 1.504 1011 HA ASP 130 HA ASP 130 -22.364 -6.207 1.205 1012 1HB ASP 130 HB2 ASP 130 -20.259 -6.188 3.368 1013 2HB ASP 130 HB1 ASP 130 -21.490 -4.939 3.239 1014 H ARG 131 HN ARG 131 -21.526 -5.559 -0.916 1015 HA ARG 131 HA ARG 131 -19.290 -4.221 -1.580 1016 1HB ARG 131 HB2 ARG 131 -22.080 -4.094 -2.514 1017 2HB ARG 131 HB1 ARG 131 -21.083 -2.721 -2.967 1018 1HG ARG 131 HG2 ARG 131 -21.049 -4.369 -4.710 1019 2HG ARG 131 HG1 ARG 131 -19.456 -4.252 -3.963 1020 1HD ARG 131 HD2 ARG 131 -20.072 -6.580 -4.371 1021 2HD ARG 131 HD1 ARG 131 -19.912 -6.249 -2.645 1022 HE ARG 131 HE ARG 131 -22.470 -5.999 -2.779 1023 1HH1 ARG 131 1HH1 ARG 131 -20.594 -8.234 -4.729 1024 2HH1 ARG 131 2HH1 ARG 131 -21.890 -9.374 -4.881 1025 1HH2 ARG 131 1HH2 ARG 131 -24.162 -7.484 -2.988 1026 2HH2 ARG 131 2HH2 ARG 131 -23.923 -8.948 -3.890 1027 H GLU 132 HN GLU 132 -22.045 -2.798 0.071 1028 HA GLU 132 HA GLU 132 -21.333 -0.129 0.148 1029 1HB GLU 132 HB2 GLU 132 -22.559 -0.105 2.344 1030 2HB GLU 132 HB1 GLU 132 -23.456 -0.785 0.993 1031 1HG GLU 132 HG2 GLU 132 -22.927 -3.041 1.802 1032 2HG GLU 132 HG1 GLU 132 -22.025 -2.345 3.143 1033 H LYS 133 HN LYS 133 -20.344 -2.739 2.277 1034 HA LYS 133 HA LYS 133 -18.856 -1.268 4.136 1035 1HB LYS 133 HB2 LYS 133 -18.711 -4.144 3.243 1036 2HB LYS 133 HB1 LYS 133 -17.732 -3.494 4.559 1037 1HG LYS 133 HG2 LYS 133 -20.744 -3.422 4.498 1038 2HG LYS 133 HG1 LYS 133 -19.798 -4.684 5.282 1039 1HD LYS 133 HD2 LYS 133 -18.786 -2.997 6.751 1040 2HD LYS 133 HD1 LYS 133 -19.745 -1.742 5.965 1041 1HE LYS 133 HE2 LYS 133 -21.793 -2.788 6.716 1042 2HE LYS 133 HE1 LYS 133 -20.886 -4.128 7.412 1043 1HZ LYS 133 HZ3 LYS 133 -19.873 -2.577 8.968 1044 2HZ LYS 133 HZ2 LYS 133 -20.745 -1.295 8.292 1045 3HZ LYS 133 HZ1 LYS 133 -21.560 -2.537 9.098 1046 H TYR 134 HN TYR 134 -18.086 -2.421 0.955 1047 HA TYR 134 HA TYR 134 -15.233 -2.008 1.237 1048 1HB TYR 134 HB2 TYR 134 -16.068 -3.819 -0.154 1049 2HB TYR 134 HB1 TYR 134 -16.993 -2.684 -1.121 1050 HD1 TYR 134 HD1 TYR 134 -16.019 -1.574 -2.965 1051 HD2 TYR 134 HD2 TYR 134 -13.565 -3.786 -0.285 1052 HE1 TYR 134 HE1 TYR 134 -14.147 -1.399 -4.545 1053 HE2 TYR 134 HE2 TYR 134 -11.689 -3.606 -1.861 1054 HH TYR 134 HH TYR 134 -11.402 -3.284 -4.336 1055 H ASN 135 HN ASN 135 -17.676 -0.727 -0.986 1056 HA ASN 135 HA ASN 135 -16.015 1.330 -1.950 1057 1HB ASN 135 HB2 ASN 135 -18.980 0.850 -2.211 1058 2HB ASN 135 HB1 ASN 135 -18.108 2.094 -3.088 1059 1HD2 ASN 135 1HD2 ASN 135 -18.567 -1.318 -2.682 1060 2HD2 ASN 135 2HD2 ASN 135 -17.831 -1.804 -4.175 1061 H ARG 136 HN ARG 136 -19.023 1.531 -0.093 1062 HA ARG 136 HA ARG 136 -19.132 4.292 0.109 1063 1HB ARG 136 HB2 ARG 136 -21.049 2.958 0.639 1064 2HB ARG 136 HB1 ARG 136 -20.192 2.140 1.935 1065 1HG ARG 136 HG2 ARG 136 -21.643 3.658 2.993 1066 2HG ARG 136 HG1 ARG 136 -20.040 4.392 3.086 1067 1HD ARG 136 HD2 ARG 136 -22.029 5.059 0.940 1068 2HD ARG 136 HD1 ARG 136 -21.917 5.946 2.459 1069 HE ARG 136 HE ARG 136 -19.413 6.118 1.621 1070 1HH1 ARG 136 1HH1 ARG 136 -22.399 6.504 -0.169 1071 2HH1 ARG 136 2HH1 ARG 136 -21.725 7.642 -1.294 1072 1HH2 ARG 136 1HH2 ARG 136 -18.530 7.625 0.149 1073 2HH2 ARG 136 2HH2 ARG 136 -19.518 8.262 -1.124 1074 H ILE 137 HN ILE 137 -17.271 2.022 2.001 1075 HA ILE 137 HA ILE 137 -17.088 3.861 4.236 1076 HB ILE 137 HB ILE 137 -15.847 1.121 4.052 1077 1HG1 ILE 137 2HG1 ILE 137 -18.218 0.839 3.567 1078 2HG1 ILE 137 1HG1 ILE 137 -17.897 0.298 5.210 1079 1HG2 ILE 137 2HG2 ILE 137 -16.716 2.898 6.341 1080 2HG2 ILE 137 1HG2 ILE 137 -16.124 1.248 6.527 1081 3HG2 ILE 137 3HG2 ILE 137 -15.065 2.498 5.878 1082 1HD1 ILE 137 3HD1 ILE 137 -19.103 2.942 4.432 1083 2HD1 ILE 137 2HD1 ILE 137 -19.975 1.546 5.062 1084 3HD1 ILE 137 1HD1 ILE 137 -18.804 2.384 6.079 1085 H ALA 138 HN ALA 138 -14.858 1.951 2.211 1086 HA ALA 138 HA ALA 138 -12.558 3.296 3.105 1087 1HB ALA 138 HB3 ALA 138 -11.405 2.125 1.383 1088 2HB ALA 138 HB2 ALA 138 -12.619 1.050 2.083 1089 3HB ALA 138 HB1 ALA 138 -12.913 1.813 0.519 1090 H ARG 139 HN ARG 139 -14.893 4.040 0.581 1091 HA ARG 139 HA ARG 139 -13.191 6.098 -0.522 1092 1HB ARG 139 HB2 ARG 139 -14.820 5.009 -1.994 1093 2HB ARG 139 HB1 ARG 139 -16.140 5.624 -1.006 1094 1HG ARG 139 HG2 ARG 139 -15.544 7.904 -1.557 1095 2HG ARG 139 HG1 ARG 139 -14.147 7.339 -2.475 1096 1HD ARG 139 HD2 ARG 139 -15.691 6.140 -3.990 1097 2HD ARG 139 HD1 ARG 139 -17.051 6.833 -3.105 1098 HE ARG 139 HE ARG 139 -15.986 9.062 -3.770 1099 1HH1 ARG 139 1HH1 ARG 139 -15.786 6.168 -5.716 1100 2HH1 ARG 139 2HH1 ARG 139 -15.689 7.028 -7.221 1101 1HH2 ARG 139 1HH2 ARG 139 -15.798 10.211 -5.758 1102 2HH2 ARG 139 2HH2 ARG 139 -15.677 9.319 -7.242 1103 H GLU 140 HN GLU 140 -15.603 5.887 2.035 1104 HA GLU 140 HA GLU 140 -15.946 8.731 2.144 1105 1HB GLU 140 HB2 GLU 140 -16.985 8.469 4.272 1106 2HB GLU 140 HB1 GLU 140 -17.630 7.244 3.204 1107 1HG GLU 140 HG2 GLU 140 -16.257 5.578 4.305 1108 2HG GLU 140 HG1 GLU 140 -15.526 6.827 5.314 1109 H TRP 141 HN TRP 141 -14.040 6.381 3.981 1110 HA TRP 141 HA TRP 141 -12.485 8.142 5.429 1111 1HB TRP 141 HB2 TRP 141 -11.607 5.587 4.087 1112 2HB TRP 141 HB1 TRP 141 -10.690 6.439 5.328 1113 HD1 TRP 141 HD1 TRP 141 -13.437 7.087 7.088 1114 HE1 TRP 141 HE1 TRP 141 -14.324 5.166 8.548 1115 HE3 TRP 141 HE3 TRP 141 -11.191 3.174 4.728 1116 HZ2 TRP 141 HZ2 TRP 141 -14.100 2.374 8.677 1117 HZ3 TRP 141 HZ3 TRP 141 -11.576 0.903 5.595 1118 HH2 TRP 141 HH2 TRP 141 -13.001 0.521 7.531 1119 H THR 142 HN THR 142 -12.255 7.189 2.092 1120 HA THR 142 HA THR 142 -9.958 8.529 1.293 1121 HB THR 142 HB THR 142 -12.568 7.877 0.003 1122 HG1 THR 142 HG1 THR 142 -11.026 6.256 0.219 1123 1HG2 THR 142 3HG2 THR 142 -10.389 9.484 -1.316 1124 2HG2 THR 142 2HG2 THR 142 -11.693 8.663 -2.177 1125 3HG2 THR 142 1HG2 THR 142 -12.063 9.971 -1.050 1126 H GLN 143 HN GLN 143 -13.253 9.719 1.563 1127 HA GLN 143 HA GLN 143 -12.665 12.411 0.793 1128 1HB GLN 143 HB2 GLN 143 -15.030 11.024 2.019 1129 2HB GLN 143 HB1 GLN 143 -15.065 12.702 1.506 1130 1HG GLN 143 HG2 GLN 143 -14.609 12.003 -0.779 1131 2HG GLN 143 HG1 GLN 143 -14.519 10.329 -0.255 1132 1HE2 GLN 143 1HE2 GLN 143 -16.784 10.546 1.572 1133 2HE2 GLN 143 2HE2 GLN 143 -18.199 10.655 0.585 1134 H LYS 144 HN LYS 144 -12.463 10.652 3.684 1135 HA LYS 144 HA LYS 144 -13.107 12.974 5.338 1136 1HB LYS 144 HB2 LYS 144 -13.495 10.056 5.599 1137 2HB LYS 144 HB1 LYS 144 -13.242 10.974 7.082 1138 1HG LYS 144 HG2 LYS 144 -15.198 12.224 6.753 1139 2HG LYS 144 HG1 LYS 144 -15.259 11.821 5.038 1140 1HD LYS 144 HD2 LYS 144 -16.983 10.592 6.117 1141 2HD LYS 144 HD1 LYS 144 -15.704 9.456 5.684 1142 1HE LYS 144 HE2 LYS 144 -14.982 9.256 7.901 1143 2HE LYS 144 HE1 LYS 144 -15.857 10.701 8.412 1144 1HZ LYS 144 HZ2 LYS 144 -17.940 9.500 7.980 1145 2HZ LYS 144 HZ1 LYS 144 -17.062 8.105 7.583 1146 3HZ LYS 144 HZ3 LYS 144 -17.003 8.731 9.156 1147 H TYR 145 HN TYR 145 -10.550 10.618 4.764 1148 HA TYR 145 HA TYR 145 -8.999 11.902 6.904 1149 1HB TYR 145 HB2 TYR 145 -9.080 8.933 6.314 1150 2HB TYR 145 HB1 TYR 145 -8.032 9.730 7.466 1151 HD1 TYR 145 HD1 TYR 145 -8.759 10.200 9.665 1152 HD2 TYR 145 HD2 TYR 145 -11.557 8.889 6.757 1153 HE1 TYR 145 HE1 TYR 145 -10.443 9.942 11.431 1154 HE2 TYR 145 HE2 TYR 145 -13.257 8.617 8.513 1155 HH TYR 145 HH TYR 145 -13.341 8.276 10.976 1156 H ALA 146 HN ALA 146 -9.127 11.681 3.731 1157 HA ALA 146 HA ALA 146 -6.287 11.147 3.540 1158 1HB ALA 146 HB3 ALA 146 -7.417 9.083 2.965 1159 2HB ALA 146 HB2 ALA 146 -8.389 9.928 1.759 1160 3HB ALA 146 HB1 ALA 146 -6.645 9.770 1.535 1161 H MET 147 HN MET 147 -8.820 11.717 1.196 1162 HA MET 147 HA MET 147 -7.799 13.212 -0.678 1163 1HB MET 147 HB2 MET 147 -9.924 13.832 -1.245 1164 2HB MET 147 HB1 MET 147 -10.284 12.618 -0.020 1165 1HG MET 147 HG2 MET 147 -10.798 14.255 1.598 1166 2HG MET 147 HG1 MET 147 -10.159 15.555 0.593 1167 1HE MET 147 HE1 MET 147 -12.326 16.977 0.946 1168 2HE MET 147 HE3 MET 147 -13.961 16.396 0.637 1169 3HE MET 147 HE2 MET 147 -13.022 15.719 1.968 No H/Q in entry = 1169 Start of MODEL 9 1 H1 MET 1 HT3 MET 1 21.563 -4.873 5.147 2 H2 MET 1 HT2 MET 1 22.357 -4.088 6.411 3 H3 MET 1 HT1 MET 1 20.699 -3.873 6.197 4 HA MET 1 HA MET 1 21.794 -1.928 5.402 5 1HB MET 1 HB2 MET 1 23.950 -3.328 5.014 6 2HB MET 1 HB1 MET 1 23.281 -3.629 3.416 7 1HG MET 1 HG2 MET 1 24.875 -1.762 3.444 8 2HG MET 1 HG1 MET 1 23.264 -1.274 2.926 9 1HE MET 1 HE3 MET 1 25.626 0.691 3.857 10 2HE MET 1 HE2 MET 1 24.059 1.321 3.346 11 3HE MET 1 HE1 MET 1 24.765 1.846 4.874 12 H ALA 2 HN ALA 2 19.468 -3.675 4.839 13 HA ALA 2 HA ALA 2 18.873 -3.713 2.090 14 1HB ALA 2 HB2 ALA 2 16.638 -4.149 2.718 15 2HB ALA 2 HB3 ALA 2 16.854 -3.383 4.291 16 3HB ALA 2 HB1 ALA 2 17.651 -4.914 3.941 17 H LEU 3 HN LEU 3 19.154 -1.129 4.227 18 HA LEU 3 HA LEU 3 17.064 0.561 3.277 19 1HB LEU 3 HB2 LEU 3 18.433 2.336 4.413 20 2HB LEU 3 HB1 LEU 3 17.942 0.996 5.427 21 HG LEU 3 HG LEU 3 20.347 0.106 4.660 22 1HD1 LEU 3 2HD1 LEU 3 20.864 2.075 3.333 23 2HD1 LEU 3 1HD1 LEU 3 20.621 3.109 4.741 24 3HD1 LEU 3 3HD1 LEU 3 21.952 1.952 4.716 25 1HD2 LEU 3 1HD2 LEU 3 19.713 1.983 6.937 26 2HD2 LEU 3 3HD2 LEU 3 19.625 0.223 6.947 27 3HD2 LEU 3 2HD2 LEU 3 21.189 1.025 6.825 28 H LYS 4 HN LYS 4 20.184 -0.324 2.201 29 HA LYS 4 HA LYS 4 20.492 2.036 0.601 30 1HB LYS 4 HB2 LYS 4 22.667 1.483 0.407 31 2HB LYS 4 HB1 LYS 4 22.278 0.523 1.824 32 1HG LYS 4 HG2 LYS 4 22.034 -1.460 0.477 33 2HG LYS 4 HG1 LYS 4 22.293 -0.520 -0.995 34 1HD LYS 4 HD2 LYS 4 24.545 0.055 -0.199 35 2HD LYS 4 HD1 LYS 4 24.275 -0.942 1.228 36 1HE LYS 4 HE2 LYS 4 25.577 -2.151 -0.427 37 2HE LYS 4 HE1 LYS 4 24.001 -2.907 -0.199 38 1HZ LYS 4 HZ2 LYS 4 24.735 -1.091 -2.435 39 2HZ LYS 4 HZ1 LYS 4 24.599 -2.772 -2.536 40 3HZ LYS 4 HZ3 LYS 4 23.233 -1.832 -2.221 41 H ARG 5 HN ARG 5 19.197 -1.007 0.394 42 HA ARG 5 HA ARG 5 19.180 -1.168 -2.501 43 1HB ARG 5 HB2 ARG 5 19.160 -3.314 -1.597 44 2HB ARG 5 HB1 ARG 5 18.126 -2.845 -0.244 45 1HG ARG 5 HG2 ARG 5 16.331 -3.528 -1.370 46 2HG ARG 5 HG1 ARG 5 16.698 -2.369 -2.650 47 1HD ARG 5 HD2 ARG 5 17.017 -4.114 -4.002 48 2HD ARG 5 HD1 ARG 5 18.473 -4.480 -3.077 49 HE ARG 5 HE ARG 5 16.096 -5.556 -1.891 50 1HH1 ARG 5 1HH1 ARG 5 18.525 -6.129 -4.343 51 2HH1 ARG 5 2HH1 ARG 5 18.306 -7.850 -4.340 52 1HH2 ARG 5 1HH2 ARG 5 15.808 -7.834 -1.892 53 2HH2 ARG 5 2HH2 ARG 5 16.786 -8.814 -2.938 54 H ILE 6 HN ILE 6 17.136 -0.531 0.236 55 HA ILE 6 HA ILE 6 14.801 0.181 -1.069 56 HB ILE 6 HB ILE 6 15.857 1.354 1.525 57 1HG1 ILE 6 2HG1 ILE 6 14.300 -1.143 0.906 58 2HG1 ILE 6 1HG1 ILE 6 15.878 -1.020 1.684 59 1HG2 ILE 6 2HG2 ILE 6 13.190 1.360 0.170 60 2HG2 ILE 6 1HG2 ILE 6 13.279 1.356 1.936 61 3HG2 ILE 6 3HG2 ILE 6 14.026 2.660 1.021 62 1HD1 ILE 6 3HD1 ILE 6 14.836 0.053 3.608 63 2HD1 ILE 6 2HD1 ILE 6 13.255 -0.105 2.840 64 3HD1 ILE 6 1HD1 ILE 6 14.164 -1.547 3.295 65 H HIS 7 HN HIS 7 17.818 1.727 -0.739 66 HA HIS 7 HA HIS 7 17.294 4.372 -1.401 67 1HB HIS 7 HB2 HIS 7 19.516 2.531 -1.451 68 2HB HIS 7 HB1 HIS 7 19.606 3.682 -2.783 69 HD1 HIS 7 HD1 HIS 7 19.124 3.812 1.003 70 HD2 HIS 7 HD2 HIS 7 20.749 6.023 -2.122 71 HE1 HIS 7 HE1 HIS 7 20.251 5.788 2.081 72 HE2 HIS 7 HE2 HIS 7 21.033 7.210 0.150 73 H LYS 8 HN LYS 8 17.029 1.512 -3.336 74 HA LYS 8 HA LYS 8 16.784 3.089 -5.779 75 1HB LYS 8 HB2 LYS 8 16.422 0.119 -5.326 76 2HB LYS 8 HB1 LYS 8 16.336 0.930 -6.884 77 1HG LYS 8 HG2 LYS 8 18.751 0.660 -5.108 78 2HG LYS 8 HG1 LYS 8 18.492 -0.079 -6.691 79 1HD LYS 8 HD2 LYS 8 18.454 2.132 -7.727 80 2HD LYS 8 HD1 LYS 8 18.682 2.892 -6.149 81 1HE LYS 8 HE2 LYS 8 20.794 2.834 -7.281 82 2HE LYS 8 HE1 LYS 8 20.843 1.670 -5.956 83 1HZ LYS 8 HZ2 LYS 8 20.351 1.017 -8.808 84 2HZ LYS 8 HZ1 LYS 8 21.802 0.768 -7.980 85 3HZ LYS 8 HZ3 LYS 8 20.419 -0.096 -7.538 86 H GLU 9 HN GLU 9 14.934 0.799 -3.910 87 HA GLU 9 HA GLU 9 12.512 0.967 -5.190 88 1HB GLU 9 HB2 GLU 9 12.802 0.629 -2.218 89 2HB GLU 9 HB1 GLU 9 11.667 -0.163 -3.292 90 1HG GLU 9 HG2 GLU 9 13.325 -1.616 -4.129 91 2HG GLU 9 HG1 GLU 9 14.617 -0.703 -3.339 92 H LEU 10 HN LEU 10 13.391 2.513 -2.181 93 HA LEU 10 HA LEU 10 11.060 4.111 -2.000 94 1HB LEU 10 HB2 LEU 10 11.833 3.512 0.049 95 2HB LEU 10 HB1 LEU 10 13.502 3.568 -0.458 96 HG LEU 10 HG LEU 10 12.112 6.156 -0.190 97 1HD1 LEU 10 3HD1 LEU 10 13.088 4.518 2.135 98 2HD1 LEU 10 2HD1 LEU 10 12.634 6.220 2.206 99 3HD1 LEU 10 1HD1 LEU 10 11.419 4.998 1.829 100 1HD2 LEU 10 2HD2 LEU 10 14.881 5.164 0.462 101 2HD2 LEU 10 1HD2 LEU 10 14.417 6.103 -0.956 102 3HD2 LEU 10 3HD2 LEU 10 14.331 6.827 0.651 103 H ASN 11 HN ASN 11 14.460 4.802 -2.766 104 HA ASN 11 HA ASN 11 14.062 7.625 -2.860 105 1HB ASN 11 HB2 ASN 11 16.265 6.163 -2.641 106 2HB ASN 11 HB1 ASN 11 16.267 6.356 -4.387 107 1HD2 ASN 11 1HD2 ASN 11 15.140 8.984 -4.403 108 2HD2 ASN 11 2HD2 ASN 11 16.362 10.049 -3.798 109 H ASP 12 HN ASP 12 13.395 5.082 -4.966 110 HA ASP 12 HA ASP 12 13.583 6.439 -7.462 111 1HB ASP 12 HB2 ASP 12 13.440 3.930 -7.108 112 2HB ASP 12 HB1 ASP 12 11.713 4.140 -6.828 113 H LEU 13 HN LEU 13 11.248 6.253 -4.923 114 HA LEU 13 HA LEU 13 9.092 7.548 -6.223 115 1HB LEU 13 HB2 LEU 13 9.887 7.215 -3.347 116 2HB LEU 13 HB1 LEU 13 8.497 8.182 -3.790 117 HG LEU 13 HG LEU 13 7.631 6.074 -3.180 118 1HD1 LEU 13 2HD1 LEU 13 6.794 7.034 -5.319 119 2HD1 LEU 13 1HD1 LEU 13 7.854 5.903 -6.162 120 3HD1 LEU 13 3HD1 LEU 13 6.560 5.298 -5.127 121 1HD2 LEU 13 2HD2 LEU 13 9.770 4.842 -4.885 122 2HD2 LEU 13 1HD2 LEU 13 9.642 4.789 -3.128 123 3HD2 LEU 13 3HD2 LEU 13 8.447 3.951 -4.124 124 H ALA 14 HN ALA 14 12.101 8.593 -5.022 125 HA ALA 14 HA ALA 14 11.284 11.386 -4.874 126 1HB ALA 14 HB1 ALA 14 12.636 10.439 -3.038 127 2HB ALA 14 HB2 ALA 14 13.392 11.825 -3.822 128 3HB ALA 14 HB3 ALA 14 13.954 10.194 -4.185 129 H ARG 15 HN ARG 15 13.123 9.189 -6.844 130 HA ARG 15 HA ARG 15 14.637 11.068 -8.306 131 1HB ARG 15 HB2 ARG 15 13.605 8.363 -9.183 132 2HB ARG 15 HB1 ARG 15 14.948 9.247 -9.899 133 1HG ARG 15 HG2 ARG 15 15.012 8.548 -7.001 134 2HG ARG 15 HG1 ARG 15 15.399 7.324 -8.201 135 1HD ARG 15 HD2 ARG 15 17.428 8.378 -7.436 136 2HD ARG 15 HD1 ARG 15 17.140 8.823 -9.114 137 HE ARG 15 HE ARG 15 16.221 10.694 -7.076 138 1HH1 ARG 15 1HH1 ARG 15 18.689 9.813 -9.391 139 2HH1 ARG 15 2HH1 ARG 15 19.387 11.397 -9.444 140 1HH2 ARG 15 1HH2 ARG 15 17.115 12.789 -7.163 141 2HH2 ARG 15 2HH2 ARG 15 18.475 13.101 -8.190 142 H ASP 16 HN ASP 16 11.746 9.262 -9.364 143 HA ASP 16 HA ASP 16 10.813 11.726 -10.632 144 1HB ASP 16 HB2 ASP 16 9.720 10.303 -12.348 145 2HB ASP 16 HB1 ASP 16 11.470 10.238 -12.410 146 HA PRO 17 HA PRO 17 7.763 10.588 -7.502 147 1HB PRO 17 HB2 PRO 17 6.972 13.088 -6.916 148 2HB PRO 17 HB1 PRO 17 8.494 12.418 -6.318 149 1HG PRO 17 HG2 PRO 17 8.014 14.296 -8.594 150 2HG PRO 17 HG1 PRO 17 9.316 14.301 -7.389 151 1HD PRO 17 HD2 PRO 17 9.564 13.312 -9.949 152 2HD PRO 17 HD1 PRO 17 10.577 12.816 -8.580 153 HA PRO 18 HA PRO 18 4.268 10.973 -10.373 154 1HB PRO 18 HB2 PRO 18 3.155 8.679 -9.026 155 2HB PRO 18 HB1 PRO 18 3.815 8.770 -10.658 156 1HG PRO 18 HG2 PRO 18 4.973 7.349 -8.620 157 2HG PRO 18 HG1 PRO 18 5.864 7.999 -10.007 158 1HD PRO 18 HD2 PRO 18 5.602 9.112 -7.235 159 2HD PRO 18 HD1 PRO 18 7.038 9.016 -8.282 160 H ALA 19 HN ALA 19 1.800 10.002 -9.318 161 HA ALA 19 HA ALA 19 1.338 12.015 -7.224 162 1HB ALA 19 HB1 ALA 19 0.225 12.452 -9.390 163 2HB ALA 19 HB2 ALA 19 -0.906 12.267 -8.054 164 3HB ALA 19 HB3 ALA 19 -0.673 10.949 -9.201 165 H GLN 20 HN GLN 20 0.051 8.875 -8.352 166 HA GLN 20 HA GLN 20 -1.472 8.305 -6.082 167 1HB GLN 20 HB2 GLN 20 -0.189 5.963 -7.288 168 2HB GLN 20 HB1 GLN 20 -1.887 6.292 -6.995 169 1HG GLN 20 HG2 GLN 20 -0.316 7.480 -9.262 170 2HG GLN 20 HG1 GLN 20 -1.261 6.002 -9.391 171 1HE2 GLN 20 1HE2 GLN 20 -3.470 6.876 -7.770 172 2HE2 GLN 20 2HE2 GLN 20 -4.309 8.084 -8.665 173 H CYS 21 HN CYS 21 1.934 8.322 -6.405 174 HA CYS 21 HA CYS 21 2.157 6.937 -3.861 175 1HB CYS 21 HB2 CYS 21 3.825 5.388 -4.639 176 2HB CYS 21 HB1 CYS 21 2.371 5.208 -5.611 177 HG CYS 21 HG CYS 21 4.499 4.859 -7.331 178 H SER 22 HN SER 22 3.616 7.776 -2.593 179 HA SER 22 HA SER 22 6.112 8.722 -3.662 180 1HB SER 22 HB2 SER 22 4.606 10.742 -3.709 181 2HB SER 22 HB1 SER 22 4.479 10.607 -1.957 182 HG SER 22 HG SER 22 6.774 11.165 -3.514 183 H ALA 23 HN ALA 23 7.636 8.045 -2.381 184 HA ALA 23 HA ALA 23 7.188 7.781 0.516 185 1HB ALA 23 HB2 ALA 23 6.970 5.547 -0.091 186 2HB ALA 23 HB3 ALA 23 8.697 5.678 0.233 187 3HB ALA 23 HB1 ALA 23 8.118 5.688 -1.425 188 H GLY 24 HN GLY 24 9.429 7.394 1.563 189 1HA GLY 24 HA1 GLY 24 11.203 9.423 0.535 190 2HA GLY 24 HA2 GLY 24 11.878 7.800 0.457 191 HA PRO 25 HA PRO 25 13.340 8.038 4.565 192 1HB PRO 25 HB2 PRO 25 14.934 10.282 4.740 193 2HB PRO 25 HB1 PRO 25 15.439 8.750 4.026 194 1HG PRO 25 HG2 PRO 25 14.453 11.235 2.697 195 2HG PRO 25 HG1 PRO 25 15.765 10.145 2.208 196 1HD PRO 25 HD2 PRO 25 13.357 10.068 1.023 197 2HD PRO 25 HD1 PRO 25 14.307 8.596 1.304 198 H VAL 26 HN VAL 26 11.891 8.413 6.155 199 HA VAL 26 HA VAL 26 10.805 11.136 6.434 200 HB VAL 26 HB VAL 26 9.888 8.502 7.590 201 1HG1 VAL 26 3HG1 VAL 26 9.610 10.254 9.276 202 2HG1 VAL 26 2HG1 VAL 26 8.768 11.264 8.102 203 3HG1 VAL 26 1HG1 VAL 26 8.052 9.741 8.633 204 1HG2 VAL 26 1HG2 VAL 26 9.375 9.060 5.218 205 2HG2 VAL 26 3HG2 VAL 26 7.951 8.853 6.236 206 3HG2 VAL 26 2HG2 VAL 26 8.488 10.474 5.791 207 H GLY 27 HN GLY 27 11.882 8.520 8.585 208 1HA GLY 27 HA1 GLY 27 12.987 8.690 10.625 209 2HA GLY 27 HA2 GLY 27 12.862 10.451 10.523 210 H ASP 28 HN ASP 28 13.817 9.910 7.623 211 HA ASP 28 HA ASP 28 15.741 9.949 6.411 212 1HB ASP 28 HB2 ASP 28 16.583 11.598 8.067 213 2HB ASP 28 HB1 ASP 28 17.167 10.273 9.065 214 H ASP 29 HN ASP 29 14.796 7.747 8.504 215 HA ASP 29 HA ASP 29 16.772 5.742 7.816 216 1HB ASP 29 HB2 ASP 29 15.064 4.281 9.162 217 2HB ASP 29 HB1 ASP 29 16.126 5.390 10.020 218 H MET 30 HN MET 30 16.352 4.028 6.487 219 HA MET 30 HA MET 30 14.169 4.333 4.604 220 1HB MET 30 HB2 MET 30 16.790 3.102 4.675 221 2HB MET 30 HB1 MET 30 15.592 2.022 4.015 222 1HG MET 30 HG2 MET 30 16.060 3.015 2.095 223 2HG MET 30 HG1 MET 30 15.097 4.329 2.659 224 1HE MET 30 HE2 MET 30 16.019 6.624 3.543 225 2HE MET 30 HE1 MET 30 16.798 5.768 4.870 226 3HE MET 30 HE3 MET 30 17.720 6.920 3.904 227 H PHE 31 HN PHE 31 14.037 3.330 7.540 228 HA PHE 31 HA PHE 31 12.382 0.995 6.927 229 1HB PHE 31 HB2 PHE 31 12.907 0.328 9.334 230 2HB PHE 31 HB1 PHE 31 14.083 -0.034 8.094 231 HD1 PHE 31 HD1 PHE 31 13.376 1.757 11.167 232 HD2 PHE 31 HD2 PHE 31 16.168 1.315 7.978 233 HE1 PHE 31 HE1 PHE 31 15.069 2.967 12.478 234 HE2 PHE 31 HE2 PHE 31 17.865 2.508 9.292 235 HZ PHE 31 HZ PHE 31 17.354 3.160 11.654 236 H HIS 32 HN HIS 32 12.194 4.029 7.598 237 HA HIS 32 HA HIS 32 9.600 3.598 8.734 238 1HB HIS 32 HB2 HIS 32 10.596 3.925 10.805 239 2HB HIS 32 HB1 HIS 32 11.836 4.992 10.159 240 HD1 HIS 32 HD1 HIS 32 11.521 7.352 10.822 241 HD2 HIS 32 HD2 HIS 32 7.912 5.295 10.781 242 HE1 HIS 32 HE1 HIS 32 9.798 8.993 11.650 243 HE2 HIS 32 HE2 HIS 32 7.665 7.661 11.807 244 H TRP 33 HN TRP 33 8.833 4.267 6.798 245 HA TRP 33 HA TRP 33 9.336 7.016 6.053 246 1HB TRP 33 HB2 TRP 33 9.610 6.111 3.643 247 2HB TRP 33 HB1 TRP 33 10.959 6.156 4.740 248 HD1 TRP 33 HD1 TRP 33 11.406 3.588 6.000 249 HE1 TRP 33 HE1 TRP 33 11.485 1.353 4.763 250 HE3 TRP 33 HE3 TRP 33 8.860 4.909 1.817 251 HZ2 TRP 33 HZ2 TRP 33 10.641 0.291 2.320 252 HZ3 TRP 33 HZ3 TRP 33 8.570 3.236 0.041 253 HH2 TRP 33 HH2 TRP 33 9.446 0.981 0.304 254 H GLN 34 HN GLN 34 7.988 7.775 4.370 255 HA GLN 34 HA GLN 34 5.270 6.855 5.006 256 1HB GLN 34 HB2 GLN 34 5.996 9.053 5.964 257 2HB GLN 34 HB1 GLN 34 6.207 9.643 4.319 258 1HG GLN 34 HG2 GLN 34 4.077 10.364 5.319 259 2HG GLN 34 HG1 GLN 34 3.855 9.397 3.862 260 1HE2 GLN 34 1HE2 GLN 34 1.780 8.766 4.384 261 2HE2 GLN 34 2HE2 GLN 34 1.438 7.659 5.667 262 H ALA 35 HN ALA 35 4.213 6.037 3.402 263 HA ALA 35 HA ALA 35 4.736 7.021 0.679 264 1HB ALA 35 HB1 ALA 35 3.542 4.402 1.593 265 2HB ALA 35 HB2 ALA 35 5.172 4.645 0.969 266 3HB ALA 35 HB3 ALA 35 3.781 4.893 -0.083 267 H THR 36 HN THR 36 3.155 8.203 -0.244 268 HA THR 36 HA THR 36 0.459 8.054 0.902 269 HB THR 36 HB THR 36 0.159 10.193 -0.541 270 HG1 THR 36 HG1 THR 36 1.906 10.945 -1.458 271 1HG2 THR 36 1HG2 THR 36 1.928 10.201 1.901 272 2HG2 THR 36 3HG2 THR 36 1.039 11.589 1.277 273 3HG2 THR 36 2HG2 THR 36 0.166 10.188 1.901 274 H ILE 37 HN ILE 37 -0.753 6.630 -0.111 275 HA ILE 37 HA ILE 37 -0.466 6.286 -3.023 276 HB ILE 37 HB ILE 37 -1.230 4.406 -0.825 277 1HG1 ILE 37 2HG1 ILE 37 0.678 4.132 -3.152 278 2HG1 ILE 37 1HG1 ILE 37 1.142 4.740 -1.561 279 1HG2 ILE 37 3HG2 ILE 37 -1.767 4.021 -3.760 280 2HG2 ILE 37 2HG2 ILE 37 -1.820 2.735 -2.555 281 3HG2 ILE 37 1HG2 ILE 37 -2.957 4.082 -2.465 282 1HD1 ILE 37 1HD1 ILE 37 -0.007 2.022 -2.098 283 2HD1 ILE 37 3HD1 ILE 37 1.700 2.378 -1.864 284 3HD1 ILE 37 2HD1 ILE 37 0.560 2.632 -0.546 285 H MET 38 HN MET 38 -2.177 6.755 -4.346 286 HA MET 38 HA MET 38 -4.460 7.846 -2.884 287 1HB MET 38 HB2 MET 38 -3.436 8.770 -5.535 288 2HB MET 38 HB1 MET 38 -4.789 9.402 -4.637 289 1HG MET 38 HG2 MET 38 -3.398 10.157 -2.898 290 2HG MET 38 HG1 MET 38 -1.984 9.386 -3.622 291 1HE MET 38 HE2 MET 38 -0.579 11.610 -3.536 292 2HE MET 38 HE1 MET 38 -1.126 13.158 -4.188 293 3HE MET 38 HE3 MET 38 -1.917 12.468 -2.771 294 H GLY 39 HN GLY 39 -6.424 7.989 -3.704 295 1HA GLY 39 HA1 GLY 39 -8.300 7.116 -4.514 296 2HA GLY 39 HA2 GLY 39 -7.374 5.832 -5.269 297 HA PRO 40 HA PRO 40 -8.632 9.851 -8.089 298 1HB PRO 40 HB2 PRO 40 -5.783 10.337 -8.834 299 2HB PRO 40 HB1 PRO 40 -7.140 11.470 -8.747 300 1HG PRO 40 HG2 PRO 40 -5.354 11.416 -6.806 301 2HG PRO 40 HG1 PRO 40 -7.081 11.557 -6.422 302 1HD PRO 40 HD2 PRO 40 -5.289 9.176 -6.252 303 2HD PRO 40 HD1 PRO 40 -6.574 9.694 -5.139 304 H ASN 41 HN ASN 41 -8.189 10.174 -10.512 305 HA ASN 41 HA ASN 41 -8.386 9.284 -12.569 306 1HB ASN 41 HB2 ASN 41 -6.778 6.986 -11.448 307 2HB ASN 41 HB1 ASN 41 -7.336 7.059 -13.115 308 1HD2 ASN 41 1HD2 ASN 41 -5.287 8.528 -10.728 309 2HD2 ASN 41 2HD2 ASN 41 -4.227 9.327 -11.835 310 H ASP 42 HN ASP 42 -8.521 6.078 -11.124 311 HA ASP 42 HA ASP 42 -11.377 6.238 -10.834 312 1HB ASP 42 HB2 ASP 42 -11.102 5.849 -13.283 313 2HB ASP 42 HB1 ASP 42 -10.260 4.346 -12.917 314 H SER 43 HN SER 43 -11.195 5.594 -8.819 315 HA SER 43 HA SER 43 -10.683 2.755 -8.434 316 1HB SER 43 HB2 SER 43 -9.387 3.099 -6.439 317 2HB SER 43 HB1 SER 43 -8.659 4.173 -7.642 318 HG SER 43 HG SER 43 -9.398 5.856 -6.636 319 HA PRO 44 HA PRO 44 -14.415 3.240 -5.916 320 1HB PRO 44 HB2 PRO 44 -13.139 1.546 -3.861 321 2HB PRO 44 HB1 PRO 44 -14.653 1.298 -4.734 322 1HG PRO 44 HG2 PRO 44 -12.467 -0.174 -5.235 323 2HG PRO 44 HG1 PRO 44 -13.611 0.276 -6.515 324 1HD PRO 44 HD2 PRO 44 -10.923 1.420 -5.876 325 2HD PRO 44 HD1 PRO 44 -11.684 1.137 -7.454 326 H TYR 45 HN TYR 45 -11.232 4.010 -5.024 327 HA TYR 45 HA TYR 45 -12.090 5.482 -2.612 328 1HB TYR 45 HB2 TYR 45 -9.279 4.597 -3.296 329 2HB TYR 45 HB1 TYR 45 -9.837 5.197 -1.755 330 HD1 TYR 45 HD1 TYR 45 -12.460 3.251 -2.175 331 HD2 TYR 45 HD2 TYR 45 -8.252 2.785 -2.033 332 HE1 TYR 45 HE1 TYR 45 -12.751 0.911 -1.486 333 HE2 TYR 45 HE2 TYR 45 -8.521 0.442 -1.341 334 HH TYR 45 HH TYR 45 -10.208 -0.975 -0.264 335 H GLN 46 HN GLN 46 -12.141 6.299 -5.493 336 HA GLN 46 HA GLN 46 -10.020 7.703 -6.424 337 1HB GLN 46 HB2 GLN 46 -12.412 7.223 -7.407 338 2HB GLN 46 HB1 GLN 46 -12.741 8.859 -6.854 339 1HG GLN 46 HG2 GLN 46 -10.298 8.406 -8.475 340 2HG GLN 46 HG1 GLN 46 -11.849 8.360 -9.300 341 1HE2 GLN 46 1HE2 GLN 46 -9.660 10.142 -9.562 342 2HE2 GLN 46 2HE2 GLN 46 -10.257 11.722 -9.232 343 H GLY 47 HN GLY 47 -8.852 9.258 -5.703 344 1HA GLY 47 HA1 GLY 47 -10.096 11.487 -4.268 345 2HA GLY 47 HA2 GLY 47 -8.589 11.582 -5.141 346 H GLY 48 HN GLY 48 -8.925 8.781 -3.279 347 1HA GLY 48 HA1 GLY 48 -8.424 8.246 -1.099 348 2HA GLY 48 HA2 GLY 48 -8.267 9.952 -0.738 349 H VAL 49 HN VAL 49 -6.346 10.881 -0.670 350 HA VAL 49 HA VAL 49 -3.956 9.451 -1.407 351 HB VAL 49 HB VAL 49 -4.263 11.714 0.554 352 1HG1 VAL 49 3HG1 VAL 49 -1.910 10.816 -1.103 353 2HG1 VAL 49 2HG1 VAL 49 -1.939 12.253 -0.081 354 3HG1 VAL 49 1HG1 VAL 49 -2.097 10.652 0.642 355 1HG2 VAL 49 2HG2 VAL 49 -3.893 11.941 -2.432 356 2HG2 VAL 49 1HG2 VAL 49 -5.317 12.413 -1.508 357 3HG2 VAL 49 3HG2 VAL 49 -3.796 13.275 -1.289 358 H PHE 50 HN PHE 50 -3.882 7.503 -0.369 359 HA PHE 50 HA PHE 50 -4.497 7.441 2.451 360 1HB PHE 50 HB2 PHE 50 -3.811 5.280 0.480 361 2HB PHE 50 HB1 PHE 50 -4.064 4.985 2.197 362 HD1 PHE 50 HD1 PHE 50 -6.260 5.470 3.205 363 HD2 PHE 50 HD2 PHE 50 -5.576 5.645 -0.987 364 HE1 PHE 50 HE1 PHE 50 -8.682 5.420 2.813 365 HE2 PHE 50 HE2 PHE 50 -7.986 5.594 -1.384 366 HZ PHE 50 HZ PHE 50 -9.522 5.492 0.521 367 H PHE 51 HN PHE 51 -3.022 6.112 3.865 368 HA PHE 51 HA PHE 51 -0.388 7.384 3.615 369 1HB PHE 51 HB2 PHE 51 -1.877 7.041 6.218 370 2HB PHE 51 HB1 PHE 51 -0.537 8.125 5.863 371 HD1 PHE 51 HD1 PHE 51 -4.109 7.522 4.977 372 HD2 PHE 51 HD2 PHE 51 -0.962 10.361 5.399 373 HE1 PHE 51 HE1 PHE 51 -5.700 9.355 4.560 374 HE2 PHE 51 HE2 PHE 51 -2.530 12.193 4.981 375 HZ PHE 51 HZ PHE 51 -4.950 11.660 4.541 376 H LEU 52 HN LEU 52 1.185 5.872 3.686 377 HA LEU 52 HA LEU 52 0.707 3.478 5.309 378 1HB LEU 52 HB2 LEU 52 1.974 3.476 2.555 379 2HB LEU 52 HB1 LEU 52 1.804 2.086 3.608 380 HG LEU 52 HG LEU 52 -0.758 2.637 3.435 381 1HD1 LEU 52 3HD1 LEU 52 0.356 3.931 0.958 382 2HD1 LEU 52 2HD1 LEU 52 -1.337 3.499 1.198 383 3HD1 LEU 52 1HD1 LEU 52 -0.580 4.705 2.236 384 1HD2 LEU 52 3HD2 LEU 52 0.832 1.343 1.228 385 2HD2 LEU 52 2HD2 LEU 52 0.226 0.570 2.693 386 3HD2 LEU 52 1HD2 LEU 52 -0.904 1.156 1.475 387 H THR 53 HN THR 53 2.252 3.218 6.771 388 HA THR 53 HA THR 53 4.862 4.477 6.307 389 HB THR 53 HB THR 53 3.910 3.173 8.860 390 HG1 THR 53 HG1 THR 53 3.240 5.587 7.728 391 1HG2 THR 53 3HG2 THR 53 6.122 5.146 8.276 392 2HG2 THR 53 2HG2 THR 53 5.663 4.571 9.881 393 3HG2 THR 53 1HG2 THR 53 6.319 3.441 8.694 394 H ILE 54 HN ILE 54 6.628 3.265 5.909 395 HA ILE 54 HA ILE 54 6.193 0.352 5.856 396 HB ILE 54 HB ILE 54 8.249 1.661 4.143 397 1HG1 ILE 54 2HG1 ILE 54 5.269 1.845 3.790 398 2HG1 ILE 54 1HG1 ILE 54 6.497 3.088 3.559 399 1HG2 ILE 54 1HG2 ILE 54 8.122 -0.760 4.249 400 2HG2 ILE 54 3HG2 ILE 54 6.426 -0.708 3.767 401 3HG2 ILE 54 2HG2 ILE 54 7.678 -0.187 2.640 402 1HD1 ILE 54 1HD1 ILE 54 7.246 1.935 1.528 403 2HD1 ILE 54 3HD1 ILE 54 5.964 0.745 1.749 404 3HD1 ILE 54 2HD1 ILE 54 5.557 2.431 1.444 405 H HIS 55 HN HIS 55 7.651 -0.945 6.820 406 HA HIS 55 HA HIS 55 10.165 0.261 7.661 407 1HB HIS 55 HB2 HIS 55 10.072 -0.883 9.829 408 2HB HIS 55 HB1 HIS 55 8.877 0.392 9.623 409 HD1 HIS 55 HD1 HIS 55 6.721 -0.250 10.565 410 HD2 HIS 55 HD2 HIS 55 8.748 -3.497 8.983 411 HE1 HIS 55 HE1 HIS 55 5.224 -2.203 10.896 412 HE2 HIS 55 HE2 HIS 55 6.580 -4.211 10.228 413 H PHE 56 HN PHE 56 11.932 -1.119 7.925 414 HA PHE 56 HA PHE 56 11.549 -3.904 7.060 415 1HB PHE 56 HB2 PHE 56 13.210 -3.807 5.453 416 2HB PHE 56 HB1 PHE 56 12.462 -2.241 5.250 417 HD1 PHE 56 HD1 PHE 56 15.439 -4.062 6.344 418 HD2 PHE 56 HD2 PHE 56 13.630 -0.251 5.898 419 HE1 PHE 56 HE1 PHE 56 17.631 -2.994 6.652 420 HE2 PHE 56 HE2 PHE 56 15.803 0.833 6.201 421 HZ PHE 56 HZ PHE 56 17.819 -0.543 6.585 422 HA PRO 57 HA PRO 57 14.836 -4.420 10.112 423 1HB PRO 57 HB2 PRO 57 14.107 -6.888 10.951 424 2HB PRO 57 HB1 PRO 57 13.314 -5.421 11.529 425 1HG PRO 57 HG2 PRO 57 12.262 -7.512 9.780 426 2HG PRO 57 HG1 PRO 57 11.387 -6.213 10.604 427 1HD PRO 57 HD2 PRO 57 12.338 -6.344 7.830 428 2HD PRO 57 HD1 PRO 57 11.180 -5.217 8.568 429 H THR 58 HN THR 58 16.475 -4.546 8.540 430 HA THR 58 HA THR 58 17.842 -5.469 6.930 431 HB THR 58 HB THR 58 19.122 -7.422 7.939 432 HG1 THR 58 HG1 THR 58 17.054 -7.771 9.368 433 1HG2 THR 58 3HG2 THR 58 19.803 -5.075 8.178 434 2HG2 THR 58 2HG2 THR 58 18.767 -4.923 9.597 435 3HG2 THR 58 1HG2 THR 58 20.159 -6.002 9.637 436 H ASP 59 HN ASP 59 15.769 -6.049 5.612 437 HA ASP 59 HA ASP 59 15.146 -8.868 5.499 438 1HB ASP 59 HB2 ASP 59 14.273 -6.617 3.696 439 2HB ASP 59 HB1 ASP 59 13.598 -8.242 3.701 440 H TYR 60 HN TYR 60 16.992 -6.587 3.589 441 HA TYR 60 HA TYR 60 17.449 -8.071 1.286 442 1HB TYR 60 HB2 TYR 60 18.157 -5.734 1.461 443 2HB TYR 60 HB1 TYR 60 19.283 -6.147 2.758 444 HD1 TYR 60 HD1 TYR 60 18.670 -6.341 -0.862 445 HD2 TYR 60 HD2 TYR 60 21.442 -7.098 2.272 446 HE1 TYR 60 HE1 TYR 60 20.457 -6.651 -2.526 447 HE2 TYR 60 HE2 TYR 60 23.235 -7.413 0.623 448 HH TYR 60 HH TYR 60 23.474 -8.017 -1.738 449 HA PRO 61 HA PRO 61 18.999 -8.708 -0.085 450 1HB PRO 61 HB2 PRO 61 19.814 -10.947 -1.317 451 2HB PRO 61 HB1 PRO 61 20.944 -9.772 -0.633 452 1HG PRO 61 HG2 PRO 61 20.129 -12.434 0.385 453 2HG PRO 61 HG1 PRO 61 21.667 -11.582 0.575 454 1HD PRO 61 HD2 PRO 61 19.573 -11.762 2.459 455 2HD PRO 61 HD1 PRO 61 21.009 -10.728 2.558 456 H PHE 62 HN PHE 62 16.836 -10.160 1.656 457 HA PHE 62 HA PHE 62 15.366 -11.248 -0.660 458 1HB PHE 62 HB2 PHE 62 15.136 -12.492 1.487 459 2HB PHE 62 HB1 PHE 62 14.477 -11.048 2.239 460 HD1 PHE 62 HD1 PHE 62 13.378 -14.018 1.573 461 HD2 PHE 62 HD2 PHE 62 12.659 -10.092 0.087 462 HE1 PHE 62 HE1 PHE 62 11.138 -14.706 0.851 463 HE2 PHE 62 HE2 PHE 62 10.407 -10.790 -0.634 464 HZ PHE 62 HZ PHE 62 9.614 -13.011 -0.195 465 H LYS 63 HN LYS 63 14.174 -9.250 1.978 466 HA LYS 63 HA LYS 63 13.524 -7.095 2.082 467 1HB LYS 63 HB2 LYS 63 15.108 -6.977 -0.055 468 2HB LYS 63 HB1 LYS 63 13.572 -6.622 -0.813 469 1HG LYS 63 HG2 LYS 63 14.666 -5.148 1.565 470 2HG LYS 63 HG1 LYS 63 14.814 -4.600 -0.107 471 1HD LYS 63 HD2 LYS 63 12.471 -4.341 -0.320 472 2HD LYS 63 HD1 LYS 63 12.173 -5.204 1.190 473 1HE LYS 63 HE2 LYS 63 12.635 -3.416 2.463 474 2HE LYS 63 HE1 LYS 63 13.897 -2.841 1.377 475 1HZ LYS 63 HZ2 LYS 63 12.123 -2.134 -0.165 476 2HZ LYS 63 HZ1 LYS 63 10.979 -2.539 1.015 477 3HZ LYS 63 HZ3 LYS 63 12.094 -1.306 1.316 478 HA PRO 64 HA PRO 64 9.294 -7.758 0.749 479 1HB PRO 64 HB2 PRO 64 8.306 -9.292 2.759 480 2HB PRO 64 HB1 PRO 64 8.979 -9.981 1.280 481 1HG PRO 64 HG2 PRO 64 10.044 -10.094 3.978 482 2HG PRO 64 HG1 PRO 64 10.603 -10.944 2.530 483 1HD PRO 64 HD2 PRO 64 11.621 -8.469 3.756 484 2HD PRO 64 HD1 PRO 64 12.413 -9.569 2.608 485 HA PRO 65 HA PRO 65 9.589 -4.581 4.079 486 1HB PRO 65 HB2 PRO 65 8.532 -2.530 2.672 487 2HB PRO 65 HB1 PRO 65 10.224 -3.019 2.508 488 1HG PRO 65 HG2 PRO 65 7.886 -3.648 0.744 489 2HG PRO 65 HG1 PRO 65 9.538 -3.197 0.290 490 1HD PRO 65 HD2 PRO 65 8.632 -5.763 0.273 491 2HD PRO 65 HD1 PRO 65 10.326 -5.335 0.570 492 H LYS 66 HN LYS 66 8.053 -4.288 5.628 493 HA LYS 66 HA LYS 66 5.348 -5.062 4.993 494 1HB LYS 66 HB2 LYS 66 6.470 -5.551 7.225 495 2HB LYS 66 HB1 LYS 66 6.261 -3.843 7.598 496 1HG LYS 66 HG2 LYS 66 4.349 -4.582 8.534 497 2HG LYS 66 HG1 LYS 66 3.747 -4.431 6.881 498 1HD LYS 66 HD2 LYS 66 4.786 -6.956 8.175 499 2HD LYS 66 HD1 LYS 66 3.096 -6.566 7.879 500 1HE LYS 66 HE2 LYS 66 3.572 -6.510 5.455 501 2HE LYS 66 HE1 LYS 66 5.231 -7.000 5.798 502 1HZ LYS 66 HZ3 LYS 66 4.311 -9.021 6.861 503 2HZ LYS 66 HZ2 LYS 66 2.768 -8.560 6.330 504 3HZ LYS 66 HZ1 LYS 66 3.976 -8.920 5.204 505 H VAL 67 HN VAL 67 4.680 -3.573 3.525 506 HA VAL 67 HA VAL 67 4.516 -0.772 4.167 507 HB VAL 67 HB VAL 67 2.931 -2.251 2.064 508 1HG1 VAL 67 3HG1 VAL 67 3.791 0.612 2.364 509 2HG1 VAL 67 2HG1 VAL 67 3.020 -0.058 0.926 510 3HG1 VAL 67 1HG1 VAL 67 2.154 -0.038 2.461 511 1HG2 VAL 67 2HG2 VAL 67 5.742 -1.200 1.887 512 2HG2 VAL 67 1HG2 VAL 67 5.185 -2.849 1.615 513 3HG2 VAL 67 3HG2 VAL 67 4.746 -1.571 0.481 514 H ALA 68 HN ALA 68 3.028 0.044 5.530 515 HA ALA 68 HA ALA 68 0.577 -1.513 5.910 516 1HB ALA 68 HB1 ALA 68 2.179 -2.121 7.674 517 2HB ALA 68 HB2 ALA 68 0.746 -1.324 8.325 518 3HB ALA 68 HB3 ALA 68 2.259 -0.430 8.170 519 H PHE 69 HN PHE 69 -1.213 -0.431 6.019 520 HA PHE 69 HA PHE 69 -1.386 2.296 5.545 521 1HB PHE 69 HB2 PHE 69 -3.349 0.178 6.180 522 2HB PHE 69 HB1 PHE 69 -3.864 1.859 6.253 523 HD1 PHE 69 HD1 PHE 69 -4.237 3.117 4.269 524 HD2 PHE 69 HD2 PHE 69 -2.504 -0.760 4.055 525 HE1 PHE 69 HE1 PHE 69 -4.546 3.102 1.825 526 HE2 PHE 69 HE2 PHE 69 -2.798 -0.765 1.614 527 HZ PHE 69 HZ PHE 69 -3.903 1.195 0.513 528 H THR 70 HN THR 70 -1.906 4.036 6.730 529 HA THR 70 HA THR 70 -1.752 3.788 9.657 530 HB THR 70 HB THR 70 -1.601 6.314 8.012 531 HG1 THR 70 HG1 THR 70 0.706 4.900 8.865 532 1HG2 THR 70 2HG2 THR 70 -0.490 5.578 10.721 533 2HG2 THR 70 1HG2 THR 70 -0.277 7.129 9.906 534 3HG2 THR 70 3HG2 THR 70 -1.884 6.612 10.407 535 H THR 71 HN THR 71 -3.987 4.147 7.199 536 HA THR 71 HA THR 71 -5.709 5.993 8.715 537 HB THR 71 HB THR 71 -4.798 6.956 6.628 538 HG1 THR 71 HG1 THR 71 -6.631 7.979 6.661 539 1HG2 THR 71 1HG2 THR 71 -4.675 4.777 5.410 540 2HG2 THR 71 3HG2 THR 71 -6.415 4.906 5.149 541 3HG2 THR 71 2HG2 THR 71 -5.322 6.126 4.491 542 H ARG 72 HN ARG 72 -8.069 5.801 7.674 543 HA ARG 72 HA ARG 72 -8.963 3.122 8.163 544 1HB ARG 72 HB2 ARG 72 -10.413 5.649 7.391 545 2HB ARG 72 HB1 ARG 72 -11.227 4.100 7.498 546 1HG ARG 72 HG2 ARG 72 -11.661 5.136 9.528 547 2HG ARG 72 HG1 ARG 72 -10.366 3.993 9.887 548 1HD ARG 72 HD2 ARG 72 -8.723 5.792 9.757 549 2HD ARG 72 HD1 ARG 72 -9.998 6.940 9.350 550 HE ARG 72 HE ARG 72 -10.772 5.838 11.740 551 1HH1 ARG 72 1HH1 ARG 72 -7.972 7.598 10.579 552 2HH1 ARG 72 2HH1 ARG 72 -7.612 8.283 12.131 553 1HH2 ARG 72 1HH2 ARG 72 -10.292 6.755 13.781 554 2HH2 ARG 72 2HH2 ARG 72 -8.914 7.804 13.943 555 H ILE 73 HN ILE 73 -9.027 1.609 6.701 556 HA ILE 73 HA ILE 73 -9.857 2.132 3.999 557 HB ILE 73 HB ILE 73 -7.639 2.720 3.607 558 1HG1 ILE 73 2HG1 ILE 73 -6.572 0.707 2.442 559 2HG1 ILE 73 1HG1 ILE 73 -7.971 -0.218 2.977 560 1HG2 ILE 73 2HG2 ILE 73 -6.852 0.403 5.377 561 2HG2 ILE 73 1HG2 ILE 73 -5.709 1.386 4.462 562 3HG2 ILE 73 3HG2 ILE 73 -6.686 2.124 5.731 563 1HD1 ILE 73 1HD1 ILE 73 -8.089 2.252 1.263 564 2HD1 ILE 73 3HD1 ILE 73 -8.146 0.596 0.660 565 3HD1 ILE 73 2HD1 ILE 73 -9.440 1.201 1.705 566 H TYR 74 HN TYR 74 -10.964 0.404 3.345 567 HA TYR 74 HA TYR 74 -10.803 -1.979 4.978 568 1HB TYR 74 HB2 TYR 74 -12.928 -2.461 4.326 569 2HB TYR 74 HB1 TYR 74 -12.952 -0.724 4.061 570 HD1 TYR 74 HD1 TYR 74 -13.200 0.185 1.915 571 HD2 TYR 74 HD2 TYR 74 -12.665 -4.004 2.388 572 HE1 TYR 74 HE1 TYR 74 -13.764 -0.122 -0.425 573 HE2 TYR 74 HE2 TYR 74 -13.256 -4.334 0.014 574 HH TYR 74 HH TYR 74 -13.521 -1.681 -2.191 575 H HIS 75 HN HIS 75 -10.387 -3.956 4.210 576 HA HIS 75 HA HIS 75 -8.261 -4.473 2.706 577 1HB HIS 75 HB2 HIS 75 -9.000 -6.274 3.911 578 2HB HIS 75 HB1 HIS 75 -10.664 -6.072 3.403 579 HD1 HIS 75 HD1 HIS 75 -7.609 -7.957 2.689 580 HD2 HIS 75 HD2 HIS 75 -11.235 -7.224 0.804 581 HE1 HIS 75 HE1 HIS 75 -7.802 -9.690 0.873 582 HE2 HIS 75 HE2 HIS 75 -9.871 -9.062 -0.396 583 HA PRO 76 HA PRO 76 -9.314 -4.696 -1.578 584 1HB PRO 76 HB2 PRO 76 -7.270 -3.157 -2.465 585 2HB PRO 76 HB1 PRO 76 -8.837 -2.464 -2.037 586 1HG PRO 76 HG2 PRO 76 -6.278 -2.198 -0.680 587 2HG PRO 76 HG1 PRO 76 -7.770 -1.285 -0.432 588 1HD PRO 76 HD2 PRO 76 -6.725 -3.560 1.083 589 2HD PRO 76 HD1 PRO 76 -8.025 -2.429 1.512 590 H ASN 77 HN ASN 77 -7.876 -5.966 0.620 591 HA ASN 77 HA ASN 77 -6.611 -7.934 0.684 592 1HB ASN 77 HB2 ASN 77 -5.180 -6.678 -1.603 593 2HB ASN 77 HB1 ASN 77 -4.322 -7.830 -0.581 594 1HD2 ASN 77 1HD2 ASN 77 -5.574 -7.837 -3.413 595 2HD2 ASN 77 2HD2 ASN 77 -6.408 -9.346 -3.441 596 H ILE 78 HN ILE 78 -6.664 -5.377 2.030 597 HA ILE 78 HA ILE 78 -4.163 -5.404 3.430 598 HB ILE 78 HB ILE 78 -6.385 -3.389 3.169 599 1HG1 ILE 78 2HG1 ILE 78 -4.309 -1.927 3.122 600 2HG1 ILE 78 1HG1 ILE 78 -3.442 -3.433 3.094 601 1HG2 ILE 78 3HG2 ILE 78 -5.984 -3.782 5.635 602 2HG2 ILE 78 2HG2 ILE 78 -4.326 -3.239 5.341 603 3HG2 ILE 78 1HG2 ILE 78 -5.675 -2.141 5.056 604 1HD1 ILE 78 3HD1 ILE 78 -4.628 -4.031 1.001 605 2HD1 ILE 78 2HD1 ILE 78 -5.312 -2.404 1.009 606 3HD1 ILE 78 1HD1 ILE 78 -3.574 -2.621 0.861 607 H ASN 79 HN ASN 79 -4.239 -5.585 5.723 608 HA ASN 79 HA ASN 79 -6.753 -6.591 6.832 609 1HB ASN 79 HB2 ASN 79 -5.549 -8.232 8.163 610 2HB ASN 79 HB1 ASN 79 -5.250 -8.486 6.448 611 1HD2 ASN 79 1HD2 ASN 79 -3.238 -7.507 5.661 612 2HD2 ASN 79 2HD2 ASN 79 -1.859 -7.634 6.669 613 H SER 80 HN SER 80 -6.415 -6.563 9.417 614 HA SER 80 HA SER 80 -6.855 -3.845 9.825 615 1HB SER 80 HB2 SER 80 -6.906 -4.656 12.310 616 2HB SER 80 HB1 SER 80 -8.115 -5.228 11.159 617 HG SER 80 HG SER 80 -6.372 -6.655 12.573 618 H ASN 81 HN ASN 81 -3.798 -4.907 9.450 619 HA ASN 81 HA ASN 81 -2.802 -2.893 11.372 620 1HB ASN 81 HB2 ASN 81 -0.743 -4.124 11.588 621 2HB ASN 81 HB1 ASN 81 -2.079 -5.231 11.883 622 1HD2 ASN 81 1HD2 ASN 81 0.532 -6.014 11.181 623 2HD2 ASN 81 2HD2 ASN 81 0.438 -6.812 9.652 624 H GLY 82 HN GLY 82 -3.609 -3.038 8.330 625 1HA GLY 82 HA1 GLY 82 -1.605 -1.189 7.455 626 2HA GLY 82 HA2 GLY 82 -3.064 -1.653 6.594 627 H SER 83 HN SER 83 -1.722 -4.496 7.402 628 HA SER 83 HA SER 83 0.431 -4.549 5.475 629 1HB SER 83 HB2 SER 83 0.678 -5.862 7.480 630 2HB SER 83 HB1 SER 83 -0.839 -6.703 7.162 631 HG SER 83 HG SER 83 0.446 -7.224 5.051 632 H ILE 84 HN ILE 84 0.378 -5.335 3.472 633 HA ILE 84 HA ILE 84 -2.249 -6.003 2.424 634 HB ILE 84 HB ILE 84 0.182 -4.919 1.030 635 1HG1 ILE 84 2HG1 ILE 84 -2.379 -3.584 1.909 636 2HG1 ILE 84 1HG1 ILE 84 -0.862 -3.504 2.804 637 1HG2 ILE 84 1HG2 ILE 84 -1.298 -6.127 -0.511 638 2HG2 ILE 84 3HG2 ILE 84 -2.673 -5.190 0.072 639 3HG2 ILE 84 2HG2 ILE 84 -1.367 -4.389 -0.798 640 1HD1 ILE 84 2HD1 ILE 84 0.184 -2.455 0.831 641 2HD1 ILE 84 1HD1 ILE 84 -1.408 -2.401 0.077 642 3HD1 ILE 84 3HD1 ILE 84 -1.104 -1.502 1.563 643 H CYS 85 HN CYS 85 -2.685 -7.638 1.073 644 HA CYS 85 HA CYS 85 -0.742 -9.750 0.682 645 1HB CYS 85 HB2 CYS 85 -3.359 -9.996 1.093 646 2HB CYS 85 HB1 CYS 85 -3.442 -9.639 -0.631 647 HG CYS 85 HG CYS 85 -3.198 -12.068 -1.348 648 H LEU 86 HN LEU 86 0.789 -8.973 -0.656 649 HA LEU 86 HA LEU 86 -0.024 -8.062 -3.350 650 1HB LEU 86 HB2 LEU 86 0.732 -6.206 -1.867 651 2HB LEU 86 HB1 LEU 86 2.266 -7.028 -1.686 652 HG LEU 86 HG LEU 86 2.850 -6.624 -4.005 653 1HD1 LEU 86 3HD1 LEU 86 0.605 -6.812 -4.997 654 2HD1 LEU 86 2HD1 LEU 86 0.158 -5.271 -4.258 655 3HD1 LEU 86 1HD1 LEU 86 1.437 -5.328 -5.474 656 1HD2 LEU 86 3HD2 LEU 86 1.753 -4.236 -2.511 657 2HD2 LEU 86 2HD2 LEU 86 3.404 -4.861 -2.485 658 3HD2 LEU 86 1HD2 LEU 86 2.766 -4.110 -3.947 659 H ASP 87 HN ASP 87 0.526 -9.777 -4.590 660 HA ASP 87 HA ASP 87 2.361 -11.743 -3.952 661 1HB ASP 87 HB2 ASP 87 1.026 -10.904 -6.461 662 2HB ASP 87 HB1 ASP 87 2.423 -11.961 -6.621 663 H ILE 88 HN ILE 88 2.972 -8.830 -5.956 664 HA ILE 88 HA ILE 88 5.574 -9.546 -6.610 665 HB ILE 88 HB ILE 88 6.027 -7.088 -6.929 666 1HG1 ILE 88 2HG1 ILE 88 3.597 -5.954 -7.117 667 2HG1 ILE 88 1HG1 ILE 88 3.325 -7.043 -5.761 668 1HG2 ILE 88 3HG2 ILE 88 5.350 -8.615 -8.727 669 2HG2 ILE 88 2HG2 ILE 88 3.664 -8.198 -8.409 670 3HG2 ILE 88 1HG2 ILE 88 4.795 -6.959 -8.963 671 1HD1 ILE 88 3HD1 ILE 88 5.546 -5.051 -5.944 672 2HD1 ILE 88 2HD1 ILE 88 4.018 -4.800 -5.103 673 3HD1 ILE 88 1HD1 ILE 88 5.129 -6.060 -4.562 674 H LEU 89 HN LEU 89 4.392 -8.696 -3.622 675 HA LEU 89 HA LEU 89 7.054 -7.882 -2.688 676 1HB LEU 89 HB2 LEU 89 4.628 -6.708 -2.268 677 2HB LEU 89 HB1 LEU 89 4.773 -7.716 -0.839 678 HG LEU 89 HG LEU 89 6.978 -6.650 -0.382 679 1HD1 LEU 89 3HD1 LEU 89 7.422 -5.963 -2.724 680 2HD1 LEU 89 2HD1 LEU 89 6.153 -4.751 -2.571 681 3HD1 LEU 89 1HD1 LEU 89 7.598 -4.641 -1.569 682 1HD2 LEU 89 3HD2 LEU 89 4.604 -4.801 -0.590 683 2HD2 LEU 89 2HD2 LEU 89 4.958 -5.892 0.748 684 3HD2 LEU 89 1HD2 LEU 89 6.028 -4.532 0.413 685 H ARG 90 HN ARG 90 4.483 -10.233 -2.290 686 HA ARG 90 HA ARG 90 5.994 -11.476 -0.080 687 1HB ARG 90 HB2 ARG 90 3.850 -12.526 0.579 688 2HB ARG 90 HB1 ARG 90 3.799 -10.769 0.619 689 1HG ARG 90 HG2 ARG 90 2.622 -10.752 -1.510 690 2HG ARG 90 HG1 ARG 90 2.698 -12.514 -1.570 691 1HD ARG 90 HD2 ARG 90 1.362 -10.937 0.626 692 2HD ARG 90 HD1 ARG 90 0.513 -11.617 -0.764 693 HE ARG 90 HE ARG 90 1.634 -13.808 0.140 694 1HH1 ARG 90 1HH1 ARG 90 0.115 -11.254 1.988 695 2HH1 ARG 90 2HH1 ARG 90 -0.286 -12.278 3.323 696 1HH2 ARG 90 1HH2 ARG 90 1.116 -15.158 1.880 697 2HH2 ARG 90 2HH2 ARG 90 0.289 -14.517 3.263 698 H SER 91 HN SER 91 5.593 -11.916 -3.298 699 HA SER 91 HA SER 91 6.107 -14.770 -3.047 700 1HB SER 91 HB2 SER 91 3.673 -14.589 -3.342 701 2HB SER 91 HB1 SER 91 3.926 -13.690 -4.837 702 HG SER 91 HG SER 91 3.526 -16.028 -5.019 703 H GLN 92 HN GLN 92 6.018 -11.923 -5.128 704 HA GLN 92 HA GLN 92 7.694 -13.350 -7.079 705 1HB GLN 92 HB2 GLN 92 6.253 -10.780 -7.658 706 2HB GLN 92 HB1 GLN 92 6.801 -12.016 -8.778 707 1HG GLN 92 HG2 GLN 92 5.091 -13.535 -7.812 708 2HG GLN 92 HG1 GLN 92 4.485 -12.176 -6.878 709 1HE2 GLN 92 1HE2 GLN 92 3.415 -10.494 -7.935 710 2HE2 GLN 92 2HE2 GLN 92 2.826 -10.652 -9.551 711 H TRP 93 HN TRP 93 8.314 -11.482 -4.557 712 HA TRP 93 HA TRP 93 9.642 -9.279 -5.693 713 1HB TRP 93 HB2 TRP 93 9.041 -9.184 -3.378 714 2HB TRP 93 HB1 TRP 93 10.090 -10.537 -2.985 715 HD1 TRP 93 HD1 TRP 93 12.762 -10.030 -3.029 716 HE1 TRP 93 HE1 TRP 93 14.081 -7.835 -2.786 717 HE3 TRP 93 HE3 TRP 93 8.977 -6.697 -3.827 718 HZ2 TRP 93 HZ2 TRP 93 13.603 -5.078 -2.908 719 HZ3 TRP 93 HZ3 TRP 93 9.504 -4.292 -3.748 720 HH2 TRP 93 HH2 TRP 93 11.763 -3.495 -3.290 721 H SER 94 HN SER 94 11.638 -8.866 -6.205 722 HA SER 94 HA SER 94 13.838 -10.640 -5.950 723 1HB SER 94 HB2 SER 94 12.539 -10.258 -8.673 724 2HB SER 94 HB1 SER 94 14.131 -10.949 -8.409 725 HG SER 94 HG SER 94 12.230 -12.147 -6.881 726 HA PRO 95 HA PRO 95 15.898 -6.696 -6.874 727 1HB PRO 95 HB2 PRO 95 17.471 -7.867 -9.082 728 2HB PRO 95 HB1 PRO 95 18.028 -7.090 -7.595 729 1HG PRO 95 HG2 PRO 95 18.234 -9.733 -7.939 730 2HG PRO 95 HG1 PRO 95 17.846 -9.036 -6.357 731 1HD PRO 95 HD2 PRO 95 16.031 -10.329 -8.354 732 2HD PRO 95 HD1 PRO 95 16.049 -10.484 -6.586 733 H ALA 96 HN ALA 96 13.666 -6.251 -7.798 734 HA ALA 96 HA ALA 96 13.887 -5.140 -10.442 735 1HB ALA 96 HB1 ALA 96 11.956 -7.419 -10.023 736 2HB ALA 96 HB3 ALA 96 12.124 -6.442 -11.482 737 3HB ALA 96 HB2 ALA 96 13.438 -7.503 -10.973 738 H LEU 97 HN LEU 97 11.842 -6.016 -7.687 739 HA LEU 97 HA LEU 97 9.808 -4.118 -8.434 740 1HB LEU 97 HB2 LEU 97 10.205 -5.722 -5.914 741 2HB LEU 97 HB1 LEU 97 8.826 -4.692 -6.228 742 HG LEU 97 HG LEU 97 8.135 -6.923 -6.594 743 1HD1 LEU 97 1HD1 LEU 97 7.312 -5.300 -8.222 744 2HD1 LEU 97 3HD1 LEU 97 8.665 -5.677 -9.289 745 3HD1 LEU 97 2HD1 LEU 97 7.459 -6.911 -8.923 746 1HD2 LEU 97 3HD2 LEU 97 10.383 -7.909 -6.876 747 2HD2 LEU 97 2HD2 LEU 97 9.227 -8.481 -8.077 748 3HD2 LEU 97 1HD2 LEU 97 10.434 -7.273 -8.516 749 H THR 98 HN THR 98 9.648 -2.083 -7.765 750 HA THR 98 HA THR 98 11.340 -1.185 -5.530 751 HB THR 98 HB THR 98 11.137 1.104 -6.654 752 HG1 THR 98 HG1 THR 98 10.170 1.219 -8.550 753 1HG2 THR 98 3HG2 THR 98 13.210 -0.237 -6.706 754 2HG2 THR 98 2HG2 THR 98 12.641 -1.040 -8.171 755 3HG2 THR 98 1HG2 THR 98 12.989 0.692 -8.190 756 H ILE 99 HN ILE 99 10.296 0.638 -4.289 757 HA ILE 99 HA ILE 99 7.556 -0.008 -3.768 758 HB ILE 99 HB ILE 99 8.357 2.589 -2.678 759 1HG1 ILE 99 2HG1 ILE 99 10.576 1.347 -2.806 760 2HG1 ILE 99 1HG1 ILE 99 10.080 1.758 -1.182 761 1HG2 ILE 99 1HG2 ILE 99 6.420 1.263 -1.954 762 2HG2 ILE 99 3HG2 ILE 99 7.497 -0.007 -1.398 763 3HG2 ILE 99 2HG2 ILE 99 7.530 1.578 -0.630 764 1HD1 ILE 99 2HD1 ILE 99 9.253 -0.538 -0.863 765 2HD1 ILE 99 1HD1 ILE 99 9.800 -0.937 -2.488 766 3HD1 ILE 99 3HD1 ILE 99 10.970 -0.487 -1.250 767 H SER 100 HN SER 100 9.153 1.946 -5.915 768 HA SER 100 HA SER 100 7.140 3.920 -6.275 769 1HB SER 100 HB2 SER 100 8.498 4.559 -8.196 770 2HB SER 100 HB1 SER 100 9.569 4.195 -6.829 771 HG SER 100 HG SER 100 10.167 3.272 -8.912 772 H LYS 101 HN LYS 101 7.906 0.734 -7.389 773 HA LYS 101 HA LYS 101 5.723 0.526 -9.208 774 1HB LYS 101 HB2 LYS 101 7.862 -0.630 -9.506 775 2HB LYS 101 HB1 LYS 101 7.630 -1.467 -7.980 776 1HG LYS 101 HG2 LYS 101 5.696 -1.747 -10.215 777 2HG LYS 101 HG1 LYS 101 7.174 -2.704 -10.142 778 1HD LYS 101 HD2 LYS 101 6.501 -3.455 -7.877 779 2HD LYS 101 HD1 LYS 101 4.981 -2.584 -8.088 780 1HE LYS 101 HE2 LYS 101 5.957 -4.816 -9.867 781 2HE LYS 101 HE1 LYS 101 4.815 -5.022 -8.539 782 1HZ LYS 101 HZ2 LYS 101 4.377 -3.258 -10.896 783 2HZ LYS 101 HZ1 LYS 101 3.709 -4.801 -10.700 784 3HZ LYS 101 HZ3 LYS 101 3.277 -3.554 -9.648 785 H VAL 102 HN VAL 102 6.504 -0.772 -5.936 786 HA VAL 102 HA VAL 102 4.093 -2.271 -5.824 787 HB VAL 102 HB VAL 102 4.782 -3.159 -3.876 788 1HG1 VAL 102 3HG1 VAL 102 7.337 -1.887 -4.793 789 2HG1 VAL 102 2HG1 VAL 102 7.215 -3.232 -3.658 790 3HG1 VAL 102 1HG1 VAL 102 6.666 -3.430 -5.323 791 1HG2 VAL 102 3HG2 VAL 102 5.724 -0.438 -3.059 792 2HG2 VAL 102 2HG2 VAL 102 4.425 -1.413 -2.374 793 3HG2 VAL 102 1HG2 VAL 102 6.106 -1.885 -2.125 794 H LEU 103 HN LEU 103 4.942 0.983 -4.764 795 HA LEU 103 HA LEU 103 2.623 1.358 -3.184 796 1HB LEU 103 HB2 LEU 103 4.306 3.373 -4.673 797 2HB LEU 103 HB1 LEU 103 3.010 3.802 -3.577 798 HG LEU 103 HG LEU 103 5.666 2.531 -2.905 799 1HD1 LEU 103 2HD1 LEU 103 4.341 5.108 -2.105 800 2HD1 LEU 103 1HD1 LEU 103 5.883 4.513 -1.489 801 3HD1 LEU 103 3HD1 LEU 103 5.710 4.908 -3.199 802 1HD2 LEU 103 1HD2 LEU 103 3.854 1.431 -1.603 803 2HD2 LEU 103 3HD2 LEU 103 4.940 2.389 -0.601 804 3HD2 LEU 103 2HD2 LEU 103 3.346 3.018 -1.013 805 H LEU 104 HN LEU 104 3.312 1.653 -6.599 806 HA LEU 104 HA LEU 104 0.737 2.699 -7.278 807 1HB LEU 104 HB2 LEU 104 2.835 1.406 -9.000 808 2HB LEU 104 HB1 LEU 104 1.349 2.113 -9.608 809 HG LEU 104 HG LEU 104 3.596 3.578 -8.226 810 1HD1 LEU 104 3HD1 LEU 104 3.987 2.906 -10.560 811 2HD1 LEU 104 2HD1 LEU 104 2.498 3.735 -11.023 812 3HD1 LEU 104 1HD1 LEU 104 3.855 4.655 -10.371 813 1HD2 LEU 104 3HD2 LEU 104 0.926 4.566 -9.243 814 2HD2 LEU 104 2HD2 LEU 104 1.474 4.549 -7.567 815 3HD2 LEU 104 1HD2 LEU 104 2.264 5.600 -8.741 816 H SER 105 HN SER 105 2.162 -0.491 -6.963 817 HA SER 105 HA SER 105 -0.071 -1.864 -8.075 818 1HB SER 105 HB2 SER 105 1.939 -2.940 -6.106 819 2HB SER 105 HB1 SER 105 0.898 -3.868 -7.185 820 HG SER 105 HG SER 105 2.090 -2.374 -8.833 821 H ILE 106 HN ILE 106 0.863 -0.885 -4.809 822 HA ILE 106 HA ILE 106 -1.401 -2.006 -3.534 823 HB ILE 106 HB ILE 106 0.362 0.308 -2.757 824 1HG1 ILE 106 2HG1 ILE 106 0.114 -2.471 -1.579 825 2HG1 ILE 106 1HG1 ILE 106 1.366 -1.973 -2.711 826 1HG2 ILE 106 2HG2 ILE 106 -1.878 -0.946 -1.173 827 2HG2 ILE 106 1HG2 ILE 106 -0.722 0.230 -0.549 828 3HG2 ILE 106 3HG2 ILE 106 -1.845 0.689 -1.829 829 1HD1 ILE 106 1HD1 ILE 106 0.929 -0.816 0.043 830 2HD1 ILE 106 3HD1 ILE 106 2.176 -1.980 -0.412 831 3HD1 ILE 106 2HD1 ILE 106 2.201 -0.354 -1.092 832 H CYS 107 HN CYS 107 -0.658 1.160 -4.872 833 HA CYS 107 HA CYS 107 -3.141 2.367 -4.623 834 1HB CYS 107 HB2 CYS 107 -1.220 3.567 -5.477 835 2HB CYS 107 HB1 CYS 107 -1.150 2.514 -6.882 836 HG CYS 107 HG CYS 107 -3.801 4.587 -6.237 837 H SER 108 HN SER 108 -2.008 -0.110 -6.906 838 HA SER 108 HA SER 108 -4.320 0.190 -8.578 839 1HB SER 108 HB2 SER 108 -3.481 -1.605 -9.902 840 2HB SER 108 HB1 SER 108 -2.120 -0.578 -9.468 841 HG SER 108 HG SER 108 -2.214 -2.346 -7.579 842 H LEU 109 HN LEU 109 -3.624 -1.436 -5.701 843 HA LEU 109 HA LEU 109 -5.768 -3.356 -6.038 844 1HB LEU 109 HB2 LEU 109 -4.101 -2.641 -3.606 845 2HB LEU 109 HB1 LEU 109 -5.239 -3.973 -3.682 846 HG LEU 109 HG LEU 109 -2.850 -3.787 -5.511 847 1HD1 LEU 109 1HD1 LEU 109 -3.061 -5.091 -2.807 848 2HD1 LEU 109 3HD1 LEU 109 -1.802 -5.454 -3.986 849 3HD1 LEU 109 2HD1 LEU 109 -1.930 -3.833 -3.311 850 1HD2 LEU 109 1HD2 LEU 109 -4.673 -6.047 -4.706 851 2HD2 LEU 109 3HD2 LEU 109 -4.598 -5.260 -6.282 852 3HD2 LEU 109 2HD2 LEU 109 -3.230 -6.213 -5.706 853 H LEU 110 HN LEU 110 -5.099 -0.294 -4.582 854 HA LEU 110 HA LEU 110 -7.699 0.102 -3.453 855 1HB LEU 110 HB2 LEU 110 -5.273 1.741 -3.962 856 2HB LEU 110 HB1 LEU 110 -6.768 2.621 -3.712 857 HG LEU 110 HG LEU 110 -6.982 1.525 -1.507 858 1HD1 LEU 110 1HD1 LEU 110 -5.814 -0.567 -2.065 859 2HD1 LEU 110 3HD1 LEU 110 -4.286 0.317 -2.078 860 3HD1 LEU 110 2HD1 LEU 110 -5.211 0.173 -0.583 861 1HD2 LEU 110 1HD2 LEU 110 -5.764 3.671 -1.776 862 2HD2 LEU 110 3HD2 LEU 110 -5.237 2.725 -0.385 863 3HD2 LEU 110 2HD2 LEU 110 -4.261 2.751 -1.852 864 H CYS 111 HN CYS 111 -6.197 0.521 -6.530 865 HA CYS 111 HA CYS 111 -8.240 2.295 -7.528 866 1HB CYS 111 HB2 CYS 111 -5.910 2.830 -7.981 867 2HB CYS 111 HB1 CYS 111 -5.705 1.277 -8.792 868 HG CYS 111 HG CYS 111 -8.191 2.833 -10.246 869 H ASP 112 HN ASP 112 -6.851 -0.870 -8.381 870 HA ASP 112 HA ASP 112 -8.867 -1.219 -10.462 871 1HB ASP 112 HB2 ASP 112 -6.449 -1.562 -10.956 872 2HB ASP 112 HB1 ASP 112 -6.462 -2.948 -9.874 873 HA PRO 113 HA PRO 113 -8.744 -4.062 -6.083 874 1HB PRO 113 HB2 PRO 113 -11.619 -3.841 -6.931 875 2HB PRO 113 HB1 PRO 113 -10.957 -4.139 -5.318 876 1HG PRO 113 HG2 PRO 113 -11.599 -1.628 -6.339 877 2HG PRO 113 HG1 PRO 113 -10.516 -1.929 -4.969 878 1HD PRO 113 HD2 PRO 113 -9.775 -0.785 -7.439 879 2HD PRO 113 HD1 PRO 113 -8.661 -1.427 -6.210 880 H ASN 114 HN ASN 114 -7.765 -5.831 -6.855 881 HA ASN 114 HA ASN 114 -8.571 -7.132 -9.243 882 1HB ASN 114 HB2 ASN 114 -6.828 -8.673 -8.911 883 2HB ASN 114 HB1 ASN 114 -6.232 -7.164 -8.244 884 1HD2 ASN 114 1HD2 ASN 114 -7.534 -7.292 -5.719 885 2HD2 ASN 114 2HD2 ASN 114 -6.814 -8.579 -4.839 886 HA PRO 115 HA PRO 115 -12.018 -9.106 -7.513 887 1HB PRO 115 HB2 PRO 115 -12.933 -10.328 -9.687 888 2HB PRO 115 HB1 PRO 115 -12.790 -8.565 -9.641 889 1HG PRO 115 HG2 PRO 115 -10.924 -10.577 -10.857 890 2HG PRO 115 HG1 PRO 115 -11.549 -9.072 -11.561 891 1HD PRO 115 HD2 PRO 115 -9.092 -9.286 -10.365 892 2HD PRO 115 HD1 PRO 115 -10.022 -7.778 -10.443 893 H ASP 116 HN ASP 116 -9.760 -10.596 -6.623 894 HA ASP 116 HA ASP 116 -11.053 -13.171 -6.520 895 1HB ASP 116 HB2 ASP 116 -9.619 -13.360 -8.555 896 2HB ASP 116 HB1 ASP 116 -8.214 -13.093 -7.526 897 H ASP 117 HN ASP 117 -7.938 -11.707 -5.808 898 HA ASP 117 HA ASP 117 -7.261 -13.501 -3.792 899 1HB ASP 117 HB2 ASP 117 -6.121 -11.306 -5.082 900 2HB ASP 117 HB1 ASP 117 -6.069 -10.918 -3.363 901 HA PRO 118 HA PRO 118 -9.506 -11.637 -0.389 902 1HB PRO 118 HB2 PRO 118 -9.950 -13.878 0.964 903 2HB PRO 118 HB1 PRO 118 -10.818 -13.551 -0.540 904 1HG PRO 118 HG2 PRO 118 -8.572 -15.423 -0.025 905 2HG PRO 118 HG1 PRO 118 -9.909 -15.564 -1.176 906 1HD PRO 118 HD2 PRO 118 -7.263 -14.655 -1.705 907 2HD PRO 118 HD1 PRO 118 -8.643 -14.654 -2.818 908 H LEU 119 HN LEU 119 -9.021 -11.382 1.857 909 HA LEU 119 HA LEU 119 -6.550 -12.589 2.840 910 1HB LEU 119 HB2 LEU 119 -6.056 -10.257 1.977 911 2HB LEU 119 HB1 LEU 119 -7.161 -9.640 3.197 912 HG LEU 119 HG LEU 119 -5.730 -10.448 4.973 913 1HD1 LEU 119 3HD1 LEU 119 -4.002 -11.566 2.767 914 2HD1 LEU 119 2HD1 LEU 119 -3.555 -11.492 4.471 915 3HD1 LEU 119 1HD1 LEU 119 -4.912 -12.495 3.958 916 1HD2 LEU 119 1HD2 LEU 119 -4.185 -8.989 2.837 917 2HD2 LEU 119 3HD2 LEU 119 -5.216 -8.264 4.072 918 3HD2 LEU 119 2HD2 LEU 119 -3.730 -9.093 4.537 919 H VAL 120 HN VAL 120 -9.030 -10.225 3.863 920 HA VAL 120 HA VAL 120 -9.317 -11.719 6.382 921 HB VAL 120 HB VAL 120 -10.649 -9.118 5.657 922 1HG1 VAL 120 1HG1 VAL 120 -10.000 -10.465 8.284 923 2HG1 VAL 120 3HG1 VAL 120 -10.663 -8.839 8.134 924 3HG1 VAL 120 2HG1 VAL 120 -11.596 -10.226 7.572 925 1HG2 VAL 120 2HG2 VAL 120 -7.917 -9.547 6.881 926 2HG2 VAL 120 1HG2 VAL 120 -8.293 -8.723 5.367 927 3HG2 VAL 120 3HG2 VAL 120 -8.779 -8.009 6.906 928 HA PRO 121 HA PRO 121 -12.681 -14.129 4.814 929 1HB PRO 121 HB2 PRO 121 -13.779 -13.531 7.536 930 2HB PRO 121 HB1 PRO 121 -13.722 -15.069 6.665 931 1HG PRO 121 HG2 PRO 121 -11.949 -14.521 8.572 932 2HG PRO 121 HG1 PRO 121 -11.463 -15.377 7.099 933 1HD PRO 121 HD2 PRO 121 -10.898 -12.597 7.943 934 2HD PRO 121 HD1 PRO 121 -9.970 -13.663 6.872 935 H GLU 122 HN GLU 122 -13.814 -11.351 6.817 936 HA GLU 122 HA GLU 122 -16.217 -11.226 5.212 937 1HB GLU 122 HB2 GLU 122 -16.738 -9.194 6.585 938 2HB GLU 122 HB1 GLU 122 -16.630 -10.730 7.464 939 1HG GLU 122 HG2 GLU 122 -14.163 -9.084 7.253 940 2HG GLU 122 HG1 GLU 122 -15.448 -8.529 8.345 941 H ILE 123 HN ILE 123 -13.317 -9.292 5.597 942 HA ILE 123 HA ILE 123 -14.493 -7.117 4.155 943 HB ILE 123 HB ILE 123 -11.537 -7.338 4.563 944 1HG1 ILE 123 2HG1 ILE 123 -13.384 -6.384 6.747 945 2HG1 ILE 123 1HG1 ILE 123 -12.740 -8.022 6.712 946 1HG2 ILE 123 1HG2 ILE 123 -13.561 -5.108 4.675 947 2HG2 ILE 123 3HG2 ILE 123 -11.844 -4.912 5.009 948 3HG2 ILE 123 2HG2 ILE 123 -12.377 -5.416 3.405 949 1HD1 ILE 123 1HD1 ILE 123 -10.486 -7.109 6.669 950 2HD1 ILE 123 3HD1 ILE 123 -11.158 -5.489 6.844 951 3HD1 ILE 123 2HD1 ILE 123 -11.382 -6.683 8.128 952 H ALA 124 HN ALA 124 -12.690 -9.949 3.523 953 HA ALA 124 HA ALA 124 -12.127 -9.485 0.802 954 1HB ALA 124 HB3 ALA 124 -12.934 -12.089 2.092 955 2HB ALA 124 HB2 ALA 124 -12.136 -11.897 0.529 956 3HB ALA 124 HB1 ALA 124 -11.291 -11.451 2.014 957 H ARG 125 HN ARG 125 -15.107 -10.709 2.400 958 HA ARG 125 HA ARG 125 -16.411 -11.254 -0.077 959 1HB ARG 125 HB2 ARG 125 -18.378 -11.711 1.164 960 2HB ARG 125 HB1 ARG 125 -17.042 -12.283 2.144 961 1HG ARG 125 HG2 ARG 125 -17.622 -10.965 3.822 962 2HG ARG 125 HG1 ARG 125 -17.687 -9.562 2.787 963 1HD ARG 125 HD2 ARG 125 -19.831 -9.956 3.852 964 2HD ARG 125 HD1 ARG 125 -19.924 -10.092 2.100 965 HE ARG 125 HE ARG 125 -19.626 -12.545 3.668 966 1HH1 ARG 125 1HH1 ARG 125 -21.575 -10.438 1.673 967 2HH1 ARG 125 2HH1 ARG 125 -22.832 -11.616 1.437 968 1HH2 ARG 125 1HH2 ARG 125 -21.258 -14.104 3.358 969 2HH2 ARG 125 2HH2 ARG 125 -22.652 -13.713 2.404 970 H ILE 126 HN ILE 126 -16.649 -8.604 2.246 971 HA ILE 126 HA ILE 126 -18.621 -7.186 0.791 972 HB ILE 126 HB ILE 126 -17.863 -5.239 2.191 973 1HG1 ILE 126 2HG1 ILE 126 -16.335 -6.130 4.157 974 2HG1 ILE 126 1HG1 ILE 126 -15.765 -7.243 2.905 975 1HG2 ILE 126 1HG2 ILE 126 -19.642 -6.750 2.925 976 2HG2 ILE 126 3HG2 ILE 126 -18.438 -7.790 3.689 977 3HG2 ILE 126 2HG2 ILE 126 -18.698 -6.151 4.289 978 1HD1 ILE 126 2HD1 ILE 126 -15.403 -5.163 1.488 979 2HD1 ILE 126 1HD1 ILE 126 -15.580 -4.260 2.989 980 3HD1 ILE 126 3HD1 ILE 126 -14.293 -5.452 2.826 981 H TYR 127 HN TYR 127 -15.402 -7.754 0.340 982 HA TYR 127 HA TYR 127 -14.942 -5.459 -1.356 983 1HB TYR 127 HB2 TYR 127 -13.068 -6.147 -0.070 984 2HB TYR 127 HB1 TYR 127 -13.308 -7.826 -0.483 985 HD1 TYR 127 HD1 TYR 127 -12.153 -8.792 -2.302 986 HD2 TYR 127 HD2 TYR 127 -12.217 -4.571 -1.818 987 HE1 TYR 127 HE1 TYR 127 -10.513 -8.559 -4.121 988 HE2 TYR 127 HE2 TYR 127 -10.570 -4.325 -3.617 989 HH TYR 127 HH TYR 127 -8.888 -5.595 -4.740 990 H LYS 128 HN LYS 128 -14.852 -8.980 -1.781 991 HA LYS 128 HA LYS 128 -14.886 -8.676 -4.688 992 1HB LYS 128 HB2 LYS 128 -14.223 -11.027 -4.706 993 2HB LYS 128 HB1 LYS 128 -13.191 -10.108 -3.614 994 1HG LYS 128 HG2 LYS 128 -14.705 -10.882 -1.742 995 2HG LYS 128 HG1 LYS 128 -15.428 -11.989 -2.899 996 1HD LYS 128 HD2 LYS 128 -12.472 -11.934 -2.324 997 2HD LYS 128 HD1 LYS 128 -13.606 -12.919 -1.397 998 1HE LYS 128 HE2 LYS 128 -14.311 -14.043 -3.463 999 2HE LYS 128 HE1 LYS 128 -13.177 -13.067 -4.388 1000 1HZ LYS 128 HZ2 LYS 128 -12.387 -14.942 -2.222 1001 2HZ LYS 128 HZ1 LYS 128 -12.358 -15.317 -3.869 1002 3HZ LYS 128 HZ3 LYS 128 -11.351 -14.099 -3.270 1003 H THR 129 HN THR 129 -17.249 -8.556 -2.649 1004 HA THR 129 HA THR 129 -19.058 -10.287 -4.137 1005 HB THR 129 HB THR 129 -18.777 -10.326 -1.132 1006 HG1 THR 129 HG1 THR 129 -17.607 -11.762 -3.080 1007 1HG2 THR 129 1HG2 THR 129 -21.127 -10.542 -1.819 1008 2HG2 THR 129 3HG2 THR 129 -20.701 -11.845 -2.927 1009 3HG2 THR 129 2HG2 THR 129 -20.522 -12.072 -1.187 1010 H ASP 130 HN ASP 130 -19.301 -8.380 -1.114 1011 HA ASP 130 HA ASP 130 -21.803 -7.346 -2.049 1012 1HB ASP 130 HB2 ASP 130 -20.140 -6.602 0.387 1013 2HB ASP 130 HB1 ASP 130 -21.721 -5.922 -0.004 1014 H ARG 131 HN ARG 131 -18.669 -5.839 -1.392 1015 HA ARG 131 HA ARG 131 -17.340 -4.637 -2.782 1016 1HB ARG 131 HB2 ARG 131 -18.403 -5.680 -4.722 1017 2HB ARG 131 HB1 ARG 131 -19.740 -4.548 -4.626 1018 1HG ARG 131 HG2 ARG 131 -18.352 -3.786 -6.367 1019 2HG ARG 131 HG1 ARG 131 -18.036 -2.717 -5.003 1020 1HD ARG 131 HD2 ARG 131 -15.989 -3.815 -4.503 1021 2HD ARG 131 HD1 ARG 131 -16.352 -5.129 -5.618 1022 HE ARG 131 HE ARG 131 -15.748 -2.362 -6.461 1023 1HH1 ARG 131 1HH1 ARG 131 -15.646 -5.824 -6.980 1024 2HH1 ARG 131 2HH1 ARG 131 -14.791 -5.710 -8.482 1025 1HH2 ARG 131 1HH2 ARG 131 -14.587 -2.205 -8.443 1026 2HH2 ARG 131 2HH2 ARG 131 -14.177 -3.652 -9.307 1027 H GLU 132 HN GLU 132 -20.517 -3.329 -3.368 1028 HA GLU 132 HA GLU 132 -19.928 -0.633 -2.967 1029 1HB GLU 132 HB2 GLU 132 -22.480 -0.655 -2.222 1030 2HB GLU 132 HB1 GLU 132 -21.980 -0.798 -3.901 1031 1HG GLU 132 HG2 GLU 132 -22.210 -3.335 -2.395 1032 2HG GLU 132 HG1 GLU 132 -23.718 -2.451 -2.717 1033 H LYS 133 HN LYS 133 -20.681 -3.159 -0.800 1034 HA LYS 133 HA LYS 133 -21.537 -1.942 1.480 1035 1HB LYS 133 HB2 LYS 133 -21.011 -4.436 0.941 1036 2HB LYS 133 HB1 LYS 133 -19.427 -4.069 1.595 1037 1HG LYS 133 HG2 LYS 133 -20.807 -5.061 3.303 1038 2HG LYS 133 HG1 LYS 133 -20.483 -3.378 3.714 1039 1HD LYS 133 HD2 LYS 133 -22.805 -3.901 4.158 1040 2HD LYS 133 HD1 LYS 133 -22.700 -2.768 2.812 1041 1HE LYS 133 HE2 LYS 133 -24.329 -4.425 2.257 1042 2HE LYS 133 HE1 LYS 133 -22.909 -4.708 1.258 1043 1HZ LYS 133 HZ1 LYS 133 -22.245 -6.389 3.002 1044 2HZ LYS 133 HZ3 LYS 133 -23.815 -6.247 3.615 1045 3HZ LYS 133 HZ2 LYS 133 -23.569 -6.803 2.038 1046 H TYR 134 HN TYR 134 -18.055 -2.639 0.855 1047 HA TYR 134 HA TYR 134 -17.552 -0.446 2.653 1048 1HB TYR 134 HB2 TYR 134 -16.139 -2.852 1.814 1049 2HB TYR 134 HB1 TYR 134 -15.158 -1.454 2.181 1050 HD1 TYR 134 HD1 TYR 134 -14.839 -0.720 4.442 1051 HD2 TYR 134 HD2 TYR 134 -17.748 -3.696 3.572 1052 HE1 TYR 134 HE1 TYR 134 -15.094 -1.165 6.843 1053 HE2 TYR 134 HE2 TYR 134 -18.016 -4.141 5.976 1054 HH TYR 134 HH TYR 134 -16.813 -3.878 8.047 1055 H ASN 135 HN ASN 135 -17.550 -0.996 -0.739 1056 HA ASN 135 HA ASN 135 -15.560 0.616 -1.754 1057 1HB ASN 135 HB2 ASN 135 -18.271 -0.086 -2.666 1058 2HB ASN 135 HB1 ASN 135 -17.601 1.367 -3.383 1059 1HD2 ASN 135 1HD2 ASN 135 -15.946 -1.599 -2.390 1060 2HD2 ASN 135 2HD2 ASN 135 -15.353 -1.991 -3.964 1061 H ARG 136 HN ARG 136 -18.793 1.801 -0.906 1062 HA ARG 136 HA ARG 136 -18.198 4.533 -1.357 1063 1HB ARG 136 HB2 ARG 136 -20.513 3.900 -1.141 1064 2HB ARG 136 HB1 ARG 136 -20.244 3.277 0.486 1065 1HG ARG 136 HG2 ARG 136 -19.548 5.618 1.132 1066 2HG ARG 136 HG1 ARG 136 -20.174 6.130 -0.430 1067 1HD ARG 136 HD2 ARG 136 -22.381 5.596 0.150 1068 2HD ARG 136 HD1 ARG 136 -21.868 4.577 1.496 1069 HE ARG 136 HE ARG 136 -20.975 6.813 2.436 1070 1HH1 ARG 136 1HH1 ARG 136 -23.932 6.429 0.577 1071 2HH1 ARG 136 2HH1 ARG 136 -24.705 7.809 1.291 1072 1HH2 ARG 136 1HH2 ARG 136 -22.000 8.615 3.380 1073 2HH2 ARG 136 2HH2 ARG 136 -23.605 9.058 2.884 1074 H ILE 137 HN ILE 137 -17.137 2.444 1.042 1075 HA ILE 137 HA ILE 137 -17.417 4.277 3.253 1076 HB ILE 137 HB ILE 137 -16.402 1.425 3.274 1077 1HG1 ILE 137 2HG1 ILE 137 -18.592 1.579 2.172 1078 2HG1 ILE 137 1HG1 ILE 137 -18.756 0.762 3.719 1079 1HG2 ILE 137 1HG2 ILE 137 -17.631 3.156 5.428 1080 2HG2 ILE 137 3HG2 ILE 137 -17.173 1.464 5.608 1081 3HG2 ILE 137 2HG2 ILE 137 -15.934 2.685 5.312 1082 1HD1 ILE 137 2HD1 ILE 137 -19.580 2.893 4.682 1083 2HD1 ILE 137 1HD1 ILE 137 -19.484 3.614 3.075 1084 3HD1 ILE 137 3HD1 ILE 137 -20.590 2.273 3.371 1085 H ALA 138 HN ALA 138 -14.728 2.237 1.921 1086 HA ALA 138 HA ALA 138 -12.685 3.841 2.992 1087 1HB ALA 138 HB2 ALA 138 -12.744 2.002 0.620 1088 2HB ALA 138 HB3 ALA 138 -12.066 1.707 2.222 1089 3HB ALA 138 HB1 ALA 138 -11.287 2.855 1.138 1090 H ARG 139 HN ARG 139 -14.876 4.324 0.431 1091 HA ARG 139 HA ARG 139 -13.356 6.188 -1.091 1092 1HB ARG 139 HB2 ARG 139 -15.343 4.867 -1.968 1093 2HB ARG 139 HB1 ARG 139 -16.368 5.945 -1.018 1094 1HG ARG 139 HG2 ARG 139 -15.494 7.873 -2.264 1095 2HG ARG 139 HG1 ARG 139 -14.507 6.781 -3.234 1096 1HD ARG 139 HD2 ARG 139 -16.394 7.188 -4.552 1097 2HD ARG 139 HD1 ARG 139 -16.697 5.613 -3.821 1098 HE ARG 139 HE ARG 139 -17.804 7.979 -2.508 1099 1HH1 ARG 139 1HH1 ARG 139 -18.320 5.114 -4.453 1100 2HH1 ARG 139 2HH1 ARG 139 -20.039 5.119 -4.240 1101 1HH2 ARG 139 1HH2 ARG 139 -20.077 7.991 -2.229 1102 2HH2 ARG 139 2HH2 ARG 139 -21.038 6.737 -2.945 1103 H GLU 140 HN GLU 140 -15.846 6.429 1.450 1104 HA GLU 140 HA GLU 140 -15.538 9.275 1.532 1105 1HB GLU 140 HB2 GLU 140 -16.680 8.957 3.814 1106 2HB GLU 140 HB1 GLU 140 -17.619 8.745 2.359 1107 1HG GLU 140 HG2 GLU 140 -17.271 6.288 2.627 1108 2HG GLU 140 HG1 GLU 140 -16.476 6.644 4.166 1109 H TRP 141 HN TRP 141 -14.151 6.530 3.186 1110 HA TRP 141 HA TRP 141 -12.733 7.918 5.109 1111 1HB TRP 141 HB2 TRP 141 -11.971 5.477 3.522 1112 2HB TRP 141 HB1 TRP 141 -10.972 6.122 4.826 1113 HD1 TRP 141 HD1 TRP 141 -13.884 6.944 6.403 1114 HE1 TRP 141 HE1 TRP 141 -14.927 5.065 7.810 1115 HE3 TRP 141 HE3 TRP 141 -11.484 2.955 4.312 1116 HZ2 TRP 141 HZ2 TRP 141 -14.753 2.275 8.004 1117 HZ3 TRP 141 HZ3 TRP 141 -11.990 0.712 5.178 1118 HH2 TRP 141 HH2 TRP 141 -13.590 0.372 6.989 1119 H THR 142 HN THR 142 -12.269 7.756 1.628 1120 HA THR 142 HA THR 142 -9.893 9.307 1.710 1121 HB THR 142 HB THR 142 -10.044 9.674 -0.581 1122 HG1 THR 142 HG1 THR 142 -12.767 9.123 -0.869 1123 1HG2 THR 142 3HG2 THR 142 -10.055 7.254 -0.060 1124 2HG2 THR 142 2HG2 THR 142 -11.803 7.264 -0.279 1125 3HG2 THR 142 1HG2 THR 142 -10.746 7.653 -1.631 1126 H GLN 143 HN GLN 143 -13.239 10.122 1.196 1127 HA GLN 143 HA GLN 143 -13.182 12.837 0.870 1128 1HB GLN 143 HB2 GLN 143 -15.151 11.017 2.179 1129 2HB GLN 143 HB1 GLN 143 -15.531 12.685 1.759 1130 1HG GLN 143 HG2 GLN 143 -15.000 12.171 -0.582 1131 2HG GLN 143 HG1 GLN 143 -14.681 10.503 -0.139 1132 1HE2 GLN 143 1HE2 GLN 143 -17.289 12.332 1.284 1133 2HE2 GLN 143 2HE2 GLN 143 -18.572 11.480 0.504 1134 H LYS 144 HN LYS 144 -12.742 11.079 3.765 1135 HA LYS 144 HA LYS 144 -13.330 13.413 5.454 1136 1HB LYS 144 HB2 LYS 144 -13.420 10.442 5.882 1137 2HB LYS 144 HB1 LYS 144 -13.611 11.599 7.201 1138 1HG LYS 144 HG2 LYS 144 -15.669 12.287 6.406 1139 2HG LYS 144 HG1 LYS 144 -15.337 11.688 4.771 1140 1HD LYS 144 HD2 LYS 144 -15.433 9.424 5.515 1141 2HD LYS 144 HD1 LYS 144 -15.652 9.938 7.202 1142 1HE LYS 144 HE2 LYS 144 -17.667 11.225 6.220 1143 2HE LYS 144 HE1 LYS 144 -17.500 10.089 4.890 1144 1HZ LYS 144 HZ3 LYS 144 -17.810 9.272 7.722 1145 2HZ LYS 144 HZ2 LYS 144 -19.093 9.381 6.633 1146 3HZ LYS 144 HZ1 LYS 144 -17.853 8.266 6.356 1147 H TYR 145 HN TYR 145 -10.951 10.992 4.626 1148 HA TYR 145 HA TYR 145 -9.206 11.958 6.785 1149 1HB TYR 145 HB2 TYR 145 -9.502 9.089 5.880 1150 2HB TYR 145 HB1 TYR 145 -8.392 9.658 7.122 1151 HD1 TYR 145 HD1 TYR 145 -9.194 10.176 9.347 1152 HD2 TYR 145 HD2 TYR 145 -11.905 8.961 6.313 1153 HE1 TYR 145 HE1 TYR 145 -10.934 9.813 11.049 1154 HE2 TYR 145 HE2 TYR 145 -13.666 8.611 7.988 1155 HH TYR 145 HH TYR 145 -13.363 9.698 11.219 1156 H ALA 146 HN ALA 146 -9.471 10.606 3.550 1157 HA ALA 146 HA ALA 146 -6.554 10.758 3.465 1158 1HB ALA 146 HB2 ALA 146 -7.843 8.573 3.071 1159 2HB ALA 146 HB1 ALA 146 -8.168 9.231 1.471 1160 3HB ALA 146 HB3 ALA 146 -6.503 8.974 1.993 1161 H MET 147 HN MET 147 -9.005 12.649 2.388 1162 HA MET 147 HA MET 147 -7.671 13.056 -0.198 1163 1HB MET 147 HB2 MET 147 -9.630 13.382 -1.375 1164 2HB MET 147 HB1 MET 147 -9.975 12.012 -0.334 1165 1HG MET 147 HG2 MET 147 -11.886 13.272 -0.337 1166 2HG MET 147 HG1 MET 147 -11.121 13.629 1.207 1167 1HE MET 147 HE2 MET 147 -11.842 14.885 -2.429 1168 2HE MET 147 HE1 MET 147 -11.157 16.510 -2.412 1169 3HE MET 147 HE3 MET 147 -10.096 15.106 -2.336 No H/Q in entry = 1169 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 21.808 -5.145 4.626 2 H2 MET 1 HT3 MET 1 22.862 -4.270 5.616 3 H3 MET 1 HT2 MET 1 21.215 -3.923 5.631 4 HA MET 1 HA MET 1 22.335 -2.244 4.382 5 1HB MET 1 HB2 MET 1 24.154 -4.103 3.810 6 2HB MET 1 HB1 MET 1 23.203 -4.231 2.336 7 1HG MET 1 HG2 MET 1 23.456 -1.710 2.154 8 2HG MET 1 HG1 MET 1 24.694 -1.862 3.394 9 1HE MET 1 HE2 MET 1 25.448 -0.483 0.791 10 2HE MET 1 HE1 MET 1 26.656 -0.897 2.007 11 3HE MET 1 HE3 MET 1 26.937 -1.296 0.313 12 H ALA 2 HN ALA 2 19.812 -4.023 4.358 13 HA ALA 2 HA ALA 2 18.854 -4.056 1.717 14 1HB ALA 2 HB3 ALA 2 16.723 -4.523 2.630 15 2HB ALA 2 HB1 ALA 2 17.140 -3.765 4.165 16 3HB ALA 2 HB2 ALA 2 17.900 -5.283 3.705 17 H LEU 3 HN LEU 3 19.353 -1.463 3.846 18 HA LEU 3 HA LEU 3 17.138 0.149 3.019 19 1HB LEU 3 HB2 LEU 3 18.517 1.930 4.246 20 2HB LEU 3 HB1 LEU 3 17.825 0.612 5.160 21 HG LEU 3 HG LEU 3 20.121 -0.504 4.903 22 1HD1 LEU 3 1HD1 LEU 3 20.859 2.367 4.352 23 2HD1 LEU 3 3HD1 LEU 3 21.999 1.092 4.785 24 3HD1 LEU 3 2HD1 LEU 3 21.095 0.992 3.274 25 1HD2 LEU 3 1HD2 LEU 3 19.721 1.916 6.649 26 2HD2 LEU 3 3HD2 LEU 3 19.193 0.271 7.001 27 3HD2 LEU 3 2HD2 LEU 3 20.913 0.645 6.921 28 H LYS 4 HN LYS 4 20.306 -0.516 1.907 29 HA LYS 4 HA LYS 4 20.535 1.953 0.477 30 1HB LYS 4 HB2 LYS 4 22.669 1.303 -0.129 31 2HB LYS 4 HB1 LYS 4 22.437 0.631 1.467 32 1HG LYS 4 HG2 LYS 4 23.483 -1.096 0.367 33 2HG LYS 4 HG1 LYS 4 21.782 -1.530 0.207 34 1HD LYS 4 HD2 LYS 4 21.756 -0.584 -2.047 35 2HD LYS 4 HD1 LYS 4 23.454 -0.133 -1.884 36 1HE LYS 4 HE2 LYS 4 22.472 -2.962 -1.616 37 2HE LYS 4 HE1 LYS 4 22.974 -2.264 -3.156 38 1HZ LYS 4 HZ1 LYS 4 25.154 -1.815 -2.162 39 2HZ LYS 4 HZ3 LYS 4 24.664 -2.573 -0.726 40 3HZ LYS 4 HZ2 LYS 4 24.787 -3.462 -2.159 41 H ARG 5 HN ARG 5 19.213 -1.055 0.038 42 HA ARG 5 HA ARG 5 19.034 -0.855 -2.852 43 1HB ARG 5 HB2 ARG 5 19.144 -3.104 -1.884 44 2HB ARG 5 HB1 ARG 5 17.721 -2.769 -0.891 45 1HG ARG 5 HG2 ARG 5 16.934 -3.998 -2.747 46 2HG ARG 5 HG1 ARG 5 16.479 -2.311 -3.017 47 1HD ARG 5 HD2 ARG 5 17.288 -3.208 -5.084 48 2HD ARG 5 HD1 ARG 5 18.466 -2.051 -4.474 49 HE ARG 5 HE ARG 5 19.508 -4.307 -3.563 50 1HH1 ARG 5 1HH1 ARG 5 18.110 -3.599 -6.682 51 2HH1 ARG 5 2HH1 ARG 5 19.099 -4.733 -7.542 52 1HH2 ARG 5 1HH2 ARG 5 20.857 -5.817 -4.699 53 2HH2 ARG 5 2HH2 ARG 5 20.656 -5.992 -6.414 54 H ILE 6 HN ILE 6 17.006 -0.783 0.003 55 HA ILE 6 HA ILE 6 14.678 0.145 -1.125 56 HB ILE 6 HB ILE 6 15.727 0.980 1.585 57 1HG1 ILE 6 2HG1 ILE 6 14.453 -1.530 0.568 58 2HG1 ILE 6 1HG1 ILE 6 15.759 -1.329 1.734 59 1HG2 ILE 6 2HG2 ILE 6 12.991 0.982 0.325 60 2HG2 ILE 6 1HG2 ILE 6 13.242 1.085 2.071 61 3HG2 ILE 6 3HG2 ILE 6 13.883 2.339 1.011 62 1HD1 ILE 6 2HD1 ILE 6 14.140 -0.539 3.389 63 2HD1 ILE 6 1HD1 ILE 6 12.841 -0.790 2.226 64 3HD1 ILE 6 3HD1 ILE 6 13.770 -2.167 2.818 65 H HIS 7 HN HIS 7 17.669 1.655 -0.764 66 HA HIS 7 HA HIS 7 17.406 4.288 -0.350 67 1HB HIS 7 HB2 HIS 7 19.217 2.564 -1.575 68 2HB HIS 7 HB1 HIS 7 18.971 3.869 -2.724 69 HD1 HIS 7 HD1 HIS 7 20.423 5.840 -2.420 70 HD2 HIS 7 HD2 HIS 7 19.949 3.712 1.125 71 HE1 HIS 7 HE1 HIS 7 21.917 6.972 -0.740 72 HE2 HIS 7 HE2 HIS 7 21.554 5.719 1.414 73 H LYS 8 HN LYS 8 17.169 2.901 -3.629 74 HA LYS 8 HA LYS 8 16.039 5.434 -4.545 75 1HB LYS 8 HB2 LYS 8 16.404 3.230 -6.483 76 2HB LYS 8 HB1 LYS 8 16.617 4.959 -6.693 77 1HG LYS 8 HG2 LYS 8 18.787 4.282 -6.859 78 2HG LYS 8 HG1 LYS 8 18.701 4.531 -5.112 79 1HD LYS 8 HD2 LYS 8 19.755 2.425 -5.482 80 2HD LYS 8 HD1 LYS 8 18.125 2.105 -4.896 81 1HE LYS 8 HE2 LYS 8 17.430 1.864 -7.307 82 2HE LYS 8 HE1 LYS 8 19.144 1.897 -7.712 83 1HZ LYS 8 HZ2 LYS 8 19.393 -0.009 -6.131 84 2HZ LYS 8 HZ1 LYS 8 17.699 -0.105 -6.070 85 3HZ LYS 8 HZ3 LYS 8 18.520 -0.355 -7.535 86 H GLU 9 HN GLU 9 15.283 2.131 -3.968 87 HA GLU 9 HA GLU 9 12.963 1.862 -5.479 88 1HB GLU 9 HB2 GLU 9 13.947 0.700 -2.867 89 2HB GLU 9 HB1 GLU 9 12.400 0.230 -3.545 90 1HG GLU 9 HG2 GLU 9 14.443 -1.268 -3.981 91 2HG GLU 9 HG1 GLU 9 13.364 -0.931 -5.310 92 H LEU 10 HN LEU 10 13.514 2.984 -2.215 93 HA LEU 10 HA LEU 10 10.966 4.195 -1.872 94 1HB LEU 10 HB2 LEU 10 11.746 3.636 0.152 95 2HB LEU 10 HB1 LEU 10 13.405 3.665 -0.384 96 HG LEU 10 HG LEU 10 12.039 6.243 0.149 97 1HD1 LEU 10 3HD1 LEU 10 13.264 4.455 2.234 98 2HD1 LEU 10 2HD1 LEU 10 12.769 6.130 2.483 99 3HD1 LEU 10 1HD1 LEU 10 11.560 4.896 2.119 100 1HD2 LEU 10 1HD2 LEU 10 14.280 6.214 -0.846 101 2HD2 LEU 10 3HD2 LEU 10 14.282 6.944 0.758 102 3HD2 LEU 10 2HD2 LEU 10 14.867 5.292 0.538 103 H ASN 11 HN ASN 11 14.271 5.497 -2.643 104 HA ASN 11 HA ASN 11 13.325 8.204 -2.404 105 1HB ASN 11 HB2 ASN 11 15.722 7.505 -2.055 106 2HB ASN 11 HB1 ASN 11 15.821 7.339 -3.801 107 1HD2 ASN 11 1HD2 ASN 11 13.887 9.886 -2.499 108 2HD2 ASN 11 2HD2 ASN 11 14.978 11.173 -2.859 109 H ASP 12 HN ASP 12 13.347 5.944 -4.990 110 HA ASP 12 HA ASP 12 13.302 7.878 -7.065 111 1HB ASP 12 HB2 ASP 12 13.914 5.585 -7.607 112 2HB ASP 12 HB1 ASP 12 12.351 4.990 -7.054 113 H LEU 13 HN LEU 13 11.127 6.828 -4.744 114 HA LEU 13 HA LEU 13 8.771 7.703 -6.035 115 1HB LEU 13 HB2 LEU 13 9.475 7.173 -3.168 116 2HB LEU 13 HB1 LEU 13 7.894 7.758 -3.651 117 HG LEU 13 HG LEU 13 9.013 5.276 -4.888 118 1HD1 LEU 13 2HD1 LEU 13 7.544 5.475 -2.270 119 2HD1 LEU 13 1HD1 LEU 13 7.779 3.988 -3.186 120 3HD1 LEU 13 3HD1 LEU 13 9.172 4.847 -2.528 121 1HD2 LEU 13 3HD2 LEU 13 6.303 6.468 -4.442 122 2HD2 LEU 13 2HD2 LEU 13 7.108 6.112 -5.972 123 3HD2 LEU 13 1HD2 LEU 13 6.538 4.795 -4.947 124 H ALA 14 HN ALA 14 11.325 9.158 -4.269 125 HA ALA 14 HA ALA 14 10.051 11.733 -4.145 126 1HB ALA 14 HB3 ALA 14 11.596 11.017 -2.375 127 2HB ALA 14 HB1 ALA 14 12.087 12.531 -3.139 128 3HB ALA 14 HB2 ALA 14 12.905 11.026 -3.559 129 H ARG 15 HN ARG 15 12.626 10.159 -5.945 130 HA ARG 15 HA ARG 15 13.413 12.337 -7.543 131 1HB ARG 15 HB2 ARG 15 13.531 9.402 -8.204 132 2HB ARG 15 HB1 ARG 15 14.506 10.671 -8.928 133 1HG ARG 15 HG2 ARG 15 14.577 10.228 -5.980 134 2HG ARG 15 HG1 ARG 15 15.503 9.189 -7.053 135 1HD ARG 15 HD2 ARG 15 16.619 11.178 -7.979 136 2HD ARG 15 HD1 ARG 15 15.687 12.198 -6.885 137 HE ARG 15 HE ARG 15 16.860 10.660 -5.116 138 1HH1 ARG 15 1HH1 ARG 15 18.236 12.019 -8.033 139 2HH1 ARG 15 2HH1 ARG 15 19.851 12.060 -7.403 140 1HH2 ARG 15 1HH2 ARG 15 18.977 10.758 -4.264 141 2HH2 ARG 15 2HH2 ARG 15 20.265 11.376 -5.251 142 H ASP 16 HN ASP 16 11.127 9.701 -8.288 143 HA ASP 16 HA ASP 16 10.576 10.870 -10.901 144 1HB ASP 16 HB2 ASP 16 10.863 8.361 -10.307 145 2HB ASP 16 HB1 ASP 16 9.210 8.461 -9.715 146 HA PRO 17 HA PRO 17 7.106 13.429 -9.977 147 1HB PRO 17 HB2 PRO 17 5.314 12.107 -11.789 148 2HB PRO 17 HB1 PRO 17 6.162 13.639 -12.006 149 1HG PRO 17 HG2 PRO 17 6.864 10.946 -12.986 150 2HG PRO 17 HG1 PRO 17 7.331 12.532 -13.618 151 1HD PRO 17 HD2 PRO 17 9.083 10.943 -12.346 152 2HD PRO 17 HD1 PRO 17 9.142 12.712 -12.187 153 HA PRO 18 HA PRO 18 5.258 10.548 -7.087 154 1HB PRO 18 HB2 PRO 18 4.666 12.350 -5.179 155 2HB PRO 18 HB1 PRO 18 6.316 11.781 -5.466 156 1HG PRO 18 HG2 PRO 18 5.008 14.325 -6.332 157 2HG PRO 18 HG1 PRO 18 6.645 14.064 -5.707 158 1HD PRO 18 HD2 PRO 18 6.044 14.341 -8.367 159 2HD PRO 18 HD1 PRO 18 7.459 13.464 -7.756 160 H ALA 19 HN ALA 19 3.453 10.081 -8.463 161 HA ALA 19 HA ALA 19 1.019 11.400 -7.441 162 1HB ALA 19 HB1 ALA 19 1.369 10.148 -10.166 163 2HB ALA 19 HB3 ALA 19 -0.147 10.762 -9.506 164 3HB ALA 19 HB2 ALA 19 1.191 11.872 -9.825 165 H GLN 20 HN GLN 20 -0.575 10.070 -6.705 166 HA GLN 20 HA GLN 20 -1.272 8.386 -5.399 167 1HB GLN 20 HB2 GLN 20 -1.453 6.119 -6.407 168 2HB GLN 20 HB1 GLN 20 -2.211 7.407 -7.327 169 1HG GLN 20 HG2 GLN 20 0.549 6.699 -8.132 170 2HG GLN 20 HG1 GLN 20 -0.682 5.467 -8.376 171 1HE2 GLN 20 1HE2 GLN 20 -1.533 8.832 -8.528 172 2HE2 GLN 20 2HE2 GLN 20 -1.786 8.891 -10.236 173 H CYS 21 HN CYS 21 1.860 8.748 -5.733 174 HA CYS 21 HA CYS 21 2.513 6.737 -3.793 175 1HB CYS 21 HB2 CYS 21 3.779 6.727 -6.538 176 2HB CYS 21 HB1 CYS 21 4.342 5.779 -5.161 177 HG CYS 21 HG CYS 21 1.303 4.976 -5.249 178 H SER 22 HN SER 22 3.700 7.739 -2.392 179 HA SER 22 HA SER 22 6.107 9.065 -3.282 180 1HB SER 22 HB2 SER 22 4.190 10.506 -1.423 181 2HB SER 22 HB1 SER 22 5.746 11.104 -1.999 182 HG SER 22 HG SER 22 4.410 10.523 -4.151 183 H ALA 23 HN ALA 23 7.620 8.120 -2.100 184 HA ALA 23 HA ALA 23 7.259 8.081 0.809 185 1HB ALA 23 HB1 ALA 23 6.877 5.778 -0.239 186 2HB ALA 23 HB3 ALA 23 8.609 5.786 -0.587 187 3HB ALA 23 HB2 ALA 23 8.040 5.903 1.078 188 H GLY 24 HN GLY 24 9.593 7.497 1.735 189 1HA GLY 24 HA1 GLY 24 11.277 9.565 0.644 190 2HA GLY 24 HA2 GLY 24 11.960 7.961 0.470 191 HA PRO 25 HA PRO 25 13.662 8.281 4.521 192 1HB PRO 25 HB2 PRO 25 14.797 10.990 4.273 193 2HB PRO 25 HB1 PRO 25 15.619 9.443 4.496 194 1HG PRO 25 HG2 PRO 25 15.715 10.756 2.160 195 2HG PRO 25 HG1 PRO 25 15.662 8.986 2.231 196 1HD PRO 25 HD2 PRO 25 13.457 10.925 1.632 197 2HD PRO 25 HD1 PRO 25 13.827 9.366 0.863 198 H VAL 26 HN VAL 26 12.220 8.419 6.172 199 HA VAL 26 HA VAL 26 10.976 11.050 6.687 200 HB VAL 26 HB VAL 26 10.130 8.292 7.585 201 1HG1 VAL 26 3HG1 VAL 26 8.921 10.984 8.227 202 2HG1 VAL 26 2HG1 VAL 26 8.160 9.429 8.560 203 3HG1 VAL 26 1HG1 VAL 26 9.663 9.866 9.374 204 1HG2 VAL 26 3HG2 VAL 26 9.699 8.984 5.218 205 2HG2 VAL 26 2HG2 VAL 26 8.254 8.618 6.160 206 3HG2 VAL 26 1HG2 VAL 26 8.702 10.295 5.851 207 H GLY 27 HN GLY 27 12.034 8.267 8.684 208 1HA GLY 27 HA1 GLY 27 13.200 8.313 10.696 209 2HA GLY 27 HA2 GLY 27 13.065 10.079 10.704 210 H ASP 28 HN ASP 28 13.914 9.620 7.766 211 HA ASP 28 HA ASP 28 15.754 9.845 6.477 212 1HB ASP 28 HB2 ASP 28 16.565 11.300 8.503 213 2HB ASP 28 HB1 ASP 28 17.602 9.914 8.841 214 H ASP 29 HN ASP 29 15.149 7.506 8.668 215 HA ASP 29 HA ASP 29 17.105 5.591 7.762 216 1HB ASP 29 HB2 ASP 29 15.453 4.013 9.055 217 2HB ASP 29 HB1 ASP 29 16.487 5.120 9.954 218 H MET 30 HN MET 30 16.765 3.991 6.303 219 HA MET 30 HA MET 30 14.552 4.328 4.463 220 1HB MET 30 HB2 MET 30 17.204 3.311 4.374 221 2HB MET 30 HB1 MET 30 16.118 2.025 3.892 222 1HG MET 30 HG2 MET 30 16.033 2.907 1.885 223 2HG MET 30 HG1 MET 30 15.273 4.318 2.542 224 1HE MET 30 HE3 MET 30 16.492 6.528 3.257 225 2HE MET 30 HE2 MET 30 17.487 5.603 4.379 226 3HE MET 30 HE1 MET 30 18.244 6.722 3.250 227 H PHE 31 HN PHE 31 14.303 3.206 7.308 228 HA PHE 31 HA PHE 31 12.681 0.910 6.512 229 1HB PHE 31 HB2 PHE 31 13.194 0.060 8.875 230 2HB PHE 31 HB1 PHE 31 14.302 -0.301 7.583 231 HD1 PHE 31 HD1 PHE 31 13.763 1.399 10.744 232 HD2 PHE 31 HD2 PHE 31 16.497 0.865 7.523 233 HE1 PHE 31 HE1 PHE 31 15.573 2.321 12.131 234 HE2 PHE 31 HE2 PHE 31 18.311 1.790 8.905 235 HZ PHE 31 HZ PHE 31 17.848 2.519 11.209 236 H HIS 32 HN HIS 32 12.547 3.898 7.539 237 HA HIS 32 HA HIS 32 9.955 3.338 8.681 238 1HB HIS 32 HB2 HIS 32 10.898 3.598 10.744 239 2HB HIS 32 HB1 HIS 32 12.243 4.561 10.127 240 HD1 HIS 32 HD1 HIS 32 12.234 6.764 11.139 241 HD2 HIS 32 HD2 HIS 32 8.356 5.381 10.581 242 HE1 HIS 32 HE1 HIS 32 10.740 8.570 12.051 243 HE2 HIS 32 HE2 HIS 32 8.398 7.684 11.770 244 H TRP 33 HN TRP 33 9.041 4.091 6.870 245 HA TRP 33 HA TRP 33 9.519 6.853 6.147 246 1HB TRP 33 HB2 TRP 33 9.617 5.897 3.690 247 2HB TRP 33 HB1 TRP 33 11.034 6.085 4.675 248 HD1 TRP 33 HD1 TRP 33 11.562 3.530 6.097 249 HE1 TRP 33 HE1 TRP 33 11.777 1.276 4.927 250 HE3 TRP 33 HE3 TRP 33 9.126 4.657 1.806 251 HZ2 TRP 33 HZ2 TRP 33 11.056 0.130 2.489 252 HZ3 TRP 33 HZ3 TRP 33 8.978 2.939 0.070 253 HH2 TRP 33 HH2 TRP 33 9.939 0.734 0.415 254 H GLN 34 HN GLN 34 8.056 7.613 4.465 255 HA GLN 34 HA GLN 34 5.356 6.690 5.222 256 1HB GLN 34 HB2 GLN 34 6.443 9.012 6.009 257 2HB GLN 34 HB1 GLN 34 5.888 9.513 4.413 258 1HG GLN 34 HG2 GLN 34 4.052 8.207 6.401 259 2HG GLN 34 HG1 GLN 34 4.320 9.945 6.370 260 1HE2 GLN 34 1HE2 GLN 34 1.897 8.374 5.896 261 2HE2 GLN 34 2HE2 GLN 34 1.347 8.821 4.320 262 H ALA 35 HN ALA 35 4.358 5.839 3.549 263 HA ALA 35 HA ALA 35 4.885 6.941 0.869 264 1HB ALA 35 HB2 ALA 35 3.960 4.741 0.083 265 2HB ALA 35 HB1 ALA 35 5.472 4.629 0.990 266 3HB ALA 35 HB3 ALA 35 3.944 4.220 1.765 267 H THR 36 HN THR 36 3.250 8.148 0.023 268 HA THR 36 HA THR 36 0.531 7.730 1.027 269 HB THR 36 HB THR 36 0.150 9.900 -0.369 270 HG1 THR 36 HG1 THR 36 1.907 10.727 -1.193 271 1HG2 THR 36 3HG2 THR 36 1.745 9.898 2.195 272 2HG2 THR 36 2HG2 THR 36 0.806 11.253 1.572 273 3HG2 THR 36 1HG2 THR 36 -0.009 9.769 2.060 274 H ILE 37 HN ILE 37 -0.411 6.161 -0.084 275 HA ILE 37 HA ILE 37 -0.236 6.053 -2.999 276 HB ILE 37 HB ILE 37 -1.339 4.160 -0.925 277 1HG1 ILE 37 2HG1 ILE 37 0.337 2.630 -1.989 278 2HG1 ILE 37 1HG1 ILE 37 0.928 4.010 -2.911 279 1HG2 ILE 37 1HG2 ILE 37 -2.794 4.186 -2.905 280 2HG2 ILE 37 3HG2 ILE 37 -1.393 3.815 -3.909 281 3HG2 ILE 37 2HG2 ILE 37 -1.946 2.654 -2.706 282 1HD1 ILE 37 3HD1 ILE 37 0.813 4.229 0.049 283 2HD1 ILE 37 2HD1 ILE 37 2.066 3.207 -0.660 284 3HD1 ILE 37 1HD1 ILE 37 1.963 4.918 -1.091 285 H MET 38 HN MET 38 -2.177 6.178 -4.336 286 HA MET 38 HA MET 38 -4.356 7.539 -2.893 287 1HB MET 38 HB2 MET 38 -3.153 8.290 -5.540 288 2HB MET 38 HB1 MET 38 -4.615 8.996 -4.869 289 1HG MET 38 HG2 MET 38 -3.473 10.000 -3.127 290 2HG MET 38 HG1 MET 38 -2.075 8.949 -3.338 291 1HE MET 38 HE1 MET 38 -0.470 11.094 -3.158 292 2HE MET 38 HE3 MET 38 -0.629 12.525 -4.175 293 3HE MET 38 HE2 MET 38 -1.860 12.162 -2.967 294 H GLY 39 HN GLY 39 -6.421 7.321 -3.571 295 1HA GLY 39 HA1 GLY 39 -8.160 6.969 -4.958 296 2HA GLY 39 HA2 GLY 39 -7.321 5.506 -5.454 297 HA PRO 40 HA PRO 40 -5.474 7.756 -9.048 298 1HB PRO 40 HB2 PRO 40 -6.682 5.493 -10.522 299 2HB PRO 40 HB1 PRO 40 -5.024 6.100 -10.554 300 1HG PRO 40 HG2 PRO 40 -5.623 3.814 -9.327 301 2HG PRO 40 HG1 PRO 40 -4.412 4.928 -8.666 302 1HD PRO 40 HD2 PRO 40 -7.239 4.480 -7.799 303 2HD PRO 40 HD1 PRO 40 -5.790 4.747 -6.815 304 H ASN 41 HN ASN 41 -6.526 7.918 -11.441 305 HA ASN 41 HA ASN 41 -8.606 9.741 -11.184 306 1HB ASN 41 HB2 ASN 41 -7.572 8.239 -13.579 307 2HB ASN 41 HB1 ASN 41 -8.891 9.395 -13.708 308 1HD2 ASN 41 1HD2 ASN 41 -7.708 11.090 -11.576 309 2HD2 ASN 41 2HD2 ASN 41 -6.394 11.919 -12.330 310 H ASP 42 HN ASP 42 -8.753 6.292 -11.666 311 HA ASP 42 HA ASP 42 -11.623 6.489 -11.149 312 1HB ASP 42 HB2 ASP 42 -11.375 6.018 -13.556 313 2HB ASP 42 HB1 ASP 42 -10.397 4.603 -13.176 314 H SER 43 HN SER 43 -11.856 5.712 -9.249 315 HA SER 43 HA SER 43 -11.014 3.039 -8.588 316 1HB SER 43 HB2 SER 43 -9.008 4.194 -7.871 317 2HB SER 43 HB1 SER 43 -9.940 5.450 -7.106 318 HG SER 43 HG SER 43 -9.292 2.937 -6.184 319 HA PRO 44 HA PRO 44 -14.752 3.188 -6.054 320 1HB PRO 44 HB2 PRO 44 -12.944 1.840 -4.092 321 2HB PRO 44 HB1 PRO 44 -14.583 1.404 -4.587 322 1HG PRO 44 HG2 PRO 44 -12.487 0.049 -5.511 323 2HG PRO 44 HG1 PRO 44 -13.868 0.418 -6.561 324 1HD PRO 44 HD2 PRO 44 -11.156 1.640 -6.492 325 2HD PRO 44 HD1 PRO 44 -12.246 1.371 -7.867 326 H TYR 45 HN TYR 45 -11.535 3.815 -4.656 327 HA TYR 45 HA TYR 45 -12.677 6.076 -3.193 328 1HB TYR 45 HB2 TYR 45 -9.949 5.511 -2.454 329 2HB TYR 45 HB1 TYR 45 -11.384 5.533 -1.464 330 HD1 TYR 45 HD1 TYR 45 -12.932 3.332 -1.884 331 HD2 TYR 45 HD2 TYR 45 -8.723 3.636 -2.371 332 HE1 TYR 45 HE1 TYR 45 -12.719 0.912 -1.484 333 HE2 TYR 45 HE2 TYR 45 -8.494 1.225 -1.980 334 HH TYR 45 HH TYR 45 -9.894 -0.548 -0.720 335 H GLN 46 HN GLN 46 -12.423 6.533 -5.790 336 HA GLN 46 HA GLN 46 -10.155 7.541 -6.911 337 1HB GLN 46 HB2 GLN 46 -12.620 7.421 -7.741 338 2HB GLN 46 HB1 GLN 46 -12.767 9.027 -7.057 339 1HG GLN 46 HG2 GLN 46 -10.806 8.230 -9.194 340 2HG GLN 46 HG1 GLN 46 -12.343 9.033 -9.481 341 1HE2 GLN 46 1HE2 GLN 46 -9.085 9.366 -8.465 342 2HE2 GLN 46 2HE2 GLN 46 -9.083 11.082 -8.283 343 H GLY 47 HN GLY 47 -8.718 8.913 -6.182 344 1HA GLY 47 HA1 GLY 47 -9.545 11.412 -4.927 345 2HA GLY 47 HA2 GLY 47 -7.936 11.027 -5.523 346 H GLY 48 HN GLY 48 -8.876 8.399 -3.850 347 1HA GLY 48 HA1 GLY 48 -8.559 7.611 -1.725 348 2HA GLY 48 HA2 GLY 48 -8.650 9.240 -1.150 349 H VAL 49 HN VAL 49 -6.826 10.424 -1.000 350 HA VAL 49 HA VAL 49 -4.239 9.276 -1.545 351 HB VAL 49 HB VAL 49 -4.874 11.636 0.219 352 1HG1 VAL 49 1HG1 VAL 49 -2.346 10.832 -1.206 353 2HG1 VAL 49 3HG1 VAL 49 -2.575 12.351 -0.338 354 3HG1 VAL 49 2HG1 VAL 49 -2.629 10.820 0.535 355 1HG2 VAL 49 1HG2 VAL 49 -5.836 11.962 -2.016 356 2HG2 VAL 49 3HG2 VAL 49 -4.524 13.089 -1.678 357 3HG2 VAL 49 2HG2 VAL 49 -4.244 11.700 -2.725 358 H PHE 50 HN PHE 50 -4.047 7.422 -0.456 359 HA PHE 50 HA PHE 50 -4.616 7.350 2.382 360 1HB PHE 50 HB2 PHE 50 -4.002 5.248 0.328 361 2HB PHE 50 HB1 PHE 50 -4.110 4.885 2.050 362 HD1 PHE 50 HD1 PHE 50 -6.293 5.589 3.239 363 HD2 PHE 50 HD2 PHE 50 -5.852 5.312 -0.990 364 HE1 PHE 50 HE1 PHE 50 -8.712 5.323 2.995 365 HE2 PHE 50 HE2 PHE 50 -8.294 5.072 -1.232 366 HZ PHE 50 HZ PHE 50 -9.710 5.413 0.789 367 H PHE 51 HN PHE 51 -3.002 5.797 3.585 368 HA PHE 51 HA PHE 51 -0.368 7.064 3.325 369 1HB PHE 51 HB2 PHE 51 -1.719 6.857 5.996 370 2HB PHE 51 HB1 PHE 51 -0.441 7.951 5.490 371 HD1 PHE 51 HD1 PHE 51 -4.062 7.220 5.047 372 HD2 PHE 51 HD2 PHE 51 -0.956 10.129 4.822 373 HE1 PHE 51 HE1 PHE 51 -5.745 8.968 4.675 374 HE2 PHE 51 HE2 PHE 51 -2.640 11.887 4.449 375 HZ PHE 51 HZ PHE 51 -5.032 11.310 4.377 376 H LEU 52 HN LEU 52 1.175 5.522 3.514 377 HA LEU 52 HA LEU 52 0.648 3.293 5.350 378 1HB LEU 52 HB2 LEU 52 1.786 3.047 2.553 379 2HB LEU 52 HB1 LEU 52 1.927 1.794 3.769 380 HG LEU 52 HG LEU 52 -0.666 1.875 3.841 381 1HD1 LEU 52 1HD1 LEU 52 -0.844 3.947 2.473 382 2HD1 LEU 52 3HD1 LEU 52 -0.233 3.028 1.097 383 3HD1 LEU 52 2HD1 LEU 52 -1.764 2.581 1.844 384 1HD2 LEU 52 3HD2 LEU 52 0.896 0.785 1.530 385 2HD2 LEU 52 2HD2 LEU 52 0.553 -0.014 3.064 386 3HD2 LEU 52 1HD2 LEU 52 -0.756 0.323 1.934 387 H THR 53 HN THR 53 2.265 2.936 6.770 388 HA THR 53 HA THR 53 4.809 4.320 6.287 389 HB THR 53 HB THR 53 4.046 2.931 8.858 390 HG1 THR 53 HG1 THR 53 3.206 5.403 7.831 391 1HG2 THR 53 3HG2 THR 53 5.977 5.159 8.199 392 2HG2 THR 53 2HG2 THR 53 5.654 4.530 9.815 393 3HG2 THR 53 1HG2 THR 53 6.391 3.492 8.597 394 H ILE 54 HN ILE 54 6.632 3.190 5.868 395 HA ILE 54 HA ILE 54 6.264 0.281 5.640 396 HB ILE 54 HB ILE 54 8.292 1.726 4.018 397 1HG1 ILE 54 2HG1 ILE 54 5.304 1.844 3.591 398 2HG1 ILE 54 1HG1 ILE 54 6.447 3.183 3.662 399 1HG2 ILE 54 3HG2 ILE 54 6.464 -0.616 3.525 400 2HG2 ILE 54 2HG2 ILE 54 7.644 0.006 2.371 401 3HG2 ILE 54 1HG2 ILE 54 8.185 -0.681 3.903 402 1HD1 ILE 54 1HD1 ILE 54 6.501 1.127 1.479 403 2HD1 ILE 54 3HD1 ILE 54 5.541 2.599 1.393 404 3HD1 ILE 54 2HD1 ILE 54 7.295 2.700 1.525 405 H HIS 55 HN HIS 55 7.671 -1.016 6.641 406 HA HIS 55 HA HIS 55 10.275 0.067 7.342 407 1HB HIS 55 HB2 HIS 55 10.203 -1.105 9.533 408 2HB HIS 55 HB1 HIS 55 9.200 0.333 9.368 409 HD1 HIS 55 HD1 HIS 55 7.023 0.073 10.379 410 HD2 HIS 55 HD2 HIS 55 8.426 -3.484 8.807 411 HE1 HIS 55 HE1 HIS 55 5.216 -1.583 10.779 412 HE2 HIS 55 HE2 HIS 55 6.210 -3.805 10.125 413 H PHE 56 HN PHE 56 11.981 -1.399 7.596 414 HA PHE 56 HA PHE 56 11.407 -4.196 6.906 415 1HB PHE 56 HB2 PHE 56 13.073 -4.302 5.283 416 2HB PHE 56 HB1 PHE 56 12.324 -2.757 4.944 417 HD1 PHE 56 HD1 PHE 56 15.302 -4.480 6.139 418 HD2 PHE 56 HD2 PHE 56 13.507 -0.705 5.426 419 HE1 PHE 56 HE1 PHE 56 17.502 -3.401 6.350 420 HE2 PHE 56 HE2 PHE 56 15.686 0.390 5.634 421 HZ PHE 56 HZ PHE 56 17.700 -0.968 6.101 422 HA PRO 57 HA PRO 57 14.846 -4.683 9.825 423 1HB PRO 57 HB2 PRO 57 14.340 -7.224 10.532 424 2HB PRO 57 HB1 PRO 57 13.325 -5.892 11.092 425 1HG PRO 57 HG2 PRO 57 12.689 -8.014 9.170 426 2HG PRO 57 HG1 PRO 57 11.597 -6.912 10.023 427 1HD PRO 57 HD2 PRO 57 12.683 -6.701 7.304 428 2HD PRO 57 HD1 PRO 57 11.359 -5.784 8.057 429 H THR 58 HN THR 58 16.517 -4.569 8.263 430 HA THR 58 HA THR 58 18.031 -5.327 6.672 431 HB THR 58 HB THR 58 19.657 -6.844 7.813 432 HG1 THR 58 HG1 THR 58 17.941 -7.963 9.039 433 1HG2 THR 58 3HG2 THR 58 19.737 -4.421 8.123 434 2HG2 THR 58 2HG2 THR 58 18.586 -4.545 9.454 435 3HG2 THR 58 1HG2 THR 58 20.191 -5.258 9.608 436 H ASP 59 HN ASP 59 16.507 -6.276 5.127 437 HA ASP 59 HA ASP 59 16.048 -9.144 5.470 438 1HB ASP 59 HB2 ASP 59 14.170 -7.431 5.121 439 2HB ASP 59 HB1 ASP 59 14.710 -7.404 3.443 440 H TYR 60 HN TYR 60 17.209 -6.858 3.054 441 HA TYR 60 HA TYR 60 17.390 -8.280 0.782 442 1HB TYR 60 HB2 TYR 60 18.098 -5.949 0.928 443 2HB TYR 60 HB1 TYR 60 19.475 -6.423 1.933 444 HD1 TYR 60 HD1 TYR 60 18.116 -6.362 -1.479 445 HD2 TYR 60 HD2 TYR 60 21.459 -7.402 0.945 446 HE1 TYR 60 HE1 TYR 60 19.505 -6.575 -3.495 447 HE2 TYR 60 HE2 TYR 60 22.854 -7.616 -1.068 448 HH TYR 60 HH TYR 60 21.951 -6.417 -4.059 449 HA PRO 61 HA PRO 61 18.588 -8.982 -0.989 450 1HB PRO 61 HB2 PRO 61 18.919 -11.675 -1.926 451 2HB PRO 61 HB1 PRO 61 19.855 -10.242 -2.343 452 1HG PRO 61 HG2 PRO 61 20.845 -12.359 -0.918 453 2HG PRO 61 HG1 PRO 61 21.483 -10.708 -0.819 454 1HD PRO 61 HD2 PRO 61 19.591 -12.125 1.026 455 2HD PRO 61 HD1 PRO 61 20.963 -11.065 1.420 456 H PHE 62 HN PHE 62 16.543 -8.659 -0.795 457 HA PHE 62 HA PHE 62 14.742 -9.806 -2.277 458 1HB PHE 62 HB2 PHE 62 14.715 -11.894 -1.017 459 2HB PHE 62 HB1 PHE 62 14.271 -11.037 0.463 460 HD1 PHE 62 HD1 PHE 62 12.979 -13.311 -1.448 461 HD2 PHE 62 HD2 PHE 62 12.140 -9.223 -0.586 462 HE1 PHE 62 HE1 PHE 62 10.620 -13.671 -2.046 463 HE2 PHE 62 HE2 PHE 62 9.779 -9.583 -1.180 464 HZ PHE 62 HZ PHE 62 9.017 -11.804 -1.912 465 H LYS 63 HN LYS 63 14.034 -9.260 1.160 466 HA LYS 63 HA LYS 63 13.410 -7.424 2.271 467 1HB LYS 63 HB2 LYS 63 15.289 -6.310 1.406 468 2HB LYS 63 HB1 LYS 63 14.570 -6.194 -0.188 469 1HG LYS 63 HG2 LYS 63 13.078 -4.790 1.880 470 2HG LYS 63 HG1 LYS 63 14.724 -4.185 1.636 471 1HD LYS 63 HD2 LYS 63 14.278 -3.437 -0.455 472 2HD LYS 63 HD1 LYS 63 13.192 -4.784 -0.821 473 1HE LYS 63 HE2 LYS 63 11.698 -3.600 0.990 474 2HE LYS 63 HE1 LYS 63 12.622 -2.172 0.489 475 1HZ LYS 63 HZ1 LYS 63 12.008 -2.681 -1.819 476 2HZ LYS 63 HZ3 LYS 63 11.063 -3.976 -1.271 477 3HZ LYS 63 HZ2 LYS 63 10.652 -2.393 -0.850 478 HA PRO 64 HA PRO 64 9.273 -7.099 0.412 479 1HB PRO 64 HB2 PRO 64 7.966 -8.333 2.418 480 2HB PRO 64 HB1 PRO 64 8.645 -9.223 1.049 481 1HG PRO 64 HG2 PRO 64 9.685 -8.925 3.825 482 2HG PRO 64 HG1 PRO 64 9.742 -10.331 2.749 483 1HD PRO 64 HD2 PRO 64 11.840 -8.592 3.197 484 2HD PRO 64 HD1 PRO 64 11.679 -9.646 1.780 485 HA PRO 65 HA PRO 65 9.368 -3.636 3.303 486 1HB PRO 65 HB2 PRO 65 7.996 -1.916 1.746 487 2HB PRO 65 HB1 PRO 65 9.698 -2.285 1.453 488 1HG PRO 65 HG2 PRO 65 7.266 -3.333 0.069 489 2HG PRO 65 HG1 PRO 65 8.827 -2.848 -0.621 490 1HD PRO 65 HD2 PRO 65 8.106 -5.452 -0.130 491 2HD PRO 65 HD1 PRO 65 9.784 -4.881 -0.175 492 H LYS 66 HN LYS 66 8.010 -3.984 4.998 493 HA LYS 66 HA LYS 66 5.291 -4.755 4.550 494 1HB LYS 66 HB2 LYS 66 6.683 -5.445 6.579 495 2HB LYS 66 HB1 LYS 66 6.422 -3.812 7.184 496 1HG LYS 66 HG2 LYS 66 4.863 -5.449 8.143 497 2HG LYS 66 HG1 LYS 66 4.051 -4.149 7.272 498 1HD LYS 66 HD2 LYS 66 3.022 -6.310 6.789 499 2HD LYS 66 HD1 LYS 66 3.755 -5.623 5.343 500 1HE LYS 66 HE2 LYS 66 4.279 -7.953 5.399 501 2HE LYS 66 HE1 LYS 66 5.751 -7.056 5.752 502 1HZ LYS 66 HZ3 LYS 66 4.007 -8.361 7.773 503 2HZ LYS 66 HZ2 LYS 66 5.483 -8.960 7.214 504 3HZ LYS 66 HZ1 LYS 66 5.440 -7.520 8.097 505 H VAL 67 HN VAL 67 4.548 -3.107 3.298 506 HA VAL 67 HA VAL 67 4.251 -0.454 4.261 507 HB VAL 67 HB VAL 67 2.788 -0.145 2.366 508 1HG1 VAL 67 1HG1 VAL 67 5.162 -0.244 1.866 509 2HG1 VAL 67 3HG1 VAL 67 5.048 -1.984 1.618 510 3HG1 VAL 67 2HG1 VAL 67 4.214 -0.880 0.524 511 1HG2 VAL 67 1HG2 VAL 67 2.732 -3.144 2.222 512 2HG2 VAL 67 3HG2 VAL 67 1.372 -2.041 2.462 513 3HG2 VAL 67 2HG2 VAL 67 2.200 -2.102 0.903 514 H ALA 68 HN ALA 68 2.659 0.348 5.517 515 HA ALA 68 HA ALA 68 0.367 -1.374 6.028 516 1HB ALA 68 HB3 ALA 68 2.058 -1.871 7.762 517 2HB ALA 68 HB1 ALA 68 0.564 -1.213 8.432 518 3HB ALA 68 HB2 ALA 68 1.990 -0.186 8.279 519 H PHE 69 HN PHE 69 -1.434 -0.377 5.940 520 HA PHE 69 HA PHE 69 -1.786 2.302 5.482 521 1HB PHE 69 HB2 PHE 69 -3.552 0.063 6.105 522 2HB PHE 69 HB1 PHE 69 -4.204 1.655 6.467 523 HD1 PHE 69 HD1 PHE 69 -4.788 3.167 4.753 524 HD2 PHE 69 HD2 PHE 69 -2.945 -0.541 3.795 525 HE1 PHE 69 HE1 PHE 69 -5.401 3.476 2.399 526 HE2 PHE 69 HE2 PHE 69 -3.555 -0.222 1.428 527 HZ PHE 69 HZ PHE 69 -4.761 1.787 0.734 528 H THR 70 HN THR 70 -1.536 3.974 6.643 529 HA THR 70 HA THR 70 -1.535 3.980 9.512 530 HB THR 70 HB THR 70 -1.857 6.392 7.727 531 HG1 THR 70 HG1 THR 70 0.347 4.685 8.083 532 1HG2 THR 70 2HG2 THR 70 -0.496 5.987 10.393 533 2HG2 THR 70 1HG2 THR 70 -0.565 7.501 9.492 534 3HG2 THR 70 3HG2 THR 70 -2.046 6.785 10.124 535 H THR 71 HN THR 71 -3.860 4.485 6.977 536 HA THR 71 HA THR 71 -5.828 5.458 8.925 537 HB THR 71 HB THR 71 -5.287 6.816 6.774 538 HG1 THR 71 HG1 THR 71 -7.625 7.281 6.588 539 1HG2 THR 71 2HG2 THR 71 -6.942 4.562 5.659 540 2HG2 THR 71 1HG2 THR 71 -6.868 6.149 4.897 541 3HG2 THR 71 3HG2 THR 71 -5.401 5.183 5.070 542 H ARG 72 HN ARG 72 -8.120 4.780 8.246 543 HA ARG 72 HA ARG 72 -8.183 1.899 8.158 544 1HB ARG 72 HB2 ARG 72 -10.659 2.240 8.464 545 2HB ARG 72 HB1 ARG 72 -9.660 2.931 9.731 546 1HG ARG 72 HG2 ARG 72 -10.029 4.899 7.728 547 2HG ARG 72 HG1 ARG 72 -11.594 4.196 8.127 548 1HD ARG 72 HD2 ARG 72 -11.055 6.153 9.504 549 2HD ARG 72 HD1 ARG 72 -11.262 4.689 10.467 550 HE ARG 72 HE ARG 72 -8.696 4.616 10.327 551 1HH1 ARG 72 1HH1 ARG 72 -10.627 7.515 10.570 552 2HH1 ARG 72 2HH1 ARG 72 -9.368 8.445 11.313 553 1HH2 ARG 72 1HH2 ARG 72 -7.029 5.844 11.310 554 2HH2 ARG 72 2HH2 ARG 72 -7.325 7.501 11.722 555 H ILE 73 HN ILE 73 -9.224 0.650 6.553 556 HA ILE 73 HA ILE 73 -10.188 1.896 4.121 557 HB ILE 73 HB ILE 73 -8.012 2.148 3.438 558 1HG1 ILE 73 2HG1 ILE 73 -7.270 -0.014 2.148 559 2HG1 ILE 73 1HG1 ILE 73 -8.858 -0.609 2.608 560 1HG2 ILE 73 1HG2 ILE 73 -7.340 -0.353 4.975 561 2HG2 ILE 73 3HG2 ILE 73 -6.176 0.546 4.002 562 3HG2 ILE 73 2HG2 ILE 73 -6.931 1.309 5.404 563 1HD1 ILE 73 3HD1 ILE 73 -8.362 1.940 1.089 564 2HD1 ILE 73 2HD1 ILE 73 -8.749 0.389 0.346 565 3HD1 ILE 73 1HD1 ILE 73 -9.918 1.176 1.412 566 H TYR 74 HN TYR 74 -11.830 0.582 3.486 567 HA TYR 74 HA TYR 74 -11.786 -2.214 4.137 568 1HB TYR 74 HB2 TYR 74 -13.791 -0.324 3.051 569 2HB TYR 74 HB1 TYR 74 -13.956 -2.019 2.587 570 HD1 TYR 74 HD1 TYR 74 -13.810 0.300 5.441 571 HD2 TYR 74 HD2 TYR 74 -14.655 -3.644 4.130 572 HE1 TYR 74 HE1 TYR 74 -14.787 -0.219 7.651 573 HE2 TYR 74 HE2 TYR 74 -15.623 -4.191 6.303 574 HH TYR 74 HH TYR 74 -15.514 -3.416 8.616 575 H HIS 75 HN HIS 75 -10.402 -3.345 3.050 576 HA HIS 75 HA HIS 75 -11.003 -4.027 0.356 577 1HB HIS 75 HB2 HIS 75 -9.495 -1.918 0.176 578 2HB HIS 75 HB1 HIS 75 -8.205 -2.959 0.766 579 HD1 HIS 75 HD1 HIS 75 -10.296 -2.268 -2.246 580 HD2 HIS 75 HD2 HIS 75 -7.315 -4.904 -1.055 581 HE1 HIS 75 HE1 HIS 75 -9.603 -3.483 -4.325 582 HE2 HIS 75 HE2 HIS 75 -7.859 -5.128 -3.576 583 HA PRO 76 HA PRO 76 -9.913 -7.539 2.734 584 1HB PRO 76 HB2 PRO 76 -10.137 -9.458 0.837 585 2HB PRO 76 HB1 PRO 76 -11.520 -8.637 1.568 586 1HG PRO 76 HG2 PRO 76 -10.183 -8.105 -1.054 587 2HG PRO 76 HG1 PRO 76 -11.913 -8.189 -0.675 588 1HD PRO 76 HD2 PRO 76 -10.604 -5.837 -0.920 589 2HD PRO 76 HD1 PRO 76 -11.950 -6.060 0.215 590 H ASN 77 HN ASN 77 -7.784 -6.239 0.620 591 HA ASN 77 HA ASN 77 -5.866 -8.405 1.078 592 1HB ASN 77 HB2 ASN 77 -6.025 -6.246 -0.993 593 2HB ASN 77 HB1 ASN 77 -4.441 -6.868 -0.545 594 1HD2 ASN 77 1HD2 ASN 77 -4.237 -7.657 -2.692 595 2HD2 ASN 77 2HD2 ASN 77 -5.021 -9.122 -3.171 596 H ILE 78 HN ILE 78 -6.956 -5.539 2.297 597 HA ILE 78 HA ILE 78 -4.493 -5.029 3.759 598 HB ILE 78 HB ILE 78 -6.949 -3.284 3.375 599 1HG1 ILE 78 2HG1 ILE 78 -5.060 -1.671 2.776 600 2HG1 ILE 78 1HG1 ILE 78 -4.066 -3.086 2.734 601 1HG2 ILE 78 1HG2 ILE 78 -6.169 -3.238 5.736 602 2HG2 ILE 78 3HG2 ILE 78 -4.562 -2.798 5.145 603 3HG2 ILE 78 2HG2 ILE 78 -5.925 -1.703 4.900 604 1HD1 ILE 78 2HD1 ILE 78 -5.599 -4.022 0.991 605 2HD1 ILE 78 1HD1 ILE 78 -6.359 -2.434 0.933 606 3HD1 ILE 78 3HD1 ILE 78 -4.659 -2.615 0.498 607 H ASN 79 HN ASN 79 -4.524 -5.204 5.907 608 HA ASN 79 HA ASN 79 -6.901 -6.406 7.117 609 1HB ASN 79 HB2 ASN 79 -5.307 -7.611 8.620 610 2HB ASN 79 HB1 ASN 79 -5.213 -8.078 6.920 611 1HD2 ASN 79 1HD2 ASN 79 -3.486 -7.527 5.771 612 2HD2 ASN 79 2HD2 ASN 79 -2.013 -6.970 6.429 613 H SER 80 HN SER 80 -6.699 -6.286 9.587 614 HA SER 80 HA SER 80 -7.271 -3.768 10.383 615 1HB SER 80 HB2 SER 80 -6.075 -5.901 12.151 616 2HB SER 80 HB1 SER 80 -7.149 -4.590 12.640 617 HG SER 80 HG SER 80 -8.151 -6.722 12.254 618 H ASN 81 HN ASN 81 -3.973 -4.877 9.829 619 HA ASN 81 HA ASN 81 -3.143 -2.399 11.222 620 1HB ASN 81 HB2 ASN 81 -0.892 -3.410 11.559 621 2HB ASN 81 HB1 ASN 81 -2.175 -4.224 12.442 622 1HD2 ASN 81 1HD2 ASN 81 0.064 -4.434 9.790 623 2HD2 ASN 81 2HD2 ASN 81 -0.056 -6.145 9.574 624 H GLY 82 HN GLY 82 -4.021 -2.839 8.454 625 1HA GLY 82 HA1 GLY 82 -2.338 -0.906 7.334 626 2HA GLY 82 HA2 GLY 82 -3.647 -1.749 6.520 627 H SER 83 HN SER 83 -1.848 -4.223 7.429 628 HA SER 83 HA SER 83 0.316 -3.993 5.565 629 1HB SER 83 HB2 SER 83 0.649 -5.404 7.463 630 2HB SER 83 HB1 SER 83 -0.820 -6.299 7.118 631 HG SER 83 HG SER 83 1.068 -6.265 5.099 632 H ILE 84 HN ILE 84 0.401 -4.727 3.518 633 HA ILE 84 HA ILE 84 -2.114 -5.694 2.394 634 HB ILE 84 HB ILE 84 0.026 -3.999 1.142 635 1HG1 ILE 84 2HG1 ILE 84 -2.888 -3.484 1.730 636 2HG1 ILE 84 1HG1 ILE 84 -1.551 -2.926 2.731 637 1HG2 ILE 84 3HG2 ILE 84 -2.475 -5.113 -0.120 638 2HG2 ILE 84 2HG2 ILE 84 -1.402 -3.918 -0.849 639 3HG2 ILE 84 1HG2 ILE 84 -0.816 -5.551 -0.531 640 1HD1 ILE 84 3HD1 ILE 84 -0.738 -1.842 0.501 641 2HD1 ILE 84 2HD1 ILE 84 -2.442 -1.978 0.072 642 3HD1 ILE 84 1HD1 ILE 84 -1.956 -1.066 1.504 643 H CYS 85 HN CYS 85 -2.205 -7.472 1.216 644 HA CYS 85 HA CYS 85 0.194 -8.991 0.746 645 1HB CYS 85 HB2 CYS 85 -1.836 -10.171 1.456 646 2HB CYS 85 HB1 CYS 85 -2.687 -9.596 0.026 647 HG CYS 85 HG CYS 85 -2.214 -11.848 -1.146 648 H LEU 86 HN LEU 86 1.311 -7.757 -0.706 649 HA LEU 86 HA LEU 86 0.204 -7.797 -3.419 650 1HB LEU 86 HB2 LEU 86 2.150 -6.058 -2.030 651 2HB LEU 86 HB1 LEU 86 2.563 -6.494 -3.671 652 HG LEU 86 HG LEU 86 -0.045 -5.175 -2.904 653 1HD1 LEU 86 1HD1 LEU 86 2.499 -3.983 -4.004 654 2HD1 LEU 86 3HD1 LEU 86 0.952 -3.145 -3.872 655 3HD1 LEU 86 2HD1 LEU 86 1.796 -3.671 -2.416 656 1HD2 LEU 86 3HD2 LEU 86 -0.037 -6.515 -4.983 657 2HD2 LEU 86 2HD2 LEU 86 -0.270 -4.791 -5.267 658 3HD2 LEU 86 1HD2 LEU 86 1.301 -5.530 -5.569 659 H ASP 87 HN ASP 87 0.811 -9.461 -4.589 660 HA ASP 87 HA ASP 87 2.438 -11.538 -3.844 661 1HB ASP 87 HB2 ASP 87 0.874 -11.006 -5.992 662 2HB ASP 87 HB1 ASP 87 2.465 -10.884 -6.739 663 H ILE 88 HN ILE 88 3.466 -8.634 -5.683 664 HA ILE 88 HA ILE 88 6.049 -9.407 -6.284 665 HB ILE 88 HB ILE 88 6.491 -6.809 -5.668 666 1HG1 ILE 88 2HG1 ILE 88 3.859 -6.992 -5.091 667 2HG1 ILE 88 1HG1 ILE 88 4.635 -5.514 -5.651 668 1HG2 ILE 88 1HG2 ILE 88 6.944 -7.927 -7.780 669 2HG2 ILE 88 3HG2 ILE 88 5.229 -7.865 -8.182 670 3HG2 ILE 88 2HG2 ILE 88 6.155 -6.371 -8.025 671 1HD1 ILE 88 1HD1 ILE 88 3.277 -7.540 -7.394 672 2HD1 ILE 88 3HD1 ILE 88 2.575 -6.006 -6.855 673 3HD1 ILE 88 2HD1 ILE 88 3.991 -6.005 -7.902 674 H LEU 89 HN LEU 89 4.753 -8.526 -3.222 675 HA LEU 89 HA LEU 89 7.384 -8.008 -2.103 676 1HB LEU 89 HB2 LEU 89 4.722 -7.963 -0.712 677 2HB LEU 89 HB1 LEU 89 6.207 -7.179 -0.227 678 HG LEU 89 HG LEU 89 4.567 -6.451 -2.643 679 1HD1 LEU 89 1HD1 LEU 89 3.480 -5.827 -0.542 680 2HD1 LEU 89 3HD1 LEU 89 4.946 -4.988 -0.033 681 3HD1 LEU 89 2HD1 LEU 89 4.042 -4.408 -1.433 682 1HD2 LEU 89 3HD2 LEU 89 7.055 -6.118 -2.785 683 2HD2 LEU 89 2HD2 LEU 89 6.060 -4.685 -3.008 684 3HD2 LEU 89 1HD2 LEU 89 6.885 -4.955 -1.476 685 H ARG 90 HN ARG 90 5.141 -10.565 -2.354 686 HA ARG 90 HA ARG 90 6.471 -11.985 -0.162 687 1HB ARG 90 HB2 ARG 90 4.131 -12.865 0.428 688 2HB ARG 90 HB1 ARG 90 4.551 -11.231 0.912 689 1HG ARG 90 HG2 ARG 90 3.405 -10.457 -1.196 690 2HG ARG 90 HG1 ARG 90 2.784 -12.101 -1.345 691 1HD ARG 90 HD2 ARG 90 2.399 -10.310 1.053 692 2HD ARG 90 HD1 ARG 90 1.205 -10.564 -0.219 693 HE ARG 90 HE ARG 90 1.724 -13.082 0.593 694 1HH1 ARG 90 1HH1 ARG 90 0.912 -10.183 2.388 695 2HH1 ARG 90 2HH1 ARG 90 0.072 -11.043 3.634 696 1HH2 ARG 90 1HH2 ARG 90 0.624 -14.205 2.224 697 2HH2 ARG 90 2HH2 ARG 90 -0.096 -13.336 3.542 698 H SER 91 HN SER 91 5.626 -12.183 -3.396 699 HA SER 91 HA SER 91 6.015 -15.038 -3.388 700 1HB SER 91 HB2 SER 91 3.433 -13.881 -4.428 701 2HB SER 91 HB1 SER 91 3.941 -15.561 -4.606 702 HG SER 91 HG SER 91 4.169 -14.990 -2.047 703 H GLN 92 HN GLN 92 5.510 -12.113 -5.302 704 HA GLN 92 HA GLN 92 6.150 -13.464 -7.776 705 1HB GLN 92 HB2 GLN 92 5.026 -10.829 -7.047 706 2HB GLN 92 HB1 GLN 92 6.114 -10.802 -8.431 707 1HG GLN 92 HG2 GLN 92 3.864 -12.768 -8.238 708 2HG GLN 92 HG1 GLN 92 3.624 -11.137 -8.855 709 1HE2 GLN 92 1HE2 GLN 92 6.602 -12.905 -9.432 710 2HE2 GLN 92 2HE2 GLN 92 6.330 -13.169 -11.115 711 H TRP 93 HN TRP 93 7.969 -11.557 -5.476 712 HA TRP 93 HA TRP 93 10.076 -11.274 -7.509 713 1HB TRP 93 HB2 TRP 93 8.619 -9.239 -7.265 714 2HB TRP 93 HB1 TRP 93 9.235 -9.067 -5.629 715 HD1 TRP 93 HD1 TRP 93 12.231 -10.023 -7.456 716 HE1 TRP 93 HE1 TRP 93 13.556 -7.919 -8.179 717 HE3 TRP 93 HE3 TRP 93 8.601 -6.556 -6.784 718 HZ2 TRP 93 HZ2 TRP 93 13.061 -5.135 -8.448 719 HZ3 TRP 93 HZ3 TRP 93 9.105 -4.203 -7.216 720 HH2 TRP 93 HH2 TRP 93 11.268 -3.514 -8.014 721 H SER 94 HN SER 94 11.476 -9.486 -5.456 722 HA SER 94 HA SER 94 12.639 -11.127 -3.539 723 1HB SER 94 HB2 SER 94 13.818 -11.382 -6.308 724 2HB SER 94 HB1 SER 94 14.687 -11.835 -4.839 725 HG SER 94 HG SER 94 12.132 -12.888 -5.167 726 HA PRO 95 HA PRO 95 15.546 -8.217 -2.747 727 1HB PRO 95 HB2 PRO 95 17.947 -8.088 -4.115 728 2HB PRO 95 HB1 PRO 95 17.486 -9.342 -2.964 729 1HG PRO 95 HG2 PRO 95 17.929 -9.649 -5.746 730 2HG PRO 95 HG1 PRO 95 17.299 -10.862 -4.622 731 1HD PRO 95 HD2 PRO 95 15.835 -9.046 -6.472 732 2HD PRO 95 HD1 PRO 95 15.441 -10.693 -5.959 733 H ALA 96 HN ALA 96 14.402 -7.140 -5.661 734 HA ALA 96 HA ALA 96 15.950 -4.635 -5.425 735 1HB ALA 96 HB1 ALA 96 16.515 -5.740 -7.476 736 2HB ALA 96 HB3 ALA 96 14.817 -5.933 -7.896 737 3HB ALA 96 HB2 ALA 96 15.535 -4.322 -7.858 738 H LEU 97 HN LEU 97 13.217 -5.788 -4.477 739 HA LEU 97 HA LEU 97 10.997 -4.806 -5.546 740 1HB LEU 97 HB2 LEU 97 11.825 -5.488 -2.910 741 2HB LEU 97 HB1 LEU 97 10.783 -4.084 -2.828 742 HG LEU 97 HG LEU 97 9.418 -5.959 -2.542 743 1HD1 LEU 97 3HD1 LEU 97 9.145 -4.973 -5.356 744 2HD1 LEU 97 2HD1 LEU 97 7.920 -5.888 -4.491 745 3HD1 LEU 97 1HD1 LEU 97 8.399 -4.294 -3.911 746 1HD2 LEU 97 3HD2 LEU 97 10.939 -7.649 -3.363 747 2HD2 LEU 97 2HD2 LEU 97 9.330 -7.843 -4.054 748 3HD2 LEU 97 1HD2 LEU 97 10.624 -7.132 -5.019 749 H THR 98 HN THR 98 10.704 -2.897 -6.586 750 HA THR 98 HA THR 98 11.746 -0.460 -5.455 751 HB THR 98 HB THR 98 10.522 0.470 -7.562 752 HG1 THR 98 HG1 THR 98 10.827 -1.665 -9.039 753 1HG2 THR 98 3HG2 THR 98 12.965 0.323 -7.301 754 2HG2 THR 98 2HG2 THR 98 12.913 -1.356 -7.837 755 3HG2 THR 98 1HG2 THR 98 12.463 -0.063 -8.949 756 H ILE 99 HN ILE 99 10.652 0.852 -4.257 757 HA ILE 99 HA ILE 99 7.999 0.115 -3.478 758 HB ILE 99 HB ILE 99 9.025 2.745 -2.579 759 1HG1 ILE 99 2HG1 ILE 99 11.074 1.364 -2.664 760 2HG1 ILE 99 1HG1 ILE 99 10.595 1.711 -1.013 761 1HG2 ILE 99 2HG2 ILE 99 7.201 0.686 -1.787 762 2HG2 ILE 99 1HG2 ILE 99 8.363 0.974 -0.499 763 3HG2 ILE 99 3HG2 ILE 99 7.404 2.308 -1.128 764 1HD1 ILE 99 1HD1 ILE 99 9.510 -0.556 -0.966 765 2HD1 ILE 99 3HD1 ILE 99 10.289 -0.865 -2.517 766 3HD1 ILE 99 2HD1 ILE 99 11.269 -0.551 -1.086 767 H SER 100 HN SER 100 9.540 2.553 -5.376 768 HA SER 100 HA SER 100 7.507 4.027 -6.381 769 1HB SER 100 HB2 SER 100 9.934 4.053 -7.048 770 2HB SER 100 HB1 SER 100 9.629 2.623 -8.031 771 HG SER 100 HG SER 100 9.481 4.961 -8.929 772 H LYS 101 HN LYS 101 8.299 0.660 -7.231 773 HA LYS 101 HA LYS 101 5.982 0.302 -8.849 774 1HB LYS 101 HB2 LYS 101 7.061 -1.541 -9.515 775 2HB LYS 101 HB1 LYS 101 8.384 -1.051 -8.474 776 1HG LYS 101 HG2 LYS 101 7.937 -3.331 -8.140 777 2HG LYS 101 HG1 LYS 101 7.456 -2.463 -6.687 778 1HD LYS 101 HD2 LYS 101 5.847 -4.162 -7.172 779 2HD LYS 101 HD1 LYS 101 5.132 -2.574 -7.469 780 1HE LYS 101 HE2 LYS 101 4.619 -4.349 -9.191 781 2HE LYS 101 HE1 LYS 101 5.272 -2.836 -9.813 782 1HZ LYS 101 HZ3 LYS 101 6.857 -5.305 -9.343 783 2HZ LYS 101 HZ2 LYS 101 6.278 -4.793 -10.844 784 3HZ LYS 101 HZ1 LYS 101 7.426 -3.865 -10.023 785 H VAL 102 HN VAL 102 6.762 -0.510 -5.483 786 HA VAL 102 HA VAL 102 4.587 -2.214 -4.986 787 HB VAL 102 HB VAL 102 6.171 -0.452 -3.132 788 1HG1 VAL 102 1HG1 VAL 102 4.242 -2.667 -2.488 789 2HG1 VAL 102 3HG1 VAL 102 5.355 -1.942 -1.330 790 3HG1 VAL 102 2HG1 VAL 102 4.076 -0.969 -2.054 791 1HG2 VAL 102 3HG2 VAL 102 6.419 -3.246 -4.101 792 2HG2 VAL 102 2HG2 VAL 102 7.633 -1.968 -4.056 793 3HG2 VAL 102 1HG2 VAL 102 7.127 -2.758 -2.559 794 H LEU 103 HN LEU 103 4.867 1.182 -3.778 795 HA LEU 103 HA LEU 103 2.408 1.798 -3.098 796 1HB LEU 103 HB2 LEU 103 4.593 3.218 -4.517 797 2HB LEU 103 HB1 LEU 103 3.065 4.055 -4.259 798 HG LEU 103 HG LEU 103 3.290 3.514 -1.891 799 1HD1 LEU 103 1HD1 LEU 103 5.987 2.569 -2.567 800 2HD1 LEU 103 3HD1 LEU 103 5.455 3.011 -0.945 801 3HD1 LEU 103 2HD1 LEU 103 4.668 1.684 -1.787 802 1HD2 LEU 103 2HD2 LEU 103 5.411 5.176 -3.143 803 2HD2 LEU 103 1HD2 LEU 103 3.821 5.708 -2.603 804 3HD2 LEU 103 3HD2 LEU 103 5.038 5.221 -1.422 805 H LEU 104 HN LEU 104 3.548 1.645 -6.460 806 HA LEU 104 HA LEU 104 1.164 2.789 -7.488 807 1HB LEU 104 HB2 LEU 104 3.461 1.348 -8.757 808 2HB LEU 104 HB1 LEU 104 2.043 1.819 -9.687 809 HG LEU 104 HG LEU 104 3.884 3.695 -8.193 810 1HD1 LEU 104 3HD1 LEU 104 3.402 3.271 -11.128 811 2HD1 LEU 104 2HD1 LEU 104 4.405 4.536 -10.423 812 3HD1 LEU 104 1HD1 LEU 104 4.861 2.838 -10.237 813 1HD2 LEU 104 3HD2 LEU 104 1.354 4.190 -9.746 814 2HD2 LEU 104 2HD2 LEU 104 1.716 4.630 -8.072 815 3HD2 LEU 104 1HD2 LEU 104 2.543 5.448 -9.396 816 H SER 105 HN SER 105 2.317 -0.543 -7.121 817 HA SER 105 HA SER 105 -0.108 -1.641 -8.104 818 1HB SER 105 HB2 SER 105 0.721 -3.737 -6.884 819 2HB SER 105 HB1 SER 105 1.678 -3.115 -8.222 820 HG SER 105 HG SER 105 2.347 -2.062 -5.770 821 H ILE 106 HN ILE 106 0.890 -0.611 -4.853 822 HA ILE 106 HA ILE 106 -1.386 -1.631 -3.491 823 HB ILE 106 HB ILE 106 0.226 0.871 -2.892 824 1HG1 ILE 106 2HG1 ILE 106 0.286 -1.882 -1.618 825 2HG1 ILE 106 1HG1 ILE 106 1.551 -1.167 -2.615 826 1HG2 ILE 106 2HG2 ILE 106 -2.094 0.963 -2.003 827 2HG2 ILE 106 1HG2 ILE 106 -1.755 -0.496 -1.081 828 3HG2 ILE 106 3HG2 ILE 106 -0.853 0.981 -0.752 829 1HD1 ILE 106 3HD1 ILE 106 1.501 0.715 -0.764 830 2HD1 ILE 106 2HD1 ILE 106 0.798 -0.579 0.212 831 3HD1 ILE 106 1HD1 ILE 106 2.388 -0.789 -0.514 832 H CYS 107 HN CYS 107 -0.666 1.478 -4.998 833 HA CYS 107 HA CYS 107 -3.115 2.744 -4.878 834 1HB CYS 107 HB2 CYS 107 -1.484 4.080 -5.809 835 2HB CYS 107 HB1 CYS 107 -0.793 2.768 -6.754 836 HG CYS 107 HG CYS 107 -1.676 3.836 -8.915 837 H SER 108 HN SER 108 -1.959 0.251 -7.069 838 HA SER 108 HA SER 108 -4.229 0.296 -8.753 839 1HB SER 108 HB2 SER 108 -2.211 -1.884 -8.291 840 2HB SER 108 HB1 SER 108 -3.423 -1.863 -9.574 841 HG SER 108 HG SER 108 -1.447 0.147 -9.212 842 H LEU 109 HN LEU 109 -3.498 -1.297 -5.721 843 HA LEU 109 HA LEU 109 -5.643 -3.200 -6.031 844 1HB LEU 109 HB2 LEU 109 -4.021 -2.452 -3.589 845 2HB LEU 109 HB1 LEU 109 -5.158 -3.782 -3.667 846 HG LEU 109 HG LEU 109 -2.647 -3.574 -5.327 847 1HD1 LEU 109 3HD1 LEU 109 -3.255 -5.174 -2.853 848 2HD1 LEU 109 2HD1 LEU 109 -1.819 -5.366 -3.861 849 3HD1 LEU 109 1HD1 LEU 109 -2.094 -3.852 -2.996 850 1HD2 LEU 109 2HD2 LEU 109 -4.639 -5.802 -4.948 851 2HD2 LEU 109 1HD2 LEU 109 -4.380 -4.864 -6.419 852 3HD2 LEU 109 3HD2 LEU 109 -3.114 -5.935 -5.820 853 H LEU 110 HN LEU 110 -4.987 -0.198 -4.424 854 HA LEU 110 HA LEU 110 -7.499 0.185 -3.224 855 1HB LEU 110 HB2 LEU 110 -5.216 1.884 -4.050 856 2HB LEU 110 HB1 LEU 110 -6.729 2.729 -3.773 857 HG LEU 110 HG LEU 110 -6.761 1.921 -1.492 858 1HD1 LEU 110 3HD1 LEU 110 -5.740 -0.302 -1.964 859 2HD1 LEU 110 2HD1 LEU 110 -4.174 0.503 -2.059 860 3HD1 LEU 110 1HD1 LEU 110 -5.076 0.507 -0.548 861 1HD2 LEU 110 1HD2 LEU 110 -5.357 3.905 -2.190 862 2HD2 LEU 110 3HD2 LEU 110 -4.965 3.178 -0.634 863 3HD2 LEU 110 2HD2 LEU 110 -3.966 2.833 -2.043 864 H CYS 111 HN CYS 111 -6.379 0.294 -6.445 865 HA CYS 111 HA CYS 111 -8.593 1.910 -7.342 866 1HB CYS 111 HB2 CYS 111 -6.447 2.520 -8.140 867 2HB CYS 111 HB1 CYS 111 -6.112 0.872 -8.673 868 HG CYS 111 HG CYS 111 -8.654 2.675 -10.087 869 H ASP 112 HN ASP 112 -7.131 -1.186 -8.581 870 HA ASP 112 HA ASP 112 -9.667 -1.487 -10.024 871 1HB ASP 112 HB2 ASP 112 -7.823 -1.190 -11.493 872 2HB ASP 112 HB1 ASP 112 -6.917 -2.484 -10.733 873 HA PRO 113 HA PRO 113 -9.378 -5.942 -8.739 874 1HB PRO 113 HB2 PRO 113 -7.020 -7.172 -8.771 875 2HB PRO 113 HB1 PRO 113 -7.624 -6.352 -10.213 876 1HG PRO 113 HG2 PRO 113 -5.404 -5.599 -8.444 877 2HG PRO 113 HG1 PRO 113 -5.761 -5.050 -10.091 878 1HD PRO 113 HD2 PRO 113 -6.488 -3.825 -7.515 879 2HD PRO 113 HD1 PRO 113 -6.455 -3.095 -9.128 880 H ASN 114 HN ASN 114 -7.602 -7.773 -7.428 881 HA ASN 114 HA ASN 114 -6.890 -7.413 -4.849 882 1HB ASN 114 HB2 ASN 114 -9.232 -6.501 -4.539 883 2HB ASN 114 HB1 ASN 114 -9.840 -8.103 -4.937 884 1HD2 ASN 114 1HD2 ASN 114 -9.442 -9.810 -3.496 885 2HD2 ASN 114 2HD2 ASN 114 -9.025 -9.511 -1.841 886 HA PRO 115 HA PRO 115 -6.811 -11.515 -6.947 887 1HB PRO 115 HB2 PRO 115 -4.174 -11.973 -6.836 888 2HB PRO 115 HB1 PRO 115 -4.873 -10.837 -7.997 889 1HG PRO 115 HG2 PRO 115 -3.509 -10.285 -5.390 890 2HG PRO 115 HG1 PRO 115 -3.341 -9.443 -6.940 891 1HD PRO 115 HD2 PRO 115 -4.911 -8.556 -4.868 892 2HD PRO 115 HD1 PRO 115 -5.190 -8.148 -6.571 893 H ASP 116 HN ASP 116 -6.949 -10.896 -3.845 894 HA ASP 116 HA ASP 116 -5.867 -13.517 -3.043 895 1HB ASP 116 HB2 ASP 116 -5.923 -10.922 -1.539 896 2HB ASP 116 HB1 ASP 116 -5.789 -12.462 -0.697 897 H ASP 117 HN ASP 117 -7.919 -11.271 -1.292 898 HA ASP 117 HA ASP 117 -10.197 -11.280 -1.004 899 1HB ASP 117 HB2 ASP 117 -11.266 -12.657 -2.371 900 2HB ASP 117 HB1 ASP 117 -9.967 -13.834 -2.337 901 HA PRO 118 HA PRO 118 -10.491 -13.932 2.748 902 1HB PRO 118 HB2 PRO 118 -9.080 -16.132 3.240 903 2HB PRO 118 HB1 PRO 118 -10.346 -16.114 2.005 904 1HG PRO 118 HG2 PRO 118 -7.388 -16.031 1.696 905 2HG PRO 118 HG1 PRO 118 -8.602 -16.808 0.670 906 1HD PRO 118 HD2 PRO 118 -7.386 -14.309 0.225 907 2HD PRO 118 HD1 PRO 118 -8.807 -14.950 -0.617 908 H LEU 119 HN LEU 119 -8.264 -11.892 2.545 909 HA LEU 119 HA LEU 119 -6.481 -12.645 4.664 910 1HB LEU 119 HB2 LEU 119 -7.113 -9.961 3.464 911 2HB LEU 119 HB1 LEU 119 -5.968 -10.179 4.771 912 HG LEU 119 HG LEU 119 -5.744 -11.097 1.919 913 1HD1 LEU 119 1HD1 LEU 119 -4.992 -8.813 2.710 914 2HD1 LEU 119 3HD1 LEU 119 -3.755 -9.653 3.648 915 3HD1 LEU 119 2HD1 LEU 119 -3.784 -9.799 1.892 916 1HD2 LEU 119 1HD2 LEU 119 -4.088 -12.024 4.266 917 2HD2 LEU 119 3HD2 LEU 119 -5.117 -13.022 3.239 918 3HD2 LEU 119 2HD2 LEU 119 -3.671 -12.269 2.570 919 H VAL 120 HN VAL 120 -9.261 -10.358 4.534 920 HA VAL 120 HA VAL 120 -9.468 -10.750 7.449 921 HB VAL 120 HB VAL 120 -10.658 -8.471 5.889 922 1HG1 VAL 120 2HG1 VAL 120 -10.114 -8.937 8.828 923 2HG1 VAL 120 1HG1 VAL 120 -10.692 -7.415 8.154 924 3HG1 VAL 120 3HG1 VAL 120 -11.690 -8.864 8.042 925 1HG2 VAL 120 1HG2 VAL 120 -8.008 -8.559 7.342 926 2HG2 VAL 120 3HG2 VAL 120 -8.243 -8.396 5.601 927 3HG2 VAL 120 2HG2 VAL 120 -8.768 -7.109 6.684 928 HA PRO 121 HA PRO 121 -12.803 -13.423 6.857 929 1HB PRO 121 HB2 PRO 121 -14.024 -11.860 9.101 930 2HB PRO 121 HB1 PRO 121 -13.908 -13.611 8.882 931 1HG PRO 121 HG2 PRO 121 -12.226 -12.352 10.504 932 2HG PRO 121 HG1 PRO 121 -11.665 -13.672 9.461 933 1HD PRO 121 HD2 PRO 121 -11.207 -10.754 9.221 934 2HD PRO 121 HD1 PRO 121 -10.193 -12.110 8.695 935 H GLU 122 HN GLU 122 -14.138 -10.149 7.675 936 HA GLU 122 HA GLU 122 -16.279 -10.764 5.808 937 1HB GLU 122 HB2 GLU 122 -16.411 -8.153 7.104 938 2HB GLU 122 HB1 GLU 122 -17.649 -9.375 6.878 939 1HG GLU 122 HG2 GLU 122 -16.507 -10.725 8.676 940 2HG GLU 122 HG1 GLU 122 -15.576 -9.268 9.037 941 H ILE 123 HN ILE 123 -13.453 -8.825 5.895 942 HA ILE 123 HA ILE 123 -14.532 -6.816 4.174 943 HB ILE 123 HB ILE 123 -11.621 -7.382 4.673 944 1HG1 ILE 123 2HG1 ILE 123 -13.456 -5.494 6.151 945 2HG1 ILE 123 1HG1 ILE 123 -12.940 -7.065 6.768 946 1HG2 ILE 123 2HG2 ILE 123 -12.171 -5.886 2.767 947 2HG2 ILE 123 1HG2 ILE 123 -13.042 -4.842 3.894 948 3HG2 ILE 123 3HG2 ILE 123 -11.300 -5.063 4.064 949 1HD1 ILE 123 1HD1 ILE 123 -10.617 -6.303 6.555 950 2HD1 ILE 123 3HD1 ILE 123 -11.219 -4.695 6.152 951 3HD1 ILE 123 2HD1 ILE 123 -11.573 -5.402 7.732 952 H ALA 124 HN ALA 124 -12.702 -9.747 3.890 953 HA ALA 124 HA ALA 124 -12.409 -10.145 1.216 954 1HB ALA 124 HB2 ALA 124 -13.880 -12.046 3.042 955 2HB ALA 124 HB1 ALA 124 -13.041 -12.457 1.548 956 3HB ALA 124 HB3 ALA 124 -12.125 -11.896 2.946 957 H ARG 125 HN ARG 125 -15.473 -10.486 2.973 958 HA ARG 125 HA ARG 125 -16.970 -11.111 0.650 959 1HB ARG 125 HB2 ARG 125 -18.527 -11.757 2.101 960 2HB ARG 125 HB1 ARG 125 -17.305 -11.462 3.325 961 1HG ARG 125 HG2 ARG 125 -18.904 -10.230 4.235 962 2HG ARG 125 HG1 ARG 125 -18.350 -9.000 3.121 963 1HD ARG 125 HD2 ARG 125 -20.769 -9.159 3.053 964 2HD ARG 125 HD1 ARG 125 -20.080 -9.698 1.523 965 HE ARG 125 HE ARG 125 -20.367 -11.961 3.087 966 1HH1 ARG 125 1HH1 ARG 125 -22.511 -9.495 1.830 967 2HH1 ARG 125 2HH1 ARG 125 -23.838 -10.600 1.597 968 1HH2 ARG 125 1HH2 ARG 125 -22.104 -13.398 2.813 969 2HH2 ARG 125 2HH2 ARG 125 -23.606 -12.819 2.166 970 H ILE 126 HN ILE 126 -16.562 -8.232 2.609 971 HA ILE 126 HA ILE 126 -18.708 -6.824 1.519 972 HB ILE 126 HB ILE 126 -17.701 -4.807 2.454 973 1HG1 ILE 126 2HG1 ILE 126 -15.583 -5.367 3.920 974 2HG1 ILE 126 1HG1 ILE 126 -15.298 -6.557 2.646 975 1HG2 ILE 126 1HG2 ILE 126 -19.012 -6.251 3.881 976 2HG2 ILE 126 3HG2 ILE 126 -17.576 -7.203 4.265 977 3HG2 ILE 126 2HG2 ILE 126 -17.689 -5.523 4.794 978 1HD1 ILE 126 1HD1 ILE 126 -15.615 -3.584 2.244 979 2HD1 ILE 126 3HD1 ILE 126 -14.099 -4.484 2.215 980 3HD1 ILE 126 2HD1 ILE 126 -15.322 -4.776 0.981 981 H TYR 127 HN TYR 127 -15.526 -7.297 0.291 982 HA TYR 127 HA TYR 127 -15.693 -5.126 -1.599 983 1HB TYR 127 HB2 TYR 127 -13.466 -5.604 -0.929 984 2HB TYR 127 HB1 TYR 127 -13.717 -7.334 -1.108 985 HD1 TYR 127 HD1 TYR 127 -12.900 -8.402 -3.000 986 HD2 TYR 127 HD2 TYR 127 -13.669 -4.223 -3.170 987 HE1 TYR 127 HE1 TYR 127 -11.965 -8.324 -5.274 988 HE2 TYR 127 HE2 TYR 127 -12.732 -4.135 -5.438 989 HH TYR 127 HH TYR 127 -11.260 -5.369 -6.867 990 H LYS 128 HN LYS 128 -15.729 -8.612 -1.690 991 HA LYS 128 HA LYS 128 -16.187 -8.615 -4.544 992 1HB LYS 128 HB2 LYS 128 -15.696 -10.999 -4.354 993 2HB LYS 128 HB1 LYS 128 -14.471 -10.054 -3.507 994 1HG LYS 128 HG2 LYS 128 -16.002 -10.480 -1.431 995 2HG LYS 128 HG1 LYS 128 -16.596 -11.827 -2.397 996 1HD LYS 128 HD2 LYS 128 -13.674 -11.354 -1.833 997 2HD LYS 128 HD1 LYS 128 -14.702 -12.356 -0.810 998 1HE LYS 128 HE2 LYS 128 -14.376 -12.826 -3.771 999 2HE LYS 128 HE1 LYS 128 -13.333 -13.577 -2.562 1000 1HZ LYS 128 HZ3 LYS 128 -15.352 -14.520 -1.544 1001 2HZ LYS 128 HZ2 LYS 128 -16.274 -13.901 -2.816 1002 3HZ LYS 128 HZ1 LYS 128 -15.095 -15.072 -3.119 1003 H THR 129 HN THR 129 -18.243 -7.919 -2.305 1004 HA THR 129 HA THR 129 -20.403 -9.496 -3.361 1005 HB THR 129 HB THR 129 -19.689 -9.641 -0.450 1006 HG1 THR 129 HG1 THR 129 -19.074 -11.205 -2.585 1007 1HG2 THR 129 1HG2 THR 129 -22.014 -10.844 -1.958 1008 2HG2 THR 129 3HG2 THR 129 -21.610 -11.168 -0.271 1009 3HG2 THR 129 2HG2 THR 129 -22.100 -9.548 -0.766 1010 H ASP 130 HN ASP 130 -19.989 -7.630 -0.340 1011 HA ASP 130 HA ASP 130 -22.572 -6.533 -0.634 1012 1HB ASP 130 HB2 ASP 130 -20.313 -6.124 1.249 1013 2HB ASP 130 HB1 ASP 130 -21.450 -4.786 1.084 1014 H ARG 131 HN ARG 131 -19.417 -4.987 -0.926 1015 HA ARG 131 HA ARG 131 -18.568 -3.819 -2.705 1016 1HB ARG 131 HB2 ARG 131 -20.462 -4.914 -4.075 1017 2HB ARG 131 HB1 ARG 131 -21.321 -3.399 -3.843 1018 1HG ARG 131 HG2 ARG 131 -20.267 -3.237 -5.938 1019 2HG ARG 131 HG1 ARG 131 -19.309 -2.247 -4.837 1020 1HD ARG 131 HD2 ARG 131 -17.815 -3.547 -6.197 1021 2HD ARG 131 HD1 ARG 131 -17.759 -4.169 -4.547 1022 HE ARG 131 HE ARG 131 -19.576 -5.786 -5.623 1023 1HH1 ARG 131 1HH1 ARG 131 -16.484 -4.738 -6.885 1024 2HH1 ARG 131 2HH1 ARG 131 -16.233 -6.179 -7.810 1025 1HH2 ARG 131 1HH2 ARG 131 -19.239 -7.690 -6.823 1026 2HH2 ARG 131 2HH2 ARG 131 -17.802 -7.862 -7.775 1027 H GLU 132 HN GLU 132 -21.726 -2.672 -1.547 1028 HA GLU 132 HA GLU 132 -21.068 0.079 -1.432 1029 1HB GLU 132 HB2 GLU 132 -22.868 0.145 0.341 1030 2HB GLU 132 HB1 GLU 132 -23.365 -0.478 -1.223 1031 1HG GLU 132 HG2 GLU 132 -23.356 -2.717 -0.415 1032 2HG GLU 132 HG1 GLU 132 -22.553 -2.234 1.077 1033 H LYS 133 HN LYS 133 -20.827 -2.554 0.846 1034 HA LYS 133 HA LYS 133 -19.852 -1.212 3.101 1035 1HB LYS 133 HB2 LYS 133 -19.339 -4.011 2.071 1036 2HB LYS 133 HB1 LYS 133 -18.839 -3.439 3.668 1037 1HG LYS 133 HG2 LYS 133 -21.641 -3.755 2.621 1038 2HG LYS 133 HG1 LYS 133 -20.860 -4.713 3.872 1039 1HD LYS 133 HD2 LYS 133 -20.744 -2.675 5.280 1040 2HD LYS 133 HD1 LYS 133 -21.639 -1.802 4.032 1041 1HE LYS 133 HE2 LYS 133 -22.579 -4.154 5.671 1042 2HE LYS 133 HE1 LYS 133 -23.208 -2.509 5.695 1043 1HZ LYS 133 HZ1 LYS 133 -23.981 -2.822 3.405 1044 2HZ LYS 133 HZ3 LYS 133 -23.399 -4.420 3.418 1045 3HZ LYS 133 HZ2 LYS 133 -24.661 -3.968 4.450 1046 H TYR 134 HN TYR 134 -18.453 -2.092 0.138 1047 HA TYR 134 HA TYR 134 -15.719 -1.753 1.002 1048 1HB TYR 134 HB2 TYR 134 -16.135 -3.544 -0.503 1049 2HB TYR 134 HB1 TYR 134 -17.068 -2.524 -1.583 1050 HD1 TYR 134 HD1 TYR 134 -16.054 -1.589 -3.421 1051 HD2 TYR 134 HD2 TYR 134 -13.632 -2.976 -0.221 1052 HE1 TYR 134 HE1 TYR 134 -14.057 -1.168 -4.758 1053 HE2 TYR 134 HE2 TYR 134 -11.609 -2.562 -1.560 1054 HH TYR 134 HH TYR 134 -11.019 -2.382 -3.984 1055 H ASN 135 HN ASN 135 -17.734 -0.356 -1.582 1056 HA ASN 135 HA ASN 135 -15.990 1.698 -2.234 1057 1HB ASN 135 HB2 ASN 135 -18.909 1.245 -2.701 1058 2HB ASN 135 HB1 ASN 135 -18.145 2.734 -3.222 1059 1HD2 ASN 135 1HD2 ASN 135 -18.485 -0.645 -3.773 1060 2HD2 ASN 135 2HD2 ASN 135 -17.599 -0.708 -5.259 1061 H ARG 136 HN ARG 136 -19.085 2.068 -0.500 1062 HA ARG 136 HA ARG 136 -18.769 4.858 -0.268 1063 1HB ARG 136 HB2 ARG 136 -20.974 3.939 -0.191 1064 2HB ARG 136 HB1 ARG 136 -20.578 2.946 1.203 1065 1HG ARG 136 HG2 ARG 136 -20.395 4.887 2.605 1066 2HG ARG 136 HG1 ARG 136 -20.616 5.955 1.220 1067 1HD ARG 136 HD2 ARG 136 -22.674 3.948 2.100 1068 2HD ARG 136 HD1 ARG 136 -22.649 5.616 2.664 1069 HE ARG 136 HE ARG 136 -22.611 5.433 -0.189 1070 1HH1 ARG 136 1HH1 ARG 136 -24.697 5.333 2.620 1071 2HH1 ARG 136 2HH1 ARG 136 -26.115 5.808 1.742 1072 1HH2 ARG 136 1HH2 ARG 136 -24.475 6.056 -1.349 1073 2HH2 ARG 136 2HH2 ARG 136 -25.986 6.235 -0.519 1074 H ILE 137 HN ILE 137 -17.406 2.335 1.561 1075 HA ILE 137 HA ILE 137 -17.397 3.835 4.050 1076 HB ILE 137 HB ILE 137 -16.303 1.068 3.506 1077 1HG1 ILE 137 2HG1 ILE 137 -18.655 0.959 3.076 1078 2HG1 ILE 137 1HG1 ILE 137 -18.408 0.325 4.698 1079 1HG2 ILE 137 3HG2 ILE 137 -16.970 2.532 6.066 1080 2HG2 ILE 137 2HG2 ILE 137 -16.480 0.843 5.963 1081 3HG2 ILE 137 1HG2 ILE 137 -15.359 2.115 5.482 1082 1HD1 ILE 137 2HD1 ILE 137 -19.109 2.494 5.625 1083 2HD1 ILE 137 1HD1 ILE 137 -19.418 3.067 3.985 1084 3HD1 ILE 137 3HD1 ILE 137 -20.360 1.731 4.645 1085 H ALA 138 HN ALA 138 -15.058 2.167 1.941 1086 HA ALA 138 HA ALA 138 -12.830 3.471 3.094 1087 1HB ALA 138 HB2 ALA 138 -11.567 2.452 1.333 1088 2HB ALA 138 HB1 ALA 138 -12.754 1.303 1.953 1089 3HB ALA 138 HB3 ALA 138 -13.041 2.123 0.418 1090 H ARG 139 HN ARG 139 -15.060 4.311 0.539 1091 HA ARG 139 HA ARG 139 -13.346 6.385 -0.531 1092 1HB ARG 139 HB2 ARG 139 -14.930 5.229 -2.003 1093 2HB ARG 139 HB1 ARG 139 -16.280 5.825 -1.048 1094 1HG ARG 139 HG2 ARG 139 -15.644 8.134 -1.642 1095 2HG ARG 139 HG1 ARG 139 -14.357 7.488 -2.660 1096 1HD ARG 139 HD2 ARG 139 -15.993 6.332 -4.034 1097 2HD ARG 139 HD1 ARG 139 -17.297 6.909 -2.997 1098 HE ARG 139 HE ARG 139 -15.933 9.149 -3.903 1099 1HH1 ARG 139 1HH1 ARG 139 -17.749 6.508 -5.298 1100 2HH1 ARG 139 2HH1 ARG 139 -18.366 7.447 -6.619 1101 1HH2 ARG 139 1HH2 ARG 139 -16.759 10.410 -5.633 1102 2HH2 ARG 139 2HH2 ARG 139 -17.805 9.671 -6.803 1103 H GLU 140 HN GLU 140 -15.833 6.191 2.005 1104 HA GLU 140 HA GLU 140 -16.177 9.028 2.140 1105 1HB GLU 140 HB2 GLU 140 -16.929 8.740 4.442 1106 2HB GLU 140 HB1 GLU 140 -17.772 7.665 3.364 1107 1HG GLU 140 HG2 GLU 140 -16.498 5.799 4.158 1108 2HG GLU 140 HG1 GLU 140 -15.469 6.869 5.108 1109 H TRP 141 HN TRP 141 -14.109 6.718 3.830 1110 HA TRP 141 HA TRP 141 -12.520 8.507 5.224 1111 1HB TRP 141 HB2 TRP 141 -11.686 5.931 3.884 1112 2HB TRP 141 HB1 TRP 141 -10.778 6.774 5.138 1113 HD1 TRP 141 HD1 TRP 141 -13.457 7.485 6.907 1114 HE1 TRP 141 HE1 TRP 141 -14.469 5.590 8.317 1115 HE3 TRP 141 HE3 TRP 141 -11.437 3.503 4.457 1116 HZ2 TRP 141 HZ2 TRP 141 -14.404 2.771 8.371 1117 HZ3 TRP 141 HZ3 TRP 141 -11.947 1.245 5.262 1118 HH2 TRP 141 HH2 TRP 141 -13.394 0.897 7.185 1119 H THR 142 HN THR 142 -12.401 7.502 1.865 1120 HA THR 142 HA THR 142 -10.190 8.896 0.952 1121 HB THR 142 HB THR 142 -12.917 8.567 -0.284 1122 HG1 THR 142 HG1 THR 142 -11.410 6.728 0.305 1123 1HG2 THR 142 3HG2 THR 142 -10.340 9.433 -1.577 1124 2HG2 THR 142 2HG2 THR 142 -11.781 8.931 -2.453 1125 3HG2 THR 142 1HG2 THR 142 -11.819 10.373 -1.437 1126 H GLN 143 HN GLN 143 -13.488 10.067 1.230 1127 HA GLN 143 HA GLN 143 -12.935 12.750 0.512 1128 1HB GLN 143 HB2 GLN 143 -15.169 11.295 1.829 1129 2HB GLN 143 HB1 GLN 143 -15.283 13.011 1.468 1130 1HG GLN 143 HG2 GLN 143 -14.814 12.413 -0.916 1131 2HG GLN 143 HG1 GLN 143 -14.932 10.723 -0.444 1132 1HE2 GLN 143 1HE2 GLN 143 -16.949 9.888 0.159 1133 2HE2 GLN 143 2HE2 GLN 143 -18.427 10.691 -0.248 1134 H LYS 144 HN LYS 144 -12.645 11.027 3.412 1135 HA LYS 144 HA LYS 144 -13.202 13.314 5.152 1136 1HB LYS 144 HB2 LYS 144 -13.108 10.367 5.344 1137 2HB LYS 144 HB1 LYS 144 -12.768 11.274 6.818 1138 1HG LYS 144 HG2 LYS 144 -14.939 12.146 6.857 1139 2HG LYS 144 HG1 LYS 144 -15.221 11.709 5.163 1140 1HD LYS 144 HD2 LYS 144 -14.983 9.350 5.740 1141 2HD LYS 144 HD1 LYS 144 -14.795 9.791 7.441 1142 1HE LYS 144 HE2 LYS 144 -17.182 10.507 5.785 1143 2HE LYS 144 HE1 LYS 144 -17.070 9.028 6.736 1144 1HZ LYS 144 HZ2 LYS 144 -16.891 11.789 7.820 1145 2HZ LYS 144 HZ1 LYS 144 -18.234 10.772 7.944 1146 3HZ LYS 144 HZ3 LYS 144 -16.794 10.366 8.726 1147 H TYR 145 HN TYR 145 -10.709 10.768 4.787 1148 HA TYR 145 HA TYR 145 -8.840 12.541 6.196 1149 1HB TYR 145 HB2 TYR 145 -8.676 9.522 6.082 1150 2HB TYR 145 HB1 TYR 145 -7.782 10.617 7.122 1151 HD1 TYR 145 HD1 TYR 145 -8.818 11.594 9.114 1152 HD2 TYR 145 HD2 TYR 145 -10.975 8.917 6.603 1153 HE1 TYR 145 HE1 TYR 145 -10.522 11.327 10.866 1154 HE2 TYR 145 HE2 TYR 145 -12.694 8.655 8.347 1155 HH TYR 145 HH TYR 145 -12.943 10.693 11.003 1156 H ALA 146 HN ALA 146 -9.490 10.704 3.377 1157 HA ALA 146 HA ALA 146 -6.650 10.803 2.725 1158 1HB ALA 146 HB3 ALA 146 -8.788 8.818 2.021 1159 2HB ALA 146 HB2 ALA 146 -7.244 8.871 1.172 1160 3HB ALA 146 HB1 ALA 146 -7.290 8.547 2.907 1161 H MET 147 HN MET 147 -7.805 13.078 2.150 1162 HA MET 147 HA MET 147 -7.766 13.035 -0.783 1163 1HB MET 147 HB2 MET 147 -10.029 13.869 0.903 1164 2HB MET 147 HB1 MET 147 -9.550 15.075 -0.279 1165 1HG MET 147 HG2 MET 147 -10.173 12.213 -0.944 1166 2HG MET 147 HG1 MET 147 -11.338 13.529 -1.039 1167 1HE MET 147 HE2 MET 147 -9.340 15.877 -2.042 1168 2HE MET 147 HE1 MET 147 -9.635 15.808 -3.777 1169 3HE MET 147 HE3 MET 147 -10.982 15.664 -2.647 No H/Q in entry = 1169
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