NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
494652 | 2l69 | 17304 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1H MET 1 2.369 10.676 11.164 2 H2 MET 1 2H MET 1 2.044 10.423 9.526 3 H3 MET 1 3H MET 1 3.589 10.118 10.135 4 HA MET 1 HA MET 1 2.741 8.332 11.510 5 HB2 MET 1 2HB MET 1 0.476 9.243 11.810 6 HB3 MET 1 3HB MET 1 0.117 8.942 10.116 7 HG2 MET 1 2HG MET 1 -0.830 7.268 11.715 8 HG3 MET 1 3HG MET 1 0.174 6.585 10.434 9 HE1 MET 1 3HE MET 1 -0.668 5.066 13.167 10 HE2 MET 1 1HE MET 1 0.850 4.258 13.554 11 HE3 MET 1 2HE MET 1 0.280 4.312 11.886 12 H ASN 2 H ASN 2 2.390 6.110 10.649 13 HA ASN 2 HA ASN 2 3.902 5.728 8.285 14 HB2 ASN 2 2HB ASN 2 3.906 4.171 10.209 15 HB3 ASN 2 3HB ASN 2 2.252 3.708 9.825 16 HD21 ASN 2 1HD2 ASN 2 2.770 1.566 9.462 17 HD22 ASN 2 2HD2 ASN 2 3.682 1.047 8.094 18 H ILE 3 H ILE 3 3.292 4.446 6.397 19 HA ILE 3 HA ILE 3 0.463 4.487 5.635 20 HB ILE 3 HB ILE 3 1.296 6.621 4.838 21 HG12 ILE 3 2HG1 ILE 3 1.055 4.682 2.517 22 HG13 ILE 3 3HG1 ILE 3 -0.301 5.372 3.403 23 HG21 ILE 3 1HG2 ILE 3 3.427 5.068 3.362 24 HG22 ILE 3 2HG2 ILE 3 3.679 6.096 4.773 25 HG23 ILE 3 3HG2 ILE 3 3.145 6.807 3.250 26 HD11 ILE 3 3HD1 ILE 3 0.356 7.608 2.662 27 HD12 ILE 3 1HD1 ILE 3 0.044 6.529 1.303 28 HD13 ILE 3 2HD1 ILE 3 1.703 6.911 1.761 29 H VAL 4 H VAL 4 -0.130 2.884 4.193 30 HA VAL 4 HA VAL 4 1.987 0.991 3.347 31 HB VAL 4 HB VAL 4 -0.894 0.345 4.046 32 HG11 VAL 4 1HG1 VAL 4 -0.000 -1.149 2.338 33 HG12 VAL 4 2HG1 VAL 4 -0.200 -2.002 3.869 34 HG13 VAL 4 3HG1 VAL 4 1.406 -1.489 3.349 35 HG21 VAL 4 3HG2 VAL 4 0.026 -0.784 6.027 36 HG22 VAL 4 1HG2 VAL 4 0.387 0.942 6.040 37 HG23 VAL 4 2HG2 VAL 4 1.641 -0.218 5.597 38 H ILE 5 H ILE 5 1.873 0.118 1.254 39 HA ILE 5 HA ILE 5 -0.221 1.232 -0.522 40 HB ILE 5 HB ILE 5 2.697 0.827 -1.233 41 HG12 ILE 5 2HG1 ILE 5 1.109 3.391 -0.873 42 HG13 ILE 5 3HG1 ILE 5 2.306 2.771 0.259 43 HG21 ILE 5 1HG2 ILE 5 1.219 0.407 -3.135 44 HG22 ILE 5 2HG2 ILE 5 2.120 1.904 -3.364 45 HG23 ILE 5 3HG2 ILE 5 0.425 1.963 -2.878 46 HD11 ILE 5 3HD1 ILE 5 3.230 4.547 -1.094 47 HD12 ILE 5 1HD1 ILE 5 2.827 3.665 -2.566 48 HD13 ILE 5 2HD1 ILE 5 4.036 3.020 -1.455 49 H VAL 6 H VAL 6 -1.414 -0.312 -1.474 50 HA VAL 6 HA VAL 6 -0.284 -3.017 -1.816 51 HB VAL 6 HB VAL 6 -3.196 -2.171 -1.828 52 HG11 VAL 6 1HG1 VAL 6 -2.816 -4.146 -3.206 53 HG12 VAL 6 2HG1 VAL 6 -3.677 -4.583 -1.730 54 HG13 VAL 6 3HG1 VAL 6 -1.953 -4.927 -1.881 55 HG21 VAL 6 3HG2 VAL 6 -1.604 -3.597 0.313 56 HG22 VAL 6 1HG2 VAL 6 -3.340 -3.284 0.354 57 HG23 VAL 6 2HG2 VAL 6 -2.200 -1.938 0.394 58 H VAL 7 H VAL 7 0.347 -3.545 -3.823 59 HA VAL 7 HA VAL 7 -0.864 -2.120 -6.117 60 HB VAL 7 HB VAL 7 1.896 -3.354 -5.921 61 HG11 VAL 7 1HG1 VAL 7 1.030 -3.429 -8.195 62 HG12 VAL 7 2HG1 VAL 7 2.321 -2.235 -8.067 63 HG13 VAL 7 3HG1 VAL 7 0.637 -1.710 -8.123 64 HG21 VAL 7 3HG2 VAL 7 1.055 -0.448 -5.892 65 HG22 VAL 7 1HG2 VAL 7 2.718 -1.038 -5.942 66 HG23 VAL 7 2HG2 VAL 7 1.711 -1.358 -4.531 67 H PHE 8 H PHE 8 -2.235 -3.370 -7.263 68 HA PHE 8 HA PHE 8 -2.106 -6.252 -7.212 69 HB2 PHE 8 2HB PHE 8 -3.881 -4.276 -8.640 70 HB3 PHE 8 3HB PHE 8 -3.973 -6.000 -8.981 71 HD1 PHE 8 HD2 PHE 8 -4.154 -3.576 -6.142 72 HD2 PHE 8 HD1 PHE 8 -5.360 -7.353 -7.708 73 HE1 PHE 8 HE2 PHE 8 -5.679 -3.884 -4.235 74 HE2 PHE 8 HE1 PHE 8 -6.886 -7.656 -5.805 75 HZ PHE 8 HZ PHE 8 -7.045 -5.921 -4.065 76 H SER 9 H SER 9 -0.499 -3.937 -9.032 77 HA SER 9 HA SER 9 -0.355 -5.378 -11.520 78 HB2 SER 9 2HB SER 9 1.296 -3.053 -10.492 79 HB3 SER 9 3HB SER 9 1.374 -3.697 -12.132 80 HG SER 9 HG SER 9 -0.724 -3.048 -12.476 81 H THR 10 H THR 10 0.625 -7.314 -11.499 82 HA THR 10 HA THR 10 2.918 -7.933 -9.889 83 HB THR 10 HB THR 10 3.005 -10.050 -11.156 84 HG1 THR 10 HG1 THR 10 0.710 -9.789 -12.567 85 HG21 THR 10 3HG2 THR 10 0.227 -9.233 -10.280 86 HG22 THR 10 1HG2 THR 10 1.490 -9.925 -9.261 87 HG23 THR 10 2HG2 THR 10 0.757 -10.895 -10.540 88 H ASP 11 H ASP 11 2.523 -6.275 -12.803 89 HA ASP 11 HA ASP 11 5.044 -6.932 -14.011 90 HB2 ASP 11 2HB ASP 11 3.165 -4.615 -14.546 91 HB3 ASP 11 3HB ASP 11 4.518 -5.098 -15.567 92 H GLU 12 H GLU 12 6.981 -6.115 -13.555 93 HA GLU 12 HA GLU 12 7.437 -4.589 -11.249 94 HB2 GLU 12 2HB GLU 12 8.973 -6.259 -12.406 95 HB3 GLU 12 3HB GLU 12 9.403 -4.969 -13.515 96 HG2 GLU 12 2HG GLU 12 9.750 -4.729 -10.534 97 HG3 GLU 12 3HG GLU 12 10.982 -5.420 -11.583 98 H GLU 13 H GLU 13 7.338 -3.600 -14.654 99 HA GLU 13 HA GLU 13 8.554 -1.122 -14.527 100 HB2 GLU 13 2HB GLU 13 6.176 -1.912 -16.221 101 HB3 GLU 13 3HB GLU 13 7.193 -0.504 -16.500 102 HG2 GLU 13 2HG GLU 13 9.131 -2.004 -16.805 103 HG3 GLU 13 3HG GLU 13 8.057 -3.387 -16.614 104 H THR 14 H THR 14 5.106 -1.824 -13.914 105 HA THR 14 HA THR 14 4.326 0.842 -13.370 106 HB THR 14 HB THR 14 3.114 -1.722 -12.289 107 HG1 THR 14 HG1 THR 14 1.571 -1.183 -14.069 108 HG21 THR 14 3HG2 THR 14 1.078 -0.402 -11.954 109 HG22 THR 14 1HG2 THR 14 1.919 1.052 -12.493 110 HG23 THR 14 2HG2 THR 14 2.409 0.252 -11.000 111 H LEU 15 H LEU 15 5.322 -1.785 -11.181 112 HA LEU 15 HA LEU 15 5.105 -0.366 -8.760 113 HB2 LEU 15 2HB LEU 15 5.326 -2.809 -8.889 114 HB3 LEU 15 3HB LEU 15 6.967 -2.637 -9.484 115 HG LEU 15 HG LEU 15 7.613 -1.595 -7.317 116 HD11 LEU 15 1HD1 LEU 15 4.793 -2.309 -6.508 117 HD12 LEU 15 2HD1 LEU 15 5.471 -0.685 -6.644 118 HD13 LEU 15 3HD1 LEU 15 6.070 -1.790 -5.408 119 HD21 LEU 15 3HD2 LEU 15 7.944 -3.992 -7.711 120 HD22 LEU 15 1HD2 LEU 15 6.334 -4.321 -7.067 121 HD23 LEU 15 2HD2 LEU 15 7.587 -3.658 -6.017 122 H ARG 16 H ARG 16 7.646 -0.480 -11.164 123 HA ARG 16 HA ARG 16 9.787 0.586 -9.744 124 HB2 ARG 16 2HB ARG 16 9.980 -0.366 -11.994 125 HB3 ARG 16 3HB ARG 16 9.082 0.993 -12.657 126 HG2 ARG 16 2HG ARG 16 10.855 2.517 -12.102 127 HG3 ARG 16 3HG ARG 16 11.726 1.252 -11.231 128 HD2 ARG 16 2HD ARG 16 11.128 1.272 -14.193 129 HD3 ARG 16 3HD ARG 16 12.685 1.641 -13.451 130 HE ARG 16 HE ARG 16 11.414 -1.001 -13.135 131 HH11 ARG 16 1HH1 ARG 16 14.127 0.952 -13.967 132 HH12 ARG 16 2HH1 ARG 16 15.162 -0.412 -14.215 133 HH21 ARG 16 1HH2 ARG 16 12.735 -2.726 -13.456 134 HH22 ARG 16 2HH2 ARG 16 14.379 -2.479 -13.940 135 H LYS 17 H LYS 17 7.252 2.319 -11.565 136 HA LYS 17 HA LYS 17 8.125 4.932 -11.091 137 HB2 LYS 17 2HB LYS 17 5.399 3.749 -11.567 138 HB3 LYS 17 3HB LYS 17 5.569 5.460 -11.211 139 HG2 LYS 17 2HG LYS 17 5.446 5.172 -13.583 140 HG3 LYS 17 3HG LYS 17 7.080 5.681 -13.161 141 HD2 LYS 17 2HD LYS 17 7.858 3.364 -13.353 142 HD3 LYS 17 3HD LYS 17 6.219 2.839 -13.749 143 HE2 LYS 17 2HE LYS 17 6.277 4.295 -15.750 144 HE3 LYS 17 3HE LYS 17 7.945 4.719 -15.367 145 HZ1 LYS 17 3HZ LYS 17 7.820 2.974 -17.031 146 HZ2 LYS 17 1HZ LYS 17 6.953 1.986 -15.968 147 HZ3 LYS 17 2HZ LYS 17 8.559 2.398 -15.624 148 H PHE 18 H PHE 18 5.996 2.871 -9.132 149 HA PHE 18 HA PHE 18 5.355 4.721 -7.131 150 HB2 PHE 18 2HB PHE 18 5.551 1.704 -7.094 151 HB3 PHE 18 3HB PHE 18 5.016 2.626 -5.694 152 HD1 PHE 18 HD2 PHE 18 4.256 3.058 -9.334 153 HD2 PHE 18 HD1 PHE 18 2.759 2.204 -5.436 154 HE1 PHE 18 HE2 PHE 18 1.962 3.083 -10.213 155 HE2 PHE 18 HE1 PHE 18 0.463 2.231 -6.313 156 HZ PHE 18 HZ PHE 18 0.061 2.670 -8.704 157 H LYS 19 H LYS 19 7.966 2.288 -7.179 158 HA LYS 19 HA LYS 19 9.111 2.933 -4.696 159 HB2 LYS 19 2HB LYS 19 10.446 1.787 -7.162 160 HB3 LYS 19 3HB LYS 19 11.133 1.774 -5.543 161 HG2 LYS 19 2HG LYS 19 9.340 0.339 -4.754 162 HG3 LYS 19 3HG LYS 19 8.558 0.406 -6.334 163 HD2 LYS 19 2HD LYS 19 11.306 -0.743 -5.790 164 HD3 LYS 19 3HD LYS 19 9.830 -1.688 -5.998 165 HE2 LYS 19 2HE LYS 19 9.596 -0.864 -8.276 166 HE3 LYS 19 3HE LYS 19 11.014 0.164 -8.074 167 HZ1 LYS 19 3HZ LYS 19 11.034 -2.802 -7.937 168 HZ2 LYS 19 1HZ LYS 19 12.381 -1.785 -7.838 169 HZ3 LYS 19 2HZ LYS 19 11.503 -1.885 -9.281 170 H ASP 20 H ASP 20 9.697 4.284 -7.920 171 HA ASP 20 HA ASP 20 11.993 5.796 -7.251 172 HB2 ASP 20 2HB ASP 20 11.209 5.208 -9.580 173 HB3 ASP 20 3HB ASP 20 9.987 6.466 -9.415 174 H ILE 21 H ILE 21 8.552 6.709 -7.411 175 HA ILE 21 HA ILE 21 8.864 9.412 -6.674 176 HB ILE 21 HB ILE 21 6.461 7.636 -6.175 177 HG12 ILE 21 2HG1 ILE 21 7.007 9.417 -8.568 178 HG13 ILE 21 3HG1 ILE 21 7.328 7.687 -8.559 179 HG21 ILE 21 1HG2 ILE 21 6.331 9.736 -4.944 180 HG22 ILE 21 2HG2 ILE 21 5.180 9.747 -6.280 181 HG23 ILE 21 3HG2 ILE 21 6.692 10.645 -6.413 182 HD11 ILE 21 3HD1 ILE 21 4.634 8.970 -8.165 183 HD12 ILE 21 1HD1 ILE 21 4.966 7.238 -8.200 184 HD13 ILE 21 2HD1 ILE 21 5.217 8.215 -9.647 185 H ILE 22 H ILE 22 8.393 6.497 -4.704 186 HA ILE 22 HA ILE 22 8.085 7.743 -2.202 187 HB ILE 22 HB ILE 22 9.262 5.032 -2.857 188 HG12 ILE 22 2HG1 ILE 22 6.497 5.842 -1.897 189 HG13 ILE 22 3HG1 ILE 22 6.904 5.355 -3.538 190 HG21 ILE 22 1HG2 ILE 22 10.037 5.745 -0.660 191 HG22 ILE 22 2HG2 ILE 22 8.833 4.468 -0.491 192 HG23 ILE 22 3HG2 ILE 22 8.386 6.146 -0.183 193 HD11 ILE 22 3HD1 ILE 22 5.844 3.549 -2.322 194 HD12 ILE 22 1HD1 ILE 22 7.096 3.624 -1.083 195 HD13 ILE 22 2HD1 ILE 22 7.509 3.133 -2.727 196 H LYS 23 H LYS 23 11.089 6.263 -3.532 197 HA LYS 23 HA LYS 23 12.767 7.210 -1.481 198 HB2 LYS 23 2HB LYS 23 14.641 6.678 -2.982 199 HB3 LYS 23 3HB LYS 23 13.459 5.384 -2.907 200 HG2 LYS 23 2HG LYS 23 12.553 6.082 -5.073 201 HG3 LYS 23 3HG LYS 23 13.744 7.384 -5.145 202 HD2 LYS 23 2HD LYS 23 15.562 5.761 -5.149 203 HD3 LYS 23 3HD LYS 23 14.411 4.435 -4.979 204 HE2 LYS 23 2HE LYS 23 15.164 4.631 -7.286 205 HE3 LYS 23 3HE LYS 23 13.446 5.005 -7.166 206 HZ1 LYS 23 3HZ LYS 23 14.453 6.605 -8.576 207 HZ2 LYS 23 1HZ LYS 23 15.683 6.928 -7.462 208 HZ3 LYS 23 2HZ LYS 23 14.098 7.393 -7.122 209 H LYS 24 H LYS 24 11.653 8.745 -4.412 210 HA LYS 24 HA LYS 24 13.319 10.935 -4.653 211 HB2 LYS 24 2HB LYS 24 11.321 10.393 -6.100 212 HB3 LYS 24 3HB LYS 24 10.296 11.064 -4.842 213 HG2 LYS 24 2HG LYS 24 12.266 13.019 -5.417 214 HG3 LYS 24 3HG LYS 24 11.677 12.413 -6.962 215 HD2 LYS 24 2HD LYS 24 10.298 14.258 -6.406 216 HD3 LYS 24 3HD LYS 24 9.330 12.820 -6.083 217 HE2 LYS 24 2HE LYS 24 9.812 13.000 -3.702 218 HE3 LYS 24 3HE LYS 24 10.870 14.378 -4.000 219 HZ1 LYS 24 3HZ LYS 24 8.774 15.176 -3.240 220 HZ2 LYS 24 1HZ LYS 24 7.929 14.268 -4.388 221 HZ3 LYS 24 2HZ LYS 24 8.895 15.566 -4.878 222 H ASN 25 H ASN 25 10.687 10.431 -2.346 223 HA ASN 25 HA ASN 25 11.000 13.058 -1.158 224 HB2 ASN 25 2HB ASN 25 9.230 10.702 -0.483 225 HB3 ASN 25 3HB ASN 25 9.254 12.183 0.468 226 HD21 ASN 25 1HD2 ASN 25 8.330 10.741 -2.555 227 HD22 ASN 25 2HD2 ASN 25 7.345 12.057 -3.091 228 H GLY 26 H GLY 26 12.656 10.172 -0.837 229 HA2 GLY 26 2HA GLY 26 14.596 10.004 0.511 230 HA3 GLY 26 3HA GLY 26 13.893 11.147 1.639 231 H PHE 27 H PHE 27 11.703 8.690 0.755 232 HA PHE 27 HA PHE 27 11.971 7.477 3.402 233 HB2 PHE 27 2HB PHE 27 9.842 7.210 1.266 234 HB3 PHE 27 3HB PHE 27 9.806 6.344 2.798 235 HD1 PHE 27 HD2 PHE 27 9.533 9.649 1.202 236 HD2 PHE 27 HD1 PHE 27 9.210 7.457 4.843 237 HE1 PHE 27 HE2 PHE 27 8.407 11.565 2.258 238 HE2 PHE 27 HE1 PHE 27 8.087 9.373 5.899 239 HZ PHE 27 HZ PHE 27 7.687 11.427 4.607 240 H LYS 28 H LYS 28 12.134 5.238 3.767 241 HA LYS 28 HA LYS 28 13.514 3.726 1.697 242 HB2 LYS 28 2HB LYS 28 12.782 2.917 4.525 243 HB3 LYS 28 3HB LYS 28 13.889 2.067 3.454 244 HG2 LYS 28 2HG LYS 28 15.354 4.071 3.448 245 HG3 LYS 28 3HG LYS 28 14.272 4.822 4.618 246 HD2 LYS 28 2HD LYS 28 16.054 3.933 5.884 247 HD3 LYS 28 3HD LYS 28 14.712 2.813 6.113 248 HE2 LYS 28 2HE LYS 28 16.934 2.408 4.106 249 HE3 LYS 28 3HE LYS 28 16.938 1.727 5.730 250 HZ1 LYS 28 3HZ LYS 28 14.988 1.142 3.571 251 HZ2 LYS 28 1HZ LYS 28 14.859 0.570 5.159 252 HZ3 LYS 28 2HZ LYS 28 16.157 0.096 4.189 253 H VAL 29 H VAL 29 12.812 1.429 1.240 254 HA VAL 29 HA VAL 29 9.855 1.238 1.174 255 HB VAL 29 HB VAL 29 11.692 0.514 -1.126 256 HG11 VAL 29 1HG1 VAL 29 9.670 -0.843 -1.071 257 HG12 VAL 29 2HG1 VAL 29 9.606 0.293 -2.419 258 HG13 VAL 29 3HG1 VAL 29 8.674 0.609 -0.955 259 HG21 VAL 29 3HG2 VAL 29 9.872 2.909 -0.828 260 HG22 VAL 29 1HG2 VAL 29 10.769 2.470 -2.282 261 HG23 VAL 29 2HG2 VAL 29 11.636 2.935 -0.818 262 H ARG 30 H ARG 30 8.948 -0.802 1.374 263 HA ARG 30 HA ARG 30 10.740 -3.139 1.192 264 HB2 ARG 30 2HB ARG 30 10.286 -2.638 3.613 265 HB3 ARG 30 3HB ARG 30 8.573 -2.874 3.296 266 HG2 ARG 30 2HG ARG 30 8.947 -5.183 2.682 267 HG3 ARG 30 3HG ARG 30 10.690 -4.975 2.831 268 HD2 ARG 30 2HD ARG 30 10.414 -4.535 5.239 269 HD3 ARG 30 3HD ARG 30 8.674 -4.787 5.074 270 HE ARG 30 HE ARG 30 9.471 -7.088 4.168 271 HH11 ARG 30 1HH1 ARG 30 10.888 -5.352 6.785 272 HH12 ARG 30 2HH1 ARG 30 11.432 -6.792 7.577 273 HH21 ARG 30 1HH2 ARG 30 10.226 -8.921 5.173 274 HH22 ARG 30 2HH2 ARG 30 11.076 -8.769 6.674 275 H THR 31 H THR 31 10.029 -4.217 -0.569 276 HA THR 31 HA THR 31 7.201 -4.197 -1.290 277 HB THR 31 HB THR 31 7.875 -5.427 -3.309 278 HG1 THR 31 HG1 THR 31 9.570 -6.689 -2.530 279 HG21 THR 31 3HG2 THR 31 9.325 -3.722 -4.319 280 HG22 THR 31 1HG2 THR 31 9.722 -3.101 -2.715 281 HG23 THR 31 2HG2 THR 31 8.072 -2.978 -3.326 282 H VAL 32 H VAL 32 5.924 -5.561 -0.163 283 HA VAL 32 HA VAL 32 6.904 -8.047 0.922 284 HB VAL 32 HB VAL 32 4.108 -6.883 0.862 285 HG11 VAL 32 1HG1 VAL 32 4.008 -9.310 1.096 286 HG12 VAL 32 2HG1 VAL 32 3.565 -8.522 2.609 287 HG13 VAL 32 3HG1 VAL 32 5.164 -9.244 2.428 288 HG21 VAL 32 3HG2 VAL 32 5.684 -5.528 2.138 289 HG22 VAL 32 1HG2 VAL 32 6.190 -6.950 3.054 290 HG23 VAL 32 2HG2 VAL 32 4.546 -6.331 3.220 291 H ARG 33 H ARG 33 6.739 -10.042 0.079 292 HA ARG 33 HA ARG 33 4.864 -10.493 -2.153 293 HB2 ARG 33 2HB ARG 33 6.438 -11.995 -3.218 294 HB3 ARG 33 3HB ARG 33 7.192 -10.428 -2.981 295 HG2 ARG 33 2HG ARG 33 7.631 -12.721 -1.079 296 HG3 ARG 33 3HG ARG 33 8.612 -12.488 -2.526 297 HD2 ARG 33 2HD ARG 33 8.278 -10.470 -0.297 298 HD3 ARG 33 3HD ARG 33 9.660 -11.547 -0.495 299 HE ARG 33 HE ARG 33 9.124 -9.889 -2.791 300 HH11 ARG 33 1HH1 ARG 33 10.762 -10.059 0.247 301 HH12 ARG 33 2HH1 ARG 33 11.941 -8.885 -0.217 302 HH21 ARG 33 1HH2 ARG 33 10.642 -8.390 -3.355 303 HH22 ARG 33 2HH2 ARG 33 11.870 -7.945 -2.220 304 H SER 34 H SER 34 5.646 -11.312 0.963 305 HA SER 34 HA SER 34 3.950 -13.684 0.898 306 HB2 SER 34 2HB SER 34 6.776 -13.738 2.011 307 HB3 SER 34 3HB SER 34 5.575 -15.001 2.280 308 HG SER 34 HG SER 34 5.891 -15.731 0.326 309 HA PRO 35 HA PRO 35 2.137 -12.030 4.523 310 HB2 PRO 35 2HB PRO 35 2.025 -14.269 6.199 311 HB3 PRO 35 3HB PRO 35 0.834 -13.836 4.970 312 HG2 PRO 35 2HG PRO 35 3.106 -15.774 4.810 313 HG3 PRO 35 3HG PRO 35 1.468 -15.903 4.140 314 HD2 PRO 35 2HD PRO 35 3.551 -15.300 2.575 315 HD3 PRO 35 3HD PRO 35 1.970 -14.526 2.324 316 H GLN 36 H GLN 36 4.862 -14.204 5.374 317 HA GLN 36 HA GLN 36 5.409 -12.995 7.867 318 HB2 GLN 36 2HB GLN 36 6.266 -15.213 7.297 319 HB3 GLN 36 3HB GLN 36 7.279 -14.519 6.037 320 HG2 GLN 36 2HG GLN 36 8.562 -13.303 7.699 321 HG3 GLN 36 3HG GLN 36 7.519 -13.917 8.980 322 HE21 GLN 36 1HE2 GLN 36 9.255 -14.864 10.042 323 HE22 GLN 36 2HE2 GLN 36 10.022 -16.295 9.453 324 H GLU 37 H GLU 37 6.353 -12.127 4.609 325 HA GLU 37 HA GLU 37 8.422 -10.306 5.249 326 HB2 GLU 37 2HB GLU 37 6.582 -10.561 2.878 327 HB3 GLU 37 3HB GLU 37 7.777 -9.275 2.979 328 HG2 GLU 37 2HG GLU 37 8.488 -12.190 3.226 329 HG3 GLU 37 3HG GLU 37 8.439 -11.338 1.683 330 H LEU 38 H LEU 38 4.971 -10.048 5.458 331 HA LEU 38 HA LEU 38 4.978 -7.167 5.781 332 HB2 LEU 38 2HB LEU 38 3.040 -8.350 4.807 333 HB3 LEU 38 3HB LEU 38 2.802 -9.198 6.323 334 HG LEU 38 HG LEU 38 2.316 -7.041 7.441 335 HD11 LEU 38 1HD1 LEU 38 3.612 -5.560 5.998 336 HD12 LEU 38 2HD1 LEU 38 1.932 -5.034 6.096 337 HD13 LEU 38 3HD1 LEU 38 2.507 -5.879 4.659 338 HD21 LEU 38 3HD2 LEU 38 0.622 -7.632 5.009 339 HD22 LEU 38 1HD2 LEU 38 0.115 -6.679 6.405 340 HD23 LEU 38 2HD2 LEU 38 0.481 -8.394 6.595 341 H LYS 39 H LYS 39 4.302 -9.962 7.897 342 HA LYS 39 HA LYS 39 4.114 -8.623 10.333 343 HB2 LYS 39 2HB LYS 39 3.478 -10.966 10.037 344 HB3 LYS 39 3HB LYS 39 5.158 -11.410 9.773 345 HG2 LYS 39 2HG LYS 39 5.697 -10.766 12.073 346 HG3 LYS 39 3HG LYS 39 4.015 -10.301 12.339 347 HD2 LYS 39 2HD LYS 39 3.319 -12.627 11.888 348 HD3 LYS 39 3HD LYS 39 5.010 -13.078 11.662 349 HE2 LYS 39 2HE LYS 39 3.778 -12.006 14.205 350 HE3 LYS 39 3HE LYS 39 4.229 -13.681 13.896 351 HZ1 LYS 39 3HZ LYS 39 5.944 -12.682 15.163 352 HZ2 LYS 39 1HZ LYS 39 6.046 -11.351 14.126 353 HZ3 LYS 39 2HZ LYS 39 6.546 -12.878 13.598 354 H ASP 40 H ASP 40 6.976 -9.915 8.703 355 HA ASP 40 HA ASP 40 8.864 -9.560 10.720 356 HB2 ASP 40 2HB ASP 40 9.227 -10.849 8.637 357 HB3 ASP 40 3HB ASP 40 9.293 -9.342 7.729 358 H SER 41 H SER 41 7.544 -7.241 8.426 359 HA SER 41 HA SER 41 9.361 -5.128 8.830 360 HB2 SER 41 2HB SER 41 7.655 -5.115 7.038 361 HB3 SER 41 3HB SER 41 6.387 -4.942 8.250 362 HG SER 41 HG SER 41 6.734 -2.891 7.836 363 H ILE 42 H ILE 42 6.380 -6.001 10.562 364 HA ILE 42 HA ILE 42 6.487 -3.888 12.463 365 HB ILE 42 HB ILE 42 5.091 -6.571 12.516 366 HG12 ILE 42 2HG1 ILE 42 3.039 -5.123 12.359 367 HG13 ILE 42 3HG1 ILE 42 4.090 -3.725 12.183 368 HG21 ILE 42 1HG2 ILE 42 4.903 -4.391 14.598 369 HG22 ILE 42 2HG2 ILE 42 5.604 -5.993 14.824 370 HG23 ILE 42 3HG2 ILE 42 3.877 -5.823 14.515 371 HD11 ILE 42 3HD1 ILE 42 3.219 -4.459 10.046 372 HD12 ILE 42 1HD1 ILE 42 3.922 -6.059 10.291 373 HD13 ILE 42 2HD1 ILE 42 4.971 -4.652 10.108 374 H GLU 43 H GLU 43 7.733 -7.218 12.480 375 HA GLU 43 HA GLU 43 8.784 -7.344 15.057 376 HB2 GLU 43 2HB GLU 43 10.069 -8.461 12.549 377 HB3 GLU 43 3HB GLU 43 10.357 -9.004 14.196 378 HG2 GLU 43 2HG GLU 43 7.749 -9.222 12.698 379 HG3 GLU 43 3HG GLU 43 8.899 -10.530 12.961 380 H GLU 44 H GLU 44 10.071 -5.755 12.183 381 HA GLU 44 HA GLU 44 12.520 -4.913 13.441 382 HB2 GLU 44 2HB GLU 44 11.140 -4.160 10.867 383 HB3 GLU 44 3HB GLU 44 12.590 -3.328 11.406 384 HG2 GLU 44 2HG GLU 44 12.369 -6.288 10.869 385 HG3 GLU 44 3HG GLU 44 13.080 -5.095 9.784 386 H LEU 45 H LEU 45 9.428 -3.319 12.671 387 HA LEU 45 HA LEU 45 10.102 -0.722 13.442 388 HB2 LEU 45 2HB LEU 45 7.419 -2.108 13.504 389 HB3 LEU 45 3HB LEU 45 7.637 -0.382 13.726 390 HG LEU 45 HG LEU 45 8.350 -1.928 11.224 391 HD11 LEU 45 1HD1 LEU 45 5.943 -1.776 11.550 392 HD12 LEU 45 2HD1 LEU 45 6.457 -0.747 10.214 393 HD13 LEU 45 3HD1 LEU 45 6.068 -0.031 11.779 394 HD21 LEU 45 3HD2 LEU 45 8.709 0.285 10.219 395 HD22 LEU 45 1HD2 LEU 45 9.824 -0.013 11.551 396 HD23 LEU 45 2HD2 LEU 45 8.430 1.041 11.788 397 H VAL 46 H VAL 46 8.921 -3.402 15.451 398 HA VAL 46 HA VAL 46 8.500 -1.859 17.799 399 HB VAL 46 HB VAL 46 7.560 -4.126 17.477 400 HG11 VAL 46 1HG1 VAL 46 10.383 -5.089 17.958 401 HG12 VAL 46 2HG1 VAL 46 9.484 -5.206 16.444 402 HG13 VAL 46 3HG1 VAL 46 8.944 -6.106 17.861 403 HG21 VAL 46 3HG2 VAL 46 9.273 -3.802 19.949 404 HG22 VAL 46 1HG2 VAL 46 7.928 -4.934 19.781 405 HG23 VAL 46 2HG2 VAL 46 7.634 -3.197 19.713 406 H LYS 47 H LYS 47 11.384 -3.060 16.312 407 HA LYS 47 HA LYS 47 12.999 -2.646 18.720 408 HB2 LYS 47 2HB LYS 47 13.824 -3.543 15.950 409 HB3 LYS 47 3HB LYS 47 14.857 -3.519 17.371 410 HG2 LYS 47 2HG LYS 47 12.341 -5.174 17.225 411 HG3 LYS 47 3HG LYS 47 13.905 -5.768 16.675 412 HD2 LYS 47 2HD LYS 47 13.734 -6.585 18.860 413 HD3 LYS 47 3HD LYS 47 14.755 -5.159 19.030 414 HE2 LYS 47 2HE LYS 47 12.799 -3.864 19.774 415 HE3 LYS 47 3HE LYS 47 11.789 -5.298 19.608 416 HZ1 LYS 47 3HZ LYS 47 13.131 -6.387 21.296 417 HZ2 LYS 47 1HZ LYS 47 12.460 -4.953 21.892 418 HZ3 LYS 47 2HZ LYS 47 14.092 -5.007 21.458 419 H LYS 48 H LYS 48 12.914 -1.479 15.353 420 HA LYS 48 HA LYS 48 13.765 1.170 16.258 421 HB2 LYS 48 2HB LYS 48 15.360 1.348 14.340 422 HB3 LYS 48 3HB LYS 48 15.850 0.187 15.564 423 HG2 LYS 48 2HG LYS 48 15.135 -1.656 14.170 424 HG3 LYS 48 3HG LYS 48 14.497 -0.536 12.964 425 HD2 LYS 48 2HD LYS 48 16.721 0.299 12.497 426 HD3 LYS 48 3HD LYS 48 17.401 -0.683 13.796 427 HE2 LYS 48 2HE LYS 48 16.076 -1.724 11.287 428 HE3 LYS 48 3HE LYS 48 17.810 -1.691 11.602 429 HZ1 LYS 48 3HZ LYS 48 17.168 -3.847 12.122 430 HZ2 LYS 48 1HZ LYS 48 15.736 -3.364 12.877 431 HZ3 LYS 48 2HZ LYS 48 17.222 -3.098 13.638 432 H TYR 49 H TYR 49 12.365 2.632 15.502 433 HA TYR 49 HA TYR 49 10.786 1.957 13.113 434 HB2 TYR 49 2HB TYR 49 9.275 3.865 14.003 435 HB3 TYR 49 3HB TYR 49 9.250 2.311 14.823 436 HD1 TYR 49 HD2 TYR 49 10.355 2.047 17.026 437 HD2 TYR 49 HD1 TYR 49 10.065 5.856 15.134 438 HE1 TYR 49 HE2 TYR 49 10.870 3.143 19.162 439 HE2 TYR 49 HE1 TYR 49 10.582 6.957 17.272 440 HH TYR 49 HH TYR 49 10.412 6.432 19.709 441 H ASN 50 H ASN 50 12.003 2.643 11.452 442 HA ASN 50 HA ASN 50 12.570 5.541 11.283 443 HB2 ASN 50 2HB ASN 50 14.604 4.112 11.233 444 HB3 ASN 50 3HB ASN 50 13.970 3.281 9.817 445 HD21 ASN 50 1HD2 ASN 50 15.709 3.902 8.537 446 HD22 ASN 50 2HD2 ASN 50 15.912 5.526 7.984 447 H ALA 51 H ALA 51 12.395 6.451 9.046 448 HA ALA 51 HA ALA 51 9.799 6.018 8.065 449 HB1 ALA 51 3HB ALA 51 10.973 8.162 7.918 450 HB2 ALA 51 1HB ALA 51 10.343 7.650 6.353 451 HB3 ALA 51 2HB ALA 51 12.063 7.482 6.711 452 H THR 52 H THR 52 9.516 3.861 7.425 453 HA THR 52 HA THR 52 10.611 3.248 4.747 454 HB THR 52 HB THR 52 10.158 1.239 6.979 455 HG1 THR 52 HG1 THR 52 12.486 0.846 6.397 456 HG21 THR 52 3HG2 THR 52 10.986 0.768 4.104 457 HG22 THR 52 1HG2 THR 52 9.447 0.300 4.829 458 HG23 THR 52 2HG2 THR 52 10.944 -0.457 5.373 459 H ILE 53 H ILE 53 8.934 3.442 3.367 460 HA ILE 53 HA ILE 53 6.222 2.823 4.168 461 HB ILE 53 HB ILE 53 7.307 3.588 1.444 462 HG12 ILE 53 2HG1 ILE 53 5.918 5.239 3.578 463 HG13 ILE 53 3HG1 ILE 53 7.607 5.371 3.099 464 HG21 ILE 53 1HG2 ILE 53 4.451 3.419 2.424 465 HG22 ILE 53 2HG2 ILE 53 5.215 2.356 1.241 466 HG23 ILE 53 3HG2 ILE 53 4.958 4.060 0.862 467 HD11 ILE 53 3HD1 ILE 53 6.307 7.168 2.150 468 HD12 ILE 53 1HD1 ILE 53 5.214 6.013 1.388 469 HD13 ILE 53 2HD1 ILE 53 6.898 6.107 0.872 470 H VAL 54 H VAL 54 5.328 0.865 4.058 471 HA VAL 54 HA VAL 54 6.745 -1.276 2.669 472 HB VAL 54 HB VAL 54 6.125 -1.770 4.936 473 HG11 VAL 54 1HG1 VAL 54 3.261 -1.244 4.151 474 HG12 VAL 54 2HG1 VAL 54 4.261 -0.217 5.178 475 HG13 VAL 54 3HG1 VAL 54 3.817 -1.836 5.717 476 HG21 VAL 54 3HG2 VAL 54 6.040 -3.633 3.349 477 HG22 VAL 54 1HG2 VAL 54 4.335 -3.305 3.042 478 HG23 VAL 54 2HG2 VAL 54 4.856 -3.843 4.639 479 H VAL 55 H VAL 55 6.226 -1.866 0.692 480 HA VAL 55 HA VAL 55 3.537 -1.290 -0.367 481 HB VAL 55 HB VAL 55 6.083 -1.881 -1.901 482 HG11 VAL 55 1HG1 VAL 55 3.373 -0.952 -2.868 483 HG12 VAL 55 2HG1 VAL 55 4.092 -2.540 -3.138 484 HG13 VAL 55 3HG1 VAL 55 4.820 -1.109 -3.865 485 HG21 VAL 55 3HG2 VAL 55 4.696 0.761 -1.407 486 HG22 VAL 55 1HG2 VAL 55 6.069 0.509 -2.485 487 HG23 VAL 55 2HG2 VAL 55 6.254 0.258 -0.749 488 H VAL 56 H VAL 56 2.255 -3.030 -0.108 489 HA VAL 56 HA VAL 56 3.283 -5.739 -0.310 490 HB VAL 56 HB VAL 56 0.417 -4.818 0.031 491 HG11 VAL 56 1HG1 VAL 56 0.019 -7.084 0.873 492 HG12 VAL 56 2HG1 VAL 56 1.702 -7.505 0.556 493 HG13 VAL 56 3HG1 VAL 56 0.622 -7.119 -0.784 494 HG21 VAL 56 3HG2 VAL 56 0.724 -5.251 2.422 495 HG22 VAL 56 1HG2 VAL 56 1.822 -3.991 1.859 496 HG23 VAL 56 2HG2 VAL 56 2.426 -5.625 2.144 497 H VAL 57 H VAL 57 3.660 -6.531 -2.300 498 HA VAL 57 HA VAL 57 2.032 -5.691 -4.572 499 HB VAL 57 HB VAL 57 4.363 -7.626 -4.532 500 HG11 VAL 57 1HG1 VAL 57 4.473 -7.183 -6.951 501 HG12 VAL 57 2HG1 VAL 57 3.031 -6.176 -6.828 502 HG13 VAL 57 3HG1 VAL 57 2.930 -7.904 -6.488 503 HG21 VAL 57 3HG2 VAL 57 5.712 -5.741 -5.363 504 HG22 VAL 57 1HG2 VAL 57 5.073 -5.433 -3.747 505 HG23 VAL 57 2HG2 VAL 57 4.329 -4.666 -5.151 506 H VAL 58 H VAL 58 0.247 -6.767 -5.138 507 HA VAL 58 HA VAL 58 -0.077 -9.541 -4.184 508 HB VAL 58 HB VAL 58 -2.480 -9.118 -3.969 509 HG11 VAL 58 1HG1 VAL 58 -2.387 -7.618 -2.021 510 HG12 VAL 58 2HG1 VAL 58 -0.775 -7.095 -2.508 511 HG13 VAL 58 3HG1 VAL 58 -1.051 -8.769 -2.025 512 HG21 VAL 58 3HG2 VAL 58 -3.376 -6.835 -4.148 513 HG22 VAL 58 1HG2 VAL 58 -2.748 -7.409 -5.693 514 HG23 VAL 58 2HG2 VAL 58 -1.809 -6.269 -4.728 515 H ASP 59 H ASP 59 -1.045 -11.052 -5.475 516 HA ASP 59 HA ASP 59 -1.229 -10.413 -8.326 517 HB2 ASP 59 2HB ASP 59 -1.239 -12.949 -8.574 518 HB3 ASP 59 3HB ASP 59 0.243 -12.227 -7.965 519 H ASP 60 H ASP 60 -3.189 -11.587 -5.640 520 HA ASP 60 HA ASP 60 -5.550 -11.063 -7.311 521 HB2 ASP 60 2HB ASP 60 -6.739 -12.987 -6.506 522 HB3 ASP 60 3HB ASP 60 -5.202 -13.528 -7.166 523 H LYS 61 H LYS 61 -7.590 -10.888 -5.926 524 HA LYS 61 HA LYS 61 -7.107 -8.763 -4.103 525 HB2 LYS 61 2HB LYS 61 -9.640 -8.816 -3.822 526 HB3 LYS 61 3HB LYS 61 -9.009 -8.500 -5.428 527 HG2 LYS 61 2HG LYS 61 -10.758 -9.966 -5.827 528 HG3 LYS 61 3HG LYS 61 -9.347 -11.019 -5.847 529 HD2 LYS 61 2HD LYS 61 -11.133 -12.081 -4.605 530 HD3 LYS 61 3HD LYS 61 -9.827 -11.653 -3.500 531 HE2 LYS 61 2HE LYS 61 -11.063 -9.702 -2.743 532 HE3 LYS 61 3HE LYS 61 -12.334 -10.020 -3.923 533 HZ1 LYS 61 3HZ LYS 61 -11.605 -11.768 -1.636 534 HZ2 LYS 61 1HZ LYS 61 -12.807 -12.107 -2.780 535 HZ3 LYS 61 2HZ LYS 61 -12.973 -10.784 -1.741 536 H GLU 62 H GLU 62 -7.632 -12.174 -3.570 537 HA GLU 62 HA GLU 62 -8.408 -11.843 -0.806 538 HB2 GLU 62 2HB GLU 62 -7.568 -14.294 -2.360 539 HB3 GLU 62 3HB GLU 62 -8.053 -14.325 -0.669 540 HG2 GLU 62 2HG GLU 62 -10.242 -13.330 -1.356 541 HG3 GLU 62 3HG GLU 62 -9.747 -13.542 -3.035 542 H TRP 63 H TRP 63 -5.400 -12.643 -2.514 543 HA TRP 63 HA TRP 63 -3.749 -12.872 -0.242 544 HB2 TRP 63 2HB TRP 63 -2.820 -13.534 -2.330 545 HB3 TRP 63 3HB TRP 63 -3.188 -11.985 -3.076 546 HD1 TRP 63 HD1 TRP 63 -0.895 -11.077 -3.714 547 HE1 TRP 63 HE1 TRP 63 1.299 -10.558 -2.487 548 HE3 TRP 63 HE3 TRP 63 -1.995 -13.183 0.814 549 HZ2 TRP 63 HZ2 TRP 63 2.419 -10.983 0.070 550 HZ3 TRP 63 HZ3 TRP 63 -0.306 -13.082 2.600 551 HH2 TRP 63 HH2 TRP 63 1.853 -12.004 2.232 552 H ALA 64 H ALA 64 -4.819 -10.040 -2.088 553 HA ALA 64 HA ALA 64 -3.553 -8.049 -0.570 554 HB1 ALA 64 3HB ALA 64 -6.246 -7.945 -1.938 555 HB2 ALA 64 1HB ALA 64 -4.687 -7.573 -2.677 556 HB3 ALA 64 2HB ALA 64 -5.318 -6.550 -1.387 557 H GLU 65 H GLU 65 -6.707 -9.657 -0.076 558 HA GLU 65 HA GLU 65 -7.519 -8.347 2.245 559 HB2 GLU 65 2HB GLU 65 -7.934 -11.227 1.421 560 HB3 GLU 65 3HB GLU 65 -8.721 -10.494 2.812 561 HG2 GLU 65 2HG GLU 65 -9.752 -8.831 1.273 562 HG3 GLU 65 3HG GLU 65 -9.060 -9.726 -0.081 563 H LYS 66 H LYS 66 -5.534 -11.299 1.962 564 HA LYS 66 HA LYS 66 -5.136 -11.988 4.586 565 HB2 LYS 66 2HB LYS 66 -3.113 -12.014 2.330 566 HB3 LYS 66 3HB LYS 66 -2.892 -12.854 3.858 567 HG2 LYS 66 2HG LYS 66 -5.274 -13.390 2.107 568 HG3 LYS 66 3HG LYS 66 -3.730 -14.197 1.838 569 HD2 LYS 66 2HD LYS 66 -5.252 -14.254 4.453 570 HD3 LYS 66 3HD LYS 66 -5.345 -15.511 3.218 571 HE2 LYS 66 2HE LYS 66 -2.875 -15.817 3.431 572 HE3 LYS 66 3HE LYS 66 -2.891 -14.670 4.769 573 HZ1 LYS 66 3HZ LYS 66 -4.347 -16.154 5.984 574 HZ2 LYS 66 1HZ LYS 66 -2.925 -16.956 5.542 575 HZ3 LYS 66 2HZ LYS 66 -4.360 -17.250 4.696 576 H ALA 67 H ALA 67 -3.308 -9.535 2.767 577 HA ALA 67 HA ALA 67 -1.563 -8.779 4.859 578 HB1 ALA 67 3HB ALA 67 -2.522 -7.077 2.554 579 HB2 ALA 67 1HB ALA 67 -1.197 -8.239 2.474 580 HB3 ALA 67 2HB ALA 67 -1.066 -6.826 3.520 581 H ILE 68 H ILE 68 -4.608 -7.279 3.730 582 HA ILE 68 HA ILE 68 -4.678 -5.218 5.659 583 HB ILE 68 HB ILE 68 -7.047 -6.487 4.256 584 HG12 ILE 68 2HG1 ILE 68 -5.350 -5.769 2.634 585 HG13 ILE 68 3HG1 ILE 68 -6.758 -4.716 2.562 586 HG21 ILE 68 1HG2 ILE 68 -7.718 -5.063 6.116 587 HG22 ILE 68 2HG2 ILE 68 -8.122 -4.296 4.580 588 HG23 ILE 68 3HG2 ILE 68 -6.718 -3.749 5.496 589 HD11 ILE 68 3HD1 ILE 68 -5.565 -3.026 3.854 590 HD12 ILE 68 1HD1 ILE 68 -4.688 -3.455 2.386 591 HD13 ILE 68 2HD1 ILE 68 -4.157 -4.084 3.945 592 H ARG 69 H ARG 69 -5.715 -8.558 5.803 593 HA ARG 69 HA ARG 69 -7.297 -8.358 8.164 594 HB2 ARG 69 2HB ARG 69 -5.883 -10.740 6.935 595 HB3 ARG 69 3HB ARG 69 -7.019 -10.842 8.274 596 HG2 ARG 69 2HG ARG 69 -8.812 -10.010 6.861 597 HG3 ARG 69 3HG ARG 69 -7.686 -9.793 5.523 598 HD2 ARG 69 2HD ARG 69 -7.242 -12.243 5.572 599 HD3 ARG 69 3HD ARG 69 -8.493 -12.406 6.806 600 HE ARG 69 HE ARG 69 -9.668 -11.091 4.678 601 HH11 ARG 69 1HH1 ARG 69 -8.199 -14.159 5.224 602 HH12 ARG 69 2HH1 ARG 69 -9.123 -14.939 3.993 603 HH21 ARG 69 1HH2 ARG 69 -10.853 -12.116 3.097 604 HH22 ARG 69 2HH2 ARG 69 -10.609 -13.804 2.813 605 H PHE 70 H PHE 70 -3.863 -8.872 7.556 606 HA PHE 70 HA PHE 70 -3.184 -9.349 10.303 607 HB2 PHE 70 2HB PHE 70 -1.692 -10.103 8.509 608 HB3 PHE 70 3HB PHE 70 -1.449 -8.438 7.988 609 HD1 PHE 70 HD1 PHE 70 -0.858 -10.800 10.784 610 HD2 PHE 70 HD2 PHE 70 0.194 -7.074 9.008 611 HE1 PHE 70 HE1 PHE 70 1.030 -10.593 12.346 612 HE2 PHE 70 HE2 PHE 70 2.081 -6.864 10.569 613 HZ PHE 70 HZ PHE 70 2.501 -8.621 12.240 614 H VAL 71 H VAL 71 -2.979 -6.496 8.159 615 HA VAL 71 HA VAL 71 -1.991 -4.659 10.016 616 HB VAL 71 HB VAL 71 -3.951 -4.071 7.777 617 HG11 VAL 71 1HG1 VAL 71 -2.948 -1.817 7.800 618 HG12 VAL 71 2HG1 VAL 71 -1.993 -2.268 9.213 619 HG13 VAL 71 3HG1 VAL 71 -3.751 -2.205 9.323 620 HG21 VAL 71 3HG2 VAL 71 -1.980 -5.290 6.969 621 HG22 VAL 71 1HG2 VAL 71 -0.926 -4.093 7.721 622 HG23 VAL 71 2HG2 VAL 71 -1.988 -3.624 6.391 623 H LYS 72 H LYS 72 -5.337 -5.653 9.374 624 HA LYS 72 HA LYS 72 -6.713 -3.970 11.108 625 HB2 LYS 72 2HB LYS 72 -7.906 -5.417 9.592 626 HB3 LYS 72 3HB LYS 72 -7.238 -6.854 10.352 627 HG2 LYS 72 2HG LYS 72 -9.568 -6.513 10.978 628 HG3 LYS 72 3HG LYS 72 -8.505 -6.394 12.381 629 HD2 LYS 72 2HD LYS 72 -8.573 -3.903 12.129 630 HD3 LYS 72 3HD LYS 72 -9.784 -4.113 10.862 631 HE2 LYS 72 2HE LYS 72 -11.305 -5.149 12.430 632 HE3 LYS 72 3HE LYS 72 -10.075 -5.124 13.693 633 HZ1 LYS 72 3HZ LYS 72 -11.458 -2.801 12.479 634 HZ2 LYS 72 1HZ LYS 72 -10.099 -2.653 13.479 635 HZ3 LYS 72 2HZ LYS 72 -11.526 -3.324 14.087 636 H SER 73 H SER 73 -4.840 -6.867 11.819 637 HA SER 73 HA SER 73 -5.647 -7.128 14.548 638 HB2 SER 73 2HB SER 73 -4.679 -9.010 13.264 639 HB3 SER 73 3HB SER 73 -3.141 -8.157 13.181 640 HG SER 73 HG SER 73 -3.655 -8.199 15.710 641 H LEU 74 H LEU 74 -3.297 -5.157 12.911 642 HA LEU 74 HA LEU 74 -1.658 -4.563 15.174 643 HB2 LEU 74 2HB LEU 74 -2.064 -2.976 12.631 644 HB3 LEU 74 3HB LEU 74 -0.771 -2.732 13.791 645 HG LEU 74 HG LEU 74 -1.178 -5.212 12.100 646 HD11 LEU 74 1HD1 LEU 74 0.868 -4.504 10.956 647 HD12 LEU 74 2HD1 LEU 74 0.897 -3.025 11.917 648 HD13 LEU 74 3HD1 LEU 74 -0.421 -3.312 10.780 649 HD21 LEU 74 3HD2 LEU 74 1.037 -4.514 14.036 650 HD22 LEU 74 1HD2 LEU 74 1.003 -5.921 12.971 651 HD23 LEU 74 2HD2 LEU 74 -0.188 -5.763 14.261 652 H GLY 75 H GLY 75 -4.483 -2.986 13.711 653 HA2 GLY 75 2HA GLY 75 -6.164 -1.893 14.926 654 HA3 GLY 75 3HA GLY 75 -5.102 -1.837 16.317 655 H ALA 76 H ALA 76 -2.923 -0.562 14.696 656 HA ALA 76 HA ALA 76 -3.530 2.111 15.349 657 HB1 ALA 76 3HB ALA 76 -1.339 1.118 13.525 658 HB2 ALA 76 1HB ALA 76 -1.239 1.226 15.285 659 HB3 ALA 76 2HB ALA 76 -1.413 2.693 14.319 660 H GLN 77 H GLN 77 -3.537 3.974 13.927 661 HA GLN 77 HA GLN 77 -5.227 3.563 11.592 662 HB2 GLN 77 2HB GLN 77 -5.498 6.027 11.619 663 HB3 GLN 77 3HB GLN 77 -5.951 5.279 13.142 664 HG2 GLN 77 2HG GLN 77 -3.187 6.377 12.824 665 HG3 GLN 77 3HG GLN 77 -4.526 7.486 13.076 666 HE21 GLN 77 1HE2 GLN 77 -3.754 8.148 15.077 667 HE22 GLN 77 2HE2 GLN 77 -3.797 7.132 16.471 668 H VAL 78 H VAL 78 -4.333 3.305 9.648 669 HA VAL 78 HA VAL 78 -2.031 4.976 8.894 670 HB VAL 78 HB VAL 78 -1.032 3.087 7.631 671 HG11 VAL 78 1HG1 VAL 78 -1.338 2.585 10.597 672 HG12 VAL 78 2HG1 VAL 78 -0.141 3.629 9.829 673 HG13 VAL 78 3HG1 VAL 78 -0.090 1.886 9.565 674 HG21 VAL 78 3HG2 VAL 78 -3.073 1.392 9.082 675 HG22 VAL 78 1HG2 VAL 78 -1.741 0.783 8.099 676 HG23 VAL 78 2HG2 VAL 78 -3.038 1.713 7.348 677 H LEU 79 H LEU 79 -1.940 5.605 6.738 678 HA LEU 79 HA LEU 79 -4.391 5.369 5.203 679 HB2 LEU 79 2HB LEU 79 -1.787 6.823 4.695 680 HB3 LEU 79 3HB LEU 79 -3.083 6.775 3.519 681 HG LEU 79 HG LEU 79 -3.132 8.875 4.719 682 HD11 LEU 79 1HD1 LEU 79 -5.421 7.079 5.523 683 HD12 LEU 79 2HD1 LEU 79 -5.266 7.973 4.010 684 HD13 LEU 79 3HD1 LEU 79 -5.445 8.844 5.533 685 HD21 LEU 79 3HD2 LEU 79 -2.037 8.181 6.781 686 HD22 LEU 79 1HD2 LEU 79 -3.454 7.232 7.233 687 HD23 LEU 79 2HD2 LEU 79 -3.567 8.989 7.123 688 H ILE 80 H ILE 80 -4.715 4.073 3.440 689 HA ILE 80 HA ILE 80 -2.423 2.421 2.560 690 HB ILE 80 HB ILE 80 -5.313 1.546 2.815 691 HG12 ILE 80 2HG1 ILE 80 -2.827 0.744 4.367 692 HG13 ILE 80 3HG1 ILE 80 -4.171 1.699 4.986 693 HG21 ILE 80 1HG2 ILE 80 -4.265 0.511 0.881 694 HG22 ILE 80 2HG2 ILE 80 -4.481 -0.682 2.161 695 HG23 ILE 80 3HG2 ILE 80 -2.887 0.012 1.862 696 HD11 ILE 80 3HD1 ILE 80 -4.290 -0.584 5.776 697 HD12 ILE 80 1HD1 ILE 80 -4.296 -1.181 4.117 698 HD13 ILE 80 2HD1 ILE 80 -5.653 -0.227 4.716 699 H ILE 81 H ILE 81 -1.839 3.079 0.587 700 HA ILE 81 HA ILE 81 -3.836 3.993 -1.344 701 HB ILE 81 HB ILE 81 -0.822 3.844 -1.607 702 HG12 ILE 81 2HG1 ILE 81 -2.627 6.213 -1.015 703 HG13 ILE 81 3HG1 ILE 81 -1.526 5.447 0.126 704 HG21 ILE 81 1HG2 ILE 81 -2.899 5.146 -3.378 705 HG22 ILE 81 2HG2 ILE 81 -1.896 3.751 -3.779 706 HG23 ILE 81 3HG2 ILE 81 -1.155 5.335 -3.557 707 HD11 ILE 81 3HD1 ILE 81 -0.745 6.920 -2.383 708 HD12 ILE 81 1HD1 ILE 81 0.369 6.121 -1.273 709 HD13 ILE 81 2HD1 ILE 81 -0.582 7.500 -0.725 710 H ILE 82 H ILE 82 -4.689 2.660 -2.833 711 HA ILE 82 HA ILE 82 -3.287 0.119 -3.407 712 HB ILE 82 HB ILE 82 -6.285 0.559 -3.369 713 HG12 ILE 82 2HG1 ILE 82 -4.493 -0.903 -1.401 714 HG13 ILE 82 3HG1 ILE 82 -5.325 0.620 -1.100 715 HG21 ILE 82 1HG2 ILE 82 -5.555 -1.140 -4.985 716 HG22 ILE 82 2HG2 ILE 82 -6.441 -1.861 -3.643 717 HG23 ILE 82 3HG2 ILE 82 -4.682 -1.982 -3.704 718 HD11 ILE 82 3HD1 ILE 82 -6.619 -2.056 -1.582 719 HD12 ILE 82 1HD1 ILE 82 -7.480 -0.534 -1.342 720 HD13 ILE 82 2HD1 ILE 82 -6.493 -1.204 -0.043 721 H TYR 83 H TYR 83 -3.088 -0.542 -5.502 722 HA TYR 83 HA TYR 83 -4.154 1.249 -7.604 723 HB2 TYR 83 2HB TYR 83 -1.746 1.587 -7.324 724 HB3 TYR 83 3HB TYR 83 -1.461 -0.138 -7.512 725 HD1 TYR 83 HD1 TYR 83 -1.660 -1.202 -9.733 726 HD2 TYR 83 HD2 TYR 83 -2.165 2.999 -9.253 727 HE1 TYR 83 HE1 TYR 83 -1.399 -0.895 -12.155 728 HE2 TYR 83 HE2 TYR 83 -1.904 3.310 -11.675 729 HH TYR 83 HH TYR 83 -0.937 2.157 -13.588 730 H ASP 84 H ASP 84 -5.481 0.271 -8.983 731 HA ASP 84 HA ASP 84 -4.763 -2.276 -10.155 732 HB2 ASP 84 2HB ASP 84 -6.126 -2.957 -8.197 733 HB3 ASP 84 3HB ASP 84 -7.454 -1.966 -8.792 734 H GLN 85 H GLN 85 -5.924 -2.702 -12.157 735 HA GLN 85 HA GLN 85 -6.483 -0.199 -13.512 736 HB2 GLN 85 2HB GLN 85 -6.175 -3.025 -14.539 737 HB3 GLN 85 3HB GLN 85 -6.508 -1.644 -15.577 738 HG2 GLN 85 2HG GLN 85 -4.396 -0.601 -14.782 739 HG3 GLN 85 3HG GLN 85 -4.058 -2.071 -13.870 740 HE21 GLN 85 1HE2 GLN 85 -3.465 -3.939 -14.985 741 HE22 GLN 85 2HE2 GLN 85 -2.992 -3.914 -16.646 742 H ASP 86 H ASP 86 -8.454 -2.414 -11.941 743 HA ASP 86 HA ASP 86 -10.753 -1.687 -13.656 744 HB2 ASP 86 2HB ASP 86 -10.341 -4.218 -12.048 745 HB3 ASP 86 3HB ASP 86 -11.842 -3.787 -12.863 746 H GLN 87 H GLN 87 -11.916 -0.143 -12.681 747 HA GLN 87 HA GLN 87 -11.937 0.514 -9.977 748 HB2 GLN 87 2HB GLN 87 -14.062 0.941 -12.088 749 HB3 GLN 87 3HB GLN 87 -14.148 1.644 -10.479 750 HG2 GLN 87 2HG GLN 87 -11.955 2.146 -12.486 751 HG3 GLN 87 3HG GLN 87 -13.306 3.226 -12.147 752 HE21 GLN 87 1HE2 GLN 87 -13.381 4.285 -10.129 753 HE22 GLN 87 2HE2 GLN 87 -11.960 4.488 -9.171 754 H ASN 88 H ASN 88 -13.988 -1.774 -11.723 755 HA ASN 88 HA ASN 88 -15.879 -2.409 -9.805 756 HB2 ASN 88 2HB ASN 88 -15.933 -3.309 -12.071 757 HB3 ASN 88 3HB ASN 88 -14.476 -4.245 -11.767 758 HD21 ASN 88 1HD2 ASN 88 -17.876 -3.960 -11.133 759 HD22 ASN 88 2HD2 ASN 88 -18.091 -5.556 -10.511 760 H ARG 89 H ARG 89 -12.554 -3.573 -10.085 761 HA ARG 89 HA ARG 89 -12.759 -5.266 -7.727 762 HB2 ARG 89 2HB ARG 89 -10.292 -4.521 -9.323 763 HB3 ARG 89 3HB ARG 89 -10.455 -5.861 -8.193 764 HG2 ARG 89 2HG ARG 89 -12.057 -6.941 -9.674 765 HG3 ARG 89 3HG ARG 89 -11.955 -5.583 -10.796 766 HD2 ARG 89 2HD ARG 89 -9.577 -6.061 -11.155 767 HD3 ARG 89 3HD ARG 89 -9.678 -7.415 -10.026 768 HE ARG 89 HE ARG 89 -11.156 -7.293 -12.578 769 HH11 ARG 89 1HH1 ARG 89 -9.334 -9.032 -10.229 770 HH12 ARG 89 2HH1 ARG 89 -9.592 -10.553 -11.015 771 HH21 ARG 89 1HH2 ARG 89 -11.452 -9.233 -13.576 772 HH22 ARG 89 2HH2 ARG 89 -10.761 -10.665 -12.890 773 H LEU 90 H LEU 90 -10.649 -2.577 -8.681 774 HA LEU 90 HA LEU 90 -9.368 -2.007 -6.343 775 HB2 LEU 90 2HB LEU 90 -8.922 -0.993 -8.547 776 HB3 LEU 90 3HB LEU 90 -10.374 -0.027 -8.393 777 HG LEU 90 HG LEU 90 -9.377 1.138 -6.449 778 HD11 LEU 90 1HD1 LEU 90 -7.890 -0.656 -5.692 779 HD12 LEU 90 2HD1 LEU 90 -7.024 0.861 -5.926 780 HD13 LEU 90 3HD1 LEU 90 -6.887 -0.427 -7.125 781 HD21 LEU 90 3HD2 LEU 90 -7.733 2.438 -7.723 782 HD22 LEU 90 1HD2 LEU 90 -9.180 2.101 -8.673 783 HD23 LEU 90 2HD2 LEU 90 -7.701 1.181 -8.961 784 H GLU 91 H GLU 91 -12.430 -0.478 -7.382 785 HA GLU 91 HA GLU 91 -12.646 1.142 -5.050 786 HB2 GLU 91 2HB GLU 91 -13.726 1.280 -7.511 787 HB3 GLU 91 3HB GLU 91 -15.077 0.539 -6.673 788 HG2 GLU 91 2HG GLU 91 -13.754 3.121 -5.851 789 HG3 GLU 91 3HG GLU 91 -15.204 3.009 -6.843 790 H GLU 92 H GLU 92 -13.813 -2.076 -5.865 791 HA GLU 92 HA GLU 92 -15.714 -2.142 -3.685 792 HB2 GLU 92 2HB GLU 92 -15.956 -3.392 -5.901 793 HB3 GLU 92 3HB GLU 92 -14.779 -4.534 -5.267 794 HG2 GLU 92 2HG GLU 92 -17.088 -5.300 -4.950 795 HG3 GLU 92 3HG GLU 92 -16.243 -5.079 -3.416 796 H PHE 93 H PHE 93 -12.471 -3.484 -4.285 797 HA PHE 93 HA PHE 93 -12.229 -4.836 -1.808 798 HB2 PHE 93 2HB PHE 93 -10.646 -5.217 -3.659 799 HB3 PHE 93 3HB PHE 93 -10.056 -3.564 -3.505 800 HD1 PHE 93 HD1 PHE 93 -10.619 -6.528 -1.295 801 HD2 PHE 93 HD2 PHE 93 -8.049 -3.314 -2.396 802 HE1 PHE 93 HE1 PHE 93 -8.971 -7.279 0.366 803 HE2 PHE 93 HE2 PHE 93 -6.394 -4.067 -0.739 804 HZ PHE 93 HZ PHE 93 -6.855 -6.052 0.646 805 H SER 94 H SER 94 -11.662 -1.521 -2.816 806 HA SER 94 HA SER 94 -10.620 -0.378 -0.517 807 HB2 SER 94 2HB SER 94 -10.848 0.953 -2.495 808 HB3 SER 94 3HB SER 94 -12.592 0.707 -2.541 809 HG SER 94 HG SER 94 -11.139 2.568 -1.199 810 H ARG 95 H ARG 95 -13.946 -1.346 -1.203 811 HA ARG 95 HA ARG 95 -15.324 -0.152 0.893 812 HB2 ARG 95 2HB ARG 95 -16.076 -1.792 -1.064 813 HB3 ARG 95 3HB ARG 95 -15.924 -3.005 0.196 814 HG2 ARG 95 2HG ARG 95 -18.142 -2.456 0.382 815 HG3 ARG 95 3HG ARG 95 -17.433 -1.349 1.563 816 HD2 ARG 95 2HD ARG 95 -19.070 -0.229 0.094 817 HD3 ARG 95 3HD ARG 95 -17.447 0.450 -0.073 818 HE ARG 95 HE ARG 95 -18.470 -1.561 -1.972 819 HH11 ARG 95 1HH1 ARG 95 -17.093 1.538 -1.349 820 HH12 ARG 95 2HH1 ARG 95 -16.775 1.848 -3.020 821 HH21 ARG 95 1HH2 ARG 95 -18.057 -1.148 -4.103 822 HH22 ARG 95 2HH2 ARG 95 -17.335 0.361 -4.559 823 H GLU 96 H GLU 96 -13.785 -3.353 0.837 824 HA GLU 96 HA GLU 96 -14.262 -4.068 3.496 825 HB2 GLU 96 2HB GLU 96 -12.107 -4.897 1.549 826 HB3 GLU 96 3HB GLU 96 -12.272 -5.623 3.144 827 HG2 GLU 96 2HG GLU 96 -14.363 -5.631 0.971 828 HG3 GLU 96 3HG GLU 96 -13.331 -6.988 1.426 829 H VAL 97 H VAL 97 -11.270 -2.717 2.082 830 HA VAL 97 HA VAL 97 -9.784 -2.557 4.431 831 HB VAL 97 HB VAL 97 -9.667 -0.615 2.110 832 HG11 VAL 97 1HG1 VAL 97 -7.313 -0.318 2.785 833 HG12 VAL 97 2HG1 VAL 97 -7.597 -1.351 4.187 834 HG13 VAL 97 3HG1 VAL 97 -8.438 0.193 4.044 835 HG21 VAL 97 3HG2 VAL 97 -7.965 -2.089 1.163 836 HG22 VAL 97 1HG2 VAL 97 -9.496 -2.945 1.355 837 HG23 VAL 97 2HG2 VAL 97 -8.181 -3.222 2.498 838 H ARG 98 H ARG 98 -11.958 -0.116 3.013 839 HA ARG 98 HA ARG 98 -11.529 1.875 4.971 840 HB2 ARG 98 2HB ARG 98 -12.512 2.296 2.738 841 HB3 ARG 98 3HB ARG 98 -13.968 1.439 3.230 842 HG2 ARG 98 2HG ARG 98 -14.427 3.111 4.921 843 HG3 ARG 98 3HG ARG 98 -12.914 3.939 4.550 844 HD2 ARG 98 2HD ARG 98 -13.737 4.406 2.280 845 HD3 ARG 98 3HD ARG 98 -15.254 3.589 2.667 846 HE ARG 98 HE ARG 98 -15.082 5.463 4.591 847 HH11 ARG 98 1HH1 ARG 98 -14.879 5.641 1.154 848 HH12 ARG 98 2HH1 ARG 98 -15.459 7.270 1.103 849 HH21 ARG 98 1HH2 ARG 98 -15.855 7.518 4.508 850 HH22 ARG 98 2HH2 ARG 98 -16.022 8.314 2.981 851 H ARG 99 H ARG 99 -14.050 -0.642 4.700 852 HA ARG 99 HA ARG 99 -15.534 0.072 6.968 853 HB2 ARG 99 2HB ARG 99 -16.456 -1.503 5.402 854 HB3 ARG 99 3HB ARG 99 -15.126 -2.626 5.660 855 HG2 ARG 99 2HG ARG 99 -15.891 -3.165 7.851 856 HG3 ARG 99 3HG ARG 99 -17.058 -1.844 7.837 857 HD2 ARG 99 2HD ARG 99 -18.182 -3.964 7.499 858 HD3 ARG 99 3HD ARG 99 -18.306 -2.973 6.050 859 HE ARG 99 HE ARG 99 -16.629 -4.397 5.029 860 HH11 ARG 99 1HH1 ARG 99 -17.994 -5.572 7.969 861 HH12 ARG 99 2HH1 ARG 99 -17.739 -7.231 7.556 862 HH21 ARG 99 1HH2 ARG 99 -16.302 -6.541 4.510 863 HH22 ARG 99 2HH2 ARG 99 -16.807 -7.771 5.615 864 H ARG 100 H ARG 100 -12.488 -1.598 6.712 865 HA ARG 100 HA ARG 100 -12.610 -2.645 9.421 866 HB2 ARG 100 2HB ARG 100 -10.337 -2.712 7.418 867 HB3 ARG 100 3HB ARG 100 -10.435 -3.642 8.914 868 HG2 ARG 100 2HG ARG 100 -12.386 -4.830 8.086 869 HG3 ARG 100 3HG ARG 100 -12.380 -3.849 6.624 870 HD2 ARG 100 2HD ARG 100 -10.125 -4.789 6.092 871 HD3 ARG 100 3HD ARG 100 -10.318 -5.883 7.466 872 HE ARG 100 HE ARG 100 -12.190 -5.844 5.184 873 HH11 ARG 100 1HH1 ARG 100 -10.247 -7.591 7.431 874 HH12 ARG 100 2HH1 ARG 100 -10.824 -9.128 6.892 875 HH21 ARG 100 1HH2 ARG 100 -12.922 -7.820 4.510 876 HH22 ARG 100 2HH2 ARG 100 -12.312 -9.257 5.259 877 H GLY 101 H GLY 101 -12.237 0.381 8.443 878 HA2 GLY 101 2HA GLY 101 -11.814 2.104 10.002 879 HA3 GLY 101 3HA GLY 101 -10.749 1.028 10.886 880 H PHE 102 H PHE 102 -10.012 0.886 7.600 881 HA PHE 102 HA PHE 102 -7.753 2.738 8.029 882 HB2 PHE 102 2HB PHE 102 -7.958 0.424 6.086 883 HB3 PHE 102 3HB PHE 102 -6.532 1.421 6.367 884 HD1 PHE 102 HD1 PHE 102 -5.548 1.430 8.740 885 HD2 PHE 102 HD2 PHE 102 -8.312 -1.504 7.356 886 HE1 PHE 102 HE1 PHE 102 -4.842 -0.087 10.544 887 HE2 PHE 102 HE2 PHE 102 -7.610 -3.017 9.161 888 HZ PHE 102 HZ PHE 102 -5.875 -2.308 10.757 889 H GLU 103 H GLU 103 -7.850 4.630 6.985 890 HA GLU 103 HA GLU 103 -9.716 5.133 4.891 891 HB2 GLU 103 2HB GLU 103 -7.394 6.823 5.854 892 HB3 GLU 103 3HB GLU 103 -8.644 7.366 4.740 893 HG2 GLU 103 2HG GLU 103 -10.326 6.845 6.547 894 HG3 GLU 103 3HG GLU 103 -8.962 6.611 7.638 895 H VAL 104 H VAL 104 -9.457 4.084 3.055 896 HA VAL 104 HA VAL 104 -6.814 3.640 1.908 897 HB VAL 104 HB VAL 104 -8.212 1.703 1.992 898 HG11 VAL 104 1HG1 VAL 104 -10.284 3.269 0.450 899 HG12 VAL 104 2HG1 VAL 104 -10.382 2.809 2.150 900 HG13 VAL 104 3HG1 VAL 104 -10.396 1.566 0.900 901 HG21 VAL 104 3HG2 VAL 104 -6.820 1.899 -0.012 902 HG22 VAL 104 1HG2 VAL 104 -8.136 2.715 -0.859 903 HG23 VAL 104 2HG2 VAL 104 -8.316 1.032 -0.361 904 H ARG 105 H ARG 105 -6.053 4.545 0.079 905 HA ARG 105 HA ARG 105 -7.820 6.344 -1.463 906 HB2 ARG 105 2HB ARG 105 -4.847 6.553 -0.925 907 HB3 ARG 105 3HB ARG 105 -5.701 7.557 -2.090 908 HG2 ARG 105 2HG ARG 105 -6.325 7.438 0.862 909 HG3 ARG 105 3HG ARG 105 -5.339 8.678 0.083 910 HD2 ARG 105 2HD ARG 105 -7.227 9.400 -1.255 911 HD3 ARG 105 3HD ARG 105 -8.217 8.083 -0.628 912 HE ARG 105 HE ARG 105 -8.516 9.257 1.338 913 HH11 ARG 105 1HH1 ARG 105 -6.216 10.872 -0.647 914 HH12 ARG 105 2HH1 ARG 105 -6.258 12.322 0.286 915 HH21 ARG 105 1HH2 ARG 105 -8.561 11.125 2.539 916 HH22 ARG 105 2HH2 ARG 105 -7.592 12.475 2.057 917 H THR 106 H THR 106 -8.194 5.785 -3.508 918 HA THR 106 HA THR 106 -6.679 3.540 -4.645 919 HB THR 106 HB THR 106 -8.585 3.335 -6.232 920 HG1 THR 106 HG1 THR 106 -9.857 5.007 -6.408 921 HG21 THR 106 3HG2 THR 106 -9.344 3.368 -3.303 922 HG22 THR 106 1HG2 THR 106 -8.611 2.023 -4.178 923 HG23 THR 106 2HG2 THR 106 -10.247 2.549 -4.578 924 H VAL 107 H VAL 107 -5.457 3.702 -6.439 925 HA VAL 107 HA VAL 107 -5.559 6.211 -7.999 926 HB VAL 107 HB VAL 107 -3.078 6.007 -8.319 927 HG11 VAL 107 1HG1 VAL 107 -4.042 6.372 -5.476 928 HG12 VAL 107 2HG1 VAL 107 -3.997 7.609 -6.733 929 HG13 VAL 107 3HG1 VAL 107 -2.493 6.931 -6.111 930 HG21 VAL 107 3HG2 VAL 107 -2.861 3.622 -7.734 931 HG22 VAL 107 1HG2 VAL 107 -3.270 4.000 -6.062 932 HG23 VAL 107 2HG2 VAL 107 -1.784 4.633 -6.772 933 H THR 108 H THR 108 -5.440 6.040 -10.196 934 HA THR 108 HA THR 108 -5.660 3.318 -11.304 935 HB THR 108 HB THR 108 -6.759 4.411 -13.243 936 HG1 THR 108 HG1 THR 108 -7.125 6.607 -13.216 937 HG21 THR 108 3HG2 THR 108 -7.954 5.153 -10.563 938 HG22 THR 108 1HG2 THR 108 -8.142 3.603 -11.386 939 HG23 THR 108 2HG2 THR 108 -8.831 5.066 -12.090 940 H SER 109 H SER 109 -3.740 6.242 -11.581 941 HA SER 109 HA SER 109 -2.034 4.878 -13.563 942 HB2 SER 109 2HB SER 109 -2.916 7.778 -13.701 943 HB3 SER 109 3HB SER 109 -1.673 7.060 -14.723 944 HG SER 109 HG SER 109 -4.051 5.666 -14.684 945 HA PRO 110 HA PRO 110 1.479 5.809 -11.065 946 HB2 PRO 110 2HB PRO 110 3.246 6.835 -12.971 947 HB3 PRO 110 3HB PRO 110 3.001 5.124 -12.613 948 HG2 PRO 110 2HG PRO 110 1.817 6.792 -14.795 949 HG3 PRO 110 3HG PRO 110 2.407 5.119 -14.853 950 HD2 PRO 110 2HD PRO 110 -0.211 5.647 -14.758 951 HD3 PRO 110 3HD PRO 110 0.471 4.273 -13.860 952 H ASP 111 H ASP 111 0.771 8.433 -13.415 953 HA ASP 111 HA ASP 111 1.955 10.494 -11.895 954 HB2 ASP 111 2HB ASP 111 -0.154 10.535 -14.054 955 HB3 ASP 111 3HB ASP 111 0.484 12.005 -13.320 956 H ASP 112 H ASP 112 -1.402 9.295 -11.947 957 HA ASP 112 HA ASP 112 -2.454 11.158 -10.112 958 HB2 ASP 112 2HB ASP 112 -3.271 8.301 -10.697 959 HB3 ASP 112 3HB ASP 112 -4.200 9.397 -9.673 960 H PHE 113 H PHE 113 -0.875 8.016 -9.594 961 HA PHE 113 HA PHE 113 -0.986 8.003 -6.775 962 HB2 PHE 113 2HB PHE 113 -0.351 5.992 -7.951 963 HB3 PHE 113 3HB PHE 113 1.036 6.796 -8.681 964 HD1 PHE 113 HD1 PHE 113 -0.368 5.663 -5.434 965 HD2 PHE 113 HD2 PHE 113 3.123 6.813 -7.591 966 HE1 PHE 113 HE1 PHE 113 1.037 4.944 -3.548 967 HE2 PHE 113 HE2 PHE 113 4.526 6.092 -5.708 968 HZ PHE 113 HZ PHE 113 3.484 5.158 -3.684 969 H LYS 114 H LYS 114 1.446 9.280 -9.008 970 HA LYS 114 HA LYS 114 3.368 10.185 -7.236 971 HB2 LYS 114 2HB LYS 114 3.686 10.152 -9.646 972 HB3 LYS 114 3HB LYS 114 2.440 11.371 -9.860 973 HG2 LYS 114 2HG LYS 114 3.826 13.051 -8.833 974 HG3 LYS 114 3HG LYS 114 5.039 11.841 -8.401 975 HD2 LYS 114 2HD LYS 114 5.674 13.141 -10.409 976 HD3 LYS 114 3HD LYS 114 5.512 11.416 -10.742 977 HE2 LYS 114 2HE LYS 114 3.192 11.881 -11.580 978 HE3 LYS 114 3HE LYS 114 3.536 13.602 -11.409 979 HZ1 LYS 114 3HZ LYS 114 3.879 12.769 -13.677 980 HZ2 LYS 114 1HZ LYS 114 5.084 11.724 -13.117 981 HZ3 LYS 114 2HZ LYS 114 5.300 13.400 -13.015 982 H LYS 115 H LYS 115 0.562 11.991 -8.486 983 HA LYS 115 HA LYS 115 1.038 14.354 -7.004 984 HB2 LYS 115 2HB LYS 115 -1.555 13.297 -8.147 985 HB3 LYS 115 3HB LYS 115 -1.270 14.951 -7.613 986 HG2 LYS 115 2HG LYS 115 0.389 15.269 -9.348 987 HG3 LYS 115 3HG LYS 115 0.231 13.582 -9.843 988 HD2 LYS 115 2HD LYS 115 -2.130 14.002 -10.432 989 HD3 LYS 115 3HD LYS 115 -1.920 15.699 -9.989 990 HE2 LYS 115 2HE LYS 115 -0.257 15.980 -11.736 991 HE3 LYS 115 3HE LYS 115 -0.354 14.265 -12.141 992 HZ1 LYS 115 3HZ LYS 115 -2.659 14.588 -12.787 993 HZ2 LYS 115 1HZ LYS 115 -1.642 15.610 -13.674 994 HZ3 LYS 115 2HZ LYS 115 -2.562 16.233 -12.401 995 H SER 116 H SER 116 -1.218 11.645 -6.409 996 HA SER 116 HA SER 116 -2.353 12.677 -4.048 997 HB2 SER 116 2HB SER 116 -3.140 10.372 -3.621 998 HB3 SER 116 3HB SER 116 -3.417 10.863 -5.291 999 HG SER 116 HG SER 116 -1.954 9.460 -5.971 1000 H LEU 117 H LEU 117 0.431 10.494 -4.486 1001 HA LEU 117 HA LEU 117 0.933 9.996 -1.764 1002 HB2 LEU 117 2HB LEU 117 1.963 8.739 -3.639 1003 HB3 LEU 117 3HB LEU 117 2.949 10.141 -4.016 1004 HG LEU 117 HG LEU 117 3.978 9.958 -1.737 1005 HD11 LEU 117 1HD1 LEU 117 2.215 8.756 -0.591 1006 HD12 LEU 117 2HD1 LEU 117 3.722 7.845 -0.508 1007 HD13 LEU 117 3HD1 LEU 117 2.456 7.353 -1.635 1008 HD21 LEU 117 3HD2 LEU 117 5.416 8.054 -2.275 1009 HD22 LEU 117 1HD2 LEU 117 5.128 9.068 -3.687 1010 HD23 LEU 117 2HD2 LEU 117 4.272 7.536 -3.515 1011 H GLU 118 H GLU 118 2.379 12.455 -3.930 1012 HA GLU 118 HA GLU 118 4.003 13.797 -2.139 1013 HB2 GLU 118 2HB GLU 118 2.312 14.908 -4.389 1014 HB3 GLU 118 3HB GLU 118 3.537 15.843 -3.542 1015 HG2 GLU 118 2HG GLU 118 4.113 13.280 -5.014 1016 HG3 GLU 118 3HG GLU 118 4.243 14.879 -5.741 1017 H ARG 119 H ARG 119 0.521 14.190 -2.642 1018 HA ARG 119 HA ARG 119 0.137 16.320 -0.809 1019 HB2 ARG 119 2HB ARG 119 -1.834 14.194 -1.686 1020 HB3 ARG 119 3HB ARG 119 -2.245 15.710 -0.897 1021 HG2 ARG 119 2HG ARG 119 -1.002 15.402 -3.624 1022 HG3 ARG 119 3HG ARG 119 -2.676 15.834 -3.275 1023 HD2 ARG 119 2HD ARG 119 -0.235 17.448 -2.530 1024 HD3 ARG 119 3HD ARG 119 -1.334 17.794 -3.864 1025 HE ARG 119 HE ARG 119 -2.613 17.654 -1.286 1026 HH11 ARG 119 1HH1 ARG 119 -0.982 19.682 -3.540 1027 HH12 ARG 119 2HH1 ARG 119 -1.707 21.127 -2.931 1028 HH21 ARG 119 1HH2 ARG 119 -3.506 19.521 -0.484 1029 HH22 ARG 119 2HH2 ARG 119 -3.106 21.035 -1.213 1030 H LEU 120 H LEU 120 -0.636 12.850 -0.445 1031 HA LEU 120 HA LEU 120 -1.448 12.910 2.203 1032 HB2 LEU 120 2HB LEU 120 -0.120 10.666 0.676 1033 HB3 LEU 120 3HB LEU 120 -0.887 10.470 2.243 1034 HG LEU 120 HG LEU 120 -2.279 11.315 -0.309 1035 HD11 LEU 120 1HD1 LEU 120 -3.377 9.140 -0.172 1036 HD12 LEU 120 2HD1 LEU 120 -2.415 8.735 1.251 1037 HD13 LEU 120 3HD1 LEU 120 -1.627 8.964 -0.310 1038 HD21 LEU 120 3HD2 LEU 120 -4.352 11.101 0.986 1039 HD22 LEU 120 1HD2 LEU 120 -3.304 12.359 1.645 1040 HD23 LEU 120 2HD2 LEU 120 -3.411 10.790 2.445 1041 H ILE 121 H ILE 121 1.853 12.303 0.976 1042 HA ILE 121 HA ILE 121 3.108 11.710 3.380 1043 HB ILE 121 HB ILE 121 4.173 13.179 0.963 1044 HG12 ILE 121 2HG1 ILE 121 4.475 10.315 1.915 1045 HG13 ILE 121 3HG1 ILE 121 3.496 10.861 0.558 1046 HG21 ILE 121 1HG2 ILE 121 5.723 12.144 3.340 1047 HG22 ILE 121 2HG2 ILE 121 5.564 13.825 2.828 1048 HG23 ILE 121 3HG2 ILE 121 6.441 12.676 1.819 1049 HD11 ILE 121 3HD1 ILE 121 5.550 9.879 -0.227 1050 HD12 ILE 121 1HD1 ILE 121 6.494 10.993 0.760 1051 HD13 ILE 121 2HD1 ILE 121 5.535 11.605 -0.589 1052 H ARG 122 H ARG 122 2.456 14.923 1.986 1053 HA ARG 122 HA ARG 122 3.751 16.350 4.105 1054 HB2 ARG 122 2HB ARG 122 1.751 17.290 2.037 1055 HB3 ARG 122 3HB ARG 122 2.658 18.349 3.112 1056 HG2 ARG 122 2HG ARG 122 4.758 17.548 2.115 1057 HG3 ARG 122 3HG ARG 122 3.835 16.519 1.019 1058 HD2 ARG 122 2HD ARG 122 2.783 18.481 0.029 1059 HD3 ARG 122 3HD ARG 122 3.630 19.531 1.166 1060 HE ARG 122 HE ARG 122 5.016 17.898 -0.866 1061 HH11 ARG 122 1HH1 ARG 122 4.638 20.845 0.886 1062 HH12 ARG 122 2HH1 ARG 122 5.999 21.588 0.123 1063 HH21 ARG 122 1HH2 ARG 122 6.754 18.874 -1.821 1064 HH22 ARG 122 2HH2 ARG 122 7.178 20.496 -1.386 1065 H GLU 123 H GLU 123 0.524 15.105 3.638 1066 HA GLU 123 HA GLU 123 -0.676 16.719 5.722 1067 HB2 GLU 123 2HB GLU 123 -1.754 14.301 4.248 1068 HB3 GLU 123 3HB GLU 123 -2.688 15.350 5.307 1069 HG2 GLU 123 2HG GLU 123 -2.266 17.237 3.779 1070 HG3 GLU 123 3HG GLU 123 -1.382 16.151 2.708 1071 H VAL 124 H VAL 124 -0.064 13.219 5.352 1072 HA VAL 124 HA VAL 124 -0.861 12.569 7.996 1073 HB VAL 124 HB VAL 124 -0.930 10.986 6.059 1074 HG11 VAL 124 1HG1 VAL 124 1.271 11.464 5.103 1075 HG12 VAL 124 2HG1 VAL 124 1.077 9.745 5.436 1076 HG13 VAL 124 3HG1 VAL 124 2.048 10.747 6.515 1077 HG21 VAL 124 3HG2 VAL 124 -0.328 8.994 7.361 1078 HG22 VAL 124 1HG2 VAL 124 -1.189 10.179 8.342 1079 HG23 VAL 124 2HG2 VAL 124 0.559 10.009 8.500 1080 H GLY 125 H GLY 125 2.248 13.417 6.594 1081 HA2 GLY 125 2HA GLY 125 3.708 14.459 8.396 1082 HA3 GLY 125 3HA GLY 125 3.523 12.924 9.227 1083 H SER 126 H SER 126 5.350 14.687 6.968 1084 HA SER 126 HA SER 126 6.530 12.414 5.616 1085 HB2 SER 126 2HB SER 126 7.845 14.021 4.405 1086 HB3 SER 126 3HB SER 126 6.220 14.689 4.551 1087 HG SER 126 HG SER 126 7.495 16.339 5.147 1088 H LEU 127 H LEU 127 9.092 12.599 5.451 1089 HA LEU 127 HA LEU 127 10.266 11.927 7.909 1090 HB2 LEU 127 2HB LEU 127 12.369 11.905 6.779 1091 HB3 LEU 127 3HB LEU 127 11.166 11.306 5.657 1092 HG LEU 127 HG LEU 127 12.303 14.114 5.620 1093 HD11 LEU 127 1HD1 LEU 127 12.940 11.752 3.854 1094 HD12 LEU 127 2HD1 LEU 127 14.012 12.480 5.051 1095 HD13 LEU 127 3HD1 LEU 127 13.526 13.401 3.629 1096 HD21 LEU 127 3HD2 LEU 127 11.246 14.283 3.419 1097 HD22 LEU 127 1HD2 LEU 127 10.050 14.002 4.683 1098 HD23 LEU 127 2HD2 LEU 127 10.543 12.679 3.625 1099 H GLU 128 H GLU 128 9.656 14.987 6.447 1100 HA GLU 128 HA GLU 128 11.419 16.518 8.148 1101 HB2 GLU 128 2HB GLU 128 10.802 17.318 5.910 1102 HB3 GLU 128 3HB GLU 128 9.105 17.339 6.363 1103 HG2 GLU 128 2HG GLU 128 9.528 19.117 7.964 1104 HG3 GLU 128 3HG GLU 128 11.253 19.061 7.595 1105 H HIS 129 H HIS 129 10.977 16.390 10.294 1106 HA HIS 129 HA HIS 129 8.392 15.685 11.268 1107 HB2 HIS 129 2HB HIS 129 10.790 16.652 12.839 1108 HB3 HIS 129 3HB HIS 129 9.386 15.819 13.497 1109 HD1 HIS 129 HD1 HIS 129 9.037 13.292 12.370 1110 HD2 HIS 129 HD2 HIS 129 12.834 14.978 12.244 1111 HE1 HIS 129 HE1 HIS 129 10.604 11.389 11.921 1112 HE2 HIS 129 HE2 HIS 129 12.866 12.455 11.683 1113 H HIS 130 H HIS 130 9.862 18.735 10.654 1114 HA HIS 130 HA HIS 130 9.147 20.886 10.850 1115 HB2 HIS 130 2HB HIS 130 6.474 19.623 11.514 1116 HB3 HIS 130 3HB HIS 130 6.725 21.323 11.138 1117 HD1 HIS 130 HD1 HIS 130 6.201 18.033 9.578 1118 HD2 HIS 130 HD2 HIS 130 7.474 21.804 8.395 1119 HE1 HIS 130 HE1 HIS 130 6.040 18.042 7.077 1120 HE2 HIS 130 HE2 HIS 130 7.059 20.231 6.390 1121 H HIS 131 H HIS 131 7.035 19.531 13.379 1122 HA HIS 131 HA HIS 131 7.623 21.579 15.219 1123 HB2 HIS 131 2HB HIS 131 6.489 20.039 16.903 1124 HB3 HIS 131 3HB HIS 131 5.542 20.504 15.497 1125 HD1 HIS 131 HD1 HIS 131 7.560 17.541 16.764 1126 HD2 HIS 131 HD2 HIS 131 4.498 18.401 14.095 1127 HE1 HIS 131 HE1 HIS 131 6.714 15.318 15.978 1128 HE2 HIS 131 HE2 HIS 131 4.725 15.867 14.542 1129 H HIS 132 H HIS 132 9.716 21.857 15.721 1130 HA HIS 132 HA HIS 132 11.207 19.604 16.913 1131 HB2 HIS 132 2HB HIS 132 13.246 20.994 16.442 1132 HB3 HIS 132 3HB HIS 132 12.367 20.501 15.000 1133 HD1 HIS 132 HD1 HIS 132 13.113 23.530 17.098 1134 HD2 HIS 132 HD2 HIS 132 11.346 22.576 13.464 1135 HE1 HIS 132 HE1 HIS 132 12.714 25.720 15.951 1136 HE2 HIS 132 HE2 HIS 132 11.496 25.127 13.836 1137 H HIS 133 H HIS 133 12.280 19.876 18.895 1138 HA HIS 133 HA HIS 133 11.110 21.862 20.668 1139 HB2 HIS 133 2HB HIS 133 13.036 19.580 21.159 1140 HB3 HIS 133 3HB HIS 133 12.463 20.657 22.427 1141 HD1 HIS 133 HD1 HIS 133 10.924 19.265 23.770 1142 HD2 HIS 133 HD2 HIS 133 10.280 18.769 19.699 1143 HE1 HIS 133 HE1 HIS 133 8.928 17.764 23.586 1144 HE2 HIS 133 HE2 HIS 133 8.698 17.306 21.124 1145 H HIS 134 H HIS 134 14.165 21.275 19.088 1146 HA HIS 134 HA HIS 134 15.651 23.237 20.583 1147 HB2 HIS 134 2HB HIS 134 16.837 21.361 19.642 1148 HB3 HIS 134 3HB HIS 134 16.241 21.730 18.026 1149 HD1 HIS 134 HD1 HIS 134 18.551 23.191 20.662 1150 HD2 HIS 134 HD2 HIS 134 17.856 23.376 16.570 1151 HE1 HIS 134 HE1 HIS 134 20.448 24.535 19.718 1152 HE2 HIS 134 HE2 HIS 134 20.106 24.463 17.225 Start of MODEL 2 1 H1 MET 1 1H MET 1 4.729 8.003 11.993 2 H2 MET 1 2H MET 1 3.115 8.140 11.506 3 H3 MET 1 3H MET 1 4.116 9.499 11.505 4 HA MET 1 HA MET 1 3.776 8.678 9.271 5 HB2 MET 1 2HB MET 1 5.853 9.817 9.708 6 HB3 MET 1 3HB MET 1 6.566 8.364 10.398 7 HG2 MET 1 2HG MET 1 7.400 8.832 8.137 8 HG3 MET 1 3HG MET 1 6.564 7.283 8.230 9 HE1 MET 1 3HE MET 1 6.573 10.899 6.794 10 HE2 MET 1 1HE MET 1 5.222 11.015 7.922 11 HE3 MET 1 2HE MET 1 4.932 11.084 6.183 12 H ASN 2 H ASN 2 2.796 6.898 8.519 13 HA ASN 2 HA ASN 2 4.275 4.587 7.891 14 HB2 ASN 2 2HB ASN 2 3.914 4.049 10.291 15 HB3 ASN 2 3HB ASN 2 2.173 4.151 10.040 16 HD21 ASN 2 1HD2 ASN 2 1.892 1.996 10.661 17 HD22 ASN 2 2HD2 ASN 2 2.349 0.687 9.636 18 H ILE 3 H ILE 3 3.350 3.675 6.109 19 HA ILE 3 HA ILE 3 0.493 3.958 5.612 20 HB ILE 3 HB ILE 3 1.266 6.084 4.803 21 HG12 ILE 3 2HG1 ILE 3 0.871 4.259 2.412 22 HG13 ILE 3 3HG1 ILE 3 -0.427 4.875 3.430 23 HG21 ILE 3 1HG2 ILE 3 3.282 4.588 3.124 24 HG22 ILE 3 2HG2 ILE 3 3.637 5.549 4.560 25 HG23 ILE 3 3HG2 ILE 3 3.008 6.332 3.110 26 HD11 ILE 3 3HD1 ILE 3 -0.237 6.152 1.380 27 HD12 ILE 3 1HD1 ILE 3 1.442 6.539 1.755 28 HD13 ILE 3 2HD1 ILE 3 0.143 7.156 2.779 29 H VAL 4 H VAL 4 -0.315 2.330 4.406 30 HA VAL 4 HA VAL 4 1.583 0.353 3.316 31 HB VAL 4 HB VAL 4 -1.343 -0.014 4.021 32 HG11 VAL 4 1HG1 VAL 4 -0.888 -2.411 3.785 33 HG12 VAL 4 2HG1 VAL 4 0.769 -2.053 3.293 34 HG13 VAL 4 3HG1 VAL 4 -0.583 -1.550 2.276 35 HG21 VAL 4 3HG2 VAL 4 1.133 -0.832 5.555 36 HG22 VAL 4 1HG2 VAL 4 -0.522 -1.285 5.967 37 HG23 VAL 4 2HG2 VAL 4 -0.029 0.408 6.030 38 H ILE 5 H ILE 5 1.712 0.054 1.160 39 HA ILE 5 HA ILE 5 -0.429 1.181 -0.546 40 HB ILE 5 HB ILE 5 2.477 0.737 -1.280 41 HG12 ILE 5 2HG1 ILE 5 1.035 3.341 -0.693 42 HG13 ILE 5 3HG1 ILE 5 2.116 2.530 0.436 43 HG21 ILE 5 1HG2 ILE 5 1.926 2.085 -3.273 44 HG22 ILE 5 2HG2 ILE 5 0.238 2.128 -2.764 45 HG23 ILE 5 3HG2 ILE 5 0.986 0.594 -3.205 46 HD11 ILE 5 3HD1 ILE 5 2.876 3.631 -2.259 47 HD12 ILE 5 1HD1 ILE 5 3.962 2.811 -1.139 48 HD13 ILE 5 2HD1 ILE 5 3.235 4.355 -0.693 49 H VAL 6 H VAL 6 -1.740 -0.454 -1.168 50 HA VAL 6 HA VAL 6 -0.689 -3.124 -1.694 51 HB VAL 6 HB VAL 6 -3.541 -2.111 -1.835 52 HG11 VAL 6 1HG1 VAL 6 -4.141 -4.512 -1.714 53 HG12 VAL 6 2HG1 VAL 6 -2.432 -4.923 -1.860 54 HG13 VAL 6 3HG1 VAL 6 -3.257 -4.101 -3.184 55 HG21 VAL 6 3HG2 VAL 6 -3.840 -3.192 0.346 56 HG22 VAL 6 1HG2 VAL 6 -2.623 -1.917 0.423 57 HG23 VAL 6 2HG2 VAL 6 -2.125 -3.610 0.380 58 H VAL 7 H VAL 7 0.162 -3.494 -3.651 59 HA VAL 7 HA VAL 7 -0.946 -2.129 -6.018 60 HB VAL 7 HB VAL 7 1.715 -3.548 -5.703 61 HG11 VAL 7 1HG1 VAL 7 0.626 -1.890 -7.985 62 HG12 VAL 7 2HG1 VAL 7 0.968 -3.621 -8.007 63 HG13 VAL 7 3HG1 VAL 7 2.288 -2.464 -7.852 64 HG21 VAL 7 3HG2 VAL 7 1.111 -0.586 -5.791 65 HG22 VAL 7 1HG2 VAL 7 2.715 -1.319 -5.711 66 HG23 VAL 7 2HG2 VAL 7 1.595 -1.498 -4.360 67 H PHE 8 H PHE 8 -2.319 -3.294 -7.233 68 HA PHE 8 HA PHE 8 -2.302 -6.203 -7.194 69 HB2 PHE 8 2HB PHE 8 -4.094 -4.161 -8.510 70 HB3 PHE 8 3HB PHE 8 -4.241 -5.881 -8.847 71 HD1 PHE 8 HD2 PHE 8 -4.329 -3.401 -6.072 72 HD2 PHE 8 HD1 PHE 8 -5.503 -7.259 -7.453 73 HE1 PHE 8 HE2 PHE 8 -5.772 -3.672 -4.097 74 HE2 PHE 8 HE1 PHE 8 -6.948 -7.528 -5.480 75 HZ PHE 8 HZ PHE 8 -7.082 -5.734 -3.799 76 H SER 9 H SER 9 -0.590 -3.928 -8.903 77 HA SER 9 HA SER 9 -0.499 -5.408 -11.416 78 HB2 SER 9 2HB SER 9 -0.388 -2.950 -11.511 79 HB3 SER 9 3HB SER 9 1.080 -2.970 -10.535 80 HG SER 9 HG SER 9 0.718 -3.986 -13.164 81 H THR 10 H THR 10 0.584 -7.281 -11.328 82 HA THR 10 HA THR 10 2.624 -7.906 -9.472 83 HB THR 10 HB THR 10 2.990 -9.947 -10.849 84 HG1 THR 10 HG1 THR 10 2.589 -9.514 -12.926 85 HG21 THR 10 3HG2 THR 10 0.739 -10.892 -10.553 86 HG22 THR 10 1HG2 THR 10 0.085 -9.268 -10.339 87 HG23 THR 10 2HG2 THR 10 1.218 -9.926 -9.156 88 H ASP 11 H ASP 11 2.758 -6.289 -12.501 89 HA ASP 11 HA ASP 11 5.342 -6.956 -13.369 90 HB2 ASP 11 2HB ASP 11 3.781 -4.391 -13.758 91 HB3 ASP 11 3HB ASP 11 5.234 -4.832 -14.651 92 H GLU 12 H GLU 12 7.118 -6.796 -12.100 93 HA GLU 12 HA GLU 12 7.587 -5.014 -10.020 94 HB2 GLU 12 2HB GLU 12 8.995 -6.993 -10.445 95 HB3 GLU 12 3HB GLU 12 9.645 -6.225 -11.889 96 HG2 GLU 12 2HG GLU 12 10.535 -4.398 -10.432 97 HG3 GLU 12 3HG GLU 12 10.010 -5.332 -9.032 98 H GLU 13 H GLU 13 7.966 -4.563 -13.476 99 HA GLU 13 HA GLU 13 9.446 -2.190 -13.489 100 HB2 GLU 13 2HB GLU 13 8.800 -3.631 -15.480 101 HB3 GLU 13 3HB GLU 13 7.229 -2.839 -15.440 102 HG2 GLU 13 2HG GLU 13 8.699 -1.814 -17.089 103 HG3 GLU 13 3HG GLU 13 8.293 -0.676 -15.804 104 H THR 14 H THR 14 5.897 -2.629 -13.389 105 HA THR 14 HA THR 14 5.180 0.082 -13.192 106 HB THR 14 HB THR 14 3.776 -2.266 -11.871 107 HG1 THR 14 HG1 THR 14 2.774 -2.595 -13.768 108 HG21 THR 14 3HG2 THR 14 1.762 -0.853 -12.045 109 HG22 THR 14 1HG2 THR 14 2.754 0.472 -12.655 110 HG23 THR 14 2HG2 THR 14 2.989 -0.123 -11.009 111 H LEU 15 H LEU 15 5.850 -2.313 -10.655 112 HA LEU 15 HA LEU 15 5.587 -0.649 -8.419 113 HB2 LEU 15 2HB LEU 15 5.718 -3.070 -8.246 114 HB3 LEU 15 3HB LEU 15 7.356 -3.057 -8.871 115 HG LEU 15 HG LEU 15 8.112 -1.860 -6.841 116 HD11 LEU 15 1HD1 LEU 15 6.049 -0.705 -6.269 117 HD12 LEU 15 2HD1 LEU 15 6.620 -1.669 -4.909 118 HD13 LEU 15 3HD1 LEU 15 5.271 -2.243 -5.891 119 HD21 LEU 15 3HD2 LEU 15 8.283 -4.276 -6.915 120 HD22 LEU 15 1HD2 LEU 15 6.627 -4.437 -6.329 121 HD23 LEU 15 2HD2 LEU 15 7.869 -3.751 -5.284 122 H ARG 16 H ARG 16 8.291 -1.094 -10.634 123 HA ARG 16 HA ARG 16 10.354 0.021 -9.111 124 HB2 ARG 16 2HB ARG 16 10.226 -1.100 -11.571 125 HB3 ARG 16 3HB ARG 16 10.377 0.590 -12.032 126 HG2 ARG 16 2HG ARG 16 12.421 0.742 -10.634 127 HG3 ARG 16 3HG ARG 16 12.280 -0.985 -10.301 128 HD2 ARG 16 2HD ARG 16 12.864 0.378 -12.919 129 HD3 ARG 16 3HD ARG 16 13.845 -0.807 -12.059 130 HE ARG 16 HE ARG 16 11.715 -1.324 -13.894 131 HH11 ARG 16 1HH1 ARG 16 13.351 -2.620 -11.143 132 HH12 ARG 16 2HH1 ARG 16 12.966 -4.258 -11.550 133 HH21 ARG 16 1HH2 ARG 16 11.275 -3.426 -14.434 134 HH22 ARG 16 2HH2 ARG 16 11.812 -4.710 -13.403 135 H LYS 17 H LYS 17 7.906 1.573 -11.133 136 HA LYS 17 HA LYS 17 8.859 4.229 -10.945 137 HB2 LYS 17 2HB LYS 17 6.127 3.044 -11.424 138 HB3 LYS 17 3HB LYS 17 6.330 4.780 -11.249 139 HG2 LYS 17 2HG LYS 17 6.279 4.153 -13.590 140 HG3 LYS 17 3HG LYS 17 7.856 4.809 -13.157 141 HD2 LYS 17 2HD LYS 17 8.777 2.550 -13.026 142 HD3 LYS 17 3HD LYS 17 7.196 1.869 -13.411 143 HE2 LYS 17 2HE LYS 17 8.660 1.925 -15.379 144 HE3 LYS 17 3HE LYS 17 7.242 2.951 -15.598 145 HZ1 LYS 17 3HZ LYS 17 8.606 4.878 -15.031 146 HZ2 LYS 17 1HZ LYS 17 9.236 4.055 -16.368 147 HZ3 LYS 17 2HZ LYS 17 9.964 3.881 -14.853 148 H PHE 18 H PHE 18 6.495 2.452 -8.956 149 HA PHE 18 HA PHE 18 5.903 4.450 -7.094 150 HB2 PHE 18 2HB PHE 18 5.957 1.436 -6.816 151 HB3 PHE 18 3HB PHE 18 5.401 2.497 -5.526 152 HD1 PHE 18 HD1 PHE 18 4.807 1.924 -9.180 153 HD2 PHE 18 HD2 PHE 18 3.143 2.913 -5.385 154 HE1 PHE 18 HE1 PHE 18 2.559 1.951 -10.175 155 HE2 PHE 18 HE2 PHE 18 0.895 2.942 -6.378 156 HZ PHE 18 HZ PHE 18 0.602 2.459 -8.773 157 H LYS 19 H LYS 19 8.459 1.974 -6.990 158 HA LYS 19 HA LYS 19 9.559 2.633 -4.503 159 HB2 LYS 19 2HB LYS 19 11.072 1.629 -6.931 160 HB3 LYS 19 3HB LYS 19 11.579 1.487 -5.254 161 HG2 LYS 19 2HG LYS 19 9.621 0.034 -4.820 162 HG3 LYS 19 3HG LYS 19 9.201 0.137 -6.528 163 HD2 LYS 19 2HD LYS 19 10.358 -1.871 -6.434 164 HD3 LYS 19 3HD LYS 19 11.621 -0.744 -6.924 165 HE2 LYS 19 2HE LYS 19 11.123 -1.661 -4.087 166 HE3 LYS 19 3HE LYS 19 12.345 -2.333 -5.162 167 HZ1 LYS 19 3HZ LYS 19 13.259 -0.703 -3.627 168 HZ2 LYS 19 1HZ LYS 19 12.242 0.491 -4.256 169 HZ3 LYS 19 2HZ LYS 19 13.436 -0.202 -5.230 170 H ASP 20 H ASP 20 10.343 3.877 -7.743 171 HA ASP 20 HA ASP 20 12.439 5.589 -6.955 172 HB2 ASP 20 2HB ASP 20 12.096 4.897 -9.280 173 HB3 ASP 20 3HB ASP 20 10.576 5.787 -9.335 174 H ILE 21 H ILE 21 8.937 6.161 -7.277 175 HA ILE 21 HA ILE 21 8.968 8.937 -6.803 176 HB ILE 21 HB ILE 21 6.800 6.916 -6.166 177 HG12 ILE 21 2HG1 ILE 21 7.141 8.789 -8.533 178 HG13 ILE 21 3HG1 ILE 21 7.459 7.059 -8.562 179 HG21 ILE 21 1HG2 ILE 21 6.491 8.971 -4.861 180 HG22 ILE 21 2HG2 ILE 21 5.253 8.822 -6.108 181 HG23 ILE 21 3HG2 ILE 21 6.605 9.932 -6.334 182 HD11 ILE 21 3HD1 ILE 21 4.794 8.379 -8.112 183 HD12 ILE 21 1HD1 ILE 21 5.086 6.640 -8.069 184 HD13 ILE 21 2HD1 ILE 21 5.325 7.539 -9.567 185 H ILE 22 H ILE 22 8.567 6.219 -4.523 186 HA ILE 22 HA ILE 22 8.384 7.707 -2.152 187 HB ILE 22 HB ILE 22 9.586 4.956 -2.567 188 HG12 ILE 22 2HG1 ILE 22 6.793 5.793 -1.719 189 HG13 ILE 22 3HG1 ILE 22 7.231 5.165 -3.304 190 HG21 ILE 22 1HG2 ILE 22 10.314 5.909 -0.439 191 HG22 ILE 22 2HG2 ILE 22 9.173 4.592 -0.176 192 HG23 ILE 22 3HG2 ILE 22 8.639 6.264 -0.012 193 HD11 ILE 22 3HD1 ILE 22 7.408 3.676 -0.693 194 HD12 ILE 22 1HD1 ILE 22 7.878 3.041 -2.272 195 HD13 ILE 22 2HD1 ILE 22 6.193 3.453 -1.951 196 H LYS 23 H LYS 23 11.264 6.354 -3.773 197 HA LYS 23 HA LYS 23 13.242 7.346 -2.058 198 HB2 LYS 23 2HB LYS 23 13.319 6.953 -5.063 199 HB3 LYS 23 3HB LYS 23 14.735 7.259 -4.069 200 HG2 LYS 23 2HG LYS 23 14.477 5.168 -2.930 201 HG3 LYS 23 3HG LYS 23 12.915 4.886 -3.700 202 HD2 LYS 23 2HD LYS 23 14.671 3.562 -4.775 203 HD3 LYS 23 3HD LYS 23 14.008 4.755 -5.892 204 HE2 LYS 23 2HE LYS 23 15.941 6.237 -5.360 205 HE3 LYS 23 3HE LYS 23 16.615 4.937 -4.378 206 HZ1 LYS 23 3HZ LYS 23 17.612 4.901 -6.534 207 HZ2 LYS 23 1HZ LYS 23 16.106 4.869 -7.301 208 HZ3 LYS 23 2HZ LYS 23 16.622 3.541 -6.394 209 H LYS 24 H LYS 24 11.600 8.865 -4.785 210 HA LYS 24 HA LYS 24 13.150 11.246 -4.841 211 HB2 LYS 24 2HB LYS 24 11.832 10.299 -6.740 212 HB3 LYS 24 3HB LYS 24 10.357 10.765 -5.908 213 HG2 LYS 24 2HG LYS 24 10.860 13.086 -6.148 214 HG3 LYS 24 3HG LYS 24 12.490 12.733 -6.729 215 HD2 LYS 24 2HD LYS 24 9.910 12.025 -8.146 216 HD3 LYS 24 3HD LYS 24 10.998 13.346 -8.578 217 HE2 LYS 24 2HE LYS 24 12.783 11.725 -9.041 218 HE3 LYS 24 3HE LYS 24 11.700 10.404 -8.602 219 HZ1 LYS 24 3HZ LYS 24 10.247 11.082 -10.441 220 HZ2 LYS 24 1HZ LYS 24 11.791 10.647 -10.977 221 HZ3 LYS 24 2HZ LYS 24 11.360 12.276 -10.879 222 H ASN 25 H ASN 25 10.546 10.213 -2.822 223 HA ASN 25 HA ASN 25 10.021 12.928 -1.860 224 HB2 ASN 25 2HB ASN 25 8.827 10.246 -1.143 225 HB3 ASN 25 3HB ASN 25 8.462 11.712 -0.241 226 HD21 ASN 25 1HD2 ASN 25 8.945 11.490 -3.726 227 HD22 ASN 25 2HD2 ASN 25 7.331 11.932 -4.143 228 H GLY 26 H GLY 26 12.055 10.265 -1.124 229 HA2 GLY 26 2HA GLY 26 13.971 10.556 0.249 230 HA3 GLY 26 3HA GLY 26 13.102 11.758 1.184 231 H PHE 27 H PHE 27 11.649 8.664 0.416 232 HA PHE 27 HA PHE 27 12.099 7.788 3.205 233 HB2 PHE 27 2HB PHE 27 9.658 7.364 1.460 234 HB3 PHE 27 3HB PHE 27 9.905 6.590 3.023 235 HD1 PHE 27 HD2 PHE 27 9.347 9.821 1.331 236 HD2 PHE 27 HD1 PHE 27 9.541 7.771 5.061 237 HE1 PHE 27 HE2 PHE 27 8.359 11.773 2.454 238 HE2 PHE 27 HE1 PHE 27 8.548 9.719 6.186 239 HZ PHE 27 HZ PHE 27 7.956 11.723 4.883 240 H LYS 28 H LYS 28 12.007 5.395 3.516 241 HA LYS 28 HA LYS 28 13.558 4.079 1.419 242 HB2 LYS 28 2HB LYS 28 12.758 2.854 4.060 243 HB3 LYS 28 3HB LYS 28 14.138 2.450 3.047 244 HG2 LYS 28 2HG LYS 28 13.770 4.983 4.647 245 HG3 LYS 28 3HG LYS 28 14.847 3.643 5.036 246 HD2 LYS 28 2HD LYS 28 15.060 5.304 2.519 247 HD3 LYS 28 3HD LYS 28 15.967 5.631 3.995 248 HE2 LYS 28 2HE LYS 28 16.946 3.350 3.834 249 HE3 LYS 28 3HE LYS 28 16.122 3.143 2.289 250 HZ1 LYS 28 3HZ LYS 28 17.382 4.929 1.361 251 HZ2 LYS 28 1HZ LYS 28 18.462 3.850 2.085 252 HZ3 LYS 28 2HZ LYS 28 18.079 5.307 2.857 253 H VAL 29 H VAL 29 12.964 1.979 0.545 254 HA VAL 29 HA VAL 29 10.028 1.697 0.362 255 HB VAL 29 HB VAL 29 12.078 0.785 -1.669 256 HG11 VAL 29 1HG1 VAL 29 9.982 -0.467 -1.745 257 HG12 VAL 29 2HG1 VAL 29 10.145 0.566 -3.164 258 HG13 VAL 29 3HG1 VAL 29 9.070 1.041 -1.849 259 HG21 VAL 29 3HG2 VAL 29 10.367 3.280 -1.670 260 HG22 VAL 29 1HG2 VAL 29 11.369 2.727 -3.011 261 HG23 VAL 29 2HG2 VAL 29 12.121 3.218 -1.493 262 H ARG 30 H ARG 30 9.229 0.011 1.456 263 HA ARG 30 HA ARG 30 10.776 -2.501 1.623 264 HB2 ARG 30 2HB ARG 30 10.114 -1.619 3.782 265 HB3 ARG 30 3HB ARG 30 8.447 -1.460 3.254 266 HG2 ARG 30 2HG ARG 30 8.725 -3.366 4.734 267 HG3 ARG 30 3HG ARG 30 8.242 -3.891 3.122 268 HD2 ARG 30 2HD ARG 30 10.483 -4.590 2.610 269 HD3 ARG 30 3HD ARG 30 11.101 -3.875 4.099 270 HE ARG 30 HE ARG 30 9.312 -5.645 5.019 271 HH11 ARG 30 1HH1 ARG 30 11.784 -6.028 2.650 272 HH12 ARG 30 2HH1 ARG 30 12.149 -7.644 3.146 273 HH21 ARG 30 1HH2 ARG 30 9.766 -7.734 5.607 274 HH22 ARG 30 2HH2 ARG 30 11.013 -8.600 4.783 275 H THR 31 H THR 31 10.278 -3.777 -0.099 276 HA THR 31 HA THR 31 7.567 -3.780 -1.186 277 HB THR 31 HB THR 31 8.534 -5.315 -2.929 278 HG1 THR 31 HG1 THR 31 10.299 -6.203 -1.893 279 HG21 THR 31 3HG2 THR 31 9.823 -3.564 -4.061 280 HG22 THR 31 1HG2 THR 31 9.955 -2.672 -2.545 281 HG23 THR 31 2HG2 THR 31 8.378 -2.895 -3.304 282 H VAL 32 H VAL 32 6.090 -5.312 -0.851 283 HA VAL 32 HA VAL 32 6.895 -7.814 0.500 284 HB VAL 32 HB VAL 32 4.271 -6.317 0.748 285 HG11 VAL 32 1HG1 VAL 32 3.913 -8.718 0.889 286 HG12 VAL 32 2HG1 VAL 32 3.703 -7.973 2.474 287 HG13 VAL 32 3HG1 VAL 32 5.183 -8.857 2.105 288 HG21 VAL 32 3HG2 VAL 32 6.077 -5.196 1.939 289 HG22 VAL 32 1HG2 VAL 32 6.502 -6.703 2.754 290 HG23 VAL 32 2HG2 VAL 32 4.949 -5.931 3.079 291 H ARG 33 H ARG 33 6.289 -9.713 -0.387 292 HA ARG 33 HA ARG 33 4.220 -9.727 -2.504 293 HB2 ARG 33 2HB ARG 33 6.471 -10.009 -3.486 294 HB3 ARG 33 3HB ARG 33 6.766 -11.377 -2.421 295 HG2 ARG 33 2HG ARG 33 6.210 -12.150 -4.644 296 HG3 ARG 33 3HG ARG 33 4.939 -12.609 -3.510 297 HD2 ARG 33 2HD ARG 33 3.571 -10.726 -4.272 298 HD3 ARG 33 3HD ARG 33 4.848 -10.239 -5.386 299 HE ARG 33 HE ARG 33 4.272 -12.835 -6.053 300 HH11 ARG 33 1HH1 ARG 33 2.465 -9.919 -5.797 301 HH12 ARG 33 2HH1 ARG 33 1.350 -10.363 -7.039 302 HH21 ARG 33 1HH2 ARG 33 2.844 -13.415 -7.647 303 HH22 ARG 33 2HH2 ARG 33 1.564 -12.339 -8.091 304 H SER 34 H SER 34 5.907 -11.523 0.004 305 HA SER 34 HA SER 34 3.609 -13.351 0.318 306 HB2 SER 34 2HB SER 34 6.497 -13.685 1.211 307 HB3 SER 34 3HB SER 34 5.206 -14.852 1.491 308 HG SER 34 HG SER 34 6.402 -14.087 -0.959 309 HA PRO 35 HA PRO 35 2.506 -11.680 4.270 310 HB2 PRO 35 2HB PRO 35 2.483 -13.943 5.897 311 HB3 PRO 35 3HB PRO 35 1.156 -13.418 4.858 312 HG2 PRO 35 2HG PRO 35 3.267 -15.477 4.343 313 HG3 PRO 35 3HG PRO 35 1.539 -15.518 3.942 314 HD2 PRO 35 2HD PRO 35 3.381 -14.997 2.072 315 HD3 PRO 35 3HD PRO 35 1.819 -14.149 2.072 316 H GLN 36 H GLN 36 5.317 -13.822 4.229 317 HA GLN 36 HA GLN 36 6.400 -13.226 6.737 318 HB2 GLN 36 2HB GLN 36 7.221 -15.054 5.311 319 HB3 GLN 36 3HB GLN 36 7.872 -13.885 4.172 320 HG2 GLN 36 2HG GLN 36 9.638 -14.787 5.553 321 HG3 GLN 36 3HG GLN 36 9.419 -13.071 5.892 322 HE21 GLN 36 1HE2 GLN 36 10.371 -13.244 7.916 323 HE22 GLN 36 2HE2 GLN 36 9.586 -14.010 9.250 324 H GLU 37 H GLU 37 7.043 -11.588 3.595 325 HA GLU 37 HA GLU 37 8.911 -9.738 4.528 326 HB2 GLU 37 2HB GLU 37 6.875 -9.415 2.317 327 HB3 GLU 37 3HB GLU 37 8.144 -8.246 2.643 328 HG2 GLU 37 2HG GLU 37 9.024 -9.500 0.915 329 HG3 GLU 37 3HG GLU 37 9.764 -10.221 2.340 330 H LEU 38 H LEU 38 5.375 -9.479 4.494 331 HA LEU 38 HA LEU 38 5.206 -6.824 5.439 332 HB2 LEU 38 2HB LEU 38 3.334 -8.019 4.377 333 HB3 LEU 38 3HB LEU 38 3.229 -9.091 5.760 334 HG LEU 38 HG LEU 38 2.618 -7.165 7.193 335 HD11 LEU 38 1HD1 LEU 38 3.738 -5.402 5.909 336 HD12 LEU 38 2HD1 LEU 38 2.041 -5.022 6.199 337 HD13 LEU 38 3HD1 LEU 38 2.558 -5.597 4.612 338 HD21 LEU 38 3HD2 LEU 38 0.860 -8.538 6.206 339 HD22 LEU 38 1HD2 LEU 38 0.860 -7.525 4.762 340 HD23 LEU 38 2HD2 LEU 38 0.351 -6.853 6.311 341 H LYS 39 H LYS 39 4.959 -9.918 7.208 342 HA LYS 39 HA LYS 39 4.680 -8.776 9.779 343 HB2 LYS 39 2HB LYS 39 4.083 -11.108 9.234 344 HB3 LYS 39 3HB LYS 39 5.786 -11.491 9.019 345 HG2 LYS 39 2HG LYS 39 6.224 -11.067 11.354 346 HG3 LYS 39 3HG LYS 39 4.562 -10.527 11.603 347 HD2 LYS 39 2HD LYS 39 3.782 -12.798 10.944 348 HD3 LYS 39 3HD LYS 39 5.469 -13.309 10.844 349 HE2 LYS 39 2HE LYS 39 5.779 -12.838 13.210 350 HE3 LYS 39 3HE LYS 39 4.129 -12.224 13.326 351 HZ1 LYS 39 3HZ LYS 39 3.357 -14.461 12.664 352 HZ2 LYS 39 1HZ LYS 39 4.180 -14.450 14.142 353 HZ3 LYS 39 2HZ LYS 39 4.951 -15.013 12.745 354 H ASP 40 H ASP 40 7.556 -10.286 8.285 355 HA ASP 40 HA ASP 40 9.453 -9.645 10.197 356 HB2 ASP 40 2HB ASP 40 9.955 -11.157 8.385 357 HB3 ASP 40 3HB ASP 40 9.729 -9.883 7.192 358 H SER 41 H SER 41 8.134 -7.613 7.629 359 HA SER 41 HA SER 41 9.870 -5.420 7.807 360 HB2 SER 41 2HB SER 41 8.113 -5.633 6.070 361 HB3 SER 41 3HB SER 41 6.879 -5.362 7.299 362 HG SER 41 HG SER 41 7.271 -3.295 7.218 363 H ILE 42 H ILE 42 6.793 -5.982 9.523 364 HA ILE 42 HA ILE 42 6.855 -3.709 11.166 365 HB ILE 42 HB ILE 42 5.633 -6.405 11.812 366 HG12 ILE 42 2HG1 ILE 42 4.388 -4.012 10.427 367 HG13 ILE 42 3HG1 ILE 42 4.925 -5.475 9.610 368 HG21 ILE 42 1HG2 ILE 42 5.003 -3.641 12.868 369 HG22 ILE 42 2HG2 ILE 42 5.744 -4.965 13.770 370 HG23 ILE 42 3HG2 ILE 42 4.075 -5.102 13.216 371 HD11 ILE 42 3HD1 ILE 42 2.517 -5.450 9.940 372 HD12 ILE 42 1HD1 ILE 42 2.749 -5.325 11.683 373 HD13 ILE 42 2HD1 ILE 42 3.270 -6.776 10.826 374 H GLU 43 H GLU 43 8.137 -6.978 11.704 375 HA GLU 43 HA GLU 43 8.959 -6.753 14.355 376 HB2 GLU 43 2HB GLU 43 10.362 -8.269 12.140 377 HB3 GLU 43 3HB GLU 43 10.543 -8.560 13.864 378 HG2 GLU 43 2HG GLU 43 8.044 -8.969 12.227 379 HG3 GLU 43 3HG GLU 43 9.099 -10.223 12.871 380 H GLU 44 H GLU 44 10.536 -5.616 11.424 381 HA GLU 44 HA GLU 44 12.919 -4.757 12.848 382 HB2 GLU 44 2HB GLU 44 12.084 -4.353 9.966 383 HB3 GLU 44 3HB GLU 44 13.654 -3.928 10.633 384 HG2 GLU 44 2HG GLU 44 12.518 -6.721 10.527 385 HG3 GLU 44 3HG GLU 44 13.672 -6.049 9.377 386 H LEU 45 H LEU 45 10.251 -3.160 11.084 387 HA LEU 45 HA LEU 45 11.084 -0.528 11.318 388 HB2 LEU 45 2HB LEU 45 8.252 -1.582 11.297 389 HB3 LEU 45 3HB LEU 45 8.696 0.094 11.034 390 HG LEU 45 HG LEU 45 9.418 -2.240 9.250 391 HD11 LEU 45 1HD1 LEU 45 7.959 -1.130 7.618 392 HD12 LEU 45 2HD1 LEU 45 7.523 0.072 8.834 393 HD13 LEU 45 3HD1 LEU 45 7.081 -1.619 9.068 394 HD21 LEU 45 3HD2 LEU 45 10.368 -0.577 7.737 395 HD22 LEU 45 1HD2 LEU 45 11.208 -0.570 9.286 396 HD23 LEU 45 2HD2 LEU 45 10.040 0.697 8.911 397 H VAL 46 H VAL 46 9.277 -2.451 13.692 398 HA VAL 46 HA VAL 46 8.598 -0.354 15.442 399 HB VAL 46 HB VAL 46 7.619 -2.608 15.608 400 HG11 VAL 46 1HG1 VAL 46 8.827 -4.443 16.671 401 HG12 VAL 46 2HG1 VAL 46 10.281 -3.449 16.755 402 HG13 VAL 46 3HG1 VAL 46 9.634 -3.932 15.187 403 HG21 VAL 46 3HG2 VAL 46 8.985 -1.685 18.141 404 HG22 VAL 46 1HG2 VAL 46 7.610 -2.789 18.066 405 HG23 VAL 46 2HG2 VAL 46 7.432 -1.122 17.522 406 H LYS 47 H LYS 47 11.620 -2.000 14.929 407 HA LYS 47 HA LYS 47 12.803 -0.857 17.369 408 HB2 LYS 47 2HB LYS 47 13.921 -2.880 15.412 409 HB3 LYS 47 3HB LYS 47 14.709 -2.350 16.892 410 HG2 LYS 47 2HG LYS 47 12.061 -3.788 16.763 411 HG3 LYS 47 3HG LYS 47 13.616 -4.548 17.104 412 HD2 LYS 47 2HD LYS 47 13.867 -3.188 19.113 413 HD3 LYS 47 3HD LYS 47 12.353 -2.351 18.761 414 HE2 LYS 47 2HE LYS 47 11.101 -4.397 19.057 415 HE3 LYS 47 3HE LYS 47 12.588 -5.324 19.252 416 HZ1 LYS 47 3HZ LYS 47 11.528 -4.853 21.370 417 HZ2 LYS 47 1HZ LYS 47 11.643 -3.192 21.087 418 HZ3 LYS 47 2HZ LYS 47 13.045 -4.115 21.281 419 H LYS 48 H LYS 48 13.143 -0.800 13.849 420 HA LYS 48 HA LYS 48 14.848 1.542 13.917 421 HB2 LYS 48 2HB LYS 48 16.381 -0.382 14.346 422 HB3 LYS 48 3HB LYS 48 15.886 -1.088 12.818 423 HG2 LYS 48 2HG LYS 48 16.852 0.810 11.617 424 HG3 LYS 48 3HG LYS 48 17.329 1.542 13.153 425 HD2 LYS 48 2HD LYS 48 18.765 -0.387 13.635 426 HD3 LYS 48 3HD LYS 48 18.278 -1.137 12.115 427 HE2 LYS 48 2HE LYS 48 20.445 -0.109 11.848 428 HE3 LYS 48 3HE LYS 48 19.257 0.775 10.893 429 HZ1 LYS 48 3HZ LYS 48 19.147 2.432 12.665 430 HZ2 LYS 48 1HZ LYS 48 20.715 2.285 12.050 431 HZ3 LYS 48 2HZ LYS 48 20.327 1.592 13.542 432 H TYR 49 H TYR 49 15.321 2.352 11.693 433 HA TYR 49 HA TYR 49 14.835 2.838 9.522 434 HB2 TYR 49 2HB TYR 49 13.722 0.020 9.482 435 HB3 TYR 49 3HB TYR 49 13.865 1.041 8.057 436 HD1 TYR 49 HD2 TYR 49 16.258 1.944 7.534 437 HD2 TYR 49 HD1 TYR 49 15.481 -1.399 10.056 438 HE1 TYR 49 HE2 TYR 49 18.555 1.148 7.180 439 HE2 TYR 49 HE1 TYR 49 17.779 -2.203 9.710 440 HH TYR 49 HH TYR 49 19.590 -1.963 8.045 441 H ASN 50 H ASN 50 13.059 3.762 11.483 442 HA ASN 50 HA ASN 50 10.335 3.197 10.853 443 HB2 ASN 50 2HB ASN 50 11.592 5.441 12.436 444 HB3 ASN 50 3HB ASN 50 9.853 5.187 12.308 445 HD21 ASN 50 1HD2 ASN 50 8.947 3.327 13.251 446 HD22 ASN 50 2HD2 ASN 50 9.780 2.437 14.470 447 H ALA 51 H ALA 51 12.531 4.911 9.050 448 HA ALA 51 HA ALA 51 10.545 6.783 7.951 449 HB1 ALA 51 3HB ALA 51 12.803 7.628 8.446 450 HB2 ALA 51 1HB ALA 51 12.407 7.765 6.733 451 HB3 ALA 51 2HB ALA 51 13.477 6.478 7.290 452 H THR 52 H THR 52 10.261 3.895 7.539 453 HA THR 52 HA THR 52 10.798 3.632 4.640 454 HB THR 52 HB THR 52 10.365 1.405 6.654 455 HG1 THR 52 HG1 THR 52 12.391 1.857 7.098 456 HG21 THR 52 3HG2 THR 52 11.260 1.300 3.762 457 HG22 THR 52 1HG2 THR 52 9.679 0.798 4.370 458 HG23 THR 52 2HG2 THR 52 11.130 -0.076 4.857 459 H ILE 53 H ILE 53 9.143 3.368 3.258 460 HA ILE 53 HA ILE 53 6.407 3.082 4.280 461 HB ILE 53 HB ILE 53 7.436 3.769 1.512 462 HG12 ILE 53 2HG1 ILE 53 6.061 5.455 3.629 463 HG13 ILE 53 3HG1 ILE 53 7.750 5.571 3.147 464 HG21 ILE 53 1HG2 ILE 53 5.089 4.247 0.934 465 HG22 ILE 53 2HG2 ILE 53 4.583 3.619 2.502 466 HG23 ILE 53 3HG2 ILE 53 5.341 2.547 1.326 467 HD11 ILE 53 3HD1 ILE 53 7.027 6.274 0.900 468 HD12 ILE 53 1HD1 ILE 53 6.478 7.364 2.173 469 HD13 ILE 53 2HD1 ILE 53 5.351 6.218 1.450 470 H VAL 54 H VAL 54 5.155 1.285 3.891 471 HA VAL 54 HA VAL 54 6.552 -1.017 2.717 472 HB VAL 54 HB VAL 54 5.845 -1.381 4.990 473 HG11 VAL 54 1HG1 VAL 54 3.026 -0.782 4.082 474 HG12 VAL 54 2HG1 VAL 54 4.025 0.248 5.107 475 HG13 VAL 54 3HG1 VAL 54 3.505 -1.333 5.688 476 HG21 VAL 54 3HG2 VAL 54 5.754 -3.311 3.505 477 HG22 VAL 54 1HG2 VAL 54 4.090 -2.920 3.067 478 HG23 VAL 54 2HG2 VAL 54 4.476 -3.408 4.717 479 H VAL 55 H VAL 55 6.054 -1.640 0.743 480 HA VAL 55 HA VAL 55 3.383 -1.049 -0.370 481 HB VAL 55 HB VAL 55 5.951 -1.598 -1.887 482 HG11 VAL 55 1HG1 VAL 55 4.687 -0.773 -3.835 483 HG12 VAL 55 2HG1 VAL 55 3.240 -0.652 -2.834 484 HG13 VAL 55 3HG1 VAL 55 3.971 -2.228 -3.144 485 HG21 VAL 55 3HG2 VAL 55 4.562 1.038 -1.361 486 HG22 VAL 55 1HG2 VAL 55 5.959 0.802 -2.415 487 HG23 VAL 55 2HG2 VAL 55 6.105 0.522 -0.679 488 H VAL 56 H VAL 56 2.095 -2.799 -0.327 489 HA VAL 56 HA VAL 56 3.247 -5.489 -0.464 490 HB VAL 56 HB VAL 56 0.382 -4.684 0.100 491 HG11 VAL 56 1HG1 VAL 56 1.817 -7.320 0.462 492 HG12 VAL 56 2HG1 VAL 56 0.554 -6.963 -0.718 493 HG13 VAL 56 3HG1 VAL 56 0.174 -6.972 1.003 494 HG21 VAL 56 3HG2 VAL 56 0.903 -5.119 2.465 495 HG22 VAL 56 1HG2 VAL 56 1.867 -3.791 1.817 496 HG23 VAL 56 2HG2 VAL 56 2.595 -5.382 2.040 497 H VAL 57 H VAL 57 3.618 -6.054 -2.566 498 HA VAL 57 HA VAL 57 1.688 -5.454 -4.656 499 HB VAL 57 HB VAL 57 4.223 -7.107 -4.838 500 HG11 VAL 57 1HG1 VAL 57 4.036 -6.726 -7.253 501 HG12 VAL 57 2HG1 VAL 57 2.523 -5.855 -7.006 502 HG13 VAL 57 3HG1 VAL 57 2.620 -7.577 -6.635 503 HG21 VAL 57 3HG2 VAL 57 4.699 -4.810 -4.136 504 HG22 VAL 57 1HG2 VAL 57 3.760 -4.190 -5.495 505 HG23 VAL 57 2HG2 VAL 57 5.248 -5.091 -5.787 506 H VAL 58 H VAL 58 -0.142 -6.613 -4.428 507 HA VAL 58 HA VAL 58 -0.095 -9.342 -3.470 508 HB VAL 58 HB VAL 58 -2.553 -9.222 -3.579 509 HG11 VAL 58 1HG1 VAL 58 -2.854 -7.441 -1.900 510 HG12 VAL 58 2HG1 VAL 58 -1.249 -6.820 -2.287 511 HG13 VAL 58 3HG1 VAL 58 -1.425 -8.424 -1.578 512 HG21 VAL 58 3HG2 VAL 58 -2.777 -7.819 -5.577 513 HG22 VAL 58 1HG2 VAL 58 -2.117 -6.442 -4.695 514 HG23 VAL 58 2HG2 VAL 58 -3.670 -7.133 -4.221 515 H ASP 59 H ASP 59 -2.079 -10.620 -4.723 516 HA ASP 59 HA ASP 59 -1.538 -10.720 -7.584 517 HB2 ASP 59 2HB ASP 59 0.241 -12.093 -6.490 518 HB3 ASP 59 3HB ASP 59 -1.015 -13.115 -5.797 519 H ASP 60 H ASP 60 -3.252 -11.940 -4.784 520 HA ASP 60 HA ASP 60 -5.593 -12.503 -6.478 521 HB2 ASP 60 2HB ASP 60 -4.734 -14.587 -5.596 522 HB3 ASP 60 3HB ASP 60 -4.653 -13.917 -3.970 523 H LYS 61 H LYS 61 -7.575 -11.740 -5.783 524 HA LYS 61 HA LYS 61 -7.727 -9.370 -4.358 525 HB2 LYS 61 2HB LYS 61 -9.429 -10.253 -5.950 526 HB3 LYS 61 3HB LYS 61 -9.953 -11.390 -4.716 527 HG2 LYS 61 2HG LYS 61 -10.546 -9.469 -3.259 528 HG3 LYS 61 3HG LYS 61 -10.120 -8.378 -4.581 529 HD2 LYS 61 2HD LYS 61 -12.295 -10.478 -4.592 530 HD3 LYS 61 3HD LYS 61 -12.519 -8.729 -4.555 531 HE2 LYS 61 2HE LYS 61 -11.577 -8.517 -6.772 532 HE3 LYS 61 3HE LYS 61 -11.178 -10.235 -6.805 533 HZ1 LYS 61 3HZ LYS 61 -13.902 -9.057 -6.749 534 HZ2 LYS 61 1HZ LYS 61 -13.570 -10.714 -6.655 535 HZ3 LYS 61 2HZ LYS 61 -13.169 -9.847 -8.052 536 H GLU 62 H GLU 62 -8.496 -12.654 -3.182 537 HA GLU 62 HA GLU 62 -9.243 -11.814 -0.564 538 HB2 GLU 62 2HB GLU 62 -8.316 -14.537 -1.510 539 HB3 GLU 62 3HB GLU 62 -9.100 -14.201 0.029 540 HG2 GLU 62 2HG GLU 62 -11.127 -13.524 -1.116 541 HG3 GLU 62 3HG GLU 62 -10.347 -13.751 -2.680 542 H TRP 63 H TRP 63 -6.194 -12.955 -1.983 543 HA TRP 63 HA TRP 63 -4.612 -13.036 0.311 544 HB2 TRP 63 2HB TRP 63 -3.619 -13.814 -1.692 545 HB3 TRP 63 3HB TRP 63 -3.973 -12.322 -2.552 546 HD1 TRP 63 HD1 TRP 63 -1.648 -11.449 -3.207 547 HE1 TRP 63 HE1 TRP 63 0.516 -10.848 -1.953 548 HE3 TRP 63 HE3 TRP 63 -2.866 -13.242 1.430 549 HZ2 TRP 63 HZ2 TRP 63 1.566 -11.095 0.649 550 HZ3 TRP 63 HZ3 TRP 63 -1.223 -13.017 3.245 551 HH2 TRP 63 HH2 TRP 63 0.949 -11.964 2.860 552 H ALA 64 H ALA 64 -5.396 -10.240 -1.755 553 HA ALA 64 HA ALA 64 -4.004 -8.272 -0.344 554 HB1 ALA 64 3HB ALA 64 -6.654 -7.995 -1.771 555 HB2 ALA 64 1HB ALA 64 -5.062 -7.884 -2.523 556 HB3 ALA 64 2HB ALA 64 -5.566 -6.675 -1.339 557 H GLU 65 H GLU 65 -7.265 -9.579 0.208 558 HA GLU 65 HA GLU 65 -7.953 -7.934 2.396 559 HB2 GLU 65 2HB GLU 65 -9.631 -9.234 1.196 560 HB3 GLU 65 3HB GLU 65 -8.876 -10.737 1.714 561 HG2 GLU 65 2HG GLU 65 -9.431 -10.238 4.035 562 HG3 GLU 65 3HG GLU 65 -10.148 -8.705 3.545 563 H LYS 66 H LYS 66 -6.346 -11.097 2.260 564 HA LYS 66 HA LYS 66 -6.227 -11.658 4.998 565 HB2 LYS 66 2HB LYS 66 -4.221 -12.379 2.842 566 HB3 LYS 66 3HB LYS 66 -4.328 -13.139 4.426 567 HG2 LYS 66 2HG LYS 66 -6.466 -14.081 3.912 568 HG3 LYS 66 3HG LYS 66 -6.577 -13.155 2.416 569 HD2 LYS 66 2HD LYS 66 -4.561 -14.393 1.588 570 HD3 LYS 66 3HD LYS 66 -4.646 -15.400 3.035 571 HE2 LYS 66 2HE LYS 66 -6.863 -16.179 2.393 572 HE3 LYS 66 3HE LYS 66 -6.853 -15.111 0.988 573 HZ1 LYS 66 3HZ LYS 66 -5.007 -17.391 1.453 574 HZ2 LYS 66 1HZ LYS 66 -4.966 -16.362 0.114 575 HZ3 LYS 66 2HZ LYS 66 -6.298 -17.366 0.361 576 H ALA 67 H ALA 67 -4.133 -9.660 2.982 577 HA ALA 67 HA ALA 67 -2.145 -9.162 4.963 578 HB1 ALA 67 3HB ALA 67 -2.856 -7.494 2.546 579 HB2 ALA 67 1HB ALA 67 -1.747 -8.865 2.552 580 HB3 ALA 67 2HB ALA 67 -1.356 -7.413 3.473 581 H ILE 68 H ILE 68 -4.878 -7.154 3.792 582 HA ILE 68 HA ILE 68 -4.485 -5.020 5.594 583 HB ILE 68 HB ILE 68 -7.066 -5.907 4.287 584 HG12 ILE 68 2HG1 ILE 68 -5.325 -5.457 2.635 585 HG13 ILE 68 3HG1 ILE 68 -6.532 -4.176 2.596 586 HG21 ILE 68 1HG2 ILE 68 -7.497 -4.403 6.159 587 HG22 ILE 68 2HG2 ILE 68 -7.825 -3.597 4.625 588 HG23 ILE 68 3HG2 ILE 68 -6.342 -3.237 5.509 589 HD11 ILE 68 3HD1 ILE 68 -3.832 -4.021 3.921 590 HD12 ILE 68 1HD1 ILE 68 -5.037 -2.735 3.881 591 HD13 ILE 68 2HD1 ILE 68 -4.287 -3.286 2.384 592 H ARG 69 H ARG 69 -6.405 -7.979 5.886 593 HA ARG 69 HA ARG 69 -7.691 -7.397 8.316 594 HB2 ARG 69 2HB ARG 69 -8.385 -9.243 6.905 595 HB3 ARG 69 3HB ARG 69 -6.838 -10.045 7.126 596 HG2 ARG 69 2HG ARG 69 -7.316 -10.525 9.408 597 HG3 ARG 69 3HG ARG 69 -8.749 -9.492 9.388 598 HD2 ARG 69 2HD ARG 69 -9.249 -11.938 9.242 599 HD3 ARG 69 3HD ARG 69 -9.891 -10.987 7.901 600 HE ARG 69 HE ARG 69 -7.340 -12.425 7.602 601 HH11 ARG 69 1HH1 ARG 69 -10.619 -11.942 6.664 602 HH12 ARG 69 2HH1 ARG 69 -10.475 -12.943 5.261 603 HH21 ARG 69 1HH2 ARG 69 -7.169 -13.693 5.794 604 HH22 ARG 69 2HH2 ARG 69 -8.545 -13.904 4.761 605 H PHE 70 H PHE 70 -4.510 -8.819 7.645 606 HA PHE 70 HA PHE 70 -3.748 -9.315 10.323 607 HB2 PHE 70 2HB PHE 70 -2.525 -10.227 8.374 608 HB3 PHE 70 3HB PHE 70 -1.995 -8.604 7.945 609 HD1 PHE 70 HD1 PHE 70 -1.780 -11.191 10.603 610 HD2 PHE 70 HD2 PHE 70 -0.039 -7.698 8.891 611 HE1 PHE 70 HE1 PHE 70 0.193 -11.469 12.045 612 HE2 PHE 70 HE2 PHE 70 1.936 -7.977 10.332 613 HZ PHE 70 HZ PHE 70 2.054 -9.861 11.909 614 H VAL 71 H VAL 71 -3.316 -6.460 8.229 615 HA VAL 71 HA VAL 71 -1.961 -4.818 10.059 616 HB VAL 71 HB VAL 71 -3.929 -3.954 7.921 617 HG11 VAL 71 1HG1 VAL 71 -2.740 -1.815 7.949 618 HG12 VAL 71 2HG1 VAL 71 -1.720 -2.388 9.269 619 HG13 VAL 71 3HG1 VAL 71 -3.451 -2.163 9.525 620 HG21 VAL 71 3HG2 VAL 71 -2.153 -5.351 7.001 621 HG22 VAL 71 1HG2 VAL 71 -0.932 -4.332 7.767 622 HG23 VAL 71 2HG2 VAL 71 -1.955 -3.676 6.489 623 H LYS 72 H LYS 72 -5.437 -5.369 9.604 624 HA LYS 72 HA LYS 72 -6.391 -3.445 11.424 625 HB2 LYS 72 2HB LYS 72 -7.762 -4.755 9.751 626 HB3 LYS 72 3HB LYS 72 -7.676 -6.125 10.851 627 HG2 LYS 72 2HG LYS 72 -8.755 -4.686 12.599 628 HG3 LYS 72 3HG LYS 72 -8.977 -3.452 11.359 629 HD2 LYS 72 2HD LYS 72 -11.027 -4.657 11.507 630 HD3 LYS 72 3HD LYS 72 -10.239 -5.176 10.016 631 HE2 LYS 72 2HE LYS 72 -11.139 -7.110 11.144 632 HE3 LYS 72 3HE LYS 72 -9.378 -7.172 11.220 633 HZ1 LYS 72 3HZ LYS 72 -9.502 -6.292 13.484 634 HZ2 LYS 72 1HZ LYS 72 -10.344 -7.750 13.339 635 HZ3 LYS 72 2HZ LYS 72 -11.189 -6.288 13.402 636 H SER 73 H SER 73 -5.210 -6.728 11.897 637 HA SER 73 HA SER 73 -5.956 -7.078 14.598 638 HB2 SER 73 2HB SER 73 -5.170 -8.944 13.203 639 HB3 SER 73 3HB SER 73 -3.562 -8.226 13.127 640 HG SER 73 HG SER 73 -4.832 -9.573 15.208 641 H LEU 74 H LEU 74 -3.334 -5.310 13.126 642 HA LEU 74 HA LEU 74 -1.672 -5.040 15.421 643 HB2 LEU 74 2HB LEU 74 -1.908 -3.188 13.040 644 HB3 LEU 74 3HB LEU 74 -0.570 -3.252 14.174 645 HG LEU 74 HG LEU 74 -1.346 -5.487 12.283 646 HD11 LEU 74 1HD1 LEU 74 0.668 -4.879 11.048 647 HD12 LEU 74 2HD1 LEU 74 0.942 -3.521 12.143 648 HD13 LEU 74 3HD1 LEU 74 -0.477 -3.539 11.094 649 HD21 LEU 74 3HD2 LEU 74 1.034 -5.179 14.122 650 HD22 LEU 74 1HD2 LEU 74 0.803 -6.474 12.947 651 HD23 LEU 74 2HD2 LEU 74 -0.296 -6.323 14.317 652 H GLY 75 H GLY 75 -4.345 -3.127 14.128 653 HA2 GLY 75 2HA GLY 75 -5.750 -1.671 15.277 654 HA3 GLY 75 3HA GLY 75 -4.726 -1.833 16.694 655 H ALA 76 H ALA 76 -2.886 -1.070 13.974 656 HA ALA 76 HA ALA 76 -2.461 1.640 14.955 657 HB1 ALA 76 3HB ALA 76 -0.525 1.670 13.481 658 HB2 ALA 76 1HB ALA 76 -1.020 0.134 12.766 659 HB3 ALA 76 2HB ALA 76 -0.531 0.204 14.460 660 H GLN 77 H GLN 77 -3.601 3.302 14.168 661 HA GLN 77 HA GLN 77 -5.119 3.086 11.739 662 HB2 GLN 77 2HB GLN 77 -5.754 5.465 12.216 663 HB3 GLN 77 3HB GLN 77 -6.097 4.342 13.521 664 HG2 GLN 77 2HG GLN 77 -4.044 5.101 14.672 665 HG3 GLN 77 3HG GLN 77 -3.785 6.275 13.383 666 HE21 GLN 77 1HE2 GLN 77 -3.929 8.017 14.809 667 HE22 GLN 77 2HE2 GLN 77 -5.431 8.511 15.501 668 H VAL 78 H VAL 78 -4.103 3.098 9.850 669 HA VAL 78 HA VAL 78 -2.126 5.216 9.284 670 HB VAL 78 HB VAL 78 -0.763 3.642 7.993 671 HG11 VAL 78 1HG1 VAL 78 -1.251 2.689 10.819 672 HG12 VAL 78 2HG1 VAL 78 -0.181 4.004 10.331 673 HG13 VAL 78 3HG1 VAL 78 0.183 2.347 9.849 674 HG21 VAL 78 3HG2 VAL 78 -2.518 2.065 7.334 675 HG22 VAL 78 1HG2 VAL 78 -2.646 1.499 9.000 676 HG23 VAL 78 2HG2 VAL 78 -1.162 1.226 8.086 677 H LEU 79 H LEU 79 -1.768 5.573 6.942 678 HA LEU 79 HA LEU 79 -4.253 5.515 5.448 679 HB2 LEU 79 2HB LEU 79 -1.522 6.684 4.937 680 HB3 LEU 79 3HB LEU 79 -2.714 6.604 3.657 681 HG LEU 79 HG LEU 79 -2.623 8.820 4.734 682 HD11 LEU 79 1HD1 LEU 79 -5.212 7.335 5.169 683 HD12 LEU 79 2HD1 LEU 79 -4.683 8.103 3.672 684 HD13 LEU 79 3HD1 LEU 79 -5.031 9.089 5.092 685 HD21 LEU 79 3HD2 LEU 79 -3.454 9.142 7.001 686 HD22 LEU 79 1HD2 LEU 79 -2.025 8.110 7.003 687 HD23 LEU 79 2HD2 LEU 79 -3.627 7.399 7.205 688 H ILE 80 H ILE 80 -4.684 4.300 3.621 689 HA ILE 80 HA ILE 80 -2.621 2.359 2.777 690 HB ILE 80 HB ILE 80 -5.569 1.784 3.161 691 HG12 ILE 80 2HG1 ILE 80 -3.100 0.750 4.593 692 HG13 ILE 80 3HG1 ILE 80 -4.315 1.832 5.266 693 HG21 ILE 80 1HG2 ILE 80 -5.042 -0.511 2.471 694 HG22 ILE 80 2HG2 ILE 80 -3.378 -0.030 2.134 695 HG23 ILE 80 3HG2 ILE 80 -4.701 0.640 1.178 696 HD11 ILE 80 3HD1 ILE 80 -5.984 0.038 5.066 697 HD12 ILE 80 1HD1 ILE 80 -4.626 -0.404 6.100 698 HD13 ILE 80 2HD1 ILE 80 -4.726 -1.038 4.458 699 H ILE 81 H ILE 81 -2.072 2.774 0.733 700 HA ILE 81 HA ILE 81 -4.046 3.915 -1.125 701 HB ILE 81 HB ILE 81 -1.052 3.571 -1.443 702 HG12 ILE 81 2HG1 ILE 81 -2.732 6.033 -0.872 703 HG13 ILE 81 3HG1 ILE 81 -1.613 5.253 0.242 704 HG21 ILE 81 1HG2 ILE 81 -1.289 4.989 -3.437 705 HG22 ILE 81 2HG2 ILE 81 -3.042 4.973 -3.237 706 HG23 ILE 81 3HG2 ILE 81 -2.180 3.476 -3.599 707 HD11 ILE 81 3HD1 ILE 81 -0.885 6.651 -2.324 708 HD12 ILE 81 1HD1 ILE 81 0.250 5.831 -1.249 709 HD13 ILE 81 2HD1 ILE 81 -0.633 7.251 -0.686 710 H ILE 82 H ILE 82 -4.927 2.743 -2.743 711 HA ILE 82 HA ILE 82 -3.824 0.048 -3.260 712 HB ILE 82 HB ILE 82 -6.702 0.953 -3.555 713 HG12 ILE 82 2HG1 ILE 82 -5.419 -0.868 -1.489 714 HG13 ILE 82 3HG1 ILE 82 -5.998 0.768 -1.195 715 HG21 ILE 82 1HG2 ILE 82 -5.442 -1.773 -3.912 716 HG22 ILE 82 2HG2 ILE 82 -6.140 -0.762 -5.177 717 HG23 ILE 82 3HG2 ILE 82 -7.174 -1.445 -3.923 718 HD11 ILE 82 3HD1 ILE 82 -7.691 -1.590 -1.993 719 HD12 ILE 82 1HD1 ILE 82 -8.276 0.051 -1.711 720 HD13 ILE 82 2HD1 ILE 82 -7.577 -0.877 -0.383 721 H TYR 83 H TYR 83 -3.099 -0.357 -5.245 722 HA TYR 83 HA TYR 83 -3.910 1.423 -7.460 723 HB2 TYR 83 2HB TYR 83 -1.562 1.730 -6.919 724 HB3 TYR 83 3HB TYR 83 -1.275 -0.005 -7.012 725 HD1 TYR 83 HD2 TYR 83 -2.150 2.986 -9.031 726 HD2 TYR 83 HD1 TYR 83 -0.797 -1.054 -9.101 727 HE1 TYR 83 HE2 TYR 83 -1.611 3.214 -11.413 728 HE2 TYR 83 HE1 TYR 83 -0.262 -0.831 -11.491 729 HH TYR 83 HH TYR 83 -1.044 0.623 -13.426 730 H ASP 84 H ASP 84 -5.205 0.448 -8.880 731 HA ASP 84 HA ASP 84 -4.455 -2.160 -9.944 732 HB2 ASP 84 2HB ASP 84 -6.009 -2.738 -8.133 733 HB3 ASP 84 3HB ASP 84 -7.215 -1.636 -8.798 734 H GLN 85 H GLN 85 -5.758 -2.693 -11.930 735 HA GLN 85 HA GLN 85 -6.220 -0.203 -13.447 736 HB2 GLN 85 2HB GLN 85 -5.473 -2.965 -14.435 737 HB3 GLN 85 3HB GLN 85 -5.663 -1.537 -15.445 738 HG2 GLN 85 2HG GLN 85 -3.615 -1.871 -13.255 739 HG3 GLN 85 3HG GLN 85 -3.314 -2.057 -14.982 740 HE21 GLN 85 1HE2 GLN 85 -4.028 0.214 -12.436 741 HE22 GLN 85 2HE2 GLN 85 -3.592 1.630 -13.318 742 H ASP 86 H ASP 86 -8.050 -2.407 -11.909 743 HA ASP 86 HA ASP 86 -10.156 -2.385 -13.984 744 HB2 ASP 86 2HB ASP 86 -9.194 -4.630 -13.151 745 HB3 ASP 86 3HB ASP 86 -10.055 -4.300 -11.652 746 H GLN 87 H GLN 87 -11.534 -0.759 -13.557 747 HA GLN 87 HA GLN 87 -11.664 0.660 -11.154 748 HB2 GLN 87 2HB GLN 87 -13.759 0.552 -13.335 749 HB3 GLN 87 3HB GLN 87 -13.611 1.805 -12.110 750 HG2 GLN 87 2HG GLN 87 -11.362 2.353 -13.023 751 HG3 GLN 87 3HG GLN 87 -11.649 1.188 -14.314 752 HE21 GLN 87 1HE2 GLN 87 -11.178 4.039 -14.521 753 HE22 GLN 87 2HE2 GLN 87 -12.563 4.717 -15.302 754 H ASN 88 H ASN 88 -13.249 -2.279 -11.968 755 HA ASN 88 HA ASN 88 -15.364 -1.977 -10.001 756 HB2 ASN 88 2HB ASN 88 -14.534 -4.261 -11.799 757 HB3 ASN 88 3HB ASN 88 -15.822 -4.410 -10.606 758 HD21 ASN 88 1HD2 ASN 88 -17.748 -3.359 -10.941 759 HD22 ASN 88 2HD2 ASN 88 -18.171 -2.631 -12.449 760 H ARG 89 H ARG 89 -12.546 -4.172 -10.359 761 HA ARG 89 HA ARG 89 -12.797 -5.315 -7.774 762 HB2 ARG 89 2HB ARG 89 -10.514 -5.190 -9.741 763 HB3 ARG 89 3HB ARG 89 -10.313 -5.931 -8.160 764 HG2 ARG 89 2HG ARG 89 -10.768 -7.636 -9.795 765 HG3 ARG 89 3HG ARG 89 -12.136 -7.509 -8.692 766 HD2 ARG 89 2HD ARG 89 -13.402 -6.270 -10.328 767 HD3 ARG 89 3HD ARG 89 -12.011 -6.207 -11.412 768 HE ARG 89 HE ARG 89 -13.050 -8.834 -10.675 769 HH11 ARG 89 1HH1 ARG 89 -12.844 -6.329 -13.036 770 HH12 ARG 89 2HH1 ARG 89 -13.227 -7.397 -14.343 771 HH21 ARG 89 1HH2 ARG 89 -13.542 -10.177 -12.372 772 HH22 ARG 89 2HH2 ARG 89 -13.621 -9.534 -13.975 773 H LEU 90 H LEU 90 -10.770 -2.672 -8.997 774 HA LEU 90 HA LEU 90 -9.282 -1.985 -6.812 775 HB2 LEU 90 2HB LEU 90 -9.125 -0.861 -8.974 776 HB3 LEU 90 3HB LEU 90 -10.700 -0.130 -8.732 777 HG LEU 90 HG LEU 90 -9.781 1.150 -6.806 778 HD11 LEU 90 1HD1 LEU 90 -7.369 1.264 -6.474 779 HD12 LEU 90 2HD1 LEU 90 -7.130 0.011 -7.694 780 HD13 LEU 90 3HD1 LEU 90 -7.970 -0.369 -6.190 781 HD21 LEU 90 3HD2 LEU 90 -8.491 2.740 -8.138 782 HD22 LEU 90 1HD2 LEU 90 -9.897 2.161 -9.032 783 HD23 LEU 90 2HD2 LEU 90 -8.293 1.533 -9.409 784 H GLU 91 H GLU 91 -12.561 -0.711 -7.490 785 HA GLU 91 HA GLU 91 -12.746 0.590 -4.954 786 HB2 GLU 91 2HB GLU 91 -14.670 0.136 -7.209 787 HB3 GLU 91 3HB GLU 91 -15.243 0.778 -5.675 788 HG2 GLU 91 2HG GLU 91 -13.057 2.004 -7.354 789 HG3 GLU 91 3HG GLU 91 -14.739 2.532 -7.330 790 H GLU 92 H GLU 92 -14.019 -2.491 -6.206 791 HA GLU 92 HA GLU 92 -15.712 -3.214 -4.139 792 HB2 GLU 92 2HB GLU 92 -15.528 -4.635 -6.075 793 HB3 GLU 92 3HB GLU 92 -13.823 -4.938 -5.765 794 HG2 GLU 92 2HG GLU 92 -14.388 -6.192 -3.754 795 HG3 GLU 92 3HG GLU 92 -16.098 -5.844 -4.001 796 H PHE 93 H PHE 93 -12.194 -3.754 -4.301 797 HA PHE 93 HA PHE 93 -12.018 -4.758 -1.625 798 HB2 PHE 93 2HB PHE 93 -10.399 -5.373 -3.380 799 HB3 PHE 93 3HB PHE 93 -9.854 -3.702 -3.467 800 HD1 PHE 93 HD1 PHE 93 -10.434 -6.218 -0.757 801 HD2 PHE 93 HD2 PHE 93 -7.811 -3.340 -2.482 802 HE1 PHE 93 HE1 PHE 93 -8.776 -6.683 0.994 803 HE2 PHE 93 HE2 PHE 93 -6.150 -3.803 -0.729 804 HZ PHE 93 HZ PHE 93 -6.631 -5.476 1.009 805 H SER 94 H SER 94 -11.468 -1.612 -3.146 806 HA SER 94 HA SER 94 -10.317 -0.174 -1.079 807 HB2 SER 94 2HB SER 94 -10.565 0.800 -3.273 808 HB3 SER 94 3HB SER 94 -12.321 0.737 -3.154 809 HG SER 94 HG SER 94 -11.453 2.827 -2.722 810 H ARG 95 H ARG 95 -13.826 -0.465 -1.733 811 HA ARG 95 HA ARG 95 -14.647 1.160 0.407 812 HB2 ARG 95 2HB ARG 95 -16.295 -1.132 -0.672 813 HB3 ARG 95 3HB ARG 95 -16.866 0.375 0.028 814 HG2 ARG 95 2HG ARG 95 -15.696 -0.114 -2.689 815 HG3 ARG 95 3HG ARG 95 -17.256 0.583 -2.267 816 HD2 ARG 95 2HD ARG 95 -14.583 1.891 -1.751 817 HD3 ARG 95 3HD ARG 95 -15.615 2.233 -3.137 818 HE ARG 95 HE ARG 95 -16.813 2.624 -0.522 819 HH11 ARG 95 1HH1 ARG 95 -15.216 4.030 -3.238 820 HH12 ARG 95 2HH1 ARG 95 -15.739 5.634 -2.848 821 HH21 ARG 95 1HH2 ARG 95 -17.463 4.700 -0.023 822 HH22 ARG 95 2HH2 ARG 95 -16.978 6.009 -1.044 823 H GLU 96 H GLU 96 -14.007 -2.298 0.219 824 HA GLU 96 HA GLU 96 -14.882 -3.044 2.785 825 HB2 GLU 96 2HB GLU 96 -13.012 -4.183 0.761 826 HB3 GLU 96 3HB GLU 96 -12.896 -4.811 2.400 827 HG2 GLU 96 2HG GLU 96 -15.463 -4.713 0.824 828 HG3 GLU 96 3HG GLU 96 -14.385 -6.109 0.869 829 H VAL 97 H VAL 97 -11.642 -2.020 1.682 830 HA VAL 97 HA VAL 97 -10.297 -2.265 4.113 831 HB VAL 97 HB VAL 97 -9.817 -0.208 1.939 832 HG11 VAL 97 1HG1 VAL 97 -7.517 -0.091 2.840 833 HG12 VAL 97 2HG1 VAL 97 -8.007 -1.125 4.184 834 HG13 VAL 97 3HG1 VAL 97 -8.720 0.477 3.998 835 HG21 VAL 97 3HG2 VAL 97 -9.718 -2.513 1.125 836 HG22 VAL 97 1HG2 VAL 97 -8.574 -2.927 2.402 837 HG23 VAL 97 2HG2 VAL 97 -8.111 -1.788 1.139 838 H ARG 98 H ARG 98 -12.037 0.592 2.842 839 HA ARG 98 HA ARG 98 -11.554 2.167 5.177 840 HB2 ARG 98 2HB ARG 98 -12.353 2.818 2.694 841 HB3 ARG 98 3HB ARG 98 -13.928 2.775 3.472 842 HG2 ARG 98 2HG ARG 98 -11.587 4.432 4.425 843 HG3 ARG 98 3HG ARG 98 -12.903 5.034 3.418 844 HD2 ARG 98 2HD ARG 98 -14.485 4.773 5.147 845 HD3 ARG 98 3HD ARG 98 -13.408 3.748 6.090 846 HE ARG 98 HE ARG 98 -12.192 6.252 5.813 847 HH11 ARG 98 1HH1 ARG 98 -14.974 4.865 7.312 848 HH12 ARG 98 2HH1 ARG 98 -14.958 5.991 8.621 849 HH21 ARG 98 1HH2 ARG 98 -12.172 7.666 7.503 850 HH22 ARG 98 2HH2 ARG 98 -13.389 7.562 8.731 851 H ARG 99 H ARG 99 -14.141 -0.014 4.189 852 HA ARG 99 HA ARG 99 -16.035 0.602 6.169 853 HB2 ARG 99 2HB ARG 99 -16.407 -0.841 4.148 854 HB3 ARG 99 3HB ARG 99 -15.500 -2.119 4.937 855 HG2 ARG 99 2HG ARG 99 -17.875 -0.969 6.337 856 HG3 ARG 99 3HG ARG 99 -18.131 -2.064 4.981 857 HD2 ARG 99 2HD ARG 99 -16.488 -2.690 7.439 858 HD3 ARG 99 3HD ARG 99 -18.145 -3.221 7.163 859 HE ARG 99 HE ARG 99 -16.608 -4.064 4.987 860 HH11 ARG 99 1HH1 ARG 99 -16.869 -4.685 8.372 861 HH12 ARG 99 2HH1 ARG 99 -16.318 -6.315 8.217 862 HH21 ARG 99 1HH2 ARG 99 -15.921 -6.150 4.806 863 HH22 ARG 99 2HH2 ARG 99 -15.789 -7.139 6.221 864 H ARG 100 H ARG 100 -13.042 -1.164 6.350 865 HA ARG 100 HA ARG 100 -13.648 -2.317 8.955 866 HB2 ARG 100 2HB ARG 100 -11.075 -2.388 7.357 867 HB3 ARG 100 3HB ARG 100 -11.457 -3.382 8.763 868 HG2 ARG 100 2HG ARG 100 -13.251 -4.468 7.558 869 HG3 ARG 100 3HG ARG 100 -12.997 -3.408 6.174 870 HD2 ARG 100 2HD ARG 100 -10.644 -4.381 6.048 871 HD3 ARG 100 3HD ARG 100 -11.202 -5.603 7.196 872 HE ARG 100 HE ARG 100 -12.625 -5.181 4.659 873 HH11 ARG 100 1HH1 ARG 100 -10.854 -7.282 6.749 874 HH12 ARG 100 2HH1 ARG 100 -11.271 -8.691 5.840 875 HH21 ARG 100 1HH2 ARG 100 -13.125 -6.982 3.508 876 HH22 ARG 100 2HH2 ARG 100 -12.510 -8.518 4.010 877 H GLY 101 H GLY 101 -12.656 0.696 7.935 878 HA2 GLY 101 2HA GLY 101 -12.596 2.314 9.790 879 HA3 GLY 101 3HA GLY 101 -11.500 1.224 10.615 880 H PHE 102 H PHE 102 -10.240 0.960 7.694 881 HA PHE 102 HA PHE 102 -8.184 2.908 8.342 882 HB2 PHE 102 2HB PHE 102 -8.323 0.738 6.244 883 HB3 PHE 102 3HB PHE 102 -6.946 1.817 6.438 884 HD1 PHE 102 HD1 PHE 102 -5.556 1.714 8.468 885 HD2 PHE 102 HD2 PHE 102 -8.709 -1.066 7.771 886 HE1 PHE 102 HE1 PHE 102 -4.618 0.228 10.185 887 HE2 PHE 102 HE2 PHE 102 -7.772 -2.556 9.489 888 HZ PHE 102 HZ PHE 102 -5.728 -1.910 10.698 889 H GLU 103 H GLU 103 -7.558 4.659 7.184 890 HA GLU 103 HA GLU 103 -9.393 5.817 5.293 891 HB2 GLU 103 2HB GLU 103 -6.651 6.737 6.206 892 HB3 GLU 103 3HB GLU 103 -7.775 7.699 5.256 893 HG2 GLU 103 2HG GLU 103 -8.520 6.617 7.958 894 HG3 GLU 103 3HG GLU 103 -7.633 8.127 7.779 895 H VAL 104 H VAL 104 -9.441 4.697 3.382 896 HA VAL 104 HA VAL 104 -6.927 3.905 2.109 897 HB VAL 104 HB VAL 104 -8.672 2.200 2.311 898 HG11 VAL 104 1HG1 VAL 104 -10.320 3.957 0.489 899 HG12 VAL 104 2HG1 VAL 104 -10.637 3.651 2.195 900 HG13 VAL 104 3HG1 VAL 104 -10.745 2.332 1.030 901 HG21 VAL 104 3HG2 VAL 104 -8.136 3.027 -0.547 902 HG22 VAL 104 1HG2 VAL 104 -8.691 1.433 -0.030 903 HG23 VAL 104 2HG2 VAL 104 -7.101 2.016 0.464 904 H ARG 105 H ARG 105 -6.229 4.606 0.152 905 HA ARG 105 HA ARG 105 -7.836 6.602 -1.321 906 HB2 ARG 105 2HB ARG 105 -4.825 6.636 -0.956 907 HB3 ARG 105 3HB ARG 105 -5.764 7.799 -1.879 908 HG2 ARG 105 2HG ARG 105 -5.992 7.365 1.097 909 HG3 ARG 105 3HG ARG 105 -5.049 8.640 0.328 910 HD2 ARG 105 2HD ARG 105 -7.163 9.464 -0.730 911 HD3 ARG 105 3HD ARG 105 -8.047 8.271 0.225 912 HE ARG 105 HE ARG 105 -6.501 9.759 1.993 913 HH11 ARG 105 1HH1 ARG 105 -9.178 10.275 -0.131 914 HH12 ARG 105 2HH1 ARG 105 -9.765 11.622 0.788 915 HH21 ARG 105 1HH2 ARG 105 -7.281 11.484 3.133 916 HH22 ARG 105 2HH2 ARG 105 -8.706 12.299 2.587 917 H THR 106 H THR 106 -8.237 5.947 -3.381 918 HA THR 106 HA THR 106 -6.655 3.714 -4.459 919 HB THR 106 HB THR 106 -8.553 3.513 -6.134 920 HG1 THR 106 HG1 THR 106 -10.556 4.534 -5.302 921 HG21 THR 106 3HG2 THR 106 -9.239 3.214 -3.202 922 HG22 THR 106 1HG2 THR 106 -8.359 2.039 -4.181 923 HG23 THR 106 2HG2 THR 106 -10.046 2.398 -4.542 924 H VAL 107 H VAL 107 -5.581 3.772 -6.363 925 HA VAL 107 HA VAL 107 -5.736 6.197 -8.029 926 HB VAL 107 HB VAL 107 -3.258 6.174 -8.293 927 HG11 VAL 107 1HG1 VAL 107 -4.207 6.561 -5.448 928 HG12 VAL 107 2HG1 VAL 107 -4.328 7.744 -6.749 929 HG13 VAL 107 3HG1 VAL 107 -2.745 7.247 -6.157 930 HG21 VAL 107 3HG2 VAL 107 -3.321 4.216 -5.987 931 HG22 VAL 107 1HG2 VAL 107 -1.876 4.961 -6.674 932 HG23 VAL 107 2HG2 VAL 107 -2.841 3.848 -7.642 933 H THR 108 H THR 108 -5.346 5.880 -10.244 934 HA THR 108 HA THR 108 -5.370 3.041 -11.074 935 HB THR 108 HB THR 108 -6.488 3.818 -13.154 936 HG1 THR 108 HG1 THR 108 -5.724 6.219 -12.343 937 HG21 THR 108 3HG2 THR 108 -7.864 4.582 -10.574 938 HG22 THR 108 1HG2 THR 108 -7.855 2.986 -11.326 939 HG23 THR 108 2HG2 THR 108 -8.674 4.331 -12.121 940 H SER 109 H SER 109 -3.387 5.767 -11.161 941 HA SER 109 HA SER 109 -1.611 4.444 -13.073 942 HB2 SER 109 2HB SER 109 -2.469 7.336 -13.414 943 HB3 SER 109 3HB SER 109 -1.205 6.532 -14.347 944 HG SER 109 HG SER 109 -3.350 5.006 -14.508 945 HA PRO 110 HA PRO 110 1.709 5.540 -10.343 946 HB2 PRO 110 2HB PRO 110 3.067 6.605 -12.794 947 HB3 PRO 110 3HB PRO 110 3.683 5.502 -11.556 948 HG2 PRO 110 2HG PRO 110 2.911 4.556 -13.913 949 HG3 PRO 110 3HG PRO 110 2.525 3.672 -12.424 950 HD2 PRO 110 2HD PRO 110 0.752 5.345 -14.152 951 HD3 PRO 110 3HD PRO 110 0.376 3.865 -13.246 952 H ASP 111 H ASP 111 0.907 8.015 -12.797 953 HA ASP 111 HA ASP 111 1.975 10.212 -11.372 954 HB2 ASP 111 2HB ASP 111 -0.182 10.122 -13.492 955 HB3 ASP 111 3HB ASP 111 0.594 11.597 -12.915 956 H ASP 112 H ASP 112 -1.304 8.803 -11.396 957 HA ASP 112 HA ASP 112 -2.588 10.655 -9.737 958 HB2 ASP 112 2HB ASP 112 -2.989 7.652 -9.607 959 HB3 ASP 112 3HB ASP 112 -4.147 8.894 -9.148 960 H PHE 113 H PHE 113 -0.899 7.661 -8.850 961 HA PHE 113 HA PHE 113 -0.938 7.881 -6.080 962 HB2 PHE 113 2HB PHE 113 -0.251 5.822 -7.061 963 HB3 PHE 113 3HB PHE 113 1.033 6.600 -7.977 964 HD1 PHE 113 HD1 PHE 113 -0.036 5.790 -4.508 965 HD2 PHE 113 HD2 PHE 113 3.204 6.684 -7.127 966 HE1 PHE 113 HE1 PHE 113 1.559 5.255 -2.716 967 HE2 PHE 113 HE2 PHE 113 4.803 6.150 -5.336 968 HZ PHE 113 HZ PHE 113 3.983 5.435 -3.128 969 H LYS 114 H LYS 114 1.492 9.076 -8.368 970 HA LYS 114 HA LYS 114 3.359 10.111 -6.589 971 HB2 LYS 114 2HB LYS 114 3.806 9.882 -8.956 972 HB3 LYS 114 3HB LYS 114 2.558 11.055 -9.345 973 HG2 LYS 114 2HG LYS 114 3.889 12.799 -8.199 974 HG3 LYS 114 3HG LYS 114 5.158 11.605 -7.917 975 HD2 LYS 114 2HD LYS 114 5.651 12.981 -9.888 976 HD3 LYS 114 3HD LYS 114 5.419 11.287 -10.325 977 HE2 LYS 114 2HE LYS 114 3.106 11.795 -11.008 978 HE3 LYS 114 3HE LYS 114 3.368 13.491 -10.604 979 HZ1 LYS 114 3HZ LYS 114 4.866 11.972 -12.668 980 HZ2 LYS 114 1HZ LYS 114 5.058 13.613 -12.304 981 HZ3 LYS 114 2HZ LYS 114 3.608 13.061 -12.973 982 H LYS 115 H LYS 115 0.704 11.901 -8.203 983 HA LYS 115 HA LYS 115 1.239 14.342 -6.861 984 HB2 LYS 115 2HB LYS 115 -1.340 13.477 -8.194 985 HB3 LYS 115 3HB LYS 115 -0.876 15.129 -7.802 986 HG2 LYS 115 2HG LYS 115 0.515 13.318 -9.776 987 HG3 LYS 115 3HG LYS 115 -0.571 14.647 -10.175 988 HD2 LYS 115 2HD LYS 115 1.986 15.033 -8.612 989 HD3 LYS 115 3HD LYS 115 1.921 15.114 -10.371 990 HE2 LYS 115 2HE LYS 115 1.791 17.346 -9.576 991 HE3 LYS 115 3HE LYS 115 0.174 16.912 -10.122 992 HZ1 LYS 115 3HZ LYS 115 -0.503 16.581 -7.859 993 HZ2 LYS 115 1HZ LYS 115 0.201 18.110 -7.993 994 HZ3 LYS 115 2HZ LYS 115 1.068 16.840 -7.293 995 H SER 116 H SER 116 -0.902 11.639 -6.115 996 HA SER 116 HA SER 116 -2.267 12.911 -3.948 997 HB2 SER 116 2HB SER 116 -1.851 9.961 -4.526 998 HB3 SER 116 3HB SER 116 -2.964 10.604 -3.320 999 HG SER 116 HG SER 116 -3.091 10.786 -6.135 1000 H LEU 117 H LEU 117 0.595 10.842 -4.165 1001 HA LEU 117 HA LEU 117 0.981 10.279 -1.461 1002 HB2 LEU 117 2HB LEU 117 2.146 9.216 -3.416 1003 HB3 LEU 117 3HB LEU 117 3.148 10.650 -3.536 1004 HG LEU 117 HG LEU 117 3.979 10.202 -1.219 1005 HD11 LEU 117 1HD1 LEU 117 2.504 7.586 -1.544 1006 HD12 LEU 117 2HD1 LEU 117 2.083 8.881 -0.421 1007 HD13 LEU 117 3HD1 LEU 117 3.603 8.008 -0.228 1008 HD21 LEU 117 3HD2 LEU 117 5.464 8.363 -1.858 1009 HD22 LEU 117 1HD2 LEU 117 5.276 9.522 -3.173 1010 HD23 LEU 117 2HD2 LEU 117 4.417 7.982 -3.224 1011 H GLU 118 H GLU 118 2.138 13.030 -3.388 1012 HA GLU 118 HA GLU 118 3.862 14.313 -1.691 1013 HB2 GLU 118 2HB GLU 118 1.682 15.677 -3.296 1014 HB3 GLU 118 3HB GLU 118 3.155 16.434 -2.707 1015 HG2 GLU 118 2HG GLU 118 4.492 15.020 -4.168 1016 HG3 GLU 118 3HG GLU 118 3.035 14.195 -4.727 1017 H ARG 119 H ARG 119 0.321 14.430 -1.557 1018 HA ARG 119 HA ARG 119 0.348 16.202 0.758 1019 HB2 ARG 119 2HB ARG 119 -1.941 14.980 -0.804 1020 HB3 ARG 119 3HB ARG 119 -2.129 16.128 0.518 1021 HG2 ARG 119 2HG ARG 119 -0.975 17.836 -0.745 1022 HG3 ARG 119 3HG ARG 119 -0.641 16.692 -2.046 1023 HD2 ARG 119 2HD ARG 119 -2.523 18.159 -2.602 1024 HD3 ARG 119 3HD ARG 119 -3.029 16.475 -2.494 1025 HE ARG 119 HE ARG 119 -4.077 16.979 -0.394 1026 HH11 ARG 119 1HH1 ARG 119 -2.926 19.753 -2.087 1027 HH12 ARG 119 2HH1 ARG 119 -4.055 20.819 -1.336 1028 HH21 ARG 119 1HH2 ARG 119 -5.530 18.369 0.565 1029 HH22 ARG 119 2HH2 ARG 119 -5.526 20.043 0.132 1030 H LEU 120 H LEU 120 -0.570 12.859 -0.011 1031 HA LEU 120 HA LEU 120 -1.775 12.194 2.420 1032 HB2 LEU 120 2HB LEU 120 -0.253 10.436 0.499 1033 HB3 LEU 120 3HB LEU 120 -1.245 9.834 1.815 1034 HG LEU 120 HG LEU 120 -2.243 11.457 -0.537 1035 HD11 LEU 120 1HD1 LEU 120 -3.373 9.378 -1.200 1036 HD12 LEU 120 2HD1 LEU 120 -2.555 8.525 0.111 1037 HD13 LEU 120 3HD1 LEU 120 -1.617 9.217 -1.214 1038 HD21 LEU 120 3HD2 LEU 120 -4.478 10.971 0.320 1039 HD22 LEU 120 1HD2 LEU 120 -3.536 11.893 1.492 1040 HD23 LEU 120 2HD2 LEU 120 -3.776 10.160 1.720 1041 H ILE 121 H ILE 121 1.658 11.905 1.477 1042 HA ILE 121 HA ILE 121 2.648 10.750 3.820 1043 HB ILE 121 HB ILE 121 3.940 12.712 1.918 1044 HG12 ILE 121 2HG1 ILE 121 4.249 9.722 2.331 1045 HG13 ILE 121 3HG1 ILE 121 3.446 10.512 0.978 1046 HG21 ILE 121 1HG2 ILE 121 5.041 13.000 4.059 1047 HG22 ILE 121 2HG2 ILE 121 6.107 12.131 2.955 1048 HG23 ILE 121 3HG2 ILE 121 5.246 11.256 4.222 1049 HD11 ILE 121 3HD1 ILE 121 6.379 10.658 1.632 1050 HD12 ILE 121 1HD1 ILE 121 5.586 11.479 0.288 1051 HD13 ILE 121 2HD1 ILE 121 5.635 9.717 0.340 1052 H ARG 122 H ARG 122 1.968 14.147 3.094 1053 HA ARG 122 HA ARG 122 2.981 15.235 5.502 1054 HB2 ARG 122 2HB ARG 122 0.799 16.274 3.674 1055 HB3 ARG 122 3HB ARG 122 1.583 17.212 4.941 1056 HG2 ARG 122 2HG ARG 122 3.722 17.017 3.788 1057 HG3 ARG 122 3HG ARG 122 2.969 16.028 2.535 1058 HD2 ARG 122 2HD ARG 122 3.241 18.364 1.821 1059 HD3 ARG 122 3HD ARG 122 1.544 17.885 1.884 1060 HE ARG 122 HE ARG 122 2.309 19.083 4.325 1061 HH11 ARG 122 1HH1 ARG 122 1.653 19.916 1.042 1062 HH12 ARG 122 2HH1 ARG 122 1.093 21.501 1.456 1063 HH21 ARG 122 1HH2 ARG 122 1.610 21.112 4.823 1064 HH22 ARG 122 2HH2 ARG 122 1.089 22.178 3.563 1065 H GLU 123 H GLU 123 -0.253 14.056 4.603 1066 HA GLU 123 HA GLU 123 -1.533 14.844 7.008 1067 HB2 GLU 123 2HB GLU 123 -2.295 12.680 5.034 1068 HB3 GLU 123 3HB GLU 123 -3.333 13.269 6.327 1069 HG2 GLU 123 2HG GLU 123 -3.191 15.547 5.296 1070 HG3 GLU 123 3HG GLU 123 -2.339 14.815 3.937 1071 H VAL 124 H VAL 124 -0.051 11.756 6.024 1072 HA VAL 124 HA VAL 124 -0.752 10.429 8.477 1073 HB VAL 124 HB VAL 124 -0.423 9.205 6.336 1074 HG11 VAL 124 1HG1 VAL 124 1.846 8.675 5.569 1075 HG12 VAL 124 2HG1 VAL 124 2.511 9.779 6.774 1076 HG13 VAL 124 3HG1 VAL 124 1.507 10.404 5.467 1077 HG21 VAL 124 3HG2 VAL 124 -0.365 8.009 8.461 1078 HG22 VAL 124 1HG2 VAL 124 1.370 8.306 8.598 1079 HG23 VAL 124 2HG2 VAL 124 0.748 7.281 7.303 1080 H GLY 125 H GLY 125 1.948 12.350 7.402 1081 HA2 GLY 125 2HA GLY 125 3.728 11.535 9.529 1082 HA3 GLY 125 3HA GLY 125 3.975 12.863 8.406 1083 H SER 126 H SER 126 1.752 14.418 8.872 1084 HA SER 126 HA SER 126 2.305 15.384 11.597 1085 HB2 SER 126 2HB SER 126 1.476 17.564 10.842 1086 HB3 SER 126 3HB SER 126 2.756 16.985 9.775 1087 HG SER 126 HG SER 126 0.528 16.082 8.745 1088 H LEU 127 H LEU 127 0.885 14.529 12.990 1089 HA LEU 127 HA LEU 127 -1.905 14.146 12.360 1090 HB2 LEU 127 2HB LEU 127 -1.999 13.605 14.886 1091 HB3 LEU 127 3HB LEU 127 -1.122 12.529 13.817 1092 HG LEU 127 HG LEU 127 1.009 13.613 14.530 1093 HD11 LEU 127 1HD1 LEU 127 -0.714 15.015 16.572 1094 HD12 LEU 127 2HD1 LEU 127 0.137 15.781 15.230 1095 HD13 LEU 127 3HD1 LEU 127 1.049 15.009 16.525 1096 HD21 LEU 127 3HD2 LEU 127 0.275 11.532 15.545 1097 HD22 LEU 127 1HD2 LEU 127 -0.668 12.425 16.740 1098 HD23 LEU 127 2HD2 LEU 127 1.092 12.545 16.733 1099 H GLU 128 H GLU 128 -0.537 16.907 12.517 1100 HA GLU 128 HA GLU 128 -1.766 18.308 14.694 1101 HB2 GLU 128 2HB GLU 128 -0.792 20.308 13.641 1102 HB3 GLU 128 3HB GLU 128 0.386 19.011 13.780 1103 HG2 GLU 128 2HG GLU 128 0.003 18.442 11.406 1104 HG3 GLU 128 3HG GLU 128 -1.101 19.812 11.282 1105 H HIS 129 H HIS 129 -3.419 16.951 12.397 1106 HA HIS 129 HA HIS 129 -4.862 18.919 11.032 1107 HB2 HIS 129 2HB HIS 129 -5.812 16.210 12.012 1108 HB3 HIS 129 3HB HIS 129 -6.662 17.210 10.837 1109 HD1 HIS 129 HD1 HIS 129 -5.275 14.277 10.430 1110 HD2 HIS 129 HD2 HIS 129 -3.940 17.961 9.040 1111 HE1 HIS 129 HE1 HIS 129 -3.782 13.759 8.481 1112 HE2 HIS 129 HE2 HIS 129 -2.830 15.990 7.796 1113 H HIS 130 H HIS 130 -5.800 20.610 11.943 1114 HA HIS 130 HA HIS 130 -6.409 20.692 14.726 1115 HB2 HIS 130 2HB HIS 130 -7.005 22.731 12.573 1116 HB3 HIS 130 3HB HIS 130 -7.030 23.026 14.309 1117 HD1 HIS 130 HD1 HIS 130 -4.635 22.788 15.536 1118 HD2 HIS 130 HD2 HIS 130 -4.559 23.051 11.392 1119 HE1 HIS 130 HE1 HIS 130 -2.263 23.338 14.940 1120 HE2 HIS 130 HE2 HIS 130 -2.208 23.299 12.428 1121 H HIS 131 H HIS 131 -8.231 20.196 15.737 1122 HA HIS 131 HA HIS 131 -10.634 19.508 14.354 1123 HB2 HIS 131 2HB HIS 131 -10.149 19.941 17.315 1124 HB3 HIS 131 3HB HIS 131 -11.613 19.249 16.620 1125 HD1 HIS 131 HD1 HIS 131 -8.913 18.072 18.395 1126 HD2 HIS 131 HD2 HIS 131 -10.506 16.957 14.719 1127 HE1 HIS 131 HE1 HIS 131 -8.118 15.727 18.000 1128 HE2 HIS 131 HE2 HIS 131 -8.976 15.129 15.713 1129 H HIS 132 H HIS 132 -11.186 21.311 13.177 1130 HA HIS 132 HA HIS 132 -11.392 23.936 14.198 1131 HB2 HIS 132 2HB HIS 132 -12.709 24.338 12.050 1132 HB3 HIS 132 3HB HIS 132 -11.070 23.725 11.870 1133 HD1 HIS 132 HD1 HIS 132 -10.795 21.332 10.932 1134 HD2 HIS 132 HD2 HIS 132 -14.747 22.572 11.247 1135 HE1 HIS 132 HE1 HIS 132 -12.129 19.654 9.636 1136 HE2 HIS 132 HE2 HIS 132 -14.473 20.551 9.662 1137 H HIS 133 H HIS 133 -12.817 24.693 15.595 1138 HA HIS 133 HA HIS 133 -15.375 23.412 16.057 1139 HB2 HIS 133 2HB HIS 133 -15.640 25.099 17.836 1140 HB3 HIS 133 3HB HIS 133 -14.081 24.289 17.947 1141 HD1 HIS 133 HD1 HIS 133 -11.972 25.715 17.565 1142 HD2 HIS 133 HD2 HIS 133 -15.521 27.838 17.119 1143 HE1 HIS 133 HE1 HIS 133 -11.308 28.130 17.463 1144 HE2 HIS 133 HE2 HIS 133 -13.446 29.375 17.037 1145 H HIS 134 H HIS 134 -17.294 25.080 16.431 1146 HA HIS 134 HA HIS 134 -17.413 27.365 14.715 1147 HB2 HIS 134 2HB HIS 134 -17.602 25.523 13.034 1148 HB3 HIS 134 3HB HIS 134 -19.070 24.978 13.840 1149 HD1 HIS 134 HD1 HIS 134 -17.736 28.040 12.046 1150 HD2 HIS 134 HD2 HIS 134 -21.351 26.203 12.945 1151 HE1 HIS 134 HE1 HIS 134 -19.475 29.334 10.792 1152 HE2 HIS 134 HE2 HIS 134 -21.661 28.273 11.430 Start of MODEL 3 1 H1 MET 1 1H MET 1 3.364 7.248 10.054 2 H2 MET 1 2H MET 1 4.559 7.439 8.872 3 H3 MET 1 3H MET 1 4.740 8.182 10.376 4 HA MET 1 HA MET 1 6.156 6.272 10.244 5 HB2 MET 1 2HB MET 1 3.772 5.852 12.066 6 HB3 MET 1 3HB MET 1 5.319 5.034 12.236 7 HG2 MET 1 2HG MET 1 6.421 7.171 12.640 8 HG3 MET 1 3HG MET 1 4.881 8.009 12.437 9 HE1 MET 1 3HE MET 1 6.729 8.412 14.971 10 HE2 MET 1 1HE MET 1 5.557 8.340 16.286 11 HE3 MET 1 2HE MET 1 5.165 9.211 14.804 12 H ASN 2 H ASN 2 2.839 4.916 10.457 13 HA ASN 2 HA ASN 2 3.796 2.593 8.939 14 HB2 ASN 2 2HB ASN 2 1.209 2.934 10.478 15 HB3 ASN 2 3HB ASN 2 1.810 1.438 9.771 16 HD21 ASN 2 1HD2 ASN 2 1.895 0.335 11.693 17 HD22 ASN 2 2HD2 ASN 2 3.021 0.705 12.945 18 H ILE 3 H ILE 3 3.519 2.722 6.801 19 HA ILE 3 HA ILE 3 0.867 3.423 5.757 20 HB ILE 3 HB ILE 3 2.101 5.450 5.428 21 HG12 ILE 3 2HG1 ILE 3 2.044 3.906 2.813 22 HG13 ILE 3 3HG1 ILE 3 0.670 4.728 3.542 23 HG21 ILE 3 1HG2 ILE 3 4.265 3.778 4.150 24 HG22 ILE 3 2HG2 ILE 3 4.355 4.600 5.708 25 HG23 ILE 3 3HG2 ILE 3 4.241 5.539 4.219 26 HD11 ILE 3 3HD1 ILE 3 1.801 6.869 3.271 27 HD12 ILE 3 1HD1 ILE 3 1.628 6.029 1.731 28 HD13 ILE 3 2HD1 ILE 3 3.188 6.048 2.555 29 H VAL 4 H VAL 4 0.140 2.020 4.266 30 HA VAL 4 HA VAL 4 2.045 0.039 3.164 31 HB VAL 4 HB VAL 4 -0.805 -0.478 4.056 32 HG11 VAL 4 1HG1 VAL 4 -0.275 -2.851 3.619 33 HG12 VAL 4 2HG1 VAL 4 1.284 -2.364 2.950 34 HG13 VAL 4 3HG1 VAL 4 -0.212 -1.868 2.156 35 HG21 VAL 4 3HG2 VAL 4 0.670 -0.167 5.966 36 HG22 VAL 4 1HG2 VAL 4 1.819 -1.329 5.300 37 HG23 VAL 4 2HG2 VAL 4 0.221 -1.866 5.821 38 H ILE 5 H ILE 5 2.024 -0.222 1.010 39 HA ILE 5 HA ILE 5 -0.195 0.969 -0.543 40 HB ILE 5 HB ILE 5 2.638 0.440 -1.478 41 HG12 ILE 5 2HG1 ILE 5 1.342 3.088 -0.747 42 HG13 ILE 5 3HG1 ILE 5 2.484 2.217 0.273 43 HG21 ILE 5 1HG2 ILE 5 0.349 1.930 -2.782 44 HG22 ILE 5 2HG2 ILE 5 1.018 0.380 -3.294 45 HG23 ILE 5 3HG2 ILE 5 1.998 1.841 -3.409 46 HD11 ILE 5 3HD1 ILE 5 3.066 3.293 -2.474 47 HD12 ILE 5 1HD1 ILE 5 4.209 2.471 -1.412 48 HD13 ILE 5 2HD1 ILE 5 3.544 4.038 -0.950 49 H VAL 6 H VAL 6 -1.577 -0.562 -1.241 50 HA VAL 6 HA VAL 6 -0.650 -3.275 -1.829 51 HB VAL 6 HB VAL 6 -3.464 -2.147 -1.857 52 HG11 VAL 6 1HG1 VAL 6 -4.159 -4.520 -1.760 53 HG12 VAL 6 2HG1 VAL 6 -2.473 -5.001 -1.950 54 HG13 VAL 6 3HG1 VAL 6 -3.291 -4.127 -3.244 55 HG21 VAL 6 3HG2 VAL 6 -3.728 -3.270 0.321 56 HG22 VAL 6 1HG2 VAL 6 -2.486 -2.018 0.374 57 HG23 VAL 6 2HG2 VAL 6 -2.022 -3.717 0.290 58 H VAL 7 H VAL 7 0.171 -3.589 -3.830 59 HA VAL 7 HA VAL 7 -0.931 -2.058 -6.102 60 HB VAL 7 HB VAL 7 1.736 -3.464 -5.803 61 HG11 VAL 7 1HG1 VAL 7 0.706 -1.843 -8.137 62 HG12 VAL 7 2HG1 VAL 7 0.957 -3.589 -8.125 63 HG13 VAL 7 3HG1 VAL 7 2.335 -2.499 -7.970 64 HG21 VAL 7 3HG2 VAL 7 1.055 -0.522 -5.966 65 HG22 VAL 7 1HG2 VAL 7 2.679 -1.206 -5.864 66 HG23 VAL 7 2HG2 VAL 7 1.558 -1.391 -4.515 67 H PHE 8 H PHE 8 -2.534 -3.220 -7.068 68 HA PHE 8 HA PHE 8 -2.416 -6.071 -7.417 69 HB2 PHE 8 2HB PHE 8 -4.240 -3.942 -8.542 70 HB3 PHE 8 3HB PHE 8 -4.376 -5.631 -9.011 71 HD1 PHE 8 HD2 PHE 8 -4.716 -3.259 -6.200 72 HD2 PHE 8 HD1 PHE 8 -5.367 -7.248 -7.559 73 HE1 PHE 8 HE2 PHE 8 -6.152 -3.691 -4.250 74 HE2 PHE 8 HE1 PHE 8 -6.804 -7.678 -5.609 75 HZ PHE 8 HZ PHE 8 -7.198 -5.899 -3.952 76 H SER 9 H SER 9 -0.350 -6.300 -8.421 77 HA SER 9 HA SER 9 -0.441 -6.809 -11.150 78 HB2 SER 9 2HB SER 9 -0.442 -4.339 -11.451 79 HB3 SER 9 3HB SER 9 1.093 -4.247 -10.589 80 HG SER 9 HG SER 9 1.203 -4.304 -12.962 81 H THR 10 H THR 10 0.787 -8.590 -10.996 82 HA THR 10 HA THR 10 3.098 -8.771 -9.299 83 HB THR 10 HB THR 10 3.442 -11.007 -10.309 84 HG1 THR 10 HG1 THR 10 2.777 -10.868 -12.384 85 HG21 THR 10 3HG2 THR 10 1.868 -10.756 -8.434 86 HG22 THR 10 1HG2 THR 10 1.357 -12.033 -9.539 87 HG23 THR 10 2HG2 THR 10 0.557 -10.462 -9.578 88 H ASP 11 H ASP 11 4.018 -6.751 -10.432 89 HA ASP 11 HA ASP 11 6.016 -7.667 -12.361 90 HB2 ASP 11 2HB ASP 11 4.231 -6.747 -13.751 91 HB3 ASP 11 3HB ASP 11 4.234 -5.256 -12.813 92 H GLU 12 H GLU 12 7.901 -6.373 -12.447 93 HA GLU 12 HA GLU 12 8.296 -4.655 -10.083 94 HB2 GLU 12 2HB GLU 12 10.739 -5.096 -10.488 95 HB3 GLU 12 3HB GLU 12 9.792 -6.518 -10.071 96 HG2 GLU 12 2HG GLU 12 9.742 -7.220 -12.381 97 HG3 GLU 12 3HG GLU 12 10.571 -5.747 -12.879 98 H GLU 13 H GLU 13 8.178 -4.613 -13.526 99 HA GLU 13 HA GLU 13 9.919 -2.384 -13.967 100 HB2 GLU 13 2HB GLU 13 9.186 -4.225 -15.617 101 HB3 GLU 13 3HB GLU 13 7.718 -3.284 -15.829 102 HG2 GLU 13 2HG GLU 13 10.507 -2.261 -16.343 103 HG3 GLU 13 3HG GLU 13 9.434 -2.913 -17.577 104 H THR 14 H THR 14 6.353 -2.597 -14.378 105 HA THR 14 HA THR 14 5.861 0.173 -14.264 106 HB THR 14 HB THR 14 4.036 -2.128 -13.498 107 HG1 THR 14 HG1 THR 14 3.609 -2.213 -15.586 108 HG21 THR 14 3HG2 THR 14 2.180 -0.538 -13.799 109 HG22 THR 14 1HG2 THR 14 3.342 0.771 -14.023 110 HG23 THR 14 2HG2 THR 14 3.231 -0.054 -12.468 111 H LEU 15 H LEU 15 6.158 -2.226 -11.684 112 HA LEU 15 HA LEU 15 5.402 -0.546 -9.537 113 HB2 LEU 15 2HB LEU 15 5.585 -2.996 -9.351 114 HB3 LEU 15 3HB LEU 15 7.324 -2.877 -9.540 115 HG LEU 15 HG LEU 15 7.450 -1.590 -7.420 116 HD11 LEU 15 1HD1 LEU 15 5.233 -0.608 -7.393 117 HD12 LEU 15 2HD1 LEU 15 5.496 -1.549 -5.926 118 HD13 LEU 15 3HD1 LEU 15 4.499 -2.205 -7.224 119 HD21 LEU 15 3HD2 LEU 15 6.079 -4.272 -7.183 120 HD22 LEU 15 1HD2 LEU 15 7.030 -3.479 -5.927 121 HD23 LEU 15 2HD2 LEU 15 7.807 -4.007 -7.419 122 H ARG 16 H ARG 16 8.427 -0.938 -11.292 123 HA ARG 16 HA ARG 16 10.211 0.319 -9.570 124 HB2 ARG 16 2HB ARG 16 10.812 -0.828 -11.705 125 HB3 ARG 16 3HB ARG 16 10.188 0.557 -12.589 126 HG2 ARG 16 2HG ARG 16 11.882 1.987 -11.547 127 HG3 ARG 16 3HG ARG 16 12.498 0.600 -10.647 128 HD2 ARG 16 2HD ARG 16 12.996 -0.524 -12.807 129 HD3 ARG 16 3HD ARG 16 12.485 0.939 -13.651 130 HE ARG 16 HE ARG 16 14.445 1.639 -11.785 131 HH11 ARG 16 1HH1 ARG 16 14.169 -0.141 -14.723 132 HH12 ARG 16 2HH1 ARG 16 15.805 0.160 -15.182 133 HH21 ARG 16 1HH2 ARG 16 16.536 1.996 -12.360 134 HH22 ARG 16 2HH2 ARG 16 17.142 1.354 -13.847 135 H LYS 17 H LYS 17 7.818 1.740 -11.748 136 HA LYS 17 HA LYS 17 8.497 4.437 -11.552 137 HB2 LYS 17 2HB LYS 17 5.848 3.030 -11.823 138 HB3 LYS 17 3HB LYS 17 5.905 4.772 -11.646 139 HG2 LYS 17 2HG LYS 17 5.784 4.456 -13.939 140 HG3 LYS 17 3HG LYS 17 7.498 4.746 -13.655 141 HD2 LYS 17 2HD LYS 17 7.918 2.326 -13.744 142 HD3 LYS 17 3HD LYS 17 6.199 2.040 -14.017 143 HE2 LYS 17 2HE LYS 17 6.373 3.447 -16.084 144 HE3 LYS 17 3HE LYS 17 8.118 3.501 -15.835 145 HZ1 LYS 17 3HZ LYS 17 7.641 1.784 -17.380 146 HZ2 LYS 17 1HZ LYS 17 6.462 1.100 -16.381 147 HZ3 LYS 17 2HZ LYS 17 8.089 1.035 -15.938 148 H PHE 18 H PHE 18 6.384 2.538 -9.402 149 HA PHE 18 HA PHE 18 5.876 4.586 -7.525 150 HB2 PHE 18 2HB PHE 18 5.856 1.580 -7.138 151 HB3 PHE 18 3HB PHE 18 5.139 2.751 -6.035 152 HD1 PHE 18 HD2 PHE 18 4.910 1.345 -9.458 153 HD2 PHE 18 HD1 PHE 18 2.971 3.612 -6.416 154 HE1 PHE 18 HE2 PHE 18 2.805 1.239 -10.725 155 HE2 PHE 18 HE1 PHE 18 0.866 3.510 -7.684 156 HZ PHE 18 HZ PHE 18 0.780 2.323 -9.838 157 H LYS 19 H LYS 19 8.311 2.010 -7.607 158 HA LYS 19 HA LYS 19 9.518 2.449 -5.123 159 HB2 LYS 19 2HB LYS 19 10.760 1.452 -7.703 160 HB3 LYS 19 3HB LYS 19 11.515 1.331 -6.118 161 HG2 LYS 19 2HG LYS 19 9.777 -0.140 -5.338 162 HG3 LYS 19 3HG LYS 19 8.861 0.086 -6.828 163 HD2 LYS 19 2HD LYS 19 10.020 -2.060 -6.845 164 HD3 LYS 19 3HD LYS 19 10.664 -1.000 -8.098 165 HE2 LYS 19 2HE LYS 19 12.584 -0.475 -6.701 166 HE3 LYS 19 3HE LYS 19 11.919 -1.443 -5.385 167 HZ1 LYS 19 3HZ LYS 19 13.616 -2.642 -6.618 168 HZ2 LYS 19 1HZ LYS 19 12.730 -2.482 -8.048 169 HZ3 LYS 19 2HZ LYS 19 12.118 -3.406 -6.769 170 H ASP 20 H ASP 20 10.203 3.954 -8.272 171 HA ASP 20 HA ASP 20 12.401 5.522 -7.392 172 HB2 ASP 20 2HB ASP 20 12.023 5.047 -9.763 173 HB3 ASP 20 3HB ASP 20 10.510 5.950 -9.725 174 H ILE 21 H ILE 21 8.925 6.242 -7.715 175 HA ILE 21 HA ILE 21 8.992 8.962 -7.084 176 HB ILE 21 HB ILE 21 6.822 6.931 -6.519 177 HG12 ILE 21 2HG1 ILE 21 7.113 8.981 -8.740 178 HG13 ILE 21 3HG1 ILE 21 7.426 7.257 -8.905 179 HG21 ILE 21 1HG2 ILE 21 5.286 8.852 -6.313 180 HG22 ILE 21 2HG2 ILE 21 6.664 9.950 -6.398 181 HG23 ILE 21 3HG2 ILE 21 6.507 8.834 -5.041 182 HD11 ILE 21 3HD1 ILE 21 4.764 8.501 -8.244 183 HD12 ILE 21 1HD1 ILE 21 5.084 6.777 -8.443 184 HD13 ILE 21 2HD1 ILE 21 5.258 7.871 -9.815 185 H ILE 22 H ILE 22 8.506 6.204 -4.852 186 HA ILE 22 HA ILE 22 8.263 7.661 -2.481 187 HB ILE 22 HB ILE 22 9.485 4.918 -2.869 188 HG12 ILE 22 2HG1 ILE 22 6.654 5.745 -2.155 189 HG13 ILE 22 3HG1 ILE 22 7.171 5.119 -3.716 190 HG21 ILE 22 1HG2 ILE 22 10.105 5.834 -0.695 191 HG22 ILE 22 2HG2 ILE 22 8.932 4.531 -0.507 192 HG23 ILE 22 3HG2 ILE 22 8.413 6.210 -0.355 193 HD11 ILE 22 3HD1 ILE 22 6.056 3.414 -2.409 194 HD12 ILE 22 1HD1 ILE 22 7.226 3.620 -1.107 195 HD13 ILE 22 2HD1 ILE 22 7.748 2.990 -2.670 196 H LYS 23 H LYS 23 11.224 6.306 -3.959 197 HA LYS 23 HA LYS 23 13.021 7.314 -2.008 198 HB2 LYS 23 2HB LYS 23 13.550 6.584 -4.901 199 HB3 LYS 23 3HB LYS 23 14.785 6.834 -3.673 200 HG2 LYS 23 2HG LYS 23 13.860 4.926 -2.397 201 HG3 LYS 23 3HG LYS 23 12.696 4.654 -3.697 202 HD2 LYS 23 2HD LYS 23 14.573 4.315 -5.270 203 HD3 LYS 23 3HD LYS 23 15.709 4.526 -3.936 204 HE2 LYS 23 2HE LYS 23 14.685 2.570 -2.808 205 HE3 LYS 23 3HE LYS 23 13.640 2.339 -4.211 206 HZ1 LYS 23 3HZ LYS 23 15.664 2.080 -5.568 207 HZ2 LYS 23 1HZ LYS 23 15.531 0.888 -4.371 208 HZ3 LYS 23 2HZ LYS 23 16.603 2.180 -4.165 209 H LYS 24 H LYS 24 11.716 8.674 -4.972 210 HA LYS 24 HA LYS 24 13.455 10.867 -5.274 211 HB2 LYS 24 2HB LYS 24 11.669 9.870 -6.887 212 HB3 LYS 24 3HB LYS 24 10.542 10.936 -6.064 213 HG2 LYS 24 2HG LYS 24 13.065 11.997 -7.299 214 HG3 LYS 24 3HG LYS 24 11.617 11.718 -8.266 215 HD2 LYS 24 2HD LYS 24 10.354 13.238 -6.814 216 HD3 LYS 24 3HD LYS 24 11.799 13.511 -5.836 217 HE2 LYS 24 2HE LYS 24 11.458 15.337 -7.410 218 HE3 LYS 24 3HE LYS 24 12.938 14.459 -7.788 219 HZ1 LYS 24 3HZ LYS 24 11.740 13.287 -9.539 220 HZ2 LYS 24 1HZ LYS 24 11.682 14.957 -9.783 221 HZ3 LYS 24 2HZ LYS 24 10.328 14.153 -9.181 222 H ASN 25 H ASN 25 10.574 10.416 -3.297 223 HA ASN 25 HA ASN 25 10.491 13.166 -2.418 224 HB2 ASN 25 2HB ASN 25 9.058 10.675 -1.486 225 HB3 ASN 25 3HB ASN 25 8.847 12.241 -0.706 226 HD21 ASN 25 1HD2 ASN 25 8.180 10.340 -3.517 227 HD22 ASN 25 2HD2 ASN 25 7.063 11.437 -4.236 228 H GLY 26 H GLY 26 11.982 10.193 -1.274 229 HA2 GLY 26 2HA GLY 26 14.093 10.745 0.003 230 HA3 GLY 26 3HA GLY 26 13.055 11.685 1.058 231 H PHE 27 H PHE 27 11.207 9.091 0.342 232 HA PHE 27 HA PHE 27 11.890 7.822 2.887 233 HB2 PHE 27 2HB PHE 27 9.488 7.568 1.066 234 HB3 PHE 27 3HB PHE 27 9.710 6.590 2.515 235 HD1 PHE 27 HD2 PHE 27 9.429 10.108 1.336 236 HD2 PHE 27 HD1 PHE 27 9.077 7.406 4.612 237 HE1 PHE 27 HE2 PHE 27 8.433 11.894 2.702 238 HE2 PHE 27 HE1 PHE 27 8.080 9.190 5.981 239 HZ PHE 27 HZ PHE 27 7.757 11.437 5.027 240 H LYS 28 H LYS 28 11.787 5.428 3.068 241 HA LYS 28 HA LYS 28 13.273 4.196 0.857 242 HB2 LYS 28 2HB LYS 28 12.910 3.402 3.750 243 HB3 LYS 28 3HB LYS 28 13.644 2.330 2.566 244 HG2 LYS 28 2HG LYS 28 15.402 3.415 3.734 245 HG3 LYS 28 3HG LYS 28 15.345 4.103 2.114 246 HD2 LYS 28 2HD LYS 28 15.668 5.916 3.617 247 HD3 LYS 28 3HD LYS 28 13.990 6.001 3.083 248 HE2 LYS 28 2HE LYS 28 14.004 6.397 5.433 249 HE3 LYS 28 3HE LYS 28 13.362 4.771 5.189 250 HZ1 LYS 28 3HZ LYS 28 15.587 3.896 5.700 251 HZ2 LYS 28 1HZ LYS 28 14.948 4.784 6.992 252 HZ3 LYS 28 2HZ LYS 28 16.134 5.465 6.003 253 H VAL 29 H VAL 29 12.794 1.932 0.255 254 HA VAL 29 HA VAL 29 9.867 1.475 0.203 255 HB VAL 29 HB VAL 29 11.818 0.810 -2.015 256 HG11 VAL 29 1HG1 VAL 29 9.835 -0.617 -1.972 257 HG12 VAL 29 2HG1 VAL 29 9.803 0.463 -3.367 258 HG13 VAL 29 3HG1 VAL 29 8.796 0.810 -1.961 259 HG21 VAL 29 3HG2 VAL 29 9.903 3.139 -1.832 260 HG22 VAL 29 1HG2 VAL 29 10.873 2.709 -3.242 261 HG23 VAL 29 2HG2 VAL 29 11.663 3.235 -1.754 262 H ARG 30 H ARG 30 9.185 -0.475 0.916 263 HA ARG 30 HA ARG 30 10.970 -2.801 0.552 264 HB2 ARG 30 2HB ARG 30 9.267 -2.188 2.977 265 HB3 ARG 30 3HB ARG 30 9.959 -3.773 2.660 266 HG2 ARG 30 2HG ARG 30 12.213 -2.554 2.542 267 HG3 ARG 30 3HG ARG 30 11.373 -1.203 3.296 268 HD2 ARG 30 2HD ARG 30 11.619 -3.996 4.418 269 HD3 ARG 30 3HD ARG 30 12.533 -2.586 4.947 270 HE ARG 30 HE ARG 30 9.601 -2.756 5.207 271 HH11 ARG 30 1HH1 ARG 30 12.709 -2.060 6.523 272 HH12 ARG 30 2HH1 ARG 30 12.074 -1.586 8.055 273 HH21 ARG 30 1HH2 ARG 30 8.802 -2.161 7.180 274 HH22 ARG 30 2HH2 ARG 30 9.878 -1.650 8.428 275 H THR 31 H THR 31 10.089 -4.027 -0.985 276 HA THR 31 HA THR 31 7.193 -4.000 -1.410 277 HB THR 31 HB THR 31 7.684 -5.209 -3.521 278 HG1 THR 31 HG1 THR 31 9.632 -6.260 -2.821 279 HG21 THR 31 3HG2 THR 31 8.782 -3.357 -4.674 280 HG22 THR 31 1HG2 THR 31 9.367 -2.725 -3.135 281 HG23 THR 31 2HG2 THR 31 7.637 -2.745 -3.480 282 H VAL 32 H VAL 32 5.983 -5.476 -0.429 283 HA VAL 32 HA VAL 32 7.054 -7.833 0.781 284 HB VAL 32 HB VAL 32 4.173 -6.988 0.390 285 HG11 VAL 32 1HG1 VAL 32 3.673 -8.549 2.237 286 HG12 VAL 32 2HG1 VAL 32 5.345 -9.106 2.197 287 HG13 VAL 32 3HG1 VAL 32 4.295 -9.374 0.807 288 HG21 VAL 32 3HG2 VAL 32 4.301 -6.200 2.704 289 HG22 VAL 32 1HG2 VAL 32 5.479 -5.374 1.683 290 HG23 VAL 32 2HG2 VAL 32 6.004 -6.659 2.772 291 H ARG 33 H ARG 33 7.123 -9.862 0.076 292 HA ARG 33 HA ARG 33 5.846 -10.574 -2.491 293 HB2 ARG 33 2HB ARG 33 7.639 -12.347 -2.593 294 HB3 ARG 33 3HB ARG 33 8.236 -10.693 -2.670 295 HG2 ARG 33 2HG ARG 33 8.710 -10.833 -0.217 296 HG3 ARG 33 3HG ARG 33 8.292 -12.543 -0.293 297 HD2 ARG 33 2HD ARG 33 10.115 -12.977 -1.805 298 HD3 ARG 33 3HD ARG 33 10.465 -11.252 -1.947 299 HE ARG 33 HE ARG 33 10.611 -12.076 0.758 300 HH11 ARG 33 1HH1 ARG 33 12.358 -12.194 -2.211 301 HH12 ARG 33 2HH1 ARG 33 13.886 -12.376 -1.419 302 HH21 ARG 33 1HH2 ARG 33 12.568 -12.273 1.757 303 HH22 ARG 33 2HH2 ARG 33 14.008 -12.407 0.799 304 H SER 34 H SER 34 6.058 -11.325 0.863 305 HA SER 34 HA SER 34 4.047 -13.433 0.607 306 HB2 SER 34 2HB SER 34 6.631 -13.840 2.160 307 HB3 SER 34 3HB SER 34 5.278 -14.966 2.096 308 HG SER 34 HG SER 34 6.109 -15.730 0.339 309 HA PRO 35 HA PRO 35 2.161 -11.453 4.074 310 HB2 PRO 35 2HB PRO 35 1.523 -13.608 5.726 311 HB3 PRO 35 3HB PRO 35 0.551 -13.040 4.366 312 HG2 PRO 35 2HG PRO 35 2.506 -15.299 4.487 313 HG3 PRO 35 3HG PRO 35 0.946 -15.208 3.647 314 HD2 PRO 35 2HD PRO 35 3.268 -14.970 2.322 315 HD3 PRO 35 3HD PRO 35 1.844 -14.015 1.859 316 H GLN 36 H GLN 36 4.484 -13.974 4.976 317 HA GLN 36 HA GLN 36 5.120 -13.154 7.562 318 HB2 GLN 36 2HB GLN 36 7.191 -14.408 7.280 319 HB3 GLN 36 3HB GLN 36 5.850 -15.284 6.556 320 HG2 GLN 36 2HG GLN 36 6.548 -14.406 4.332 321 HG3 GLN 36 3HG GLN 36 7.959 -13.687 5.106 322 HE21 GLN 36 1HE2 GLN 36 7.881 -15.691 3.024 323 HE22 GLN 36 2HE2 GLN 36 8.689 -17.082 3.646 324 H GLU 37 H GLU 37 6.204 -11.876 4.473 325 HA GLU 37 HA GLU 37 8.430 -10.399 5.453 326 HB2 GLU 37 2HB GLU 37 6.822 -9.909 2.935 327 HB3 GLU 37 3HB GLU 37 8.449 -9.330 3.264 328 HG2 GLU 37 2HG GLU 37 7.671 -12.236 3.025 329 HG3 GLU 37 3HG GLU 37 8.368 -11.268 1.728 330 H LEU 38 H LEU 38 5.032 -9.564 4.850 331 HA LEU 38 HA LEU 38 5.238 -6.797 5.407 332 HB2 LEU 38 2HB LEU 38 3.294 -7.783 4.290 333 HB3 LEU 38 3HB LEU 38 2.886 -8.666 5.749 334 HG LEU 38 HG LEU 38 2.474 -6.514 6.917 335 HD11 LEU 38 1HD1 LEU 38 3.956 -5.079 5.614 336 HD12 LEU 38 2HD1 LEU 38 2.314 -4.441 5.623 337 HD13 LEU 38 3HD1 LEU 38 2.924 -5.279 4.196 338 HD21 LEU 38 3HD2 LEU 38 0.900 -6.877 4.366 339 HD22 LEU 38 1HD2 LEU 38 0.370 -5.983 5.792 340 HD23 LEU 38 2HD2 LEU 38 0.622 -7.726 5.886 341 H LYS 39 H LYS 39 4.313 -9.539 7.481 342 HA LYS 39 HA LYS 39 3.977 -8.193 9.891 343 HB2 LYS 39 2HB LYS 39 3.359 -10.530 9.572 344 HB3 LYS 39 3HB LYS 39 5.048 -10.980 9.378 345 HG2 LYS 39 2HG LYS 39 5.492 -10.368 11.698 346 HG3 LYS 39 3HG LYS 39 3.811 -9.869 11.898 347 HD2 LYS 39 2HD LYS 39 4.692 -12.667 11.159 348 HD3 LYS 39 3HD LYS 39 4.299 -12.141 12.795 349 HE2 LYS 39 2HE LYS 39 2.018 -11.627 12.111 350 HE3 LYS 39 3HE LYS 39 2.401 -12.062 10.444 351 HZ1 LYS 39 3HZ LYS 39 2.632 -13.961 12.706 352 HZ2 LYS 39 1HZ LYS 39 2.683 -14.311 11.052 353 HZ3 LYS 39 2HZ LYS 39 1.234 -13.811 11.763 354 H ASP 40 H ASP 40 6.949 -9.654 8.572 355 HA ASP 40 HA ASP 40 8.665 -8.975 10.696 356 HB2 ASP 40 2HB ASP 40 9.116 -10.657 8.890 357 HB3 ASP 40 3HB ASP 40 9.392 -9.324 7.773 358 H SER 41 H SER 41 7.886 -7.260 7.691 359 HA SER 41 HA SER 41 9.630 -5.089 7.909 360 HB2 SER 41 2HB SER 41 8.411 -5.467 5.856 361 HB3 SER 41 3HB SER 41 6.864 -5.256 6.676 362 HG SER 41 HG SER 41 7.129 -3.291 5.903 363 H ILE 42 H ILE 42 6.331 -5.460 9.214 364 HA ILE 42 HA ILE 42 6.164 -2.856 10.319 365 HB ILE 42 HB ILE 42 4.694 -5.375 11.133 366 HG12 ILE 42 2HG1 ILE 42 3.919 -3.082 9.299 367 HG13 ILE 42 3HG1 ILE 42 4.316 -4.722 8.796 368 HG21 ILE 42 1HG2 ILE 42 4.068 -2.492 11.808 369 HG22 ILE 42 2HG2 ILE 42 4.651 -3.715 12.938 370 HG23 ILE 42 3HG2 ILE 42 3.060 -3.888 12.198 371 HD11 ILE 42 3HD1 ILE 42 1.939 -4.380 8.752 372 HD12 ILE 42 1HD1 ILE 42 1.946 -3.881 10.443 373 HD13 ILE 42 2HD1 ILE 42 2.349 -5.543 10.011 374 H GLU 43 H GLU 43 7.326 -5.934 11.662 375 HA GLU 43 HA GLU 43 7.812 -5.018 14.284 376 HB2 GLU 43 2HB GLU 43 9.184 -7.198 12.699 377 HB3 GLU 43 3HB GLU 43 9.444 -6.920 14.417 378 HG2 GLU 43 2HG GLU 43 6.850 -7.702 13.092 379 HG3 GLU 43 3HG GLU 43 7.872 -8.728 14.096 380 H GLU 44 H GLU 44 9.608 -4.554 11.321 381 HA GLU 44 HA GLU 44 11.911 -3.422 12.601 382 HB2 GLU 44 2HB GLU 44 10.879 -3.103 9.772 383 HB3 GLU 44 3HB GLU 44 12.429 -2.497 10.343 384 HG2 GLU 44 2HG GLU 44 13.044 -4.853 10.925 385 HG3 GLU 44 3HG GLU 44 11.560 -5.371 10.123 386 H LEU 45 H LEU 45 8.943 -2.102 11.161 387 HA LEU 45 HA LEU 45 9.559 0.630 11.381 388 HB2 LEU 45 2HB LEU 45 6.856 -0.720 11.484 389 HB3 LEU 45 3HB LEU 45 7.110 0.998 11.235 390 HG LEU 45 HG LEU 45 8.015 -1.198 9.357 391 HD11 LEU 45 1HD1 LEU 45 6.297 -0.322 7.847 392 HD12 LEU 45 2HD1 LEU 45 5.766 0.804 9.099 393 HD13 LEU 45 3HD1 LEU 45 5.595 -0.935 9.344 394 HD21 LEU 45 3HD2 LEU 45 8.560 0.642 7.825 395 HD22 LEU 45 1HD2 LEU 45 9.527 0.708 9.298 396 HD23 LEU 45 2HD2 LEU 45 8.163 1.808 9.088 397 H VAL 46 H VAL 46 8.081 -1.571 13.743 398 HA VAL 46 HA VAL 46 7.273 0.389 15.606 399 HB VAL 46 HB VAL 46 6.494 -1.984 15.608 400 HG11 VAL 46 1HG1 VAL 46 7.831 -3.689 16.752 401 HG12 VAL 46 2HG1 VAL 46 9.175 -2.552 16.872 402 HG13 VAL 46 3HG1 VAL 46 8.626 -3.105 15.290 403 HG21 VAL 46 3HG2 VAL 46 6.362 -2.202 18.059 404 HG22 VAL 46 1HG2 VAL 46 6.037 -0.555 17.519 405 HG23 VAL 46 2HG2 VAL 46 7.602 -0.959 18.226 406 H LYS 47 H LYS 47 10.413 -0.751 14.825 407 HA LYS 47 HA LYS 47 11.530 0.467 17.280 408 HB2 LYS 47 2HB LYS 47 12.625 -1.760 15.554 409 HB3 LYS 47 3HB LYS 47 13.554 -0.964 16.815 410 HG2 LYS 47 2HG LYS 47 10.956 -2.417 17.304 411 HG3 LYS 47 3HG LYS 47 12.551 -3.152 17.476 412 HD2 LYS 47 2HD LYS 47 13.122 -1.412 19.157 413 HD3 LYS 47 3HD LYS 47 11.475 -0.789 19.031 414 HE2 LYS 47 2HE LYS 47 10.579 -2.885 19.850 415 HE3 LYS 47 3HE LYS 47 12.188 -3.609 19.852 416 HZ1 LYS 47 3HZ LYS 47 11.553 -2.930 22.066 417 HZ2 LYS 47 1HZ LYS 47 11.302 -1.339 21.552 418 HZ3 LYS 47 2HZ LYS 47 12.860 -1.997 21.535 419 H LYS 48 H LYS 48 12.544 -0.229 13.920 420 HA LYS 48 HA LYS 48 13.937 2.384 13.841 421 HB2 LYS 48 2HB LYS 48 14.654 0.059 12.066 422 HB3 LYS 48 3HB LYS 48 15.645 1.431 12.540 423 HG2 LYS 48 2HG LYS 48 15.909 0.524 14.770 424 HG3 LYS 48 3HG LYS 48 14.804 -0.801 14.387 425 HD2 LYS 48 2HD LYS 48 16.420 -1.419 12.519 426 HD3 LYS 48 3HD LYS 48 17.553 -0.283 13.257 427 HE2 LYS 48 2HE LYS 48 17.995 -2.566 13.999 428 HE3 LYS 48 3HE LYS 48 17.473 -1.556 15.345 429 HZ1 LYS 48 3HZ LYS 48 16.452 -3.853 15.164 430 HZ2 LYS 48 1HZ LYS 48 15.571 -3.264 13.849 431 HZ3 LYS 48 2HZ LYS 48 15.375 -2.569 15.377 432 H TYR 49 H TYR 49 14.432 2.796 11.268 433 HA TYR 49 HA TYR 49 13.660 3.318 9.195 434 HB2 TYR 49 2HB TYR 49 12.353 0.619 9.569 435 HB3 TYR 49 3HB TYR 49 12.429 1.465 8.026 436 HD1 TYR 49 HD2 TYR 49 14.731 2.041 7.089 437 HD2 TYR 49 HD1 TYR 49 14.173 -0.708 10.292 438 HE1 TYR 49 HE2 TYR 49 16.967 1.111 6.675 439 HE2 TYR 49 HE1 TYR 49 16.411 -1.642 9.885 440 HH TYR 49 HH TYR 49 18.708 -0.111 7.900 441 H ASN 50 H ASN 50 12.084 4.535 11.239 442 HA ASN 50 HA ASN 50 9.295 4.269 10.826 443 HB2 ASN 50 2HB ASN 50 10.971 6.513 11.951 444 HB3 ASN 50 3HB ASN 50 9.213 6.581 11.900 445 HD21 ASN 50 1HD2 ASN 50 10.778 3.525 12.428 446 HD22 ASN 50 2HD2 ASN 50 10.395 3.405 14.102 447 H ALA 51 H ALA 51 11.634 5.633 8.783 448 HA ALA 51 HA ALA 51 9.604 7.196 7.308 449 HB1 ALA 51 3HB ALA 51 11.577 8.481 7.984 450 HB2 ALA 51 1HB ALA 51 11.484 8.336 6.227 451 HB3 ALA 51 2HB ALA 51 12.619 7.338 7.137 452 H THR 52 H THR 52 9.785 4.292 7.194 453 HA THR 52 HA THR 52 10.650 3.899 4.388 454 HB THR 52 HB THR 52 10.458 1.801 6.569 455 HG1 THR 52 HG1 THR 52 12.259 3.003 6.974 456 HG21 THR 52 3HG2 THR 52 11.522 1.598 3.741 457 HG22 THR 52 1HG2 THR 52 10.024 0.877 4.331 458 HG23 THR 52 2HG2 THR 52 11.576 0.323 4.958 459 H ILE 53 H ILE 53 9.019 3.690 2.996 460 HA ILE 53 HA ILE 53 6.349 2.941 3.902 461 HB ILE 53 HB ILE 53 7.296 3.702 1.125 462 HG12 ILE 53 2HG1 ILE 53 5.982 5.382 3.284 463 HG13 ILE 53 3HG1 ILE 53 7.636 5.545 2.706 464 HG21 ILE 53 1HG2 ILE 53 4.912 4.095 0.663 465 HG22 ILE 53 2HG2 ILE 53 4.508 3.496 2.273 466 HG23 ILE 53 3HG2 ILE 53 5.233 2.412 1.085 467 HD11 ILE 53 3HD1 ILE 53 6.251 7.279 1.777 468 HD12 ILE 53 1HD1 ILE 53 5.128 6.083 1.126 469 HD13 ILE 53 2HD1 ILE 53 6.774 6.186 0.495 470 H VAL 54 H VAL 54 5.389 0.983 3.539 471 HA VAL 54 HA VAL 54 7.018 -1.035 2.139 472 HB VAL 54 HB VAL 54 6.587 -1.470 4.531 473 HG11 VAL 54 1HG1 VAL 54 4.373 -2.131 5.309 474 HG12 VAL 54 2HG1 VAL 54 3.690 -1.740 3.731 475 HG13 VAL 54 3HG1 VAL 54 4.371 -0.461 4.737 476 HG21 VAL 54 3HG2 VAL 54 7.021 -3.310 2.983 477 HG22 VAL 54 1HG2 VAL 54 5.289 -3.466 2.678 478 HG23 VAL 54 2HG2 VAL 54 5.935 -3.805 4.284 479 H VAL 55 H VAL 55 6.335 -1.888 0.310 480 HA VAL 55 HA VAL 55 3.605 -1.291 -0.630 481 HB VAL 55 HB VAL 55 6.075 -1.961 -2.250 482 HG11 VAL 55 1HG1 VAL 55 4.765 -1.246 -4.189 483 HG12 VAL 55 2HG1 VAL 55 3.359 -0.994 -3.155 484 HG13 VAL 55 3HG1 VAL 55 4.008 -2.619 -3.379 485 HG21 VAL 55 3HG2 VAL 55 4.738 0.709 -1.787 486 HG22 VAL 55 1HG2 VAL 55 6.087 0.408 -2.884 487 HG23 VAL 55 2HG2 VAL 55 6.300 0.204 -1.146 488 H VAL 56 H VAL 56 2.280 -3.003 -0.349 489 HA VAL 56 HA VAL 56 3.266 -5.732 -0.515 490 HB VAL 56 HB VAL 56 0.425 -4.759 -0.099 491 HG11 VAL 56 1HG1 VAL 56 0.011 -7.025 0.772 492 HG12 VAL 56 2HG1 VAL 56 1.661 -7.484 0.349 493 HG13 VAL 56 3HG1 VAL 56 0.513 -7.055 -0.919 494 HG21 VAL 56 3HG2 VAL 56 2.480 -5.619 1.951 495 HG22 VAL 56 1HG2 VAL 56 0.797 -5.203 2.284 496 HG23 VAL 56 2HG2 VAL 56 1.909 -3.972 1.686 497 H VAL 57 H VAL 57 3.652 -6.483 -2.518 498 HA VAL 57 HA VAL 57 2.067 -5.667 -4.803 499 HB VAL 57 HB VAL 57 4.221 -7.796 -4.695 500 HG11 VAL 57 1HG1 VAL 57 4.449 -7.339 -7.099 501 HG12 VAL 57 2HG1 VAL 57 3.109 -6.194 -7.005 502 HG13 VAL 57 3HG1 VAL 57 2.830 -7.908 -6.695 503 HG21 VAL 57 3HG2 VAL 57 5.109 -5.680 -3.857 504 HG22 VAL 57 1HG2 VAL 57 4.506 -4.845 -5.289 505 HG23 VAL 57 2HG2 VAL 57 5.780 -6.054 -5.445 506 H VAL 58 H VAL 58 0.182 -6.612 -5.317 507 HA VAL 58 HA VAL 58 -0.277 -9.399 -4.460 508 HB VAL 58 HB VAL 58 -2.627 -8.862 -4.052 509 HG11 VAL 58 1HG1 VAL 58 -1.087 -8.711 -2.182 510 HG12 VAL 58 2HG1 VAL 58 -2.320 -7.460 -2.040 511 HG13 VAL 58 3HG1 VAL 58 -0.702 -7.039 -2.597 512 HG21 VAL 58 3HG2 VAL 58 -1.860 -6.000 -4.663 513 HG22 VAL 58 1HG2 VAL 58 -3.425 -6.549 -4.066 514 HG23 VAL 58 2HG2 VAL 58 -2.877 -7.032 -5.670 515 H ASP 59 H ASP 59 -1.823 -10.632 -5.661 516 HA ASP 59 HA ASP 59 -2.199 -9.765 -8.460 517 HB2 ASP 59 2HB ASP 59 -2.065 -12.125 -9.106 518 HB3 ASP 59 3HB ASP 59 -0.615 -11.655 -8.226 519 H ASP 60 H ASP 60 -3.583 -11.787 -5.877 520 HA ASP 60 HA ASP 60 -6.246 -11.596 -7.135 521 HB2 ASP 60 2HB ASP 60 -5.307 -13.867 -6.867 522 HB3 ASP 60 3HB ASP 60 -5.165 -13.600 -5.134 523 H LYS 61 H LYS 61 -8.110 -11.340 -5.714 524 HA LYS 61 HA LYS 61 -7.859 -9.172 -3.962 525 HB2 LYS 61 2HB LYS 61 -9.947 -9.670 -5.120 526 HB3 LYS 61 3HB LYS 61 -10.126 -11.163 -4.205 527 HG2 LYS 61 2HG LYS 61 -10.297 -9.845 -2.125 528 HG3 LYS 61 3HG LYS 61 -10.181 -8.363 -3.074 529 HD2 LYS 61 2HD LYS 61 -12.256 -8.930 -4.236 530 HD3 LYS 61 3HD LYS 61 -12.354 -10.451 -3.344 531 HE2 LYS 61 2HE LYS 61 -12.519 -9.192 -1.239 532 HE3 LYS 61 3HE LYS 61 -12.445 -7.680 -2.142 533 HZ1 LYS 61 3HZ LYS 61 -14.712 -8.307 -1.555 534 HZ2 LYS 61 1HZ LYS 61 -14.560 -9.739 -2.439 535 HZ3 LYS 61 2HZ LYS 61 -14.501 -8.252 -3.232 536 H GLU 62 H GLU 62 -8.084 -12.651 -3.245 537 HA GLU 62 HA GLU 62 -8.411 -12.369 -0.446 538 HB2 GLU 62 2HB GLU 62 -7.278 -14.684 -2.031 539 HB3 GLU 62 3HB GLU 62 -7.695 -14.748 -0.323 540 HG2 GLU 62 2HG GLU 62 -10.038 -14.176 -0.931 541 HG3 GLU 62 3HG GLU 62 -9.579 -14.292 -2.629 542 H TRP 63 H TRP 63 -5.486 -12.742 -2.438 543 HA TRP 63 HA TRP 63 -3.648 -12.769 -0.281 544 HB2 TRP 63 2HB TRP 63 -2.862 -13.545 -2.385 545 HB3 TRP 63 3HB TRP 63 -3.367 -12.077 -3.209 546 HD1 TRP 63 HD1 TRP 63 -1.145 -11.200 -4.135 547 HE1 TRP 63 HE1 TRP 63 1.102 -10.461 -3.134 548 HE3 TRP 63 HE3 TRP 63 -1.822 -12.814 0.674 549 HZ2 TRP 63 HZ2 TRP 63 2.417 -10.554 -0.647 550 HZ3 TRP 63 HZ3 TRP 63 -0.015 -12.448 2.298 551 HH2 TRP 63 HH2 TRP 63 2.060 -11.342 1.651 552 H ALA 64 H ALA 64 -5.042 -10.114 -2.186 553 HA ALA 64 HA ALA 64 -3.626 -8.007 -0.948 554 HB1 ALA 64 3HB ALA 64 -6.417 -7.956 -2.106 555 HB2 ALA 64 1HB ALA 64 -4.923 -7.735 -3.016 556 HB3 ALA 64 2HB ALA 64 -5.391 -6.555 -1.792 557 H GLU 65 H GLU 65 -6.708 -9.560 -0.123 558 HA GLU 65 HA GLU 65 -7.311 -7.928 2.118 559 HB2 GLU 65 2HB GLU 65 -8.723 -9.732 0.693 560 HB3 GLU 65 3HB GLU 65 -8.283 -10.750 2.054 561 HG2 GLU 65 2HG GLU 65 -9.790 -8.138 2.194 562 HG3 GLU 65 3HG GLU 65 -10.478 -9.750 2.360 563 H LYS 66 H LYS 66 -5.424 -10.860 1.686 564 HA LYS 66 HA LYS 66 -5.085 -11.758 4.278 565 HB2 LYS 66 2HB LYS 66 -4.196 -12.839 2.213 566 HB3 LYS 66 3HB LYS 66 -2.945 -11.609 2.136 567 HG2 LYS 66 2HG LYS 66 -2.052 -13.651 3.064 568 HG3 LYS 66 3HG LYS 66 -2.062 -12.387 4.296 569 HD2 LYS 66 2HD LYS 66 -4.015 -13.327 5.335 570 HD3 LYS 66 3HD LYS 66 -4.222 -14.478 4.013 571 HE2 LYS 66 2HE LYS 66 -2.166 -15.611 4.633 572 HE3 LYS 66 3HE LYS 66 -1.850 -14.411 5.886 573 HZ1 LYS 66 3HZ LYS 66 -3.709 -15.153 7.119 574 HZ2 LYS 66 1HZ LYS 66 -2.836 -16.534 6.688 575 HZ3 LYS 66 2HZ LYS 66 -4.259 -16.139 5.862 576 H ALA 67 H ALA 67 -3.500 -9.055 2.663 577 HA ALA 67 HA ALA 67 -1.771 -8.406 4.871 578 HB1 ALA 67 3HB ALA 67 -2.534 -6.748 2.461 579 HB2 ALA 67 1HB ALA 67 -1.168 -7.860 2.553 580 HB3 ALA 67 2HB ALA 67 -1.203 -6.420 3.571 581 H ILE 68 H ILE 68 -4.766 -6.989 3.535 582 HA ILE 68 HA ILE 68 -4.957 -4.821 5.317 583 HB ILE 68 HB ILE 68 -7.213 -6.265 3.903 584 HG12 ILE 68 2HG1 ILE 68 -5.490 -5.476 2.342 585 HG13 ILE 68 3HG1 ILE 68 -6.959 -4.524 2.173 586 HG21 ILE 68 1HG2 ILE 68 -8.056 -4.856 5.696 587 HG22 ILE 68 2HG2 ILE 68 -8.440 -4.139 4.131 588 HG23 ILE 68 3HG2 ILE 68 -7.114 -3.489 5.097 589 HD11 ILE 68 3HD1 ILE 68 -4.468 -3.682 3.640 590 HD12 ILE 68 1HD1 ILE 68 -5.941 -2.725 3.479 591 HD13 ILE 68 2HD1 ILE 68 -4.987 -3.124 2.050 592 H ARG 69 H ARG 69 -6.572 -8.011 5.477 593 HA ARG 69 HA ARG 69 -7.867 -7.781 7.902 594 HB2 ARG 69 2HB ARG 69 -8.179 -9.741 6.551 595 HB3 ARG 69 3HB ARG 69 -6.477 -10.167 6.672 596 HG2 ARG 69 2HG ARG 69 -6.750 -10.606 9.062 597 HG3 ARG 69 3HG ARG 69 -8.457 -10.172 8.950 598 HD2 ARG 69 2HD ARG 69 -7.157 -12.413 7.397 599 HD3 ARG 69 3HD ARG 69 -8.016 -12.629 8.922 600 HE ARG 69 HE ARG 69 -9.392 -11.460 6.597 601 HH11 ARG 69 1HH1 ARG 69 -9.065 -13.977 8.928 602 HH12 ARG 69 2HH1 ARG 69 -10.610 -14.668 8.571 603 HH21 ARG 69 1HH2 ARG 69 -11.389 -12.371 6.145 604 HH22 ARG 69 2HH2 ARG 69 -11.902 -13.774 7.021 605 H PHE 70 H PHE 70 -4.486 -8.773 7.349 606 HA PHE 70 HA PHE 70 -3.764 -9.223 10.013 607 HB2 PHE 70 2HB PHE 70 -2.326 -9.898 8.157 608 HB3 PHE 70 3HB PHE 70 -2.055 -8.215 7.719 609 HD1 PHE 70 HD1 PHE 70 -1.787 -10.343 10.788 610 HD2 PHE 70 HD2 PHE 70 -0.010 -7.354 8.323 611 HE1 PHE 70 HE1 PHE 70 0.168 -10.282 12.277 612 HE2 PHE 70 HE2 PHE 70 1.945 -7.289 9.815 613 HZ PHE 70 HZ PHE 70 2.036 -8.753 11.792 614 H VAL 71 H VAL 71 -3.575 -6.231 8.093 615 HA VAL 71 HA VAL 71 -2.523 -4.518 10.030 616 HB VAL 71 HB VAL 71 -4.543 -3.868 7.867 617 HG11 VAL 71 1HG1 VAL 71 -2.714 -2.002 9.390 618 HG12 VAL 71 2HG1 VAL 71 -4.460 -2.125 9.599 619 HG13 VAL 71 3HG1 VAL 71 -3.797 -1.556 8.068 620 HG21 VAL 71 3HG2 VAL 71 -2.601 -3.169 6.550 621 HG22 VAL 71 1HG2 VAL 71 -2.479 -4.869 7.001 622 HG23 VAL 71 2HG2 VAL 71 -1.525 -3.659 7.858 623 H LYS 72 H LYS 72 -5.940 -5.325 9.370 624 HA LYS 72 HA LYS 72 -7.051 -3.755 11.438 625 HB2 LYS 72 2HB LYS 72 -8.394 -4.692 9.592 626 HB3 LYS 72 3HB LYS 72 -8.130 -6.313 10.222 627 HG2 LYS 72 2HG LYS 72 -10.335 -5.512 10.837 628 HG3 LYS 72 3HG LYS 72 -9.334 -5.712 12.277 629 HD2 LYS 72 2HD LYS 72 -8.840 -3.255 12.179 630 HD3 LYS 72 3HD LYS 72 -10.015 -3.125 10.869 631 HE2 LYS 72 2HE LYS 72 -11.750 -4.026 12.387 632 HE3 LYS 72 3HE LYS 72 -10.563 -4.056 13.690 633 HZ1 LYS 72 3HZ LYS 72 -11.589 -1.661 12.265 634 HZ2 LYS 72 1HZ LYS 72 -10.310 -1.625 13.373 635 HZ3 LYS 72 2HZ LYS 72 -11.856 -2.078 13.882 636 H SER 73 H SER 73 -5.751 -7.032 11.400 637 HA SER 73 HA SER 73 -6.572 -7.763 14.025 638 HB2 SER 73 2HB SER 73 -4.298 -8.836 12.330 639 HB3 SER 73 3HB SER 73 -4.892 -9.584 13.812 640 HG SER 73 HG SER 73 -6.957 -9.114 12.158 641 H LEU 74 H LEU 74 -4.144 -5.639 12.918 642 HA LEU 74 HA LEU 74 -2.523 -5.731 15.318 643 HB2 LEU 74 2HB LEU 74 -2.657 -3.634 13.140 644 HB3 LEU 74 3HB LEU 74 -1.429 -3.736 14.390 645 HG LEU 74 HG LEU 74 -1.874 -5.832 12.256 646 HD11 LEU 74 1HD1 LEU 74 0.140 -4.952 11.209 647 HD12 LEU 74 2HD1 LEU 74 0.241 -3.685 12.432 648 HD13 LEU 74 3HD1 LEU 74 -1.112 -3.711 11.299 649 HD21 LEU 74 3HD2 LEU 74 -0.881 -6.713 14.317 650 HD22 LEU 74 1HD2 LEU 74 0.370 -5.473 14.250 651 HD23 LEU 74 2HD2 LEU 74 0.283 -6.710 12.994 652 H GLY 75 H GLY 75 -4.946 -3.507 13.936 653 HA2 GLY 75 2HA GLY 75 -6.648 -2.513 15.317 654 HA3 GLY 75 3HA GLY 75 -5.530 -2.540 16.670 655 H ALA 76 H ALA 76 -3.290 -1.403 15.473 656 HA ALA 76 HA ALA 76 -3.688 1.329 15.822 657 HB1 ALA 76 3HB ALA 76 -1.503 -0.002 14.219 658 HB2 ALA 76 1HB ALA 76 -1.503 0.204 15.971 659 HB3 ALA 76 2HB ALA 76 -1.450 1.617 14.917 660 H GLN 77 H GLN 77 -4.391 2.973 14.532 661 HA GLN 77 HA GLN 77 -5.413 2.363 11.922 662 HB2 GLN 77 2HB GLN 77 -6.128 4.701 11.826 663 HB3 GLN 77 3HB GLN 77 -6.592 3.956 13.346 664 HG2 GLN 77 2HG GLN 77 -4.694 5.064 14.453 665 HG3 GLN 77 3HG GLN 77 -4.276 5.841 12.924 666 HE21 GLN 77 1HE2 GLN 77 -5.639 7.480 12.118 667 HE22 GLN 77 2HE2 GLN 77 -6.786 8.277 13.133 668 H VAL 78 H VAL 78 -4.349 2.411 10.066 669 HA VAL 78 HA VAL 78 -1.876 4.015 9.856 670 HB VAL 78 HB VAL 78 -0.871 2.262 8.498 671 HG11 VAL 78 1HG1 VAL 78 -0.542 0.554 10.208 672 HG12 VAL 78 2HG1 VAL 78 -1.979 1.108 11.066 673 HG13 VAL 78 3HG1 VAL 78 -0.568 2.158 10.943 674 HG21 VAL 78 3HG2 VAL 78 -2.898 1.377 7.454 675 HG22 VAL 78 1HG2 VAL 78 -3.409 0.698 9.000 676 HG23 VAL 78 2HG2 VAL 78 -1.963 0.082 8.201 677 H LEU 79 H LEU 79 -1.231 4.482 7.578 678 HA LEU 79 HA LEU 79 -3.595 5.208 5.995 679 HB2 LEU 79 2HB LEU 79 -1.976 6.971 6.595 680 HB3 LEU 79 3HB LEU 79 -0.713 6.100 5.745 681 HG LEU 79 HG LEU 79 -1.840 6.473 3.609 682 HD11 LEU 79 1HD1 LEU 79 -3.931 7.934 5.229 683 HD12 LEU 79 2HD1 LEU 79 -4.155 6.416 4.361 684 HD13 LEU 79 3HD1 LEU 79 -3.834 7.901 3.468 685 HD21 LEU 79 3HD2 LEU 79 -1.572 8.995 5.252 686 HD22 LEU 79 1HD2 LEU 79 -1.603 8.917 3.490 687 HD23 LEU 79 2HD2 LEU 79 -0.276 8.172 4.380 688 H ILE 80 H ILE 80 -4.099 4.170 4.154 689 HA ILE 80 HA ILE 80 -2.092 2.335 2.985 690 HB ILE 80 HB ILE 80 -5.073 1.851 3.238 691 HG12 ILE 80 2HG1 ILE 80 -2.752 0.480 4.640 692 HG13 ILE 80 3HG1 ILE 80 -3.838 1.646 5.385 693 HG21 ILE 80 1HG2 ILE 80 -4.551 -0.410 2.371 694 HG22 ILE 80 2HG2 ILE 80 -2.886 0.103 2.092 695 HG23 ILE 80 3HG2 ILE 80 -4.204 0.863 1.199 696 HD11 ILE 80 3HD1 ILE 80 -5.713 0.120 5.042 697 HD12 ILE 80 1HD1 ILE 80 -4.429 -0.623 5.996 698 HD13 ILE 80 2HD1 ILE 80 -4.621 -1.048 4.296 699 H ILE 81 H ILE 81 -1.808 2.398 0.819 700 HA ILE 81 HA ILE 81 -3.775 3.875 -0.834 701 HB ILE 81 HB ILE 81 -0.785 3.633 -1.300 702 HG12 ILE 81 2HG1 ILE 81 -2.509 6.010 -0.528 703 HG13 ILE 81 3HG1 ILE 81 -1.298 5.226 0.482 704 HG21 ILE 81 1HG2 ILE 81 -1.155 5.137 -3.217 705 HG22 ILE 81 2HG2 ILE 81 -2.894 5.058 -2.936 706 HG23 ILE 81 3HG2 ILE 81 -2.010 3.607 -3.410 707 HD11 ILE 81 3HD1 ILE 81 -0.794 6.778 -2.047 708 HD12 ILE 81 1HD1 ILE 81 0.442 5.935 -1.111 709 HD13 ILE 81 2HD1 ILE 81 -0.435 7.288 -0.399 710 H ILE 82 H ILE 82 -4.707 2.720 -2.465 711 HA ILE 82 HA ILE 82 -3.557 0.064 -3.072 712 HB ILE 82 HB ILE 82 -6.474 0.880 -3.131 713 HG12 ILE 82 2HG1 ILE 82 -4.961 -0.966 -1.254 714 HG13 ILE 82 3HG1 ILE 82 -5.597 0.625 -0.844 715 HG21 ILE 82 1HG2 ILE 82 -5.967 -0.750 -4.871 716 HG22 ILE 82 2HG2 ILE 82 -6.919 -1.495 -3.589 717 HG23 ILE 82 3HG2 ILE 82 -5.183 -1.798 -3.687 718 HD11 ILE 82 3HD1 ILE 82 -7.212 -1.805 -1.587 719 HD12 ILE 82 1HD1 ILE 82 -7.870 -0.207 -1.227 720 HD13 ILE 82 2HD1 ILE 82 -7.021 -1.114 0.024 721 H TYR 83 H TYR 83 -2.805 -0.169 -5.041 722 HA TYR 83 HA TYR 83 -3.760 1.509 -7.253 723 HB2 TYR 83 2HB TYR 83 -1.399 1.571 -7.157 724 HB3 TYR 83 3HB TYR 83 -1.276 -0.150 -6.814 725 HD1 TYR 83 HD2 TYR 83 -1.951 2.331 -9.489 726 HD2 TYR 83 HD1 TYR 83 -1.170 -1.759 -8.582 727 HE1 TYR 83 HE2 TYR 83 -1.606 1.865 -11.879 728 HE2 TYR 83 HE1 TYR 83 -0.828 -2.231 -10.967 729 HH TYR 83 HH TYR 83 -0.446 0.191 -13.294 730 H ASP 84 H ASP 84 -5.167 0.698 -8.688 731 HA ASP 84 HA ASP 84 -4.872 -2.023 -9.641 732 HB2 ASP 84 2HB ASP 84 -6.421 -2.330 -7.759 733 HB3 ASP 84 3HB ASP 84 -7.499 -1.113 -8.434 734 H GLN 85 H GLN 85 -6.106 -2.440 -11.587 735 HA GLN 85 HA GLN 85 -6.381 0.026 -13.177 736 HB2 GLN 85 2HB GLN 85 -5.848 -2.838 -13.992 737 HB3 GLN 85 3HB GLN 85 -6.052 -1.510 -15.127 738 HG2 GLN 85 2HG GLN 85 -4.064 -0.438 -14.362 739 HG3 GLN 85 3HG GLN 85 -3.926 -1.541 -12.993 740 HE21 GLN 85 1HE2 GLN 85 -1.827 -2.113 -13.644 741 HE22 GLN 85 2HE2 GLN 85 -1.554 -3.169 -14.984 742 H ASP 86 H ASP 86 -8.105 -2.864 -12.197 743 HA ASP 86 HA ASP 86 -10.350 -2.202 -13.977 744 HB2 ASP 86 2HB ASP 86 -9.775 -4.712 -12.381 745 HB3 ASP 86 3HB ASP 86 -11.169 -4.477 -13.435 746 H GLN 87 H GLN 87 -11.412 -0.570 -12.927 747 HA GLN 87 HA GLN 87 -11.564 -0.045 -10.248 748 HB2 GLN 87 2HB GLN 87 -13.706 0.550 -12.295 749 HB3 GLN 87 3HB GLN 87 -13.560 1.325 -10.725 750 HG2 GLN 87 2HG GLN 87 -11.630 1.510 -13.031 751 HG3 GLN 87 3HG GLN 87 -12.683 2.783 -12.417 752 HE21 GLN 87 1HE2 GLN 87 -12.159 3.766 -10.414 753 HE22 GLN 87 2HE2 GLN 87 -10.571 3.651 -9.750 754 H ASN 88 H ASN 88 -13.516 -2.403 -11.961 755 HA ASN 88 HA ASN 88 -15.586 -2.846 -10.164 756 HB2 ASN 88 2HB ASN 88 -15.242 -3.976 -12.394 757 HB3 ASN 88 3HB ASN 88 -14.051 -5.015 -11.624 758 HD21 ASN 88 1HD2 ASN 88 -16.518 -5.735 -12.929 759 HD22 ASN 88 2HD2 ASN 88 -17.464 -6.578 -11.756 760 H ARG 89 H ARG 89 -12.291 -4.180 -10.109 761 HA ARG 89 HA ARG 89 -12.647 -5.634 -7.658 762 HB2 ARG 89 2HB ARG 89 -10.055 -4.807 -8.996 763 HB3 ARG 89 3HB ARG 89 -10.265 -6.091 -7.813 764 HG2 ARG 89 2HG ARG 89 -11.465 -6.071 -10.583 765 HG3 ARG 89 3HG ARG 89 -9.999 -6.934 -10.112 766 HD2 ARG 89 2HD ARG 89 -11.296 -8.263 -8.510 767 HD3 ARG 89 3HD ARG 89 -12.761 -7.396 -8.974 768 HE ARG 89 HE ARG 89 -12.267 -8.352 -11.284 769 HH11 ARG 89 1HH1 ARG 89 -11.437 -9.960 -8.352 770 HH12 ARG 89 2HH1 ARG 89 -11.556 -11.535 -9.050 771 HH21 ARG 89 1HH2 ARG 89 -12.434 -10.393 -12.172 772 HH22 ARG 89 2HH2 ARG 89 -12.118 -11.775 -11.184 773 H LEU 90 H LEU 90 -10.783 -2.737 -8.549 774 HA LEU 90 HA LEU 90 -9.796 -1.931 -6.138 775 HB2 LEU 90 2HB LEU 90 -9.342 -0.865 -8.313 776 HB3 LEU 90 3HB LEU 90 -10.941 -0.146 -8.291 777 HG LEU 90 HG LEU 90 -10.324 1.186 -6.313 778 HD11 LEU 90 1HD1 LEU 90 -8.700 -0.320 -5.302 779 HD12 LEU 90 2HD1 LEU 90 -7.988 1.271 -5.562 780 HD13 LEU 90 3HD1 LEU 90 -7.593 -0.060 -6.650 781 HD21 LEU 90 3HD2 LEU 90 -8.763 2.708 -7.422 782 HD22 LEU 90 1HD2 LEU 90 -9.995 2.132 -8.545 783 HD23 LEU 90 2HD2 LEU 90 -8.366 1.456 -8.600 784 H GLU 91 H GLU 91 -12.974 -0.862 -7.425 785 HA GLU 91 HA GLU 91 -13.685 0.694 -5.205 786 HB2 GLU 91 2HB GLU 91 -15.307 -0.599 -7.383 787 HB3 GLU 91 3HB GLU 91 -16.089 0.301 -6.090 788 HG2 GLU 91 2HG GLU 91 -14.029 1.379 -8.009 789 HG3 GLU 91 3HG GLU 91 -15.764 1.693 -8.054 790 H GLU 92 H GLU 92 -14.649 -2.670 -5.949 791 HA GLU 92 HA GLU 92 -16.274 -3.052 -3.696 792 HB2 GLU 92 2HB GLU 92 -16.300 -4.601 -5.580 793 HB3 GLU 92 3HB GLU 92 -14.644 -5.086 -5.236 794 HG2 GLU 92 2HG GLU 92 -15.361 -6.008 -3.084 795 HG3 GLU 92 3HG GLU 92 -17.020 -5.525 -3.431 796 H PHE 93 H PHE 93 -12.846 -3.888 -4.163 797 HA PHE 93 HA PHE 93 -12.424 -4.958 -1.588 798 HB2 PHE 93 2HB PHE 93 -10.961 -5.396 -3.529 799 HB3 PHE 93 3HB PHE 93 -10.420 -3.722 -3.495 800 HD1 PHE 93 HD1 PHE 93 -10.672 -6.673 -1.213 801 HD2 PHE 93 HD2 PHE 93 -8.416 -3.273 -2.442 802 HE1 PHE 93 HE1 PHE 93 -8.876 -7.307 0.340 803 HE2 PHE 93 HE2 PHE 93 -6.617 -3.906 -0.887 804 HZ PHE 93 HZ PHE 93 -6.848 -5.924 0.503 805 H SER 94 H SER 94 -11.677 -1.725 -2.904 806 HA SER 94 HA SER 94 -10.569 -0.537 -0.649 807 HB2 SER 94 2HB SER 94 -10.561 0.603 -2.791 808 HB3 SER 94 3HB SER 94 -12.319 0.708 -2.789 809 HG SER 94 HG SER 94 -11.922 2.595 -1.931 810 H ARG 95 H ARG 95 -13.982 -0.914 -1.496 811 HA ARG 95 HA ARG 95 -15.120 0.639 0.543 812 HB2 ARG 95 2HB ARG 95 -16.304 -0.319 -1.455 813 HB3 ARG 95 3HB ARG 95 -16.280 -1.885 -0.659 814 HG2 ARG 95 2HG ARG 95 -18.440 -0.878 -0.365 815 HG3 ARG 95 3HG ARG 95 -17.615 -0.932 1.194 816 HD2 ARG 95 2HD ARG 95 -18.768 1.210 0.841 817 HD3 ARG 95 3HD ARG 95 -17.024 1.422 0.989 818 HE ARG 95 HE ARG 95 -17.093 1.466 -1.566 819 HH11 ARG 95 1HH1 ARG 95 -19.678 2.608 0.407 820 HH12 ARG 95 2HH1 ARG 95 -20.190 3.776 -0.762 821 HH21 ARG 95 1HH2 ARG 95 -17.772 2.943 -3.053 822 HH22 ARG 95 2HH2 ARG 95 -19.127 3.961 -2.699 823 H GLU 96 H GLU 96 -14.250 -2.816 0.520 824 HA GLU 96 HA GLU 96 -15.152 -3.358 3.167 825 HB2 GLU 96 2HB GLU 96 -13.191 -4.827 1.385 826 HB3 GLU 96 3HB GLU 96 -13.765 -5.444 2.929 827 HG2 GLU 96 2HG GLU 96 -16.033 -5.530 2.109 828 HG3 GLU 96 3HG GLU 96 -15.552 -4.767 0.597 829 H VAL 97 H VAL 97 -12.004 -2.455 1.817 830 HA VAL 97 HA VAL 97 -10.473 -2.735 4.170 831 HB VAL 97 HB VAL 97 -10.046 -0.863 1.827 832 HG11 VAL 97 1HG1 VAL 97 -8.099 -1.730 3.971 833 HG12 VAL 97 2HG1 VAL 97 -8.758 -0.107 3.749 834 HG13 VAL 97 3HG1 VAL 97 -7.688 -0.800 2.529 835 HG21 VAL 97 3HG2 VAL 97 -8.475 -2.583 1.032 836 HG22 VAL 97 1HG2 VAL 97 -10.122 -3.201 1.150 837 HG23 VAL 97 2HG2 VAL 97 -8.933 -3.619 2.384 838 H ARG 98 H ARG 98 -12.064 0.151 2.793 839 HA ARG 98 HA ARG 98 -11.267 1.994 4.741 840 HB2 ARG 98 2HB ARG 98 -12.348 2.533 2.534 841 HB3 ARG 98 3HB ARG 98 -13.889 2.037 3.223 842 HG2 ARG 98 2HG ARG 98 -13.769 4.416 3.337 843 HG3 ARG 98 3HG ARG 98 -13.585 3.796 4.979 844 HD2 ARG 98 2HD ARG 98 -11.094 3.979 4.659 845 HD3 ARG 98 3HD ARG 98 -11.416 4.817 3.143 846 HE ARG 98 HE ARG 98 -12.046 5.813 5.837 847 HH11 ARG 98 1HH1 ARG 98 -11.700 6.364 2.448 848 HH12 ARG 98 2HH1 ARG 98 -11.690 8.086 2.623 849 HH21 ARG 98 1HH2 ARG 98 -11.995 8.021 6.041 850 HH22 ARG 98 2HH2 ARG 98 -11.859 9.008 4.630 851 H ARG 99 H ARG 99 -14.105 -0.117 4.621 852 HA ARG 99 HA ARG 99 -15.450 0.944 6.859 853 HB2 ARG 99 2HB ARG 99 -16.523 -0.425 5.116 854 HB3 ARG 99 3HB ARG 99 -15.629 -1.834 5.663 855 HG2 ARG 99 2HG ARG 99 -16.830 -1.912 7.714 856 HG3 ARG 99 3HG ARG 99 -17.540 -0.321 7.434 857 HD2 ARG 99 2HD ARG 99 -19.142 -2.150 7.013 858 HD3 ARG 99 3HD ARG 99 -18.835 -1.186 5.570 859 HE ARG 99 HE ARG 99 -17.145 -3.482 5.708 860 HH11 ARG 99 1HH1 ARG 99 -20.335 -2.468 4.900 861 HH12 ARG 99 2HH1 ARG 99 -20.579 -3.757 3.772 862 HH21 ARG 99 1HH2 ARG 99 -17.479 -5.138 4.255 863 HH22 ARG 99 2HH2 ARG 99 -18.985 -5.242 3.409 864 H ARG 100 H ARG 100 -12.604 -0.936 6.768 865 HA ARG 100 HA ARG 100 -12.937 -2.208 9.334 866 HB2 ARG 100 2HB ARG 100 -10.381 -1.718 7.787 867 HB3 ARG 100 3HB ARG 100 -10.574 -2.804 9.154 868 HG2 ARG 100 2HG ARG 100 -12.358 -3.964 7.642 869 HG3 ARG 100 3HG ARG 100 -11.525 -3.116 6.335 870 HD2 ARG 100 2HD ARG 100 -9.374 -4.117 7.211 871 HD3 ARG 100 3HD ARG 100 -10.358 -5.114 8.277 872 HE ARG 100 HE ARG 100 -9.725 -5.722 5.662 873 HH11 ARG 100 1HH1 ARG 100 -12.629 -5.541 7.529 874 HH12 ARG 100 2HH1 ARG 100 -13.427 -6.734 6.575 875 HH21 ARG 100 1HH2 ARG 100 -10.743 -7.260 4.500 876 HH22 ARG 100 2HH2 ARG 100 -12.376 -7.693 4.870 877 H GLY 101 H GLY 101 -12.379 0.983 8.457 878 HA2 GLY 101 2HA GLY 101 -12.291 2.727 10.062 879 HA3 GLY 101 3HA GLY 101 -11.546 1.619 11.199 880 H PHE 102 H PHE 102 -10.316 1.813 7.948 881 HA PHE 102 HA PHE 102 -7.957 3.303 8.937 882 HB2 PHE 102 2HB PHE 102 -8.048 1.124 6.831 883 HB3 PHE 102 3HB PHE 102 -6.611 2.033 7.288 884 HD1 PHE 102 HD1 PHE 102 -5.820 1.859 9.716 885 HD2 PHE 102 HD2 PHE 102 -8.626 -0.831 7.974 886 HE1 PHE 102 HE1 PHE 102 -5.326 0.208 11.468 887 HE2 PHE 102 HE2 PHE 102 -8.133 -2.483 9.726 888 HZ PHE 102 HZ PHE 102 -6.476 -1.965 11.477 889 H GLU 103 H GLU 103 -6.958 4.799 7.541 890 HA GLU 103 HA GLU 103 -8.688 5.970 5.539 891 HB2 GLU 103 2HB GLU 103 -5.962 6.760 6.592 892 HB3 GLU 103 3HB GLU 103 -6.776 7.630 5.298 893 HG2 GLU 103 2HG GLU 103 -7.799 7.266 8.113 894 HG3 GLU 103 3HG GLU 103 -7.107 8.739 7.432 895 H VAL 104 H VAL 104 -8.805 4.651 3.775 896 HA VAL 104 HA VAL 104 -6.303 3.911 2.420 897 HB VAL 104 HB VAL 104 -7.941 2.104 2.774 898 HG11 VAL 104 1HG1 VAL 104 -10.054 2.068 1.520 899 HG12 VAL 104 2HG1 VAL 104 -9.749 3.715 0.965 900 HG13 VAL 104 3HG1 VAL 104 -10.004 3.396 2.681 901 HG21 VAL 104 3HG2 VAL 104 -7.579 2.833 -0.139 902 HG22 VAL 104 1HG2 VAL 104 -7.956 1.227 0.485 903 HG23 VAL 104 2HG2 VAL 104 -6.408 1.981 0.868 904 H ARG 105 H ARG 105 -5.806 4.602 0.355 905 HA ARG 105 HA ARG 105 -7.687 6.432 -0.995 906 HB2 ARG 105 2HB ARG 105 -4.695 6.797 -0.683 907 HB3 ARG 105 3HB ARG 105 -5.696 7.768 -1.752 908 HG2 ARG 105 2HG ARG 105 -5.840 7.637 1.261 909 HG3 ARG 105 3HG ARG 105 -5.287 8.991 0.275 910 HD2 ARG 105 2HD ARG 105 -7.558 9.202 -0.672 911 HD3 ARG 105 3HD ARG 105 -8.100 7.882 0.363 912 HE ARG 105 HE ARG 105 -7.453 10.604 1.185 913 HH11 ARG 105 1HH1 ARG 105 -8.410 7.417 2.116 914 HH12 ARG 105 2HH1 ARG 105 -8.929 7.932 3.686 915 HH21 ARG 105 1HH2 ARG 105 -8.142 11.225 3.190 916 HH22 ARG 105 2HH2 ARG 105 -8.767 10.042 4.292 917 H THR 106 H THR 106 -7.997 6.049 -3.129 918 HA THR 106 HA THR 106 -6.648 3.694 -4.259 919 HB THR 106 HB THR 106 -8.505 3.609 -5.865 920 HG1 THR 106 HG1 THR 106 -9.566 5.399 -6.219 921 HG21 THR 106 3HG2 THR 106 -9.501 3.955 -3.029 922 HG22 THR 106 1HG2 THR 106 -8.749 2.493 -3.672 923 HG23 THR 106 2HG2 THR 106 -10.295 3.045 -4.316 924 H VAL 107 H VAL 107 -5.411 3.738 -6.059 925 HA VAL 107 HA VAL 107 -5.382 6.157 -7.746 926 HB VAL 107 HB VAL 107 -2.940 6.075 -7.929 927 HG11 VAL 107 1HG1 VAL 107 -3.889 6.248 -5.063 928 HG12 VAL 107 2HG1 VAL 107 -3.894 7.554 -6.248 929 HG13 VAL 107 3HG1 VAL 107 -2.365 6.890 -5.675 930 HG21 VAL 107 3HG2 VAL 107 -3.067 3.894 -5.835 931 HG22 VAL 107 1HG2 VAL 107 -1.593 4.663 -6.427 932 HG23 VAL 107 2HG2 VAL 107 -2.581 3.693 -7.518 933 H THR 108 H THR 108 -4.852 5.808 -9.952 934 HA THR 108 HA THR 108 -4.913 2.961 -10.770 935 HB THR 108 HB THR 108 -6.105 3.570 -12.784 936 HG1 THR 108 HG1 THR 108 -5.936 6.264 -11.827 937 HG21 THR 108 3HG2 THR 108 -7.395 4.845 -10.363 938 HG22 THR 108 1HG2 THR 108 -7.470 3.137 -10.801 939 HG23 THR 108 2HG2 THR 108 -8.230 4.346 -11.834 940 H SER 109 H SER 109 -3.488 6.118 -11.447 941 HA SER 109 HA SER 109 -1.468 4.787 -13.155 942 HB2 SER 109 2HB SER 109 -2.403 7.675 -13.176 943 HB3 SER 109 3HB SER 109 -1.061 7.056 -14.139 944 HG SER 109 HG SER 109 -2.716 6.871 -15.503 945 HA PRO 110 HA PRO 110 1.825 5.792 -10.303 946 HB2 PRO 110 2HB PRO 110 3.689 6.942 -12.028 947 HB3 PRO 110 3HB PRO 110 3.499 5.210 -11.745 948 HG2 PRO 110 2HG PRO 110 2.427 6.898 -13.972 949 HG3 PRO 110 3HG PRO 110 3.101 5.257 -14.031 950 HD2 PRO 110 2HD PRO 110 0.457 5.676 -14.144 951 HD3 PRO 110 3HD PRO 110 1.124 4.288 -13.255 952 H ASP 111 H ASP 111 1.021 8.330 -12.663 953 HA ASP 111 HA ASP 111 1.904 10.571 -11.249 954 HB2 ASP 111 2HB ASP 111 -0.523 10.340 -13.054 955 HB3 ASP 111 3HB ASP 111 0.307 11.836 -12.622 956 H ASP 112 H ASP 112 -1.307 9.010 -11.197 957 HA ASP 112 HA ASP 112 -2.591 10.567 -9.298 958 HB2 ASP 112 2HB ASP 112 -2.789 7.549 -9.494 959 HB3 ASP 112 3HB ASP 112 -4.003 8.641 -8.843 960 H PHE 113 H PHE 113 -0.642 7.640 -8.762 961 HA PHE 113 HA PHE 113 -0.718 7.509 -5.998 962 HB2 PHE 113 2HB PHE 113 0.223 5.686 -7.219 963 HB3 PHE 113 3HB PHE 113 1.449 6.719 -7.952 964 HD1 PHE 113 HD1 PHE 113 0.302 5.482 -4.625 965 HD2 PHE 113 HD2 PHE 113 3.572 6.802 -7.017 966 HE1 PHE 113 HE1 PHE 113 1.859 4.920 -2.808 967 HE2 PHE 113 HE2 PHE 113 5.133 6.236 -5.203 968 HZ PHE 113 HZ PHE 113 4.276 5.295 -3.093 969 H LYS 114 H LYS 114 1.651 9.256 -8.025 970 HA LYS 114 HA LYS 114 3.197 10.206 -5.860 971 HB2 LYS 114 2HB LYS 114 4.017 10.138 -8.187 972 HB3 LYS 114 3HB LYS 114 2.897 11.428 -8.613 973 HG2 LYS 114 2HG LYS 114 4.037 12.977 -7.168 974 HG3 LYS 114 3HG LYS 114 5.072 11.693 -6.539 975 HD2 LYS 114 2HD LYS 114 6.068 11.404 -8.760 976 HD3 LYS 114 3HD LYS 114 5.022 12.675 -9.400 977 HE2 LYS 114 2HE LYS 114 7.068 13.036 -7.206 978 HE3 LYS 114 3HE LYS 114 7.295 13.491 -8.894 979 HZ1 LYS 114 3HZ LYS 114 6.614 15.330 -7.392 980 HZ2 LYS 114 1HZ LYS 114 5.117 14.572 -7.192 981 HZ3 LYS 114 2HZ LYS 114 5.594 15.109 -8.717 982 H LYS 115 H LYS 115 0.555 11.766 -7.693 983 HA LYS 115 HA LYS 115 0.700 14.218 -6.260 984 HB2 LYS 115 2HB LYS 115 -1.519 13.028 -7.936 985 HB3 LYS 115 3HB LYS 115 -1.559 14.661 -7.275 986 HG2 LYS 115 2HG LYS 115 0.446 13.562 -9.246 987 HG3 LYS 115 3HG LYS 115 -0.837 14.731 -9.577 988 HD2 LYS 115 2HD LYS 115 0.217 16.388 -8.203 989 HD3 LYS 115 3HD LYS 115 1.382 15.218 -7.584 990 HE2 LYS 115 2HE LYS 115 2.276 14.980 -9.897 991 HE3 LYS 115 3HE LYS 115 1.194 16.279 -10.401 992 HZ1 LYS 115 3HZ LYS 115 2.310 17.798 -8.971 993 HZ2 LYS 115 1HZ LYS 115 3.491 17.002 -9.883 994 HZ3 LYS 115 2HZ LYS 115 3.234 16.567 -8.264 995 H SER 116 H SER 116 -0.853 11.196 -5.562 996 HA SER 116 HA SER 116 -2.413 12.226 -3.363 997 HB2 SER 116 2HB SER 116 -1.532 9.382 -3.966 998 HB3 SER 116 3HB SER 116 -2.720 9.847 -2.749 999 HG SER 116 HG SER 116 -2.909 9.975 -5.564 1000 H LEU 117 H LEU 117 0.684 10.546 -3.732 1001 HA LEU 117 HA LEU 117 1.285 10.239 -1.005 1002 HB2 LEU 117 2HB LEU 117 2.351 9.044 -2.953 1003 HB3 LEU 117 3HB LEU 117 3.272 10.503 -3.265 1004 HG LEU 117 HG LEU 117 4.282 10.289 -0.983 1005 HD11 LEU 117 1HD1 LEU 117 2.874 7.615 -0.976 1006 HD12 LEU 117 2HD1 LEU 117 2.528 8.981 0.086 1007 HD13 LEU 117 3HD1 LEU 117 4.079 8.151 0.198 1008 HD21 LEU 117 3HD2 LEU 117 5.783 8.431 -1.569 1009 HD22 LEU 117 1HD2 LEU 117 5.485 9.496 -2.943 1010 HD23 LEU 117 2HD2 LEU 117 4.665 7.937 -2.841 1011 H GLU 118 H GLU 118 2.147 12.847 -3.290 1012 HA GLU 118 HA GLU 118 3.918 14.280 -1.697 1013 HB2 GLU 118 2HB GLU 118 1.935 15.317 -3.740 1014 HB3 GLU 118 3HB GLU 118 3.200 16.304 -3.017 1015 HG2 GLU 118 2HG GLU 118 4.869 14.641 -3.916 1016 HG3 GLU 118 3HG GLU 118 3.542 13.903 -4.806 1017 H ARG 119 H ARG 119 0.441 14.099 -1.470 1018 HA ARG 119 HA ARG 119 0.316 16.177 0.586 1019 HB2 ARG 119 2HB ARG 119 -1.835 14.378 -0.558 1020 HB3 ARG 119 3HB ARG 119 -2.113 15.661 0.612 1021 HG2 ARG 119 2HG ARG 119 -1.375 17.323 -1.008 1022 HG3 ARG 119 3HG ARG 119 -1.041 16.047 -2.181 1023 HD2 ARG 119 2HD ARG 119 -3.403 15.428 -2.206 1024 HD3 ARG 119 3HD ARG 119 -3.753 16.651 -0.987 1025 HE ARG 119 HE ARG 119 -2.679 18.130 -2.931 1026 HH11 ARG 119 1HH1 ARG 119 -5.108 15.694 -3.022 1027 HH12 ARG 119 2HH1 ARG 119 -5.922 16.395 -4.371 1028 HH21 ARG 119 1HH2 ARG 119 -3.736 19.026 -4.680 1029 HH22 ARG 119 2HH2 ARG 119 -5.155 18.257 -5.299 1030 H LEU 120 H LEU 120 -0.282 12.682 0.283 1031 HA LEU 120 HA LEU 120 -1.163 12.247 2.907 1032 HB2 LEU 120 2HB LEU 120 0.066 10.352 0.908 1033 HB3 LEU 120 3HB LEU 120 -0.654 9.837 2.422 1034 HG LEU 120 HG LEU 120 -2.102 11.240 0.163 1035 HD11 LEU 120 1HD1 LEU 120 -1.561 8.936 -0.379 1036 HD12 LEU 120 2HD1 LEU 120 -3.292 9.114 -0.090 1037 HD13 LEU 120 3HD1 LEU 120 -2.261 8.392 1.147 1038 HD21 LEU 120 3HD2 LEU 120 -4.141 10.817 1.466 1039 HD22 LEU 120 1HD2 LEU 120 -3.030 11.886 2.324 1040 HD23 LEU 120 2HD2 LEU 120 -3.162 10.191 2.793 1041 H ILE 121 H ILE 121 2.118 12.359 1.639 1042 HA ILE 121 HA ILE 121 3.527 11.170 3.723 1043 HB ILE 121 HB ILE 121 4.220 13.552 2.003 1044 HG12 ILE 121 2HG1 ILE 121 5.190 10.678 2.013 1045 HG13 ILE 121 3HG1 ILE 121 4.051 11.375 0.866 1046 HG21 ILE 121 1HG2 ILE 121 6.028 12.154 3.978 1047 HG22 ILE 121 2HG2 ILE 121 5.455 13.819 4.079 1048 HG23 ILE 121 3HG2 ILE 121 6.547 13.340 2.780 1049 HD11 ILE 121 3HD1 ILE 121 6.257 11.177 -0.104 1050 HD12 ILE 121 1HD1 ILE 121 6.936 12.161 1.192 1051 HD13 ILE 121 2HD1 ILE 121 5.798 12.874 0.048 1052 H ARG 122 H ARG 122 2.169 14.414 3.508 1053 HA ARG 122 HA ARG 122 3.232 15.436 5.933 1054 HB2 ARG 122 2HB ARG 122 0.653 16.301 4.607 1055 HB3 ARG 122 3HB ARG 122 1.720 17.270 5.618 1056 HG2 ARG 122 2HG ARG 122 3.418 17.279 3.896 1057 HG3 ARG 122 3HG ARG 122 2.459 16.179 2.902 1058 HD2 ARG 122 2HD ARG 122 2.136 18.354 2.008 1059 HD3 ARG 122 3HD ARG 122 0.657 17.951 2.880 1060 HE ARG 122 HE ARG 122 2.633 19.466 4.366 1061 HH11 ARG 122 1HH1 ARG 122 -0.288 19.534 2.537 1062 HH12 ARG 122 2HH1 ARG 122 -0.649 21.164 2.986 1063 HH21 ARG 122 1HH2 ARG 122 2.139 21.530 4.939 1064 HH22 ARG 122 2HH2 ARG 122 0.697 22.271 4.335 1065 H GLU 123 H GLU 123 0.447 13.500 5.151 1066 HA GLU 123 HA GLU 123 -0.862 13.902 7.710 1067 HB2 GLU 123 2HB GLU 123 -1.578 11.944 5.515 1068 HB3 GLU 123 3HB GLU 123 -2.612 12.482 6.832 1069 HG2 GLU 123 2HG GLU 123 -1.618 14.137 4.516 1070 HG3 GLU 123 3HG GLU 123 -3.262 13.563 4.776 1071 H VAL 124 H VAL 124 1.196 11.485 6.203 1072 HA VAL 124 HA VAL 124 0.604 9.482 8.223 1073 HB VAL 124 HB VAL 124 1.024 8.831 5.866 1074 HG11 VAL 124 1HG1 VAL 124 3.332 8.757 5.020 1075 HG12 VAL 124 2HG1 VAL 124 3.874 9.651 6.440 1076 HG13 VAL 124 3HG1 VAL 124 2.772 10.405 5.288 1077 HG21 VAL 124 3HG2 VAL 124 1.263 7.176 7.627 1078 HG22 VAL 124 1HG2 VAL 124 2.941 7.657 7.890 1079 HG23 VAL 124 2HG2 VAL 124 2.467 6.898 6.371 1080 H GLY 125 H GLY 125 3.084 11.905 7.668 1081 HA2 GLY 125 2HA GLY 125 3.958 11.743 10.348 1082 HA3 GLY 125 3HA GLY 125 5.088 10.851 9.347 1083 H SER 126 H SER 126 6.054 12.085 7.502 1084 HA SER 126 HA SER 126 7.309 14.379 8.646 1085 HB2 SER 126 2HB SER 126 7.586 13.204 5.867 1086 HB3 SER 126 3HB SER 126 8.659 14.410 6.576 1087 HG SER 126 HG SER 126 9.641 12.888 7.642 1088 H LEU 127 H LEU 127 6.332 16.314 8.716 1089 HA LEU 127 HA LEU 127 4.503 17.302 6.778 1090 HB2 LEU 127 2HB LEU 127 4.543 19.358 7.953 1091 HB3 LEU 127 3HB LEU 127 4.694 18.098 9.161 1092 HG LEU 127 HG LEU 127 7.001 19.761 8.112 1093 HD11 LEU 127 1HD1 LEU 127 6.928 20.883 10.291 1094 HD12 LEU 127 2HD1 LEU 127 5.463 19.989 10.700 1095 HD13 LEU 127 3HD1 LEU 127 5.450 21.143 9.366 1096 HD21 LEU 127 3HD2 LEU 127 6.868 17.831 10.435 1097 HD22 LEU 127 1HD2 LEU 127 8.255 18.828 9.994 1098 HD23 LEU 127 2HD2 LEU 127 7.704 17.554 8.907 1099 H GLU 128 H GLU 128 7.901 17.072 6.797 1100 HA GLU 128 HA GLU 128 8.536 19.243 5.058 1101 HB2 GLU 128 2HB GLU 128 10.353 18.509 6.314 1102 HB3 GLU 128 3HB GLU 128 9.980 16.813 6.058 1103 HG2 GLU 128 2HG GLU 128 12.026 17.453 4.912 1104 HG3 GLU 128 3HG GLU 128 10.791 16.947 3.768 1105 H HIS 129 H HIS 129 7.790 19.369 3.043 1106 HA HIS 129 HA HIS 129 8.604 17.349 1.173 1107 HB2 HIS 129 2HB HIS 129 6.380 16.489 1.873 1108 HB3 HIS 129 3HB HIS 129 5.648 18.002 1.342 1109 HD1 HIS 129 HD1 HIS 129 5.867 18.505 -1.288 1110 HD2 HIS 129 HD2 HIS 129 6.731 14.625 -0.092 1111 HE1 HIS 129 HE1 HIS 129 5.822 17.134 -3.387 1112 HE2 HIS 129 HE2 HIS 129 6.542 14.835 -2.658 1113 H HIS 130 H HIS 130 9.876 19.386 0.835 1114 HA HIS 130 HA HIS 130 8.666 21.560 -0.562 1115 HB2 HIS 130 2HB HIS 130 11.517 20.576 -0.370 1116 HB3 HIS 130 3HB HIS 130 11.076 21.950 -1.377 1117 HD1 HIS 130 HD1 HIS 130 11.402 20.907 2.205 1118 HD2 HIS 130 HD2 HIS 130 10.501 24.312 0.007 1119 HE1 HIS 130 HE1 HIS 130 11.484 22.800 3.842 1120 HE2 HIS 130 HE2 HIS 130 11.162 24.860 2.444 1121 H HIS 131 H HIS 131 8.329 21.885 -2.736 1122 HA HIS 131 HA HIS 131 8.369 19.466 -4.381 1123 HB2 HIS 131 2HB HIS 131 6.296 20.861 -4.165 1124 HB3 HIS 131 3HB HIS 131 7.128 22.156 -5.019 1125 HD1 HIS 131 HD1 HIS 131 5.935 18.588 -5.591 1126 HD2 HIS 131 HD2 HIS 131 6.994 21.986 -7.744 1127 HE1 HIS 131 HE1 HIS 131 5.396 18.066 -7.977 1128 HE2 HIS 131 HE2 HIS 131 5.843 20.205 -9.219 1129 H HIS 132 H HIS 132 10.642 21.660 -3.779 1130 HA HIS 132 HA HIS 132 11.574 22.636 -6.208 1131 HB2 HIS 132 2HB HIS 132 12.569 23.075 -3.925 1132 HB3 HIS 132 3HB HIS 132 13.356 21.504 -4.033 1133 HD1 HIS 132 HD1 HIS 132 13.669 25.013 -5.108 1134 HD2 HIS 132 HD2 HIS 132 15.386 21.355 -6.076 1135 HE1 HIS 132 HE1 HIS 132 15.730 25.564 -6.426 1136 HE2 HIS 132 HE2 HIS 132 16.831 23.346 -6.859 1137 H HIS 133 H HIS 133 12.344 19.446 -4.720 1138 HA HIS 133 HA HIS 133 13.074 18.410 -7.334 1139 HB2 HIS 133 2HB HIS 133 13.042 16.150 -6.132 1140 HB3 HIS 133 3HB HIS 133 14.260 17.307 -5.627 1141 HD1 HIS 133 HD1 HIS 133 10.667 16.717 -4.430 1142 HD2 HIS 133 HD2 HIS 133 14.545 17.024 -2.978 1143 HE1 HIS 133 HE1 HIS 133 10.474 16.463 -1.942 1144 HE2 HIS 133 HE2 HIS 133 12.847 16.468 -1.114 1145 H HIS 134 H HIS 134 11.438 18.472 -8.727 1146 HA HIS 134 HA HIS 134 8.740 18.632 -8.096 1147 HB2 HIS 134 2HB HIS 134 9.914 17.698 -10.726 1148 HB3 HIS 134 3HB HIS 134 8.310 18.384 -10.482 1149 HD1 HIS 134 HD1 HIS 134 11.489 19.344 -11.668 1150 HD2 HIS 134 HD2 HIS 134 8.669 21.158 -9.219 1151 HE1 HIS 134 HE1 HIS 134 12.034 21.791 -11.714 1152 HE2 HIS 134 HE2 HIS 134 10.428 22.838 -10.090 Start of MODEL 4 1 H1 MET 1 1H MET 1 5.429 0.896 10.964 2 H2 MET 1 2H MET 1 5.536 2.238 11.989 3 H3 MET 1 3H MET 1 6.850 1.809 11.018 4 HA MET 1 HA MET 1 5.672 3.735 10.137 5 HB2 MET 1 2HB MET 1 5.461 2.932 7.840 6 HB3 MET 1 3HB MET 1 6.862 2.201 8.611 7 HG2 MET 1 2HG MET 1 4.194 0.903 8.095 8 HG3 MET 1 3HG MET 1 5.728 0.543 7.303 9 HE1 MET 1 3HE MET 1 3.852 -1.700 8.614 10 HE2 MET 1 1HE MET 1 5.054 -2.691 9.441 11 HE3 MET 1 2HE MET 1 5.389 -2.062 7.827 12 H ASN 2 H ASN 2 3.745 4.627 9.205 13 HA ASN 2 HA ASN 2 1.279 3.156 9.923 14 HB2 ASN 2 2HB ASN 2 1.735 6.151 9.931 15 HB3 ASN 2 3HB ASN 2 0.225 5.340 10.345 16 HD21 ASN 2 1HD2 ASN 2 0.126 4.130 12.274 17 HD22 ASN 2 2HD2 ASN 2 1.260 4.388 13.547 18 H ILE 3 H ILE 3 2.846 3.435 7.282 19 HA ILE 3 HA ILE 3 0.494 4.115 5.647 20 HB ILE 3 HB ILE 3 1.990 5.991 5.414 21 HG12 ILE 3 2HG1 ILE 3 2.147 4.206 2.962 22 HG13 ILE 3 3HG1 ILE 3 0.789 5.240 3.394 23 HG21 ILE 3 1HG2 ILE 3 4.070 4.891 6.118 24 HG22 ILE 3 2HG2 ILE 3 4.280 5.802 4.623 25 HG23 ILE 3 3HG2 ILE 3 4.143 4.044 4.573 26 HD11 ILE 3 3HD1 ILE 3 2.187 7.209 3.115 27 HD12 ILE 3 1HD1 ILE 3 2.162 6.229 1.649 28 HD13 ILE 3 2HD1 ILE 3 3.566 6.184 2.715 29 H VAL 4 H VAL 4 -0.116 2.523 4.334 30 HA VAL 4 HA VAL 4 1.835 0.436 3.556 31 HB VAL 4 HB VAL 4 -1.078 -0.045 4.242 32 HG11 VAL 4 1HG1 VAL 4 -0.467 -2.429 4.142 33 HG12 VAL 4 2HG1 VAL 4 1.159 -1.981 3.625 34 HG13 VAL 4 3HG1 VAL 4 -0.225 -1.617 2.595 35 HG21 VAL 4 3HG2 VAL 4 -0.258 -1.188 6.265 36 HG22 VAL 4 1HG2 VAL 4 0.145 0.530 6.267 37 HG23 VAL 4 2HG2 VAL 4 1.383 -0.667 5.884 38 H ILE 5 H ILE 5 1.865 -0.057 1.391 39 HA ILE 5 HA ILE 5 -0.319 1.032 -0.287 40 HB ILE 5 HB ILE 5 2.562 0.545 -1.092 41 HG12 ILE 5 2HG1 ILE 5 1.072 3.150 -0.611 42 HG13 ILE 5 3HG1 ILE 5 2.310 2.471 0.441 43 HG21 ILE 5 1HG2 ILE 5 0.277 1.786 -2.638 44 HG22 ILE 5 2HG2 ILE 5 1.018 0.218 -2.952 45 HG23 ILE 5 3HG2 ILE 5 1.954 1.694 -3.180 46 HD11 ILE 5 3HD1 ILE 5 3.952 2.707 -1.369 47 HD12 ILE 5 1HD1 ILE 5 3.223 4.247 -0.915 48 HD13 ILE 5 2HD1 ILE 5 2.703 3.427 -2.385 49 H VAL 6 H VAL 6 -1.628 -0.512 -1.041 50 HA VAL 6 HA VAL 6 -0.659 -3.249 -1.437 51 HB VAL 6 HB VAL 6 -3.484 -2.161 -1.630 52 HG11 VAL 6 1HG1 VAL 6 -3.179 -4.210 -2.933 53 HG12 VAL 6 2HG1 VAL 6 -4.186 -4.508 -1.516 54 HG13 VAL 6 3HG1 VAL 6 -2.498 -5.017 -1.520 55 HG21 VAL 6 3HG2 VAL 6 -2.128 -3.631 0.640 56 HG22 VAL 6 1HG2 VAL 6 -3.837 -3.200 0.571 57 HG23 VAL 6 2HG2 VAL 6 -2.612 -1.934 0.637 58 H VAL 7 H VAL 7 0.226 -3.658 -3.390 59 HA VAL 7 HA VAL 7 -0.811 -2.214 -5.758 60 HB VAL 7 HB VAL 7 1.915 -3.470 -5.345 61 HG11 VAL 7 1HG1 VAL 7 0.860 -1.787 -7.622 62 HG12 VAL 7 2HG1 VAL 7 1.246 -3.508 -7.686 63 HG13 VAL 7 3HG1 VAL 7 2.529 -2.327 -7.428 64 HG21 VAL 7 3HG2 VAL 7 1.080 -0.565 -5.354 65 HG22 VAL 7 1HG2 VAL 7 2.739 -1.158 -5.268 66 HG23 VAL 7 2HG2 VAL 7 1.614 -1.494 -3.952 67 H PHE 8 H PHE 8 -2.037 -3.390 -7.094 68 HA PHE 8 HA PHE 8 -1.930 -6.297 -7.095 69 HB2 PHE 8 2HB PHE 8 -3.722 -4.298 -8.482 70 HB3 PHE 8 3HB PHE 8 -3.832 -6.028 -8.776 71 HD1 PHE 8 HD2 PHE 8 -4.113 -3.441 -6.123 72 HD2 PHE 8 HD1 PHE 8 -5.047 -7.419 -7.335 73 HE1 PHE 8 HE2 PHE 8 -5.620 -3.673 -4.193 74 HE2 PHE 8 HE1 PHE 8 -6.561 -7.654 -5.409 75 HZ PHE 8 HZ PHE 8 -6.847 -5.779 -3.835 76 H SER 9 H SER 9 -0.160 -4.007 -8.751 77 HA SER 9 HA SER 9 -0.357 -4.958 -11.434 78 HB2 SER 9 2HB SER 9 1.582 -3.580 -11.921 79 HB3 SER 9 3HB SER 9 0.492 -2.690 -10.857 80 HG SER 9 HG SER 9 3.057 -3.541 -10.424 81 H THR 10 H THR 10 1.553 -5.936 -8.705 82 HA THR 10 HA THR 10 2.969 -7.640 -8.284 83 HB THR 10 HB THR 10 2.964 -9.670 -9.550 84 HG1 THR 10 HG1 THR 10 1.441 -8.495 -11.630 85 HG21 THR 10 3HG2 THR 10 0.565 -10.156 -9.724 86 HG22 THR 10 1HG2 THR 10 0.208 -8.430 -9.650 87 HG23 THR 10 2HG2 THR 10 0.932 -9.243 -8.261 88 H ASP 11 H ASP 11 3.371 -7.048 -11.804 89 HA ASP 11 HA ASP 11 6.085 -7.646 -11.907 90 HB2 ASP 11 2HB ASP 11 4.494 -5.779 -13.679 91 HB3 ASP 11 3HB ASP 11 6.095 -6.410 -14.057 92 H GLU 12 H GLU 12 7.868 -6.671 -11.276 93 HA GLU 12 HA GLU 12 7.983 -4.280 -9.824 94 HB2 GLU 12 2HB GLU 12 10.057 -6.010 -11.147 95 HB3 GLU 12 3HB GLU 12 10.529 -4.485 -10.414 96 HG2 GLU 12 2HG GLU 12 8.931 -6.426 -8.800 97 HG3 GLU 12 3HG GLU 12 10.645 -6.736 -9.069 98 H GLU 13 H GLU 13 7.919 -4.724 -13.249 99 HA GLU 13 HA GLU 13 9.314 -2.471 -14.137 100 HB2 GLU 13 2HB GLU 13 8.475 -4.230 -15.636 101 HB3 GLU 13 3HB GLU 13 6.823 -3.708 -15.333 102 HG2 GLU 13 2HG GLU 13 7.221 -1.606 -16.425 103 HG3 GLU 13 3HG GLU 13 8.942 -1.958 -16.576 104 H THR 14 H THR 14 5.755 -2.674 -13.706 105 HA THR 14 HA THR 14 5.378 0.155 -13.767 106 HB THR 14 HB THR 14 3.559 -2.028 -12.708 107 HG1 THR 14 HG1 THR 14 2.859 -2.184 -14.719 108 HG21 THR 14 3HG2 THR 14 1.746 -0.370 -12.924 109 HG22 THR 14 1HG2 THR 14 2.932 0.871 -13.326 110 HG23 THR 14 2HG2 THR 14 2.940 0.126 -11.726 111 H LEU 15 H LEU 15 5.736 -2.196 -11.147 112 HA LEU 15 HA LEU 15 5.069 -0.567 -8.975 113 HB2 LEU 15 2HB LEU 15 5.361 -2.996 -8.830 114 HB3 LEU 15 3HB LEU 15 7.082 -2.818 -9.109 115 HG LEU 15 HG LEU 15 7.291 -1.590 -6.969 116 HD11 LEU 15 1HD1 LEU 15 4.378 -2.275 -6.597 117 HD12 LEU 15 2HD1 LEU 15 5.044 -0.660 -6.844 118 HD13 LEU 15 3HD1 LEU 15 5.442 -1.562 -5.383 119 HD21 LEU 15 3HD2 LEU 15 7.715 -3.977 -6.996 120 HD22 LEU 15 1HD2 LEU 15 6.000 -4.312 -6.751 121 HD23 LEU 15 2HD2 LEU 15 6.935 -3.519 -5.482 122 H ARG 16 H ARG 16 8.132 -0.881 -10.713 123 HA ARG 16 HA ARG 16 9.861 0.418 -8.984 124 HB2 ARG 16 2HB ARG 16 10.546 -0.720 -11.065 125 HB3 ARG 16 3HB ARG 16 9.853 0.597 -12.003 126 HG2 ARG 16 2HG ARG 16 11.453 2.157 -10.997 127 HG3 ARG 16 3HG ARG 16 12.145 0.835 -10.053 128 HD2 ARG 16 2HD ARG 16 12.711 -0.319 -12.176 129 HD3 ARG 16 3HD ARG 16 12.117 1.086 -13.062 130 HE ARG 16 HE ARG 16 14.064 1.888 -11.184 131 HH11 ARG 16 1HH1 ARG 16 13.744 0.231 -14.175 132 HH12 ARG 16 2HH1 ARG 16 15.343 0.619 -14.699 133 HH21 ARG 16 1HH2 ARG 16 16.141 2.371 -11.850 134 HH22 ARG 16 2HH2 ARG 16 16.695 1.803 -13.388 135 H LYS 17 H LYS 17 7.583 1.838 -11.281 136 HA LYS 17 HA LYS 17 8.372 4.516 -11.147 137 HB2 LYS 17 2HB LYS 17 5.701 3.192 -11.615 138 HB3 LYS 17 3HB LYS 17 5.829 4.940 -11.558 139 HG2 LYS 17 2HG LYS 17 5.883 4.182 -13.843 140 HG3 LYS 17 3HG LYS 17 7.441 4.882 -13.406 141 HD2 LYS 17 2HD LYS 17 8.347 2.610 -13.071 142 HD3 LYS 17 3HD LYS 17 6.788 1.931 -13.548 143 HE2 LYS 17 2HE LYS 17 8.394 1.903 -15.402 144 HE3 LYS 17 3HE LYS 17 7.008 2.933 -15.759 145 HZ1 LYS 17 3HZ LYS 17 8.323 4.866 -15.232 146 HZ2 LYS 17 1HZ LYS 17 9.124 3.942 -16.400 147 HZ3 LYS 17 2HZ LYS 17 9.643 3.902 -14.796 148 H PHE 18 H PHE 18 6.101 2.746 -9.061 149 HA PHE 18 HA PHE 18 5.476 4.909 -7.333 150 HB2 PHE 18 2HB PHE 18 5.415 1.921 -6.794 151 HB3 PHE 18 3HB PHE 18 4.638 3.151 -5.801 152 HD1 PHE 18 HD1 PHE 18 4.652 1.648 -9.193 153 HD2 PHE 18 HD2 PHE 18 2.488 3.933 -6.323 154 HE1 PHE 18 HE1 PHE 18 2.643 1.511 -10.601 155 HE2 PHE 18 HE2 PHE 18 0.476 3.798 -7.730 156 HZ PHE 18 HZ PHE 18 0.554 2.588 -9.872 157 H LYS 19 H LYS 19 7.879 2.318 -7.165 158 HA LYS 19 HA LYS 19 8.962 2.867 -4.641 159 HB2 LYS 19 2HB LYS 19 10.352 1.728 -7.084 160 HB3 LYS 19 3HB LYS 19 10.924 1.592 -5.423 161 HG2 LYS 19 2HG LYS 19 9.100 0.193 -4.817 162 HG3 LYS 19 3HG LYS 19 8.255 0.529 -6.327 163 HD2 LYS 19 2HD LYS 19 9.183 -1.654 -6.523 164 HD3 LYS 19 3HD LYS 19 10.155 -0.591 -7.536 165 HE2 LYS 19 2HE LYS 19 11.866 -0.482 -5.789 166 HE3 LYS 19 3HE LYS 19 10.886 -1.526 -4.757 167 HZ1 LYS 19 3HZ LYS 19 11.018 -3.201 -6.622 168 HZ2 LYS 19 1HZ LYS 19 12.463 -2.912 -5.786 169 HZ3 LYS 19 2HZ LYS 19 12.217 -2.226 -7.309 170 H ASP 20 H ASP 20 9.849 4.172 -7.833 171 HA ASP 20 HA ASP 20 12.033 5.722 -6.880 172 HB2 ASP 20 2HB ASP 20 10.536 5.513 -9.441 173 HB3 ASP 20 3HB ASP 20 11.463 6.985 -9.177 174 H ILE 21 H ILE 21 8.591 6.504 -7.382 175 HA ILE 21 HA ILE 21 8.761 9.262 -6.815 176 HB ILE 21 HB ILE 21 6.476 7.348 -6.255 177 HG12 ILE 21 2HG1 ILE 21 6.956 9.281 -8.546 178 HG13 ILE 21 3HG1 ILE 21 7.129 7.532 -8.635 179 HG21 ILE 21 1HG2 ILE 21 6.272 9.366 -4.873 180 HG22 ILE 21 2HG2 ILE 21 5.041 9.339 -6.137 181 HG23 ILE 21 3HG2 ILE 21 6.458 10.376 -6.309 182 HD11 ILE 21 3HD1 ILE 21 4.570 9.015 -8.075 183 HD12 ILE 21 1HD1 ILE 21 4.749 7.264 -8.213 184 HD13 ILE 21 2HD1 ILE 21 5.035 8.294 -9.616 185 H ILE 22 H ILE 22 8.410 6.467 -4.655 186 HA ILE 22 HA ILE 22 8.350 7.866 -2.202 187 HB ILE 22 HB ILE 22 9.449 5.107 -2.815 188 HG12 ILE 22 2HG1 ILE 22 6.733 5.965 -1.760 189 HG13 ILE 22 3HG1 ILE 22 7.060 5.416 -3.402 190 HG21 ILE 22 1HG2 ILE 22 10.320 5.951 -0.694 191 HG22 ILE 22 2HG2 ILE 22 9.175 4.637 -0.428 192 HG23 ILE 22 3HG2 ILE 22 8.679 6.308 -0.152 193 HD11 ILE 22 3HD1 ILE 22 7.687 3.222 -2.549 194 HD12 ILE 22 1HD1 ILE 22 6.050 3.663 -2.063 195 HD13 ILE 22 2HD1 ILE 22 7.372 3.768 -0.900 196 H LYS 23 H LYS 23 11.082 6.418 -3.977 197 HA LYS 23 HA LYS 23 13.203 7.203 -2.361 198 HB2 LYS 23 2HB LYS 23 13.040 6.868 -5.364 199 HB3 LYS 23 3HB LYS 23 14.555 7.118 -4.507 200 HG2 LYS 23 2HG LYS 23 14.404 5.043 -3.411 201 HG3 LYS 23 3HG LYS 23 12.701 4.853 -3.822 202 HD2 LYS 23 2HD LYS 23 14.097 3.378 -5.179 203 HD3 LYS 23 3HD LYS 23 13.291 4.577 -6.186 204 HE2 LYS 23 2HE LYS 23 16.113 4.949 -5.194 205 HE3 LYS 23 3HE LYS 23 15.751 4.072 -6.679 206 HZ1 LYS 23 3HZ LYS 23 14.636 6.080 -7.513 207 HZ2 LYS 23 1HZ LYS 23 16.271 6.347 -7.171 208 HZ3 LYS 23 2HZ LYS 23 15.092 6.912 -6.109 209 H LYS 24 H LYS 24 11.516 9.043 -4.862 210 HA LYS 24 HA LYS 24 13.209 11.236 -5.126 211 HB2 LYS 24 2HB LYS 24 11.262 10.813 -6.578 212 HB3 LYS 24 3HB LYS 24 10.181 11.193 -5.244 213 HG2 LYS 24 2HG LYS 24 11.032 13.497 -5.214 214 HG3 LYS 24 3HG LYS 24 12.107 13.111 -6.560 215 HD2 LYS 24 2HD LYS 24 10.123 12.558 -7.940 216 HD3 LYS 24 3HD LYS 24 9.083 13.036 -6.596 217 HE2 LYS 24 2HE LYS 24 9.243 14.845 -8.206 218 HE3 LYS 24 3HE LYS 24 10.029 15.312 -6.699 219 HZ1 LYS 24 3HZ LYS 24 11.436 14.316 -9.118 220 HZ2 LYS 24 1HZ LYS 24 12.170 14.842 -7.686 221 HZ3 LYS 24 2HZ LYS 24 11.321 15.937 -8.658 222 H ASN 25 H ASN 25 10.671 10.646 -2.728 223 HA ASN 25 HA ASN 25 11.106 13.226 -1.453 224 HB2 ASN 25 2HB ASN 25 9.226 10.944 -0.809 225 HB3 ASN 25 3HB ASN 25 9.308 12.441 0.119 226 HD21 ASN 25 1HD2 ASN 25 8.314 10.970 -2.859 227 HD22 ASN 25 2HD2 ASN 25 7.403 12.315 -3.441 228 H GLY 26 H GLY 26 12.914 10.567 -1.402 229 HA2 GLY 26 2HA GLY 26 14.769 10.199 -0.051 230 HA3 GLY 26 3HA GLY 26 14.130 11.354 1.102 231 H PHE 27 H PHE 27 11.783 9.032 0.369 232 HA PHE 27 HA PHE 27 12.171 7.798 2.979 233 HB2 PHE 27 2HB PHE 27 9.918 7.600 0.971 234 HB3 PHE 27 3HB PHE 27 9.942 6.722 2.497 235 HD1 PHE 27 HD2 PHE 27 9.651 10.032 0.934 236 HD2 PHE 27 HD1 PHE 27 9.544 7.853 4.590 237 HE1 PHE 27 HE2 PHE 27 8.651 11.978 2.063 238 HE2 PHE 27 HE1 PHE 27 8.540 9.789 5.723 239 HZ PHE 27 HZ PHE 27 8.092 11.857 4.461 240 H LYS 28 H LYS 28 11.740 5.392 3.174 241 HA LYS 28 HA LYS 28 13.311 3.955 1.138 242 HB2 LYS 28 2HB LYS 28 12.690 3.289 4.023 243 HB3 LYS 28 3HB LYS 28 13.516 2.188 2.927 244 HG2 LYS 28 2HG LYS 28 14.509 4.944 3.647 245 HG3 LYS 28 3HG LYS 28 15.045 3.448 4.417 246 HD2 LYS 28 2HD LYS 28 15.911 2.630 2.298 247 HD3 LYS 28 3HD LYS 28 15.286 4.053 1.462 248 HE2 LYS 28 2HE LYS 28 17.374 4.108 3.644 249 HE3 LYS 28 3HE LYS 28 17.720 4.177 1.916 250 HZ1 LYS 28 3HZ LYS 28 16.099 6.158 3.421 251 HZ2 LYS 28 1HZ LYS 28 16.479 6.229 1.773 252 HZ3 LYS 28 2HZ LYS 28 17.704 6.373 2.929 253 H VAL 29 H VAL 29 12.628 1.879 0.390 254 HA VAL 29 HA VAL 29 9.684 1.605 0.375 255 HB VAL 29 HB VAL 29 11.643 0.585 -1.696 256 HG11 VAL 29 1HG1 VAL 29 9.579 -0.702 -1.617 257 HG12 VAL 29 2HG1 VAL 29 9.638 0.270 -3.087 258 HG13 VAL 29 3HG1 VAL 29 8.627 0.780 -1.735 259 HG21 VAL 29 3HG2 VAL 29 11.661 3.022 -1.670 260 HG22 VAL 29 1HG2 VAL 29 9.898 3.054 -1.773 261 HG23 VAL 29 2HG2 VAL 29 10.851 2.428 -3.119 262 H ARG 30 H ARG 30 9.038 0.018 1.726 263 HA ARG 30 HA ARG 30 10.611 -2.453 1.945 264 HB2 ARG 30 2HB ARG 30 9.923 -1.590 4.065 265 HB3 ARG 30 3HB ARG 30 8.274 -1.357 3.516 266 HG2 ARG 30 2HG ARG 30 8.387 -3.232 5.028 267 HG3 ARG 30 3HG ARG 30 7.974 -3.801 3.413 268 HD2 ARG 30 2HD ARG 30 10.814 -3.814 4.400 269 HD3 ARG 30 3HD ARG 30 9.706 -5.126 4.792 270 HE ARG 30 HE ARG 30 9.521 -4.946 2.097 271 HH11 ARG 30 1HH1 ARG 30 12.164 -5.289 4.281 272 HH12 ARG 30 2HH1 ARG 30 13.137 -6.143 3.130 273 HH21 ARG 30 1HH2 ARG 30 10.787 -6.067 0.639 274 HH22 ARG 30 2HH2 ARG 30 12.376 -6.570 1.111 275 H THR 31 H THR 31 10.213 -3.528 0.029 276 HA THR 31 HA THR 31 7.528 -3.921 -0.969 277 HB THR 31 HB THR 31 8.634 -5.469 -2.610 278 HG1 THR 31 HG1 THR 31 11.043 -5.235 -2.572 279 HG21 THR 31 3HG2 THR 31 9.852 -3.714 -3.816 280 HG22 THR 31 1HG2 THR 31 9.893 -2.730 -2.351 281 HG23 THR 31 2HG2 THR 31 8.352 -3.089 -3.130 282 H VAL 32 H VAL 32 6.164 -5.520 -0.450 283 HA VAL 32 HA VAL 32 7.203 -7.863 1.033 284 HB VAL 32 HB VAL 32 4.516 -6.485 1.296 285 HG11 VAL 32 1HG1 VAL 32 4.258 -8.915 1.483 286 HG12 VAL 32 2HG1 VAL 32 4.003 -8.124 3.037 287 HG13 VAL 32 3HG1 VAL 32 5.521 -8.961 2.713 288 HG21 VAL 32 3HG2 VAL 32 6.311 -5.299 2.431 289 HG22 VAL 32 1HG2 VAL 32 6.811 -6.784 3.243 290 HG23 VAL 32 2HG2 VAL 32 5.245 -6.059 3.614 291 H ARG 33 H ARG 33 6.772 -9.847 0.216 292 HA ARG 33 HA ARG 33 4.725 -10.069 -1.905 293 HB2 ARG 33 2HB ARG 33 6.983 -10.334 -2.812 294 HB3 ARG 33 3HB ARG 33 7.322 -11.608 -1.649 295 HG2 ARG 33 2HG ARG 33 6.834 -12.528 -3.849 296 HG3 ARG 33 3HG ARG 33 5.617 -13.020 -2.670 297 HD2 ARG 33 2HD ARG 33 4.181 -11.128 -3.512 298 HD3 ARG 33 3HD ARG 33 5.360 -10.900 -4.805 299 HE ARG 33 HE ARG 33 4.835 -13.371 -5.289 300 HH11 ARG 33 1HH1 ARG 33 2.548 -11.068 -4.124 301 HH12 ARG 33 2HH1 ARG 33 1.201 -11.903 -4.821 302 HH21 ARG 33 1HH2 ARG 33 3.092 -14.403 -6.199 303 HH22 ARG 33 2HH2 ARG 33 1.504 -13.757 -5.969 304 H SER 34 H SER 34 6.184 -11.669 0.899 305 HA SER 34 HA SER 34 3.967 -13.626 0.897 306 HB2 SER 34 2HB SER 34 5.351 -15.119 2.153 307 HB3 SER 34 3HB SER 34 6.372 -14.489 0.859 308 HG SER 34 HG SER 34 7.631 -14.165 2.565 309 HA PRO 35 HA PRO 35 2.284 -11.925 4.680 310 HB2 PRO 35 2HB PRO 35 1.783 -14.217 6.136 311 HB3 PRO 35 3HB PRO 35 0.738 -13.610 4.848 312 HG2 PRO 35 2HG PRO 35 2.836 -15.748 4.734 313 HG3 PRO 35 3HG PRO 35 1.212 -15.734 4.015 314 HD2 PRO 35 2HD PRO 35 3.398 -15.236 2.539 315 HD3 PRO 35 3HD PRO 35 1.877 -14.366 2.248 316 H GLN 36 H GLN 36 4.829 -14.351 4.916 317 HA GLN 36 HA GLN 36 5.741 -13.784 7.521 318 HB2 GLN 36 2HB GLN 36 6.415 -15.788 6.300 319 HB3 GLN 36 3HB GLN 36 7.254 -14.807 5.106 320 HG2 GLN 36 2HG GLN 36 8.876 -14.109 6.745 321 HG3 GLN 36 3HG GLN 36 7.985 -14.924 8.028 322 HE21 GLN 36 1HE2 GLN 36 9.744 -16.213 8.566 323 HE22 GLN 36 2HE2 GLN 36 10.285 -17.508 7.559 324 H GLU 37 H GLU 37 6.810 -12.506 4.357 325 HA GLU 37 HA GLU 37 8.695 -10.652 5.221 326 HB2 GLU 37 2HB GLU 37 6.706 -10.436 2.945 327 HB3 GLU 37 3HB GLU 37 8.059 -9.339 3.167 328 HG2 GLU 37 2HG GLU 37 8.354 -12.312 2.778 329 HG3 GLU 37 3HG GLU 37 8.410 -11.132 1.470 330 H LEU 38 H LEU 38 5.164 -10.304 5.000 331 HA LEU 38 HA LEU 38 5.053 -7.569 5.757 332 HB2 LEU 38 2HB LEU 38 3.240 -8.738 4.559 333 HB3 LEU 38 3HB LEU 38 2.927 -9.708 5.984 334 HG LEU 38 HG LEU 38 2.260 -7.680 7.221 335 HD11 LEU 38 1HD1 LEU 38 3.626 -6.035 6.067 336 HD12 LEU 38 2HD1 LEU 38 1.927 -5.566 6.023 337 HD13 LEU 38 3HD1 LEU 38 2.687 -6.260 4.590 338 HD21 LEU 38 3HD2 LEU 38 0.550 -8.985 6.089 339 HD22 LEU 38 1HD2 LEU 38 0.804 -8.065 4.603 340 HD23 LEU 38 2HD2 LEU 38 0.153 -7.269 6.036 341 H LYS 39 H LYS 39 4.784 -10.571 7.624 342 HA LYS 39 HA LYS 39 4.120 -9.360 10.104 343 HB2 LYS 39 2HB LYS 39 3.651 -11.689 9.772 344 HB3 LYS 39 3HB LYS 39 5.334 -12.037 9.407 345 HG2 LYS 39 2HG LYS 39 5.964 -11.603 11.707 346 HG3 LYS 39 3HG LYS 39 4.308 -11.133 12.097 347 HD2 LYS 39 2HD LYS 39 5.064 -13.866 11.051 348 HD3 LYS 39 3HD LYS 39 4.956 -13.480 12.769 349 HE2 LYS 39 2HE LYS 39 2.682 -13.117 10.815 350 HE3 LYS 39 3HE LYS 39 2.909 -14.558 11.805 351 HZ1 LYS 39 3HZ LYS 39 1.341 -12.952 12.781 352 HZ2 LYS 39 1HZ LYS 39 2.583 -11.811 12.894 353 HZ3 LYS 39 2HZ LYS 39 2.670 -13.247 13.780 354 H ASP 40 H ASP 40 7.219 -10.672 8.926 355 HA ASP 40 HA ASP 40 8.756 -9.826 11.132 356 HB2 ASP 40 2HB ASP 40 9.457 -10.696 8.334 357 HB3 ASP 40 3HB ASP 40 10.693 -10.248 9.503 358 H SER 41 H SER 41 7.785 -8.126 8.232 359 HA SER 41 HA SER 41 9.767 -6.205 7.980 360 HB2 SER 41 2HB SER 41 8.186 -4.821 6.830 361 HB3 SER 41 3HB SER 41 7.750 -6.490 6.470 362 HG SER 41 HG SER 41 5.931 -6.253 7.536 363 H ILE 42 H ILE 42 6.887 -6.064 10.062 364 HA ILE 42 HA ILE 42 7.224 -3.541 11.152 365 HB ILE 42 HB ILE 42 6.198 -5.995 12.597 366 HG12 ILE 42 2HG1 ILE 42 4.709 -3.937 10.935 367 HG13 ILE 42 3HG1 ILE 42 5.029 -5.604 10.464 368 HG21 ILE 42 1HG2 ILE 42 5.733 -3.058 13.159 369 HG22 ILE 42 2HG2 ILE 42 6.668 -4.180 14.148 370 HG23 ILE 42 3HG2 ILE 42 4.927 -4.399 13.979 371 HD11 ILE 42 3HD1 ILE 42 2.751 -5.337 11.227 372 HD12 ILE 42 1HD1 ILE 42 3.318 -4.717 12.777 373 HD13 ILE 42 2HD1 ILE 42 3.649 -6.390 12.319 374 H GLU 43 H GLU 43 8.603 -6.619 12.335 375 HA GLU 43 HA GLU 43 9.884 -5.491 14.600 376 HB2 GLU 43 2HB GLU 43 10.182 -8.110 13.154 377 HB3 GLU 43 3HB GLU 43 11.271 -7.683 14.468 378 HG2 GLU 43 2HG GLU 43 8.270 -7.913 14.642 379 HG3 GLU 43 3HG GLU 43 9.449 -9.062 15.274 380 H GLU 44 H GLU 44 10.889 -5.729 11.260 381 HA GLU 44 HA GLU 44 13.653 -5.095 11.912 382 HB2 GLU 44 2HB GLU 44 13.135 -6.561 9.992 383 HB3 GLU 44 3HB GLU 44 12.300 -5.224 9.207 384 HG2 GLU 44 2HG GLU 44 14.380 -3.955 9.115 385 HG3 GLU 44 3HG GLU 44 15.224 -5.255 9.951 386 H LEU 45 H LEU 45 10.939 -3.442 10.281 387 HA LEU 45 HA LEU 45 12.231 -1.071 9.633 388 HB2 LEU 45 2HB LEU 45 9.328 -1.455 10.383 389 HB3 LEU 45 3HB LEU 45 9.980 -0.033 9.588 390 HG LEU 45 HG LEU 45 9.819 -2.833 8.457 391 HD11 LEU 45 1HD1 LEU 45 8.367 -1.796 6.779 392 HD12 LEU 45 2HD1 LEU 45 8.499 -0.250 7.618 393 HD13 LEU 45 3HD1 LEU 45 7.713 -1.617 8.407 394 HD21 LEU 45 3HD2 LEU 45 10.794 -1.893 6.403 395 HD22 LEU 45 1HD2 LEU 45 11.922 -1.833 7.759 396 HD23 LEU 45 2HD2 LEU 45 11.082 -0.371 7.244 397 H VAL 46 H VAL 46 10.489 -1.870 12.646 398 HA VAL 46 HA VAL 46 10.787 0.545 13.994 399 HB VAL 46 HB VAL 46 9.433 -1.204 14.955 400 HG11 VAL 46 1HG1 VAL 46 11.988 -2.777 15.307 401 HG12 VAL 46 2HG1 VAL 46 10.684 -3.144 14.179 402 HG13 VAL 46 3HG1 VAL 46 10.400 -3.246 15.916 403 HG21 VAL 46 3HG2 VAL 46 11.799 -0.712 16.772 404 HG22 VAL 46 1HG2 VAL 46 10.172 -1.177 17.273 405 HG23 VAL 46 2HG2 VAL 46 10.450 0.400 16.530 406 H LYS 47 H LYS 47 13.149 -1.999 13.462 407 HA LYS 47 HA LYS 47 15.097 -0.765 15.249 408 HB2 LYS 47 2HB LYS 47 15.259 -3.247 13.524 409 HB3 LYS 47 3HB LYS 47 16.505 -2.719 14.652 410 HG2 LYS 47 2HG LYS 47 15.023 -3.027 16.524 411 HG3 LYS 47 3HG LYS 47 13.673 -3.388 15.447 412 HD2 LYS 47 2HD LYS 47 14.848 -5.400 14.663 413 HD3 LYS 47 3HD LYS 47 16.188 -5.041 15.756 414 HE2 LYS 47 2HE LYS 47 14.669 -6.737 16.688 415 HE3 LYS 47 3HE LYS 47 14.713 -5.287 17.681 416 HZ1 LYS 47 3HZ LYS 47 12.461 -6.226 17.301 417 HZ2 LYS 47 1HZ LYS 47 12.611 -5.836 15.663 418 HZ3 LYS 47 2HZ LYS 47 12.619 -4.611 16.826 419 H LYS 48 H LYS 48 14.291 -0.696 11.907 420 HA LYS 48 HA LYS 48 16.926 0.438 11.200 421 HB2 LYS 48 2HB LYS 48 14.717 -0.542 9.366 422 HB3 LYS 48 3HB LYS 48 16.284 0.065 8.851 423 HG2 LYS 48 2HG LYS 48 15.831 -2.415 10.514 424 HG3 LYS 48 3HG LYS 48 16.164 -2.385 8.782 425 HD2 LYS 48 2HD LYS 48 18.350 -1.360 9.213 426 HD3 LYS 48 3HD LYS 48 18.015 -1.355 10.947 427 HE2 LYS 48 2HE LYS 48 19.427 -3.233 10.458 428 HE3 LYS 48 3HE LYS 48 17.821 -3.839 10.853 429 HZ1 LYS 48 3HZ LYS 48 19.055 -3.621 8.163 430 HZ2 LYS 48 1HZ LYS 48 17.417 -3.956 8.403 431 HZ3 LYS 48 2HZ LYS 48 18.587 -5.029 8.976 432 H TYR 49 H TYR 49 13.693 1.022 9.805 433 HA TYR 49 HA TYR 49 13.839 3.862 10.514 434 HB2 TYR 49 2HB TYR 49 13.603 2.868 7.659 435 HB3 TYR 49 3HB TYR 49 13.310 4.528 8.162 436 HD1 TYR 49 HD2 TYR 49 15.236 5.829 9.194 437 HD2 TYR 49 HD1 TYR 49 15.788 2.131 7.150 438 HE1 TYR 49 HE2 TYR 49 17.617 6.352 8.895 439 HE2 TYR 49 HE1 TYR 49 18.174 2.647 6.853 440 HH TYR 49 HH TYR 49 19.734 5.132 8.543 441 H ASN 50 H ASN 50 11.922 4.256 11.462 442 HA ASN 50 HA ASN 50 9.529 2.804 10.888 443 HB2 ASN 50 2HB ASN 50 10.082 5.310 12.475 444 HB3 ASN 50 3HB ASN 50 8.448 4.696 12.256 445 HD21 ASN 50 1HD2 ASN 50 11.564 4.073 13.696 446 HD22 ASN 50 2HD2 ASN 50 11.021 2.846 14.778 447 H ALA 51 H ALA 51 11.050 5.439 9.348 448 HA ALA 51 HA ALA 51 8.630 6.524 8.152 449 HB1 ALA 51 3HB ALA 51 10.467 8.024 8.758 450 HB2 ALA 51 1HB ALA 51 10.133 8.089 7.027 451 HB3 ALA 51 2HB ALA 51 11.530 7.190 7.623 452 H THR 52 H THR 52 9.995 3.716 7.618 453 HA THR 52 HA THR 52 10.376 3.757 4.751 454 HB THR 52 HB THR 52 10.146 1.389 6.631 455 HG1 THR 52 HG1 THR 52 12.096 1.966 7.173 456 HG21 THR 52 3HG2 THR 52 11.177 1.541 3.791 457 HG22 THR 52 1HG2 THR 52 9.682 0.761 4.309 458 HG23 THR 52 2HG2 THR 52 11.238 0.119 4.832 459 H ILE 53 H ILE 53 8.795 3.603 3.273 460 HA ILE 53 HA ILE 53 6.066 3.092 4.084 461 HB ILE 53 HB ILE 53 7.188 3.568 1.308 462 HG12 ILE 53 2HG1 ILE 53 5.894 5.489 3.274 463 HG13 ILE 53 3HG1 ILE 53 7.593 5.475 2.811 464 HG21 ILE 53 1HG2 ILE 53 4.338 3.644 2.318 465 HG22 ILE 53 2HG2 ILE 53 5.033 2.435 1.238 466 HG23 ILE 53 3HG2 ILE 53 4.865 4.104 0.697 467 HD11 ILE 53 3HD1 ILE 53 6.972 6.057 0.521 468 HD12 ILE 53 1HD1 ILE 53 6.384 7.248 1.680 469 HD13 ILE 53 2HD1 ILE 53 5.270 6.072 0.985 470 H VAL 54 H VAL 54 5.201 1.104 4.217 471 HA VAL 54 HA VAL 54 6.569 -1.148 2.992 472 HB VAL 54 HB VAL 54 5.900 -1.464 5.274 473 HG11 VAL 54 1HG1 VAL 54 3.555 -1.466 5.992 474 HG12 VAL 54 2HG1 VAL 54 3.065 -0.936 4.383 475 HG13 VAL 54 3HG1 VAL 54 4.055 0.116 5.395 476 HG21 VAL 54 3HG2 VAL 54 5.828 -3.442 3.853 477 HG22 VAL 54 1HG2 VAL 54 4.144 -3.108 3.444 478 HG23 VAL 54 2HG2 VAL 54 4.583 -3.529 5.100 479 H VAL 55 H VAL 55 6.173 -1.551 0.947 480 HA VAL 55 HA VAL 55 3.490 -1.217 -0.184 481 HB VAL 55 HB VAL 55 6.118 -1.803 -1.578 482 HG11 VAL 55 1HG1 VAL 55 4.915 -1.187 -3.636 483 HG12 VAL 55 2HG1 VAL 55 3.421 -1.040 -2.710 484 HG13 VAL 55 3HG1 VAL 55 4.216 -2.608 -2.862 485 HG21 VAL 55 3HG2 VAL 55 6.049 0.552 -2.290 486 HG22 VAL 55 1HG2 VAL 55 6.145 0.404 -0.534 487 HG23 VAL 55 2HG2 VAL 55 4.609 0.804 -1.303 488 H VAL 56 H VAL 56 2.248 -2.992 0.112 489 HA VAL 56 HA VAL 56 3.386 -5.669 0.061 490 HB VAL 56 HB VAL 56 0.498 -4.826 0.448 491 HG11 VAL 56 1HG1 VAL 56 0.212 -7.081 1.395 492 HG12 VAL 56 2HG1 VAL 56 1.883 -7.462 0.982 493 HG13 VAL 56 3HG1 VAL 56 0.710 -7.139 -0.294 494 HG21 VAL 56 3HG2 VAL 56 2.582 -5.530 2.528 495 HG22 VAL 56 1HG2 VAL 56 0.889 -5.145 2.839 496 HG23 VAL 56 2HG2 VAL 56 1.971 -3.908 2.196 497 H VAL 57 H VAL 57 3.777 -6.498 -1.914 498 HA VAL 57 HA VAL 57 2.201 -5.747 -4.223 499 HB VAL 57 HB VAL 57 4.432 -7.788 -4.066 500 HG11 VAL 57 1HG1 VAL 57 4.664 -7.348 -6.469 501 HG12 VAL 57 2HG1 VAL 57 3.291 -6.240 -6.399 502 HG13 VAL 57 3HG1 VAL 57 3.056 -7.960 -6.077 503 HG21 VAL 57 3HG2 VAL 57 5.198 -5.611 -3.232 504 HG22 VAL 57 1HG2 VAL 57 4.607 -4.835 -4.704 505 HG23 VAL 57 2HG2 VAL 57 5.936 -5.995 -4.787 506 H VAL 58 H VAL 58 0.277 -6.680 -4.516 507 HA VAL 58 HA VAL 58 -0.110 -9.485 -3.695 508 HB VAL 58 HB VAL 58 -2.491 -8.971 -3.446 509 HG11 VAL 58 1HG1 VAL 58 -2.318 -7.455 -1.493 510 HG12 VAL 58 2HG1 VAL 58 -0.671 -7.053 -1.979 511 HG13 VAL 58 3HG1 VAL 58 -1.071 -8.702 -1.498 512 HG21 VAL 58 3HG2 VAL 58 -2.710 -7.239 -5.152 513 HG22 VAL 58 1HG2 VAL 58 -1.712 -6.146 -4.193 514 HG23 VAL 58 2HG2 VAL 58 -3.296 -6.644 -3.598 515 H ASP 59 H ASP 59 -1.236 -10.910 -5.022 516 HA ASP 59 HA ASP 59 -1.368 -10.151 -7.862 517 HB2 ASP 59 2HB ASP 59 -1.343 -12.663 -8.233 518 HB3 ASP 59 3HB ASP 59 0.126 -11.973 -7.548 519 H ASP 60 H ASP 60 -3.198 -12.069 -5.442 520 HA ASP 60 HA ASP 60 -5.624 -11.585 -7.056 521 HB2 ASP 60 2HB ASP 60 -4.649 -13.997 -6.878 522 HB3 ASP 60 3HB ASP 60 -5.326 -13.977 -5.253 523 H LYS 61 H LYS 61 -7.651 -12.055 -5.601 524 HA LYS 61 HA LYS 61 -7.870 -9.825 -3.921 525 HB2 LYS 61 2HB LYS 61 -9.758 -12.171 -3.907 526 HB3 LYS 61 3HB LYS 61 -10.134 -10.477 -3.625 527 HG2 LYS 61 2HG LYS 61 -9.816 -9.947 -5.941 528 HG3 LYS 61 3HG LYS 61 -9.173 -11.557 -6.274 529 HD2 LYS 61 2HD LYS 61 -12.003 -10.863 -5.468 530 HD3 LYS 61 3HD LYS 61 -11.463 -11.438 -7.045 531 HE2 LYS 61 2HE LYS 61 -11.392 -12.980 -4.446 532 HE3 LYS 61 3HE LYS 61 -12.495 -13.247 -5.792 533 HZ1 LYS 61 3HZ LYS 61 -10.689 -14.850 -5.788 534 HZ2 LYS 61 1HZ LYS 61 -9.542 -13.613 -5.885 535 HZ3 LYS 61 2HZ LYS 61 -10.609 -13.880 -7.169 536 H GLU 62 H GLU 62 -7.929 -13.300 -3.028 537 HA GLU 62 HA GLU 62 -8.381 -12.930 -0.295 538 HB2 GLU 62 2HB GLU 62 -7.131 -15.204 -1.828 539 HB3 GLU 62 3HB GLU 62 -7.328 -15.270 -0.082 540 HG2 GLU 62 2HG GLU 62 -9.142 -16.426 -1.192 541 HG3 GLU 62 3HG GLU 62 -9.745 -15.012 -0.333 542 H TRP 63 H TRP 63 -5.275 -13.165 -2.019 543 HA TRP 63 HA TRP 63 -3.670 -12.848 0.311 544 HB2 TRP 63 2HB TRP 63 -2.632 -13.763 -1.644 545 HB3 TRP 63 3HB TRP 63 -3.105 -12.383 -2.625 546 HD1 TRP 63 HD1 TRP 63 -0.883 -11.309 -3.319 547 HE1 TRP 63 HE1 TRP 63 1.199 -10.425 -2.096 548 HE3 TRP 63 HE3 TRP 63 -1.951 -12.941 1.417 549 HZ2 TRP 63 HZ2 TRP 63 2.255 -10.423 0.505 550 HZ3 TRP 63 HZ3 TRP 63 -0.343 -12.450 3.213 551 HH2 TRP 63 HH2 TRP 63 1.716 -11.218 2.766 552 H ALA 64 H ALA 64 -5.138 -10.546 -1.941 553 HA ALA 64 HA ALA 64 -3.885 -8.202 -1.018 554 HB1 ALA 64 3HB ALA 64 -6.665 -8.495 -2.165 555 HB2 ALA 64 1HB ALA 64 -5.180 -8.304 -3.099 556 HB3 ALA 64 2HB ALA 64 -5.737 -6.999 -2.052 557 H GLU 65 H GLU 65 -7.041 -9.598 -0.065 558 HA GLU 65 HA GLU 65 -7.475 -7.697 2.015 559 HB2 GLU 65 2HB GLU 65 -9.342 -8.868 0.948 560 HB3 GLU 65 3HB GLU 65 -8.756 -10.407 1.569 561 HG2 GLU 65 2HG GLU 65 -9.179 -9.696 3.847 562 HG3 GLU 65 3HG GLU 65 -9.641 -8.089 3.290 563 H LYS 66 H LYS 66 -5.769 -10.741 1.864 564 HA LYS 66 HA LYS 66 -5.628 -11.410 4.569 565 HB2 LYS 66 2HB LYS 66 -4.764 -12.883 2.843 566 HB3 LYS 66 3HB LYS 66 -3.527 -11.711 2.410 567 HG2 LYS 66 2HG LYS 66 -2.608 -13.549 3.725 568 HG3 LYS 66 3HG LYS 66 -2.452 -12.010 4.573 569 HD2 LYS 66 2HD LYS 66 -4.416 -12.564 5.938 570 HD3 LYS 66 3HD LYS 66 -4.583 -14.097 5.079 571 HE2 LYS 66 2HE LYS 66 -2.200 -13.263 6.740 572 HE3 LYS 66 3HE LYS 66 -3.468 -14.376 7.253 573 HZ1 LYS 66 3HZ LYS 66 -1.501 -15.543 6.463 574 HZ2 LYS 66 1HZ LYS 66 -1.642 -14.804 4.950 575 HZ3 LYS 66 2HZ LYS 66 -2.835 -15.877 5.478 576 H ALA 67 H ALA 67 -3.680 -9.087 2.717 577 HA ALA 67 HA ALA 67 -1.926 -8.301 4.767 578 HB1 ALA 67 3HB ALA 67 -3.012 -6.612 2.509 579 HB2 ALA 67 1HB ALA 67 -1.615 -7.685 2.413 580 HB3 ALA 67 2HB ALA 67 -1.569 -6.270 3.465 581 H ILE 68 H ILE 68 -5.058 -6.912 3.793 582 HA ILE 68 HA ILE 68 -5.216 -4.930 5.794 583 HB ILE 68 HB ILE 68 -7.518 -6.355 4.433 584 HG12 ILE 68 2HG1 ILE 68 -5.955 -5.415 2.788 585 HG13 ILE 68 3HG1 ILE 68 -7.461 -4.504 2.805 586 HG21 ILE 68 1HG2 ILE 68 -8.227 -5.079 6.390 587 HG22 ILE 68 2HG2 ILE 68 -8.789 -4.307 4.907 588 HG23 ILE 68 3HG2 ILE 68 -7.401 -3.647 5.772 589 HD11 ILE 68 3HD1 ILE 68 -6.390 -2.761 4.133 590 HD12 ILE 68 1HD1 ILE 68 -5.537 -3.042 2.615 591 HD13 ILE 68 2HD1 ILE 68 -4.885 -3.680 4.124 592 H ARG 69 H ARG 69 -6.212 -8.317 5.759 593 HA ARG 69 HA ARG 69 -7.601 -8.403 8.203 594 HB2 ARG 69 2HB ARG 69 -7.459 -10.188 6.371 595 HB3 ARG 69 3HB ARG 69 -5.916 -10.649 7.065 596 HG2 ARG 69 2HG ARG 69 -8.474 -10.639 8.657 597 HG3 ARG 69 3HG ARG 69 -7.938 -12.031 7.722 598 HD2 ARG 69 2HD ARG 69 -5.816 -12.019 9.046 599 HD3 ARG 69 3HD ARG 69 -6.502 -10.735 10.042 600 HE ARG 69 HE ARG 69 -8.110 -13.125 9.850 601 HH11 ARG 69 1HH1 ARG 69 -5.648 -11.483 11.609 602 HH12 ARG 69 2HH1 ARG 69 -5.941 -12.367 13.062 603 HH21 ARG 69 1HH2 ARG 69 -8.454 -14.277 11.714 604 HH22 ARG 69 2HH2 ARG 69 -7.506 -13.935 13.118 605 H PHE 70 H PHE 70 -4.164 -8.834 7.436 606 HA PHE 70 HA PHE 70 -3.252 -9.429 10.032 607 HB2 PHE 70 2HB PHE 70 -1.890 -9.776 8.009 608 HB3 PHE 70 3HB PHE 70 -1.785 -8.035 7.774 609 HD1 PHE 70 HD1 PHE 70 -0.886 -10.766 10.129 610 HD2 PHE 70 HD2 PHE 70 -0.071 -6.800 8.802 611 HE1 PHE 70 HE1 PHE 70 1.139 -10.715 11.527 612 HE2 PHE 70 HE2 PHE 70 1.952 -6.745 10.196 613 HZ PHE 70 HZ PHE 70 2.559 -8.704 11.563 614 H VAL 71 H VAL 71 -3.352 -6.294 8.310 615 HA VAL 71 HA VAL 71 -2.393 -4.699 10.405 616 HB VAL 71 HB VAL 71 -4.368 -3.887 8.256 617 HG11 VAL 71 1HG1 VAL 71 -2.498 -2.222 9.952 618 HG12 VAL 71 2HG1 VAL 71 -4.258 -2.261 10.066 619 HG13 VAL 71 3HG1 VAL 71 -3.484 -1.618 8.618 620 HG21 VAL 71 3HG2 VAL 71 -2.387 -3.136 6.999 621 HG22 VAL 71 1HG2 VAL 71 -2.360 -4.878 7.281 622 HG23 VAL 71 2HG2 VAL 71 -1.342 -3.812 8.249 623 H LYS 72 H LYS 72 -5.748 -5.554 9.561 624 HA LYS 72 HA LYS 72 -7.014 -4.171 11.660 625 HB2 LYS 72 2HB LYS 72 -7.812 -5.879 9.556 626 HB3 LYS 72 3HB LYS 72 -8.402 -6.646 11.022 627 HG2 LYS 72 2HG LYS 72 -8.938 -3.773 10.273 628 HG3 LYS 72 3HG LYS 72 -10.032 -5.112 9.932 629 HD2 LYS 72 2HD LYS 72 -9.106 -4.316 12.700 630 HD3 LYS 72 3HD LYS 72 -10.632 -3.813 11.973 631 HE2 LYS 72 2HE LYS 72 -11.289 -6.179 11.762 632 HE3 LYS 72 3HE LYS 72 -9.782 -6.657 12.544 633 HZ1 LYS 72 3HZ LYS 72 -10.477 -5.433 14.516 634 HZ2 LYS 72 1HZ LYS 72 -11.600 -6.628 14.111 635 HZ3 LYS 72 2HZ LYS 72 -11.932 -5.007 13.765 636 H SER 73 H SER 73 -5.471 -7.330 11.534 637 HA SER 73 HA SER 73 -6.315 -8.242 14.101 638 HB2 SER 73 2HB SER 73 -5.490 -9.808 12.405 639 HB3 SER 73 3HB SER 73 -3.900 -9.048 12.453 640 HG SER 73 HG SER 73 -5.198 -10.535 14.495 641 H LEU 74 H LEU 74 -3.685 -6.206 13.004 642 HA LEU 74 HA LEU 74 -2.092 -6.211 15.333 643 HB2 LEU 74 2HB LEU 74 -2.563 -3.950 13.378 644 HB3 LEU 74 3HB LEU 74 -1.243 -4.042 14.529 645 HG LEU 74 HG LEU 74 -1.668 -5.965 12.234 646 HD11 LEU 74 1HD1 LEU 74 0.232 -4.845 11.186 647 HD12 LEU 74 2HD1 LEU 74 0.280 -3.676 12.506 648 HD13 LEU 74 3HD1 LEU 74 -1.118 -3.736 11.429 649 HD21 LEU 74 3HD2 LEU 74 0.654 -5.648 14.141 650 HD22 LEU 74 1HD2 LEU 74 0.589 -6.744 12.760 651 HD23 LEU 74 2HD2 LEU 74 -0.504 -6.979 14.123 652 H GLY 75 H GLY 75 -5.046 -4.509 14.518 653 HA2 GLY 75 2HA GLY 75 -6.545 -3.434 15.938 654 HA3 GLY 75 3HA GLY 75 -5.420 -3.669 17.267 655 H ALA 76 H ALA 76 -5.115 -1.986 14.137 656 HA ALA 76 HA ALA 76 -4.990 0.613 15.420 657 HB1 ALA 76 3HB ALA 76 -2.575 -0.439 13.941 658 HB2 ALA 76 1HB ALA 76 -2.693 -0.259 15.692 659 HB3 ALA 76 2HB ALA 76 -2.756 1.165 14.653 660 H GLN 77 H GLN 77 -5.142 2.354 13.941 661 HA GLN 77 HA GLN 77 -6.112 1.583 11.273 662 HB2 GLN 77 2HB GLN 77 -6.414 4.216 12.743 663 HB3 GLN 77 3HB GLN 77 -7.142 3.812 11.192 664 HG2 GLN 77 2HG GLN 77 -8.400 1.990 12.317 665 HG3 GLN 77 3HG GLN 77 -7.744 2.537 13.858 666 HE21 GLN 77 1HE2 GLN 77 -7.912 5.363 13.140 667 HE22 GLN 77 2HE2 GLN 77 -9.584 5.776 13.210 668 H VAL 78 H VAL 78 -4.692 1.735 9.652 669 HA VAL 78 HA VAL 78 -2.603 3.821 9.776 670 HB VAL 78 HB VAL 78 -1.220 2.400 8.323 671 HG11 VAL 78 1HG1 VAL 78 -2.173 1.040 10.850 672 HG12 VAL 78 2HG1 VAL 78 -0.878 2.230 10.710 673 HG13 VAL 78 3HG1 VAL 78 -0.691 0.637 9.981 674 HG21 VAL 78 3HG2 VAL 78 -3.436 0.366 8.635 675 HG22 VAL 78 1HG2 VAL 78 -1.858 0.053 7.910 676 HG23 VAL 78 2HG2 VAL 78 -2.970 1.189 7.146 677 H LEU 79 H LEU 79 -1.809 4.572 7.651 678 HA LEU 79 HA LEU 79 -4.040 5.276 5.920 679 HB2 LEU 79 2HB LEU 79 -2.480 6.986 6.749 680 HB3 LEU 79 3HB LEU 79 -1.151 6.167 5.952 681 HG LEU 79 HG LEU 79 -2.103 6.691 3.764 682 HD11 LEU 79 1HD1 LEU 79 -4.302 8.057 5.322 683 HD12 LEU 79 2HD1 LEU 79 -4.471 6.632 4.296 684 HD13 LEU 79 3HD1 LEU 79 -4.054 8.189 3.581 685 HD21 LEU 79 3HD2 LEU 79 -1.921 9.087 5.597 686 HD22 LEU 79 1HD2 LEU 79 -1.801 9.126 3.838 687 HD23 LEU 79 2HD2 LEU 79 -0.574 8.285 4.784 688 H ILE 80 H ILE 80 -4.484 4.150 4.111 689 HA ILE 80 HA ILE 80 -2.393 2.377 3.007 690 HB ILE 80 HB ILE 80 -5.391 1.966 2.965 691 HG12 ILE 80 2HG1 ILE 80 -3.268 0.578 4.628 692 HG13 ILE 80 3HG1 ILE 80 -4.394 1.785 5.238 693 HG21 ILE 80 1HG2 ILE 80 -4.288 0.932 1.052 694 HG22 ILE 80 2HG2 ILE 80 -4.847 -0.302 2.182 695 HG23 ILE 80 3HG2 ILE 80 -3.137 0.134 2.122 696 HD11 ILE 80 3HD1 ILE 80 -6.260 0.294 4.736 697 HD12 ILE 80 1HD1 ILE 80 -5.095 -0.461 5.825 698 HD13 ILE 80 2HD1 ILE 80 -5.130 -0.913 4.120 699 H ILE 81 H ILE 81 -2.000 2.330 0.848 700 HA ILE 81 HA ILE 81 -3.715 3.927 -0.958 701 HB ILE 81 HB ILE 81 -0.742 3.426 -1.272 702 HG12 ILE 81 2HG1 ILE 81 -2.185 5.958 -0.426 703 HG13 ILE 81 3HG1 ILE 81 -1.211 4.938 0.627 704 HG21 ILE 81 1HG2 ILE 81 -0.889 5.097 -3.075 705 HG22 ILE 81 2HG2 ILE 81 -2.634 5.193 -2.836 706 HG23 ILE 81 3HG2 ILE 81 -1.902 3.691 -3.403 707 HD11 ILE 81 3HD1 ILE 81 0.764 5.455 -0.736 708 HD12 ILE 81 1HD1 ILE 81 0.026 6.897 -0.040 709 HD13 ILE 81 2HD1 ILE 81 -0.224 6.513 -1.744 710 H ILE 82 H ILE 82 -4.672 2.745 -2.552 711 HA ILE 82 HA ILE 82 -3.633 0.019 -3.051 712 HB ILE 82 HB ILE 82 -6.486 0.993 -3.357 713 HG12 ILE 82 2HG1 ILE 82 -5.245 -0.760 -1.209 714 HG13 ILE 82 3HG1 ILE 82 -5.772 0.906 -0.991 715 HG21 ILE 82 1HG2 ILE 82 -5.936 -0.827 -4.893 716 HG22 ILE 82 2HG2 ILE 82 -7.029 -1.390 -3.630 717 HG23 ILE 82 3HG2 ILE 82 -5.314 -1.790 -3.550 718 HD11 ILE 82 3HD1 ILE 82 -7.563 -1.411 -1.693 719 HD12 ILE 82 1HD1 ILE 82 -8.070 0.255 -1.414 720 HD13 ILE 82 2HD1 ILE 82 -7.379 -0.688 -0.095 721 H TYR 83 H TYR 83 -3.105 -0.569 -5.084 722 HA TYR 83 HA TYR 83 -3.872 1.220 -7.311 723 HB2 TYR 83 2HB TYR 83 -1.530 1.587 -6.821 724 HB3 TYR 83 3HB TYR 83 -1.208 -0.143 -6.846 725 HD1 TYR 83 HD2 TYR 83 -2.494 2.585 -9.066 726 HD2 TYR 83 HD1 TYR 83 -0.378 -1.101 -8.811 727 HE1 TYR 83 HE2 TYR 83 -1.952 2.738 -11.452 728 HE2 TYR 83 HE1 TYR 83 0.162 -0.954 -11.206 729 HH TYR 83 HH TYR 83 -0.754 0.161 -13.245 730 H ASP 84 H ASP 84 -5.221 0.188 -8.622 731 HA ASP 84 HA ASP 84 -4.413 -2.391 -9.729 732 HB2 ASP 84 2HB ASP 84 -5.984 -2.968 -7.911 733 HB3 ASP 84 3HB ASP 84 -7.201 -1.913 -8.623 734 H GLN 85 H GLN 85 -5.222 -2.782 -11.836 735 HA GLN 85 HA GLN 85 -5.852 -0.351 -13.302 736 HB2 GLN 85 2HB GLN 85 -5.321 -3.180 -14.241 737 HB3 GLN 85 3HB GLN 85 -5.582 -1.809 -15.312 738 HG2 GLN 85 2HG GLN 85 -3.340 -2.022 -13.304 739 HG3 GLN 85 3HG GLN 85 -3.201 -2.388 -15.023 740 HE21 GLN 85 1HE2 GLN 85 -3.622 0.144 -12.667 741 HE22 GLN 85 2HE2 GLN 85 -3.251 1.459 -13.722 742 H ASP 86 H ASP 86 -7.355 -3.514 -12.714 743 HA ASP 86 HA ASP 86 -9.759 -2.857 -14.151 744 HB2 ASP 86 2HB ASP 86 -9.183 -5.095 -12.194 745 HB3 ASP 86 3HB ASP 86 -10.618 -4.976 -13.203 746 H GLN 87 H GLN 87 -10.532 -0.951 -13.243 747 HA GLN 87 HA GLN 87 -10.732 -0.256 -10.585 748 HB2 GLN 87 2HB GLN 87 -12.638 0.495 -12.812 749 HB3 GLN 87 3HB GLN 87 -12.492 1.335 -11.272 750 HG2 GLN 87 2HG GLN 87 -10.141 1.863 -11.815 751 HG3 GLN 87 3HG GLN 87 -10.352 1.089 -13.386 752 HE21 GLN 87 1HE2 GLN 87 -11.135 3.842 -11.421 753 HE22 GLN 87 2HE2 GLN 87 -11.760 4.818 -12.697 754 H ASN 88 H ASN 88 -12.714 -2.531 -12.303 755 HA ASN 88 HA ASN 88 -15.043 -2.618 -10.821 756 HB2 ASN 88 2HB ASN 88 -14.570 -4.010 -12.828 757 HB3 ASN 88 3HB ASN 88 -13.508 -5.021 -11.855 758 HD21 ASN 88 1HD2 ASN 88 -14.422 -6.427 -10.342 759 HD22 ASN 88 2HD2 ASN 88 -16.101 -6.814 -10.347 760 H ARG 89 H ARG 89 -11.949 -4.277 -10.057 761 HA ARG 89 HA ARG 89 -12.992 -5.128 -7.471 762 HB2 ARG 89 2HB ARG 89 -10.133 -5.351 -8.434 763 HB3 ARG 89 3HB ARG 89 -10.871 -6.207 -7.093 764 HG2 ARG 89 2HG ARG 89 -10.907 -7.866 -8.645 765 HG3 ARG 89 3HG ARG 89 -12.462 -7.115 -9.014 766 HD2 ARG 89 2HD ARG 89 -11.094 -7.592 -11.029 767 HD3 ARG 89 3HD ARG 89 -11.490 -5.883 -10.844 768 HE ARG 89 HE ARG 89 -9.239 -5.468 -10.169 769 HH11 ARG 89 1HH1 ARG 89 -9.786 -8.658 -11.341 770 HH12 ARG 89 2HH1 ARG 89 -8.109 -8.963 -11.623 771 HH21 ARG 89 1HH2 ARG 89 -7.107 -5.835 -10.555 772 HH22 ARG 89 2HH2 ARG 89 -6.598 -7.361 -11.195 773 H LEU 90 H LEU 90 -10.688 -2.769 -8.746 774 HA LEU 90 HA LEU 90 -9.424 -1.884 -6.482 775 HB2 LEU 90 2HB LEU 90 -8.910 -1.078 -8.732 776 HB3 LEU 90 3HB LEU 90 -10.432 -0.210 -8.788 777 HG LEU 90 HG LEU 90 -9.648 1.248 -6.937 778 HD11 LEU 90 1HD1 LEU 90 -7.273 1.220 -6.310 779 HD12 LEU 90 2HD1 LEU 90 -7.042 -0.241 -7.274 780 HD13 LEU 90 3HD1 LEU 90 -8.093 -0.273 -5.856 781 HD21 LEU 90 3HD2 LEU 90 -8.023 2.524 -8.261 782 HD22 LEU 90 1HD2 LEU 90 -9.376 1.970 -9.246 783 HD23 LEU 90 2HD2 LEU 90 -7.821 1.143 -9.340 784 H GLU 91 H GLU 91 -12.454 -0.426 -7.752 785 HA GLU 91 HA GLU 91 -12.792 1.162 -5.383 786 HB2 GLU 91 2HB GLU 91 -14.603 0.702 -7.758 787 HB3 GLU 91 3HB GLU 91 -14.991 1.798 -6.437 788 HG2 GLU 91 2HG GLU 91 -12.886 3.040 -6.929 789 HG3 GLU 91 3HG GLU 91 -12.656 2.002 -8.335 790 H GLU 92 H GLU 92 -14.101 -1.917 -6.491 791 HA GLU 92 HA GLU 92 -16.170 -2.242 -4.620 792 HB2 GLU 92 2HB GLU 92 -15.846 -3.794 -6.476 793 HB3 GLU 92 3HB GLU 92 -14.300 -4.308 -5.816 794 HG2 GLU 92 2HG GLU 92 -15.808 -6.019 -5.284 795 HG3 GLU 92 3HG GLU 92 -15.580 -5.122 -3.787 796 H PHE 93 H PHE 93 -12.854 -3.530 -4.398 797 HA PHE 93 HA PHE 93 -12.936 -4.278 -1.696 798 HB2 PHE 93 2HB PHE 93 -11.264 -5.074 -3.352 799 HB3 PHE 93 3HB PHE 93 -10.532 -3.475 -3.363 800 HD1 PHE 93 HD1 PHE 93 -11.491 -6.130 -0.914 801 HD2 PHE 93 HD2 PHE 93 -8.653 -3.164 -2.057 802 HE1 PHE 93 HE1 PHE 93 -10.033 -6.814 0.944 803 HE2 PHE 93 HE2 PHE 93 -7.193 -3.841 -0.195 804 HZ PHE 93 HZ PHE 93 -7.882 -5.669 1.307 805 H SER 94 H SER 94 -12.049 -1.232 -3.255 806 HA SER 94 HA SER 94 -10.980 0.183 -1.113 807 HB2 SER 94 2HB SER 94 -11.003 1.120 -3.360 808 HB3 SER 94 3HB SER 94 -12.764 1.208 -3.341 809 HG SER 94 HG SER 94 -11.841 3.226 -2.852 810 H ARG 95 H ARG 95 -14.419 -0.113 -2.051 811 HA ARG 95 HA ARG 95 -15.532 1.486 -0.066 812 HB2 ARG 95 2HB ARG 95 -16.681 -1.001 -1.331 813 HB3 ARG 95 3HB ARG 95 -17.594 0.114 -0.322 814 HG2 ARG 95 2HG ARG 95 -16.631 1.865 -2.094 815 HG3 ARG 95 3HG ARG 95 -16.634 0.420 -3.107 816 HD2 ARG 95 2HD ARG 95 -18.983 1.593 -1.619 817 HD3 ARG 95 3HD ARG 95 -18.717 1.616 -3.357 818 HE ARG 95 HE ARG 95 -18.743 -1.043 -2.379 819 HH11 ARG 95 1HH1 ARG 95 -20.862 1.580 -3.145 820 HH12 ARG 95 2HH1 ARG 95 -22.216 0.532 -3.409 821 HH21 ARG 95 1HH2 ARG 95 -20.484 -2.345 -2.708 822 HH22 ARG 95 2HH2 ARG 95 -22.003 -1.656 -3.177 823 H GLU 96 H GLU 96 -14.636 -1.944 0.062 824 HA GLU 96 HA GLU 96 -15.618 -2.449 2.663 825 HB2 GLU 96 2HB GLU 96 -13.302 -3.820 1.276 826 HB3 GLU 96 3HB GLU 96 -14.208 -4.440 2.651 827 HG2 GLU 96 2HG GLU 96 -16.259 -4.304 1.109 828 HG3 GLU 96 3HG GLU 96 -15.093 -4.140 -0.203 829 H VAL 97 H VAL 97 -12.333 -1.582 1.547 830 HA VAL 97 HA VAL 97 -11.028 -1.560 3.999 831 HB VAL 97 HB VAL 97 -10.572 0.328 1.671 832 HG11 VAL 97 1HG1 VAL 97 -8.295 0.582 2.568 833 HG12 VAL 97 2HG1 VAL 97 -8.739 -0.400 3.966 834 HG13 VAL 97 3HG1 VAL 97 -9.510 1.165 3.707 835 HG21 VAL 97 3HG2 VAL 97 -10.423 -2.022 1.020 836 HG22 VAL 97 1HG2 VAL 97 -9.293 -2.333 2.340 837 HG23 VAL 97 2HG2 VAL 97 -8.826 -1.275 1.008 838 H ARG 98 H ARG 98 -12.809 1.125 2.462 839 HA ARG 98 HA ARG 98 -12.512 2.976 4.584 840 HB2 ARG 98 2HB ARG 98 -14.848 2.788 2.659 841 HB3 ARG 98 3HB ARG 98 -14.343 4.205 3.571 842 HG2 ARG 98 2HG ARG 98 -12.221 4.224 2.300 843 HG3 ARG 98 3HG ARG 98 -12.818 2.870 1.340 844 HD2 ARG 98 2HD ARG 98 -13.975 5.653 1.493 845 HD3 ARG 98 3HD ARG 98 -13.170 4.906 0.115 846 HE ARG 98 HE ARG 98 -15.662 3.743 1.138 847 HH11 ARG 98 1HH1 ARG 98 -13.934 5.308 -1.394 848 HH12 ARG 98 2HH1 ARG 98 -15.208 5.106 -2.541 849 HH21 ARG 98 1HH2 ARG 98 -17.291 3.487 -0.327 850 HH22 ARG 98 2HH2 ARG 98 -17.093 4.077 -1.944 851 H ARG 99 H ARG 99 -14.917 0.482 3.913 852 HA ARG 99 HA ARG 99 -16.753 1.088 5.962 853 HB2 ARG 99 2HB ARG 99 -17.241 -0.379 4.035 854 HB3 ARG 99 3HB ARG 99 -16.140 -1.586 4.677 855 HG2 ARG 99 2HG ARG 99 -18.425 -2.216 5.139 856 HG3 ARG 99 3HG ARG 99 -17.594 -1.843 6.650 857 HD2 ARG 99 2HD ARG 99 -18.646 0.327 6.747 858 HD3 ARG 99 3HD ARG 99 -19.376 0.086 5.159 859 HE ARG 99 HE ARG 99 -20.402 -1.963 6.499 860 HH11 ARG 99 1HH1 ARG 99 -20.062 1.335 7.424 861 HH12 ARG 99 2HH1 ARG 99 -21.478 1.316 8.415 862 HH21 ARG 99 1HH2 ARG 99 -22.224 -1.971 7.753 863 HH22 ARG 99 2HH2 ARG 99 -22.703 -0.535 8.583 864 H ARG 100 H ARG 100 -13.790 -0.830 5.985 865 HA ARG 100 HA ARG 100 -14.277 -1.930 8.619 866 HB2 ARG 100 2HB ARG 100 -11.696 -1.955 7.032 867 HB3 ARG 100 3HB ARG 100 -12.119 -3.002 8.383 868 HG2 ARG 100 2HG ARG 100 -13.958 -3.954 7.018 869 HG3 ARG 100 3HG ARG 100 -13.421 -2.954 5.670 870 HD2 ARG 100 2HD ARG 100 -12.513 -5.117 5.315 871 HD3 ARG 100 3HD ARG 100 -11.181 -4.093 5.846 872 HE ARG 100 HE ARG 100 -11.732 -5.137 8.143 873 HH11 ARG 100 1HH1 ARG 100 -12.032 -6.754 5.115 874 HH12 ARG 100 2HH1 ARG 100 -11.686 -8.309 5.780 875 HH21 ARG 100 1HH2 ARG 100 -11.296 -7.141 9.002 876 HH22 ARG 100 2HH2 ARG 100 -11.280 -8.528 7.975 877 H GLY 101 H GLY 101 -13.490 1.093 7.671 878 HA2 GLY 101 2HA GLY 101 -13.009 2.896 9.052 879 HA3 GLY 101 3HA GLY 101 -12.564 1.778 10.324 880 H PHE 102 H PHE 102 -11.160 1.796 7.067 881 HA PHE 102 HA PHE 102 -8.636 2.801 8.246 882 HB2 PHE 102 2HB PHE 102 -9.161 0.809 6.062 883 HB3 PHE 102 3HB PHE 102 -7.641 1.693 6.100 884 HD1 PHE 102 HD1 PHE 102 -6.365 1.651 8.364 885 HD2 PHE 102 HD2 PHE 102 -9.320 -1.201 7.225 886 HE1 PHE 102 HE1 PHE 102 -5.413 0.033 9.954 887 HE2 PHE 102 HE2 PHE 102 -8.368 -2.824 8.815 888 HZ PHE 102 HZ PHE 102 -6.408 -2.210 10.182 889 H GLU 103 H GLU 103 -7.647 4.551 7.412 890 HA GLU 103 HA GLU 103 -8.854 6.184 5.404 891 HB2 GLU 103 2HB GLU 103 -6.099 6.239 6.665 892 HB3 GLU 103 3HB GLU 103 -6.661 7.447 5.522 893 HG2 GLU 103 2HG GLU 103 -6.890 8.338 7.711 894 HG3 GLU 103 3HG GLU 103 -8.503 8.001 7.097 895 H VAL 104 H VAL 104 -8.582 6.110 3.193 896 HA VAL 104 HA VAL 104 -6.388 4.475 2.123 897 HB VAL 104 HB VAL 104 -8.304 2.964 2.384 898 HG11 VAL 104 1HG1 VAL 104 -10.113 4.591 2.206 899 HG12 VAL 104 2HG1 VAL 104 -10.345 3.268 1.064 900 HG13 VAL 104 3HG1 VAL 104 -9.750 4.829 0.496 901 HG21 VAL 104 3HG2 VAL 104 -7.706 3.602 -0.511 902 HG22 VAL 104 1HG2 VAL 104 -8.373 2.085 0.096 903 HG23 VAL 104 2HG2 VAL 104 -6.739 2.573 0.545 904 H ARG 105 H ARG 105 -5.717 4.919 0.060 905 HA ARG 105 HA ARG 105 -7.174 6.938 -1.522 906 HB2 ARG 105 2HB ARG 105 -4.332 6.930 -0.673 907 HB3 ARG 105 3HB ARG 105 -4.597 7.302 -2.370 908 HG2 ARG 105 2HG ARG 105 -5.859 8.757 -0.045 909 HG3 ARG 105 3HG ARG 105 -4.474 9.320 -0.984 910 HD2 ARG 105 2HD ARG 105 -7.281 8.851 -2.005 911 HD3 ARG 105 3HD ARG 105 -6.497 10.412 -1.766 912 HE ARG 105 HE ARG 105 -4.859 9.528 -3.529 913 HH11 ARG 105 1HH1 ARG 105 -8.227 8.777 -3.471 914 HH12 ARG 105 2HH1 ARG 105 -8.301 8.529 -5.185 915 HH21 ARG 105 1HH2 ARG 105 -4.977 9.199 -5.713 916 HH22 ARG 105 2HH2 ARG 105 -6.484 8.743 -6.427 917 H THR 106 H THR 106 -7.852 6.074 -3.383 918 HA THR 106 HA THR 106 -6.538 3.665 -4.423 919 HB THR 106 HB THR 106 -8.558 3.517 -5.922 920 HG1 THR 106 HG1 THR 106 -10.379 4.859 -4.992 921 HG21 THR 106 3HG2 THR 106 -9.094 3.598 -2.945 922 HG22 THR 106 1HG2 THR 106 -8.425 2.233 -3.843 923 HG23 THR 106 2HG2 THR 106 -10.079 2.763 -4.148 924 H VAL 107 H VAL 107 -5.200 3.766 -6.097 925 HA VAL 107 HA VAL 107 -5.365 6.079 -7.930 926 HB VAL 107 HB VAL 107 -2.908 5.940 -8.219 927 HG11 VAL 107 1HG1 VAL 107 -3.796 6.300 -5.351 928 HG12 VAL 107 2HG1 VAL 107 -3.842 7.526 -6.618 929 HG13 VAL 107 3HG1 VAL 107 -2.292 6.908 -6.048 930 HG21 VAL 107 3HG2 VAL 107 -2.590 3.580 -7.626 931 HG22 VAL 107 1HG2 VAL 107 -3.011 3.934 -5.953 932 HG23 VAL 107 2HG2 VAL 107 -1.549 4.621 -6.661 933 H THR 108 H THR 108 -5.454 5.663 -10.074 934 HA THR 108 HA THR 108 -5.315 2.855 -10.952 935 HB THR 108 HB THR 108 -6.490 3.533 -12.957 936 HG1 THR 108 HG1 THR 108 -6.087 5.503 -13.611 937 HG21 THR 108 3HG2 THR 108 -7.746 4.833 -10.529 938 HG22 THR 108 1HG2 THR 108 -7.888 3.133 -10.981 939 HG23 THR 108 2HG2 THR 108 -8.592 4.380 -12.010 940 H SER 109 H SER 109 -3.399 5.627 -10.954 941 HA SER 109 HA SER 109 -1.622 4.517 -13.004 942 HB2 SER 109 2HB SER 109 -1.366 6.659 -14.149 943 HB3 SER 109 3HB SER 109 -3.068 6.195 -14.160 944 HG SER 109 HG SER 109 -3.518 7.924 -13.053 945 HA PRO 110 HA PRO 110 1.669 5.681 -10.186 946 HB2 PRO 110 2HB PRO 110 3.113 6.505 -12.671 947 HB3 PRO 110 3HB PRO 110 3.636 5.426 -11.371 948 HG2 PRO 110 2HG PRO 110 2.871 4.427 -13.713 949 HG3 PRO 110 3HG PRO 110 2.414 3.623 -12.199 950 HD2 PRO 110 2HD PRO 110 0.760 5.358 -14.001 951 HD3 PRO 110 3HD PRO 110 0.299 3.885 -13.118 952 H ASP 111 H ASP 111 0.952 7.879 -12.898 953 HA ASP 111 HA ASP 111 1.979 10.241 -11.797 954 HB2 ASP 111 2HB ASP 111 -0.240 9.751 -13.787 955 HB3 ASP 111 3HB ASP 111 0.330 11.367 -13.369 956 H ASP 112 H ASP 112 -1.312 8.863 -11.540 957 HA ASP 112 HA ASP 112 -2.382 10.948 -9.955 958 HB2 ASP 112 2HB ASP 112 -3.727 9.182 -11.126 959 HB3 ASP 112 3HB ASP 112 -3.187 8.026 -9.912 960 H PHE 113 H PHE 113 -0.741 7.919 -9.123 961 HA PHE 113 HA PHE 113 -0.863 8.081 -6.330 962 HB2 PHE 113 2HB PHE 113 -0.110 6.053 -7.390 963 HB3 PHE 113 3HB PHE 113 1.242 6.886 -8.149 964 HD1 PHE 113 HD1 PHE 113 -0.115 5.751 -4.890 965 HD2 PHE 113 HD2 PHE 113 3.304 7.131 -7.026 966 HE1 PHE 113 HE1 PHE 113 1.318 5.165 -2.979 967 HE2 PHE 113 HE2 PHE 113 4.740 6.545 -5.118 968 HZ PHE 113 HZ PHE 113 3.746 5.559 -3.089 969 H LYS 114 H LYS 114 1.393 9.547 -8.611 970 HA LYS 114 HA LYS 114 3.384 10.514 -6.995 971 HB2 LYS 114 2HB LYS 114 3.401 10.765 -9.412 972 HB3 LYS 114 3HB LYS 114 2.047 11.880 -9.338 973 HG2 LYS 114 2HG LYS 114 3.458 13.489 -8.115 974 HG3 LYS 114 3HG LYS 114 4.819 12.373 -8.256 975 HD2 LYS 114 2HD LYS 114 4.891 14.142 -9.973 976 HD3 LYS 114 3HD LYS 114 4.734 12.537 -10.688 977 HE2 LYS 114 2HE LYS 114 2.349 12.890 -11.024 978 HE3 LYS 114 3HE LYS 114 2.443 14.454 -10.215 979 HZ1 LYS 114 3HZ LYS 114 3.797 13.735 -12.757 980 HZ2 LYS 114 1HZ LYS 114 3.902 15.230 -11.975 981 HZ3 LYS 114 2HZ LYS 114 2.424 14.711 -12.606 982 H LYS 115 H LYS 115 0.340 12.267 -7.739 983 HA LYS 115 HA LYS 115 0.864 14.292 -5.763 984 HB2 LYS 115 2HB LYS 115 -1.717 13.641 -7.211 985 HB3 LYS 115 3HB LYS 115 -1.461 15.049 -6.195 986 HG2 LYS 115 2HG LYS 115 -1.132 15.962 -8.267 987 HG3 LYS 115 3HG LYS 115 0.521 15.516 -7.849 988 HD2 LYS 115 2HD LYS 115 0.001 14.874 -10.147 989 HD3 LYS 115 3HD LYS 115 0.294 13.448 -9.148 990 HE2 LYS 115 2HE LYS 115 -1.637 13.151 -10.650 991 HE3 LYS 115 3HE LYS 115 -2.098 13.059 -8.952 992 HZ1 LYS 115 3HZ LYS 115 -2.809 15.409 -9.122 993 HZ2 LYS 115 1HZ LYS 115 -3.693 14.371 -10.120 994 HZ3 LYS 115 2HZ LYS 115 -2.498 15.362 -10.782 995 H SER 116 H SER 116 -1.204 11.401 -5.887 996 HA SER 116 HA SER 116 -2.604 11.689 -3.516 997 HB2 SER 116 2HB SER 116 -1.514 9.160 -4.779 998 HB3 SER 116 3HB SER 116 -2.668 9.170 -3.447 999 HG SER 116 HG SER 116 -3.028 9.841 -6.139 1000 H LEU 117 H LEU 117 0.704 10.543 -3.980 1001 HA LEU 117 HA LEU 117 1.119 9.717 -1.291 1002 HB2 LEU 117 2HB LEU 117 2.464 8.908 -3.206 1003 HB3 LEU 117 3HB LEU 117 3.162 10.508 -3.374 1004 HG LEU 117 HG LEU 117 4.158 10.291 -1.108 1005 HD11 LEU 117 1HD1 LEU 117 3.077 7.472 -1.236 1006 HD12 LEU 117 2HD1 LEU 117 2.580 8.739 -0.112 1007 HD13 LEU 117 3HD1 LEU 117 4.212 8.080 -0.030 1008 HD21 LEU 117 3HD2 LEU 117 5.903 8.692 -1.721 1009 HD22 LEU 117 1HD2 LEU 117 5.474 9.723 -3.087 1010 HD23 LEU 117 2HD2 LEU 117 4.883 8.062 -3.015 1011 H GLU 118 H GLU 118 2.206 12.662 -3.060 1012 HA GLU 118 HA GLU 118 3.472 13.842 -0.852 1013 HB2 GLU 118 2HB GLU 118 3.513 15.905 -2.118 1014 HB3 GLU 118 3HB GLU 118 3.857 14.555 -3.182 1015 HG2 GLU 118 2HG GLU 118 2.471 15.862 -4.472 1016 HG3 GLU 118 3HG GLU 118 1.348 14.690 -3.791 1017 H ARG 119 H ARG 119 0.102 14.029 -1.910 1018 HA ARG 119 HA ARG 119 -0.860 15.914 -0.082 1019 HB2 ARG 119 2HB ARG 119 -2.184 13.445 -1.230 1020 HB3 ARG 119 3HB ARG 119 -3.043 14.633 -0.256 1021 HG2 ARG 119 2HG ARG 119 -2.531 16.362 -1.908 1022 HG3 ARG 119 3HG ARG 119 -1.663 15.176 -2.882 1023 HD2 ARG 119 2HD ARG 119 -3.685 13.939 -3.284 1024 HD3 ARG 119 3HD ARG 119 -4.582 14.948 -2.146 1025 HE ARG 119 HE ARG 119 -3.407 16.444 -4.294 1026 HH11 ARG 119 1HH1 ARG 119 -6.133 14.515 -3.415 1027 HH12 ARG 119 2HH1 ARG 119 -7.185 15.320 -4.526 1028 HH21 ARG 119 1HH2 ARG 119 -4.773 17.444 -5.723 1029 HH22 ARG 119 2HH2 ARG 119 -6.423 16.936 -5.824 1030 H LEU 120 H LEU 120 -0.635 12.383 0.270 1031 HA LEU 120 HA LEU 120 -1.651 12.288 2.903 1032 HB2 LEU 120 2HB LEU 120 0.075 10.321 1.396 1033 HB3 LEU 120 3HB LEU 120 -0.729 9.978 2.918 1034 HG LEU 120 HG LEU 120 -2.080 10.613 0.287 1035 HD11 LEU 120 1HD1 LEU 120 -1.977 8.065 1.893 1036 HD12 LEU 120 2HD1 LEU 120 -1.142 8.373 0.370 1037 HD13 LEU 120 3HD1 LEU 120 -2.903 8.321 0.414 1038 HD21 LEU 120 3HD2 LEU 120 -4.187 10.150 1.463 1039 HD22 LEU 120 1HD2 LEU 120 -3.359 11.560 2.125 1040 HD23 LEU 120 2HD2 LEU 120 -3.304 10.021 2.984 1041 H ILE 121 H ILE 121 1.677 12.525 1.676 1042 HA ILE 121 HA ILE 121 3.044 12.237 4.108 1043 HB ILE 121 HB ILE 121 3.758 13.984 1.735 1044 HG12 ILE 121 2HG1 ILE 121 4.649 11.187 2.516 1045 HG13 ILE 121 3HG1 ILE 121 3.556 11.589 1.196 1046 HG21 ILE 121 1HG2 ILE 121 5.504 13.099 4.042 1047 HG22 ILE 121 2HG2 ILE 121 4.953 14.743 3.724 1048 HG23 ILE 121 3HG2 ILE 121 6.060 13.953 2.603 1049 HD11 ILE 121 3HD1 ILE 121 5.768 11.099 0.359 1050 HD12 ILE 121 1HD1 ILE 121 6.460 12.352 1.389 1051 HD13 ILE 121 2HD1 ILE 121 5.367 12.793 0.076 1052 H ARG 122 H ARG 122 1.507 15.096 2.665 1053 HA ARG 122 HA ARG 122 2.227 16.869 4.787 1054 HB2 ARG 122 2HB ARG 122 0.174 17.029 2.579 1055 HB3 ARG 122 3HB ARG 122 0.338 18.294 3.789 1056 HG2 ARG 122 2HG ARG 122 2.688 18.608 3.124 1057 HG3 ARG 122 3HG ARG 122 2.487 17.375 1.880 1058 HD2 ARG 122 2HD ARG 122 0.749 19.832 1.994 1059 HD3 ARG 122 3HD ARG 122 2.303 19.823 1.166 1060 HE ARG 122 HE ARG 122 1.366 18.005 -0.245 1061 HH11 ARG 122 1HH1 ARG 122 -0.801 20.139 1.405 1062 HH12 ARG 122 2HH1 ARG 122 -2.039 19.954 0.214 1063 HH21 ARG 122 1HH2 ARG 122 -0.202 17.831 -1.772 1064 HH22 ARG 122 2HH2 ARG 122 -1.697 18.683 -1.579 1065 H GLU 123 H GLU 123 -0.375 14.579 4.357 1066 HA GLU 123 HA GLU 123 -2.105 15.639 6.372 1067 HB2 GLU 123 2HB GLU 123 -1.950 12.830 5.247 1068 HB3 GLU 123 3HB GLU 123 -3.260 13.457 6.236 1069 HG2 GLU 123 2HG GLU 123 -2.483 14.478 3.509 1070 HG3 GLU 123 3HG GLU 123 -3.829 13.397 3.857 1071 H VAL 124 H VAL 124 0.124 12.830 6.390 1072 HA VAL 124 HA VAL 124 -0.208 12.551 9.272 1073 HB VAL 124 HB VAL 124 -0.183 10.521 7.931 1074 HG11 VAL 124 1HG1 VAL 124 2.653 11.244 7.186 1075 HG12 VAL 124 2HG1 VAL 124 1.263 11.250 6.103 1076 HG13 VAL 124 3HG1 VAL 124 1.834 9.730 6.793 1077 HG21 VAL 124 3HG2 VAL 124 2.261 10.722 9.696 1078 HG22 VAL 124 1HG2 VAL 124 1.462 9.228 9.204 1079 HG23 VAL 124 2HG2 VAL 124 0.617 10.383 10.234 1080 H GLY 125 H GLY 125 2.428 13.385 7.017 1081 HA2 GLY 125 2HA GLY 125 4.365 13.647 9.150 1082 HA3 GLY 125 3HA GLY 125 4.622 14.012 7.453 1083 H SER 126 H SER 126 2.856 15.943 6.876 1084 HA SER 126 HA SER 126 2.546 18.202 6.932 1085 HB2 SER 126 2HB SER 126 1.163 17.606 8.893 1086 HB3 SER 126 3HB SER 126 2.569 17.799 9.939 1087 HG SER 126 HG SER 126 2.618 19.995 9.403 1088 H LEU 127 H LEU 127 5.318 17.182 6.952 1089 HA LEU 127 HA LEU 127 6.890 18.898 8.619 1090 HB2 LEU 127 2HB LEU 127 8.812 18.020 7.257 1091 HB3 LEU 127 3HB LEU 127 7.848 16.816 8.083 1092 HG LEU 127 HG LEU 127 6.648 16.446 5.853 1093 HD11 LEU 127 1HD1 LEU 127 7.919 17.017 3.833 1094 HD12 LEU 127 2HD1 LEU 127 9.037 17.967 4.811 1095 HD13 LEU 127 3HD1 LEU 127 7.346 18.452 4.683 1096 HD21 LEU 127 3HD2 LEU 127 9.578 15.750 6.046 1097 HD22 LEU 127 1HD2 LEU 127 8.374 14.929 5.051 1098 HD23 LEU 127 2HD2 LEU 127 8.253 14.869 6.808 1099 H GLU 128 H GLU 128 5.103 19.684 5.989 1100 HA GLU 128 HA GLU 128 6.974 21.404 4.626 1101 HB2 GLU 128 2HB GLU 128 4.007 20.940 4.345 1102 HB3 GLU 128 3HB GLU 128 4.856 22.166 3.412 1103 HG2 GLU 128 2HG GLU 128 5.531 19.226 3.397 1104 HG3 GLU 128 3HG GLU 128 4.529 20.037 2.194 1105 H HIS 129 H HIS 129 7.648 23.218 5.545 1106 HA HIS 129 HA HIS 129 5.642 25.060 6.699 1107 HB2 HIS 129 2HB HIS 129 8.500 24.678 7.661 1108 HB3 HIS 129 3HB HIS 129 7.372 25.884 8.271 1109 HD1 HIS 129 HD1 HIS 129 5.873 25.173 10.160 1110 HD2 HIS 129 HD2 HIS 129 7.744 21.953 8.317 1111 HE1 HIS 129 HE1 HIS 129 5.316 23.175 11.570 1112 HE2 HIS 129 HE2 HIS 129 6.570 21.268 10.514 1113 H HIS 130 H HIS 130 9.041 25.069 5.645 1114 HA HIS 130 HA HIS 130 8.644 26.751 3.399 1115 HB2 HIS 130 2HB HIS 130 9.046 28.096 5.943 1116 HB3 HIS 130 3HB HIS 130 10.378 28.447 4.854 1117 HD1 HIS 130 HD1 HIS 130 9.500 30.928 4.830 1118 HD2 HIS 130 HD2 HIS 130 6.926 28.141 3.132 1119 HE1 HIS 130 HE1 HIS 130 7.825 32.264 3.526 1120 HE2 HIS 130 HE2 HIS 130 6.384 30.555 2.383 1121 H HIS 131 H HIS 131 10.040 25.687 2.121 1122 HA HIS 131 HA HIS 131 11.960 24.861 1.231 1123 HB2 HIS 131 2HB HIS 131 13.263 26.260 3.573 1124 HB3 HIS 131 3HB HIS 131 14.178 25.384 2.351 1125 HD1 HIS 131 HD1 HIS 131 14.725 26.617 0.248 1126 HD2 HIS 131 HD2 HIS 131 11.868 28.580 2.535 1127 HE1 HIS 131 HE1 HIS 131 14.409 28.847 -0.849 1128 HE2 HIS 131 HE2 HIS 131 12.808 30.079 0.645 1129 H HIS 132 H HIS 132 11.338 24.188 4.605 1130 HA HIS 132 HA HIS 132 13.135 22.055 4.971 1131 HB2 HIS 132 2HB HIS 132 12.181 23.222 6.859 1132 HB3 HIS 132 3HB HIS 132 10.554 22.741 6.388 1133 HD1 HIS 132 HD1 HIS 132 9.882 20.261 6.809 1134 HD2 HIS 132 HD2 HIS 132 13.621 21.305 8.299 1135 HE1 HIS 132 HE1 HIS 132 10.509 18.426 8.402 1136 HE2 HIS 132 HE2 HIS 132 12.825 19.006 9.184 1137 H HIS 133 H HIS 133 13.088 20.430 3.504 1138 HA HIS 133 HA HIS 133 10.611 18.820 3.355 1139 HB2 HIS 133 2HB HIS 133 12.695 19.405 1.270 1140 HB3 HIS 133 3HB HIS 133 11.794 17.895 1.200 1141 HD1 HIS 133 HD1 HIS 133 9.782 18.019 -0.195 1142 HD2 HIS 133 HD2 HIS 133 10.725 21.723 1.421 1143 HE1 HIS 133 HE1 HIS 133 8.090 19.605 -1.134 1144 HE2 HIS 133 HE2 HIS 133 8.496 21.743 0.111 1145 H HIS 134 H HIS 134 11.165 16.444 2.783 1146 HA HIS 134 HA HIS 134 12.882 15.481 4.906 1147 HB2 HIS 134 2HB HIS 134 10.670 14.484 4.571 1148 HB3 HIS 134 3HB HIS 134 11.123 13.988 2.944 1149 HD1 HIS 134 HD1 HIS 134 12.469 11.863 2.696 1150 HD2 HIS 134 HD2 HIS 134 11.904 12.960 6.662 1151 HE1 HIS 134 HE1 HIS 134 13.221 9.891 4.054 1152 HE2 HIS 134 HE2 HIS 134 13.055 10.650 6.436 Start of MODEL 5 1 H1 MET 1 1H MET 1 5.592 5.755 7.762 2 H2 MET 1 2H MET 1 6.219 4.302 7.159 3 H3 MET 1 3H MET 1 7.169 5.287 8.151 4 HA MET 1 HA MET 1 6.308 3.339 9.317 5 HB2 MET 1 2HB MET 1 6.864 5.440 10.510 6 HB3 MET 1 3HB MET 1 5.204 5.977 10.315 7 HG2 MET 1 2HG MET 1 5.597 5.112 12.553 8 HG3 MET 1 3HG MET 1 4.424 4.118 11.686 9 HE1 MET 1 3HE MET 1 5.968 3.212 14.366 10 HE2 MET 1 1HE MET 1 6.342 1.537 13.957 11 HE3 MET 1 2HE MET 1 4.767 2.215 13.543 12 H ASN 2 H ASN 2 3.517 5.533 9.654 13 HA ASN 2 HA ASN 2 1.754 3.233 9.508 14 HB2 ASN 2 2HB ASN 2 1.131 6.157 10.001 15 HB3 ASN 2 3HB ASN 2 -0.030 4.840 10.133 16 HD21 ASN 2 1HD2 ASN 2 0.196 3.350 11.842 17 HD22 ASN 2 2HD2 ASN 2 1.117 3.738 13.250 18 H ILE 3 H ILE 3 2.621 3.141 7.098 19 HA ILE 3 HA ILE 3 0.373 3.968 5.464 20 HB ILE 3 HB ILE 3 1.771 5.919 5.217 21 HG12 ILE 3 2HG1 ILE 3 2.037 4.191 2.737 22 HG13 ILE 3 3HG1 ILE 3 0.574 5.050 3.210 23 HG21 ILE 3 1HG2 ILE 3 3.908 4.944 5.877 24 HG22 ILE 3 2HG2 ILE 3 4.055 5.819 4.353 25 HG23 ILE 3 3HG2 ILE 3 3.985 4.056 4.356 26 HD11 ILE 3 3HD1 ILE 3 1.811 6.232 1.477 27 HD12 ILE 3 1HD1 ILE 3 3.214 6.334 2.540 28 HD13 ILE 3 2HD1 ILE 3 1.723 7.175 2.964 29 H VAL 4 H VAL 4 -0.150 2.410 4.067 30 HA VAL 4 HA VAL 4 1.903 0.479 3.187 31 HB VAL 4 HB VAL 4 -0.874 -0.246 4.178 32 HG11 VAL 4 1HG1 VAL 4 -0.195 -2.583 3.764 33 HG12 VAL 4 2HG1 VAL 4 1.293 -2.005 3.015 34 HG13 VAL 4 3HG1 VAL 4 -0.266 -1.634 2.279 35 HG21 VAL 4 3HG2 VAL 4 0.308 -1.511 5.924 36 HG22 VAL 4 1HG2 VAL 4 0.686 0.211 6.007 37 HG23 VAL 4 2HG2 VAL 4 1.851 -0.915 5.311 38 H ILE 5 H ILE 5 1.925 0.253 1.022 39 HA ILE 5 HA ILE 5 -0.386 1.269 -0.512 40 HB ILE 5 HB ILE 5 2.479 0.880 -1.414 41 HG12 ILE 5 2HG1 ILE 5 0.984 3.432 -0.727 42 HG13 ILE 5 3HG1 ILE 5 2.179 2.658 0.308 43 HG21 ILE 5 1HG2 ILE 5 0.884 0.696 -3.261 44 HG22 ILE 5 2HG2 ILE 5 1.822 2.184 -3.385 45 HG23 ILE 5 3HG2 ILE 5 0.160 2.238 -2.800 46 HD11 ILE 5 3HD1 ILE 5 3.900 3.055 -1.361 47 HD12 ILE 5 1HD1 ILE 5 3.107 4.557 -0.893 48 HD13 ILE 5 2HD1 ILE 5 2.705 3.793 -2.430 49 H VAL 6 H VAL 6 -1.593 -0.098 -1.674 50 HA VAL 6 HA VAL 6 -0.695 -2.891 -1.969 51 HB VAL 6 HB VAL 6 -3.503 -1.761 -2.111 52 HG11 VAL 6 1HG1 VAL 6 -4.230 -4.112 -2.008 53 HG12 VAL 6 2HG1 VAL 6 -2.547 -4.628 -2.108 54 HG13 VAL 6 3HG1 VAL 6 -3.289 -3.775 -3.461 55 HG21 VAL 6 3HG2 VAL 6 -2.556 -1.610 0.145 56 HG22 VAL 6 1HG2 VAL 6 -2.158 -3.329 0.098 57 HG23 VAL 6 2HG2 VAL 6 -3.845 -2.812 0.072 58 H VAL 7 H VAL 7 -0.075 -3.550 -3.941 59 HA VAL 7 HA VAL 7 -1.067 -2.085 -6.319 60 HB VAL 7 HB VAL 7 1.531 -3.610 -5.987 61 HG11 VAL 7 1HG1 VAL 7 0.544 -1.982 -8.337 62 HG12 VAL 7 2HG1 VAL 7 0.685 -3.739 -8.282 63 HG13 VAL 7 3HG1 VAL 7 2.133 -2.736 -8.190 64 HG21 VAL 7 3HG2 VAL 7 1.053 -0.634 -6.223 65 HG22 VAL 7 1HG2 VAL 7 2.622 -1.432 -6.111 66 HG23 VAL 7 2HG2 VAL 7 1.504 -1.492 -4.748 67 H PHE 8 H PHE 8 -2.609 -3.243 -7.377 68 HA PHE 8 HA PHE 8 -2.695 -6.134 -7.313 69 HB2 PHE 8 2HB PHE 8 -4.359 -4.029 -8.696 70 HB3 PHE 8 3HB PHE 8 -4.582 -5.742 -9.037 71 HD1 PHE 8 HD2 PHE 8 -4.665 -3.223 -6.301 72 HD2 PHE 8 HD1 PHE 8 -5.870 -7.096 -7.616 73 HE1 PHE 8 HE2 PHE 8 -6.151 -3.428 -4.349 74 HE2 PHE 8 HE1 PHE 8 -7.351 -7.300 -5.663 75 HZ PHE 8 HZ PHE 8 -7.494 -5.465 -4.028 76 H SER 9 H SER 9 -0.299 -5.757 -8.234 77 HA SER 9 HA SER 9 -0.340 -6.930 -10.846 78 HB2 SER 9 2HB SER 9 -0.495 -4.620 -11.594 79 HB3 SER 9 3HB SER 9 0.857 -4.155 -10.561 80 HG SER 9 HG SER 9 0.861 -5.608 -12.965 81 H THR 10 H THR 10 1.029 -8.549 -10.512 82 HA THR 10 HA THR 10 3.202 -8.415 -8.649 83 HB THR 10 HB THR 10 3.797 -10.689 -9.501 84 HG1 THR 10 HG1 THR 10 3.145 -10.689 -11.613 85 HG21 THR 10 3HG2 THR 10 1.761 -11.805 -8.700 86 HG22 THR 10 1HG2 THR 10 0.871 -10.290 -8.844 87 HG23 THR 10 2HG2 THR 10 2.181 -10.434 -7.672 88 H ASP 11 H ASP 11 2.976 -7.152 -11.703 89 HA ASP 11 HA ASP 11 5.520 -7.869 -12.784 90 HB2 ASP 11 2HB ASP 11 3.674 -5.565 -13.456 91 HB3 ASP 11 3HB ASP 11 5.090 -6.030 -14.398 92 H GLU 12 H GLU 12 7.402 -7.273 -11.953 93 HA GLU 12 HA GLU 12 7.675 -5.343 -9.920 94 HB2 GLU 12 2HB GLU 12 9.188 -7.305 -10.264 95 HB3 GLU 12 3HB GLU 12 9.892 -6.468 -11.642 96 HG2 GLU 12 2HG GLU 12 10.528 -4.607 -10.106 97 HG3 GLU 12 3HG GLU 12 9.966 -5.593 -8.757 98 H GLU 13 H GLU 13 8.070 -5.088 -13.414 99 HA GLU 13 HA GLU 13 9.452 -2.616 -13.452 100 HB2 GLU 13 2HB GLU 13 7.559 -3.773 -15.509 101 HB3 GLU 13 3HB GLU 13 8.631 -2.402 -15.776 102 HG2 GLU 13 2HG GLU 13 10.561 -3.887 -15.287 103 HG3 GLU 13 3HG GLU 13 9.439 -5.243 -15.189 104 H THR 14 H THR 14 5.953 -3.309 -13.714 105 HA THR 14 HA THR 14 5.032 -0.651 -13.642 106 HB THR 14 HB THR 14 3.669 -3.076 -12.410 107 HG1 THR 14 HG1 THR 14 2.854 -3.483 -14.427 108 HG21 THR 14 3HG2 THR 14 1.582 -1.848 -12.892 109 HG22 THR 14 1HG2 THR 14 2.533 -0.469 -13.451 110 HG23 THR 14 2HG2 THR 14 2.611 -0.969 -11.760 111 H LEU 15 H LEU 15 5.711 -2.938 -11.030 112 HA LEU 15 HA LEU 15 5.117 -1.291 -8.833 113 HB2 LEU 15 2HB LEU 15 5.418 -3.710 -8.684 114 HB3 LEU 15 3HB LEU 15 7.107 -3.548 -9.119 115 HG LEU 15 HG LEU 15 7.510 -2.313 -7.004 116 HD11 LEU 15 1HD1 LEU 15 5.293 -1.401 -6.625 117 HD12 LEU 15 2HD1 LEU 15 5.784 -2.380 -5.245 118 HD13 LEU 15 3HD1 LEU 15 4.632 -3.022 -6.416 119 HD21 LEU 15 3HD2 LEU 15 7.348 -4.271 -5.543 120 HD22 LEU 15 1HD2 LEU 15 7.927 -4.714 -7.147 121 HD23 LEU 15 2HD2 LEU 15 6.255 -5.043 -6.689 122 H ARG 16 H ARG 16 7.949 -1.474 -10.886 123 HA ARG 16 HA ARG 16 9.841 -0.164 -9.290 124 HB2 ARG 16 2HB ARG 16 10.421 -1.347 -11.352 125 HB3 ARG 16 3HB ARG 16 9.534 -0.167 -12.303 126 HG2 ARG 16 2HG ARG 16 11.897 0.259 -12.473 127 HG3 ARG 16 3HG ARG 16 11.124 1.576 -11.593 128 HD2 ARG 16 2HD ARG 16 11.903 0.673 -9.482 129 HD3 ARG 16 3HD ARG 16 12.581 -0.735 -10.302 130 HE ARG 16 HE ARG 16 13.792 1.394 -11.497 131 HH11 ARG 16 1HH1 ARG 16 13.545 0.292 -8.234 132 HH12 ARG 16 2HH1 ARG 16 15.065 0.970 -7.783 133 HH21 ARG 16 1HH2 ARG 16 15.738 2.234 -10.903 134 HH22 ARG 16 2HH2 ARG 16 16.291 2.051 -9.277 135 H LYS 17 H LYS 17 7.274 1.120 -11.339 136 HA LYS 17 HA LYS 17 7.997 3.830 -11.369 137 HB2 LYS 17 2HB LYS 17 5.336 2.422 -11.528 138 HB3 LYS 17 3HB LYS 17 5.417 4.174 -11.522 139 HG2 LYS 17 2HG LYS 17 5.244 3.348 -13.785 140 HG3 LYS 17 3HG LYS 17 6.809 4.124 -13.540 141 HD2 LYS 17 2HD LYS 17 7.870 1.941 -13.290 142 HD3 LYS 17 3HD LYS 17 6.306 1.142 -13.459 143 HE2 LYS 17 2HE LYS 17 7.554 1.047 -15.544 144 HE3 LYS 17 3HE LYS 17 6.102 2.029 -15.734 145 HZ1 LYS 17 3HZ LYS 17 7.472 4.016 -15.494 146 HZ2 LYS 17 1HZ LYS 17 7.996 3.063 -16.789 147 HZ3 LYS 17 2HZ LYS 17 8.858 3.062 -15.337 148 H PHE 18 H PHE 18 6.037 2.028 -9.015 149 HA PHE 18 HA PHE 18 5.460 4.203 -7.303 150 HB2 PHE 18 2HB PHE 18 5.671 1.255 -6.616 151 HB3 PHE 18 3HB PHE 18 4.878 2.486 -5.636 152 HD1 PHE 18 HD1 PHE 18 4.656 0.448 -8.673 153 HD2 PHE 18 HD2 PHE 18 2.720 3.386 -6.273 154 HE1 PHE 18 HE1 PHE 18 2.562 0.072 -9.905 155 HE2 PHE 18 HE2 PHE 18 0.624 3.007 -7.499 156 HZ PHE 18 HZ PHE 18 0.548 1.353 -9.319 157 H LYS 19 H LYS 19 8.029 1.742 -7.198 158 HA LYS 19 HA LYS 19 9.239 2.581 -4.810 159 HB2 LYS 19 2HB LYS 19 10.447 1.168 -7.200 160 HB3 LYS 19 3HB LYS 19 11.256 1.356 -5.649 161 HG2 LYS 19 2HG LYS 19 9.366 0.120 -4.583 162 HG3 LYS 19 3HG LYS 19 8.713 -0.174 -6.195 163 HD2 LYS 19 2HD LYS 19 11.471 -1.029 -5.300 164 HD3 LYS 19 3HD LYS 19 10.050 -2.070 -5.246 165 HE2 LYS 19 2HE LYS 19 9.803 -1.870 -7.674 166 HE3 LYS 19 3HE LYS 19 11.208 -0.805 -7.734 167 HZ1 LYS 19 3HZ LYS 19 11.243 -3.628 -6.806 168 HZ2 LYS 19 1HZ LYS 19 12.581 -2.601 -6.930 169 HZ3 LYS 19 2HZ LYS 19 11.767 -3.091 -8.326 170 H ASP 20 H ASP 20 9.798 3.641 -8.155 171 HA ASP 20 HA ASP 20 12.061 5.247 -7.641 172 HB2 ASP 20 2HB ASP 20 11.367 4.555 -9.916 173 HB3 ASP 20 3HB ASP 20 9.965 5.615 -9.799 174 H ILE 21 H ILE 21 8.590 6.053 -7.711 175 HA ILE 21 HA ILE 21 8.861 8.818 -7.250 176 HB ILE 21 HB ILE 21 6.555 6.974 -6.588 177 HG12 ILE 21 2HG1 ILE 21 7.009 8.849 -8.934 178 HG13 ILE 21 3HG1 ILE 21 7.172 7.098 -8.991 179 HG21 ILE 21 1HG2 ILE 21 6.375 8.978 -5.233 180 HG22 ILE 21 2HG2 ILE 21 5.169 9.019 -6.519 181 HG23 ILE 21 3HG2 ILE 21 6.632 9.996 -6.652 182 HD11 ILE 21 3HD1 ILE 21 4.637 8.635 -8.467 183 HD12 ILE 21 1HD1 ILE 21 4.786 6.876 -8.469 184 HD13 ILE 21 2HD1 ILE 21 5.072 7.788 -9.951 185 H ILE 22 H ILE 22 8.254 6.172 -4.913 186 HA ILE 22 HA ILE 22 8.106 7.799 -2.618 187 HB ILE 22 HB ILE 22 9.045 4.925 -2.777 188 HG12 ILE 22 2HG1 ILE 22 6.255 6.027 -2.295 189 HG13 ILE 22 3HG1 ILE 22 6.806 5.296 -3.800 190 HG21 ILE 22 1HG2 ILE 22 9.613 5.971 -0.648 191 HG22 ILE 22 2HG2 ILE 22 8.325 4.785 -0.428 192 HG23 ILE 22 3HG2 ILE 22 7.945 6.509 -0.449 193 HD11 ILE 22 3HD1 ILE 22 5.495 3.734 -2.507 194 HD12 ILE 22 1HD1 ILE 22 6.585 3.919 -1.134 195 HD13 ILE 22 2HD1 ILE 22 7.165 3.180 -2.626 196 H LYS 23 H LYS 23 10.902 6.049 -4.010 197 HA LYS 23 HA LYS 23 12.814 7.008 -2.157 198 HB2 LYS 23 2HB LYS 23 13.171 6.129 -5.032 199 HB3 LYS 23 3HB LYS 23 14.495 6.433 -3.914 200 HG2 LYS 23 2HG LYS 23 13.736 4.629 -2.474 201 HG3 LYS 23 3HG LYS 23 12.343 4.356 -3.521 202 HD2 LYS 23 2HD LYS 23 13.897 2.690 -4.115 203 HD3 LYS 23 3HD LYS 23 14.019 3.902 -5.387 204 HE2 LYS 23 2HE LYS 23 15.898 3.671 -3.027 205 HE3 LYS 23 3HE LYS 23 16.220 3.033 -4.636 206 HZ1 LYS 23 3HZ LYS 23 15.973 5.371 -5.451 207 HZ2 LYS 23 1HZ LYS 23 17.317 5.098 -4.461 208 HZ3 LYS 23 2HZ LYS 23 15.955 5.872 -3.837 209 H LYS 24 H LYS 24 11.506 8.350 -5.128 210 HA LYS 24 HA LYS 24 13.259 10.527 -5.470 211 HB2 LYS 24 2HB LYS 24 11.553 9.653 -7.116 212 HB3 LYS 24 3HB LYS 24 10.312 10.445 -6.157 213 HG2 LYS 24 2HG LYS 24 11.455 12.616 -6.576 214 HG3 LYS 24 3HG LYS 24 12.569 11.770 -7.652 215 HD2 LYS 24 2HD LYS 24 9.580 12.089 -7.974 216 HD3 LYS 24 3HD LYS 24 10.849 12.760 -8.999 217 HE2 LYS 24 2HE LYS 24 10.224 9.820 -8.660 218 HE3 LYS 24 3HE LYS 24 9.760 10.817 -10.036 219 HZ1 LYS 24 3HZ LYS 24 11.755 9.466 -10.434 220 HZ2 LYS 24 1HZ LYS 24 12.566 10.302 -9.211 221 HZ3 LYS 24 2HZ LYS 24 12.057 11.124 -10.595 222 H ASN 25 H ASN 25 10.284 10.171 -3.578 223 HA ASN 25 HA ASN 25 10.189 12.852 -2.623 224 HB2 ASN 25 2HB ASN 25 8.985 10.305 -1.513 225 HB3 ASN 25 3HB ASN 25 8.633 11.916 -0.892 226 HD21 ASN 25 1HD2 ASN 25 8.669 13.159 -3.535 227 HD22 ASN 25 2HD2 ASN 25 7.196 12.679 -4.288 228 H GLY 26 H GLY 26 11.669 9.891 -1.392 229 HA2 GLY 26 2HA GLY 26 13.863 10.248 -0.301 230 HA3 GLY 26 3HA GLY 26 13.107 11.542 0.611 231 H PHE 27 H PHE 27 11.767 8.316 -0.033 232 HA PHE 27 HA PHE 27 12.132 7.645 2.820 233 HB2 PHE 27 2HB PHE 27 9.672 7.118 1.128 234 HB3 PHE 27 3HB PHE 27 9.915 6.518 2.765 235 HD1 PHE 27 HD2 PHE 27 9.244 9.491 0.717 236 HD2 PHE 27 HD1 PHE 27 9.722 7.984 4.676 237 HE1 PHE 27 HE2 PHE 27 8.286 11.567 1.622 238 HE2 PHE 27 HE1 PHE 27 8.765 10.062 5.583 239 HZ PHE 27 HZ PHE 27 8.047 11.858 4.056 240 H LYS 28 H LYS 28 12.176 5.343 3.296 241 HA LYS 28 HA LYS 28 13.519 3.827 1.199 242 HB2 LYS 28 2HB LYS 28 13.045 3.186 4.126 243 HB3 LYS 28 3HB LYS 28 13.943 2.165 3.016 244 HG2 LYS 28 2HG LYS 28 15.535 3.363 4.296 245 HG3 LYS 28 3HG LYS 28 15.539 4.078 2.683 246 HD2 LYS 28 2HD LYS 28 14.256 5.962 3.446 247 HD3 LYS 28 3HD LYS 28 13.982 5.205 5.017 248 HE2 LYS 28 2HE LYS 28 15.699 6.932 5.168 249 HE3 LYS 28 3HE LYS 28 16.377 5.341 5.506 250 HZ1 LYS 28 3HZ LYS 28 16.571 6.728 2.890 251 HZ2 LYS 28 1HZ LYS 28 17.321 5.276 3.318 252 HZ3 LYS 28 2HZ LYS 28 17.788 6.719 4.060 253 H VAL 29 H VAL 29 12.529 2.297 0.002 254 HA VAL 29 HA VAL 29 9.737 1.632 0.611 255 HB VAL 29 HB VAL 29 11.278 0.941 -1.899 256 HG11 VAL 29 1HG1 VAL 29 9.221 -0.327 -1.588 257 HG12 VAL 29 2HG1 VAL 29 9.048 0.810 -2.924 258 HG13 VAL 29 3HG1 VAL 29 8.310 1.167 -1.363 259 HG21 VAL 29 3HG2 VAL 29 9.605 3.405 -1.392 260 HG22 VAL 29 1HG2 VAL 29 10.344 2.948 -2.926 261 HG23 VAL 29 2HG2 VAL 29 11.362 3.364 -1.547 262 H ARG 30 H ARG 30 9.005 -0.455 0.990 263 HA ARG 30 HA ARG 30 10.839 -2.678 0.412 264 HB2 ARG 30 2HB ARG 30 10.701 -2.002 2.959 265 HB3 ARG 30 3HB ARG 30 9.168 -2.859 2.901 266 HG2 ARG 30 2HG ARG 30 10.250 -4.882 2.171 267 HG3 ARG 30 3HG ARG 30 11.798 -4.051 2.035 268 HD2 ARG 30 2HD ARG 30 11.902 -5.257 4.053 269 HD3 ARG 30 3HD ARG 30 11.607 -3.584 4.520 270 HE ARG 30 HE ARG 30 9.469 -4.168 5.224 271 HH11 ARG 30 1HH1 ARG 30 11.051 -6.844 3.749 272 HH12 ARG 30 2HH1 ARG 30 9.980 -8.012 4.431 273 HH21 ARG 30 1HH2 ARG 30 8.084 -5.675 6.096 274 HH22 ARG 30 2HH2 ARG 30 8.313 -7.351 5.757 275 H THR 31 H THR 31 9.866 -3.953 -1.010 276 HA THR 31 HA THR 31 6.944 -3.912 -1.198 277 HB THR 31 HB THR 31 7.246 -4.970 -3.403 278 HG1 THR 31 HG1 THR 31 9.359 -5.981 -2.706 279 HG21 THR 31 3HG2 THR 31 9.004 -2.541 -2.981 280 HG22 THR 31 1HG2 THR 31 7.255 -2.523 -3.223 281 HG23 THR 31 2HG2 THR 31 8.320 -3.066 -4.519 282 H VAL 32 H VAL 32 5.860 -5.423 -0.140 283 HA VAL 32 HA VAL 32 7.108 -8.006 0.470 284 HB VAL 32 HB VAL 32 4.574 -6.741 1.546 285 HG11 VAL 32 1HG1 VAL 32 4.373 -9.171 1.560 286 HG12 VAL 32 2HG1 VAL 32 4.577 -8.566 3.204 287 HG13 VAL 32 3HG1 VAL 32 5.937 -9.314 2.367 288 HG21 VAL 32 3HG2 VAL 32 6.611 -5.610 2.290 289 HG22 VAL 32 1HG2 VAL 32 7.278 -7.151 2.838 290 HG23 VAL 32 2HG2 VAL 32 5.850 -6.478 3.624 291 H ARG 33 H ARG 33 6.449 -9.887 -0.386 292 HA ARG 33 HA ARG 33 3.918 -9.988 -1.908 293 HB2 ARG 33 2HB ARG 33 5.915 -9.864 -3.402 294 HB3 ARG 33 3HB ARG 33 6.516 -11.347 -2.676 295 HG2 ARG 33 2HG ARG 33 4.447 -12.496 -3.478 296 HG3 ARG 33 3HG ARG 33 4.021 -11.009 -4.332 297 HD2 ARG 33 2HD ARG 33 5.119 -12.563 -5.846 298 HD3 ARG 33 3HD ARG 33 6.138 -11.145 -5.590 299 HE ARG 33 HE ARG 33 6.573 -13.703 -4.181 300 HH11 ARG 33 1HH1 ARG 33 7.789 -11.032 -5.994 301 HH12 ARG 33 2HH1 ARG 33 9.439 -11.495 -5.773 302 HH21 ARG 33 1HH2 ARG 33 8.691 -14.291 -3.922 303 HH22 ARG 33 2HH2 ARG 33 9.948 -13.324 -4.610 304 H SER 34 H SER 34 6.114 -11.504 0.303 305 HA SER 34 HA SER 34 4.358 -13.867 0.523 306 HB2 SER 34 2HB SER 34 7.205 -13.513 1.519 307 HB3 SER 34 3HB SER 34 6.246 -14.988 1.633 308 HG SER 34 HG SER 34 7.289 -15.357 -0.197 309 HA PRO 35 HA PRO 35 2.662 -12.254 4.296 310 HB2 PRO 35 2HB PRO 35 2.232 -14.674 5.607 311 HB3 PRO 35 3HB PRO 35 1.134 -13.935 4.439 312 HG2 PRO 35 2HG PRO 35 3.178 -16.082 4.029 313 HG3 PRO 35 3HG PRO 35 1.543 -15.943 3.352 314 HD2 PRO 35 2HD PRO 35 3.701 -15.363 1.878 315 HD3 PRO 35 3HD PRO 35 2.214 -14.400 1.733 316 H GLN 36 H GLN 36 5.157 -14.767 4.597 317 HA GLN 36 HA GLN 36 5.981 -14.280 7.216 318 HB2 GLN 36 2HB GLN 36 8.172 -15.239 6.479 319 HB3 GLN 36 3HB GLN 36 6.776 -16.208 6.029 320 HG2 GLN 36 2HG GLN 36 6.894 -15.126 3.756 321 HG3 GLN 36 3HG GLN 36 8.440 -14.440 4.252 322 HE21 GLN 36 1HE2 GLN 36 6.741 -17.337 3.384 323 HE22 GLN 36 2HE2 GLN 36 8.134 -18.340 3.196 324 H GLU 37 H GLU 37 6.897 -12.577 4.234 325 HA GLU 37 HA GLU 37 8.876 -10.917 5.407 326 HB2 GLU 37 2HB GLU 37 7.227 -10.730 2.899 327 HB3 GLU 37 3HB GLU 37 8.260 -9.394 3.385 328 HG2 GLU 37 2HG GLU 37 9.180 -12.218 2.874 329 HG3 GLU 37 3HG GLU 37 9.339 -10.865 1.754 330 H LEU 38 H LEU 38 5.377 -10.571 5.048 331 HA LEU 38 HA LEU 38 5.101 -7.907 5.876 332 HB2 LEU 38 2HB LEU 38 3.272 -9.267 4.925 333 HB3 LEU 38 3HB LEU 38 3.234 -10.233 6.387 334 HG LEU 38 HG LEU 38 2.556 -8.213 7.675 335 HD11 LEU 38 1HD1 LEU 38 3.511 -6.483 6.274 336 HD12 LEU 38 2HD1 LEU 38 1.775 -6.230 6.440 337 HD13 LEU 38 3HD1 LEU 38 2.427 -6.912 4.950 338 HD21 LEU 38 3HD2 LEU 38 0.259 -8.128 6.829 339 HD22 LEU 38 1HD2 LEU 38 0.874 -9.780 6.848 340 HD23 LEU 38 2HD2 LEU 38 0.777 -8.894 5.327 341 H LYS 39 H LYS 39 5.297 -10.892 7.759 342 HA LYS 39 HA LYS 39 4.949 -9.904 10.339 343 HB2 LYS 39 2HB LYS 39 5.016 -12.269 9.923 344 HB3 LYS 39 3HB LYS 39 6.646 -12.168 9.275 345 HG2 LYS 39 2HG LYS 39 7.493 -11.580 11.501 346 HG3 LYS 39 3HG LYS 39 5.856 -11.701 12.149 347 HD2 LYS 39 2HD LYS 39 7.129 -13.735 12.609 348 HD3 LYS 39 3HD LYS 39 5.783 -14.072 11.519 349 HE2 LYS 39 2HE LYS 39 7.797 -15.239 10.788 350 HE3 LYS 39 3HE LYS 39 7.323 -14.021 9.606 351 HZ1 LYS 39 3HZ LYS 39 9.415 -13.599 11.669 352 HZ2 LYS 39 1HZ LYS 39 9.049 -12.581 10.370 353 HZ3 LYS 39 2HZ LYS 39 9.737 -14.097 10.084 354 H ASP 40 H ASP 40 7.875 -9.969 8.338 355 HA ASP 40 HA ASP 40 9.642 -9.216 10.463 356 HB2 ASP 40 2HB ASP 40 10.112 -9.172 7.474 357 HB3 ASP 40 3HB ASP 40 11.355 -9.096 8.724 358 H SER 41 H SER 41 7.431 -7.363 8.771 359 HA SER 41 HA SER 41 8.927 -4.964 8.336 360 HB2 SER 41 2HB SER 41 6.784 -3.873 7.999 361 HB3 SER 41 3HB SER 41 6.738 -5.457 7.228 362 HG SER 41 HG SER 41 5.149 -5.976 8.495 363 H ILE 42 H ILE 42 6.830 -6.072 10.961 364 HA ILE 42 HA ILE 42 6.798 -3.758 12.521 365 HB ILE 42 HB ILE 42 6.691 -6.615 13.513 366 HG12 ILE 42 2HG1 ILE 42 4.428 -4.784 12.664 367 HG13 ILE 42 3HG1 ILE 42 5.049 -6.126 11.708 368 HG21 ILE 42 1HG2 ILE 42 5.669 -4.061 14.763 369 HG22 ILE 42 2HG2 ILE 42 7.044 -5.015 15.319 370 HG23 ILE 42 3HG2 ILE 42 5.416 -5.687 15.396 371 HD11 ILE 42 3HD1 ILE 42 3.001 -6.732 12.847 372 HD12 ILE 42 1HD1 ILE 42 3.727 -6.338 14.405 373 HD13 ILE 42 2HD1 ILE 42 4.355 -7.686 13.454 374 H GLU 43 H GLU 43 8.993 -6.568 12.762 375 HA GLU 43 HA GLU 43 10.439 -5.734 14.994 376 HB2 GLU 43 2HB GLU 43 11.415 -7.411 12.674 377 HB3 GLU 43 3HB GLU 43 12.209 -7.283 14.238 378 HG2 GLU 43 2HG GLU 43 9.509 -8.483 13.657 379 HG3 GLU 43 3HG GLU 43 10.968 -9.326 14.173 380 H GLU 44 H GLU 44 10.736 -4.713 11.673 381 HA GLU 44 HA GLU 44 13.257 -3.403 11.929 382 HB2 GLU 44 2HB GLU 44 12.340 -4.028 9.742 383 HB3 GLU 44 3HB GLU 44 10.975 -2.950 9.988 384 HG2 GLU 44 2HG GLU 44 12.435 -1.834 8.518 385 HG3 GLU 44 3HG GLU 44 12.631 -1.048 10.083 386 H LEU 45 H LEU 45 9.932 -2.122 11.803 387 HA LEU 45 HA LEU 45 10.634 0.568 12.245 388 HB2 LEU 45 2HB LEU 45 8.015 -0.873 12.657 389 HB3 LEU 45 3HB LEU 45 8.194 0.872 12.710 390 HG LEU 45 HG LEU 45 8.805 -0.841 10.293 391 HD11 LEU 45 1HD1 LEU 45 6.749 0.107 9.341 392 HD12 LEU 45 2HD1 LEU 45 6.397 0.882 10.886 393 HD13 LEU 45 3HD1 LEU 45 6.426 -0.878 10.767 394 HD21 LEU 45 3HD2 LEU 45 8.872 1.319 9.103 395 HD22 LEU 45 1HD2 LEU 45 10.123 1.201 10.338 396 HD23 LEU 45 2HD2 LEU 45 8.675 2.160 10.641 397 H VAL 46 H VAL 46 9.836 -1.997 14.532 398 HA VAL 46 HA VAL 46 9.425 -0.289 16.778 399 HB VAL 46 HB VAL 46 8.511 -2.536 16.790 400 HG11 VAL 46 1HG1 VAL 46 11.329 -3.588 16.962 401 HG12 VAL 46 2HG1 VAL 46 10.361 -3.599 15.491 402 HG13 VAL 46 3HG1 VAL 46 9.842 -4.531 16.898 403 HG21 VAL 46 3HG2 VAL 46 9.212 -3.271 19.023 404 HG22 VAL 46 1HG2 VAL 46 9.010 -1.519 18.961 405 HG23 VAL 46 2HG2 VAL 46 10.627 -2.224 18.930 406 H LYS 47 H LYS 47 12.296 -1.925 15.502 407 HA LYS 47 HA LYS 47 13.903 -1.114 17.804 408 HB2 LYS 47 2HB LYS 47 14.729 -2.639 15.321 409 HB3 LYS 47 3HB LYS 47 15.676 -2.452 16.793 410 HG2 LYS 47 2HG LYS 47 14.041 -3.728 18.051 411 HG3 LYS 47 3HG LYS 47 13.006 -3.836 16.629 412 HD2 LYS 47 2HD LYS 47 14.849 -5.064 15.470 413 HD3 LYS 47 3HD LYS 47 15.724 -5.084 17.005 414 HE2 LYS 47 2HE LYS 47 12.978 -6.265 16.542 415 HE3 LYS 47 3HE LYS 47 14.479 -7.181 16.588 416 HZ1 LYS 47 3HZ LYS 47 13.287 -5.644 18.833 417 HZ2 LYS 47 1HZ LYS 47 14.790 -6.420 18.885 418 HZ3 LYS 47 2HZ LYS 47 13.384 -7.331 18.694 419 H LYS 48 H LYS 48 13.822 -0.535 14.298 420 HA LYS 48 HA LYS 48 15.503 1.864 14.703 421 HB2 LYS 48 2HB LYS 48 15.282 0.063 12.282 422 HB3 LYS 48 3HB LYS 48 16.155 1.588 12.306 423 HG2 LYS 48 2HG LYS 48 17.756 0.742 13.865 424 HG3 LYS 48 3HG LYS 48 16.799 -0.717 14.137 425 HD2 LYS 48 2HD LYS 48 18.746 -1.106 12.652 426 HD3 LYS 48 3HD LYS 48 17.206 -1.465 11.873 427 HE2 LYS 48 2HE LYS 48 18.630 -0.286 10.323 428 HE3 LYS 48 3HE LYS 48 17.283 0.755 10.775 429 HZ1 LYS 48 3HZ LYS 48 18.761 1.886 12.344 430 HZ2 LYS 48 1HZ LYS 48 19.350 1.976 10.762 431 HZ3 LYS 48 2HZ LYS 48 20.045 0.899 11.861 432 H TYR 49 H TYR 49 14.153 3.579 14.741 433 HA TYR 49 HA TYR 49 11.693 3.687 13.299 434 HB2 TYR 49 2HB TYR 49 13.278 5.908 14.612 435 HB3 TYR 49 3HB TYR 49 11.633 6.065 14.003 436 HD1 TYR 49 HD1 TYR 49 13.725 4.336 16.530 437 HD2 TYR 49 HD2 TYR 49 9.777 5.367 15.308 438 HE1 TYR 49 HE1 TYR 49 12.862 3.591 18.708 439 HE2 TYR 49 HE2 TYR 49 8.904 4.620 17.483 440 HH TYR 49 HH TYR 49 10.912 3.992 20.152 441 H ASN 50 H ASN 50 12.638 3.057 11.213 442 HA ASN 50 HA ASN 50 14.188 5.060 9.775 443 HB2 ASN 50 2HB ASN 50 14.666 2.615 9.567 444 HB3 ASN 50 3HB ASN 50 13.086 2.397 8.822 445 HD21 ASN 50 1HD2 ASN 50 13.861 1.683 6.873 446 HD22 ASN 50 2HD2 ASN 50 14.728 2.694 5.779 447 H ALA 51 H ALA 51 13.441 6.253 8.005 448 HA ALA 51 HA ALA 51 10.636 6.763 7.780 449 HB1 ALA 51 3HB ALA 51 12.284 8.504 7.310 450 HB2 ALA 51 1HB ALA 51 11.260 8.224 5.900 451 HB3 ALA 51 2HB ALA 51 12.900 7.574 5.943 452 H THR 52 H THR 52 10.025 4.458 7.447 453 HA THR 52 HA THR 52 10.636 3.387 4.771 454 HB THR 52 HB THR 52 9.545 1.900 7.178 455 HG1 THR 52 HG1 THR 52 11.569 1.521 7.717 456 HG21 THR 52 3HG2 THR 52 10.633 0.879 4.545 457 HG22 THR 52 1HG2 THR 52 8.942 0.846 5.044 458 HG23 THR 52 2HG2 THR 52 10.137 -0.121 5.909 459 H ILE 53 H ILE 53 9.121 3.120 3.273 460 HA ILE 53 HA ILE 53 6.275 3.029 4.075 461 HB ILE 53 HB ILE 53 7.439 4.048 1.464 462 HG12 ILE 53 2HG1 ILE 53 6.009 5.476 3.728 463 HG13 ILE 53 3HG1 ILE 53 7.696 5.668 3.268 464 HG21 ILE 53 1HG2 ILE 53 5.133 4.574 0.825 465 HG22 ILE 53 2HG2 ILE 53 4.544 3.837 2.316 466 HG23 ILE 53 3HG2 ILE 53 5.339 2.844 1.093 467 HD11 ILE 53 3HD1 ILE 53 6.371 7.541 2.508 468 HD12 ILE 53 1HD1 ILE 53 5.305 6.455 1.615 469 HD13 ILE 53 2HD1 ILE 53 6.992 6.632 1.132 470 H VAL 54 H VAL 54 5.428 1.041 3.823 471 HA VAL 54 HA VAL 54 6.898 -0.900 2.190 472 HB VAL 54 HB VAL 54 6.552 -1.506 4.523 473 HG11 VAL 54 1HG1 VAL 54 4.483 -0.282 4.937 474 HG12 VAL 54 2HG1 VAL 54 4.338 -1.968 5.428 475 HG13 VAL 54 3HG1 VAL 54 3.596 -1.422 3.924 476 HG21 VAL 54 3HG2 VAL 54 6.679 -3.303 2.877 477 HG22 VAL 54 1HG2 VAL 54 4.929 -3.233 2.647 478 HG23 VAL 54 2HG2 VAL 54 5.596 -3.743 4.198 479 H VAL 55 H VAL 55 6.067 -1.937 0.471 480 HA VAL 55 HA VAL 55 3.320 -1.245 -0.375 481 HB VAL 55 HB VAL 55 5.704 -1.875 -2.138 482 HG11 VAL 55 1HG1 VAL 55 2.910 -0.982 -2.863 483 HG12 VAL 55 2HG1 VAL 55 3.607 -2.575 -3.157 484 HG13 VAL 55 3HG1 VAL 55 4.254 -1.162 -3.990 485 HG21 VAL 55 3HG2 VAL 55 4.352 0.772 -1.584 486 HG22 VAL 55 1HG2 VAL 55 5.620 0.498 -2.780 487 HG23 VAL 55 2HG2 VAL 55 5.969 0.297 -1.063 488 H VAL 56 H VAL 56 1.980 -2.939 -0.237 489 HA VAL 56 HA VAL 56 3.005 -5.668 -0.338 490 HB VAL 56 HB VAL 56 0.171 -4.697 0.111 491 HG11 VAL 56 1HG1 VAL 56 -0.271 -6.957 0.943 492 HG12 VAL 56 2HG1 VAL 56 1.381 -7.435 0.555 493 HG13 VAL 56 3HG1 VAL 56 0.264 -6.999 -0.738 494 HG21 VAL 56 3HG2 VAL 56 0.579 -5.167 2.483 495 HG22 VAL 56 1HG2 VAL 56 1.689 -3.937 1.876 496 HG23 VAL 56 2HG2 VAL 56 2.251 -5.592 2.118 497 H VAL 57 H VAL 57 3.265 -6.598 -2.252 498 HA VAL 57 HA VAL 57 1.745 -5.755 -4.581 499 HB VAL 57 HB VAL 57 3.875 -7.899 -4.354 500 HG11 VAL 57 1HG1 VAL 57 4.066 -7.639 -6.801 501 HG12 VAL 57 2HG1 VAL 57 2.694 -6.529 -6.779 502 HG13 VAL 57 3HG1 VAL 57 2.471 -8.218 -6.315 503 HG21 VAL 57 3HG2 VAL 57 5.400 -6.212 -5.293 504 HG22 VAL 57 1HG2 VAL 57 4.760 -5.716 -3.725 505 HG23 VAL 57 2HG2 VAL 57 4.114 -5.007 -5.206 506 H VAL 58 H VAL 58 -0.161 -6.640 -5.069 507 HA VAL 58 HA VAL 58 -0.720 -9.392 -4.169 508 HB VAL 58 HB VAL 58 -3.039 -8.787 -3.795 509 HG11 VAL 58 1HG1 VAL 58 -2.757 -7.250 -1.883 510 HG12 VAL 58 2HG1 VAL 58 -1.129 -6.869 -2.448 511 HG13 VAL 58 3HG1 VAL 58 -1.520 -8.507 -1.924 512 HG21 VAL 58 3HG2 VAL 58 -3.312 -7.089 -5.525 513 HG22 VAL 58 1HG2 VAL 58 -2.250 -5.991 -4.641 514 HG23 VAL 58 2HG2 VAL 58 -3.808 -6.452 -3.957 515 H ASP 59 H ASP 59 -2.065 -10.698 -5.457 516 HA ASP 59 HA ASP 59 -2.177 -9.947 -8.289 517 HB2 ASP 59 2HB ASP 59 -2.661 -12.362 -8.657 518 HB3 ASP 59 3HB ASP 59 -1.138 -12.081 -7.816 519 H ASP 60 H ASP 60 -4.318 -11.080 -5.675 520 HA ASP 60 HA ASP 60 -6.595 -9.936 -7.137 521 HB2 ASP 60 2HB ASP 60 -6.343 -12.543 -7.307 522 HB3 ASP 60 3HB ASP 60 -6.946 -12.536 -5.654 523 H LYS 61 H LYS 61 -8.474 -10.913 -5.057 524 HA LYS 61 HA LYS 61 -8.209 -8.498 -3.501 525 HB2 LYS 61 2HB LYS 61 -10.540 -8.885 -2.900 526 HB3 LYS 61 3HB LYS 61 -10.309 -9.058 -4.634 527 HG2 LYS 61 2HG LYS 61 -10.181 -11.557 -4.247 528 HG3 LYS 61 3HG LYS 61 -10.716 -11.238 -2.598 529 HD2 LYS 61 2HD LYS 61 -12.729 -11.677 -3.613 530 HD3 LYS 61 3HD LYS 61 -12.651 -9.927 -3.809 531 HE2 LYS 61 2HE LYS 61 -11.884 -11.984 -5.891 532 HE3 LYS 61 3HE LYS 61 -13.370 -11.040 -5.874 533 HZ1 LYS 61 3HZ LYS 61 -10.617 -9.971 -6.186 534 HZ2 LYS 61 1HZ LYS 61 -12.023 -9.025 -6.104 535 HZ3 LYS 61 2HZ LYS 61 -11.788 -10.092 -7.396 536 H GLU 62 H GLU 62 -8.547 -11.991 -2.693 537 HA GLU 62 HA GLU 62 -8.835 -11.522 0.085 538 HB2 GLU 62 2HB GLU 62 -9.579 -13.610 -1.012 539 HB3 GLU 62 3HB GLU 62 -7.896 -14.065 -1.256 540 HG2 GLU 62 2HG GLU 62 -7.561 -14.044 1.188 541 HG3 GLU 62 3HG GLU 62 -9.268 -13.661 1.400 542 H TRP 63 H TRP 63 -5.958 -12.466 -1.821 543 HA TRP 63 HA TRP 63 -4.107 -12.651 0.230 544 HB2 TRP 63 2HB TRP 63 -3.427 -13.243 -1.975 545 HB3 TRP 63 3HB TRP 63 -3.810 -11.646 -2.603 546 HD1 TRP 63 HD1 TRP 63 -1.556 -10.760 -3.408 547 HE1 TRP 63 HE1 TRP 63 0.759 -10.375 -2.359 548 HE3 TRP 63 HE3 TRP 63 -2.299 -13.106 1.075 549 HZ2 TRP 63 HZ2 TRP 63 2.092 -10.984 0.046 550 HZ3 TRP 63 HZ3 TRP 63 -0.448 -13.160 2.695 551 HH2 TRP 63 HH2 TRP 63 1.701 -12.123 2.190 552 H ALA 64 H ALA 64 -5.198 -9.695 -1.440 553 HA ALA 64 HA ALA 64 -3.648 -7.876 0.080 554 HB1 ALA 64 3HB ALA 64 -5.199 -6.162 -0.733 555 HB2 ALA 64 1HB ALA 64 -6.295 -7.421 -1.303 556 HB3 ALA 64 2HB ALA 64 -4.698 -7.246 -2.032 557 H GLU 65 H GLU 65 -6.911 -9.181 0.539 558 HA GLU 65 HA GLU 65 -7.733 -7.739 2.769 559 HB2 GLU 65 2HB GLU 65 -9.215 -9.205 1.507 560 HB3 GLU 65 3HB GLU 65 -8.309 -10.618 2.017 561 HG2 GLU 65 2HG GLU 65 -9.589 -8.872 4.077 562 HG3 GLU 65 3HG GLU 65 -10.583 -9.989 3.150 563 H LYS 66 H LYS 66 -5.781 -10.702 2.634 564 HA LYS 66 HA LYS 66 -5.553 -11.252 5.360 565 HB2 LYS 66 2HB LYS 66 -3.434 -11.638 3.231 566 HB3 LYS 66 3HB LYS 66 -3.500 -12.464 4.782 567 HG2 LYS 66 2HG LYS 66 -5.498 -13.634 4.145 568 HG3 LYS 66 3HG LYS 66 -5.621 -12.696 2.654 569 HD2 LYS 66 2HD LYS 66 -3.420 -13.652 1.953 570 HD3 LYS 66 3HD LYS 66 -3.468 -14.687 3.381 571 HE2 LYS 66 2HE LYS 66 -5.559 -14.649 1.205 572 HE3 LYS 66 3HE LYS 66 -4.247 -15.819 1.316 573 HZ1 LYS 66 3HZ LYS 66 -6.422 -15.431 3.302 574 HZ2 LYS 66 1HZ LYS 66 -5.130 -16.513 3.472 575 HZ3 LYS 66 2HZ LYS 66 -6.257 -16.730 2.228 576 H ALA 67 H ALA 67 -3.516 -9.174 3.318 577 HA ALA 67 HA ALA 67 -1.659 -8.431 5.310 578 HB1 ALA 67 3HB ALA 67 -1.240 -8.168 2.908 579 HB2 ALA 67 1HB ALA 67 -0.991 -6.657 3.781 580 HB3 ALA 67 2HB ALA 67 -2.461 -6.898 2.834 581 H ILE 68 H ILE 68 -4.558 -6.731 4.098 582 HA ILE 68 HA ILE 68 -4.395 -4.516 5.840 583 HB ILE 68 HB ILE 68 -6.914 -5.706 4.652 584 HG12 ILE 68 2HG1 ILE 68 -5.346 -5.304 2.858 585 HG13 ILE 68 3HG1 ILE 68 -6.557 -4.028 2.823 586 HG21 ILE 68 1HG2 ILE 68 -7.378 -4.079 6.404 587 HG22 ILE 68 2HG2 ILE 68 -7.804 -3.417 4.827 588 HG23 ILE 68 3HG2 ILE 68 -6.316 -2.905 5.624 589 HD11 ILE 68 3HD1 ILE 68 -4.969 -2.529 3.956 590 HD12 ILE 68 1HD1 ILE 68 -4.368 -3.116 2.407 591 HD13 ILE 68 2HD1 ILE 68 -3.758 -3.808 3.909 592 H ARG 69 H ARG 69 -5.817 -7.707 6.214 593 HA ARG 69 HA ARG 69 -7.219 -7.273 8.630 594 HB2 ARG 69 2HB ARG 69 -7.523 -9.246 7.134 595 HB3 ARG 69 3HB ARG 69 -5.952 -9.845 7.650 596 HG2 ARG 69 2HG ARG 69 -6.782 -10.017 9.956 597 HG3 ARG 69 3HG ARG 69 -8.359 -9.427 9.424 598 HD2 ARG 69 2HD ARG 69 -8.467 -11.815 9.582 599 HD3 ARG 69 3HD ARG 69 -8.496 -11.377 7.874 600 HE ARG 69 HE ARG 69 -6.081 -12.356 9.259 601 HH11 ARG 69 1HH1 ARG 69 -8.081 -12.200 6.449 602 HH12 ARG 69 2HH1 ARG 69 -7.161 -13.399 5.611 603 HH21 ARG 69 1HH2 ARG 69 -4.904 -13.849 8.167 604 HH22 ARG 69 2HH2 ARG 69 -5.367 -14.314 6.565 605 H PHE 70 H PHE 70 -3.904 -8.372 7.970 606 HA PHE 70 HA PHE 70 -3.097 -8.876 10.603 607 HB2 PHE 70 2HB PHE 70 -1.808 -9.501 8.575 608 HB3 PHE 70 3HB PHE 70 -1.402 -7.807 8.328 609 HD1 PHE 70 HD1 PHE 70 -1.016 -10.635 10.702 610 HD2 PHE 70 HD2 PHE 70 0.467 -6.856 9.400 611 HE1 PHE 70 HE1 PHE 70 0.964 -10.920 12.133 612 HE2 PHE 70 HE2 PHE 70 2.445 -7.138 10.834 613 HZ PHE 70 HZ PHE 70 2.696 -9.169 12.201 614 H VAL 71 H VAL 71 -3.001 -5.849 8.728 615 HA VAL 71 HA VAL 71 -1.853 -4.244 10.765 616 HB VAL 71 HB VAL 71 -3.731 -3.313 8.578 617 HG11 VAL 71 1HG1 VAL 71 -2.555 -1.166 8.808 618 HG12 VAL 71 2HG1 VAL 71 -1.599 -1.833 10.132 619 HG13 VAL 71 3HG1 VAL 71 -3.341 -1.639 10.316 620 HG21 VAL 71 3HG2 VAL 71 -1.899 -4.617 7.620 621 HG22 VAL 71 1HG2 VAL 71 -0.723 -3.635 8.491 622 HG23 VAL 71 2HG2 VAL 71 -1.720 -2.907 7.229 623 H LYS 72 H LYS 72 -5.205 -5.077 9.975 624 HA LYS 72 HA LYS 72 -6.505 -3.484 11.897 625 HB2 LYS 72 2HB LYS 72 -7.710 -4.681 10.114 626 HB3 LYS 72 3HB LYS 72 -7.285 -6.219 10.846 627 HG2 LYS 72 2HG LYS 72 -9.431 -5.981 11.597 628 HG3 LYS 72 3HG LYS 72 -8.552 -5.241 12.930 629 HD2 LYS 72 2HD LYS 72 -9.779 -3.698 10.636 630 HD3 LYS 72 3HD LYS 72 -10.581 -3.978 12.180 631 HE2 LYS 72 2HE LYS 72 -8.720 -2.796 13.315 632 HE3 LYS 72 3HE LYS 72 -8.006 -2.458 11.738 633 HZ1 LYS 72 3HZ LYS 72 -10.649 -1.514 12.709 634 HZ2 LYS 72 1HZ LYS 72 -10.045 -1.249 11.152 635 HZ3 LYS 72 2HZ LYS 72 -9.265 -0.570 12.490 636 H SER 73 H SER 73 -5.103 -6.740 12.134 637 HA SER 73 HA SER 73 -5.756 -7.312 14.796 638 HB2 SER 73 2HB SER 73 -3.257 -8.117 13.272 639 HB3 SER 73 3HB SER 73 -3.835 -8.869 14.760 640 HG SER 73 HG SER 73 -4.450 -10.003 12.837 641 H LEU 74 H LEU 74 -3.000 -5.535 13.443 642 HA LEU 74 HA LEU 74 -1.650 -4.976 15.850 643 HB2 LEU 74 2HB LEU 74 -1.849 -3.246 13.373 644 HB3 LEU 74 3HB LEU 74 -0.643 -3.087 14.636 645 HG LEU 74 HG LEU 74 -0.939 -5.490 12.824 646 HD11 LEU 74 1HD1 LEU 74 1.119 -4.705 11.762 647 HD12 LEU 74 2HD1 LEU 74 1.090 -3.255 12.767 648 HD13 LEU 74 3HD1 LEU 74 -0.190 -3.533 11.583 649 HD21 LEU 74 3HD2 LEU 74 1.166 -4.792 14.875 650 HD22 LEU 74 1HD2 LEU 74 1.236 -6.158 13.760 651 HD23 LEU 74 2HD2 LEU 74 -0.022 -6.090 14.991 652 H GLY 75 H GLY 75 -4.307 -3.301 14.216 653 HA2 GLY 75 2HA GLY 75 -6.017 -2.073 15.231 654 HA3 GLY 75 3HA GLY 75 -5.121 -2.101 16.740 655 H ALA 76 H ALA 76 -4.041 -0.966 13.561 656 HA ALA 76 HA ALA 76 -4.053 1.807 14.547 657 HB1 ALA 76 3HB ALA 76 -1.676 0.453 13.260 658 HB2 ALA 76 1HB ALA 76 -1.809 0.935 14.952 659 HB3 ALA 76 2HB ALA 76 -1.779 2.163 13.685 660 H GLN 77 H GLN 77 -5.203 2.986 13.131 661 HA GLN 77 HA GLN 77 -5.701 2.142 10.454 662 HB2 GLN 77 2HB GLN 77 -6.771 4.400 10.191 663 HB3 GLN 77 3HB GLN 77 -7.402 3.432 11.514 664 HG2 GLN 77 2HG GLN 77 -6.116 4.738 13.115 665 HG3 GLN 77 3HG GLN 77 -5.410 5.678 11.802 666 HE21 GLN 77 1HE2 GLN 77 -6.244 7.589 12.713 667 HE22 GLN 77 2HE2 GLN 77 -7.920 7.995 12.579 668 H VAL 78 H VAL 78 -4.077 2.050 9.059 669 HA VAL 78 HA VAL 78 -2.100 4.219 8.916 670 HB VAL 78 HB VAL 78 -0.796 2.707 7.483 671 HG11 VAL 78 1HG1 VAL 78 -1.744 1.387 10.034 672 HG12 VAL 78 2HG1 VAL 78 -0.469 2.598 9.901 673 HG13 VAL 78 3HG1 VAL 78 -0.251 1.007 9.172 674 HG21 VAL 78 3HG2 VAL 78 -3.051 0.737 7.914 675 HG22 VAL 78 1HG2 VAL 78 -1.516 0.387 7.119 676 HG23 VAL 78 2HG2 VAL 78 -2.645 1.530 6.390 677 H LEU 79 H LEU 79 -1.424 4.945 6.700 678 HA LEU 79 HA LEU 79 -3.749 5.531 5.079 679 HB2 LEU 79 2HB LEU 79 -0.842 6.315 4.852 680 HB3 LEU 79 3HB LEU 79 -2.014 6.719 3.614 681 HG LEU 79 HG LEU 79 -1.710 8.630 5.011 682 HD11 LEU 79 1HD1 LEU 79 -3.979 9.048 5.782 683 HD12 LEU 79 2HD1 LEU 79 -4.337 7.323 5.703 684 HD13 LEU 79 3HD1 LEU 79 -3.984 8.218 4.225 685 HD21 LEU 79 3HD2 LEU 79 -2.114 8.627 7.416 686 HD22 LEU 79 1HD2 LEU 79 -0.816 7.509 6.997 687 HD23 LEU 79 2HD2 LEU 79 -2.426 6.891 7.374 688 H ILE 80 H ILE 80 -4.494 4.074 3.726 689 HA ILE 80 HA ILE 80 -2.642 2.184 2.426 690 HB ILE 80 HB ILE 80 -5.644 1.989 2.788 691 HG12 ILE 80 2HG1 ILE 80 -3.417 0.477 4.192 692 HG13 ILE 80 3HG1 ILE 80 -4.320 1.812 4.902 693 HG21 ILE 80 1HG2 ILE 80 -4.881 0.815 0.781 694 HG22 ILE 80 2HG2 ILE 80 -5.375 -0.336 2.023 695 HG23 ILE 80 3HG2 ILE 80 -3.662 -0.038 1.728 696 HD11 ILE 80 3HD1 ILE 80 -5.097 -0.382 5.665 697 HD12 ILE 80 1HD1 ILE 80 -5.516 -0.798 4.004 698 HD13 ILE 80 2HD1 ILE 80 -6.355 0.520 4.821 699 H ILE 81 H ILE 81 -2.059 2.800 0.428 700 HA ILE 81 HA ILE 81 -4.067 4.075 -1.319 701 HB ILE 81 HB ILE 81 -1.059 3.939 -1.664 702 HG12 ILE 81 2HG1 ILE 81 -2.887 6.232 -0.873 703 HG13 ILE 81 3HG1 ILE 81 -1.694 5.443 0.153 704 HG21 ILE 81 1HG2 ILE 81 -3.144 5.373 -3.324 705 HG22 ILE 81 2HG2 ILE 81 -2.213 3.958 -3.818 706 HG23 ILE 81 3HG2 ILE 81 -1.397 5.494 -3.538 707 HD11 ILE 81 3HD1 ILE 81 -0.901 7.591 -0.641 708 HD12 ILE 81 1HD1 ILE 81 -1.105 7.065 -2.311 709 HD13 ILE 81 2HD1 ILE 81 0.093 6.281 -1.279 710 H ILE 82 H ILE 82 -5.046 2.822 -2.768 711 HA ILE 82 HA ILE 82 -3.828 0.235 -3.490 712 HB ILE 82 HB ILE 82 -6.706 1.137 -3.770 713 HG12 ILE 82 2HG1 ILE 82 -5.454 -0.795 -1.790 714 HG13 ILE 82 3HG1 ILE 82 -6.016 0.831 -1.410 715 HG21 ILE 82 1HG2 ILE 82 -6.072 -0.506 -5.467 716 HG22 ILE 82 2HG2 ILE 82 -7.184 -1.212 -4.295 717 HG23 ILE 82 3HG2 ILE 82 -5.462 -1.582 -4.210 718 HD11 ILE 82 3HD1 ILE 82 -7.747 -1.426 -2.393 719 HD12 ILE 82 1HD1 ILE 82 -8.291 0.189 -1.940 720 HD13 ILE 82 2HD1 ILE 82 -7.606 -0.885 -0.721 721 H TYR 83 H TYR 83 -3.270 -0.235 -5.539 722 HA TYR 83 HA TYR 83 -4.193 1.538 -7.716 723 HB2 TYR 83 2HB TYR 83 -1.824 1.934 -7.328 724 HB3 TYR 83 3HB TYR 83 -1.488 0.208 -7.418 725 HD1 TYR 83 HD2 TYR 83 -2.543 3.158 -9.401 726 HD2 TYR 83 HD1 TYR 83 -1.178 -0.879 -9.529 727 HE1 TYR 83 HE2 TYR 83 -2.171 3.360 -11.823 728 HE2 TYR 83 HE1 TYR 83 -0.807 -0.680 -11.951 729 HH TYR 83 HH TYR 83 -0.927 2.337 -13.592 730 H ASP 84 H ASP 84 -5.082 0.594 -9.437 731 HA ASP 84 HA ASP 84 -4.694 -2.260 -9.971 732 HB2 ASP 84 2HB ASP 84 -6.693 -2.247 -8.606 733 HB3 ASP 84 3HB ASP 84 -7.396 -0.957 -9.571 734 H GLN 85 H GLN 85 -5.668 -2.884 -12.075 735 HA GLN 85 HA GLN 85 -4.555 -1.264 -14.112 736 HB2 GLN 85 2HB GLN 85 -6.368 -3.674 -14.222 737 HB3 GLN 85 3HB GLN 85 -5.510 -3.012 -15.609 738 HG2 GLN 85 2HG GLN 85 -3.386 -3.550 -14.598 739 HG3 GLN 85 3HG GLN 85 -4.190 -4.084 -13.121 740 HE21 GLN 85 1HE2 GLN 85 -5.374 -6.020 -13.152 741 HE22 GLN 85 2HE2 GLN 85 -5.111 -7.217 -14.374 742 H ASP 86 H ASP 86 -7.711 -1.396 -12.703 743 HA ASP 86 HA ASP 86 -8.652 0.655 -14.539 744 HB2 ASP 86 2HB ASP 86 -10.735 -0.575 -15.067 745 HB3 ASP 86 3HB ASP 86 -9.294 -1.362 -15.700 746 H GLN 87 H GLN 87 -11.397 0.543 -13.784 747 HA GLN 87 HA GLN 87 -11.119 1.587 -11.049 748 HB2 GLN 87 2HB GLN 87 -13.164 2.117 -13.208 749 HB3 GLN 87 3HB GLN 87 -13.357 2.684 -11.556 750 HG2 GLN 87 2HG GLN 87 -12.499 4.492 -12.822 751 HG3 GLN 87 3HG GLN 87 -11.185 3.910 -11.803 752 HE21 GLN 87 1HE2 GLN 87 -9.421 2.878 -12.785 753 HE22 GLN 87 2HE2 GLN 87 -9.136 2.970 -14.487 754 H ASN 88 H ASN 88 -12.510 -1.077 -12.704 755 HA ASN 88 HA ASN 88 -14.773 -1.486 -10.983 756 HB2 ASN 88 2HB ASN 88 -13.388 -3.539 -12.724 757 HB3 ASN 88 3HB ASN 88 -15.032 -3.620 -12.094 758 HD21 ASN 88 1HD2 ASN 88 -12.946 -2.268 -14.477 759 HD22 ASN 88 2HD2 ASN 88 -14.183 -1.549 -15.447 760 H ARG 89 H ARG 89 -11.711 -3.300 -11.342 761 HA ARG 89 HA ARG 89 -12.128 -4.826 -8.960 762 HB2 ARG 89 2HB ARG 89 -9.687 -4.404 -10.704 763 HB3 ARG 89 3HB ARG 89 -9.729 -5.525 -9.345 764 HG2 ARG 89 2HG ARG 89 -11.435 -6.845 -10.401 765 HG3 ARG 89 3HG ARG 89 -11.623 -5.657 -11.689 766 HD2 ARG 89 2HD ARG 89 -9.014 -7.082 -11.195 767 HD3 ARG 89 3HD ARG 89 -10.278 -7.766 -12.218 768 HE ARG 89 HE ARG 89 -9.246 -5.076 -12.808 769 HH11 ARG 89 1HH1 ARG 89 -9.666 -8.379 -13.716 770 HH12 ARG 89 2HH1 ARG 89 -9.114 -8.121 -15.333 771 HH21 ARG 89 1HH2 ARG 89 -8.568 -4.754 -14.886 772 HH22 ARG 89 2HH2 ARG 89 -8.516 -6.081 -16.000 773 H LEU 90 H LEU 90 -10.371 -1.879 -9.711 774 HA LEU 90 HA LEU 90 -8.973 -1.412 -7.366 775 HB2 LEU 90 2HB LEU 90 -8.872 -0.004 -9.385 776 HB3 LEU 90 3HB LEU 90 -10.483 0.594 -9.051 777 HG LEU 90 HG LEU 90 -9.650 1.638 -6.965 778 HD11 LEU 90 1HD1 LEU 90 -7.798 0.151 -6.475 779 HD12 LEU 90 2HD1 LEU 90 -7.227 1.815 -6.592 780 HD13 LEU 90 3HD1 LEU 90 -6.948 0.691 -7.924 781 HD21 LEU 90 3HD2 LEU 90 -8.363 3.434 -8.044 782 HD22 LEU 90 1HD2 LEU 90 -9.766 2.961 -9.000 783 HD23 LEU 90 2HD2 LEU 90 -8.155 2.419 -9.471 784 H GLU 91 H GLU 91 -12.256 -0.145 -8.064 785 HA GLU 91 HA GLU 91 -12.590 0.853 -5.420 786 HB2 GLU 91 2HB GLU 91 -14.612 0.441 -7.628 787 HB3 GLU 91 3HB GLU 91 -14.941 1.291 -6.124 788 HG2 GLU 91 2HG GLU 91 -12.971 2.094 -8.261 789 HG3 GLU 91 3HG GLU 91 -14.499 2.883 -7.876 790 H GLU 92 H GLU 92 -13.212 -2.269 -6.793 791 HA GLU 92 HA GLU 92 -15.225 -3.189 -5.068 792 HB2 GLU 92 2HB GLU 92 -14.462 -4.464 -7.036 793 HB3 GLU 92 3HB GLU 92 -12.921 -4.769 -6.242 794 HG2 GLU 92 2HG GLU 92 -14.130 -5.976 -4.446 795 HG3 GLU 92 3HG GLU 92 -15.629 -5.744 -5.341 796 H PHE 93 H PHE 93 -11.674 -3.324 -4.686 797 HA PHE 93 HA PHE 93 -11.898 -4.517 -2.066 798 HB2 PHE 93 2HB PHE 93 -10.023 -5.049 -3.631 799 HB3 PHE 93 3HB PHE 93 -9.413 -3.413 -3.399 800 HD1 PHE 93 HD1 PHE 93 -10.547 -6.293 -1.303 801 HD2 PHE 93 HD2 PHE 93 -7.708 -3.171 -1.863 802 HE1 PHE 93 HE1 PHE 93 -9.333 -7.045 0.698 803 HE2 PHE 93 HE2 PHE 93 -6.491 -3.913 0.141 804 HZ PHE 93 HZ PHE 93 -7.304 -5.855 1.424 805 H SER 94 H SER 94 -11.511 -1.253 -3.314 806 HA SER 94 HA SER 94 -10.522 0.044 -1.029 807 HB2 SER 94 2HB SER 94 -11.430 2.093 -1.925 808 HB3 SER 94 3HB SER 94 -10.871 1.120 -3.284 809 HG SER 94 HG SER 94 -12.901 1.912 -3.778 810 H ARG 95 H ARG 95 -13.850 -0.743 -1.944 811 HA ARG 95 HA ARG 95 -15.244 0.263 0.238 812 HB2 ARG 95 2HB ARG 95 -15.767 -2.271 -1.306 813 HB3 ARG 95 3HB ARG 95 -16.914 -1.489 -0.220 814 HG2 ARG 95 2HG ARG 95 -16.684 0.573 -1.658 815 HG3 ARG 95 3HG ARG 95 -15.808 -0.441 -2.807 816 HD2 ARG 95 2HD ARG 95 -18.618 -0.868 -1.823 817 HD3 ARG 95 3HD ARG 95 -18.137 -0.262 -3.401 818 HE ARG 95 HE ARG 95 -17.049 -2.846 -2.765 819 HH11 ARG 95 1HH1 ARG 95 -19.723 -1.187 -4.172 820 HH12 ARG 95 2HH1 ARG 95 -20.248 -2.575 -5.059 821 HH21 ARG 95 1HH2 ARG 95 -17.743 -4.611 -3.873 822 HH22 ARG 95 2HH2 ARG 95 -19.144 -4.501 -4.884 823 H GLU 96 H GLU 96 -13.720 -2.932 -0.143 824 HA GLU 96 HA GLU 96 -14.463 -4.088 2.283 825 HB2 GLU 96 2HB GLU 96 -11.885 -4.530 0.754 826 HB3 GLU 96 3HB GLU 96 -12.589 -5.629 1.930 827 HG2 GLU 96 2HG GLU 96 -13.851 -4.847 -0.694 828 HG3 GLU 96 3HG GLU 96 -12.969 -6.341 -0.389 829 H VAL 97 H VAL 97 -11.505 -2.260 1.500 830 HA VAL 97 HA VAL 97 -10.260 -2.368 3.996 831 HB VAL 97 HB VAL 97 -10.198 -0.072 2.019 832 HG11 VAL 97 1HG1 VAL 97 -8.247 -0.816 4.204 833 HG12 VAL 97 2HG1 VAL 97 -9.332 0.575 4.210 834 HG13 VAL 97 3HG1 VAL 97 -8.031 0.478 3.023 835 HG21 VAL 97 3HG2 VAL 97 -9.574 -2.173 0.960 836 HG22 VAL 97 1HG2 VAL 97 -8.419 -2.506 2.252 837 HG23 VAL 97 2HG2 VAL 97 -8.154 -1.146 1.160 838 H ARG 98 H ARG 98 -12.606 0.018 2.767 839 HA ARG 98 HA ARG 98 -12.651 1.610 5.128 840 HB2 ARG 98 2HB ARG 98 -14.640 1.355 2.860 841 HB3 ARG 98 3HB ARG 98 -14.745 2.569 4.131 842 HG2 ARG 98 2HG ARG 98 -12.618 3.515 3.451 843 HG3 ARG 98 3HG ARG 98 -12.424 2.256 2.232 844 HD2 ARG 98 2HD ARG 98 -14.415 3.093 1.061 845 HD3 ARG 98 3HD ARG 98 -14.599 4.356 2.281 846 HE ARG 98 HE ARG 98 -12.174 4.924 1.475 847 HH11 ARG 98 1HH1 ARG 98 -14.864 3.998 -0.467 848 HH12 ARG 98 2HH1 ARG 98 -14.280 4.826 -1.868 849 HH21 ARG 98 1HH2 ARG 98 -11.436 5.989 -0.334 850 HH22 ARG 98 2HH2 ARG 98 -12.367 5.937 -1.794 851 H ARG 99 H ARG 99 -14.344 -1.299 4.184 852 HA ARG 99 HA ARG 99 -16.367 -1.249 6.175 853 HB2 ARG 99 2HB ARG 99 -15.076 -3.501 4.635 854 HB3 ARG 99 3HB ARG 99 -16.343 -3.788 5.818 855 HG2 ARG 99 2HG ARG 99 -16.624 -2.048 3.368 856 HG3 ARG 99 3HG ARG 99 -17.194 -3.711 3.513 857 HD2 ARG 99 2HD ARG 99 -18.127 -1.328 5.120 858 HD3 ARG 99 3HD ARG 99 -19.039 -2.193 3.881 859 HE ARG 99 HE ARG 99 -18.207 -3.897 6.027 860 HH11 ARG 99 1HH1 ARG 99 -20.630 -1.682 5.005 861 HH12 ARG 99 2HH1 ARG 99 -21.806 -2.288 6.114 862 HH21 ARG 99 1HH2 ARG 99 -19.715 -4.668 7.442 863 HH22 ARG 99 2HH2 ARG 99 -21.298 -3.961 7.481 864 H ARG 100 H ARG 100 -12.975 -2.046 6.301 865 HA ARG 100 HA ARG 100 -13.249 -3.417 8.874 866 HB2 ARG 100 2HB ARG 100 -10.629 -2.860 7.499 867 HB3 ARG 100 3HB ARG 100 -11.037 -4.165 8.607 868 HG2 ARG 100 2HG ARG 100 -12.628 -4.987 6.785 869 HG3 ARG 100 3HG ARG 100 -11.795 -3.855 5.718 870 HD2 ARG 100 2HD ARG 100 -10.711 -5.915 5.389 871 HD3 ARG 100 3HD ARG 100 -9.634 -5.005 6.449 872 HE ARG 100 HE ARG 100 -11.120 -6.405 8.205 873 HH11 ARG 100 1HH1 ARG 100 -9.291 -7.323 5.441 874 HH12 ARG 100 2HH1 ARG 100 -9.095 -8.956 5.971 875 HH21 ARG 100 1HH2 ARG 100 -10.865 -8.499 8.874 876 HH22 ARG 100 2HH2 ARG 100 -10.017 -9.623 7.872 877 H GLY 101 H GLY 101 -13.388 -0.329 8.189 878 HA2 GLY 101 2HA GLY 101 -13.030 1.578 9.433 879 HA3 GLY 101 3HA GLY 101 -12.397 0.558 10.716 880 H PHE 102 H PHE 102 -11.325 1.249 7.384 881 HA PHE 102 HA PHE 102 -8.798 2.305 8.477 882 HB2 PHE 102 2HB PHE 102 -9.223 0.215 6.394 883 HB3 PHE 102 3HB PHE 102 -7.898 1.346 6.148 884 HD1 PHE 102 HD1 PHE 102 -6.142 1.570 7.920 885 HD2 PHE 102 HD2 PHE 102 -9.007 -1.589 7.904 886 HE1 PHE 102 HE1 PHE 102 -4.704 0.253 9.426 887 HE2 PHE 102 HE2 PHE 102 -7.573 -2.903 9.411 888 HZ PHE 102 HZ PHE 102 -5.415 -1.984 10.174 889 H GLU 103 H GLU 103 -7.569 3.618 6.893 890 HA GLU 103 HA GLU 103 -9.372 5.353 5.342 891 HB2 GLU 103 2HB GLU 103 -8.040 6.409 7.150 892 HB3 GLU 103 3HB GLU 103 -6.563 5.867 6.366 893 HG2 GLU 103 2HG GLU 103 -6.809 8.128 5.798 894 HG3 GLU 103 3HG GLU 103 -7.263 7.218 4.362 895 H VAL 104 H VAL 104 -9.389 4.913 3.185 896 HA VAL 104 HA VAL 104 -6.872 3.983 1.951 897 HB VAL 104 HB VAL 104 -8.389 2.093 2.156 898 HG11 VAL 104 1HG1 VAL 104 -10.331 3.706 0.499 899 HG12 VAL 104 2HG1 VAL 104 -10.517 3.292 2.204 900 HG13 VAL 104 3HG1 VAL 104 -10.534 2.021 0.981 901 HG21 VAL 104 3HG2 VAL 104 -8.127 3.058 -0.693 902 HG22 VAL 104 1HG2 VAL 104 -8.447 1.396 -0.203 903 HG23 VAL 104 2HG2 VAL 104 -6.915 2.161 0.221 904 H ARG 105 H ARG 105 -6.200 4.969 0.187 905 HA ARG 105 HA ARG 105 -8.044 6.712 -1.332 906 HB2 ARG 105 2HB ARG 105 -5.062 7.043 -0.876 907 HB3 ARG 105 3HB ARG 105 -6.038 8.072 -1.916 908 HG2 ARG 105 2HG ARG 105 -6.330 7.762 1.072 909 HG3 ARG 105 3HG ARG 105 -5.636 9.145 0.224 910 HD2 ARG 105 2HD ARG 105 -7.778 9.644 -0.794 911 HD3 ARG 105 3HD ARG 105 -8.488 8.191 -0.092 912 HE ARG 105 HE ARG 105 -7.414 10.233 1.706 913 HH11 ARG 105 1HH1 ARG 105 -10.166 8.644 0.358 914 HH12 ARG 105 2HH1 ARG 105 -11.230 9.233 1.590 915 HH21 ARG 105 1HH2 ARG 105 -8.791 10.973 3.256 916 HH22 ARG 105 2HH2 ARG 105 -10.457 10.514 3.218 917 H THR 106 H THR 106 -8.375 6.078 -3.397 918 HA THR 106 HA THR 106 -6.680 3.933 -4.476 919 HB THR 106 HB THR 106 -8.491 3.600 -6.143 920 HG1 THR 106 HG1 THR 106 -10.400 4.769 -5.958 921 HG21 THR 106 3HG2 THR 106 -9.414 3.609 -3.262 922 HG22 THR 106 1HG2 THR 106 -8.508 2.321 -4.058 923 HG23 THR 106 2HG2 THR 106 -10.153 2.691 -4.576 924 H VAL 107 H VAL 107 -5.594 4.050 -6.395 925 HA VAL 107 HA VAL 107 -5.692 6.589 -7.893 926 HB VAL 107 HB VAL 107 -3.245 6.536 -8.174 927 HG11 VAL 107 1HG1 VAL 107 -2.644 7.211 -5.873 928 HG12 VAL 107 2HG1 VAL 107 -4.164 6.535 -5.293 929 HG13 VAL 107 3HG1 VAL 107 -4.175 7.908 -6.401 930 HG21 VAL 107 3HG2 VAL 107 -3.312 4.250 -6.192 931 HG22 VAL 107 1HG2 VAL 107 -1.860 5.057 -6.784 932 HG23 VAL 107 2HG2 VAL 107 -2.870 4.132 -7.896 933 H THR 108 H THR 108 -5.557 6.434 -10.093 934 HA THR 108 HA THR 108 -5.539 3.707 -11.226 935 HB THR 108 HB THR 108 -6.706 4.718 -13.186 936 HG1 THR 108 HG1 THR 108 -6.495 6.838 -13.276 937 HG21 THR 108 3HG2 THR 108 -8.050 5.159 -10.511 938 HG22 THR 108 1HG2 THR 108 -8.013 3.648 -11.421 939 HG23 THR 108 2HG2 THR 108 -8.877 5.044 -12.064 940 H SER 109 H SER 109 -3.691 6.556 -11.127 941 HA SER 109 HA SER 109 -2.069 5.645 -13.415 942 HB2 SER 109 2HB SER 109 -2.885 8.525 -12.897 943 HB3 SER 109 3HB SER 109 -1.756 7.994 -14.143 944 HG SER 109 HG SER 109 -4.190 8.319 -14.592 945 HA PRO 110 HA PRO 110 1.379 6.018 -10.635 946 HB2 PRO 110 2HB PRO 110 3.306 6.929 -12.425 947 HB3 PRO 110 3HB PRO 110 2.861 5.237 -12.186 948 HG2 PRO 110 2HG PRO 110 1.955 7.157 -14.297 949 HG3 PRO 110 3HG PRO 110 2.365 5.437 -14.445 950 HD2 PRO 110 2HD PRO 110 -0.184 6.260 -14.397 951 HD3 PRO 110 3HD PRO 110 0.306 4.748 -13.601 952 H ASP 111 H ASP 111 0.973 8.743 -12.913 953 HA ASP 111 HA ASP 111 2.214 10.732 -11.364 954 HB2 ASP 111 2HB ASP 111 -0.134 11.077 -13.249 955 HB3 ASP 111 3HB ASP 111 1.008 12.327 -12.753 956 H ASP 112 H ASP 112 -1.219 9.805 -11.558 957 HA ASP 112 HA ASP 112 -2.247 11.540 -9.620 958 HB2 ASP 112 2HB ASP 112 -3.589 10.177 -11.226 959 HB3 ASP 112 3HB ASP 112 -3.205 8.739 -10.287 960 H PHE 113 H PHE 113 -0.798 8.327 -9.302 961 HA PHE 113 HA PHE 113 -1.156 7.902 -6.563 962 HB2 PHE 113 2HB PHE 113 -0.360 6.082 -7.865 963 HB3 PHE 113 3HB PHE 113 0.998 7.016 -8.484 964 HD1 PHE 113 HD1 PHE 113 -0.371 5.498 -5.371 965 HD2 PHE 113 HD2 PHE 113 3.083 6.944 -7.412 966 HE1 PHE 113 HE1 PHE 113 1.063 4.619 -3.575 967 HE2 PHE 113 HE2 PHE 113 4.515 6.066 -5.617 968 HZ PHE 113 HZ PHE 113 3.506 4.902 -3.697 969 H LYS 114 H LYS 114 1.597 9.423 -8.248 970 HA LYS 114 HA LYS 114 3.129 10.135 -6.037 971 HB2 LYS 114 2HB LYS 114 3.884 10.334 -8.381 972 HB3 LYS 114 3HB LYS 114 2.772 11.672 -8.625 973 HG2 LYS 114 2HG LYS 114 4.008 13.010 -6.990 974 HG3 LYS 114 3HG LYS 114 5.112 11.660 -6.718 975 HD2 LYS 114 2HD LYS 114 5.784 11.756 -9.092 976 HD3 LYS 114 3HD LYS 114 4.713 13.140 -9.326 977 HE2 LYS 114 2HE LYS 114 7.070 13.040 -7.438 978 HE3 LYS 114 3HE LYS 114 7.062 13.814 -9.020 979 HZ1 LYS 114 3HZ LYS 114 6.723 15.429 -7.283 980 HZ2 LYS 114 1HZ LYS 114 5.386 14.582 -6.690 981 HZ3 LYS 114 2HZ LYS 114 5.315 15.311 -8.218 982 H LYS 115 H LYS 115 0.451 11.883 -7.573 983 HA LYS 115 HA LYS 115 0.527 14.209 -6.010 984 HB2 LYS 115 2HB LYS 115 -1.891 12.857 -7.234 985 HB3 LYS 115 3HB LYS 115 -1.826 14.524 -6.672 986 HG2 LYS 115 2HG LYS 115 -0.259 13.332 -8.958 987 HG3 LYS 115 3HG LYS 115 -1.613 14.459 -9.075 988 HD2 LYS 115 2HD LYS 115 -0.296 16.177 -7.938 989 HD3 LYS 115 3HD LYS 115 1.050 15.049 -7.763 990 HE2 LYS 115 2HE LYS 115 1.272 14.920 -10.191 991 HE3 LYS 115 3HE LYS 115 -0.103 16.010 -10.386 992 HZ1 LYS 115 3HZ LYS 115 1.157 17.726 -9.226 993 HZ2 LYS 115 1HZ LYS 115 1.973 17.198 -10.611 994 HZ3 LYS 115 2HZ LYS 115 2.483 16.682 -9.082 995 H SER 116 H SER 116 -1.527 11.312 -5.543 996 HA SER 116 HA SER 116 -2.694 12.125 -3.124 997 HB2 SER 116 2HB SER 116 -3.572 10.260 -4.458 998 HB3 SER 116 3HB SER 116 -2.136 9.306 -4.091 999 HG SER 116 HG SER 116 -3.250 8.659 -2.435 1000 H LEU 117 H LEU 117 0.180 10.113 -3.678 1001 HA LEU 117 HA LEU 117 0.744 9.348 -1.073 1002 HB2 LEU 117 2HB LEU 117 1.855 8.417 -3.041 1003 HB3 LEU 117 3HB LEU 117 2.666 9.945 -3.328 1004 HG LEU 117 HG LEU 117 3.870 9.663 -1.155 1005 HD11 LEU 117 1HD1 LEU 117 2.292 8.195 -0.029 1006 HD12 LEU 117 2HD1 LEU 117 3.894 7.462 -0.093 1007 HD13 LEU 117 3HD1 LEU 117 2.628 6.913 -1.193 1008 HD21 LEU 117 3HD2 LEU 117 4.923 9.045 -3.273 1009 HD22 LEU 117 1HD2 LEU 117 4.243 7.423 -3.149 1010 HD23 LEU 117 2HD2 LEU 117 5.436 7.974 -1.971 1011 H GLU 118 H GLU 118 2.262 12.089 -2.808 1012 HA GLU 118 HA GLU 118 3.815 12.981 -0.663 1013 HB2 GLU 118 2HB GLU 118 2.718 14.624 -2.942 1014 HB3 GLU 118 3HB GLU 118 4.091 15.048 -1.930 1015 HG2 GLU 118 2HG GLU 118 5.372 13.216 -2.803 1016 HG3 GLU 118 3HG GLU 118 3.977 12.605 -3.691 1017 H ARG 119 H ARG 119 0.510 13.975 -1.601 1018 HA ARG 119 HA ARG 119 0.210 16.007 0.334 1019 HB2 ARG 119 2HB ARG 119 -1.694 14.316 -1.228 1020 HB3 ARG 119 3HB ARG 119 -2.325 15.181 0.161 1021 HG2 ARG 119 2HG ARG 119 -2.741 16.536 -1.719 1022 HG3 ARG 119 3HG ARG 119 -1.408 17.293 -0.854 1023 HD2 ARG 119 2HD ARG 119 -0.793 15.391 -3.071 1024 HD3 ARG 119 3HD ARG 119 -1.366 17.002 -3.479 1025 HE ARG 119 HE ARG 119 0.622 17.604 -1.836 1026 HH11 ARG 119 1HH1 ARG 119 0.557 15.186 -4.285 1027 HH12 ARG 119 2HH1 ARG 119 2.211 15.435 -4.734 1028 HH21 ARG 119 1HH2 ARG 119 2.735 17.938 -2.449 1029 HH22 ARG 119 2HH2 ARG 119 3.414 16.983 -3.720 1030 H LEU 120 H LEU 120 -0.555 12.522 0.509 1031 HA LEU 120 HA LEU 120 -1.591 12.537 3.129 1032 HB2 LEU 120 2HB LEU 120 -0.237 10.328 1.578 1033 HB3 LEU 120 3HB LEU 120 -1.047 10.088 3.116 1034 HG LEU 120 HG LEU 120 -2.363 11.016 0.552 1035 HD11 LEU 120 1HD1 LEU 120 -1.751 8.659 0.483 1036 HD12 LEU 120 2HD1 LEU 120 -3.500 8.848 0.611 1037 HD13 LEU 120 3HD1 LEU 120 -2.556 8.388 2.029 1038 HD21 LEU 120 3HD2 LEU 120 -3.575 10.425 3.256 1039 HD22 LEU 120 1HD2 LEU 120 -4.468 10.805 1.783 1040 HD23 LEU 120 2HD2 LEU 120 -3.418 12.017 2.514 1041 H ILE 121 H ILE 121 1.724 12.375 1.958 1042 HA ILE 121 HA ILE 121 3.072 11.601 4.263 1043 HB ILE 121 HB ILE 121 3.928 13.637 2.188 1044 HG12 ILE 121 2HG1 ILE 121 4.582 10.687 2.489 1045 HG13 ILE 121 3HG1 ILE 121 3.477 11.374 1.304 1046 HG21 ILE 121 1HG2 ILE 121 5.219 13.941 4.243 1047 HG22 ILE 121 2HG2 ILE 121 6.225 13.253 2.969 1048 HG23 ILE 121 3HG2 ILE 121 5.614 12.221 4.262 1049 HD11 ILE 121 3HD1 ILE 121 5.326 12.570 0.265 1050 HD12 ILE 121 1HD1 ILE 121 5.630 10.834 0.317 1051 HD13 ILE 121 2HD1 ILE 121 6.435 11.903 1.465 1052 H ARG 122 H ARG 122 1.749 14.784 3.426 1053 HA ARG 122 HA ARG 122 2.765 16.139 5.729 1054 HB2 ARG 122 2HB ARG 122 0.497 16.776 3.833 1055 HB3 ARG 122 3HB ARG 122 0.965 17.838 5.152 1056 HG2 ARG 122 2HG ARG 122 2.780 16.982 2.902 1057 HG3 ARG 122 3HG ARG 122 1.906 18.513 2.975 1058 HD2 ARG 122 2HD ARG 122 3.984 17.565 4.955 1059 HD3 ARG 122 3HD ARG 122 4.235 18.770 3.692 1060 HE ARG 122 HE ARG 122 2.104 19.363 5.566 1061 HH11 ARG 122 1HH1 ARG 122 5.437 19.770 4.792 1062 HH12 ARG 122 2HH1 ARG 122 5.605 21.180 5.774 1063 HH21 ARG 122 1HH2 ARG 122 2.326 21.191 6.810 1064 HH22 ARG 122 2HH2 ARG 122 3.857 21.992 6.886 1065 H GLU 123 H GLU 123 -0.237 14.435 5.014 1066 HA GLU 123 HA GLU 123 -1.702 15.271 7.282 1067 HB2 GLU 123 2HB GLU 123 -2.043 12.705 5.713 1068 HB3 GLU 123 3HB GLU 123 -3.258 13.496 6.709 1069 HG2 GLU 123 2HG GLU 123 -2.064 14.582 4.159 1070 HG3 GLU 123 3HG GLU 123 -3.670 13.880 4.341 1071 H VAL 124 H VAL 124 0.423 12.477 6.756 1072 HA VAL 124 HA VAL 124 -0.061 11.584 9.519 1073 HB VAL 124 HB VAL 124 -0.285 9.872 7.784 1074 HG11 VAL 124 1HG1 VAL 124 2.636 10.377 7.198 1075 HG12 VAL 124 2HG1 VAL 124 1.277 10.722 6.127 1076 HG13 VAL 124 3HG1 VAL 124 1.672 9.053 6.540 1077 HG21 VAL 124 3HG2 VAL 124 1.156 8.159 8.793 1078 HG22 VAL 124 1HG2 VAL 124 0.417 9.190 10.018 1079 HG23 VAL 124 2HG2 VAL 124 2.109 9.418 9.576 1080 H GLY 125 H GLY 125 2.608 12.573 7.381 1081 HA2 GLY 125 2HA GLY 125 4.591 12.152 9.470 1082 HA3 GLY 125 3HA GLY 125 4.892 12.711 7.833 1083 H SER 126 H SER 126 3.778 13.709 11.025 1084 HA SER 126 HA SER 126 3.688 16.504 10.507 1085 HB2 SER 126 2HB SER 126 4.097 15.041 13.136 1086 HB3 SER 126 3HB SER 126 3.669 16.743 12.971 1087 HG SER 126 HG SER 126 1.669 16.202 12.591 1088 H LEU 127 H LEU 127 5.316 17.946 10.295 1089 HA LEU 127 HA LEU 127 8.030 17.142 10.329 1090 HB2 LEU 127 2HB LEU 127 8.612 19.382 9.779 1091 HB3 LEU 127 3HB LEU 127 7.138 18.991 8.920 1092 HG LEU 127 HG LEU 127 7.139 20.576 11.498 1093 HD11 LEU 127 1HD1 LEU 127 6.964 22.593 10.148 1094 HD12 LEU 127 2HD1 LEU 127 7.170 21.644 8.676 1095 HD13 LEU 127 3HD1 LEU 127 8.489 21.764 9.842 1096 HD21 LEU 127 3HD2 LEU 127 5.091 20.226 9.302 1097 HD22 LEU 127 1HD2 LEU 127 4.937 21.339 10.663 1098 HD23 LEU 127 2HD2 LEU 127 4.997 19.602 10.949 1099 H GLU 128 H GLU 128 6.014 18.071 12.895 1100 HA GLU 128 HA GLU 128 7.787 19.300 14.683 1101 HB2 GLU 128 2HB GLU 128 5.393 17.515 15.106 1102 HB3 GLU 128 3HB GLU 128 6.289 18.188 16.460 1103 HG2 GLU 128 2HG GLU 128 5.178 19.943 14.294 1104 HG3 GLU 128 3HG GLU 128 4.187 19.413 15.652 1105 H HIS 129 H HIS 129 9.830 18.436 14.794 1106 HA HIS 129 HA HIS 129 10.167 15.625 15.568 1107 HB2 HIS 129 2HB HIS 129 12.329 17.709 15.176 1108 HB3 HIS 129 3HB HIS 129 12.523 15.961 15.219 1109 HD1 HIS 129 HD1 HIS 129 10.787 14.843 13.164 1110 HD2 HIS 129 HD2 HIS 129 12.552 18.566 12.632 1111 HE1 HIS 129 HE1 HIS 129 10.774 15.243 10.691 1112 HE2 HIS 129 HE2 HIS 129 11.709 17.557 10.406 1113 H HIS 130 H HIS 130 10.966 18.867 16.765 1114 HA HIS 130 HA HIS 130 10.843 17.839 19.530 1115 HB2 HIS 130 2HB HIS 130 12.566 20.070 18.416 1116 HB3 HIS 130 3HB HIS 130 12.362 19.751 20.137 1117 HD1 HIS 130 HD1 HIS 130 14.317 18.727 17.206 1118 HD2 HIS 130 HD2 HIS 130 13.449 17.189 20.968 1119 HE1 HIS 130 HE1 HIS 130 16.014 16.923 17.603 1120 HE2 HIS 130 HE2 HIS 130 15.550 16.097 19.931 1121 H HIS 131 H HIS 131 9.415 18.845 20.875 1122 HA HIS 131 HA HIS 131 7.511 20.606 19.569 1123 HB2 HIS 131 2HB HIS 131 7.477 19.196 22.240 1124 HB3 HIS 131 3HB HIS 131 6.185 20.260 21.691 1125 HD1 HIS 131 HD1 HIS 131 7.620 16.857 21.165 1126 HD2 HIS 131 HD2 HIS 131 4.619 19.250 19.566 1127 HE1 HIS 131 HE1 HIS 131 6.222 15.331 19.747 1128 HE2 HIS 131 HE2 HIS 131 4.359 16.775 18.871 1129 H HIS 132 H HIS 132 6.644 22.511 20.567 1130 HA HIS 132 HA HIS 132 8.772 24.259 21.466 1131 HB2 HIS 132 2HB HIS 132 5.865 24.911 20.910 1132 HB3 HIS 132 3HB HIS 132 7.191 26.061 21.058 1133 HD1 HIS 132 HD1 HIS 132 5.643 23.620 18.703 1134 HD2 HIS 132 HD2 HIS 132 8.858 26.250 18.782 1135 HE1 HIS 132 HE1 HIS 132 6.418 23.798 16.332 1136 HE2 HIS 132 HE2 HIS 132 8.452 25.267 16.426 1137 H HIS 133 H HIS 133 8.697 25.575 23.334 1138 HA HIS 133 HA HIS 133 6.713 24.834 25.398 1139 HB2 HIS 133 2HB HIS 133 9.670 25.305 25.886 1140 HB3 HIS 133 3HB HIS 133 8.462 24.951 27.117 1141 HD1 HIS 133 HD1 HIS 133 11.000 23.325 25.242 1142 HD2 HIS 133 HD2 HIS 133 7.172 22.266 26.470 1143 HE1 HIS 133 HE1 HIS 133 10.913 20.820 25.095 1144 HE2 HIS 133 HE2 HIS 133 8.600 20.200 25.864 1145 H HIS 134 H HIS 134 6.014 26.519 26.742 1146 HA HIS 134 HA HIS 134 6.495 29.198 25.688 1147 HB2 HIS 134 2HB HIS 134 4.597 28.315 27.879 1148 HB3 HIS 134 3HB HIS 134 4.604 29.881 27.073 1149 HD1 HIS 134 HD1 HIS 134 2.907 26.753 27.003 1150 HD2 HIS 134 HD2 HIS 134 4.110 29.477 24.106 1151 HE1 HIS 134 HE1 HIS 134 1.505 26.253 24.986 1152 HE2 HIS 134 HE2 HIS 134 2.393 27.773 23.195 Start of MODEL 6 1 H1 MET 1 1H MET 1 7.031 4.136 6.953 2 H2 MET 1 2H MET 1 7.289 3.303 8.399 3 H3 MET 1 3H MET 1 8.120 4.741 8.100 4 HA MET 1 HA MET 1 6.342 5.116 9.667 5 HB2 MET 1 2HB MET 1 5.893 6.317 6.920 6 HB3 MET 1 3HB MET 1 5.114 6.903 8.384 7 HG2 MET 1 2HG MET 1 7.296 7.435 9.340 8 HG3 MET 1 3HG MET 1 8.084 6.841 7.878 9 HE1 MET 1 3HE MET 1 9.396 9.183 7.655 10 HE2 MET 1 1HE MET 1 8.600 9.733 9.128 11 HE3 MET 1 2HE MET 1 8.581 10.746 7.686 12 H ASN 2 H ASN 2 3.805 5.717 9.489 13 HA ASN 2 HA ASN 2 2.540 3.136 9.175 14 HB2 ASN 2 2HB ASN 2 0.537 4.288 10.147 15 HB3 ASN 2 3HB ASN 2 1.978 4.379 11.150 16 HD21 ASN 2 1HD2 ASN 2 -0.432 6.101 10.990 17 HD22 ASN 2 2HD2 ASN 2 0.181 7.695 10.740 18 H ILE 3 H ILE 3 2.935 3.198 6.774 19 HA ILE 3 HA ILE 3 0.474 3.998 5.454 20 HB ILE 3 HB ILE 3 1.776 6.002 5.123 21 HG12 ILE 3 2HG1 ILE 3 1.815 4.353 2.575 22 HG13 ILE 3 3HG1 ILE 3 0.402 5.183 3.218 23 HG21 ILE 3 1HG2 ILE 3 3.945 4.246 3.963 24 HG22 ILE 3 2HG2 ILE 3 4.005 5.077 5.518 25 HG23 ILE 3 3HG2 ILE 3 3.960 6.008 4.021 26 HD11 ILE 3 3HD1 ILE 3 1.535 7.326 2.923 27 HD12 ILE 3 1HD1 ILE 3 1.411 6.433 1.406 28 HD13 ILE 3 2HD1 ILE 3 2.946 6.487 2.274 29 H VAL 4 H VAL 4 -0.151 2.506 4.019 30 HA VAL 4 HA VAL 4 1.811 0.477 3.134 31 HB VAL 4 HB VAL 4 -1.129 0.054 3.744 32 HG11 VAL 4 1HG1 VAL 4 -0.624 -2.343 3.421 33 HG12 VAL 4 2HG1 VAL 4 1.005 -1.914 2.896 34 HG13 VAL 4 3HG1 VAL 4 -0.392 -1.402 1.948 35 HG21 VAL 4 3HG2 VAL 4 1.320 -0.868 5.267 36 HG22 VAL 4 1HG2 VAL 4 -0.352 -1.297 5.640 37 HG23 VAL 4 2HG2 VAL 4 0.182 0.379 5.783 38 H ILE 5 H ILE 5 1.971 0.134 0.997 39 HA ILE 5 HA ILE 5 -0.043 1.368 -0.788 40 HB ILE 5 HB ILE 5 2.866 0.757 -1.384 41 HG12 ILE 5 2HG1 ILE 5 1.504 3.430 -0.917 42 HG13 ILE 5 3HG1 ILE 5 2.535 2.608 0.250 43 HG21 ILE 5 1HG2 ILE 5 1.438 0.624 -3.376 44 HG22 ILE 5 2HG2 ILE 5 2.506 2.024 -3.450 45 HG23 ILE 5 3HG2 ILE 5 0.806 2.235 -3.035 46 HD11 ILE 5 3HD1 ILE 5 3.718 4.389 -0.910 47 HD12 ILE 5 1HD1 ILE 5 3.401 3.603 -2.457 48 HD13 ILE 5 2HD1 ILE 5 4.429 2.814 -1.260 49 H VAL 6 H VAL 6 -1.382 -0.111 -1.657 50 HA VAL 6 HA VAL 6 -0.468 -2.880 -2.014 51 HB VAL 6 HB VAL 6 -3.264 -1.745 -2.298 52 HG11 VAL 6 1HG1 VAL 6 -3.990 -4.090 -2.169 53 HG12 VAL 6 2HG1 VAL 6 -2.305 -4.610 -2.145 54 HG13 VAL 6 3HG1 VAL 6 -2.959 -3.804 -3.571 55 HG21 VAL 6 3HG2 VAL 6 -3.693 -2.771 -0.097 56 HG22 VAL 6 1HG2 VAL 6 -2.470 -1.503 -0.011 57 HG23 VAL 6 2HG2 VAL 6 -1.985 -3.199 0.028 58 H VAL 7 H VAL 7 0.255 -3.523 -3.949 59 HA VAL 7 HA VAL 7 -0.611 -2.050 -6.365 60 HB VAL 7 HB VAL 7 1.925 -3.664 -5.985 61 HG11 VAL 7 1HG1 VAL 7 1.076 -1.855 -8.258 62 HG12 VAL 7 2HG1 VAL 7 1.158 -3.616 -8.311 63 HG13 VAL 7 3HG1 VAL 7 2.633 -2.672 -8.109 64 HG21 VAL 7 3HG2 VAL 7 1.559 -0.664 -6.038 65 HG22 VAL 7 1HG2 VAL 7 3.097 -1.522 -5.937 66 HG23 VAL 7 2HG2 VAL 7 1.936 -1.632 -4.612 67 H PHE 8 H PHE 8 -2.138 -3.150 -7.466 68 HA PHE 8 HA PHE 8 -2.161 -6.065 -7.539 69 HB2 PHE 8 2HB PHE 8 -3.974 -3.938 -8.681 70 HB3 PHE 8 3HB PHE 8 -4.158 -5.635 -9.107 71 HD1 PHE 8 HD2 PHE 8 -4.312 -3.214 -6.319 72 HD2 PHE 8 HD1 PHE 8 -5.167 -7.184 -7.617 73 HE1 PHE 8 HE2 PHE 8 -5.680 -3.580 -4.306 74 HE2 PHE 8 HE1 PHE 8 -6.537 -7.546 -5.606 75 HZ PHE 8 HZ PHE 8 -6.794 -5.745 -3.949 76 H SER 9 H SER 9 0.187 -5.130 -8.630 77 HA SER 9 HA SER 9 0.006 -6.204 -11.322 78 HB2 SER 9 2HB SER 9 1.089 -3.416 -10.824 79 HB3 SER 9 3HB SER 9 1.314 -4.316 -12.323 80 HG SER 9 HG SER 9 -1.281 -4.345 -11.706 81 H THR 10 H THR 10 1.443 -7.789 -11.220 82 HA THR 10 HA THR 10 3.769 -7.742 -9.539 83 HB THR 10 HB THR 10 4.315 -9.925 -10.604 84 HG1 THR 10 HG1 THR 10 2.819 -10.761 -12.135 85 HG21 THR 10 3HG2 THR 10 2.814 -9.860 -8.669 86 HG22 THR 10 1HG2 THR 10 2.338 -11.139 -9.787 87 HG23 THR 10 2HG2 THR 10 1.431 -9.628 -9.740 88 H ASP 11 H ASP 11 3.180 -6.453 -12.591 89 HA ASP 11 HA ASP 11 5.484 -6.941 -14.061 90 HB2 ASP 11 2HB ASP 11 3.848 -4.397 -13.977 91 HB3 ASP 11 3HB ASP 11 4.950 -4.873 -15.270 92 H GLU 12 H GLU 12 7.549 -6.400 -13.862 93 HA GLU 12 HA GLU 12 8.671 -5.130 -11.667 94 HB2 GLU 12 2HB GLU 12 10.759 -5.064 -12.955 95 HB3 GLU 12 3HB GLU 12 9.936 -6.607 -13.156 96 HG2 GLU 12 2HG GLU 12 9.106 -5.914 -15.331 97 HG3 GLU 12 3HG GLU 12 9.845 -4.327 -15.130 98 H GLU 13 H GLU 13 7.871 -3.739 -14.837 99 HA GLU 13 HA GLU 13 9.068 -1.203 -14.377 100 HB2 GLU 13 2HB GLU 13 6.937 -2.063 -16.344 101 HB3 GLU 13 3HB GLU 13 7.749 -0.503 -16.380 102 HG2 GLU 13 2HG GLU 13 9.178 -3.143 -16.594 103 HG3 GLU 13 3HG GLU 13 8.632 -2.203 -17.981 104 H THR 14 H THR 14 5.729 -2.374 -14.052 105 HA THR 14 HA THR 14 4.534 0.071 -13.355 106 HB THR 14 HB THR 14 3.750 -2.671 -12.315 107 HG1 THR 14 HG1 THR 14 2.188 -2.391 -14.166 108 HG21 THR 14 3HG2 THR 14 1.505 -1.689 -12.103 109 HG22 THR 14 1HG2 THR 14 2.134 -0.126 -12.627 110 HG23 THR 14 2HG2 THR 14 2.673 -0.829 -11.101 111 H LEU 15 H LEU 15 5.832 -2.488 -11.221 112 HA LEU 15 HA LEU 15 5.533 -1.051 -8.804 113 HB2 LEU 15 2HB LEU 15 5.844 -3.495 -8.949 114 HB3 LEU 15 3HB LEU 15 7.494 -3.249 -9.493 115 HG LEU 15 HG LEU 15 8.075 -2.259 -7.322 116 HD11 LEU 15 1HD1 LEU 15 5.953 -1.253 -6.723 117 HD12 LEU 15 2HD1 LEU 15 6.467 -2.365 -5.452 118 HD13 LEU 15 3HD1 LEU 15 5.205 -2.845 -6.587 119 HD21 LEU 15 3HD2 LEU 15 8.369 -4.650 -7.610 120 HD22 LEU 15 1HD2 LEU 15 6.698 -4.938 -7.123 121 HD23 LEU 15 2HD2 LEU 15 7.858 -4.300 -5.960 122 H ARG 16 H ARG 16 8.072 -1.146 -11.206 123 HA ARG 16 HA ARG 16 10.166 0.169 -9.938 124 HB2 ARG 16 2HB ARG 16 10.335 -0.848 -12.144 125 HB3 ARG 16 3HB ARG 16 9.214 0.327 -12.803 126 HG2 ARG 16 2HG ARG 16 10.864 2.109 -12.390 127 HG3 ARG 16 3HG ARG 16 11.997 0.889 -11.791 128 HD2 ARG 16 2HD ARG 16 11.886 -0.263 -13.962 129 HD3 ARG 16 3HD ARG 16 10.776 0.968 -14.555 130 HE ARG 16 HE ARG 16 13.124 2.226 -13.690 131 HH11 ARG 16 1HH1 ARG 16 12.039 0.087 -16.180 132 HH12 ARG 16 2HH1 ARG 16 13.241 0.623 -17.303 133 HH21 ARG 16 1HH2 ARG 16 14.657 2.895 -15.147 134 HH22 ARG 16 2HH2 ARG 16 14.702 2.197 -16.728 135 H LYS 17 H LYS 17 7.317 1.536 -11.570 136 HA LYS 17 HA LYS 17 7.927 4.249 -11.468 137 HB2 LYS 17 2HB LYS 17 5.197 3.002 -11.048 138 HB3 LYS 17 3HB LYS 17 5.511 4.654 -11.560 139 HG2 LYS 17 2HG LYS 17 6.182 2.158 -13.114 140 HG3 LYS 17 3HG LYS 17 4.844 3.260 -13.440 141 HD2 LYS 17 2HD LYS 17 6.411 5.055 -13.937 142 HD3 LYS 17 3HD LYS 17 7.773 4.010 -13.523 143 HE2 LYS 17 2HE LYS 17 7.207 2.521 -15.376 144 HE3 LYS 17 3HE LYS 17 5.816 3.531 -15.777 145 HZ1 LYS 17 3HZ LYS 17 8.663 4.376 -15.871 146 HZ2 LYS 17 1HZ LYS 17 7.335 5.362 -16.232 147 HZ3 LYS 17 2HZ LYS 17 7.687 4.027 -17.206 148 H PHE 18 H PHE 18 6.314 2.265 -8.986 149 HA PHE 18 HA PHE 18 5.907 4.275 -7.071 150 HB2 PHE 18 2HB PHE 18 6.465 1.326 -6.629 151 HB3 PHE 18 3HB PHE 18 5.814 2.426 -5.419 152 HD1 PHE 18 HD1 PHE 18 5.107 0.670 -8.573 153 HD2 PHE 18 HD2 PHE 18 3.506 3.086 -5.455 154 HE1 PHE 18 HE1 PHE 18 2.832 0.186 -9.371 155 HE2 PHE 18 HE2 PHE 18 1.230 2.607 -6.250 156 HZ PHE 18 HZ PHE 18 0.893 1.157 -8.211 157 H LYS 19 H LYS 19 8.684 2.145 -7.624 158 HA LYS 19 HA LYS 19 10.228 2.953 -5.413 159 HB2 LYS 19 2HB LYS 19 11.157 1.904 -8.097 160 HB3 LYS 19 3HB LYS 19 12.142 1.992 -6.640 161 HG2 LYS 19 2HG LYS 19 10.650 0.425 -5.516 162 HG3 LYS 19 3HG LYS 19 9.628 0.353 -6.953 163 HD2 LYS 19 2HD LYS 19 11.498 -0.582 -8.236 164 HD3 LYS 19 3HD LYS 19 12.527 -0.501 -6.804 165 HE2 LYS 19 2HE LYS 19 11.026 -2.060 -5.644 166 HE3 LYS 19 3HE LYS 19 10.001 -2.140 -7.076 167 HZ1 LYS 19 3HZ LYS 19 11.527 -4.024 -6.908 168 HZ2 LYS 19 1HZ LYS 19 12.850 -2.973 -6.971 169 HZ3 LYS 19 2HZ LYS 19 11.820 -3.114 -8.305 170 H ASP 20 H ASP 20 10.095 4.205 -8.743 171 HA ASP 20 HA ASP 20 12.147 6.117 -8.475 172 HB2 ASP 20 2HB ASP 20 9.763 5.972 -10.324 173 HB3 ASP 20 3HB ASP 20 10.944 7.274 -10.416 174 H ILE 21 H ILE 21 8.649 6.382 -7.903 175 HA ILE 21 HA ILE 21 8.664 9.165 -7.323 176 HB ILE 21 HB ILE 21 6.674 7.038 -6.500 177 HG12 ILE 21 2HG1 ILE 21 6.633 9.013 -8.806 178 HG13 ILE 21 3HG1 ILE 21 6.959 7.289 -8.946 179 HG21 ILE 21 1HG2 ILE 21 6.456 8.972 -5.051 180 HG22 ILE 21 2HG2 ILE 21 5.095 8.910 -6.170 181 HG23 ILE 21 3HG2 ILE 21 6.414 10.049 -6.447 182 HD11 ILE 21 3HD1 ILE 21 4.694 7.772 -9.607 183 HD12 ILE 21 1HD1 ILE 21 4.376 8.553 -8.059 184 HD13 ILE 21 2HD1 ILE 21 4.691 6.819 -8.124 185 H ILE 22 H ILE 22 8.665 6.312 -5.173 186 HA ILE 22 HA ILE 22 8.604 7.758 -2.750 187 HB ILE 22 HB ILE 22 9.632 4.959 -3.272 188 HG12 ILE 22 2HG1 ILE 22 6.942 5.930 -2.249 189 HG13 ILE 22 3HG1 ILE 22 7.249 5.318 -3.870 190 HG21 ILE 22 1HG2 ILE 22 10.522 5.829 -1.176 191 HG22 ILE 22 2HG2 ILE 22 9.311 4.587 -0.863 192 HG23 ILE 22 3HG2 ILE 22 8.900 6.291 -0.658 193 HD11 ILE 22 3HD1 ILE 22 7.528 3.753 -1.315 194 HD12 ILE 22 1HD1 ILE 22 7.815 3.138 -2.944 195 HD13 ILE 22 2HD1 ILE 22 6.195 3.645 -2.464 196 H LYS 23 H LYS 23 11.367 6.463 -4.619 197 HA LYS 23 HA LYS 23 13.363 7.233 -2.761 198 HB2 LYS 23 2HB LYS 23 14.968 6.815 -4.466 199 HB3 LYS 23 3HB LYS 23 13.680 5.647 -4.717 200 HG2 LYS 23 2HG LYS 23 12.784 6.997 -6.535 201 HG3 LYS 23 3HG LYS 23 14.031 8.214 -6.262 202 HD2 LYS 23 2HD LYS 23 15.759 6.525 -6.808 203 HD3 LYS 23 3HD LYS 23 14.480 5.354 -7.146 204 HE2 LYS 23 2HE LYS 23 13.616 6.819 -8.918 205 HE3 LYS 23 3HE LYS 23 14.897 7.981 -8.583 206 HZ1 LYS 23 3HZ LYS 23 15.352 6.522 -10.489 207 HZ2 LYS 23 1HZ LYS 23 15.358 5.188 -9.456 208 HZ3 LYS 23 2HZ LYS 23 16.528 6.399 -9.282 209 H LYS 24 H LYS 24 11.796 8.935 -5.417 210 HA LYS 24 HA LYS 24 13.435 11.206 -5.532 211 HB2 LYS 24 2HB LYS 24 11.770 10.685 -7.246 212 HB3 LYS 24 3HB LYS 24 10.469 10.954 -6.094 213 HG2 LYS 24 2HG LYS 24 11.018 13.304 -5.955 214 HG3 LYS 24 3HG LYS 24 12.425 13.069 -6.996 215 HD2 LYS 24 2HD LYS 24 9.543 12.617 -7.793 216 HD3 LYS 24 3HD LYS 24 10.518 14.021 -8.225 217 HE2 LYS 24 2HE LYS 24 11.045 11.157 -9.037 218 HE3 LYS 24 3HE LYS 24 10.424 12.438 -10.076 219 HZ1 LYS 24 3HZ LYS 24 12.535 13.650 -9.657 220 HZ2 LYS 24 1HZ LYS 24 12.740 12.192 -10.487 221 HZ3 LYS 24 2HZ LYS 24 13.120 12.288 -8.845 222 H ASN 25 H ASN 25 10.535 10.578 -3.566 223 HA ASN 25 HA ASN 25 10.603 13.089 -2.207 224 HB2 ASN 25 2HB ASN 25 9.247 10.473 -1.517 225 HB3 ASN 25 3HB ASN 25 9.016 11.965 -0.609 226 HD21 ASN 25 1HD2 ASN 25 7.101 10.368 -2.139 227 HD22 ASN 25 2HD2 ASN 25 6.420 11.443 -3.302 228 H GLY 26 H GLY 26 12.109 9.963 -1.599 229 HA2 GLY 26 2HA GLY 26 14.262 9.986 -0.477 230 HA3 GLY 26 3HA GLY 26 13.663 11.264 0.564 231 H PHE 27 H PHE 27 12.081 8.181 -0.264 232 HA PHE 27 HA PHE 27 12.410 7.328 2.553 233 HB2 PHE 27 2HB PHE 27 9.918 7.008 0.854 234 HB3 PHE 27 3HB PHE 27 10.131 6.383 2.486 235 HD1 PHE 27 HD1 PHE 27 10.152 7.903 4.406 236 HD2 PHE 27 HD2 PHE 27 9.497 9.348 0.452 237 HE1 PHE 27 HE1 PHE 27 9.308 10.023 5.324 238 HE2 PHE 27 HE2 PHE 27 8.649 11.469 1.366 239 HZ PHE 27 HZ PHE 27 8.555 11.810 3.804 240 H LYS 28 H LYS 28 12.342 5.003 2.908 241 HA LYS 28 HA LYS 28 13.583 3.535 0.725 242 HB2 LYS 28 2HB LYS 28 13.078 2.841 3.625 243 HB3 LYS 28 3HB LYS 28 13.749 1.691 2.480 244 HG2 LYS 28 2HG LYS 28 15.545 2.638 3.727 245 HG3 LYS 28 3HG LYS 28 15.636 3.268 2.082 246 HD2 LYS 28 2HD LYS 28 14.559 5.354 2.838 247 HD3 LYS 28 3HD LYS 28 14.490 4.714 4.482 248 HE2 LYS 28 2HE LYS 28 16.946 4.570 4.517 249 HE3 LYS 28 3HE LYS 28 17.002 5.234 2.883 250 HZ1 LYS 28 3HZ LYS 28 15.942 7.246 3.729 251 HZ2 LYS 28 1HZ LYS 28 17.410 6.945 4.509 252 HZ3 LYS 28 2HZ LYS 28 15.954 6.613 5.293 253 H VAL 29 H VAL 29 12.761 1.717 -0.294 254 HA VAL 29 HA VAL 29 9.838 1.395 -0.088 255 HB VAL 29 HB VAL 29 11.671 0.493 -2.326 256 HG11 VAL 29 1HG1 VAL 29 9.587 -0.764 -2.236 257 HG12 VAL 29 2HG1 VAL 29 9.600 0.308 -3.638 258 HG13 VAL 29 3HG1 VAL 29 8.662 0.739 -2.208 259 HG21 VAL 29 3HG2 VAL 29 11.757 2.911 -2.170 260 HG22 VAL 29 1HG2 VAL 29 9.994 3.000 -2.129 261 HG23 VAL 29 2HG2 VAL 29 10.816 2.438 -3.584 262 H ARG 30 H ARG 30 9.036 -0.409 0.833 263 HA ARG 30 HA ARG 30 10.657 -2.883 0.730 264 HB2 ARG 30 2HB ARG 30 10.158 -2.100 3.042 265 HB3 ARG 30 3HB ARG 30 8.440 -2.222 2.686 266 HG2 ARG 30 2HG ARG 30 8.617 -4.602 2.350 267 HG3 ARG 30 3HG ARG 30 10.368 -4.534 2.537 268 HD2 ARG 30 2HD ARG 30 10.074 -3.784 4.860 269 HD3 ARG 30 3HD ARG 30 8.323 -3.899 4.664 270 HE ARG 30 HE ARG 30 8.797 -6.345 4.161 271 HH11 ARG 30 1HH1 ARG 30 10.807 -4.468 6.228 272 HH12 ARG 30 2HH1 ARG 30 11.273 -5.817 7.196 273 HH21 ARG 30 1HH2 ARG 30 9.403 -8.079 5.399 274 HH22 ARG 30 2HH2 ARG 30 10.509 -7.850 6.710 275 H THR 31 H THR 31 9.978 -3.965 -1.049 276 HA THR 31 HA THR 31 7.148 -4.012 -1.763 277 HB THR 31 HB THR 31 7.864 -5.260 -3.767 278 HG1 THR 31 HG1 THR 31 9.671 -6.364 -2.887 279 HG21 THR 31 3HG2 THR 31 9.169 -3.465 -4.813 280 HG22 THR 31 1HG2 THR 31 9.535 -2.795 -3.222 281 HG23 THR 31 2HG2 THR 31 7.873 -2.807 -3.816 282 H VAL 32 H VAL 32 6.026 -5.314 -0.395 283 HA VAL 32 HA VAL 32 7.059 -7.799 0.605 284 HB VAL 32 HB VAL 32 4.249 -6.670 0.744 285 HG11 VAL 32 1HG1 VAL 32 4.256 -9.101 1.056 286 HG12 VAL 32 2HG1 VAL 32 3.887 -8.269 2.567 287 HG13 VAL 32 3HG1 VAL 32 5.495 -8.944 2.303 288 HG21 VAL 32 3HG2 VAL 32 5.899 -5.240 1.838 289 HG22 VAL 32 1HG2 VAL 32 6.502 -6.617 2.761 290 HG23 VAL 32 2HG2 VAL 32 4.864 -6.021 3.033 291 H ARG 33 H ARG 33 6.777 -9.814 -0.121 292 HA ARG 33 HA ARG 33 5.171 -10.225 -2.571 293 HB2 ARG 33 2HB ARG 33 6.742 -12.130 -3.004 294 HB3 ARG 33 3HB ARG 33 7.528 -10.554 -2.969 295 HG2 ARG 33 2HG ARG 33 8.183 -10.998 -0.610 296 HG3 ARG 33 3HG ARG 33 7.523 -12.623 -0.772 297 HD2 ARG 33 2HD ARG 33 9.156 -13.203 -2.414 298 HD3 ARG 33 3HD ARG 33 9.697 -11.527 -2.554 299 HE ARG 33 HE ARG 33 10.171 -11.999 0.022 300 HH11 ARG 33 1HH1 ARG 33 10.921 -13.926 -2.739 301 HH12 ARG 33 2HH1 ARG 33 12.323 -14.610 -2.001 302 HH21 ARG 33 1HH2 ARG 33 11.934 -12.882 0.943 303 HH22 ARG 33 2HH2 ARG 33 12.891 -14.027 0.068 304 H SER 34 H SER 34 5.591 -11.285 0.715 305 HA SER 34 HA SER 34 3.413 -13.204 0.443 306 HB2 SER 34 2HB SER 34 6.161 -14.036 1.428 307 HB3 SER 34 3HB SER 34 4.711 -15.027 1.552 308 HG SER 34 HG SER 34 4.884 -14.273 -0.972 309 HA PRO 35 HA PRO 35 2.029 -12.001 4.475 310 HB2 PRO 35 2HB PRO 35 2.072 -14.574 5.722 311 HB3 PRO 35 3HB PRO 35 0.694 -13.738 5.007 312 HG2 PRO 35 2HG PRO 35 2.428 -15.846 3.854 313 HG3 PRO 35 3HG PRO 35 0.734 -15.464 3.504 314 HD2 PRO 35 2HD PRO 35 2.707 -14.877 1.771 315 HD3 PRO 35 3HD PRO 35 1.294 -13.821 1.965 316 H GLN 36 H GLN 36 4.540 -14.560 4.839 317 HA GLN 36 HA GLN 36 5.541 -13.787 7.306 318 HB2 GLN 36 2HB GLN 36 7.673 -14.880 6.611 319 HB3 GLN 36 3HB GLN 36 6.245 -15.860 6.308 320 HG2 GLN 36 2HG GLN 36 6.312 -15.334 3.962 321 HG3 GLN 36 3HG GLN 36 7.629 -14.188 4.216 322 HE21 GLN 36 1HE2 GLN 36 9.700 -14.958 4.564 323 HE22 GLN 36 2HE2 GLN 36 10.144 -16.608 4.284 324 H GLU 37 H GLU 37 6.427 -12.525 4.111 325 HA GLU 37 HA GLU 37 8.585 -10.901 4.927 326 HB2 GLU 37 2HB GLU 37 6.713 -10.364 2.611 327 HB3 GLU 37 3HB GLU 37 8.372 -9.807 2.781 328 HG2 GLU 37 2HG GLU 37 7.523 -12.686 2.488 329 HG3 GLU 37 3HG GLU 37 8.131 -11.665 1.190 330 H LEU 38 H LEU 38 5.113 -10.352 4.813 331 HA LEU 38 HA LEU 38 5.191 -7.578 5.509 332 HB2 LEU 38 2HB LEU 38 3.241 -8.620 4.422 333 HB3 LEU 38 3HB LEU 38 2.982 -9.623 5.837 334 HG LEU 38 HG LEU 38 2.555 -7.548 7.169 335 HD11 LEU 38 1HD1 LEU 38 3.774 -5.953 5.797 336 HD12 LEU 38 2HD1 LEU 38 2.089 -5.464 5.969 337 HD13 LEU 38 3HD1 LEU 38 2.643 -6.204 4.465 338 HD21 LEU 38 3HD2 LEU 38 0.715 -8.884 6.277 339 HD22 LEU 38 1HD2 LEU 38 0.764 -7.966 4.772 340 HD23 LEU 38 2HD2 LEU 38 0.310 -7.169 6.279 341 H LYS 39 H LYS 39 4.424 -10.508 7.394 342 HA LYS 39 HA LYS 39 4.173 -9.423 9.924 343 HB2 LYS 39 2HB LYS 39 3.700 -11.767 9.383 344 HB3 LYS 39 3HB LYS 39 5.412 -12.074 9.137 345 HG2 LYS 39 2HG LYS 39 5.831 -11.600 11.514 346 HG3 LYS 39 3HG LYS 39 4.103 -11.320 11.751 347 HD2 LYS 39 2HD LYS 39 3.640 -13.630 11.047 348 HD3 LYS 39 3HD LYS 39 5.368 -13.904 10.822 349 HE2 LYS 39 2HE LYS 39 5.742 -13.487 13.208 350 HE3 LYS 39 3HE LYS 39 4.016 -13.205 13.431 351 HZ1 LYS 39 3HZ LYS 39 4.541 -15.432 14.073 352 HZ2 LYS 39 1HZ LYS 39 5.303 -15.743 12.598 353 HZ3 LYS 39 2HZ LYS 39 3.639 -15.497 12.644 354 H ASP 40 H ASP 40 7.127 -10.354 8.219 355 HA ASP 40 HA ASP 40 8.987 -9.916 10.255 356 HB2 ASP 40 2HB ASP 40 9.527 -11.063 8.165 357 HB3 ASP 40 3HB ASP 40 9.303 -9.569 7.262 358 H SER 41 H SER 41 7.588 -7.604 7.919 359 HA SER 41 HA SER 41 9.188 -5.379 8.691 360 HB2 SER 41 2HB SER 41 7.708 -3.998 7.429 361 HB3 SER 41 3HB SER 41 7.770 -5.535 6.569 362 HG SER 41 HG SER 41 5.747 -5.988 7.197 363 H ILE 42 H ILE 42 5.915 -6.412 9.656 364 HA ILE 42 HA ILE 42 5.340 -4.432 11.520 365 HB ILE 42 HB ILE 42 4.528 -7.315 11.303 366 HG12 ILE 42 2HG1 ILE 42 2.266 -6.285 11.059 367 HG13 ILE 42 3HG1 ILE 42 2.998 -4.696 11.232 368 HG21 ILE 42 1HG2 ILE 42 3.776 -5.513 13.607 369 HG22 ILE 42 2HG2 ILE 42 4.700 -7.014 13.698 370 HG23 ILE 42 3HG2 ILE 42 3.002 -7.050 13.227 371 HD11 ILE 42 3HD1 ILE 42 3.546 -6.656 9.013 372 HD12 ILE 42 1HD1 ILE 42 4.262 -5.052 9.178 373 HD13 ILE 42 2HD1 ILE 42 2.527 -5.220 8.910 374 H GLU 43 H GLU 43 7.125 -7.478 12.030 375 HA GLU 43 HA GLU 43 7.684 -7.248 14.737 376 HB2 GLU 43 2HB GLU 43 9.270 -8.443 12.467 377 HB3 GLU 43 3HB GLU 43 9.854 -8.504 14.124 378 HG2 GLU 43 2HG GLU 43 7.262 -9.669 13.115 379 HG3 GLU 43 3HG GLU 43 8.731 -10.567 13.500 380 H GLU 44 H GLU 44 9.238 -5.609 12.033 381 HA GLU 44 HA GLU 44 11.320 -4.454 13.668 382 HB2 GLU 44 2HB GLU 44 10.438 -3.808 10.841 383 HB3 GLU 44 3HB GLU 44 11.873 -3.156 11.624 384 HG2 GLU 44 2HG GLU 44 12.789 -5.420 11.825 385 HG3 GLU 44 3HG GLU 44 11.355 -6.068 11.032 386 H LEU 45 H LEU 45 8.420 -3.181 12.026 387 HA LEU 45 HA LEU 45 8.684 -0.510 12.815 388 HB2 LEU 45 2HB LEU 45 6.168 -2.061 12.187 389 HB3 LEU 45 3HB LEU 45 6.275 -0.312 12.274 390 HG LEU 45 HG LEU 45 7.731 -2.057 10.275 391 HD11 LEU 45 1HD1 LEU 45 5.333 -1.987 9.853 392 HD12 LEU 45 2HD1 LEU 45 6.216 -1.085 8.624 393 HD13 LEU 45 3HD1 LEU 45 5.362 -0.226 9.906 394 HD21 LEU 45 3HD2 LEU 45 8.335 0.058 9.190 395 HD22 LEU 45 1HD2 LEU 45 9.003 -0.048 10.817 396 HD23 LEU 45 2HD2 LEU 45 7.584 0.952 10.510 397 H VAL 46 H VAL 46 7.054 -3.200 14.471 398 HA VAL 46 HA VAL 46 5.768 -1.659 16.460 399 HB VAL 46 HB VAL 46 5.221 -4.039 15.948 400 HG11 VAL 46 1HG1 VAL 46 7.722 -4.656 17.530 401 HG12 VAL 46 2HG1 VAL 46 7.490 -4.927 15.802 402 HG13 VAL 46 3HG1 VAL 46 6.531 -5.836 16.972 403 HG21 VAL 46 3HG2 VAL 46 5.832 -3.467 18.855 404 HG22 VAL 46 1HG2 VAL 46 4.716 -4.694 18.260 405 HG23 VAL 46 2HG2 VAL 46 4.376 -2.986 17.986 406 H LYS 47 H LYS 47 9.068 -2.707 16.150 407 HA LYS 47 HA LYS 47 9.699 -1.937 18.915 408 HB2 LYS 47 2HB LYS 47 11.447 -3.146 16.756 409 HB3 LYS 47 3HB LYS 47 11.977 -2.785 18.392 410 HG2 LYS 47 2HG LYS 47 9.855 -4.782 17.609 411 HG3 LYS 47 3HG LYS 47 11.500 -5.150 18.132 412 HD2 LYS 47 2HD LYS 47 10.938 -3.953 20.300 413 HD3 LYS 47 3HD LYS 47 9.258 -3.948 19.758 414 HE2 LYS 47 2HE LYS 47 10.978 -6.396 20.178 415 HE3 LYS 47 3HE LYS 47 9.720 -5.823 21.268 416 HZ1 LYS 47 3HZ LYS 47 9.258 -6.692 18.468 417 HZ2 LYS 47 1HZ LYS 47 8.071 -6.263 19.595 418 HZ3 LYS 47 2HZ LYS 47 9.003 -7.658 19.827 419 H LYS 48 H LYS 48 10.948 -1.258 15.646 420 HA LYS 48 HA LYS 48 11.548 1.507 16.468 421 HB2 LYS 48 2HB LYS 48 13.325 -0.211 14.714 422 HB3 LYS 48 3HB LYS 48 13.652 1.429 15.260 423 HG2 LYS 48 2HG LYS 48 13.940 0.704 17.518 424 HG3 LYS 48 3HG LYS 48 13.367 -0.919 17.126 425 HD2 LYS 48 2HD LYS 48 15.322 -1.222 15.641 426 HD3 LYS 48 3HD LYS 48 15.903 0.378 16.107 427 HE2 LYS 48 2HE LYS 48 16.129 -0.336 18.412 428 HE3 LYS 48 3HE LYS 48 15.428 -1.907 18.025 429 HZ1 LYS 48 3HZ LYS 48 17.854 -1.964 18.180 430 HZ2 LYS 48 1HZ LYS 48 17.968 -0.862 16.901 431 HZ3 LYS 48 2HZ LYS 48 17.312 -2.397 16.639 432 H TYR 49 H TYR 49 9.871 2.469 15.332 433 HA TYR 49 HA TYR 49 9.341 1.705 12.583 434 HB2 TYR 49 2HB TYR 49 7.504 3.359 12.690 435 HB3 TYR 49 3HB TYR 49 7.426 2.169 13.981 436 HD1 TYR 49 HD2 TYR 49 8.361 2.884 16.296 437 HD2 TYR 49 HD1 TYR 49 7.409 5.647 13.193 438 HE1 TYR 49 HE2 TYR 49 8.196 4.691 17.956 439 HE2 TYR 49 HE1 TYR 49 7.242 7.455 14.850 440 HH TYR 49 HH TYR 49 8.383 7.170 18.008 441 H ASN 50 H ASN 50 10.457 2.482 10.950 442 HA ASN 50 HA ASN 50 11.793 5.098 11.193 443 HB2 ASN 50 2HB ASN 50 13.231 4.188 9.294 444 HB3 ASN 50 3HB ASN 50 13.399 3.380 10.851 445 HD21 ASN 50 1HD2 ASN 50 14.135 1.471 9.925 446 HD22 ASN 50 2HD2 ASN 50 13.095 0.412 9.041 447 H ALA 51 H ALA 51 12.358 5.771 8.664 448 HA ALA 51 HA ALA 51 9.834 6.751 7.692 449 HB1 ALA 51 3HB ALA 51 11.835 8.165 7.767 450 HB2 ALA 51 1HB ALA 51 11.163 8.061 6.140 451 HB3 ALA 51 2HB ALA 51 12.603 7.134 6.560 452 H THR 52 H THR 52 10.985 3.783 7.249 453 HA THR 52 HA THR 52 10.952 3.478 4.407 454 HB THR 52 HB THR 52 10.582 1.367 6.555 455 HG1 THR 52 HG1 THR 52 12.846 1.002 6.108 456 HG21 THR 52 3HG2 THR 52 11.360 1.053 3.645 457 HG22 THR 52 1HG2 THR 52 9.794 0.619 4.334 458 HG23 THR 52 2HG2 THR 52 11.250 -0.240 4.840 459 H ILE 53 H ILE 53 9.322 2.964 3.036 460 HA ILE 53 HA ILE 53 6.583 2.803 4.114 461 HB ILE 53 HB ILE 53 7.504 3.411 1.291 462 HG12 ILE 53 2HG1 ILE 53 6.375 5.247 3.429 463 HG13 ILE 53 3HG1 ILE 53 8.046 5.222 2.879 464 HG21 ILE 53 1HG2 ILE 53 5.327 2.324 1.304 465 HG22 ILE 53 2HG2 ILE 53 5.152 4.028 0.882 466 HG23 ILE 53 3HG2 ILE 53 4.736 3.474 2.506 467 HD11 ILE 53 3HD1 ILE 53 6.811 7.076 1.911 468 HD12 ILE 53 1HD1 ILE 53 5.651 5.951 1.205 469 HD13 ILE 53 2HD1 ILE 53 7.331 5.944 0.662 470 H VAL 54 H VAL 54 5.334 1.005 3.783 471 HA VAL 54 HA VAL 54 6.689 -1.305 2.586 472 HB VAL 54 HB VAL 54 6.029 -1.724 4.828 473 HG11 VAL 54 1HG1 VAL 54 4.330 0.019 5.070 474 HG12 VAL 54 2HG1 VAL 54 3.733 -1.539 5.643 475 HG13 VAL 54 3HG1 VAL 54 3.215 -0.917 4.074 476 HG21 VAL 54 3HG2 VAL 54 5.727 -3.608 3.311 477 HG22 VAL 54 1HG2 VAL 54 4.075 -3.092 2.971 478 HG23 VAL 54 2HG2 VAL 54 4.512 -3.644 4.588 479 H VAL 55 H VAL 55 6.284 -1.542 0.512 480 HA VAL 55 HA VAL 55 3.627 -1.042 -0.608 481 HB VAL 55 HB VAL 55 6.208 -1.761 -2.027 482 HG11 VAL 55 1HG1 VAL 55 5.062 -0.974 -4.052 483 HG12 VAL 55 2HG1 VAL 55 3.585 -0.724 -3.118 484 HG13 VAL 55 3HG1 VAL 55 4.234 -2.352 -3.325 485 HG21 VAL 55 3HG2 VAL 55 4.920 0.946 -1.624 486 HG22 VAL 55 1HG2 VAL 55 6.324 0.619 -2.641 487 HG23 VAL 55 2HG2 VAL 55 6.426 0.384 -0.897 488 H VAL 56 H VAL 56 2.292 -2.760 -0.316 489 HA VAL 56 HA VAL 56 3.288 -5.484 -0.386 490 HB VAL 56 HB VAL 56 0.441 -4.490 -0.080 491 HG11 VAL 56 1HG1 VAL 56 -0.018 -6.740 0.808 492 HG12 VAL 56 2HG1 VAL 56 1.635 -7.222 0.427 493 HG13 VAL 56 3HG1 VAL 56 0.520 -6.793 -0.872 494 HG21 VAL 56 3HG2 VAL 56 0.751 -4.938 2.318 495 HG22 VAL 56 1HG2 VAL 56 1.862 -3.696 1.741 496 HG23 VAL 56 2HG2 VAL 56 2.445 -5.337 2.024 497 H VAL 57 H VAL 57 3.763 -6.262 -2.365 498 HA VAL 57 HA VAL 57 2.144 -5.627 -4.695 499 HB VAL 57 HB VAL 57 4.459 -7.572 -4.470 500 HG11 VAL 57 1HG1 VAL 57 4.624 -7.287 -6.912 501 HG12 VAL 57 2HG1 VAL 57 3.181 -6.271 -6.883 502 HG13 VAL 57 3HG1 VAL 57 3.072 -7.973 -6.432 503 HG21 VAL 57 3HG2 VAL 57 5.846 -5.760 -5.395 504 HG22 VAL 57 1HG2 VAL 57 5.178 -5.336 -3.818 505 HG23 VAL 57 2HG2 VAL 57 4.472 -4.661 -5.287 506 H VAL 58 H VAL 58 0.251 -6.684 -4.977 507 HA VAL 58 HA VAL 58 -0.002 -9.396 -3.855 508 HB VAL 58 HB VAL 58 -2.439 -9.025 -3.875 509 HG11 VAL 58 1HG1 VAL 58 -2.498 -7.354 -2.062 510 HG12 VAL 58 2HG1 VAL 58 -0.850 -6.874 -2.466 511 HG13 VAL 58 3HG1 VAL 58 -1.171 -8.500 -1.865 512 HG21 VAL 58 3HG2 VAL 58 -3.351 -6.789 -4.314 513 HG22 VAL 58 1HG2 VAL 58 -2.578 -7.457 -5.755 514 HG23 VAL 58 2HG2 VAL 58 -1.747 -6.227 -4.798 515 H ASP 59 H ASP 59 -0.208 -11.093 -5.132 516 HA ASP 59 HA ASP 59 -0.923 -10.768 -7.961 517 HB2 ASP 59 2HB ASP 59 1.066 -12.101 -7.464 518 HB3 ASP 59 3HB ASP 59 0.131 -13.147 -6.401 519 H ASP 60 H ASP 60 -2.180 -11.901 -4.952 520 HA ASP 60 HA ASP 60 -4.574 -12.994 -6.286 521 HB2 ASP 60 2HB ASP 60 -3.382 -14.832 -5.308 522 HB3 ASP 60 3HB ASP 60 -3.153 -13.956 -3.795 523 H LYS 61 H LYS 61 -6.586 -12.808 -5.089 524 HA LYS 61 HA LYS 61 -6.841 -10.171 -3.949 525 HB2 LYS 61 2HB LYS 61 -9.267 -10.632 -3.965 526 HB3 LYS 61 3HB LYS 61 -8.511 -10.914 -5.527 527 HG2 LYS 61 2HG LYS 61 -8.531 -13.317 -5.128 528 HG3 LYS 61 3HG LYS 61 -9.237 -13.055 -3.531 529 HD2 LYS 61 2HD LYS 61 -11.224 -12.056 -4.564 530 HD3 LYS 61 3HD LYS 61 -10.514 -12.287 -6.164 531 HE2 LYS 61 2HE LYS 61 -10.549 -14.697 -5.859 532 HE3 LYS 61 3HE LYS 61 -11.170 -14.503 -4.220 533 HZ1 LYS 61 3HZ LYS 61 -12.581 -13.623 -6.678 534 HZ2 LYS 61 1HZ LYS 61 -13.181 -13.556 -5.097 535 HZ3 LYS 61 2HZ LYS 61 -12.905 -15.052 -5.838 536 H GLU 62 H GLU 62 -7.149 -13.505 -2.705 537 HA GLU 62 HA GLU 62 -8.145 -12.763 -0.150 538 HB2 GLU 62 2HB GLU 62 -8.292 -15.078 -0.917 539 HB3 GLU 62 3HB GLU 62 -6.538 -15.204 -0.954 540 HG2 GLU 62 2HG GLU 62 -6.464 -14.878 1.477 541 HG3 GLU 62 3HG GLU 62 -8.224 -14.772 1.512 542 H TRP 63 H TRP 63 -4.834 -13.367 -1.330 543 HA TRP 63 HA TRP 63 -3.426 -12.726 0.986 544 HB2 TRP 63 2HB TRP 63 -2.156 -13.580 -0.811 545 HB3 TRP 63 3HB TRP 63 -2.781 -12.384 -1.938 546 HD1 TRP 63 HD1 TRP 63 -0.708 -11.093 -2.705 547 HE1 TRP 63 HE1 TRP 63 1.208 -9.825 -1.555 548 HE3 TRP 63 HE3 TRP 63 -1.696 -12.357 2.162 549 HZ2 TRP 63 HZ2 TRP 63 2.168 -9.405 1.065 550 HZ3 TRP 63 HZ3 TRP 63 -0.233 -11.469 3.924 551 HH2 TRP 63 HH2 TRP 63 1.662 -10.023 3.386 552 H ALA 64 H ALA 64 -4.706 -10.538 -1.515 553 HA ALA 64 HA ALA 64 -3.703 -8.122 -0.567 554 HB1 ALA 64 3HB ALA 64 -6.384 -8.571 -1.878 555 HB2 ALA 64 1HB ALA 64 -4.848 -8.395 -2.725 556 HB3 ALA 64 2HB ALA 64 -5.502 -7.047 -1.795 557 H GLU 65 H GLU 65 -6.869 -9.621 0.259 558 HA GLU 65 HA GLU 65 -7.502 -7.580 2.156 559 HB2 GLU 65 2HB GLU 65 -9.447 -8.861 2.714 560 HB3 GLU 65 3HB GLU 65 -9.221 -8.954 0.978 561 HG2 GLU 65 2HG GLU 65 -9.815 -11.113 1.529 562 HG3 GLU 65 3HG GLU 65 -8.058 -11.208 1.469 563 H LYS 66 H LYS 66 -5.950 -10.716 2.375 564 HA LYS 66 HA LYS 66 -5.975 -11.093 5.145 565 HB2 LYS 66 2HB LYS 66 -5.304 -12.829 3.561 566 HB3 LYS 66 3HB LYS 66 -3.878 -11.902 3.117 567 HG2 LYS 66 2HG LYS 66 -2.958 -12.191 5.349 568 HG3 LYS 66 3HG LYS 66 -4.417 -13.047 5.859 569 HD2 LYS 66 2HD LYS 66 -3.966 -14.807 4.215 570 HD3 LYS 66 3HD LYS 66 -2.522 -13.947 3.678 571 HE2 LYS 66 2HE LYS 66 -1.513 -14.231 5.877 572 HE3 LYS 66 3HE LYS 66 -2.976 -15.027 6.464 573 HZ1 LYS 66 3HZ LYS 66 -1.196 -16.589 5.836 574 HZ2 LYS 66 1HZ LYS 66 -1.296 -16.045 4.236 575 HZ3 LYS 66 2HZ LYS 66 -2.615 -16.826 4.953 576 H ALA 67 H ALA 67 -3.538 -9.466 3.106 577 HA ALA 67 HA ALA 67 -1.745 -8.691 5.092 578 HB1 ALA 67 3HB ALA 67 -2.483 -7.154 2.595 579 HB2 ALA 67 1HB ALA 67 -1.300 -8.460 2.690 580 HB3 ALA 67 2HB ALA 67 -1.011 -6.946 3.547 581 H ILE 68 H ILE 68 -4.496 -6.826 3.792 582 HA ILE 68 HA ILE 68 -4.255 -4.631 5.552 583 HB ILE 68 HB ILE 68 -6.795 -5.616 4.225 584 HG12 ILE 68 2HG1 ILE 68 -5.066 -5.393 2.530 585 HG13 ILE 68 3HG1 ILE 68 -6.196 -4.054 2.373 586 HG21 ILE 68 1HG2 ILE 68 -7.489 -3.262 4.317 587 HG22 ILE 68 2HG2 ILE 68 -6.003 -2.859 5.177 588 HG23 ILE 68 3HG2 ILE 68 -7.196 -3.921 5.927 589 HD11 ILE 68 3HD1 ILE 68 -4.606 -2.605 3.553 590 HD12 ILE 68 1HD1 ILE 68 -3.930 -3.290 2.077 591 HD13 ILE 68 2HD1 ILE 68 -3.471 -3.949 3.646 592 H ARG 69 H ARG 69 -5.919 -7.718 5.869 593 HA ARG 69 HA ARG 69 -7.362 -6.998 8.247 594 HB2 ARG 69 2HB ARG 69 -8.242 -8.695 6.741 595 HB3 ARG 69 3HB ARG 69 -6.821 -9.698 6.984 596 HG2 ARG 69 2HG ARG 69 -7.470 -10.338 9.113 597 HG3 ARG 69 3HG ARG 69 -8.514 -8.934 9.330 598 HD2 ARG 69 2HD ARG 69 -9.761 -11.057 9.036 599 HD3 ARG 69 3HD ARG 69 -10.152 -9.840 7.824 600 HE ARG 69 HE ARG 69 -8.609 -11.126 6.318 601 HH11 ARG 69 1HH1 ARG 69 -10.197 -12.667 8.962 602 HH12 ARG 69 2HH1 ARG 69 -10.220 -14.212 8.188 603 HH21 ARG 69 1HH2 ARG 69 -8.660 -13.104 5.324 604 HH22 ARG 69 2HH2 ARG 69 -9.351 -14.457 6.150 605 H PHE 70 H PHE 70 -4.181 -8.206 7.588 606 HA PHE 70 HA PHE 70 -3.609 -9.068 10.266 607 HB2 PHE 70 2HB PHE 70 -2.333 -9.833 8.259 608 HB3 PHE 70 3HB PHE 70 -1.687 -8.207 8.081 609 HD1 PHE 70 HD1 PHE 70 -1.737 -11.180 10.295 610 HD2 PHE 70 HD2 PHE 70 0.194 -7.497 9.348 611 HE1 PHE 70 HE1 PHE 70 0.124 -11.770 11.793 612 HE2 PHE 70 HE2 PHE 70 2.052 -8.088 10.849 613 HZ PHE 70 HZ PHE 70 2.019 -10.222 12.072 614 H VAL 71 H VAL 71 -3.224 -6.067 8.445 615 HA VAL 71 HA VAL 71 -1.634 -4.624 10.238 616 HB VAL 71 HB VAL 71 -3.736 -3.536 8.347 617 HG11 VAL 71 1HG1 VAL 71 -2.411 -1.460 8.397 618 HG12 VAL 71 2HG1 VAL 71 -1.365 -2.166 9.630 619 HG13 VAL 71 3HG1 VAL 71 -3.065 -1.861 9.986 620 HG21 VAL 71 3HG2 VAL 71 -1.871 -3.240 6.772 621 HG22 VAL 71 1HG2 VAL 71 -2.100 -4.938 7.193 622 HG23 VAL 71 2HG2 VAL 71 -0.780 -4.020 7.920 623 H LYS 72 H LYS 72 -5.149 -5.108 10.252 624 HA LYS 72 HA LYS 72 -5.815 -3.042 12.047 625 HB2 LYS 72 2HB LYS 72 -7.934 -4.104 12.331 626 HB3 LYS 72 3HB LYS 72 -7.448 -4.362 10.661 627 HG2 LYS 72 2HG LYS 72 -6.796 -6.638 11.162 628 HG3 LYS 72 3HG LYS 72 -7.155 -6.394 12.871 629 HD2 LYS 72 2HD LYS 72 -9.526 -5.969 12.282 630 HD3 LYS 72 3HD LYS 72 -9.142 -6.301 10.590 631 HE2 LYS 72 2HE LYS 72 -10.135 -8.257 11.651 632 HE3 LYS 72 3HE LYS 72 -8.464 -8.578 11.192 633 HZ1 LYS 72 3HZ LYS 72 -7.789 -8.234 13.472 634 HZ2 LYS 72 1HZ LYS 72 -8.991 -9.418 13.404 635 HZ3 LYS 72 2HZ LYS 72 -9.375 -7.860 13.929 636 H SER 73 H SER 73 -4.170 -5.987 12.615 637 HA SER 73 HA SER 73 -4.901 -6.307 15.386 638 HB2 SER 73 2HB SER 73 -4.150 -8.183 13.873 639 HB3 SER 73 3HB SER 73 -2.522 -7.511 13.945 640 HG SER 73 HG SER 73 -2.398 -8.015 16.084 641 H LEU 74 H LEU 74 -2.795 -4.216 13.756 642 HA LEU 74 HA LEU 74 -0.694 -4.079 15.718 643 HB2 LEU 74 2HB LEU 74 -1.371 -2.147 13.494 644 HB3 LEU 74 3HB LEU 74 0.140 -2.212 14.385 645 HG LEU 74 HG LEU 74 -0.909 -4.366 12.539 646 HD11 LEU 74 1HD1 LEU 74 0.939 -3.727 11.077 647 HD12 LEU 74 2HD1 LEU 74 1.369 -2.422 12.182 648 HD13 LEU 74 3HD1 LEU 74 -0.174 -2.383 11.331 649 HD21 LEU 74 3HD2 LEU 74 1.707 -4.190 14.041 650 HD22 LEU 74 1HD2 LEU 74 1.275 -5.426 12.860 651 HD23 LEU 74 2HD2 LEU 74 0.387 -5.312 14.380 652 H GLY 75 H GLY 75 -3.799 -2.629 15.421 653 HA2 GLY 75 2HA GLY 75 -4.934 -1.113 16.729 654 HA3 GLY 75 3HA GLY 75 -3.641 -1.277 17.904 655 H ALA 76 H ALA 76 -3.410 -0.082 14.572 656 HA ALA 76 HA ALA 76 -2.843 2.630 15.548 657 HB1 ALA 76 3HB ALA 76 -0.986 1.092 13.719 658 HB2 ALA 76 1HB ALA 76 -0.674 1.490 15.410 659 HB3 ALA 76 2HB ALA 76 -0.799 2.777 14.210 660 H GLN 77 H GLN 77 -2.899 4.275 13.861 661 HA GLN 77 HA GLN 77 -4.724 3.582 11.679 662 HB2 GLN 77 2HB GLN 77 -5.037 5.967 11.378 663 HB3 GLN 77 3HB GLN 77 -5.211 5.569 13.081 664 HG2 GLN 77 2HG GLN 77 -2.956 6.402 13.519 665 HG3 GLN 77 3HG GLN 77 -2.752 6.769 11.809 666 HE21 GLN 77 1HE2 GLN 77 -3.944 8.484 10.908 667 HE22 GLN 77 2HE2 GLN 77 -4.623 9.728 11.898 668 H VAL 78 H VAL 78 -4.157 3.540 9.547 669 HA VAL 78 HA VAL 78 -1.496 4.526 8.765 670 HB VAL 78 HB VAL 78 -1.113 2.495 7.383 671 HG11 VAL 78 1HG1 VAL 78 -0.482 0.987 9.219 672 HG12 VAL 78 2HG1 VAL 78 -1.460 1.941 10.336 673 HG13 VAL 78 3HG1 VAL 78 -0.045 2.658 9.567 674 HG21 VAL 78 3HG2 VAL 78 -3.506 1.383 8.858 675 HG22 VAL 78 1HG2 VAL 78 -2.430 0.466 7.803 676 HG23 VAL 78 2HG2 VAL 78 -3.429 1.757 7.136 677 H LEU 79 H LEU 79 -1.306 5.237 6.637 678 HA LEU 79 HA LEU 79 -3.786 5.637 5.150 679 HB2 LEU 79 2HB LEU 79 -0.957 6.616 4.773 680 HB3 LEU 79 3HB LEU 79 -2.162 6.811 3.516 681 HG LEU 79 HG LEU 79 -1.970 8.861 4.762 682 HD11 LEU 79 1HD1 LEU 79 -4.293 9.178 5.446 683 HD12 LEU 79 2HD1 LEU 79 -4.539 7.431 5.453 684 HD13 LEU 79 3HD1 LEU 79 -4.183 8.267 3.939 685 HD21 LEU 79 3HD2 LEU 79 -2.426 9.028 7.135 686 HD22 LEU 79 1HD2 LEU 79 -1.091 7.910 6.859 687 HD23 LEU 79 2HD2 LEU 79 -2.699 7.287 7.238 688 H ILE 80 H ILE 80 -4.476 4.211 3.665 689 HA ILE 80 HA ILE 80 -2.493 2.350 2.500 690 HB ILE 80 HB ILE 80 -5.461 1.923 2.932 691 HG12 ILE 80 2HG1 ILE 80 -3.038 0.670 4.272 692 HG13 ILE 80 3HG1 ILE 80 -4.117 1.851 5.004 693 HG21 ILE 80 1HG2 ILE 80 -4.670 0.798 0.897 694 HG22 ILE 80 2HG2 ILE 80 -5.063 -0.372 2.155 695 HG23 ILE 80 3HG2 ILE 80 -3.379 0.027 1.818 696 HD11 ILE 80 3HD1 ILE 80 -5.960 0.247 4.844 697 HD12 ILE 80 1HD1 ILE 80 -4.614 -0.367 5.803 698 HD13 ILE 80 2HD1 ILE 80 -4.851 -0.936 4.153 699 H ILE 81 H ILE 81 -1.923 3.061 0.540 700 HA ILE 81 HA ILE 81 -3.974 4.146 -1.271 701 HB ILE 81 HB ILE 81 -0.968 4.098 -1.652 702 HG12 ILE 81 2HG1 ILE 81 -2.773 6.358 -0.728 703 HG13 ILE 81 3HG1 ILE 81 -1.595 5.508 0.267 704 HG21 ILE 81 1HG2 ILE 81 -3.141 5.563 -3.161 705 HG22 ILE 81 2HG2 ILE 81 -2.192 4.198 -3.754 706 HG23 ILE 81 3HG2 ILE 81 -1.406 5.744 -3.430 707 HD11 ILE 81 3HD1 ILE 81 -0.978 7.230 -2.124 708 HD12 ILE 81 1HD1 ILE 81 0.208 6.368 -1.146 709 HD13 ILE 81 2HD1 ILE 81 -0.749 7.665 -0.431 710 H ILE 82 H ILE 82 -4.895 2.790 -2.667 711 HA ILE 82 HA ILE 82 -3.483 0.307 -3.400 712 HB ILE 82 HB ILE 82 -6.442 0.926 -3.606 713 HG12 ILE 82 2HG1 ILE 82 -4.941 -0.796 -1.605 714 HG13 ILE 82 3HG1 ILE 82 -5.656 0.778 -1.264 715 HG21 ILE 82 1HG2 ILE 82 -5.700 -0.702 -5.272 716 HG22 ILE 82 2HG2 ILE 82 -6.690 -1.482 -4.039 717 HG23 ILE 82 3HG2 ILE 82 -4.935 -1.666 -4.007 718 HD11 ILE 82 3HD1 ILE 82 -7.046 -1.032 -0.444 719 HD12 ILE 82 1HD1 ILE 82 -7.154 -1.704 -2.071 720 HD13 ILE 82 2HD1 ILE 82 -7.870 -0.131 -1.717 721 H TYR 83 H TYR 83 -2.678 0.149 -5.370 722 HA TYR 83 HA TYR 83 -3.686 1.881 -7.528 723 HB2 TYR 83 2HB TYR 83 -1.285 2.092 -6.989 724 HB3 TYR 83 3HB TYR 83 -1.060 0.378 -7.310 725 HD1 TYR 83 HD1 TYR 83 -1.136 -0.476 -9.629 726 HD2 TYR 83 HD2 TYR 83 -1.500 3.687 -8.796 727 HE1 TYR 83 HE1 TYR 83 -0.658 0.033 -11.985 728 HE2 TYR 83 HE2 TYR 83 -1.029 4.199 -11.152 729 HH TYR 83 HH TYR 83 -1.127 1.915 -13.591 730 H ASP 84 H ASP 84 -5.067 0.931 -8.883 731 HA ASP 84 HA ASP 84 -4.520 -1.764 -9.876 732 HB2 ASP 84 2HB ASP 84 -6.077 -1.876 -7.829 733 HB3 ASP 84 3HB ASP 84 -7.286 -1.095 -8.842 734 H GLN 85 H GLN 85 -5.428 -2.189 -11.900 735 HA GLN 85 HA GLN 85 -6.184 0.183 -13.433 736 HB2 GLN 85 2HB GLN 85 -5.581 -2.642 -14.347 737 HB3 GLN 85 3HB GLN 85 -5.852 -1.263 -15.407 738 HG2 GLN 85 2HG GLN 85 -3.862 -0.170 -14.507 739 HG3 GLN 85 3HG GLN 85 -3.594 -1.536 -13.425 740 HE21 GLN 85 1HE2 GLN 85 -2.875 -3.490 -14.283 741 HE22 GLN 85 2HE2 GLN 85 -2.198 -3.608 -15.867 742 H ASP 86 H ASP 86 -7.552 -2.847 -12.315 743 HA ASP 86 HA ASP 86 -9.991 -2.626 -13.840 744 HB2 ASP 86 2HB ASP 86 -9.210 -4.367 -11.488 745 HB3 ASP 86 3HB ASP 86 -10.746 -4.498 -12.335 746 H GLN 87 H GLN 87 -11.192 -0.808 -13.382 747 HA GLN 87 HA GLN 87 -11.365 0.471 -10.887 748 HB2 GLN 87 2HB GLN 87 -13.402 0.480 -13.131 749 HB3 GLN 87 3HB GLN 87 -13.339 1.634 -11.804 750 HG2 GLN 87 2HG GLN 87 -11.135 2.393 -12.585 751 HG3 GLN 87 3HG GLN 87 -11.228 1.253 -13.927 752 HE21 GLN 87 1HE2 GLN 87 -11.135 2.853 -15.486 753 HE22 GLN 87 2HE2 GLN 87 -12.439 3.955 -15.776 754 H ASN 88 H ASN 88 -13.296 -2.119 -12.289 755 HA ASN 88 HA ASN 88 -15.354 -2.168 -10.353 756 HB2 ASN 88 2HB ASN 88 -14.281 -4.351 -12.155 757 HB3 ASN 88 3HB ASN 88 -15.760 -4.485 -11.206 758 HD21 ASN 88 1HD2 ASN 88 -17.583 -3.409 -11.867 759 HD22 ASN 88 2HD2 ASN 88 -17.700 -2.607 -13.394 760 H ARG 89 H ARG 89 -12.204 -3.817 -10.478 761 HA ARG 89 HA ARG 89 -12.659 -5.323 -8.067 762 HB2 ARG 89 2HB ARG 89 -11.038 -5.956 -9.920 763 HB3 ARG 89 3HB ARG 89 -9.987 -4.670 -9.338 764 HG2 ARG 89 2HG ARG 89 -10.126 -5.864 -7.060 765 HG3 ARG 89 3HG ARG 89 -10.754 -7.234 -7.976 766 HD2 ARG 89 2HD ARG 89 -8.076 -5.884 -8.319 767 HD3 ARG 89 3HD ARG 89 -8.378 -7.494 -7.678 768 HE ARG 89 HE ARG 89 -9.241 -8.006 -9.998 769 HH11 ARG 89 1HH1 ARG 89 -6.961 -5.490 -9.485 770 HH12 ARG 89 2HH1 ARG 89 -6.188 -5.725 -11.011 771 HH21 ARG 89 1HH2 ARG 89 -8.222 -8.309 -11.969 772 HH22 ARG 89 2HH2 ARG 89 -6.860 -7.324 -12.380 773 H LEU 90 H LEU 90 -10.789 -2.437 -8.909 774 HA LEU 90 HA LEU 90 -9.642 -1.794 -6.484 775 HB2 LEU 90 2HB LEU 90 -9.145 -0.700 -8.622 776 HB3 LEU 90 3HB LEU 90 -10.722 0.062 -8.613 777 HG LEU 90 HG LEU 90 -10.083 1.374 -6.627 778 HD11 LEU 90 1HD1 LEU 90 -8.498 -0.194 -5.623 779 HD12 LEU 90 2HD1 LEU 90 -7.770 1.398 -5.843 780 HD13 LEU 90 3HD1 LEU 90 -7.370 0.085 -6.952 781 HD21 LEU 90 3HD2 LEU 90 -8.461 2.842 -7.736 782 HD22 LEU 90 1HD2 LEU 90 -9.726 2.316 -8.847 783 HD23 LEU 90 2HD2 LEU 90 -8.125 1.578 -8.920 784 H GLU 91 H GLU 91 -12.789 -0.579 -7.708 785 HA GLU 91 HA GLU 91 -13.501 0.791 -5.354 786 HB2 GLU 91 2HB GLU 91 -15.067 -0.253 -7.694 787 HB3 GLU 91 3HB GLU 91 -15.902 0.455 -6.318 788 HG2 GLU 91 2HG GLU 91 -13.735 1.882 -7.851 789 HG3 GLU 91 3HG GLU 91 -15.453 2.017 -8.229 790 H GLU 92 H GLU 92 -14.021 -2.576 -6.305 791 HA GLU 92 HA GLU 92 -15.770 -3.300 -4.220 792 HB2 GLU 92 2HB GLU 92 -15.499 -4.795 -6.076 793 HB3 GLU 92 3HB GLU 92 -13.765 -4.912 -5.811 794 HG2 GLU 92 2HG GLU 92 -14.116 -6.138 -3.758 795 HG3 GLU 92 3HG GLU 92 -15.860 -5.927 -3.893 796 H PHE 93 H PHE 93 -12.264 -3.930 -4.435 797 HA PHE 93 HA PHE 93 -11.986 -4.945 -1.843 798 HB2 PHE 93 2HB PHE 93 -10.370 -5.341 -3.641 799 HB3 PHE 93 3HB PHE 93 -9.906 -3.644 -3.617 800 HD1 PHE 93 HD1 PHE 93 -10.357 -6.281 -0.997 801 HD2 PHE 93 HD2 PHE 93 -7.799 -3.349 -2.732 802 HE1 PHE 93 HE1 PHE 93 -8.632 -6.798 0.676 803 HE2 PHE 93 HE2 PHE 93 -6.072 -3.862 -1.056 804 HZ PHE 93 HZ PHE 93 -6.486 -5.589 0.648 805 H SER 94 H SER 94 -11.673 -1.619 -3.026 806 HA SER 94 HA SER 94 -10.485 -0.427 -0.803 807 HB2 SER 94 2HB SER 94 -11.413 1.680 -1.566 808 HB3 SER 94 3HB SER 94 -10.931 0.730 -2.971 809 HG SER 94 HG SER 94 -12.971 0.490 -3.539 810 H ARG 95 H ARG 95 -13.862 -1.344 -1.295 811 HA ARG 95 HA ARG 95 -14.937 0.063 0.921 812 HB2 ARG 95 2HB ARG 95 -15.985 -2.477 -0.347 813 HB3 ARG 95 3HB ARG 95 -16.893 -1.376 0.680 814 HG2 ARG 95 2HG ARG 95 -15.884 -0.905 -2.114 815 HG3 ARG 95 3HG ARG 95 -17.553 -0.933 -1.544 816 HD2 ARG 95 2HD ARG 95 -16.986 1.087 -0.134 817 HD3 ARG 95 3HD ARG 95 -15.449 1.162 -0.996 818 HE ARG 95 HE ARG 95 -18.109 1.659 -2.120 819 HH11 ARG 95 1HH1 ARG 95 -14.682 1.626 -2.566 820 HH12 ARG 95 2HH1 ARG 95 -14.757 2.630 -3.974 821 HH21 ARG 95 1HH2 ARG 95 -18.183 2.922 -3.916 822 HH22 ARG 95 2HH2 ARG 95 -16.716 3.341 -4.738 823 H GLU 96 H GLU 96 -13.869 -3.326 0.574 824 HA GLU 96 HA GLU 96 -14.336 -4.136 3.218 825 HB2 GLU 96 2HB GLU 96 -12.499 -5.097 1.049 826 HB3 GLU 96 3HB GLU 96 -12.340 -5.765 2.666 827 HG2 GLU 96 2HG GLU 96 -13.736 -7.162 1.222 828 HG3 GLU 96 3HG GLU 96 -14.622 -6.555 2.617 829 H VAL 97 H VAL 97 -11.577 -2.450 1.803 830 HA VAL 97 HA VAL 97 -9.930 -2.559 4.130 831 HB VAL 97 HB VAL 97 -9.875 -0.578 1.838 832 HG11 VAL 97 1HG1 VAL 97 -7.768 -1.194 3.917 833 HG12 VAL 97 2HG1 VAL 97 -8.697 0.301 3.784 834 HG13 VAL 97 3HG1 VAL 97 -7.555 -0.142 2.516 835 HG21 VAL 97 3HG2 VAL 97 -9.579 -2.880 1.080 836 HG22 VAL 97 1HG2 VAL 97 -8.297 -3.121 2.269 837 HG23 VAL 97 2HG2 VAL 97 -8.069 -1.980 0.943 838 H ARG 98 H ARG 98 -12.077 -0.029 2.826 839 HA ARG 98 HA ARG 98 -11.610 1.916 4.793 840 HB2 ARG 98 2HB ARG 98 -12.718 2.384 2.639 841 HB3 ARG 98 3HB ARG 98 -14.115 1.448 3.154 842 HG2 ARG 98 2HG ARG 98 -14.609 3.784 3.397 843 HG3 ARG 98 3HG ARG 98 -14.468 3.066 5.001 844 HD2 ARG 98 2HD ARG 98 -12.116 3.913 5.099 845 HD3 ARG 98 3HD ARG 98 -12.405 4.746 3.570 846 HE ARG 98 HE ARG 98 -14.280 5.376 5.678 847 HH11 ARG 98 1HH1 ARG 98 -11.356 6.263 4.091 848 HH12 ARG 98 2HH1 ARG 98 -11.356 7.860 4.747 849 HH21 ARG 98 1HH2 ARG 98 -14.267 7.423 6.508 850 HH22 ARG 98 2HH2 ARG 98 -12.987 8.511 6.097 851 H ARG 99 H ARG 99 -14.107 -0.612 4.618 852 HA ARG 99 HA ARG 99 -15.539 0.126 6.924 853 HB2 ARG 99 2HB ARG 99 -16.397 -1.364 5.151 854 HB3 ARG 99 3HB ARG 99 -15.276 -2.616 5.661 855 HG2 ARG 99 2HG ARG 99 -17.129 -1.556 7.724 856 HG3 ARG 99 3HG ARG 99 -17.837 -2.529 6.437 857 HD2 ARG 99 2HD ARG 99 -15.558 -3.372 8.235 858 HD3 ARG 99 3HD ARG 99 -17.238 -3.888 8.391 859 HE ARG 99 HE ARG 99 -16.279 -4.471 5.797 860 HH11 ARG 99 1HH1 ARG 99 -16.026 -5.564 9.056 861 HH12 ARG 99 2HH1 ARG 99 -15.615 -7.179 8.592 862 HH21 ARG 99 1HH2 ARG 99 -15.797 -6.527 5.213 863 HH22 ARG 99 2HH2 ARG 99 -15.506 -7.725 6.429 864 H ARG 100 H ARG 100 -12.502 -1.493 6.614 865 HA ARG 100 HA ARG 100 -12.523 -2.640 9.270 866 HB2 ARG 100 2HB ARG 100 -10.317 -2.292 7.232 867 HB3 ARG 100 3HB ARG 100 -10.100 -3.098 8.781 868 HG2 ARG 100 2HG ARG 100 -11.728 -4.789 8.158 869 HG3 ARG 100 3HG ARG 100 -12.036 -3.955 6.637 870 HD2 ARG 100 2HD ARG 100 -9.781 -4.376 5.889 871 HD3 ARG 100 3HD ARG 100 -9.354 -5.080 7.450 872 HE ARG 100 HE ARG 100 -11.481 -6.560 6.491 873 HH11 ARG 100 1HH1 ARG 100 -8.302 -5.808 5.422 874 HH12 ARG 100 2HH1 ARG 100 -8.079 -7.338 4.655 875 HH21 ARG 100 1HH2 ARG 100 -11.192 -8.516 5.493 876 HH22 ARG 100 2HH2 ARG 100 -9.700 -8.862 4.690 877 H GLY 101 H GLY 101 -12.468 0.472 8.376 878 HA2 GLY 101 2HA GLY 101 -12.150 2.286 9.834 879 HA3 GLY 101 3HA GLY 101 -11.130 1.276 10.844 880 H PHE 102 H PHE 102 -10.257 1.038 7.588 881 HA PHE 102 HA PHE 102 -7.903 2.718 8.099 882 HB2 PHE 102 2HB PHE 102 -8.410 0.560 6.042 883 HB3 PHE 102 3HB PHE 102 -6.931 1.512 6.131 884 HD1 PHE 102 HD1 PHE 102 -5.899 1.577 8.614 885 HD2 PHE 102 HD2 PHE 102 -8.336 -1.531 7.017 886 HE1 PHE 102 HE1 PHE 102 -4.954 0.001 10.245 887 HE2 PHE 102 HE2 PHE 102 -7.390 -3.112 8.649 888 HZ PHE 102 HZ PHE 102 -5.695 -2.342 10.264 889 H GLU 103 H GLU 103 -7.329 4.435 6.856 890 HA GLU 103 HA GLU 103 -9.332 5.550 5.077 891 HB2 GLU 103 2HB GLU 103 -6.637 6.634 5.947 892 HB3 GLU 103 3HB GLU 103 -7.856 7.532 5.048 893 HG2 GLU 103 2HG GLU 103 -9.407 7.302 6.933 894 HG3 GLU 103 3HG GLU 103 -8.177 6.418 7.833 895 H VAL 104 H VAL 104 -9.368 4.476 3.176 896 HA VAL 104 HA VAL 104 -6.868 3.806 1.812 897 HB VAL 104 HB VAL 104 -8.459 1.992 2.058 898 HG11 VAL 104 1HG1 VAL 104 -10.399 3.686 0.476 899 HG12 VAL 104 2HG1 VAL 104 -10.523 3.293 2.189 900 HG13 VAL 104 3HG1 VAL 104 -10.656 2.016 0.981 901 HG21 VAL 104 3HG2 VAL 104 -8.289 2.917 -0.815 902 HG22 VAL 104 1HG2 VAL 104 -8.645 1.273 -0.281 903 HG23 VAL 104 2HG2 VAL 104 -7.068 1.987 0.054 904 H ARG 105 H ARG 105 -6.264 4.589 -0.152 905 HA ARG 105 HA ARG 105 -8.090 6.450 -1.545 906 HB2 ARG 105 2HB ARG 105 -5.114 6.603 -1.112 907 HB3 ARG 105 3HB ARG 105 -5.858 7.413 -2.489 908 HG2 ARG 105 2HG ARG 105 -7.355 8.600 -0.861 909 HG3 ARG 105 3HG ARG 105 -6.384 7.905 0.438 910 HD2 ARG 105 2HD ARG 105 -4.403 9.026 -0.392 911 HD3 ARG 105 3HD ARG 105 -5.296 9.633 -1.787 912 HE ARG 105 HE ARG 105 -6.318 10.407 0.817 913 HH11 ARG 105 1HH1 ARG 105 -4.428 11.265 -1.930 914 HH12 ARG 105 2HH1 ARG 105 -4.466 12.953 -1.571 915 HH21 ARG 105 1HH2 ARG 105 -6.369 12.563 1.271 916 HH22 ARG 105 2HH2 ARG 105 -5.542 13.686 0.252 917 H THR 106 H THR 106 -8.614 5.954 -3.581 918 HA THR 106 HA THR 106 -7.414 3.561 -4.791 919 HB THR 106 HB THR 106 -9.413 3.588 -6.279 920 HG1 THR 106 HG1 THR 106 -9.914 5.813 -6.220 921 HG21 THR 106 3HG2 THR 106 -10.021 3.689 -3.318 922 HG22 THR 106 1HG2 THR 106 -9.464 2.278 -4.219 923 HG23 THR 106 2HG2 THR 106 -11.055 2.966 -4.550 924 H VAL 107 H VAL 107 -5.901 3.838 -6.331 925 HA VAL 107 HA VAL 107 -6.216 6.079 -8.233 926 HB VAL 107 HB VAL 107 -3.758 6.310 -8.364 927 HG11 VAL 107 1HG1 VAL 107 -3.443 7.487 -6.239 928 HG12 VAL 107 2HG1 VAL 107 -4.864 6.679 -5.574 929 HG13 VAL 107 3HG1 VAL 107 -5.039 7.807 -6.918 930 HG21 VAL 107 3HG2 VAL 107 -3.730 4.383 -6.029 931 HG22 VAL 107 1HG2 VAL 107 -2.340 5.305 -6.604 932 HG23 VAL 107 2HG2 VAL 107 -3.080 4.087 -7.642 933 H THR 108 H THR 108 -5.816 5.658 -10.369 934 HA THR 108 HA THR 108 -5.186 2.856 -11.090 935 HB THR 108 HB THR 108 -6.428 3.186 -13.169 936 HG1 THR 108 HG1 THR 108 -7.256 5.734 -12.210 937 HG21 THR 108 3HG2 THR 108 -8.699 3.417 -12.260 938 HG22 THR 108 1HG2 THR 108 -8.034 4.074 -10.763 939 HG23 THR 108 2HG2 THR 108 -7.695 2.405 -11.222 940 H SER 109 H SER 109 -4.335 6.193 -11.592 941 HA SER 109 HA SER 109 -2.257 5.410 -13.540 942 HB2 SER 109 2HB SER 109 -3.429 8.159 -13.009 943 HB3 SER 109 3HB SER 109 -2.174 7.798 -14.191 944 HG SER 109 HG SER 109 -4.777 7.714 -14.544 945 HA PRO 110 HA PRO 110 0.875 5.842 -10.475 946 HB2 PRO 110 2HB PRO 110 2.936 6.823 -12.065 947 HB3 PRO 110 3HB PRO 110 2.496 5.122 -11.895 948 HG2 PRO 110 2HG PRO 110 1.747 7.071 -14.038 949 HG3 PRO 110 3HG PRO 110 2.198 5.359 -14.182 950 HD2 PRO 110 2HD PRO 110 -0.363 6.134 -14.341 951 HD3 PRO 110 3HD PRO 110 0.087 4.620 -13.524 952 H ASP 111 H ASP 111 0.237 8.684 -12.521 953 HA ASP 111 HA ASP 111 1.658 10.488 -10.816 954 HB2 ASP 111 2HB ASP 111 -0.364 10.939 -13.006 955 HB3 ASP 111 3HB ASP 111 0.358 12.265 -12.094 956 H ASP 112 H ASP 112 -1.749 9.484 -10.971 957 HA ASP 112 HA ASP 112 -2.710 11.245 -8.985 958 HB2 ASP 112 2HB ASP 112 -3.635 8.487 -9.817 959 HB3 ASP 112 3HB ASP 112 -4.488 9.469 -8.628 960 H PHE 113 H PHE 113 -1.186 8.052 -8.768 961 HA PHE 113 HA PHE 113 -1.215 7.749 -5.978 962 HB2 PHE 113 2HB PHE 113 -0.505 5.888 -7.289 963 HB3 PHE 113 3HB PHE 113 0.743 6.834 -8.096 964 HD1 PHE 113 HD1 PHE 113 -0.222 5.389 -4.808 965 HD2 PHE 113 HD2 PHE 113 2.925 6.912 -7.240 966 HE1 PHE 113 HE1 PHE 113 1.426 4.645 -3.141 967 HE2 PHE 113 HE2 PHE 113 4.577 6.165 -5.582 968 HZ PHE 113 HZ PHE 113 3.830 5.032 -3.528 969 H LYS 114 H LYS 114 1.158 9.344 -8.084 970 HA LYS 114 HA LYS 114 3.054 10.099 -6.202 971 HB2 LYS 114 2HB LYS 114 3.367 10.289 -8.639 972 HB3 LYS 114 3HB LYS 114 2.198 11.602 -8.691 973 HG2 LYS 114 2HG LYS 114 3.697 12.929 -7.218 974 HG3 LYS 114 3HG LYS 114 4.883 11.629 -7.319 975 HD2 LYS 114 2HD LYS 114 3.805 13.146 -9.701 976 HD3 LYS 114 3HD LYS 114 5.311 13.537 -8.878 977 HE2 LYS 114 2HE LYS 114 5.964 12.252 -10.733 978 HE3 LYS 114 3HE LYS 114 6.016 11.128 -9.379 979 HZ1 LYS 114 3HZ LYS 114 3.889 10.241 -10.068 980 HZ2 LYS 114 1HZ LYS 114 4.988 10.162 -11.347 981 HZ3 LYS 114 2HZ LYS 114 3.792 11.352 -11.339 982 H LYS 115 H LYS 115 0.366 12.151 -7.428 983 HA LYS 115 HA LYS 115 0.891 14.276 -5.644 984 HB2 LYS 115 2HB LYS 115 -1.435 15.066 -6.278 985 HB3 LYS 115 3HB LYS 115 -0.301 14.836 -7.596 986 HG2 LYS 115 2HG LYS 115 -2.211 13.919 -8.472 987 HG3 LYS 115 3HG LYS 115 -1.412 12.495 -7.815 988 HD2 LYS 115 2HD LYS 115 -3.741 12.389 -7.245 989 HD3 LYS 115 3HD LYS 115 -2.829 12.717 -5.771 990 HE2 LYS 115 2HE LYS 115 -3.440 15.048 -5.849 991 HE3 LYS 115 3HE LYS 115 -4.203 14.839 -7.426 992 HZ1 LYS 115 3HZ LYS 115 -5.827 13.373 -6.408 993 HZ2 LYS 115 1HZ LYS 115 -5.839 14.887 -5.653 994 HZ3 LYS 115 2HZ LYS 115 -5.097 13.571 -4.895 995 H SER 116 H SER 116 -1.214 11.452 -5.315 996 HA SER 116 HA SER 116 -2.500 12.266 -2.920 997 HB2 SER 116 2HB SER 116 -1.919 9.495 -4.000 998 HB3 SER 116 3HB SER 116 -2.901 9.799 -2.566 999 HG SER 116 HG SER 116 -3.482 10.204 -5.253 1000 H LEU 117 H LEU 117 0.458 10.403 -3.507 1001 HA LEU 117 HA LEU 117 1.071 9.748 -0.851 1002 HB2 LEU 117 2HB LEU 117 2.142 8.715 -2.801 1003 HB3 LEU 117 3HB LEU 117 2.932 10.231 -3.188 1004 HG LEU 117 HG LEU 117 4.211 10.081 -1.062 1005 HD11 LEU 117 1HD1 LEU 117 2.898 7.372 -0.825 1006 HD12 LEU 117 2HD1 LEU 117 2.660 8.750 0.251 1007 HD13 LEU 117 3HD1 LEU 117 4.231 7.954 0.173 1008 HD21 LEU 117 3HD2 LEU 117 5.726 8.307 -1.778 1009 HD22 LEU 117 1HD2 LEU 117 5.173 9.250 -3.162 1010 HD23 LEU 117 2HD2 LEU 117 4.482 7.658 -2.847 1011 H GLU 118 H GLU 118 2.333 12.456 -2.830 1012 HA GLU 118 HA GLU 118 3.915 13.627 -0.842 1013 HB2 GLU 118 2HB GLU 118 2.519 14.954 -3.179 1014 HB3 GLU 118 3HB GLU 118 3.777 15.706 -2.204 1015 HG2 GLU 118 2HG GLU 118 5.313 13.857 -2.882 1016 HG3 GLU 118 3HG GLU 118 4.056 13.285 -3.979 1017 H ARG 119 H ARG 119 0.490 14.181 -1.607 1018 HA ARG 119 HA ARG 119 0.043 16.296 0.202 1019 HB2 ARG 119 2HB ARG 119 -1.803 14.197 -0.943 1020 HB3 ARG 119 3HB ARG 119 -2.378 15.483 0.109 1021 HG2 ARG 119 2HG ARG 119 -0.956 15.904 -2.518 1022 HG3 ARG 119 3HG ARG 119 -2.704 15.975 -2.281 1023 HD2 ARG 119 2HD ARG 119 -0.638 17.779 -1.015 1024 HD3 ARG 119 3HD ARG 119 -1.779 18.215 -2.286 1025 HE ARG 119 HE ARG 119 -3.282 17.293 -0.156 1026 HH11 ARG 119 1HH1 ARG 119 -1.189 19.935 -0.858 1027 HH12 ARG 119 2HH1 ARG 119 -1.874 20.941 0.371 1028 HH21 ARG 119 1HH2 ARG 119 -4.167 18.612 1.392 1029 HH22 ARG 119 2HH2 ARG 119 -3.554 20.214 1.600 1030 H LEU 120 H LEU 120 -0.498 12.785 0.633 1031 HA LEU 120 HA LEU 120 -1.455 12.901 3.258 1032 HB2 LEU 120 2HB LEU 120 0.051 10.692 1.849 1033 HB3 LEU 120 3HB LEU 120 -0.744 10.498 3.402 1034 HG LEU 120 HG LEU 120 -2.123 11.188 0.799 1035 HD11 LEU 120 1HD1 LEU 120 -1.302 8.881 0.855 1036 HD12 LEU 120 2HD1 LEU 120 -3.061 8.944 0.927 1037 HD13 LEU 120 3HD1 LEU 120 -2.131 8.620 2.390 1038 HD21 LEU 120 3HD2 LEU 120 -3.268 10.628 3.540 1039 HD22 LEU 120 1HD2 LEU 120 -4.201 10.848 2.059 1040 HD23 LEU 120 2HD2 LEU 120 -3.258 12.186 2.713 1041 H ILE 121 H ILE 121 1.895 12.487 2.106 1042 HA ILE 121 HA ILE 121 3.175 12.066 4.540 1043 HB ILE 121 HB ILE 121 4.204 13.562 2.117 1044 HG12 ILE 121 2HG1 ILE 121 4.579 10.679 2.986 1045 HG13 ILE 121 3HG1 ILE 121 3.503 11.222 1.701 1046 HG21 ILE 121 1HG2 ILE 121 5.543 14.127 4.081 1047 HG22 ILE 121 2HG2 ILE 121 6.459 13.101 2.979 1048 HG23 ILE 121 3HG2 ILE 121 5.758 12.414 4.443 1049 HD11 ILE 121 3HD1 ILE 121 5.446 12.054 0.455 1050 HD12 ILE 121 1HD1 ILE 121 5.540 10.323 0.777 1051 HD13 ILE 121 2HD1 ILE 121 6.504 11.449 1.731 1052 H ARG 122 H ARG 122 2.544 15.201 2.939 1053 HA ARG 122 HA ARG 122 3.826 16.816 4.859 1054 HB2 ARG 122 2HB ARG 122 1.487 17.579 3.096 1055 HB3 ARG 122 3HB ARG 122 2.609 18.687 3.875 1056 HG2 ARG 122 2HG ARG 122 3.290 16.702 1.707 1057 HG3 ARG 122 3HG ARG 122 3.099 18.442 1.505 1058 HD2 ARG 122 2HD ARG 122 4.999 18.799 3.054 1059 HD3 ARG 122 3HD ARG 122 5.210 17.049 3.161 1060 HE ARG 122 HE ARG 122 5.264 17.854 0.460 1061 HH11 ARG 122 1HH1 ARG 122 7.196 17.925 3.321 1062 HH12 ARG 122 2HH1 ARG 122 8.672 18.048 2.430 1063 HH21 ARG 122 1HH2 ARG 122 7.177 17.994 -0.654 1064 HH22 ARG 122 2HH2 ARG 122 8.662 18.101 0.228 1065 H GLU 123 H GLU 123 0.610 15.434 4.786 1066 HA GLU 123 HA GLU 123 -0.390 17.114 6.928 1067 HB2 GLU 123 2HB GLU 123 -1.645 14.720 5.562 1068 HB3 GLU 123 3HB GLU 123 -2.464 15.804 6.679 1069 HG2 GLU 123 2HG GLU 123 -1.281 16.636 4.032 1070 HG3 GLU 123 3HG GLU 123 -2.980 16.250 4.298 1071 H VAL 124 H VAL 124 0.211 13.592 6.550 1072 HA VAL 124 HA VAL 124 -0.422 12.903 9.203 1073 HB VAL 124 HB VAL 124 -0.284 11.257 7.349 1074 HG11 VAL 124 1HG1 VAL 124 1.768 12.036 6.274 1075 HG12 VAL 124 2HG1 VAL 124 1.881 10.324 6.685 1076 HG13 VAL 124 3HG1 VAL 124 2.708 11.526 7.677 1077 HG21 VAL 124 3HG2 VAL 124 -0.308 10.500 9.675 1078 HG22 VAL 124 1HG2 VAL 124 1.452 10.593 9.733 1079 HG23 VAL 124 2HG2 VAL 124 0.664 9.424 8.669 1080 H GLY 125 H GLY 125 2.619 13.965 7.756 1081 HA2 GLY 125 2HA GLY 125 4.161 13.492 10.162 1082 HA3 GLY 125 3HA GLY 125 4.710 14.303 8.706 1083 H SER 126 H SER 126 1.765 15.503 10.013 1084 HA SER 126 HA SER 126 3.137 17.592 11.559 1085 HB2 SER 126 2HB SER 126 1.109 18.193 9.386 1086 HB3 SER 126 3HB SER 126 1.884 19.374 10.441 1087 HG SER 126 HG SER 126 2.877 18.026 8.220 1088 H LEU 127 H LEU 127 2.127 17.963 13.451 1089 HA LEU 127 HA LEU 127 -0.504 16.978 14.022 1090 HB2 LEU 127 2HB LEU 127 1.482 18.661 15.507 1091 HB3 LEU 127 3HB LEU 127 -0.173 18.577 16.084 1092 HG LEU 127 HG LEU 127 1.692 16.230 15.739 1093 HD11 LEU 127 1HD1 LEU 127 1.623 16.138 18.197 1094 HD12 LEU 127 2HD1 LEU 127 0.649 17.611 18.218 1095 HD13 LEU 127 3HD1 LEU 127 2.307 17.659 17.620 1096 HD21 LEU 127 3HD2 LEU 127 -0.098 14.955 16.872 1097 HD22 LEU 127 1HD2 LEU 127 -0.615 15.589 15.308 1098 HD23 LEU 127 2HD2 LEU 127 -1.137 16.382 16.794 1099 H GLU 128 H GLU 128 0.721 20.317 14.162 1100 HA GLU 128 HA GLU 128 -1.945 21.211 13.296 1101 HB2 GLU 128 2HB GLU 128 -0.920 21.786 15.672 1102 HB3 GLU 128 3HB GLU 128 -0.070 23.034 14.767 1103 HG2 GLU 128 2HG GLU 128 -2.212 23.911 13.974 1104 HG3 GLU 128 3HG GLU 128 -3.051 22.650 14.875 1105 H HIS 129 H HIS 129 -1.232 20.940 11.076 1106 HA HIS 129 HA HIS 129 0.964 22.423 10.006 1107 HB2 HIS 129 2HB HIS 129 -0.051 20.365 8.960 1108 HB3 HIS 129 3HB HIS 129 -1.440 21.345 8.503 1109 HD1 HIS 129 HD1 HIS 129 -0.532 20.380 6.065 1110 HD2 HIS 129 HD2 HIS 129 1.685 23.387 7.886 1111 HE1 HIS 129 HE1 HIS 129 0.884 21.368 4.248 1112 HE2 HIS 129 HE2 HIS 129 2.044 23.316 5.330 1113 H HIS 130 H HIS 130 -2.484 23.027 10.371 1114 HA HIS 130 HA HIS 130 -2.030 25.835 9.568 1115 HB2 HIS 130 2HB HIS 130 -3.804 24.674 8.286 1116 HB3 HIS 130 3HB HIS 130 -4.656 24.329 9.788 1117 HD1 HIS 130 HD1 HIS 130 -5.813 26.353 10.977 1118 HD2 HIS 130 HD2 HIS 130 -4.134 27.255 7.285 1119 HE1 HIS 130 HE1 HIS 130 -6.757 28.589 10.338 1120 HE2 HIS 130 HE2 HIS 130 -5.666 29.153 8.143 1121 H HIS 131 H HIS 131 -1.344 26.814 11.431 1122 HA HIS 131 HA HIS 131 -1.996 26.116 14.038 1123 HB2 HIS 131 2HB HIS 131 -1.144 28.297 14.723 1124 HB3 HIS 131 3HB HIS 131 -0.124 27.612 13.467 1125 HD1 HIS 131 HD1 HIS 131 0.032 28.885 11.247 1126 HD2 HIS 131 HD2 HIS 131 -2.608 30.603 13.956 1127 HE1 HIS 131 HE1 HIS 131 -0.498 31.153 10.324 1128 HE2 HIS 131 HE2 HIS 131 -1.957 32.231 12.059 1129 H HIS 132 H HIS 132 -3.617 26.585 15.460 1130 HA HIS 132 HA HIS 132 -5.686 28.491 14.664 1131 HB2 HIS 132 2HB HIS 132 -7.468 26.738 15.230 1132 HB3 HIS 132 3HB HIS 132 -6.646 26.593 13.683 1133 HD1 HIS 132 HD1 HIS 132 -5.545 24.416 13.189 1134 HD2 HIS 132 HD2 HIS 132 -6.515 24.796 17.211 1135 HE1 HIS 132 HE1 HIS 132 -5.149 22.155 14.195 1136 HE2 HIS 132 HE2 HIS 132 -5.549 22.463 16.651 1137 H HIS 133 H HIS 133 -6.019 29.778 16.290 1138 HA HIS 133 HA HIS 133 -5.396 29.328 18.995 1139 HB2 HIS 133 2HB HIS 133 -6.789 31.358 19.409 1140 HB3 HIS 133 3HB HIS 133 -5.628 31.575 18.103 1141 HD1 HIS 133 HD1 HIS 133 -9.332 30.865 18.594 1142 HD2 HIS 133 HD2 HIS 133 -6.727 32.371 15.721 1143 HE1 HIS 133 HE1 HIS 133 -10.787 31.664 16.716 1144 HE2 HIS 133 HE2 HIS 133 -9.205 32.658 15.036 1145 H HIS 134 H HIS 134 -7.139 29.618 20.774 1146 HA HIS 134 HA HIS 134 -9.227 27.612 20.414 1147 HB2 HIS 134 2HB HIS 134 -7.865 27.645 22.486 1148 HB3 HIS 134 3HB HIS 134 -8.508 29.237 22.873 1149 HD1 HIS 134 HD1 HIS 134 -10.930 29.355 23.767 1150 HD2 HIS 134 HD2 HIS 134 -9.648 25.496 22.902 1151 HE1 HIS 134 HE1 HIS 134 -12.633 27.834 24.802 1152 HE2 HIS 134 HE2 HIS 134 -11.781 25.511 24.369 Start of MODEL 7 1 H1 MET 1 1H MET 1 7.499 8.922 9.915 2 H2 MET 1 2H MET 1 8.139 7.465 9.353 3 H3 MET 1 3H MET 1 7.220 7.490 10.769 4 HA MET 1 HA MET 1 5.245 8.089 9.565 5 HB2 MET 1 2HB MET 1 7.079 8.008 7.152 6 HB3 MET 1 3HB MET 1 5.325 8.106 7.060 7 HG2 MET 1 2HG MET 1 6.420 10.278 6.743 8 HG3 MET 1 3HG MET 1 5.338 10.259 8.136 9 HE1 MET 1 3HE MET 1 7.710 12.413 7.432 10 HE2 MET 1 1HE MET 1 8.363 12.708 9.043 11 HE3 MET 1 2HE MET 1 6.618 12.621 8.802 12 H ASN 2 H ASN 2 3.849 6.463 8.724 13 HA ASN 2 HA ASN 2 5.035 3.889 7.957 14 HB2 ASN 2 2HB ASN 2 4.554 3.857 10.439 15 HB3 ASN 2 3HB ASN 2 2.851 4.095 10.059 16 HD21 ASN 2 1HD2 ASN 2 4.147 1.864 11.413 17 HD22 ASN 2 2HD2 ASN 2 3.766 0.457 10.493 18 H ILE 3 H ILE 3 4.081 3.213 6.128 19 HA ILE 3 HA ILE 3 1.244 3.606 5.657 20 HB ILE 3 HB ILE 3 2.021 5.717 4.847 21 HG12 ILE 3 2HG1 ILE 3 1.610 3.871 2.474 22 HG13 ILE 3 3HG1 ILE 3 0.329 4.591 3.445 23 HG21 ILE 3 1HG2 ILE 3 4.059 4.224 3.198 24 HG22 ILE 3 2HG2 ILE 3 4.387 5.199 4.630 25 HG23 ILE 3 3HG2 ILE 3 3.775 5.964 3.165 26 HD11 ILE 3 3HD1 ILE 3 0.607 5.779 1.362 27 HD12 ILE 3 1HD1 ILE 3 2.305 6.078 1.727 28 HD13 ILE 3 2HD1 ILE 3 1.046 6.816 2.718 29 H VAL 4 H VAL 4 0.378 2.049 4.388 30 HA VAL 4 HA VAL 4 2.214 0.047 3.226 31 HB VAL 4 HB VAL 4 -0.704 -0.304 3.969 32 HG11 VAL 4 1HG1 VAL 4 -0.229 -2.710 3.757 33 HG12 VAL 4 2HG1 VAL 4 1.408 -2.333 3.219 34 HG13 VAL 4 3HG1 VAL 4 0.025 -1.850 2.238 35 HG21 VAL 4 3HG2 VAL 4 1.758 -1.144 5.515 36 HG22 VAL 4 1HG2 VAL 4 0.093 -1.549 5.931 37 HG23 VAL 4 2HG2 VAL 4 0.628 0.131 5.974 38 H ILE 5 H ILE 5 2.085 -0.497 1.072 39 HA ILE 5 HA ILE 5 -0.051 0.781 -0.532 40 HB ILE 5 HB ILE 5 2.818 0.293 -1.374 41 HG12 ILE 5 2HG1 ILE 5 1.311 2.881 -0.864 42 HG13 ILE 5 3HG1 ILE 5 2.566 2.204 0.168 43 HG21 ILE 5 1HG2 ILE 5 1.295 -0.034 -3.247 44 HG22 ILE 5 2HG2 ILE 5 2.194 1.467 -3.455 45 HG23 ILE 5 3HG2 ILE 5 0.516 1.513 -2.916 46 HD11 ILE 5 3HD1 ILE 5 4.186 2.476 -1.647 47 HD12 ILE 5 1HD1 ILE 5 3.439 4.005 -1.184 48 HD13 ILE 5 2HD1 ILE 5 2.923 3.181 -2.655 49 H VAL 6 H VAL 6 -1.415 -0.707 -1.312 50 HA VAL 6 HA VAL 6 -0.500 -3.446 -1.824 51 HB VAL 6 HB VAL 6 -3.308 -2.304 -1.868 52 HG11 VAL 6 1HG1 VAL 6 -4.032 -4.663 -1.799 53 HG12 VAL 6 2HG1 VAL 6 -2.351 -5.171 -1.968 54 HG13 VAL 6 3HG1 VAL 6 -3.137 -4.279 -3.271 55 HG21 VAL 6 3HG2 VAL 6 -1.887 -3.899 0.275 56 HG22 VAL 6 1HG2 VAL 6 -3.592 -3.441 0.297 57 HG23 VAL 6 2HG2 VAL 6 -2.344 -2.198 0.368 58 H VAL 7 H VAL 7 0.156 -3.966 -3.833 59 HA VAL 7 HA VAL 7 -0.984 -2.491 -6.138 60 HB VAL 7 HB VAL 7 1.747 -3.787 -5.928 61 HG11 VAL 7 1HG1 VAL 7 0.543 -2.118 -8.144 62 HG12 VAL 7 2HG1 VAL 7 0.883 -3.848 -8.210 63 HG13 VAL 7 3HG1 VAL 7 2.210 -2.693 -8.078 64 HG21 VAL 7 3HG2 VAL 7 0.965 -0.867 -5.900 65 HG22 VAL 7 1HG2 VAL 7 2.618 -1.484 -5.967 66 HG23 VAL 7 2HG2 VAL 7 1.618 -1.792 -4.547 67 H PHE 8 H PHE 8 -2.293 -3.692 -7.402 68 HA PHE 8 HA PHE 8 -2.302 -6.580 -7.247 69 HB2 PHE 8 2HB PHE 8 -3.940 -4.615 -8.852 70 HB3 PHE 8 3HB PHE 8 -4.145 -6.358 -8.984 71 HD1 PHE 8 HD2 PHE 8 -4.502 -3.452 -6.743 72 HD2 PHE 8 HD1 PHE 8 -5.281 -7.605 -7.292 73 HE1 PHE 8 HE2 PHE 8 -6.042 -3.418 -4.826 74 HE2 PHE 8 HE1 PHE 8 -6.822 -7.572 -5.375 75 HZ PHE 8 HZ PHE 8 -7.204 -5.479 -4.139 76 H SER 9 H SER 9 -0.595 -4.375 -9.140 77 HA SER 9 HA SER 9 -0.438 -5.994 -11.540 78 HB2 SER 9 2HB SER 9 -0.283 -3.577 -11.790 79 HB3 SER 9 3HB SER 9 1.115 -3.525 -10.716 80 HG SER 9 HG SER 9 2.347 -4.068 -12.330 81 H THR 10 H THR 10 0.728 -7.811 -11.556 82 HA THR 10 HA THR 10 2.910 -8.290 -9.740 83 HB THR 10 HB THR 10 3.169 -10.448 -10.899 84 HG1 THR 10 HG1 THR 10 1.292 -10.738 -12.548 85 HG21 THR 10 3HG2 THR 10 0.954 -11.384 -10.409 86 HG22 THR 10 1HG2 THR 10 0.271 -9.757 -10.359 87 HG23 THR 10 2HG2 THR 10 1.456 -10.255 -9.149 88 H ASP 11 H ASP 11 2.713 -6.631 -12.641 89 HA ASP 11 HA ASP 11 5.260 -7.337 -13.770 90 HB2 ASP 11 2HB ASP 11 3.350 -6.472 -15.113 91 HB3 ASP 11 3HB ASP 11 3.523 -4.913 -14.313 92 H GLU 12 H GLU 12 7.157 -6.770 -12.873 93 HA GLU 12 HA GLU 12 7.407 -4.851 -10.815 94 HB2 GLU 12 2HB GLU 12 8.973 -6.700 -10.951 95 HB3 GLU 12 3HB GLU 12 9.556 -6.135 -12.513 96 HG2 GLU 12 2HG GLU 12 10.385 -4.075 -11.441 97 HG3 GLU 12 3HG GLU 12 9.844 -4.687 -9.881 98 H GLU 13 H GLU 13 7.965 -4.598 -14.305 99 HA GLU 13 HA GLU 13 9.504 -2.295 -14.406 100 HB2 GLU 13 2HB GLU 13 8.961 -3.664 -16.376 101 HB3 GLU 13 3HB GLU 13 7.297 -3.109 -16.312 102 HG2 GLU 13 2HG GLU 13 8.486 -1.937 -18.043 103 HG3 GLU 13 3HG GLU 13 8.056 -0.812 -16.756 104 H THR 14 H THR 14 5.930 -2.492 -14.356 105 HA THR 14 HA THR 14 5.438 0.288 -14.245 106 HB THR 14 HB THR 14 3.769 -1.984 -13.122 107 HG1 THR 14 HG1 THR 14 2.641 -1.774 -15.091 108 HG21 THR 14 3HG2 THR 14 1.882 -0.417 -13.206 109 HG22 THR 14 1HG2 THR 14 2.975 0.879 -13.693 110 HG23 THR 14 2HG2 THR 14 3.129 0.149 -12.095 111 H LEU 15 H LEU 15 5.604 -2.093 -11.579 112 HA LEU 15 HA LEU 15 5.212 -0.322 -9.447 113 HB2 LEU 15 2HB LEU 15 5.094 -2.744 -9.207 114 HB3 LEU 15 3HB LEU 15 6.810 -2.883 -9.544 115 HG LEU 15 HG LEU 15 7.284 -1.607 -7.458 116 HD11 LEU 15 1HD1 LEU 15 5.207 -0.373 -7.263 117 HD12 LEU 15 2HD1 LEU 15 5.498 -1.322 -5.806 118 HD13 LEU 15 3HD1 LEU 15 4.316 -1.871 -6.994 119 HD21 LEU 15 3HD2 LEU 15 7.368 -4.040 -7.459 120 HD22 LEU 15 1HD2 LEU 15 5.641 -4.115 -7.098 121 HD23 LEU 15 2HD2 LEU 15 6.763 -3.438 -5.916 122 H ARG 16 H ARG 16 8.086 -1.039 -11.286 123 HA ARG 16 HA ARG 16 10.081 -0.133 -9.549 124 HB2 ARG 16 2HB ARG 16 10.378 -1.437 -11.677 125 HB3 ARG 16 3HB ARG 16 10.080 0.045 -12.573 126 HG2 ARG 16 2HG ARG 16 12.079 1.050 -11.633 127 HG3 ARG 16 3HG ARG 16 12.348 -0.375 -10.626 128 HD2 ARG 16 2HD ARG 16 12.356 -0.308 -13.647 129 HD3 ARG 16 3HD ARG 16 13.780 -0.407 -12.612 130 HE ARG 16 HE ARG 16 12.827 -2.598 -11.842 131 HH11 ARG 16 1HH1 ARG 16 12.032 -1.314 -14.943 132 HH12 ARG 16 2HH1 ARG 16 11.729 -2.867 -15.631 133 HH21 ARG 16 1HH2 ARG 16 12.423 -4.603 -12.746 134 HH22 ARG 16 2HH2 ARG 16 11.937 -4.703 -14.404 135 H LYS 17 H LYS 17 8.035 1.620 -11.824 136 HA LYS 17 HA LYS 17 9.268 4.168 -11.542 137 HB2 LYS 17 2HB LYS 17 6.564 3.233 -12.488 138 HB3 LYS 17 3HB LYS 17 6.904 4.947 -12.323 139 HG2 LYS 17 2HG LYS 17 7.196 4.049 -14.628 140 HG3 LYS 17 3HG LYS 17 8.624 4.850 -13.974 141 HD2 LYS 17 2HD LYS 17 9.641 2.705 -13.473 142 HD3 LYS 17 3HD LYS 17 8.183 1.860 -13.993 143 HE2 LYS 17 2HE LYS 17 9.850 3.618 -15.791 144 HE3 LYS 17 3HE LYS 17 10.039 1.871 -15.670 145 HZ1 LYS 17 3HZ LYS 17 8.643 2.539 -17.542 146 HZ2 LYS 17 1HZ LYS 17 7.542 3.251 -16.476 147 HZ3 LYS 17 2HZ LYS 17 7.794 1.581 -16.435 148 H PHE 18 H PHE 18 6.587 2.573 -9.859 149 HA PHE 18 HA PHE 18 5.818 4.733 -8.219 150 HB2 PHE 18 2HB PHE 18 5.565 1.742 -7.843 151 HB3 PHE 18 3HB PHE 18 4.874 2.908 -6.719 152 HD1 PHE 18 HD1 PHE 18 4.914 2.222 -10.402 153 HD2 PHE 18 HD2 PHE 18 2.663 3.468 -7.008 154 HE1 PHE 18 HE1 PHE 18 2.899 2.375 -11.799 155 HE2 PHE 18 HE2 PHE 18 0.644 3.627 -8.404 156 HZ PHE 18 HZ PHE 18 0.760 3.080 -10.803 157 H LYS 19 H LYS 19 8.273 2.220 -7.778 158 HA LYS 19 HA LYS 19 8.921 2.860 -5.095 159 HB2 LYS 19 2HB LYS 19 10.685 1.582 -7.197 160 HB3 LYS 19 3HB LYS 19 10.978 1.569 -5.461 161 HG2 LYS 19 2HG LYS 19 8.797 0.354 -5.197 162 HG3 LYS 19 3HG LYS 19 8.740 0.216 -6.953 163 HD2 LYS 19 2HD LYS 19 10.916 -0.881 -5.159 164 HD3 LYS 19 3HD LYS 19 9.623 -1.821 -5.899 165 HE2 LYS 19 2HE LYS 19 11.451 -2.204 -7.297 166 HE3 LYS 19 3HE LYS 19 10.546 -0.951 -8.141 167 HZ1 LYS 19 3HZ LYS 19 12.095 0.690 -7.421 168 HZ2 LYS 19 1HZ LYS 19 12.992 -0.600 -8.043 169 HZ3 LYS 19 2HZ LYS 19 12.864 -0.387 -6.370 170 H ASP 20 H ASP 20 10.010 4.196 -8.175 171 HA ASP 20 HA ASP 20 12.203 5.643 -7.070 172 HB2 ASP 20 2HB ASP 20 11.926 5.079 -9.511 173 HB3 ASP 20 3HB ASP 20 10.697 6.342 -9.596 174 H ILE 21 H ILE 21 8.783 6.347 -7.495 175 HA ILE 21 HA ILE 21 8.831 9.083 -6.815 176 HB ILE 21 HB ILE 21 6.647 7.052 -6.266 177 HG12 ILE 21 2HG1 ILE 21 7.032 8.934 -8.617 178 HG13 ILE 21 3HG1 ILE 21 7.312 7.197 -8.650 179 HG21 ILE 21 1HG2 ILE 21 5.128 8.995 -6.224 180 HG22 ILE 21 2HG2 ILE 21 6.516 10.074 -6.367 181 HG23 ILE 21 3HG2 ILE 21 6.326 9.066 -4.932 182 HD11 ILE 21 3HD1 ILE 21 4.666 8.555 -8.183 183 HD12 ILE 21 1HD1 ILE 21 4.943 6.812 -8.196 184 HD13 ILE 21 2HD1 ILE 21 5.191 7.757 -9.665 185 H ILE 22 H ILE 22 8.681 6.163 -4.818 186 HA ILE 22 HA ILE 22 8.521 7.404 -2.285 187 HB ILE 22 HB ILE 22 9.830 4.769 -3.029 188 HG12 ILE 22 2HG1 ILE 22 7.011 5.362 -2.062 189 HG13 ILE 22 3HG1 ILE 22 7.457 4.906 -3.704 190 HG21 ILE 22 1HG2 ILE 22 9.482 4.144 -0.675 191 HG22 ILE 22 2HG2 ILE 22 8.888 5.770 -0.337 192 HG23 ILE 22 3HG2 ILE 22 10.561 5.530 -0.833 193 HD11 ILE 22 3HD1 ILE 22 6.532 3.025 -2.507 194 HD12 ILE 22 1HD1 ILE 22 7.752 3.194 -1.244 195 HD13 ILE 22 2HD1 ILE 22 8.231 2.735 -2.879 196 H LYS 23 H LYS 23 11.334 6.332 -4.199 197 HA LYS 23 HA LYS 23 13.416 7.204 -2.569 198 HB2 LYS 23 2HB LYS 23 13.184 7.159 -5.587 199 HB3 LYS 23 3HB LYS 23 14.689 7.480 -4.739 200 HG2 LYS 23 2HG LYS 23 14.725 5.282 -3.814 201 HG3 LYS 23 3HG LYS 23 13.088 4.954 -4.382 202 HD2 LYS 23 2HD LYS 23 14.784 3.855 -5.785 203 HD3 LYS 23 3HD LYS 23 13.841 5.032 -6.695 204 HE2 LYS 23 2HE LYS 23 16.506 5.745 -5.493 205 HE3 LYS 23 3HE LYS 23 16.388 4.956 -7.063 206 HZ1 LYS 23 3HZ LYS 23 14.941 6.831 -7.773 207 HZ2 LYS 23 1HZ LYS 23 16.524 7.291 -7.399 208 HZ3 LYS 23 2HZ LYS 23 15.280 7.608 -6.309 209 H LYS 24 H LYS 24 11.708 9.013 -5.110 210 HA LYS 24 HA LYS 24 13.009 11.445 -4.989 211 HB2 LYS 24 2HB LYS 24 11.453 11.137 -6.729 212 HB3 LYS 24 3HB LYS 24 10.161 10.695 -5.619 213 HG2 LYS 24 2HG LYS 24 10.105 13.020 -4.795 214 HG3 LYS 24 3HG LYS 24 11.349 13.446 -5.972 215 HD2 LYS 24 2HD LYS 24 9.879 12.962 -7.802 216 HD3 LYS 24 3HD LYS 24 8.673 12.262 -6.717 217 HE2 LYS 24 2HE LYS 24 9.558 15.151 -6.667 218 HE3 LYS 24 3HE LYS 24 8.109 14.558 -7.477 219 HZ1 LYS 24 3HZ LYS 24 7.717 15.478 -5.219 220 HZ2 LYS 24 1HZ LYS 24 8.624 14.203 -4.575 221 HZ3 LYS 24 2HZ LYS 24 7.189 13.884 -5.406 222 H ASN 25 H ASN 25 10.198 10.414 -3.051 223 HA ASN 25 HA ASN 25 10.058 12.932 -1.662 224 HB2 ASN 25 2HB ASN 25 8.623 10.320 -1.137 225 HB3 ASN 25 3HB ASN 25 8.238 11.865 -0.381 226 HD21 ASN 25 1HD2 ASN 25 6.529 10.229 -2.024 227 HD22 ASN 25 2HD2 ASN 25 6.083 11.191 -3.383 228 H GLY 26 H GLY 26 12.094 10.309 -1.291 229 HA2 GLY 26 2HA GLY 26 13.886 10.230 0.198 230 HA3 GLY 26 3HA GLY 26 13.108 11.464 1.170 231 H PHE 27 H PHE 27 12.000 8.213 0.173 232 HA PHE 27 HA PHE 27 12.063 7.389 3.003 233 HB2 PHE 27 2HB PHE 27 9.743 7.031 1.091 234 HB3 PHE 27 3HB PHE 27 9.880 6.185 2.628 235 HD1 PHE 27 HD1 PHE 27 9.822 7.473 4.757 236 HD2 PHE 27 HD2 PHE 27 9.014 9.297 0.990 237 HE1 PHE 27 HE1 PHE 27 8.756 9.369 5.906 238 HE2 PHE 27 HE2 PHE 27 7.953 11.195 2.137 239 HZ PHE 27 HZ PHE 27 7.823 11.233 4.597 240 H LYS 28 H LYS 28 12.089 5.084 3.352 241 HA LYS 28 HA LYS 28 13.705 3.682 1.393 242 HB2 LYS 28 2HB LYS 28 12.687 2.819 4.115 243 HB3 LYS 28 3HB LYS 28 13.868 1.945 3.150 244 HG2 LYS 28 2HG LYS 28 15.482 3.673 3.405 245 HG3 LYS 28 3HG LYS 28 14.291 4.771 4.099 246 HD2 LYS 28 2HD LYS 28 15.729 3.900 5.846 247 HD3 LYS 28 3HD LYS 28 14.091 3.292 6.065 248 HE2 LYS 28 2HE LYS 28 16.184 1.688 4.617 249 HE3 LYS 28 3HE LYS 28 16.061 1.662 6.373 250 HZ1 LYS 28 3HZ LYS 28 14.837 -0.159 5.521 251 HZ2 LYS 28 1HZ LYS 28 13.994 0.810 4.422 252 HZ3 LYS 28 2HZ LYS 28 13.706 0.965 6.081 253 H VAL 29 H VAL 29 13.158 1.690 0.390 254 HA VAL 29 HA VAL 29 10.245 1.246 0.150 255 HB VAL 29 HB VAL 29 12.417 0.433 -1.799 256 HG11 VAL 29 1HG1 VAL 29 10.451 -0.999 -1.944 257 HG12 VAL 29 2HG1 VAL 29 10.547 0.049 -3.360 258 HG13 VAL 29 3HG1 VAL 29 9.403 0.417 -2.067 259 HG21 VAL 29 3HG2 VAL 29 12.253 2.860 -1.676 260 HG22 VAL 29 1HG2 VAL 29 10.507 2.773 -1.909 261 HG23 VAL 29 2HG2 VAL 29 11.596 2.277 -3.206 262 H ARG 30 H ARG 30 9.395 -0.579 0.958 263 HA ARG 30 HA ARG 30 11.122 -2.977 1.196 264 HB2 ARG 30 2HB ARG 30 10.482 -2.138 3.399 265 HB3 ARG 30 3HB ARG 30 8.786 -2.143 2.939 266 HG2 ARG 30 2HG ARG 30 9.246 -4.046 4.345 267 HG3 ARG 30 3HG ARG 30 8.878 -4.605 2.714 268 HD2 ARG 30 2HD ARG 30 11.269 -4.892 2.268 269 HD3 ARG 30 3HD ARG 30 11.651 -4.295 3.882 270 HE ARG 30 HE ARG 30 10.431 -6.882 3.226 271 HH11 ARG 30 1HH1 ARG 30 11.763 -4.734 5.565 272 HH12 ARG 30 2HH1 ARG 30 11.951 -5.970 6.756 273 HH21 ARG 30 1HH2 ARG 30 10.675 -8.465 4.770 274 HH22 ARG 30 2HH2 ARG 30 11.337 -8.057 6.318 275 H THR 31 H THR 31 10.616 -4.426 -0.328 276 HA THR 31 HA THR 31 7.939 -4.523 -1.491 277 HB THR 31 HB THR 31 8.929 -6.249 -3.018 278 HG1 THR 31 HG1 THR 31 11.065 -6.775 -2.847 279 HG21 THR 31 3HG2 THR 31 10.384 -4.687 -4.252 280 HG22 THR 31 1HG2 THR 31 10.439 -3.632 -2.839 281 HG23 THR 31 2HG2 THR 31 8.912 -3.896 -3.682 282 H VAL 32 H VAL 32 6.406 -5.960 -0.939 283 HA VAL 32 HA VAL 32 7.201 -8.372 0.587 284 HB VAL 32 HB VAL 32 4.775 -6.607 1.014 285 HG11 VAL 32 1HG1 VAL 32 4.115 -8.946 1.239 286 HG12 VAL 32 2HG1 VAL 32 4.137 -8.155 2.814 287 HG13 VAL 32 3HG1 VAL 32 5.453 -9.235 2.352 288 HG21 VAL 32 3HG2 VAL 32 6.829 -5.748 2.022 289 HG22 VAL 32 1HG2 VAL 32 7.091 -7.294 2.834 290 HG23 VAL 32 2HG2 VAL 32 5.703 -6.293 3.265 291 H ARG 33 H ARG 33 6.474 -10.283 -0.173 292 HA ARG 33 HA ARG 33 4.266 -10.287 -2.149 293 HB2 ARG 33 2HB ARG 33 6.459 -11.004 -3.063 294 HB3 ARG 33 3HB ARG 33 6.529 -12.284 -1.860 295 HG2 ARG 33 2HG ARG 33 4.499 -13.290 -2.837 296 HG3 ARG 33 3HG ARG 33 4.481 -12.024 -4.065 297 HD2 ARG 33 2HD ARG 33 6.657 -14.076 -3.637 298 HD3 ARG 33 3HD ARG 33 5.472 -14.071 -4.940 299 HE ARG 33 HE ARG 33 7.266 -11.778 -4.694 300 HH11 ARG 33 1HH1 ARG 33 6.346 -14.627 -6.402 301 HH12 ARG 33 2HH1 ARG 33 7.317 -14.240 -7.780 302 HH21 ARG 33 1HH2 ARG 33 8.496 -11.296 -6.449 303 HH22 ARG 33 2HH2 ARG 33 8.518 -12.358 -7.813 304 H SER 34 H SER 34 5.508 -11.690 0.799 305 HA SER 34 HA SER 34 3.032 -13.275 1.107 306 HB2 SER 34 2HB SER 34 4.421 -14.910 2.429 307 HB3 SER 34 3HB SER 34 4.835 -14.833 0.717 308 HG SER 34 HG SER 34 6.756 -14.187 1.237 309 HA PRO 35 HA PRO 35 2.053 -11.192 4.828 310 HB2 PRO 35 2HB PRO 35 1.533 -13.289 6.593 311 HB3 PRO 35 3HB PRO 35 0.392 -12.635 5.416 312 HG2 PRO 35 2HG PRO 35 2.148 -15.048 5.217 313 HG3 PRO 35 3HG PRO 35 0.474 -14.830 4.672 314 HD2 PRO 35 2HD PRO 35 2.511 -14.775 2.940 315 HD3 PRO 35 3HD PRO 35 1.119 -13.687 2.749 316 H GLN 36 H GLN 36 4.378 -13.823 5.275 317 HA GLN 36 HA GLN 36 5.370 -13.164 7.792 318 HB2 GLN 36 2HB GLN 36 7.424 -14.367 7.091 319 HB3 GLN 36 3HB GLN 36 5.946 -15.245 6.720 320 HG2 GLN 36 2HG GLN 36 6.105 -14.399 4.381 321 HG3 GLN 36 3HG GLN 36 7.670 -13.697 4.791 322 HE21 GLN 36 1HE2 GLN 36 9.422 -15.075 5.176 323 HE22 GLN 36 2HE2 GLN 36 9.401 -16.732 4.679 324 H GLU 37 H GLU 37 6.264 -11.840 4.624 325 HA GLU 37 HA GLU 37 8.413 -10.228 5.584 326 HB2 GLU 37 2HB GLU 37 6.797 -10.234 3.043 327 HB3 GLU 37 3HB GLU 37 7.995 -8.985 3.353 328 HG2 GLU 37 2HG GLU 37 8.539 -11.950 3.271 329 HG3 GLU 37 3HG GLU 37 8.880 -10.804 1.975 330 H LEU 38 H LEU 38 4.960 -9.665 5.155 331 HA LEU 38 HA LEU 38 5.014 -6.871 5.666 332 HB2 LEU 38 2HB LEU 38 3.102 -8.086 4.627 333 HB3 LEU 38 3HB LEU 38 2.772 -8.849 6.170 334 HG LEU 38 HG LEU 38 2.282 -6.630 7.154 335 HD11 LEU 38 1HD1 LEU 38 3.681 -5.245 5.723 336 HD12 LEU 38 2HD1 LEU 38 2.011 -4.683 5.690 337 HD13 LEU 38 3HD1 LEU 38 2.657 -5.610 4.336 338 HD21 LEU 38 3HD2 LEU 38 0.690 -7.269 4.665 339 HD22 LEU 38 1HD2 LEU 38 0.144 -6.270 6.014 340 HD23 LEU 38 2HD2 LEU 38 0.459 -7.987 6.260 341 H LYS 39 H LYS 39 4.579 -9.705 7.775 342 HA LYS 39 HA LYS 39 4.340 -8.321 10.226 343 HB2 LYS 39 2HB LYS 39 3.783 -10.667 10.078 344 HB3 LYS 39 3HB LYS 39 5.420 -11.073 9.583 345 HG2 LYS 39 2HG LYS 39 6.210 -10.268 11.821 346 HG3 LYS 39 3HG LYS 39 4.516 -10.107 12.290 347 HD2 LYS 39 2HD LYS 39 4.152 -12.471 11.991 348 HD3 LYS 39 3HD LYS 39 5.766 -12.679 11.309 349 HE2 LYS 39 2HE LYS 39 6.714 -11.929 13.495 350 HE3 LYS 39 3HE LYS 39 5.076 -11.910 14.148 351 HZ1 LYS 39 3HZ LYS 39 6.333 -13.967 14.632 352 HZ2 LYS 39 1HZ LYS 39 6.375 -14.306 12.976 353 HZ3 LYS 39 2HZ LYS 39 4.892 -14.250 13.789 354 H ASP 40 H ASP 40 7.207 -9.742 8.649 355 HA ASP 40 HA ASP 40 9.116 -9.050 10.569 356 HB2 ASP 40 2HB ASP 40 9.530 -10.670 8.783 357 HB3 ASP 40 3HB ASP 40 9.434 -9.392 7.575 358 H SER 41 H SER 41 7.854 -7.192 7.847 359 HA SER 41 HA SER 41 9.730 -5.044 8.053 360 HB2 SER 41 2HB SER 41 8.229 -3.856 6.500 361 HB3 SER 41 3HB SER 41 8.520 -5.507 5.955 362 HG SER 41 HG SER 41 6.485 -5.952 6.211 363 H ILE 42 H ILE 42 6.225 -5.131 8.804 364 HA ILE 42 HA ILE 42 6.027 -2.643 10.006 365 HB ILE 42 HB ILE 42 4.438 -5.133 10.651 366 HG12 ILE 42 2HG1 ILE 42 3.849 -2.831 8.760 367 HG13 ILE 42 3HG1 ILE 42 4.392 -4.432 8.270 368 HG21 ILE 42 1HG2 ILE 42 3.806 -2.239 11.256 369 HG22 ILE 42 2HG2 ILE 42 4.188 -3.493 12.435 370 HG23 ILE 42 3HG2 ILE 42 2.704 -3.594 11.487 371 HD11 ILE 42 3HD1 ILE 42 1.795 -3.787 9.645 372 HD12 ILE 42 1HD1 ILE 42 2.343 -5.399 9.181 373 HD13 ILE 42 2HD1 ILE 42 2.013 -4.188 7.943 374 H GLU 43 H GLU 43 6.572 -5.762 11.694 375 HA GLU 43 HA GLU 43 6.734 -4.723 14.295 376 HB2 GLU 43 2HB GLU 43 7.707 -7.240 12.997 377 HB3 GLU 43 3HB GLU 43 8.236 -6.870 14.630 378 HG2 GLU 43 2HG GLU 43 5.355 -7.056 13.762 379 HG3 GLU 43 3HG GLU 43 6.260 -8.352 14.547 380 H GLU 44 H GLU 44 9.073 -4.692 11.738 381 HA GLU 44 HA GLU 44 11.316 -4.103 13.467 382 HB2 GLU 44 2HB GLU 44 11.554 -5.298 11.288 383 HB3 GLU 44 3HB GLU 44 11.077 -3.826 10.460 384 HG2 GLU 44 2HG GLU 44 13.436 -3.981 10.329 385 HG3 GLU 44 3HG GLU 44 13.058 -2.694 11.473 386 H LEU 45 H LEU 45 9.262 -2.293 11.204 387 HA LEU 45 HA LEU 45 10.618 0.173 11.382 388 HB2 LEU 45 2HB LEU 45 7.712 -0.327 10.720 389 HB3 LEU 45 3HB LEU 45 8.608 1.138 10.363 390 HG LEU 45 HG LEU 45 9.086 -1.595 9.155 391 HD11 LEU 45 1HD1 LEU 45 8.404 -0.525 7.062 392 HD12 LEU 45 2HD1 LEU 45 8.059 0.968 7.935 393 HD13 LEU 45 3HD1 LEU 45 7.114 -0.486 8.264 394 HD21 LEU 45 3HD2 LEU 45 10.759 -0.463 7.741 395 HD22 LEU 45 1HD2 LEU 45 11.206 -0.465 9.447 396 HD23 LEU 45 2HD2 LEU 45 10.562 1.001 8.706 397 H VAL 46 H VAL 46 7.966 -1.171 13.297 398 HA VAL 46 HA VAL 46 7.320 1.268 14.630 399 HB VAL 46 HB VAL 46 5.686 -0.535 14.462 400 HG11 VAL 46 1HG1 VAL 46 5.868 -2.573 15.793 401 HG12 VAL 46 2HG1 VAL 46 7.468 -2.081 16.347 402 HG13 VAL 46 3HG1 VAL 46 7.200 -2.447 14.643 403 HG21 VAL 46 3HG2 VAL 46 4.862 -0.519 16.775 404 HG22 VAL 46 1HG2 VAL 46 5.436 1.074 16.282 405 HG23 VAL 46 2HG2 VAL 46 6.431 0.063 17.331 406 H LYS 47 H LYS 47 9.502 -1.408 15.413 407 HA LYS 47 HA LYS 47 10.078 -0.387 18.071 408 HB2 LYS 47 2HB LYS 47 11.581 -2.549 16.585 409 HB3 LYS 47 3HB LYS 47 11.496 -2.297 18.323 410 HG2 LYS 47 2HG LYS 47 9.156 -3.083 16.598 411 HG3 LYS 47 3HG LYS 47 10.158 -4.214 17.505 412 HD2 LYS 47 2HD LYS 47 9.463 -3.247 19.595 413 HD3 LYS 47 3HD LYS 47 8.613 -1.942 18.760 414 HE2 LYS 47 2HE LYS 47 7.110 -3.747 19.592 415 HE3 LYS 47 3HE LYS 47 7.006 -3.483 17.852 416 HZ1 LYS 47 3HZ LYS 47 7.068 -5.808 18.226 417 HZ2 LYS 47 1HZ LYS 47 8.409 -5.688 19.252 418 HZ3 LYS 47 2HZ LYS 47 8.578 -5.383 17.600 419 H LYS 48 H LYS 48 11.945 -0.882 15.082 420 HA LYS 48 HA LYS 48 14.147 0.769 16.034 421 HB2 LYS 48 2HB LYS 48 13.668 -0.797 13.486 422 HB3 LYS 48 3HB LYS 48 15.072 0.230 13.705 423 HG2 LYS 48 2HG LYS 48 15.665 -2.060 14.116 424 HG3 LYS 48 3HG LYS 48 15.766 -1.146 15.620 425 HD2 LYS 48 2HD LYS 48 13.804 -2.135 16.477 426 HD3 LYS 48 3HD LYS 48 13.314 -2.736 14.892 427 HE2 LYS 48 2HE LYS 48 14.203 -4.495 16.428 428 HE3 LYS 48 3HE LYS 48 15.058 -4.377 14.892 429 HZ1 LYS 48 3HZ LYS 48 15.973 -3.201 17.460 430 HZ2 LYS 48 1HZ LYS 48 16.802 -3.138 15.987 431 HZ3 LYS 48 2HZ LYS 48 16.570 -4.621 16.763 432 H TYR 49 H TYR 49 14.978 2.006 13.699 433 HA TYR 49 HA TYR 49 13.292 4.260 13.352 434 HB2 TYR 49 2HB TYR 49 14.841 4.870 11.525 435 HB3 TYR 49 3HB TYR 49 15.725 4.358 12.959 436 HD1 TYR 49 HD2 TYR 49 16.727 2.040 13.016 437 HD2 TYR 49 HD1 TYR 49 15.103 3.718 9.451 438 HE1 TYR 49 HE2 TYR 49 17.913 0.349 11.685 439 HE2 TYR 49 HE1 TYR 49 16.282 2.027 8.116 440 HH TYR 49 HH TYR 49 17.734 -0.730 9.513 441 H ASN 50 H ASN 50 11.577 4.575 11.969 442 HA ASN 50 HA ASN 50 10.840 2.356 10.236 443 HB2 ASN 50 2HB ASN 50 8.739 3.803 9.840 444 HB3 ASN 50 3HB ASN 50 8.970 3.075 11.423 445 HD21 ASN 50 1HD2 ASN 50 9.536 4.402 13.168 446 HD22 ASN 50 2HD2 ASN 50 9.293 6.112 13.114 447 H ALA 51 H ALA 51 10.073 5.664 9.256 448 HA ALA 51 HA ALA 51 10.417 6.778 7.296 449 HB1 ALA 51 3HB ALA 51 12.742 7.088 6.672 450 HB2 ALA 51 1HB ALA 51 13.206 5.663 7.602 451 HB3 ALA 51 2HB ALA 51 12.582 7.090 8.429 452 H THR 52 H THR 52 9.686 3.819 7.079 453 HA THR 52 HA THR 52 10.642 3.352 4.321 454 HB THR 52 HB THR 52 10.126 1.230 6.425 455 HG1 THR 52 HG1 THR 52 12.102 2.256 6.804 456 HG21 THR 52 3HG2 THR 52 9.557 0.438 4.179 457 HG22 THR 52 1HG2 THR 52 11.027 -0.345 4.761 458 HG23 THR 52 2HG2 THR 52 11.132 0.962 3.581 459 H ILE 53 H ILE 53 9.113 3.045 2.831 460 HA ILE 53 HA ILE 53 6.327 2.673 3.648 461 HB ILE 53 HB ILE 53 7.483 3.211 0.897 462 HG12 ILE 53 2HG1 ILE 53 6.175 5.069 2.908 463 HG13 ILE 53 3HG1 ILE 53 7.851 5.112 2.376 464 HG21 ILE 53 1HG2 ILE 53 5.350 2.049 0.772 465 HG22 ILE 53 2HG2 ILE 53 5.164 3.725 0.259 466 HG23 ILE 53 3HG2 ILE 53 4.618 3.230 1.861 467 HD11 ILE 53 3HD1 ILE 53 5.433 5.695 0.675 468 HD12 ILE 53 1HD1 ILE 53 7.109 5.717 0.122 469 HD13 ILE 53 2HD1 ILE 53 6.566 6.876 1.333 470 H VAL 54 H VAL 54 5.471 0.678 3.684 471 HA VAL 54 HA VAL 54 6.929 -1.516 2.434 472 HB VAL 54 HB VAL 54 6.307 -1.893 4.716 473 HG11 VAL 54 1HG1 VAL 54 3.434 -1.450 3.895 474 HG12 VAL 54 2HG1 VAL 54 4.412 -0.373 4.892 475 HG13 VAL 54 3HG1 VAL 54 3.985 -1.977 5.487 476 HG21 VAL 54 3HG2 VAL 54 6.255 -3.838 3.222 477 HG22 VAL 54 1HG2 VAL 54 4.538 -3.562 2.921 478 HG23 VAL 54 2HG2 VAL 54 5.092 -4.000 4.538 479 H VAL 55 H VAL 55 6.510 -1.899 0.377 480 HA VAL 55 HA VAL 55 3.819 -1.533 -0.714 481 HB VAL 55 HB VAL 55 6.392 -2.218 -2.158 482 HG11 VAL 55 1HG1 VAL 55 5.161 -1.555 -4.186 483 HG12 VAL 55 2HG1 VAL 55 3.698 -1.353 -3.222 484 HG13 VAL 55 3HG1 VAL 55 4.427 -2.950 -3.393 485 HG21 VAL 55 3HG2 VAL 55 4.994 0.442 -1.824 486 HG22 VAL 55 1HG2 VAL 55 6.371 0.142 -2.883 487 HG23 VAL 55 2HG2 VAL 55 6.552 -0.020 -1.137 488 H VAL 56 H VAL 56 2.518 -3.226 -0.417 489 HA VAL 56 HA VAL 56 3.526 -5.965 -0.530 490 HB VAL 56 HB VAL 56 0.726 -4.963 0.060 491 HG11 VAL 56 1HG1 VAL 56 0.324 -7.210 0.951 492 HG12 VAL 56 2HG1 VAL 56 1.946 -7.703 0.459 493 HG13 VAL 56 3HG1 VAL 56 0.747 -7.267 -0.760 494 HG21 VAL 56 3HG2 VAL 56 1.260 -5.434 2.415 495 HG22 VAL 56 1HG2 VAL 56 2.308 -4.184 1.744 496 HG23 VAL 56 2HG2 VAL 56 2.918 -5.826 1.956 497 H VAL 57 H VAL 57 3.791 -6.709 -2.563 498 HA VAL 57 HA VAL 57 1.979 -5.986 -4.711 499 HB VAL 57 HB VAL 57 4.216 -8.033 -4.748 500 HG11 VAL 57 1HG1 VAL 57 4.168 -7.688 -7.185 501 HG12 VAL 57 2HG1 VAL 57 2.793 -6.599 -6.999 502 HG13 VAL 57 3HG1 VAL 57 2.630 -8.305 -6.581 503 HG21 VAL 57 3HG2 VAL 57 5.081 -5.835 -4.110 504 HG22 VAL 57 1HG2 VAL 57 4.301 -5.107 -5.514 505 HG23 VAL 57 2HG2 VAL 57 5.609 -6.271 -5.735 506 H VAL 58 H VAL 58 0.047 -6.951 -4.858 507 HA VAL 58 HA VAL 58 -0.280 -9.662 -3.766 508 HB VAL 58 HB VAL 58 -2.668 -9.161 -3.567 509 HG11 VAL 58 1HG1 VAL 58 -0.851 -7.079 -2.343 510 HG12 VAL 58 2HG1 VAL 58 -1.248 -8.662 -1.672 511 HG13 VAL 58 3HG1 VAL 58 -2.495 -7.421 -1.806 512 HG21 VAL 58 3HG2 VAL 58 -2.926 -7.640 -5.455 513 HG22 VAL 58 1HG2 VAL 58 -1.940 -6.427 -4.639 514 HG23 VAL 58 2HG2 VAL 58 -3.511 -6.883 -3.975 515 H ASP 59 H ASP 59 -1.207 -11.303 -4.917 516 HA ASP 59 HA ASP 59 -1.453 -10.852 -7.813 517 HB2 ASP 59 2HB ASP 59 -1.163 -13.448 -7.832 518 HB3 ASP 59 3HB ASP 59 0.234 -12.408 -7.593 519 H ASP 60 H ASP 60 -2.990 -12.769 -5.210 520 HA ASP 60 HA ASP 60 -5.465 -12.818 -6.821 521 HB2 ASP 60 2HB ASP 60 -4.549 -14.656 -4.592 522 HB3 ASP 60 3HB ASP 60 -6.140 -14.730 -5.341 523 H LYS 61 H LYS 61 -7.485 -12.413 -5.787 524 HA LYS 61 HA LYS 61 -7.573 -10.123 -4.235 525 HB2 LYS 61 2HB LYS 61 -9.971 -10.570 -3.939 526 HB3 LYS 61 3HB LYS 61 -9.454 -10.859 -5.595 527 HG2 LYS 61 2HG LYS 61 -9.423 -13.265 -5.181 528 HG3 LYS 61 3HG LYS 61 -9.899 -12.992 -3.506 529 HD2 LYS 61 2HD LYS 61 -11.879 -13.601 -4.643 530 HD3 LYS 61 3HD LYS 61 -11.980 -11.857 -4.417 531 HE2 LYS 61 2HE LYS 61 -11.021 -13.169 -6.963 532 HE3 LYS 61 3HE LYS 61 -12.690 -12.692 -6.680 533 HZ1 LYS 61 3HZ LYS 61 -11.952 -10.400 -6.429 534 HZ2 LYS 61 1HZ LYS 61 -11.504 -11.023 -7.937 535 HZ3 LYS 61 2HZ LYS 61 -10.350 -10.866 -6.717 536 H GLU 62 H GLU 62 -7.591 -13.482 -3.109 537 HA GLU 62 HA GLU 62 -8.416 -12.963 -0.465 538 HB2 GLU 62 2HB GLU 62 -6.646 -15.202 -1.465 539 HB3 GLU 62 3HB GLU 62 -7.441 -15.150 0.103 540 HG2 GLU 62 2HG GLU 62 -9.617 -14.905 -1.302 541 HG3 GLU 62 3HG GLU 62 -8.628 -15.555 -2.611 542 H TRP 63 H TRP 63 -5.140 -13.176 -1.858 543 HA TRP 63 HA TRP 63 -3.729 -12.703 0.535 544 HB2 TRP 63 2HB TRP 63 -2.520 -13.599 -1.308 545 HB3 TRP 63 3HB TRP 63 -3.006 -12.285 -2.368 546 HD1 TRP 63 HD1 TRP 63 -0.722 -11.302 -3.006 547 HE1 TRP 63 HE1 TRP 63 1.216 -10.209 -1.722 548 HE3 TRP 63 HE3 TRP 63 -2.182 -12.400 1.780 549 HZ2 TRP 63 HZ2 TRP 63 2.022 -9.854 0.953 550 HZ3 TRP 63 HZ3 TRP 63 -0.766 -11.641 3.641 551 HH2 TRP 63 HH2 TRP 63 1.292 -10.395 3.233 552 H ALA 64 H ALA 64 -4.933 -10.443 -1.946 553 HA ALA 64 HA ALA 64 -3.925 -8.063 -0.920 554 HB1 ALA 64 3HB ALA 64 -6.624 -8.476 -2.212 555 HB2 ALA 64 1HB ALA 64 -5.101 -8.239 -3.070 556 HB3 ALA 64 2HB ALA 64 -5.759 -6.944 -2.070 557 H GLU 65 H GLU 65 -6.982 -9.686 -0.111 558 HA GLU 65 HA GLU 65 -7.764 -7.818 1.890 559 HB2 GLU 65 2HB GLU 65 -9.348 -9.258 0.662 560 HB3 GLU 65 3HB GLU 65 -8.667 -10.674 1.442 561 HG2 GLU 65 2HG GLU 65 -9.781 -8.488 3.143 562 HG3 GLU 65 3HG GLU 65 -10.893 -9.565 2.303 563 H LYS 66 H LYS 66 -5.970 -10.855 1.970 564 HA LYS 66 HA LYS 66 -5.937 -11.263 4.756 565 HB2 LYS 66 2HB LYS 66 -5.283 -13.014 3.185 566 HB3 LYS 66 3HB LYS 66 -3.906 -12.061 2.654 567 HG2 LYS 66 2HG LYS 66 -3.192 -13.825 4.155 568 HG3 LYS 66 3HG LYS 66 -2.909 -12.244 4.886 569 HD2 LYS 66 2HD LYS 66 -4.963 -12.503 6.219 570 HD3 LYS 66 3HD LYS 66 -5.233 -14.087 5.489 571 HE2 LYS 66 2HE LYS 66 -2.851 -13.301 7.175 572 HE3 LYS 66 3HE LYS 66 -4.217 -14.277 7.715 573 HZ1 LYS 66 3HZ LYS 66 -2.322 -15.647 7.111 574 HZ2 LYS 66 1HZ LYS 66 -2.328 -15.013 5.544 575 HZ3 LYS 66 2HZ LYS 66 -3.626 -15.950 6.081 576 H ALA 67 H ALA 67 -3.688 -9.492 2.635 577 HA ALA 67 HA ALA 67 -1.796 -8.721 4.539 578 HB1 ALA 67 3HB ALA 67 -2.765 -7.137 2.153 579 HB2 ALA 67 1HB ALA 67 -1.516 -8.381 2.124 580 HB3 ALA 67 2HB ALA 67 -1.249 -6.886 3.020 581 H ILE 68 H ILE 68 -4.718 -6.954 3.486 582 HA ILE 68 HA ILE 68 -4.528 -4.860 5.371 583 HB ILE 68 HB ILE 68 -7.029 -5.956 4.059 584 HG12 ILE 68 2HG1 ILE 68 -5.338 -5.338 2.395 585 HG13 ILE 68 3HG1 ILE 68 -6.674 -4.193 2.367 586 HG21 ILE 68 1HG2 ILE 68 -6.492 -3.265 5.323 587 HG22 ILE 68 2HG2 ILE 68 -7.559 -4.522 5.948 588 HG23 ILE 68 3HG2 ILE 68 -7.955 -3.702 4.438 589 HD11 ILE 68 3HD1 ILE 68 -3.982 -3.761 3.644 590 HD12 ILE 68 1HD1 ILE 68 -5.324 -2.615 3.671 591 HD13 ILE 68 2HD1 ILE 68 -4.565 -3.048 2.141 592 H ARG 69 H ARG 69 -5.874 -8.093 5.583 593 HA ARG 69 HA ARG 69 -7.328 -7.796 7.993 594 HB2 ARG 69 2HB ARG 69 -7.575 -9.732 6.456 595 HB3 ARG 69 3HB ARG 69 -5.968 -10.283 6.915 596 HG2 ARG 69 2HG ARG 69 -6.768 -10.504 9.258 597 HG3 ARG 69 3HG ARG 69 -8.387 -10.076 8.706 598 HD2 ARG 69 2HD ARG 69 -6.774 -12.468 7.806 599 HD3 ARG 69 3HD ARG 69 -8.135 -12.495 8.926 600 HE ARG 69 HE ARG 69 -8.758 -11.369 6.346 601 HH11 ARG 69 1HH1 ARG 69 -8.562 -14.259 8.209 602 HH12 ARG 69 2HH1 ARG 69 -9.696 -15.105 7.218 603 HH21 ARG 69 1HH2 ARG 69 -10.180 -12.471 5.065 604 HH22 ARG 69 2HH2 ARG 69 -10.605 -14.102 5.449 605 H PHE 70 H PHE 70 -3.978 -8.866 7.375 606 HA PHE 70 HA PHE 70 -3.218 -9.199 10.068 607 HB2 PHE 70 2HB PHE 70 -1.828 -10.064 8.254 608 HB3 PHE 70 3HB PHE 70 -1.521 -8.429 7.676 609 HD1 PHE 70 HD1 PHE 70 -0.969 -10.711 10.551 610 HD2 PHE 70 HD2 PHE 70 0.265 -7.160 8.546 611 HE1 PHE 70 HE1 PHE 70 0.994 -10.563 12.025 612 HE2 PHE 70 HE2 PHE 70 2.231 -7.010 10.015 613 HZ PHE 70 HZ PHE 70 2.597 -8.710 11.759 614 H VAL 71 H VAL 71 -2.933 -6.373 7.912 615 HA VAL 71 HA VAL 71 -1.806 -4.569 9.718 616 HB VAL 71 HB VAL 71 -3.816 -3.976 7.525 617 HG11 VAL 71 1HG1 VAL 71 -2.897 -1.694 7.554 618 HG12 VAL 71 2HG1 VAL 71 -1.902 -2.119 8.948 619 HG13 VAL 71 3HG1 VAL 71 -3.660 -2.111 9.092 620 HG21 VAL 71 3HG2 VAL 71 -1.841 -3.439 6.162 621 HG22 VAL 71 1HG2 VAL 71 -1.829 -5.124 6.688 622 HG23 VAL 71 2HG2 VAL 71 -0.793 -3.942 7.487 623 H LYS 72 H LYS 72 -5.207 -5.467 9.255 624 HA LYS 72 HA LYS 72 -6.330 -3.648 11.107 625 HB2 LYS 72 2HB LYS 72 -7.668 -4.829 9.426 626 HB3 LYS 72 3HB LYS 72 -7.325 -6.365 10.206 627 HG2 LYS 72 2HG LYS 72 -8.527 -5.568 12.224 628 HG3 LYS 72 3HG LYS 72 -8.940 -4.087 11.356 629 HD2 LYS 72 2HD LYS 72 -10.169 -5.384 9.693 630 HD3 LYS 72 3HD LYS 72 -9.707 -6.887 10.495 631 HE2 LYS 72 2HE LYS 72 -10.930 -6.157 12.514 632 HE3 LYS 72 3HE LYS 72 -11.423 -4.690 11.669 633 HZ1 LYS 72 3HZ LYS 72 -12.106 -7.456 10.832 634 HZ2 LYS 72 1HZ LYS 72 -12.615 -6.035 10.075 635 HZ3 LYS 72 2HZ LYS 72 -13.144 -6.397 11.637 636 H SER 73 H SER 73 -4.595 -6.606 11.558 637 HA SER 73 HA SER 73 -5.652 -7.247 14.160 638 HB2 SER 73 2HB SER 73 -3.138 -8.277 12.811 639 HB3 SER 73 3HB SER 73 -3.926 -8.986 14.219 640 HG SER 73 HG SER 73 -5.335 -8.642 11.791 641 H LEU 74 H LEU 74 -3.269 -5.061 13.047 642 HA LEU 74 HA LEU 74 -1.369 -5.193 15.131 643 HB2 LEU 74 2HB LEU 74 -2.093 -2.832 13.388 644 HB3 LEU 74 3HB LEU 74 -0.626 -2.990 14.337 645 HG LEU 74 HG LEU 74 -1.392 -4.761 12.004 646 HD11 LEU 74 1HD1 LEU 74 -0.841 -2.494 11.295 647 HD12 LEU 74 2HD1 LEU 74 0.414 -3.634 10.813 648 HD13 LEU 74 3HD1 LEU 74 0.675 -2.570 12.196 649 HD21 LEU 74 3HD2 LEU 74 1.150 -4.652 13.635 650 HD22 LEU 74 1HD2 LEU 74 0.883 -5.644 12.202 651 HD23 LEU 74 2HD2 LEU 74 -0.048 -5.946 13.668 652 H GLY 75 H GLY 75 -4.195 -3.041 14.725 653 HA2 GLY 75 2HA GLY 75 -5.510 -2.367 16.642 654 HA3 GLY 75 3HA GLY 75 -4.056 -2.448 17.622 655 H ALA 76 H ALA 76 -3.420 -1.024 14.645 656 HA ALA 76 HA ALA 76 -3.950 1.702 15.626 657 HB1 ALA 76 3HB ALA 76 -1.728 2.439 14.979 658 HB2 ALA 76 1HB ALA 76 -1.314 0.809 14.449 659 HB3 ALA 76 2HB ALA 76 -1.612 1.132 16.159 660 H GLN 77 H GLN 77 -4.827 3.004 14.123 661 HA GLN 77 HA GLN 77 -5.302 2.031 11.467 662 HB2 GLN 77 2HB GLN 77 -6.445 4.236 11.134 663 HB3 GLN 77 3HB GLN 77 -7.042 3.302 12.497 664 HG2 GLN 77 2HG GLN 77 -5.635 4.706 13.998 665 HG3 GLN 77 3HG GLN 77 -5.217 5.697 12.602 666 HE21 GLN 77 1HE2 GLN 77 -6.163 7.536 13.466 667 HE22 GLN 77 2HE2 GLN 77 -7.872 7.722 13.597 668 H VAL 78 H VAL 78 -3.856 2.086 9.898 669 HA VAL 78 HA VAL 78 -1.870 4.273 9.802 670 HB VAL 78 HB VAL 78 -0.426 2.740 8.512 671 HG11 VAL 78 1HG1 VAL 78 0.201 1.266 10.379 672 HG12 VAL 78 2HG1 VAL 78 -1.324 1.644 11.185 673 HG13 VAL 78 3HG1 VAL 78 -0.125 2.912 10.921 674 HG21 VAL 78 3HG2 VAL 78 -2.158 1.318 7.525 675 HG22 VAL 78 1HG2 VAL 78 -2.536 0.655 9.117 676 HG23 VAL 78 2HG2 VAL 78 -0.961 0.348 8.384 677 H LEU 79 H LEU 79 -1.054 4.760 7.547 678 HA LEU 79 HA LEU 79 -3.329 5.337 5.842 679 HB2 LEU 79 2HB LEU 79 -1.183 6.793 6.410 680 HB3 LEU 79 3HB LEU 79 -0.475 5.906 5.078 681 HG LEU 79 HG LEU 79 -1.242 8.026 4.262 682 HD11 LEU 79 1HD1 LEU 79 -1.556 6.166 2.725 683 HD12 LEU 79 2HD1 LEU 79 -2.813 7.382 2.510 684 HD13 LEU 79 3HD1 LEU 79 -3.173 5.887 3.373 685 HD21 LEU 79 3HD2 LEU 79 -2.838 8.555 6.015 686 HD22 LEU 79 1HD2 LEU 79 -3.949 7.329 5.401 687 HD23 LEU 79 2HD2 LEU 79 -3.574 8.752 4.425 688 H ILE 80 H ILE 80 -3.928 4.133 4.088 689 HA ILE 80 HA ILE 80 -1.988 2.167 3.020 690 HB ILE 80 HB ILE 80 -4.959 1.735 3.409 691 HG12 ILE 80 2HG1 ILE 80 -2.594 0.434 4.796 692 HG13 ILE 80 3HG1 ILE 80 -3.657 1.639 5.515 693 HG21 ILE 80 1HG2 ILE 80 -4.154 0.627 1.392 694 HG22 ILE 80 2HG2 ILE 80 -4.535 -0.560 2.638 695 HG23 ILE 80 3HG2 ILE 80 -2.854 -0.138 2.308 696 HD11 ILE 80 3HD1 ILE 80 -5.538 0.086 5.319 697 HD12 ILE 80 1HD1 ILE 80 -4.220 -0.585 6.279 698 HD13 ILE 80 2HD1 ILE 80 -4.460 -1.121 4.617 699 H ILE 81 H ILE 81 -1.516 2.610 0.947 700 HA ILE 81 HA ILE 81 -3.588 3.802 -0.782 701 HB ILE 81 HB ILE 81 -0.599 3.582 -1.226 702 HG12 ILE 81 2HG1 ILE 81 -2.361 5.981 -0.625 703 HG13 ILE 81 3HG1 ILE 81 -1.194 5.249 0.472 704 HG21 ILE 81 1HG2 ILE 81 -0.977 4.989 -3.215 705 HG22 ILE 81 2HG2 ILE 81 -2.717 4.877 -2.956 706 HG23 ILE 81 3HG2 ILE 81 -1.789 3.429 -3.345 707 HD11 ILE 81 3HD1 ILE 81 -0.548 6.610 -2.135 708 HD12 ILE 81 1HD1 ILE 81 0.620 5.885 -1.028 709 HD13 ILE 81 2HD1 ILE 81 -0.324 7.285 -0.521 710 H ILE 82 H ILE 82 -4.428 2.680 -2.485 711 HA ILE 82 HA ILE 82 -3.265 0.023 -3.083 712 HB ILE 82 HB ILE 82 -6.215 0.719 -3.115 713 HG12 ILE 82 2HG1 ILE 82 -4.633 -0.941 -1.125 714 HG13 ILE 82 3HG1 ILE 82 -5.326 0.647 -0.815 715 HG21 ILE 82 1HG2 ILE 82 -5.607 -0.995 -4.745 716 HG22 ILE 82 2HG2 ILE 82 -6.558 -1.685 -3.430 717 HG23 ILE 82 3HG2 ILE 82 -4.811 -1.933 -3.480 718 HD11 ILE 82 3HD1 ILE 82 -6.859 -1.875 -1.412 719 HD12 ILE 82 1HD1 ILE 82 -7.570 -0.284 -1.133 720 HD13 ILE 82 2HD1 ILE 82 -6.685 -1.094 0.159 721 H TYR 83 H TYR 83 -2.935 -0.470 -5.202 722 HA TYR 83 HA TYR 83 -3.897 1.462 -7.221 723 HB2 TYR 83 2HB TYR 83 -1.538 1.813 -6.935 724 HB3 TYR 83 3HB TYR 83 -1.210 0.086 -7.036 725 HD1 TYR 83 HD2 TYR 83 -2.515 2.958 -9.033 726 HD2 TYR 83 HD1 TYR 83 -0.692 -0.895 -9.122 727 HE1 TYR 83 HE2 TYR 83 -2.201 3.162 -11.462 728 HE2 TYR 83 HE1 TYR 83 -0.378 -0.694 -11.554 729 HH TYR 83 HH TYR 83 -1.315 0.529 -13.443 730 H ASP 84 H ASP 84 -5.260 0.596 -8.606 731 HA ASP 84 HA ASP 84 -4.509 -1.864 -9.985 732 HB2 ASP 84 2HB ASP 84 -6.160 -2.569 -8.253 733 HB3 ASP 84 3HB ASP 84 -7.324 -1.436 -8.930 734 H GLN 85 H GLN 85 -5.392 -1.993 -12.133 735 HA GLN 85 HA GLN 85 -5.551 0.582 -13.363 736 HB2 GLN 85 2HB GLN 85 -4.376 -1.281 -14.421 737 HB3 GLN 85 3HB GLN 85 -5.875 -2.188 -14.543 738 HG2 GLN 85 2HG GLN 85 -5.756 0.492 -15.837 739 HG3 GLN 85 3HG GLN 85 -4.870 -0.834 -16.586 740 HE21 GLN 85 1HE2 GLN 85 -7.256 0.663 -17.485 741 HE22 GLN 85 2HE2 GLN 85 -8.471 -0.529 -17.769 742 H ASP 86 H ASP 86 -7.948 -1.845 -12.501 743 HA ASP 86 HA ASP 86 -10.054 -0.223 -13.773 744 HB2 ASP 86 2HB ASP 86 -9.810 -3.123 -13.145 745 HB3 ASP 86 3HB ASP 86 -11.413 -2.413 -13.001 746 H GLN 87 H GLN 87 -11.107 1.151 -12.490 747 HA GLN 87 HA GLN 87 -11.082 1.123 -9.674 748 HB2 GLN 87 2HB GLN 87 -13.008 2.420 -11.610 749 HB3 GLN 87 3HB GLN 87 -13.056 2.688 -9.872 750 HG2 GLN 87 2HG GLN 87 -10.732 3.545 -9.988 751 HG3 GLN 87 3HG GLN 87 -10.792 3.373 -11.741 752 HE21 GLN 87 1HE2 GLN 87 -10.459 5.601 -12.007 753 HE22 GLN 87 2HE2 GLN 87 -11.708 6.750 -11.696 754 H ASN 88 H ASN 88 -12.989 -0.618 -11.968 755 HA ASN 88 HA ASN 88 -15.204 -1.344 -10.413 756 HB2 ASN 88 2HB ASN 88 -14.964 -1.745 -12.861 757 HB3 ASN 88 3HB ASN 88 -13.800 -3.020 -12.512 758 HD21 ASN 88 1HD2 ASN 88 -15.145 -4.502 -13.570 759 HD22 ASN 88 2HD2 ASN 88 -16.565 -5.126 -12.817 760 H ARG 89 H ARG 89 -11.956 -2.802 -10.596 761 HA ARG 89 HA ARG 89 -12.582 -4.779 -8.542 762 HB2 ARG 89 2HB ARG 89 -9.786 -4.054 -9.401 763 HB3 ARG 89 3HB ARG 89 -10.395 -5.598 -8.827 764 HG2 ARG 89 2HG ARG 89 -11.561 -5.932 -10.952 765 HG3 ARG 89 3HG ARG 89 -10.969 -4.367 -11.521 766 HD2 ARG 89 2HD ARG 89 -8.622 -5.286 -10.994 767 HD3 ARG 89 3HD ARG 89 -9.402 -6.863 -10.923 768 HE ARG 89 HE ARG 89 -10.080 -6.458 -13.273 769 HH11 ARG 89 1HH1 ARG 89 -7.465 -4.639 -11.946 770 HH12 ARG 89 2HH1 ARG 89 -6.670 -4.476 -13.477 771 HH21 ARG 89 1HH2 ARG 89 -9.033 -6.227 -15.232 772 HH22 ARG 89 2HH2 ARG 89 -7.552 -5.341 -15.305 773 H LEU 90 H LEU 90 -10.509 -1.955 -8.918 774 HA LEU 90 HA LEU 90 -9.271 -1.754 -6.500 775 HB2 LEU 90 2HB LEU 90 -8.919 -0.354 -8.534 776 HB3 LEU 90 3HB LEU 90 -10.365 0.547 -8.123 777 HG LEU 90 HG LEU 90 -9.286 1.340 -6.057 778 HD11 LEU 90 1HD1 LEU 90 -7.802 -0.553 -5.645 779 HD12 LEU 90 2HD1 LEU 90 -6.901 0.960 -5.687 780 HD13 LEU 90 3HD1 LEU 90 -6.853 -0.132 -7.071 781 HD21 LEU 90 3HD2 LEU 90 -7.658 1.817 -8.556 782 HD22 LEU 90 1HD2 LEU 90 -7.666 2.840 -7.118 783 HD23 LEU 90 2HD2 LEU 90 -9.126 2.678 -8.094 784 H GLU 91 H GLU 91 -12.348 -0.075 -7.281 785 HA GLU 91 HA GLU 91 -12.755 0.803 -4.603 786 HB2 GLU 91 2HB GLU 91 -14.605 0.670 -6.985 787 HB3 GLU 91 3HB GLU 91 -15.086 1.347 -5.435 788 HG2 GLU 91 2HG GLU 91 -12.790 2.341 -7.124 789 HG3 GLU 91 3HG GLU 91 -14.395 3.067 -7.060 790 H GLU 92 H GLU 92 -13.882 -2.028 -6.401 791 HA GLU 92 HA GLU 92 -15.798 -3.055 -4.674 792 HB2 GLU 92 2HB GLU 92 -15.360 -4.141 -6.776 793 HB3 GLU 92 3HB GLU 92 -13.693 -4.472 -6.328 794 HG2 GLU 92 2HG GLU 92 -14.478 -6.025 -4.593 795 HG3 GLU 92 3HG GLU 92 -16.144 -5.704 -5.073 796 H PHE 93 H PHE 93 -12.276 -3.483 -4.539 797 HA PHE 93 HA PHE 93 -12.342 -4.881 -2.022 798 HB2 PHE 93 2HB PHE 93 -10.584 -5.316 -3.669 799 HB3 PHE 93 3HB PHE 93 -10.045 -3.644 -3.563 800 HD1 PHE 93 HD1 PHE 93 -10.810 -6.366 -1.107 801 HD2 PHE 93 HD2 PHE 93 -8.045 -3.415 -2.453 802 HE1 PHE 93 HE1 PHE 93 -9.257 -7.000 0.689 803 HE2 PHE 93 HE2 PHE 93 -6.493 -4.049 -0.656 804 HZ PHE 93 HZ PHE 93 -7.099 -5.843 0.917 805 H SER 94 H SER 94 -11.726 -1.573 -3.069 806 HA SER 94 HA SER 94 -10.646 -0.445 -0.778 807 HB2 SER 94 2HB SER 94 -10.811 0.764 -2.896 808 HB3 SER 94 3HB SER 94 -12.566 0.822 -2.748 809 HG SER 94 HG SER 94 -11.325 2.742 -2.069 810 H ARG 95 H ARG 95 -14.064 -1.027 -1.521 811 HA ARG 95 HA ARG 95 -15.221 0.437 0.555 812 HB2 ARG 95 2HB ARG 95 -16.198 -2.132 -0.709 813 HB3 ARG 95 3HB ARG 95 -17.173 -1.090 0.317 814 HG2 ARG 95 2HG ARG 95 -16.049 -0.448 -2.402 815 HG3 ARG 95 3HG ARG 95 -17.743 -0.648 -1.957 816 HD2 ARG 95 2HD ARG 95 -15.872 1.581 -1.155 817 HD3 ARG 95 3HD ARG 95 -17.303 1.697 -2.178 818 HE ARG 95 HE ARG 95 -17.311 1.258 0.737 819 HH11 ARG 95 1HH1 ARG 95 -18.965 2.154 -2.151 820 HH12 ARG 95 2HH1 ARG 95 -20.304 2.832 -1.298 821 HH21 ARG 95 1HH2 ARG 95 -19.022 2.116 1.814 822 HH22 ARG 95 2HH2 ARG 95 -20.351 2.788 0.930 823 H GLU 96 H GLU 96 -14.145 -2.966 0.575 824 HA GLU 96 HA GLU 96 -15.006 -3.472 3.235 825 HB2 GLU 96 2HB GLU 96 -12.954 -4.912 1.541 826 HB3 GLU 96 3HB GLU 96 -13.563 -5.499 3.084 827 HG2 GLU 96 2HG GLU 96 -15.880 -5.392 2.047 828 HG3 GLU 96 3HG GLU 96 -15.065 -5.160 0.501 829 H VAL 97 H VAL 97 -11.851 -2.529 1.878 830 HA VAL 97 HA VAL 97 -10.366 -2.579 4.266 831 HB VAL 97 HB VAL 97 -10.014 -0.657 1.946 832 HG11 VAL 97 1HG1 VAL 97 -7.672 -0.538 2.686 833 HG12 VAL 97 2HG1 VAL 97 -8.056 -1.569 4.063 834 HG13 VAL 97 3HG1 VAL 97 -8.775 0.036 3.936 835 HG21 VAL 97 3HG2 VAL 97 -10.023 -2.991 1.200 836 HG22 VAL 97 1HG2 VAL 97 -8.784 -3.382 2.394 837 HG23 VAL 97 2HG2 VAL 97 -8.413 -2.283 1.064 838 H ARG 98 H ARG 98 -12.302 0.011 2.809 839 HA ARG 98 HA ARG 98 -11.840 2.068 4.626 840 HB2 ARG 98 2HB ARG 98 -13.095 2.313 2.503 841 HB3 ARG 98 3HB ARG 98 -14.433 1.412 3.201 842 HG2 ARG 98 2HG ARG 98 -14.991 3.721 3.303 843 HG3 ARG 98 3HG ARG 98 -14.627 3.196 4.949 844 HD2 ARG 98 2HD ARG 98 -13.614 5.367 4.482 845 HD3 ARG 98 3HD ARG 98 -12.370 4.144 4.748 846 HE ARG 98 HE ARG 98 -12.926 4.329 1.997 847 HH11 ARG 98 1HH1 ARG 98 -11.404 6.111 4.516 848 HH12 ARG 98 2HH1 ARG 98 -10.346 6.941 3.435 849 HH21 ARG 98 1HH2 ARG 98 -11.547 5.360 0.632 850 HH22 ARG 98 2HH2 ARG 98 -10.407 6.506 1.252 851 H ARG 99 H ARG 99 -14.246 -0.539 4.760 852 HA ARG 99 HA ARG 99 -15.587 0.371 7.083 853 HB2 ARG 99 2HB ARG 99 -15.456 -2.347 5.776 854 HB3 ARG 99 3HB ARG 99 -16.491 -1.991 7.152 855 HG2 ARG 99 2HG ARG 99 -16.621 -0.665 4.444 856 HG3 ARG 99 3HG ARG 99 -17.736 -1.885 5.065 857 HD2 ARG 99 2HD ARG 99 -18.313 -0.315 6.922 858 HD3 ARG 99 3HD ARG 99 -17.311 0.907 6.138 859 HE ARG 99 HE ARG 99 -19.392 -0.230 4.481 860 HH11 ARG 99 1HH1 ARG 99 -18.537 2.289 6.671 861 HH12 ARG 99 2HH1 ARG 99 -19.777 3.349 6.097 862 HH21 ARG 99 1HH2 ARG 99 -20.987 1.132 3.774 863 HH22 ARG 99 2HH2 ARG 99 -21.135 2.710 4.472 864 H ARG 100 H ARG 100 -12.484 -0.896 6.865 865 HA ARG 100 HA ARG 100 -12.591 -2.211 9.483 866 HB2 ARG 100 2HB ARG 100 -10.277 -1.930 7.550 867 HB3 ARG 100 3HB ARG 100 -10.287 -2.906 9.017 868 HG2 ARG 100 2HG ARG 100 -12.152 -4.233 8.079 869 HG3 ARG 100 3HG ARG 100 -12.023 -3.297 6.590 870 HD2 ARG 100 2HD ARG 100 -9.804 -4.146 6.185 871 HD3 ARG 100 3HD ARG 100 -9.779 -4.945 7.761 872 HE ARG 100 HE ARG 100 -11.973 -5.832 6.190 873 HH11 ARG 100 1HH1 ARG 100 -8.557 -6.235 6.524 874 HH12 ARG 100 2HH1 ARG 100 -8.589 -7.845 5.895 875 HH21 ARG 100 1HH2 ARG 100 -11.976 -7.891 5.402 876 HH22 ARG 100 2HH2 ARG 100 -10.490 -8.771 5.295 877 H GLY 101 H GLY 101 -12.419 0.880 8.567 878 HA2 GLY 101 2HA GLY 101 -12.033 2.732 9.903 879 HA3 GLY 101 3HA GLY 101 -11.303 1.684 11.105 880 H PHE 102 H PHE 102 -10.168 1.667 7.794 881 HA PHE 102 HA PHE 102 -7.709 3.049 8.686 882 HB2 PHE 102 2HB PHE 102 -8.092 0.894 6.604 883 HB3 PHE 102 3HB PHE 102 -6.601 1.813 6.771 884 HD1 PHE 102 HD1 PHE 102 -5.164 1.529 8.712 885 HD2 PHE 102 HD2 PHE 102 -8.718 -0.774 8.247 886 HE1 PHE 102 HE1 PHE 102 -4.390 -0.020 10.457 887 HE2 PHE 102 HE2 PHE 102 -7.943 -2.324 9.992 888 HZ PHE 102 HZ PHE 102 -5.776 -1.946 11.098 889 H GLU 103 H GLU 103 -6.915 4.763 7.588 890 HA GLU 103 HA GLU 103 -8.480 6.077 5.590 891 HB2 GLU 103 2HB GLU 103 -5.697 6.555 6.676 892 HB3 GLU 103 3HB GLU 103 -6.397 7.555 5.412 893 HG2 GLU 103 2HG GLU 103 -7.716 7.159 8.089 894 HG3 GLU 103 3HG GLU 103 -6.545 8.438 7.777 895 H VAL 104 H VAL 104 -8.704 4.764 3.799 896 HA VAL 104 HA VAL 104 -6.252 3.870 2.450 897 HB VAL 104 HB VAL 104 -7.813 2.071 2.877 898 HG11 VAL 104 1HG1 VAL 104 -9.832 3.616 1.246 899 HG12 VAL 104 2HG1 VAL 104 -9.887 3.368 2.991 900 HG13 VAL 104 3HG1 VAL 104 -10.047 1.992 1.900 901 HG21 VAL 104 3HG2 VAL 104 -6.492 1.945 0.828 902 HG22 VAL 104 1HG2 VAL 104 -7.762 2.790 -0.061 903 HG23 VAL 104 2HG2 VAL 104 -8.068 1.185 0.603 904 H ARG 105 H ARG 105 -5.599 4.723 0.600 905 HA ARG 105 HA ARG 105 -7.456 6.428 -0.929 906 HB2 ARG 105 2HB ARG 105 -4.618 6.832 -0.127 907 HB3 ARG 105 3HB ARG 105 -5.074 7.384 -1.734 908 HG2 ARG 105 2HG ARG 105 -6.531 8.185 0.784 909 HG3 ARG 105 3HG ARG 105 -5.226 9.125 0.052 910 HD2 ARG 105 2HD ARG 105 -7.845 8.389 -1.280 911 HD3 ARG 105 3HD ARG 105 -7.424 9.976 -0.630 912 HE ARG 105 HE ARG 105 -5.666 10.078 -2.333 913 HH11 ARG 105 1HH1 ARG 105 -8.264 7.853 -2.853 914 HH12 ARG 105 2HH1 ARG 105 -7.956 7.744 -4.550 915 HH21 ARG 105 1HH2 ARG 105 -5.323 9.935 -4.495 916 HH22 ARG 105 2HH2 ARG 105 -6.337 8.934 -5.478 917 H THR 106 H THR 106 -7.968 5.701 -2.841 918 HA THR 106 HA THR 106 -6.373 3.572 -4.077 919 HB THR 106 HB THR 106 -8.420 3.203 -5.476 920 HG1 THR 106 HG1 THR 106 -10.337 4.266 -4.831 921 HG21 THR 106 3HG2 THR 106 -8.855 3.119 -2.483 922 HG22 THR 106 1HG2 THR 106 -8.032 1.887 -3.441 923 HG23 THR 106 2HG2 THR 106 -9.752 2.190 -3.685 924 H VAL 107 H VAL 107 -5.350 3.805 -5.971 925 HA VAL 107 HA VAL 107 -5.900 6.174 -7.648 926 HB VAL 107 HB VAL 107 -3.477 6.413 -8.098 927 HG11 VAL 107 1HG1 VAL 107 -4.500 7.828 -6.395 928 HG12 VAL 107 2HG1 VAL 107 -2.845 7.423 -5.947 929 HG13 VAL 107 3HG1 VAL 107 -4.194 6.601 -5.164 930 HG21 VAL 107 3HG2 VAL 107 -3.138 4.354 -5.906 931 HG22 VAL 107 1HG2 VAL 107 -1.837 5.268 -6.671 932 HG23 VAL 107 2HG2 VAL 107 -2.780 4.116 -7.617 933 H THR 108 H THR 108 -5.447 5.924 -9.904 934 HA THR 108 HA THR 108 -5.271 3.097 -10.779 935 HB THR 108 HB THR 108 -6.667 3.674 -12.703 936 HG1 THR 108 HG1 THR 108 -6.455 5.761 -13.185 937 HG21 THR 108 3HG2 THR 108 -8.788 4.129 -11.524 938 HG22 THR 108 1HG2 THR 108 -7.879 4.570 -10.078 939 HG23 THR 108 2HG2 THR 108 -7.818 2.917 -10.688 940 H SER 109 H SER 109 -3.364 5.731 -10.694 941 HA SER 109 HA SER 109 -1.824 4.866 -13.003 942 HB2 SER 109 2HB SER 109 -1.756 6.965 -14.147 943 HB3 SER 109 3HB SER 109 -3.461 6.637 -13.845 944 HG SER 109 HG SER 109 -3.537 8.419 -12.755 945 HA PRO 110 HA PRO 110 1.654 6.111 -10.469 946 HB2 PRO 110 2HB PRO 110 3.359 7.146 -12.375 947 HB3 PRO 110 3HB PRO 110 3.147 5.420 -12.066 948 HG2 PRO 110 2HG PRO 110 1.892 7.130 -14.186 949 HG3 PRO 110 3HG PRO 110 2.580 5.500 -14.325 950 HD2 PRO 110 2HD PRO 110 -0.068 5.884 -14.179 951 HD3 PRO 110 3HD PRO 110 0.703 4.494 -13.386 952 H ASP 111 H ASP 111 0.356 8.433 -12.795 953 HA ASP 111 HA ASP 111 1.450 10.783 -11.664 954 HB2 ASP 111 2HB ASP 111 -1.092 10.401 -13.269 955 HB3 ASP 111 3HB ASP 111 -0.332 11.956 -12.933 956 H ASP 112 H ASP 112 -1.864 9.436 -11.346 957 HA ASP 112 HA ASP 112 -2.703 11.180 -9.311 958 HB2 ASP 112 2HB ASP 112 -3.609 8.395 -10.061 959 HB3 ASP 112 3HB ASP 112 -4.382 9.325 -8.781 960 H PHE 113 H PHE 113 -1.020 8.068 -9.131 961 HA PHE 113 HA PHE 113 -1.050 7.703 -6.353 962 HB2 PHE 113 2HB PHE 113 -0.294 5.928 -7.799 963 HB3 PHE 113 3HB PHE 113 1.025 6.921 -8.412 964 HD1 PHE 113 HD1 PHE 113 -0.231 5.163 -5.399 965 HD2 PHE 113 HD2 PHE 113 3.110 7.005 -7.299 966 HE1 PHE 113 HE1 PHE 113 1.256 4.270 -3.653 967 HE2 PHE 113 HE2 PHE 113 4.596 6.112 -5.557 968 HZ PHE 113 HZ PHE 113 3.671 4.746 -3.731 969 H LYS 114 H LYS 114 1.513 9.225 -8.336 970 HA LYS 114 HA LYS 114 3.234 10.014 -6.316 971 HB2 LYS 114 2HB LYS 114 3.860 10.190 -8.641 972 HB3 LYS 114 3HB LYS 114 2.591 11.369 -8.942 973 HG2 LYS 114 2HG LYS 114 3.758 12.930 -7.381 974 HG3 LYS 114 3HG LYS 114 5.079 11.763 -7.284 975 HD2 LYS 114 2HD LYS 114 5.463 11.959 -9.680 976 HD3 LYS 114 3HD LYS 114 4.086 13.054 -9.831 977 HE2 LYS 114 2HE LYS 114 6.610 13.577 -8.257 978 HE3 LYS 114 3HE LYS 114 6.199 14.282 -9.818 979 HZ1 LYS 114 3HZ LYS 114 4.748 14.707 -7.259 980 HZ2 LYS 114 1HZ LYS 114 4.258 15.325 -8.760 981 HZ3 LYS 114 2HZ LYS 114 5.714 15.830 -8.066 982 H LYS 115 H LYS 115 0.678 12.005 -7.803 983 HA LYS 115 HA LYS 115 1.097 14.281 -6.204 984 HB2 LYS 115 2HB LYS 115 -1.462 13.452 -7.588 985 HB3 LYS 115 3HB LYS 115 -1.012 15.085 -7.105 986 HG2 LYS 115 2HG LYS 115 0.853 15.052 -8.683 987 HG3 LYS 115 3HG LYS 115 0.438 13.402 -9.147 988 HD2 LYS 115 2HD LYS 115 -1.799 14.264 -9.889 989 HD3 LYS 115 3HD LYS 115 -1.199 15.899 -9.595 990 HE2 LYS 115 2HE LYS 115 0.656 15.453 -11.189 991 HE3 LYS 115 3HE LYS 115 -0.061 13.881 -11.536 992 HZ1 LYS 115 3HZ LYS 115 -0.741 15.383 -13.218 993 HZ2 LYS 115 1HZ LYS 115 -1.224 16.551 -12.090 994 HZ3 LYS 115 2HZ LYS 115 -2.094 15.111 -12.237 995 H SER 116 H SER 116 -1.302 11.650 -5.870 996 HA SER 116 HA SER 116 -2.556 12.688 -3.548 997 HB2 SER 116 2HB SER 116 -3.553 10.924 -5.007 998 HB3 SER 116 3HB SER 116 -2.368 9.778 -4.391 999 HG SER 116 HG SER 116 -3.619 11.017 -2.338 1000 H LEU 117 H LEU 117 0.137 10.406 -3.963 1001 HA LEU 117 HA LEU 117 0.521 9.629 -1.318 1002 HB2 LEU 117 2HB LEU 117 1.692 8.550 -3.139 1003 HB3 LEU 117 3HB LEU 117 2.532 10.038 -3.537 1004 HG LEU 117 HG LEU 117 3.732 9.908 -1.360 1005 HD11 LEU 117 1HD1 LEU 117 2.404 7.209 -1.112 1006 HD12 LEU 117 2HD1 LEU 117 2.087 8.620 -0.099 1007 HD13 LEU 117 3HD1 LEU 117 3.670 7.844 -0.062 1008 HD21 LEU 117 3HD2 LEU 117 4.013 7.477 -3.133 1009 HD22 LEU 117 1HD2 LEU 117 5.217 8.052 -1.980 1010 HD23 LEU 117 2HD2 LEU 117 4.787 9.045 -3.372 1011 H GLU 118 H GLU 118 2.161 12.317 -3.031 1012 HA GLU 118 HA GLU 118 3.626 13.228 -0.817 1013 HB2 GLU 118 2HB GLU 118 2.712 14.732 -3.280 1014 HB3 GLU 118 3HB GLU 118 3.902 15.335 -2.129 1015 HG2 GLU 118 2HG GLU 118 5.300 13.329 -2.614 1016 HG3 GLU 118 3HG GLU 118 4.144 12.879 -3.863 1017 H ARG 119 H ARG 119 0.317 13.907 -1.777 1018 HA ARG 119 HA ARG 119 -0.144 16.028 0.082 1019 HB2 ARG 119 2HB ARG 119 -2.106 14.069 -1.143 1020 HB3 ARG 119 3HB ARG 119 -2.543 15.543 -0.289 1021 HG2 ARG 119 2HG ARG 119 -1.558 16.907 -1.997 1022 HG3 ARG 119 3HG ARG 119 -0.874 15.493 -2.800 1023 HD2 ARG 119 2HD ARG 119 -3.233 14.666 -3.131 1024 HD3 ARG 119 3HD ARG 119 -3.791 16.234 -2.544 1025 HE ARG 119 HE ARG 119 -2.195 17.000 -4.516 1026 HH11 ARG 119 1HH1 ARG 119 -4.598 14.534 -4.444 1027 HH12 ARG 119 2HH1 ARG 119 -4.897 14.627 -6.144 1028 HH21 ARG 119 1HH2 ARG 119 -2.597 17.114 -6.692 1029 HH22 ARG 119 2HH2 ARG 119 -3.762 16.048 -7.406 1030 H LEU 120 H LEU 120 -0.606 12.512 0.211 1031 HA LEU 120 HA LEU 120 -1.756 12.410 2.806 1032 HB2 LEU 120 2HB LEU 120 -0.292 10.299 1.215 1033 HB3 LEU 120 3HB LEU 120 -1.201 9.984 2.685 1034 HG LEU 120 HG LEU 120 -2.422 11.116 0.158 1035 HD11 LEU 120 1HD1 LEU 120 -1.593 8.857 -0.246 1036 HD12 LEU 120 2HD1 LEU 120 -3.354 8.892 -0.206 1037 HD13 LEU 120 3HD1 LEU 120 -2.455 8.276 1.180 1038 HD21 LEU 120 3HD2 LEU 120 -4.543 10.565 1.222 1039 HD22 LEU 120 1HD2 LEU 120 -3.616 11.676 2.227 1040 HD23 LEU 120 2HD2 LEU 120 -3.693 9.964 2.646 1041 H ILE 121 H ILE 121 1.586 12.206 1.658 1042 HA ILE 121 HA ILE 121 2.857 11.337 3.973 1043 HB ILE 121 HB ILE 121 3.855 13.295 1.893 1044 HG12 ILE 121 2HG1 ILE 121 4.317 10.315 2.240 1045 HG13 ILE 121 3HG1 ILE 121 3.282 11.061 1.026 1046 HG21 ILE 121 1HG2 ILE 121 5.150 13.560 3.949 1047 HG22 ILE 121 2HG2 ILE 121 6.121 12.799 2.691 1048 HG23 ILE 121 3HG2 ILE 121 5.451 11.823 3.997 1049 HD11 ILE 121 3HD1 ILE 121 6.268 11.394 1.234 1050 HD12 ILE 121 1HD1 ILE 121 5.228 12.118 0.007 1051 HD13 ILE 121 2HD1 ILE 121 5.412 10.366 0.085 1052 H ARG 122 H ARG 122 1.746 14.595 3.138 1053 HA ARG 122 HA ARG 122 2.949 15.919 5.353 1054 HB2 ARG 122 2HB ARG 122 0.475 16.750 3.823 1055 HB3 ARG 122 3HB ARG 122 1.488 17.788 4.817 1056 HG2 ARG 122 2HG ARG 122 3.358 17.423 3.248 1057 HG3 ARG 122 3HG ARG 122 2.293 16.440 2.241 1058 HD2 ARG 122 2HD ARG 122 2.025 19.377 2.872 1059 HD3 ARG 122 3HD ARG 122 2.383 18.646 1.309 1060 HE ARG 122 HE ARG 122 -0.132 17.819 2.439 1061 HH11 ARG 122 1HH1 ARG 122 1.445 20.180 0.495 1062 HH12 ARG 122 2HH1 ARG 122 -0.009 20.640 -0.317 1063 HH21 ARG 122 1HH2 ARG 122 -1.991 18.429 1.427 1064 HH22 ARG 122 2HH2 ARG 122 -1.944 19.669 0.218 1065 H GLU 123 H GLU 123 0.027 14.066 4.990 1066 HA GLU 123 HA GLU 123 -1.232 15.049 7.396 1067 HB2 GLU 123 2HB GLU 123 -1.917 12.636 5.699 1068 HB3 GLU 123 3HB GLU 123 -2.938 13.343 6.945 1069 HG2 GLU 123 2HG GLU 123 -2.103 14.651 4.359 1070 HG3 GLU 123 3HG GLU 123 -3.695 13.996 4.736 1071 H VAL 124 H VAL 124 0.056 11.851 6.418 1072 HA VAL 124 HA VAL 124 -0.001 10.820 9.086 1073 HB VAL 124 HB VAL 124 -0.181 9.307 7.180 1074 HG11 VAL 124 1HG1 VAL 124 1.736 8.805 5.738 1075 HG12 VAL 124 2HG1 VAL 124 2.670 10.072 6.535 1076 HG13 VAL 124 3HG1 VAL 124 1.240 10.492 5.591 1077 HG21 VAL 124 3HG2 VAL 124 0.699 8.392 9.268 1078 HG22 VAL 124 1HG2 VAL 124 2.341 8.801 8.772 1079 HG23 VAL 124 2HG2 VAL 124 1.428 7.586 7.878 1080 H GLY 125 H GLY 125 2.406 12.468 7.146 1081 HA2 GLY 125 2HA GLY 125 4.550 11.978 9.054 1082 HA3 GLY 125 3HA GLY 125 4.654 12.930 7.582 1083 H SER 126 H SER 126 2.926 13.036 10.698 1084 HA SER 126 HA SER 126 3.149 15.961 10.702 1085 HB2 SER 126 2HB SER 126 1.543 14.069 12.440 1086 HB3 SER 126 3HB SER 126 1.577 15.819 12.658 1087 HG SER 126 HG SER 126 0.484 14.299 10.544 1088 H LEU 127 H LEU 127 4.264 17.121 12.188 1089 HA LEU 127 HA LEU 127 6.553 16.131 13.382 1090 HB2 LEU 127 2HB LEU 127 6.794 18.230 14.467 1091 HB3 LEU 127 3HB LEU 127 6.033 18.536 12.920 1092 HG LEU 127 HG LEU 127 4.598 18.474 15.588 1093 HD11 LEU 127 1HD1 LEU 127 4.389 20.893 15.303 1094 HD12 LEU 127 2HD1 LEU 127 5.372 20.809 13.839 1095 HD13 LEU 127 3HD1 LEU 127 6.077 20.394 15.403 1096 HD21 LEU 127 3HD2 LEU 127 3.131 17.801 13.750 1097 HD22 LEU 127 1HD2 LEU 127 3.573 19.254 12.852 1098 HD23 LEU 127 2HD2 LEU 127 2.684 19.388 14.369 1099 H GLU 128 H GLU 128 3.317 16.120 14.625 1100 HA GLU 128 HA GLU 128 3.712 15.821 17.357 1101 HB2 GLU 128 2HB GLU 128 1.622 14.681 15.502 1102 HB3 GLU 128 3HB GLU 128 1.552 14.453 17.244 1103 HG2 GLU 128 2HG GLU 128 1.614 17.143 15.886 1104 HG3 GLU 128 3HG GLU 128 0.143 16.314 16.398 1105 H HIS 129 H HIS 129 3.797 13.324 14.819 1106 HA HIS 129 HA HIS 129 4.351 11.113 14.818 1107 HB2 HIS 129 2HB HIS 129 6.040 11.884 17.213 1108 HB3 HIS 129 3HB HIS 129 6.202 10.396 16.286 1109 HD1 HIS 129 HD1 HIS 129 7.314 13.874 16.402 1110 HD2 HIS 129 HD2 HIS 129 7.139 10.843 13.565 1111 HE1 HIS 129 HE1 HIS 129 8.859 14.586 14.559 1112 HE2 HIS 129 HE2 HIS 129 8.884 12.647 12.960 1113 H HIS 130 H HIS 130 2.327 12.295 17.024 1114 HA HIS 130 HA HIS 130 2.344 10.164 18.979 1115 HB2 HIS 130 2HB HIS 130 0.393 12.456 18.625 1116 HB3 HIS 130 3HB HIS 130 0.467 11.369 20.008 1117 HD1 HIS 130 HD1 HIS 130 1.247 14.654 19.389 1118 HD2 HIS 130 HD2 HIS 130 3.513 11.502 20.879 1119 HE1 HIS 130 HE1 HIS 130 3.149 15.721 20.630 1120 HE2 HIS 130 HE2 HIS 130 4.558 13.801 21.439 1121 H HIS 131 H HIS 131 1.933 8.367 17.613 1122 HA HIS 131 HA HIS 131 -0.937 8.073 16.965 1123 HB2 HIS 131 2HB HIS 131 0.665 8.026 14.982 1124 HB3 HIS 131 3HB HIS 131 1.303 6.524 15.642 1125 HD1 HIS 131 HD1 HIS 131 -2.270 7.736 15.120 1126 HD2 HIS 131 HD2 HIS 131 0.197 4.530 14.163 1127 HE1 HIS 131 HE1 HIS 131 -3.721 6.120 13.881 1128 HE2 HIS 131 HE2 HIS 131 -2.159 4.314 13.116 1129 H HIS 132 H HIS 132 -1.904 6.027 17.521 1130 HA HIS 132 HA HIS 132 -2.364 4.381 19.027 1131 HB2 HIS 132 2HB HIS 132 -0.402 3.188 18.148 1132 HB3 HIS 132 3HB HIS 132 0.658 4.106 19.208 1133 HD1 HIS 132 HD1 HIS 132 0.638 3.476 21.743 1134 HD2 HIS 132 HD2 HIS 132 -1.687 1.012 19.329 1135 HE1 HIS 132 HE1 HIS 132 0.145 1.444 23.129 1136 HE2 HIS 132 HE2 HIS 132 -1.190 -0.066 21.629 1137 H HIS 133 H HIS 133 -3.215 6.174 20.246 1138 HA HIS 133 HA HIS 133 -1.506 7.273 22.374 1139 HB2 HIS 133 2HB HIS 133 -2.512 8.869 20.781 1140 HB3 HIS 133 3HB HIS 133 -4.118 8.302 21.223 1141 HD1 HIS 133 HD1 HIS 133 -5.017 9.012 23.571 1142 HD2 HIS 133 HD2 HIS 133 -1.368 10.710 22.528 1143 HE1 HIS 133 HE1 HIS 133 -4.662 10.898 25.192 1144 HE2 HIS 133 HE2 HIS 133 -2.420 11.864 24.588 1145 H HIS 134 H HIS 134 -1.928 6.930 24.483 1146 HA HIS 134 HA HIS 134 -4.368 5.479 25.237 1147 HB2 HIS 134 2HB HIS 134 -1.799 6.034 26.732 1148 HB3 HIS 134 3HB HIS 134 -3.204 5.292 27.486 1149 HD1 HIS 134 HD1 HIS 134 -0.120 4.290 26.212 1150 HD2 HIS 134 HD2 HIS 134 -4.002 2.918 25.644 1151 HE1 HIS 134 HE1 HIS 134 0.110 1.919 25.430 1152 HE2 HIS 134 HE2 HIS 134 -2.245 1.056 25.292 Start of MODEL 8 1 H1 MET 1 1H MET 1 7.143 5.985 8.515 2 H2 MET 1 2H MET 1 6.240 4.966 7.514 3 H3 MET 1 3H MET 1 6.289 4.686 9.181 4 HA MET 1 HA MET 1 5.120 6.708 9.638 5 HB2 MET 1 2HB MET 1 6.058 7.978 7.728 6 HB3 MET 1 3HB MET 1 5.062 7.041 6.624 7 HG2 MET 1 2HG MET 1 3.049 7.975 7.601 8 HG3 MET 1 3HG MET 1 4.005 8.853 8.794 9 HE1 MET 1 3HE MET 1 5.578 10.899 8.226 10 HE2 MET 1 1HE MET 1 5.875 11.488 6.590 11 HE3 MET 1 2HE MET 1 6.478 9.904 7.080 12 H ASN 2 H ASN 2 2.760 6.781 9.618 13 HA ASN 2 HA ASN 2 1.560 4.234 9.306 14 HB2 ASN 2 2HB ASN 2 0.330 6.958 9.788 15 HB3 ASN 2 3HB ASN 2 -0.566 5.444 9.858 16 HD21 ASN 2 1HD2 ASN 2 -1.078 5.810 12.016 17 HD22 ASN 2 2HD2 ASN 2 0.087 5.608 13.274 18 H ILE 3 H ILE 3 2.144 3.923 6.976 19 HA ILE 3 HA ILE 3 -0.185 4.494 5.351 20 HB ILE 3 HB ILE 3 1.138 6.456 4.869 21 HG12 ILE 3 2HG1 ILE 3 1.389 4.537 2.533 22 HG13 ILE 3 3HG1 ILE 3 -0.112 5.329 3.005 23 HG21 ILE 3 1HG2 ILE 3 3.374 4.584 4.085 24 HG22 ILE 3 2HG2 ILE 3 3.332 5.608 5.521 25 HG23 ILE 3 3HG2 ILE 3 3.386 6.339 3.917 26 HD11 ILE 3 3HD1 ILE 3 0.959 6.462 1.142 27 HD12 ILE 3 1HD1 ILE 3 2.404 6.721 2.117 28 HD13 ILE 3 2HD1 ILE 3 0.885 7.502 2.565 29 H VAL 4 H VAL 4 -0.681 2.818 4.077 30 HA VAL 4 HA VAL 4 1.379 0.771 3.501 31 HB VAL 4 HB VAL 4 -1.558 0.240 4.045 32 HG11 VAL 4 1HG1 VAL 4 -0.875 -2.132 4.074 33 HG12 VAL 4 2HG1 VAL 4 0.760 -1.655 3.614 34 HG13 VAL 4 3HG1 VAL 4 -0.584 -1.374 2.507 35 HG21 VAL 4 3HG2 VAL 4 0.829 -0.287 5.825 36 HG22 VAL 4 1HG2 VAL 4 -0.832 -0.781 6.151 37 HG23 VAL 4 2HG2 VAL 4 -0.417 0.932 6.095 38 H ILE 5 H ILE 5 1.654 0.376 1.364 39 HA ILE 5 HA ILE 5 -0.421 1.330 -0.512 40 HB ILE 5 HB ILE 5 2.506 0.783 -1.059 41 HG12 ILE 5 2HG1 ILE 5 1.070 3.443 -0.742 42 HG13 ILE 5 3HG1 ILE 5 2.120 2.716 0.469 43 HG21 ILE 5 1HG2 ILE 5 1.093 0.495 -3.037 44 HG22 ILE 5 2HG2 ILE 5 2.107 1.930 -3.190 45 HG23 ILE 5 3HG2 ILE 5 0.398 2.097 -2.787 46 HD11 ILE 5 3HD1 ILE 5 3.265 4.456 -0.779 47 HD12 ILE 5 1HD1 ILE 5 2.958 3.595 -2.285 48 HD13 ILE 5 2HD1 ILE 5 4.012 2.884 -1.061 49 H VAL 6 H VAL 6 -1.634 -0.183 -1.467 50 HA VAL 6 HA VAL 6 -0.625 -2.948 -1.676 51 HB VAL 6 HB VAL 6 -3.483 -1.955 -1.870 52 HG11 VAL 6 1HG1 VAL 6 -4.096 -4.328 -1.685 53 HG12 VAL 6 2HG1 VAL 6 -2.389 -4.770 -1.713 54 HG13 VAL 6 3HG1 VAL 6 -3.128 -4.017 -3.127 55 HG21 VAL 6 3HG2 VAL 6 -2.593 -1.652 0.384 56 HG22 VAL 6 1HG2 VAL 6 -2.064 -3.334 0.418 57 HG23 VAL 6 2HG2 VAL 6 -3.786 -2.952 0.356 58 H VAL 7 H VAL 7 0.170 -3.475 -3.631 59 HA VAL 7 HA VAL 7 -0.838 -2.057 -6.021 60 HB VAL 7 HB VAL 7 1.777 -3.551 -5.686 61 HG11 VAL 7 1HG1 VAL 7 0.815 -1.740 -7.907 62 HG12 VAL 7 2HG1 VAL 7 1.033 -3.488 -8.005 63 HG13 VAL 7 3HG1 VAL 7 2.431 -2.438 -7.777 64 HG21 VAL 7 3HG2 VAL 7 2.840 -1.352 -5.580 65 HG22 VAL 7 1HG2 VAL 7 1.698 -1.572 -4.254 66 HG23 VAL 7 2HG2 VAL 7 1.257 -0.573 -5.642 67 H PHE 8 H PHE 8 -2.161 -3.194 -7.331 68 HA PHE 8 HA PHE 8 -2.236 -6.101 -7.223 69 HB2 PHE 8 2HB PHE 8 -3.929 -4.014 -8.582 70 HB3 PHE 8 3HB PHE 8 -4.110 -5.722 -8.965 71 HD1 PHE 8 HD2 PHE 8 -4.180 -3.328 -6.105 72 HD2 PHE 8 HD1 PHE 8 -5.455 -7.088 -7.651 73 HE1 PHE 8 HE2 PHE 8 -5.669 -3.625 -4.168 74 HE2 PHE 8 HE1 PHE 8 -6.944 -7.382 -5.719 75 HZ PHE 8 HZ PHE 8 -7.054 -5.650 -3.974 76 H SER 9 H SER 9 0.195 -5.061 -8.289 77 HA SER 9 HA SER 9 0.035 -5.851 -11.135 78 HB2 SER 9 2HB SER 9 0.920 -3.596 -10.883 79 HB3 SER 9 3HB SER 9 2.119 -4.159 -9.721 80 HG SER 9 HG SER 9 3.193 -5.219 -11.331 81 H THR 10 H THR 10 0.494 -7.947 -11.316 82 HA THR 10 HA THR 10 1.828 -9.549 -9.458 83 HB THR 10 HB THR 10 1.977 -11.251 -11.278 84 HG1 THR 10 HG1 THR 10 2.202 -10.308 -13.199 85 HG21 THR 10 3HG2 THR 10 -0.438 -11.479 -11.630 86 HG22 THR 10 1HG2 THR 10 -0.681 -9.809 -11.118 87 HG23 THR 10 2HG2 THR 10 -0.090 -11.007 -9.966 88 H ASP 11 H ASP 11 3.120 -7.958 -12.357 89 HA ASP 11 HA ASP 11 5.770 -9.081 -11.810 90 HB2 ASP 11 2HB ASP 11 4.723 -7.542 -14.197 91 HB3 ASP 11 3HB ASP 11 6.363 -8.172 -14.046 92 H GLU 12 H GLU 12 7.644 -7.783 -11.688 93 HA GLU 12 HA GLU 12 7.260 -5.564 -9.931 94 HB2 GLU 12 2HB GLU 12 9.862 -6.562 -11.112 95 HB3 GLU 12 3HB GLU 12 9.675 -5.552 -9.688 96 HG2 GLU 12 2HG GLU 12 10.001 -7.557 -8.670 97 HG3 GLU 12 3HG GLU 12 8.248 -7.615 -8.833 98 H GLU 13 H GLU 13 7.603 -5.761 -13.313 99 HA GLU 13 HA GLU 13 9.110 -3.610 -14.092 100 HB2 GLU 13 2HB GLU 13 6.482 -4.526 -15.282 101 HB3 GLU 13 3HB GLU 13 7.637 -3.479 -16.092 102 HG2 GLU 13 2HG GLU 13 8.213 -6.297 -15.188 103 HG3 GLU 13 3HG GLU 13 7.755 -5.835 -16.826 104 H THR 14 H THR 14 5.610 -3.454 -13.335 105 HA THR 14 HA THR 14 5.486 -0.603 -13.538 106 HB THR 14 HB THR 14 3.568 -2.582 -12.279 107 HG1 THR 14 HG1 THR 14 2.501 -2.425 -14.201 108 HG21 THR 14 3HG2 THR 14 1.907 -0.761 -12.316 109 HG22 THR 14 1HG2 THR 14 3.165 0.371 -12.810 110 HG23 THR 14 2HG2 THR 14 3.243 -0.400 -11.226 111 H LEU 15 H LEU 15 5.778 -2.850 -10.811 112 HA LEU 15 HA LEU 15 5.494 -1.073 -8.679 113 HB2 LEU 15 2HB LEU 15 5.539 -3.509 -8.438 114 HB3 LEU 15 3HB LEU 15 7.235 -3.538 -8.882 115 HG LEU 15 HG LEU 15 7.755 -2.228 -6.823 116 HD11 LEU 15 1HD1 LEU 15 4.837 -2.685 -6.197 117 HD12 LEU 15 2HD1 LEU 15 5.619 -1.130 -6.488 118 HD13 LEU 15 3HD1 LEU 15 6.043 -2.077 -5.062 119 HD21 LEU 15 3HD2 LEU 15 6.300 -4.840 -6.382 120 HD22 LEU 15 1HD2 LEU 15 7.450 -4.100 -5.268 121 HD23 LEU 15 2HD2 LEU 15 7.990 -4.657 -6.851 122 H ARG 16 H ARG 16 8.304 -1.764 -10.676 123 HA ARG 16 HA ARG 16 10.353 -0.582 -9.228 124 HB2 ARG 16 2HB ARG 16 10.726 -1.872 -11.265 125 HB3 ARG 16 3HB ARG 16 9.917 -0.642 -12.225 126 HG2 ARG 16 2HG ARG 16 12.263 -0.395 -12.543 127 HG3 ARG 16 3HG ARG 16 11.711 0.962 -11.565 128 HD2 ARG 16 2HD ARG 16 12.483 -0.273 -9.534 129 HD3 ARG 16 3HD ARG 16 13.157 -1.510 -10.599 130 HE ARG 16 HE ARG 16 14.068 1.153 -11.189 131 HH11 ARG 16 1HH1 ARG 16 14.683 -1.696 -9.336 132 HH12 ARG 16 2HH1 ARG 16 16.325 -1.259 -9.021 133 HH21 ARG 16 1HH2 ARG 16 16.165 1.688 -10.795 134 HH22 ARG 16 2HH2 ARG 16 17.158 0.639 -9.844 135 H LYS 17 H LYS 17 7.975 0.964 -11.356 136 HA LYS 17 HA LYS 17 9.162 3.548 -11.324 137 HB2 LYS 17 2HB LYS 17 6.448 2.507 -12.089 138 HB3 LYS 17 3HB LYS 17 6.735 4.240 -12.011 139 HG2 LYS 17 2HG LYS 17 7.000 3.428 -14.283 140 HG3 LYS 17 3HG LYS 17 8.536 4.027 -13.656 141 HD2 LYS 17 2HD LYS 17 9.153 1.654 -13.124 142 HD3 LYS 17 3HD LYS 17 7.681 1.142 -13.953 143 HE2 LYS 17 2HE LYS 17 9.587 0.967 -15.447 144 HE3 LYS 17 3HE LYS 17 8.487 2.222 -16.015 145 HZ1 LYS 17 3HZ LYS 17 10.976 2.703 -14.466 146 HZ2 LYS 17 1HZ LYS 17 9.939 3.892 -15.068 147 HZ3 LYS 17 2HZ LYS 17 10.812 2.911 -16.133 148 H PHE 18 H PHE 18 6.899 1.946 -9.173 149 HA PHE 18 HA PHE 18 6.151 4.300 -7.730 150 HB2 PHE 18 2HB PHE 18 5.952 1.356 -7.080 151 HB3 PHE 18 3HB PHE 18 5.380 2.614 -5.985 152 HD1 PHE 18 HD1 PHE 18 4.966 1.271 -9.425 153 HD2 PHE 18 HD2 PHE 18 3.263 3.582 -6.277 154 HE1 PHE 18 HE1 PHE 18 2.843 1.389 -10.658 155 HE2 PHE 18 HE2 PHE 18 1.137 3.694 -7.507 156 HZ PHE 18 HZ PHE 18 0.929 2.600 -9.701 157 H LYS 19 H LYS 19 8.626 1.803 -7.254 158 HA LYS 19 HA LYS 19 9.690 2.676 -4.823 159 HB2 LYS 19 2HB LYS 19 11.114 1.490 -7.218 160 HB3 LYS 19 3HB LYS 19 11.855 1.703 -5.637 161 HG2 LYS 19 2HG LYS 19 10.146 0.202 -4.668 162 HG3 LYS 19 3HG LYS 19 9.498 -0.067 -6.291 163 HD2 LYS 19 2HD LYS 19 11.576 -1.053 -7.016 164 HD3 LYS 19 3HD LYS 19 12.359 -0.636 -5.491 165 HE2 LYS 19 2HE LYS 19 10.750 -2.134 -4.323 166 HE3 LYS 19 3HE LYS 19 10.115 -2.617 -5.896 167 HZ1 LYS 19 3HZ LYS 19 12.948 -2.939 -5.072 168 HZ2 LYS 19 1HZ LYS 19 12.227 -3.535 -6.480 169 HZ3 LYS 19 2HZ LYS 19 11.787 -4.163 -4.973 170 H ASP 20 H ASP 20 10.474 3.711 -8.130 171 HA ASP 20 HA ASP 20 12.474 5.567 -7.572 172 HB2 ASP 20 2HB ASP 20 11.972 4.811 -9.830 173 HB3 ASP 20 3HB ASP 20 10.390 5.578 -9.770 174 H ILE 21 H ILE 21 8.948 6.052 -7.692 175 HA ILE 21 HA ILE 21 8.925 8.829 -7.256 176 HB ILE 21 HB ILE 21 6.848 6.748 -6.528 177 HG12 ILE 21 2HG1 ILE 21 7.053 8.625 -8.905 178 HG13 ILE 21 3HG1 ILE 21 7.396 6.899 -8.937 179 HG21 ILE 21 1HG2 ILE 21 6.483 8.757 -5.198 180 HG22 ILE 21 2HG2 ILE 21 5.240 8.612 -6.440 181 HG23 ILE 21 3HG2 ILE 21 6.565 9.756 -6.651 182 HD11 ILE 21 3HD1 ILE 21 4.728 8.184 -8.398 183 HD12 ILE 21 1HD1 ILE 21 5.050 6.449 -8.345 184 HD13 ILE 21 2HD1 ILE 21 5.216 7.331 -9.863 185 H ILE 22 H ILE 22 8.449 6.202 -4.857 186 HA ILE 22 HA ILE 22 8.243 7.838 -2.593 187 HB ILE 22 HB ILE 22 9.341 5.018 -2.732 188 HG12 ILE 22 2HG1 ILE 22 6.510 6.006 -2.250 189 HG13 ILE 22 3HG1 ILE 22 7.087 5.250 -3.732 190 HG21 ILE 22 1HG2 ILE 22 9.877 6.094 -0.608 191 HG22 ILE 22 2HG2 ILE 22 8.649 4.850 -0.376 192 HG23 ILE 22 3HG2 ILE 22 8.186 6.552 -0.393 193 HD11 ILE 22 3HD1 ILE 22 6.902 3.953 -1.020 194 HD12 ILE 22 1HD1 ILE 22 7.543 3.186 -2.475 195 HD13 ILE 22 2HD1 ILE 22 5.848 3.667 -2.404 196 H LYS 23 H LYS 23 11.139 6.361 -4.057 197 HA LYS 23 HA LYS 23 13.013 7.286 -2.149 198 HB2 LYS 23 2HB LYS 23 13.397 6.682 -5.093 199 HB3 LYS 23 3HB LYS 23 14.703 6.940 -3.945 200 HG2 LYS 23 2HG LYS 23 14.013 4.970 -2.688 201 HG3 LYS 23 3HG LYS 23 12.664 4.722 -3.800 202 HD2 LYS 23 2HD LYS 23 14.296 4.485 -5.657 203 HD3 LYS 23 3HD LYS 23 15.608 4.624 -4.485 204 HE2 LYS 23 2HE LYS 23 14.754 2.616 -3.331 205 HE3 LYS 23 3HE LYS 23 13.497 2.465 -4.561 206 HZ1 LYS 23 3HZ LYS 23 16.426 2.239 -4.959 207 HZ2 LYS 23 1HZ LYS 23 15.308 2.301 -6.227 208 HZ3 LYS 23 2HZ LYS 23 15.269 1.018 -5.133 209 H LYS 24 H LYS 24 11.630 8.772 -5.023 210 HA LYS 24 HA LYS 24 13.378 11.019 -5.128 211 HB2 LYS 24 2HB LYS 24 11.951 10.144 -7.018 212 HB3 LYS 24 3HB LYS 24 10.554 10.834 -6.206 213 HG2 LYS 24 2HG LYS 24 11.549 13.070 -6.407 214 HG3 LYS 24 3HG LYS 24 12.944 12.368 -7.231 215 HD2 LYS 24 2HD LYS 24 11.320 11.467 -8.953 216 HD3 LYS 24 3HD LYS 24 10.082 12.465 -8.187 217 HE2 LYS 24 2HE LYS 24 10.981 13.654 -10.079 218 HE3 LYS 24 3HE LYS 24 11.502 14.460 -8.600 219 HZ1 LYS 24 3HZ LYS 24 13.157 12.561 -10.175 220 HZ2 LYS 24 1HZ LYS 24 13.652 13.415 -8.801 221 HZ3 LYS 24 2HZ LYS 24 13.296 14.245 -10.231 222 H ASN 25 H ASN 25 10.318 10.377 -3.506 223 HA ASN 25 HA ASN 25 9.912 13.048 -2.549 224 HB2 ASN 25 2HB ASN 25 8.788 10.427 -1.519 225 HB3 ASN 25 3HB ASN 25 8.199 12.029 -1.093 226 HD21 ASN 25 1HD2 ASN 25 8.530 13.062 -3.819 227 HD22 ASN 25 2HD2 ASN 25 7.252 12.363 -4.739 228 H GLY 26 H GLY 26 11.566 10.193 -1.302 229 HA2 GLY 26 2HA GLY 26 13.553 10.592 0.053 230 HA3 GLY 26 3HA GLY 26 12.690 11.895 0.845 231 H PHE 27 H PHE 27 11.615 8.553 0.201 232 HA PHE 27 HA PHE 27 11.659 8.046 3.107 233 HB2 PHE 27 2HB PHE 27 9.374 7.526 1.199 234 HB3 PHE 27 3HB PHE 27 9.488 6.760 2.781 235 HD1 PHE 27 HD2 PHE 27 8.965 9.938 1.005 236 HD2 PHE 27 HD1 PHE 27 9.098 8.002 4.798 237 HE1 PHE 27 HE2 PHE 27 7.903 11.898 2.043 238 HE2 PHE 27 HE1 PHE 27 8.040 9.961 5.838 239 HZ PHE 27 HZ PHE 27 7.441 11.912 4.462 240 H LYS 28 H LYS 28 11.182 5.617 3.529 241 HA LYS 28 HA LYS 28 13.010 4.081 1.805 242 HB2 LYS 28 2HB LYS 28 12.096 3.596 4.650 243 HB3 LYS 28 3HB LYS 28 13.176 2.535 3.759 244 HG2 LYS 28 2HG LYS 28 13.800 5.433 4.312 245 HG3 LYS 28 3HG LYS 28 14.259 4.121 5.394 246 HD2 LYS 28 2HD LYS 28 16.185 4.439 4.124 247 HD3 LYS 28 3HD LYS 28 15.402 3.091 3.303 248 HE2 LYS 28 2HE LYS 28 16.212 4.639 1.651 249 HE3 LYS 28 3HE LYS 28 14.454 4.718 1.666 250 HZ1 LYS 28 3HZ LYS 28 15.364 6.923 1.557 251 HZ2 LYS 28 1HZ LYS 28 16.318 6.656 2.925 252 HZ3 LYS 28 2HZ LYS 28 14.638 6.722 3.071 253 H VAL 29 H VAL 29 12.388 2.244 0.759 254 HA VAL 29 HA VAL 29 9.497 1.717 0.696 255 HB VAL 29 HB VAL 29 11.610 0.831 -1.283 256 HG11 VAL 29 1HG1 VAL 29 9.607 -0.551 -1.349 257 HG12 VAL 29 2HG1 VAL 29 9.695 0.461 -2.791 258 HG13 VAL 29 3HG1 VAL 29 8.594 0.885 -1.480 259 HG21 VAL 29 3HG2 VAL 29 11.519 3.261 -1.222 260 HG22 VAL 29 1HG2 VAL 29 9.764 3.221 -1.401 261 HG23 VAL 29 2HG2 VAL 29 10.798 2.664 -2.717 262 H ARG 30 H ARG 30 8.621 -0.195 1.289 263 HA ARG 30 HA ARG 30 10.379 -2.561 1.578 264 HB2 ARG 30 2HB ARG 30 7.962 -1.786 3.234 265 HB3 ARG 30 3HB ARG 30 8.760 -3.351 3.331 266 HG2 ARG 30 2HG ARG 30 10.061 -0.698 3.940 267 HG3 ARG 30 3HG ARG 30 9.427 -1.827 5.140 268 HD2 ARG 30 2HD ARG 30 11.015 -3.531 4.383 269 HD3 ARG 30 3HD ARG 30 11.642 -2.414 3.170 270 HE ARG 30 HE ARG 30 12.156 -0.983 5.260 271 HH11 ARG 30 1HH1 ARG 30 12.374 -4.417 5.062 272 HH12 ARG 30 2HH1 ARG 30 13.621 -4.512 6.258 273 HH21 ARG 30 1HH2 ARG 30 13.761 -1.112 6.764 274 HH22 ARG 30 2HH2 ARG 30 14.402 -2.658 7.213 275 H THR 31 H THR 31 9.856 -4.205 0.211 276 HA THR 31 HA THR 31 7.154 -4.173 -1.002 277 HB THR 31 HB THR 31 8.189 -5.490 -2.885 278 HG1 THR 31 HG1 THR 31 10.090 -6.179 -1.771 279 HG21 THR 31 3HG2 THR 31 9.193 -3.540 -3.952 280 HG22 THR 31 1HG2 THR 31 9.362 -2.747 -2.385 281 HG23 THR 31 2HG2 THR 31 7.757 -3.069 -3.043 282 H VAL 32 H VAL 32 5.927 -5.571 0.087 283 HA VAL 32 HA VAL 32 7.002 -8.167 0.942 284 HB VAL 32 HB VAL 32 4.407 -6.763 1.620 285 HG11 VAL 32 1HG1 VAL 32 4.098 -9.184 1.656 286 HG12 VAL 32 2HG1 VAL 32 4.067 -8.522 3.289 287 HG13 VAL 32 3HG1 VAL 32 5.504 -9.360 2.707 288 HG21 VAL 32 3HG2 VAL 32 6.328 -5.681 2.629 289 HG22 VAL 32 1HG2 VAL 32 6.906 -7.226 3.256 290 HG23 VAL 32 2HG2 VAL 32 5.404 -6.533 3.867 291 H ARG 33 H ARG 33 6.391 -10.067 0.018 292 HA ARG 33 HA ARG 33 4.014 -10.084 -1.745 293 HB2 ARG 33 2HB ARG 33 6.212 -10.079 -2.991 294 HB3 ARG 33 3HB ARG 33 6.567 -11.635 -2.253 295 HG2 ARG 33 2HG ARG 33 4.606 -12.608 -3.354 296 HG3 ARG 33 3HG ARG 33 4.239 -11.046 -4.087 297 HD2 ARG 33 2HD ARG 33 5.386 -12.495 -5.671 298 HD3 ARG 33 3HD ARG 33 6.386 -11.099 -5.270 299 HE ARG 33 HE ARG 33 6.969 -13.353 -3.617 300 HH11 ARG 33 1HH1 ARG 33 7.572 -11.934 -6.696 301 HH12 ARG 33 2HH1 ARG 33 9.044 -12.808 -6.929 302 HH21 ARG 33 1HH2 ARG 33 8.875 -14.446 -3.915 303 HH22 ARG 33 2HH2 ARG 33 9.778 -14.202 -5.369 304 H SER 34 H SER 34 5.044 -11.125 1.103 305 HA SER 34 HA SER 34 3.266 -13.412 1.133 306 HB2 SER 34 2HB SER 34 4.911 -14.992 2.065 307 HB3 SER 34 3HB SER 34 5.404 -14.460 0.458 308 HG SER 34 HG SER 34 6.877 -13.049 1.409 309 HA PRO 35 HA PRO 35 2.286 -11.920 5.184 310 HB2 PRO 35 2HB PRO 35 2.016 -14.333 6.561 311 HB3 PRO 35 3HB PRO 35 0.756 -13.550 5.604 312 HG2 PRO 35 2HG PRO 35 2.615 -15.768 4.848 313 HG3 PRO 35 3HG PRO 35 0.898 -15.558 4.451 314 HD2 PRO 35 2HD PRO 35 2.804 -15.057 2.642 315 HD3 PRO 35 3HD PRO 35 1.352 -14.037 2.744 316 H GLN 36 H GLN 36 4.788 -14.437 5.022 317 HA GLN 36 HA GLN 36 6.007 -14.006 7.513 318 HB2 GLN 36 2HB GLN 36 6.556 -15.924 6.107 319 HB3 GLN 36 3HB GLN 36 7.226 -14.866 4.874 320 HG2 GLN 36 2HG GLN 36 9.022 -15.871 6.078 321 HG3 GLN 36 3HG GLN 36 8.966 -14.157 6.484 322 HE21 GLN 36 1HE2 GLN 36 10.015 -14.379 8.410 323 HE22 GLN 36 2HE2 GLN 36 9.334 -15.188 9.780 324 H GLU 37 H GLU 37 6.909 -12.601 4.333 325 HA GLU 37 HA GLU 37 8.846 -10.794 5.245 326 HB2 GLU 37 2HB GLU 37 6.928 -10.469 2.921 327 HB3 GLU 37 3HB GLU 37 8.387 -9.521 3.170 328 HG2 GLU 37 2HG GLU 37 9.756 -11.506 2.902 329 HG3 GLU 37 3HG GLU 37 8.308 -12.500 2.735 330 H LEU 38 H LEU 38 5.345 -10.469 4.978 331 HA LEU 38 HA LEU 38 5.080 -7.763 5.651 332 HB2 LEU 38 2HB LEU 38 3.289 -9.264 4.754 333 HB3 LEU 38 3HB LEU 38 3.178 -10.012 6.335 334 HG LEU 38 HG LEU 38 2.430 -7.885 7.309 335 HD11 LEU 38 1HD1 LEU 38 3.598 -6.330 5.854 336 HD12 LEU 38 2HD1 LEU 38 1.869 -5.988 5.847 337 HD13 LEU 38 3HD1 LEU 38 2.605 -6.830 4.483 338 HD21 LEU 38 3HD2 LEU 38 0.859 -8.737 4.870 339 HD22 LEU 38 1HD2 LEU 38 0.228 -7.782 6.214 340 HD23 LEU 38 2HD2 LEU 38 0.755 -9.444 6.484 341 H LYS 39 H LYS 39 5.476 -10.620 7.674 342 HA LYS 39 HA LYS 39 5.129 -9.205 10.154 343 HB2 LYS 39 2HB LYS 39 4.666 -11.623 9.948 344 HB3 LYS 39 3HB LYS 39 6.371 -11.919 9.629 345 HG2 LYS 39 2HG LYS 39 6.954 -11.144 11.847 346 HG3 LYS 39 3HG LYS 39 5.270 -10.735 12.175 347 HD2 LYS 39 2HD LYS 39 4.692 -13.148 11.854 348 HD3 LYS 39 3HD LYS 39 6.416 -13.493 11.707 349 HE2 LYS 39 2HE LYS 39 5.044 -12.286 14.114 350 HE3 LYS 39 3HE LYS 39 5.612 -13.949 13.971 351 HZ1 LYS 39 3HZ LYS 39 7.193 -12.644 15.195 352 HZ2 LYS 39 1HZ LYS 39 7.302 -11.505 13.947 353 HZ3 LYS 39 2HZ LYS 39 7.874 -13.076 13.712 354 H ASP 40 H ASP 40 7.942 -10.409 8.315 355 HA ASP 40 HA ASP 40 9.917 -9.665 10.160 356 HB2 ASP 40 2HB ASP 40 10.031 -10.075 7.175 357 HB3 ASP 40 3HB ASP 40 11.462 -9.694 8.132 358 H SER 41 H SER 41 8.271 -7.730 7.729 359 HA SER 41 HA SER 41 9.950 -5.475 7.744 360 HB2 SER 41 2HB SER 41 8.046 -4.203 6.942 361 HB3 SER 41 3HB SER 41 8.003 -5.799 6.192 362 HG SER 41 HG SER 41 6.251 -6.302 7.320 363 H ILE 42 H ILE 42 7.026 -6.075 9.731 364 HA ILE 42 HA ILE 42 7.345 -3.948 11.521 365 HB ILE 42 HB ILE 42 5.996 -6.627 11.805 366 HG12 ILE 42 2HG1 ILE 42 3.954 -5.191 11.973 367 HG13 ILE 42 3HG1 ILE 42 4.968 -3.770 11.758 368 HG21 ILE 42 1HG2 ILE 42 6.195 -4.521 13.961 369 HG22 ILE 42 2HG2 ILE 42 6.822 -6.169 14.027 370 HG23 ILE 42 3HG2 ILE 42 5.082 -5.889 13.986 371 HD11 ILE 42 3HD1 ILE 42 4.607 -5.978 9.747 372 HD12 ILE 42 1HD1 ILE 42 5.561 -4.511 9.530 373 HD13 ILE 42 2HD1 ILE 42 3.810 -4.405 9.712 374 H GLU 43 H GLU 43 8.740 -7.207 11.593 375 HA GLU 43 HA GLU 43 9.982 -7.121 14.088 376 HB2 GLU 43 2HB GLU 43 10.982 -8.441 11.555 377 HB3 GLU 43 3HB GLU 43 11.607 -8.756 13.168 378 HG2 GLU 43 2HG GLU 43 8.801 -9.310 12.214 379 HG3 GLU 43 3HG GLU 43 10.076 -10.503 12.441 380 H GLU 44 H GLU 44 11.002 -5.648 11.028 381 HA GLU 44 HA GLU 44 13.457 -4.642 12.202 382 HB2 GLU 44 2HB GLU 44 12.141 -4.293 9.527 383 HB3 GLU 44 3HB GLU 44 13.400 -3.172 10.026 384 HG2 GLU 44 2HG GLU 44 14.842 -5.238 10.453 385 HG3 GLU 44 3HG GLU 44 13.618 -6.129 9.548 386 H LEU 45 H LEU 45 10.205 -3.402 11.588 387 HA LEU 45 HA LEU 45 10.679 -0.673 11.981 388 HB2 LEU 45 2HB LEU 45 8.215 -2.310 12.585 389 HB3 LEU 45 3HB LEU 45 8.257 -0.558 12.644 390 HG LEU 45 HG LEU 45 8.738 -2.251 10.180 391 HD11 LEU 45 1HD1 LEU 45 6.612 -1.357 9.395 392 HD12 LEU 45 2HD1 LEU 45 6.410 -0.464 10.904 393 HD13 LEU 45 3HD1 LEU 45 6.390 -2.229 10.914 394 HD21 LEU 45 3HD2 LEU 45 8.745 -0.117 8.971 395 HD22 LEU 45 1HD2 LEU 45 10.065 -0.201 10.137 396 HD23 LEU 45 2HD2 LEU 45 8.624 0.752 10.501 397 H VAL 46 H VAL 46 10.277 -3.240 14.354 398 HA VAL 46 HA VAL 46 9.975 -1.541 16.616 399 HB VAL 46 HB VAL 46 9.343 -3.946 16.591 400 HG11 VAL 46 1HG1 VAL 46 11.048 -5.658 16.966 401 HG12 VAL 46 2HG1 VAL 46 12.312 -4.442 16.773 402 HG13 VAL 46 3HG1 VAL 46 11.265 -4.849 15.413 403 HG21 VAL 46 3HG2 VAL 46 11.265 -3.157 18.787 404 HG22 VAL 46 1HG2 VAL 46 10.065 -4.447 18.886 405 HG23 VAL 46 2HG2 VAL 46 9.545 -2.771 18.713 406 H LYS 47 H LYS 47 12.685 -2.194 14.656 407 HA LYS 47 HA LYS 47 14.482 -1.026 16.692 408 HB2 LYS 47 2HB LYS 47 15.221 -2.415 14.101 409 HB3 LYS 47 3HB LYS 47 16.359 -1.704 15.230 410 HG2 LYS 47 2HG LYS 47 16.522 -3.858 15.904 411 HG3 LYS 47 3HG LYS 47 15.150 -3.387 16.911 412 HD2 LYS 47 2HD LYS 47 13.600 -4.344 15.316 413 HD3 LYS 47 3HD LYS 47 14.918 -4.693 14.194 414 HE2 LYS 47 2HE LYS 47 15.897 -6.230 15.864 415 HE3 LYS 47 3HE LYS 47 14.532 -5.915 16.932 416 HZ1 LYS 47 3HZ LYS 47 14.289 -7.977 15.642 417 HZ2 LYS 47 1HZ LYS 47 14.307 -7.079 14.210 418 HZ3 LYS 47 2HZ LYS 47 13.051 -6.873 15.320 419 H LYS 48 H LYS 48 13.966 -0.841 13.142 420 HA LYS 48 HA LYS 48 14.670 2.025 13.237 421 HB2 LYS 48 2HB LYS 48 14.628 0.144 10.858 422 HB3 LYS 48 3HB LYS 48 15.052 1.847 10.797 423 HG2 LYS 48 2HG LYS 48 17.101 0.747 10.768 424 HG3 LYS 48 3HG LYS 48 16.923 1.259 12.446 425 HD2 LYS 48 2HD LYS 48 16.174 -0.990 13.059 426 HD3 LYS 48 3HD LYS 48 16.307 -1.503 11.376 427 HE2 LYS 48 2HE LYS 48 18.246 -2.221 12.701 428 HE3 LYS 48 3HE LYS 48 18.713 -1.098 11.426 429 HZ1 LYS 48 3HZ LYS 48 18.865 0.659 13.013 430 HZ2 LYS 48 1HZ LYS 48 19.771 -0.643 13.593 431 HZ3 LYS 48 2HZ LYS 48 18.251 -0.314 14.250 432 H TYR 49 H TYR 49 13.076 3.477 12.961 433 HA TYR 49 HA TYR 49 10.648 2.696 11.497 434 HB2 TYR 49 2HB TYR 49 9.336 3.973 13.308 435 HB3 TYR 49 3HB TYR 49 9.919 2.361 13.698 436 HD1 TYR 49 HD1 TYR 49 10.296 5.947 14.397 437 HD2 TYR 49 HD2 TYR 49 11.692 2.035 15.347 438 HE1 TYR 49 HE1 TYR 49 11.389 6.830 16.413 439 HE2 TYR 49 HE2 TYR 49 12.791 2.913 17.363 440 HH TYR 49 HH TYR 49 13.659 5.045 18.216 441 H ASN 50 H ASN 50 9.226 5.108 12.096 442 HA ASN 50 HA ASN 50 8.940 7.268 11.490 443 HB2 ASN 50 2HB ASN 50 11.939 7.322 11.117 444 HB3 ASN 50 3HB ASN 50 10.896 8.726 10.926 445 HD21 ASN 50 1HD2 ASN 50 13.054 8.286 12.803 446 HD22 ASN 50 2HD2 ASN 50 12.367 8.475 14.374 447 H ALA 51 H ALA 51 11.619 6.752 9.188 448 HA ALA 51 HA ALA 51 9.900 7.887 7.146 449 HB1 ALA 51 3HB ALA 51 11.918 8.078 5.811 450 HB2 ALA 51 1HB ALA 51 12.805 7.088 6.971 451 HB3 ALA 51 2HB ALA 51 12.202 8.675 7.445 452 H THR 52 H THR 52 10.231 4.769 8.100 453 HA THR 52 HA THR 52 10.501 3.485 5.537 454 HB THR 52 HB THR 52 9.570 2.309 8.172 455 HG1 THR 52 HG1 THR 52 12.086 1.663 7.253 456 HG21 THR 52 3HG2 THR 52 10.575 0.953 5.658 457 HG22 THR 52 1HG2 THR 52 8.916 0.925 6.259 458 HG23 THR 52 2HG2 THR 52 10.202 0.148 7.182 459 H ILE 53 H ILE 53 8.972 2.835 4.147 460 HA ILE 53 HA ILE 53 6.118 2.977 4.922 461 HB ILE 53 HB ILE 53 7.335 3.625 2.219 462 HG12 ILE 53 2HG1 ILE 53 5.909 5.381 4.244 463 HG13 ILE 53 3HG1 ILE 53 7.620 5.445 3.832 464 HG21 ILE 53 1HG2 ILE 53 5.037 4.168 1.509 465 HG22 ILE 53 2HG2 ILE 53 4.432 3.572 3.055 466 HG23 ILE 53 3HG2 ILE 53 5.218 2.465 1.930 467 HD11 ILE 53 3HD1 ILE 53 6.393 7.250 2.781 468 HD12 ILE 53 1HD1 ILE 53 5.333 6.091 1.982 469 HD13 ILE 53 2HD1 ILE 53 7.046 6.151 1.567 470 H VAL 54 H VAL 54 4.823 1.228 4.327 471 HA VAL 54 HA VAL 54 6.285 -1.095 3.252 472 HB VAL 54 HB VAL 54 5.395 -1.431 5.494 473 HG11 VAL 54 1HG1 VAL 54 3.510 0.117 5.416 474 HG12 VAL 54 2HG1 VAL 54 2.990 -1.485 5.935 475 HG13 VAL 54 3HG1 VAL 54 2.669 -0.947 4.287 476 HG21 VAL 54 3HG2 VAL 54 5.548 -3.365 4.025 477 HG22 VAL 54 1HG2 VAL 54 3.925 -3.051 3.406 478 HG23 VAL 54 2HG2 VAL 54 4.152 -3.518 5.092 479 H VAL 55 H VAL 55 5.688 -2.093 1.436 480 HA VAL 55 HA VAL 55 3.156 -1.345 0.104 481 HB VAL 55 HB VAL 55 5.827 -1.823 -1.261 482 HG11 VAL 55 1HG1 VAL 55 4.683 -1.115 -3.312 483 HG12 VAL 55 2HG1 VAL 55 3.165 -0.979 -2.424 484 HG13 VAL 55 3HG1 VAL 55 3.934 -2.555 -2.621 485 HG21 VAL 55 3HG2 VAL 55 4.301 0.767 -0.915 486 HG22 VAL 55 1HG2 VAL 55 5.799 0.557 -1.822 487 HG23 VAL 55 2HG2 VAL 55 5.786 0.328 -0.073 488 H VAL 56 H VAL 56 1.896 -3.102 -0.240 489 HA VAL 56 HA VAL 56 3.163 -5.769 -0.282 490 HB VAL 56 HB VAL 56 0.249 -5.105 0.228 491 HG11 VAL 56 1HG1 VAL 56 0.099 -7.428 1.011 492 HG12 VAL 56 2HG1 VAL 56 1.786 -7.689 0.567 493 HG13 VAL 56 3HG1 VAL 56 0.588 -7.347 -0.682 494 HG21 VAL 56 3HG2 VAL 56 0.720 -5.592 2.585 495 HG22 VAL 56 1HG2 VAL 56 1.677 -4.222 2.015 496 HG23 VAL 56 2HG2 VAL 56 2.429 -5.807 2.205 497 H VAL 57 H VAL 57 3.189 -6.913 -2.120 498 HA VAL 57 HA VAL 57 1.718 -5.917 -4.449 499 HB VAL 57 HB VAL 57 3.802 -8.113 -4.337 500 HG11 VAL 57 1HG1 VAL 57 3.995 -7.734 -6.751 501 HG12 VAL 57 2HG1 VAL 57 2.717 -6.521 -6.668 502 HG13 VAL 57 3HG1 VAL 57 2.355 -8.212 -6.311 503 HG21 VAL 57 3HG2 VAL 57 4.752 -5.995 -3.561 504 HG22 VAL 57 1HG2 VAL 57 4.153 -5.183 -5.008 505 HG23 VAL 57 2HG2 VAL 57 5.395 -6.429 -5.145 506 H VAL 58 H VAL 58 -0.135 -6.820 -5.078 507 HA VAL 58 HA VAL 58 -0.752 -9.597 -4.311 508 HB VAL 58 HB VAL 58 -3.020 -8.959 -3.662 509 HG11 VAL 58 1HG1 VAL 58 -2.491 -7.737 -1.579 510 HG12 VAL 58 2HG1 VAL 58 -0.890 -7.371 -2.217 511 HG13 VAL 58 3HG1 VAL 58 -1.353 -9.044 -1.902 512 HG21 VAL 58 3HG2 VAL 58 -3.296 -7.001 -5.100 513 HG22 VAL 58 1HG2 VAL 58 -2.120 -6.107 -4.134 514 HG23 VAL 58 2HG2 VAL 58 -3.659 -6.599 -3.421 515 H ASP 59 H ASP 59 -2.862 -10.337 -5.434 516 HA ASP 59 HA ASP 59 -3.053 -9.180 -8.148 517 HB2 ASP 59 2HB ASP 59 -3.492 -11.476 -8.998 518 HB3 ASP 59 3HB ASP 59 -1.887 -11.294 -8.299 519 H ASP 60 H ASP 60 -4.853 -11.068 -5.693 520 HA ASP 60 HA ASP 60 -7.331 -9.829 -6.703 521 HB2 ASP 60 2HB ASP 60 -7.138 -12.161 -7.525 522 HB3 ASP 60 3HB ASP 60 -7.057 -12.726 -5.860 523 H LYS 61 H LYS 61 -9.161 -9.977 -5.154 524 HA LYS 61 HA LYS 61 -8.632 -8.596 -2.846 525 HB2 LYS 61 2HB LYS 61 -10.967 -9.207 -2.150 526 HB3 LYS 61 3HB LYS 61 -10.818 -8.553 -3.776 527 HG2 LYS 61 2HG LYS 61 -10.935 -10.823 -4.699 528 HG3 LYS 61 3HG LYS 61 -11.097 -11.474 -3.068 529 HD2 LYS 61 2HD LYS 61 -13.268 -11.323 -4.185 530 HD3 LYS 61 3HD LYS 61 -13.201 -10.259 -2.780 531 HE2 LYS 61 2HE LYS 61 -12.832 -8.335 -4.214 532 HE3 LYS 61 3HE LYS 61 -12.761 -9.377 -5.637 533 HZ1 LYS 61 3HZ LYS 61 -15.139 -9.145 -3.880 534 HZ2 LYS 61 1HZ LYS 61 -15.043 -9.935 -5.373 535 HZ3 LYS 61 2HZ LYS 61 -14.932 -8.249 -5.298 536 H GLU 62 H GLU 62 -9.173 -12.152 -3.014 537 HA GLU 62 HA GLU 62 -9.165 -12.634 -0.263 538 HB2 GLU 62 2HB GLU 62 -8.622 -14.288 -2.668 539 HB3 GLU 62 3HB GLU 62 -8.052 -14.931 -1.136 540 HG2 GLU 62 2HG GLU 62 -10.265 -15.782 -1.724 541 HG3 GLU 62 3HG GLU 62 -10.297 -14.856 -0.225 542 H TRP 63 H TRP 63 -6.335 -13.014 -2.450 543 HA TRP 63 HA TRP 63 -4.422 -13.302 -0.419 544 HB2 TRP 63 2HB TRP 63 -3.758 -13.894 -2.620 545 HB3 TRP 63 3HB TRP 63 -4.219 -12.328 -3.272 546 HD1 TRP 63 HD1 TRP 63 -2.033 -11.318 -4.144 547 HE1 TRP 63 HE1 TRP 63 0.301 -10.841 -3.171 548 HE3 TRP 63 HE3 TRP 63 -2.517 -13.707 0.357 549 HZ2 TRP 63 HZ2 TRP 63 1.743 -11.404 -0.827 550 HZ3 TRP 63 HZ3 TRP 63 -0.607 -13.687 1.905 551 HH2 TRP 63 HH2 TRP 63 1.483 -12.557 1.326 552 H ALA 64 H ALA 64 -5.643 -10.366 -1.996 553 HA ALA 64 HA ALA 64 -3.906 -8.514 -0.810 554 HB1 ALA 64 3HB ALA 64 -6.762 -8.106 -1.696 555 HB2 ALA 64 1HB ALA 64 -5.331 -7.988 -2.722 556 HB3 ALA 64 2HB ALA 64 -5.574 -6.833 -1.412 557 H GLU 65 H GLU 65 -6.888 -9.960 0.399 558 HA GLU 65 HA GLU 65 -7.257 -8.298 2.648 559 HB2 GLU 65 2HB GLU 65 -9.028 -9.785 1.878 560 HB3 GLU 65 3HB GLU 65 -8.036 -11.195 2.235 561 HG2 GLU 65 2HG GLU 65 -8.062 -10.533 4.637 562 HG3 GLU 65 3HG GLU 65 -9.182 -9.236 4.222 563 H LYS 66 H LYS 66 -5.218 -11.122 2.126 564 HA LYS 66 HA LYS 66 -4.626 -11.811 4.764 565 HB2 LYS 66 2HB LYS 66 -2.797 -11.942 2.356 566 HB3 LYS 66 3HB LYS 66 -2.550 -12.802 3.869 567 HG2 LYS 66 2HG LYS 66 -4.885 -13.198 1.999 568 HG3 LYS 66 3HG LYS 66 -3.469 -14.245 2.115 569 HD2 LYS 66 2HD LYS 66 -4.038 -14.716 4.471 570 HD3 LYS 66 3HD LYS 66 -5.480 -13.711 4.312 571 HE2 LYS 66 2HE LYS 66 -6.337 -15.208 2.577 572 HE3 LYS 66 3HE LYS 66 -4.886 -16.201 2.703 573 HZ1 LYS 66 3HZ LYS 66 -5.487 -16.681 5.008 574 HZ2 LYS 66 1HZ LYS 66 -6.692 -17.182 3.932 575 HZ3 LYS 66 2HZ LYS 66 -6.902 -15.771 4.842 576 H ALA 67 H ALA 67 -3.348 -9.194 2.791 577 HA ALA 67 HA ALA 67 -1.220 -8.425 4.500 578 HB1 ALA 67 3HB ALA 67 -1.293 -6.287 3.298 579 HB2 ALA 67 1HB ALA 67 -2.838 -6.745 2.580 580 HB3 ALA 67 2HB ALA 67 -1.379 -7.657 2.191 581 H ILE 68 H ILE 68 -4.458 -6.955 4.109 582 HA ILE 68 HA ILE 68 -4.317 -5.266 6.360 583 HB ILE 68 HB ILE 68 -6.823 -6.445 5.131 584 HG12 ILE 68 2HG1 ILE 68 -5.454 -5.410 3.390 585 HG13 ILE 68 3HG1 ILE 68 -6.863 -4.408 3.716 586 HG21 ILE 68 1HG2 ILE 68 -6.405 -3.906 6.717 587 HG22 ILE 68 2HG2 ILE 68 -7.232 -5.362 7.274 588 HG23 ILE 68 3HG2 ILE 68 -7.917 -4.407 5.959 589 HD11 ILE 68 3HD1 ILE 68 -5.472 -2.908 5.067 590 HD12 ILE 68 1HD1 ILE 68 -4.882 -3.049 3.412 591 HD13 ILE 68 2HD1 ILE 68 -4.063 -3.910 4.714 592 H ARG 69 H ARG 69 -5.073 -8.632 6.042 593 HA ARG 69 HA ARG 69 -6.460 -9.117 8.440 594 HB2 ARG 69 2HB ARG 69 -6.124 -10.682 6.444 595 HB3 ARG 69 3HB ARG 69 -4.531 -11.027 7.095 596 HG2 ARG 69 2HG ARG 69 -5.928 -12.789 7.798 597 HG3 ARG 69 3HG ARG 69 -5.681 -11.768 9.218 598 HD2 ARG 69 2HD ARG 69 -7.854 -10.710 8.841 599 HD3 ARG 69 3HD ARG 69 -8.096 -11.698 7.400 600 HE ARG 69 HE ARG 69 -7.840 -12.877 10.092 601 HH11 ARG 69 1HH1 ARG 69 -9.443 -12.652 7.048 602 HH12 ARG 69 2HH1 ARG 69 -10.580 -13.895 7.435 603 HH21 ARG 69 1HH2 ARG 69 -9.312 -14.470 10.563 604 HH22 ARG 69 2HH2 ARG 69 -10.515 -14.896 9.394 605 H PHE 70 H PHE 70 -3.024 -8.809 7.736 606 HA PHE 70 HA PHE 70 -2.239 -9.418 10.469 607 HB2 PHE 70 2HB PHE 70 -0.780 -10.028 8.563 608 HB3 PHE 70 3HB PHE 70 -0.594 -8.325 8.168 609 HD1 PHE 70 HD1 PHE 70 0.178 -10.922 10.683 610 HD2 PHE 70 HD2 PHE 70 0.966 -6.953 9.340 611 HE1 PHE 70 HE1 PHE 70 2.109 -10.793 12.200 612 HE2 PHE 70 HE2 PHE 70 2.897 -6.825 10.859 613 HZ PHE 70 HZ PHE 70 3.472 -8.745 12.289 614 H VAL 71 H VAL 71 -2.322 -6.553 8.349 615 HA VAL 71 HA VAL 71 -1.283 -4.638 10.065 616 HB VAL 71 HB VAL 71 -3.475 -4.256 8.007 617 HG11 VAL 71 1HG1 VAL 71 -2.754 -1.911 7.928 618 HG12 VAL 71 2HG1 VAL 71 -1.612 -2.215 9.238 619 HG13 VAL 71 3HG1 VAL 71 -3.346 -2.348 9.532 620 HG21 VAL 71 3HG2 VAL 71 -1.623 -3.589 6.507 621 HG22 VAL 71 1HG2 VAL 71 -1.491 -5.269 7.033 622 HG23 VAL 71 2HG2 VAL 71 -0.467 -4.034 7.763 623 H LYS 72 H LYS 72 -4.532 -5.986 10.022 624 HA LYS 72 HA LYS 72 -5.917 -4.121 11.548 625 HB2 LYS 72 2HB LYS 72 -7.483 -5.915 12.053 626 HB3 LYS 72 3HB LYS 72 -6.945 -6.051 10.385 627 HG2 LYS 72 2HG LYS 72 -6.783 -8.233 10.979 628 HG3 LYS 72 3HG LYS 72 -5.174 -7.704 11.469 629 HD2 LYS 72 2HD LYS 72 -6.182 -7.308 13.782 630 HD3 LYS 72 3HD LYS 72 -7.590 -8.200 13.205 631 HE2 LYS 72 2HE LYS 72 -4.751 -9.214 13.392 632 HE3 LYS 72 3HE LYS 72 -6.108 -9.685 14.414 633 HZ1 LYS 72 3HZ LYS 72 -5.874 -10.202 11.499 634 HZ2 LYS 72 1HZ LYS 72 -7.184 -10.647 12.472 635 HZ3 LYS 72 2HZ LYS 72 -5.667 -11.344 12.728 636 H SER 73 H SER 73 -3.406 -6.262 12.561 637 HA SER 73 HA SER 73 -4.160 -6.296 15.364 638 HB2 SER 73 2HB SER 73 -3.082 -8.265 14.387 639 HB3 SER 73 3HB SER 73 -1.653 -7.312 13.993 640 HG SER 73 HG SER 73 -1.244 -7.056 16.182 641 H LEU 74 H LEU 74 -2.486 -4.101 13.394 642 HA LEU 74 HA LEU 74 -0.437 -3.279 15.200 643 HB2 LEU 74 2HB LEU 74 -1.704 -1.782 12.899 644 HB3 LEU 74 3HB LEU 74 -0.239 -1.294 13.733 645 HG LEU 74 HG LEU 74 -0.596 -3.803 12.078 646 HD11 LEU 74 1HD1 LEU 74 -0.446 -1.772 10.732 647 HD12 LEU 74 2HD1 LEU 74 1.005 -2.756 10.557 648 HD13 LEU 74 3HD1 LEU 74 1.036 -1.312 11.569 649 HD21 LEU 74 3HD2 LEU 74 0.905 -4.251 13.927 650 HD22 LEU 74 1HD2 LEU 74 1.823 -2.786 13.577 651 HD23 LEU 74 2HD2 LEU 74 1.826 -4.125 12.429 652 H GLY 75 H GLY 75 -3.747 -2.146 14.632 653 HA2 GLY 75 2HA GLY 75 -5.146 -0.898 15.975 654 HA3 GLY 75 3HA GLY 75 -3.966 -1.072 17.261 655 H ALA 76 H ALA 76 -3.649 0.504 14.081 656 HA ALA 76 HA ALA 76 -3.579 3.140 15.352 657 HB1 ALA 76 3HB ALA 76 -1.468 3.762 14.361 658 HB2 ALA 76 1HB ALA 76 -1.317 2.176 13.601 659 HB3 ALA 76 2HB ALA 76 -1.244 2.325 15.357 660 H GLN 77 H GLN 77 -3.732 4.914 13.839 661 HA GLN 77 HA GLN 77 -5.433 4.283 11.585 662 HB2 GLN 77 2HB GLN 77 -4.418 6.966 12.566 663 HB3 GLN 77 3HB GLN 77 -5.704 6.716 11.392 664 HG2 GLN 77 2HG GLN 77 -7.070 5.638 13.101 665 HG3 GLN 77 3HG GLN 77 -5.777 5.844 14.280 666 HE21 GLN 77 1HE2 GLN 77 -8.518 6.867 14.312 667 HE22 GLN 77 2HE2 GLN 77 -8.374 8.583 14.458 668 H VAL 78 H VAL 78 -4.499 3.622 9.726 669 HA VAL 78 HA VAL 78 -2.077 5.036 8.788 670 HB VAL 78 HB VAL 78 -1.402 3.013 7.594 671 HG11 VAL 78 1HG1 VAL 78 -0.850 1.586 9.530 672 HG12 VAL 78 2HG1 VAL 78 -1.992 2.502 10.515 673 HG13 VAL 78 3HG1 VAL 78 -0.562 3.294 9.854 674 HG21 VAL 78 3HG2 VAL 78 -3.585 2.051 7.119 675 HG22 VAL 78 1HG2 VAL 78 -3.844 1.731 8.834 676 HG23 VAL 78 2HG2 VAL 78 -2.576 0.874 7.959 677 H LEU 79 H LEU 79 -1.902 5.576 6.602 678 HA LEU 79 HA LEU 79 -4.411 5.752 5.116 679 HB2 LEU 79 2HB LEU 79 -1.659 6.888 4.573 680 HB3 LEU 79 3HB LEU 79 -3.022 7.086 3.490 681 HG LEU 79 HG LEU 79 -2.769 9.098 4.758 682 HD11 LEU 79 1HD1 LEU 79 -5.110 7.552 5.865 683 HD12 LEU 79 2HD1 LEU 79 -5.066 8.389 4.313 684 HD13 LEU 79 3HD1 LEU 79 -4.943 9.308 5.811 685 HD21 LEU 79 3HD2 LEU 79 -2.962 7.420 7.262 686 HD22 LEU 79 1HD2 LEU 79 -2.867 9.181 7.192 687 HD23 LEU 79 2HD2 LEU 79 -1.503 8.204 6.650 688 H ILE 80 H ILE 80 -4.962 4.212 3.701 689 HA ILE 80 HA ILE 80 -2.859 2.430 2.662 690 HB ILE 80 HB ILE 80 -5.848 1.987 2.828 691 HG12 ILE 80 2HG1 ILE 80 -3.561 0.807 4.439 692 HG13 ILE 80 3HG1 ILE 80 -4.719 1.997 5.023 693 HG21 ILE 80 1HG2 ILE 80 -4.876 0.802 0.919 694 HG22 ILE 80 2HG2 ILE 80 -5.356 -0.331 2.181 695 HG23 ILE 80 3HG2 ILE 80 -3.655 0.084 1.973 696 HD11 ILE 80 3HD1 ILE 80 -5.244 -0.225 5.833 697 HD12 ILE 80 1HD1 ILE 80 -5.360 -0.820 4.177 698 HD13 ILE 80 2HD1 ILE 80 -6.517 0.372 4.770 699 H ILE 81 H ILE 81 -2.166 2.890 0.676 700 HA ILE 81 HA ILE 81 -4.010 4.094 -1.284 701 HB ILE 81 HB ILE 81 -0.996 3.825 -1.422 702 HG12 ILE 81 2HG1 ILE 81 -2.725 6.231 -0.772 703 HG13 ILE 81 3HG1 ILE 81 -1.673 5.377 0.353 704 HG21 ILE 81 1HG2 ILE 81 -2.922 5.326 -3.201 705 HG22 ILE 81 2HG2 ILE 81 -2.003 3.883 -3.632 706 HG23 ILE 81 3HG2 ILE 81 -1.163 5.398 -3.309 707 HD11 ILE 81 3HD1 ILE 81 0.275 6.049 -0.993 708 HD12 ILE 81 1HD1 ILE 81 -0.634 7.431 -0.379 709 HD13 ILE 81 2HD1 ILE 81 -0.799 6.948 -2.066 710 H ILE 82 H ILE 82 -4.963 2.719 -2.675 711 HA ILE 82 HA ILE 82 -3.621 0.163 -3.288 712 HB ILE 82 HB ILE 82 -6.551 0.872 -3.572 713 HG12 ILE 82 2HG1 ILE 82 -5.134 -0.838 -1.503 714 HG13 ILE 82 3HG1 ILE 82 -5.830 0.752 -1.213 715 HG21 ILE 82 1HG2 ILE 82 -5.839 -0.824 -5.183 716 HG22 ILE 82 2HG2 ILE 82 -6.881 -1.530 -3.949 717 HG23 ILE 82 3HG2 ILE 82 -5.137 -1.783 -3.879 718 HD11 ILE 82 3HD1 ILE 82 -7.265 -1.011 -0.377 719 HD12 ILE 82 1HD1 ILE 82 -7.351 -1.725 -1.986 720 HD13 ILE 82 2HD1 ILE 82 -8.052 -0.134 -1.690 721 H TYR 83 H TYR 83 -3.057 -0.353 -5.339 722 HA TYR 83 HA TYR 83 -3.747 1.564 -7.481 723 HB2 TYR 83 2HB TYR 83 -1.405 1.751 -6.898 724 HB3 TYR 83 3HB TYR 83 -1.185 0.011 -7.048 725 HD1 TYR 83 HD2 TYR 83 -2.103 3.037 -9.038 726 HD2 TYR 83 HD1 TYR 83 -0.496 -0.908 -9.105 727 HE1 TYR 83 HE2 TYR 83 -1.481 3.337 -11.393 728 HE2 TYR 83 HE1 TYR 83 0.126 -0.614 -11.467 729 HH TYR 83 HH TYR 83 -0.502 0.761 -13.395 730 H ASP 84 H ASP 84 -5.009 0.738 -8.999 731 HA ASP 84 HA ASP 84 -4.249 -1.680 -10.370 732 HB2 ASP 84 2HB ASP 84 -5.747 -2.450 -8.444 733 HB3 ASP 84 3HB ASP 84 -7.059 -1.585 -9.235 734 H GLN 85 H GLN 85 -4.749 -1.500 -12.515 735 HA GLN 85 HA GLN 85 -5.874 0.944 -13.485 736 HB2 GLN 85 2HB GLN 85 -5.062 -1.587 -14.931 737 HB3 GLN 85 3HB GLN 85 -5.621 -0.134 -15.750 738 HG2 GLN 85 2HG GLN 85 -3.736 1.111 -14.707 739 HG3 GLN 85 3HG GLN 85 -3.146 -0.417 -14.050 740 HE21 GLN 85 1HE2 GLN 85 -2.271 -1.942 -15.459 741 HE22 GLN 85 2HE2 GLN 85 -1.805 -1.547 -17.070 742 H ASP 86 H ASP 86 -7.154 -2.268 -12.933 743 HA ASP 86 HA ASP 86 -9.614 -1.754 -14.367 744 HB2 ASP 86 2HB ASP 86 -8.870 -3.981 -12.449 745 HB3 ASP 86 3HB ASP 86 -10.366 -3.909 -13.378 746 H GLN 87 H GLN 87 -10.475 0.088 -13.477 747 HA GLN 87 HA GLN 87 -10.462 0.795 -10.772 748 HB2 GLN 87 2HB GLN 87 -12.343 1.727 -12.954 749 HB3 GLN 87 3HB GLN 87 -12.070 2.545 -11.419 750 HG2 GLN 87 2HG GLN 87 -9.740 2.929 -12.012 751 HG3 GLN 87 3HG GLN 87 -9.967 2.057 -13.525 752 HE21 GLN 87 1HE2 GLN 87 -9.381 3.816 -14.773 753 HE22 GLN 87 2HE2 GLN 87 -10.381 5.209 -14.953 754 H ASN 88 H ASN 88 -12.722 -1.227 -12.507 755 HA ASN 88 HA ASN 88 -14.934 -1.099 -10.778 756 HB2 ASN 88 2HB ASN 88 -15.006 -2.178 -12.992 757 HB3 ASN 88 3HB ASN 88 -13.946 -3.457 -12.411 758 HD21 ASN 88 1HD2 ASN 88 -15.455 -5.067 -12.825 759 HD22 ASN 88 2HD2 ASN 88 -16.893 -5.255 -11.884 760 H ARG 89 H ARG 89 -12.401 -3.644 -10.836 761 HA ARG 89 HA ARG 89 -13.181 -4.769 -8.340 762 HB2 ARG 89 2HB ARG 89 -11.223 -6.162 -8.531 763 HB3 ARG 89 3HB ARG 89 -11.948 -6.004 -10.126 764 HG2 ARG 89 2HG ARG 89 -10.247 -4.143 -10.531 765 HG3 ARG 89 3HG ARG 89 -9.435 -4.731 -9.081 766 HD2 ARG 89 2HD ARG 89 -9.958 -6.242 -11.640 767 HD3 ARG 89 3HD ARG 89 -8.398 -5.735 -10.997 768 HE ARG 89 HE ARG 89 -10.069 -7.929 -9.983 769 HH11 ARG 89 1HH1 ARG 89 -7.108 -6.164 -9.839 770 HH12 ARG 89 2HH1 ARG 89 -6.245 -7.481 -9.116 771 HH21 ARG 89 1HH2 ARG 89 -8.944 -9.600 -9.049 772 HH22 ARG 89 2HH2 ARG 89 -7.267 -9.387 -8.663 773 H LEU 90 H LEU 90 -10.751 -2.390 -9.273 774 HA LEU 90 HA LEU 90 -9.345 -2.032 -6.909 775 HB2 LEU 90 2HB LEU 90 -8.720 -0.906 -8.953 776 HB3 LEU 90 3HB LEU 90 -10.236 -0.027 -8.984 777 HG LEU 90 HG LEU 90 -9.495 1.092 -6.824 778 HD11 LEU 90 1HD1 LEU 90 -7.091 1.130 -6.368 779 HD12 LEU 90 2HD1 LEU 90 -6.835 -0.093 -7.615 780 HD13 LEU 90 3HD1 LEU 90 -7.768 -0.486 -6.170 781 HD21 LEU 90 3HD2 LEU 90 -8.047 2.702 -7.999 782 HD22 LEU 90 1HD2 LEU 90 -9.474 2.267 -8.939 783 HD23 LEU 90 2HD2 LEU 90 -7.903 1.571 -9.346 784 H GLU 91 H GLU 91 -12.267 -0.292 -7.955 785 HA GLU 91 HA GLU 91 -12.571 1.280 -5.651 786 HB2 GLU 91 2HB GLU 91 -13.623 1.522 -7.996 787 HB3 GLU 91 3HB GLU 91 -14.856 0.410 -7.425 788 HG2 GLU 91 2HG GLU 91 -14.249 2.880 -5.856 789 HG3 GLU 91 3HG GLU 91 -15.215 2.995 -7.322 790 H GLU 92 H GLU 92 -14.040 -1.855 -6.527 791 HA GLU 92 HA GLU 92 -15.726 -2.050 -4.271 792 HB2 GLU 92 2HB GLU 92 -16.009 -3.437 -6.296 793 HB3 GLU 92 3HB GLU 92 -14.538 -4.315 -5.890 794 HG2 GLU 92 2HG GLU 92 -15.555 -5.134 -3.842 795 HG3 GLU 92 3HG GLU 92 -17.015 -4.204 -4.169 796 H PHE 93 H PHE 93 -12.406 -3.327 -4.785 797 HA PHE 93 HA PHE 93 -12.234 -4.572 -2.245 798 HB2 PHE 93 2HB PHE 93 -10.655 -5.128 -4.040 799 HB3 PHE 93 3HB PHE 93 -9.977 -3.501 -3.963 800 HD1 PHE 93 HD1 PHE 93 -10.686 -6.391 -1.694 801 HD2 PHE 93 HD2 PHE 93 -8.049 -3.207 -2.720 802 HE1 PHE 93 HE1 PHE 93 -9.124 -7.123 0.060 803 HE2 PHE 93 HE2 PHE 93 -6.482 -3.937 -0.972 804 HZ PHE 93 HZ PHE 93 -7.019 -5.896 0.424 805 H SER 94 H SER 94 -11.453 -1.295 -3.329 806 HA SER 94 HA SER 94 -10.361 -0.333 -0.908 807 HB2 SER 94 2HB SER 94 -11.907 1.159 -3.048 808 HB3 SER 94 3HB SER 94 -10.957 1.921 -1.771 809 HG SER 94 HG SER 94 -10.077 0.382 -3.967 810 H ARG 95 H ARG 95 -13.690 -0.647 -2.030 811 HA ARG 95 HA ARG 95 -15.004 0.574 0.140 812 HB2 ARG 95 2HB ARG 95 -16.171 0.015 -1.889 813 HB3 ARG 95 3HB ARG 95 -15.857 -1.698 -1.644 814 HG2 ARG 95 2HG ARG 95 -17.349 -1.812 0.187 815 HG3 ARG 95 3HG ARG 95 -17.462 -0.052 0.297 816 HD2 ARG 95 2HD ARG 95 -18.658 0.084 -1.742 817 HD3 ARG 95 3HD ARG 95 -18.318 -1.599 -2.125 818 HE ARG 95 HE ARG 95 -19.730 -1.632 0.242 819 HH11 ARG 95 1HH1 ARG 95 -20.276 -0.453 -2.947 820 HH12 ARG 95 2HH1 ARG 95 -21.973 -0.785 -2.901 821 HH21 ARG 95 1HH2 ARG 95 -21.897 -2.071 0.298 822 HH22 ARG 95 2HH2 ARG 95 -22.889 -1.688 -1.066 823 H GLU 96 H GLU 96 -13.943 -2.783 -0.354 824 HA GLU 96 HA GLU 96 -14.833 -3.913 2.044 825 HB2 GLU 96 2HB GLU 96 -12.299 -4.546 0.505 826 HB3 GLU 96 3HB GLU 96 -13.037 -5.584 1.716 827 HG2 GLU 96 2HG GLU 96 -14.517 -4.730 -0.757 828 HG3 GLU 96 3HG GLU 96 -13.449 -6.133 -0.741 829 H VAL 97 H VAL 97 -11.695 -2.379 1.331 830 HA VAL 97 HA VAL 97 -10.520 -2.628 3.859 831 HB VAL 97 HB VAL 97 -10.125 -0.423 1.819 832 HG11 VAL 97 1HG1 VAL 97 -7.928 -0.095 2.887 833 HG12 VAL 97 2HG1 VAL 97 -8.372 -1.262 4.134 834 HG13 VAL 97 3HG1 VAL 97 -9.259 0.255 3.990 835 HG21 VAL 97 3HG2 VAL 97 -9.716 -2.674 0.924 836 HG22 VAL 97 1HG2 VAL 97 -8.587 -2.992 2.242 837 HG23 VAL 97 2HG2 VAL 97 -8.221 -1.746 1.049 838 H ARG 98 H ARG 98 -12.412 0.094 2.530 839 HA ARG 98 HA ARG 98 -12.413 1.665 4.882 840 HB2 ARG 98 2HB ARG 98 -13.584 1.789 2.252 841 HB3 ARG 98 3HB ARG 98 -14.812 2.185 3.442 842 HG2 ARG 98 2HG ARG 98 -12.111 3.519 3.294 843 HG3 ARG 98 3HG ARG 98 -13.576 4.144 2.535 844 HD2 ARG 98 2HD ARG 98 -14.658 4.322 4.711 845 HD3 ARG 98 3HD ARG 98 -13.236 3.628 5.496 846 HE ARG 98 HE ARG 98 -12.121 5.712 4.367 847 HH11 ARG 98 1HH1 ARG 98 -15.192 5.578 5.930 848 HH12 ARG 98 2HH1 ARG 98 -15.119 7.225 6.442 849 HH21 ARG 98 1HH2 ARG 98 -12.037 7.818 5.048 850 HH22 ARG 98 2HH2 ARG 98 -13.356 8.472 5.956 851 H ARG 99 H ARG 99 -14.474 -0.966 3.803 852 HA ARG 99 HA ARG 99 -16.531 -0.662 5.727 853 HB2 ARG 99 2HB ARG 99 -16.643 -2.071 3.636 854 HB3 ARG 99 3HB ARG 99 -15.614 -3.248 4.443 855 HG2 ARG 99 2HG ARG 99 -17.994 -3.859 4.522 856 HG3 ARG 99 3HG ARG 99 -17.311 -3.627 6.133 857 HD2 ARG 99 2HD ARG 99 -18.300 -1.420 6.277 858 HD3 ARG 99 3HD ARG 99 -18.888 -1.542 4.620 859 HE ARG 99 HE ARG 99 -20.135 -3.598 5.670 860 HH11 ARG 99 1HH1 ARG 99 -19.630 -0.499 7.083 861 HH12 ARG 99 2HH1 ARG 99 -21.107 -0.547 7.977 862 HH21 ARG 99 1HH2 ARG 99 -22.043 -3.631 6.780 863 HH22 ARG 99 2HH2 ARG 99 -22.486 -2.276 7.766 864 H ARG 100 H ARG 100 -13.352 -2.090 5.838 865 HA ARG 100 HA ARG 100 -13.721 -3.317 8.429 866 HB2 ARG 100 2HB ARG 100 -11.241 -2.770 6.782 867 HB3 ARG 100 3HB ARG 100 -11.225 -3.612 8.328 868 HG2 ARG 100 2HG ARG 100 -12.730 -5.330 7.366 869 HG3 ARG 100 3HG ARG 100 -12.619 -4.509 5.806 870 HD2 ARG 100 2HD ARG 100 -10.323 -5.009 5.588 871 HD3 ARG 100 3HD ARG 100 -10.168 -5.442 7.289 872 HE ARG 100 HE ARG 100 -11.449 -7.078 5.209 873 HH11 ARG 100 1HH1 ARG 100 -10.104 -6.750 8.369 874 HH12 ARG 100 2HH1 ARG 100 -10.177 -8.449 8.684 875 HH21 ARG 100 1HH2 ARG 100 -11.488 -9.279 5.636 876 HH22 ARG 100 2HH2 ARG 100 -10.938 -9.842 7.178 877 H GLY 101 H GLY 101 -13.628 -0.162 7.580 878 HA2 GLY 101 2HA GLY 101 -13.727 1.593 9.143 879 HA3 GLY 101 3HA GLY 101 -12.817 0.616 10.280 880 H PHE 102 H PHE 102 -11.228 0.437 7.360 881 HA PHE 102 HA PHE 102 -9.187 2.280 8.319 882 HB2 PHE 102 2HB PHE 102 -9.240 0.057 6.321 883 HB3 PHE 102 3HB PHE 102 -7.984 1.283 6.183 884 HD1 PHE 102 HD1 PHE 102 -6.532 1.747 8.209 885 HD2 PHE 102 HD2 PHE 102 -9.024 -1.699 7.865 886 HE1 PHE 102 HE1 PHE 102 -5.191 0.599 9.934 887 HE2 PHE 102 HE2 PHE 102 -7.690 -2.843 9.588 888 HZ PHE 102 HZ PHE 102 -5.771 -1.696 10.623 889 H GLU 103 H GLU 103 -7.996 3.635 6.796 890 HA GLU 103 HA GLU 103 -9.829 5.145 5.057 891 HB2 GLU 103 2HB GLU 103 -8.777 6.406 6.870 892 HB3 GLU 103 3HB GLU 103 -7.183 5.890 6.340 893 HG2 GLU 103 2HG GLU 103 -7.570 8.163 5.679 894 HG3 GLU 103 3HG GLU 103 -7.485 7.133 4.253 895 H VAL 104 H VAL 104 -9.590 4.997 2.886 896 HA VAL 104 HA VAL 104 -7.032 3.995 1.807 897 HB VAL 104 HB VAL 104 -8.561 2.118 1.926 898 HG11 VAL 104 1HG1 VAL 104 -10.665 2.091 0.631 899 HG12 VAL 104 2HG1 VAL 104 -10.452 3.807 0.283 900 HG13 VAL 104 3HG1 VAL 104 -10.687 3.265 1.946 901 HG21 VAL 104 3HG2 VAL 104 -8.220 3.089 -0.917 902 HG22 VAL 104 1HG2 VAL 104 -8.567 1.428 -0.433 903 HG23 VAL 104 2HG2 VAL 104 -7.040 2.181 0.026 904 H ARG 105 H ARG 105 -6.388 4.713 -0.192 905 HA ARG 105 HA ARG 105 -8.156 6.574 -1.655 906 HB2 ARG 105 2HB ARG 105 -5.690 7.216 -0.442 907 HB3 ARG 105 3HB ARG 105 -5.332 7.088 -2.155 908 HG2 ARG 105 2HG ARG 105 -7.506 8.818 -0.977 909 HG3 ARG 105 3HG ARG 105 -5.897 9.384 -1.419 910 HD2 ARG 105 2HD ARG 105 -7.812 8.091 -3.364 911 HD3 ARG 105 3HD ARG 105 -7.700 9.830 -3.114 912 HE ARG 105 HE ARG 105 -5.138 8.844 -3.698 913 HH11 ARG 105 1HH1 ARG 105 -8.184 9.337 -5.234 914 HH12 ARG 105 2HH1 ARG 105 -7.493 9.546 -6.802 915 HH21 ARG 105 1HH2 ARG 105 -4.253 9.131 -5.734 916 HH22 ARG 105 2HH2 ARG 105 -5.285 9.439 -7.084 917 H THR 106 H THR 106 -8.345 6.209 -3.822 918 HA THR 106 HA THR 106 -7.104 3.755 -4.857 919 HB THR 106 HB THR 106 -8.822 3.875 -6.651 920 HG1 THR 106 HG1 THR 106 -10.482 5.444 -6.477 921 HG21 THR 106 3HG2 THR 106 -9.945 4.067 -3.850 922 HG22 THR 106 1HG2 THR 106 -9.293 2.613 -4.607 923 HG23 THR 106 2HG2 THR 106 -10.763 3.354 -5.241 924 H VAL 107 H VAL 107 -5.411 3.885 -6.201 925 HA VAL 107 HA VAL 107 -5.128 6.294 -7.893 926 HB VAL 107 HB VAL 107 -2.686 5.967 -7.846 927 HG11 VAL 107 1HG1 VAL 107 -3.906 6.184 -5.091 928 HG12 VAL 107 2HG1 VAL 107 -3.766 7.497 -6.260 929 HG13 VAL 107 3HG1 VAL 107 -2.313 6.768 -5.575 930 HG21 VAL 107 3HG2 VAL 107 -3.258 3.819 -5.795 931 HG22 VAL 107 1HG2 VAL 107 -1.664 4.442 -6.218 932 HG23 VAL 107 2HG2 VAL 107 -2.613 3.560 -7.413 933 H THR 108 H THR 108 -4.423 6.039 -10.031 934 HA THR 108 HA THR 108 -4.542 3.288 -11.114 935 HB THR 108 HB THR 108 -5.831 4.213 -13.068 936 HG1 THR 108 HG1 THR 108 -5.953 6.487 -11.337 937 HG21 THR 108 3HG2 THR 108 -6.940 2.957 -11.259 938 HG22 THR 108 1HG2 THR 108 -7.990 4.211 -11.925 939 HG23 THR 108 2HG2 THR 108 -7.188 4.465 -10.377 940 H SER 109 H SER 109 -2.906 6.266 -11.099 941 HA SER 109 HA SER 109 -1.164 5.367 -13.286 942 HB2 SER 109 2HB SER 109 -2.309 8.181 -13.125 943 HB3 SER 109 3HB SER 109 -1.088 7.637 -14.275 944 HG SER 109 HG SER 109 -2.570 6.428 -15.318 945 HA PRO 110 HA PRO 110 2.238 6.437 -10.669 946 HB2 PRO 110 2HB PRO 110 3.800 7.979 -12.425 947 HB3 PRO 110 3HB PRO 110 3.865 6.226 -12.236 948 HG2 PRO 110 2HG PRO 110 2.428 7.859 -14.281 949 HG3 PRO 110 3HG PRO 110 3.254 6.299 -14.463 950 HD2 PRO 110 2HD PRO 110 0.581 6.441 -14.366 951 HD3 PRO 110 3HD PRO 110 1.452 5.105 -13.582 952 H ASP 111 H ASP 111 1.208 9.234 -12.667 953 HA ASP 111 HA ASP 111 2.019 11.196 -10.768 954 HB2 ASP 111 2HB ASP 111 0.566 12.735 -12.131 955 HB3 ASP 111 3HB ASP 111 1.771 11.850 -13.064 956 H ASP 112 H ASP 112 -1.193 9.835 -11.539 957 HA ASP 112 HA ASP 112 -2.736 11.071 -9.596 958 HB2 ASP 112 2HB ASP 112 -3.689 9.700 -11.361 959 HB3 ASP 112 3HB ASP 112 -2.909 8.262 -10.720 960 H PHE 113 H PHE 113 -0.494 8.393 -9.268 961 HA PHE 113 HA PHE 113 -1.110 7.819 -6.528 962 HB2 PHE 113 2HB PHE 113 -0.106 6.071 -7.820 963 HB3 PHE 113 3HB PHE 113 1.227 7.109 -8.313 964 HD1 PHE 113 HD1 PHE 113 -0.278 5.396 -5.377 965 HD2 PHE 113 HD2 PHE 113 3.200 7.213 -7.040 966 HE1 PHE 113 HE1 PHE 113 1.062 4.568 -3.487 967 HE2 PHE 113 HE2 PHE 113 4.540 6.388 -5.151 968 HZ PHE 113 HZ PHE 113 3.471 5.064 -3.374 969 H LYS 114 H LYS 114 1.590 9.528 -8.126 970 HA LYS 114 HA LYS 114 3.028 10.170 -5.823 971 HB2 LYS 114 2HB LYS 114 3.876 10.335 -8.174 972 HB3 LYS 114 3HB LYS 114 2.931 11.806 -8.366 973 HG2 LYS 114 2HG LYS 114 4.221 12.882 -6.589 974 HG3 LYS 114 3HG LYS 114 5.156 11.401 -6.365 975 HD2 LYS 114 2HD LYS 114 6.486 12.855 -7.699 976 HD3 LYS 114 3HD LYS 114 5.863 11.609 -8.782 977 HE2 LYS 114 2HE LYS 114 5.670 13.728 -9.890 978 HE3 LYS 114 3HE LYS 114 4.047 13.199 -9.448 979 HZ1 LYS 114 3HZ LYS 114 4.143 14.669 -7.524 980 HZ2 LYS 114 1HZ LYS 114 4.368 15.536 -8.960 981 HZ3 LYS 114 2HZ LYS 114 5.692 15.179 -7.966 982 H LYS 115 H LYS 115 0.669 12.194 -7.590 983 HA LYS 115 HA LYS 115 0.809 14.453 -5.934 984 HB2 LYS 115 2HB LYS 115 -1.540 13.401 -7.532 985 HB3 LYS 115 3HB LYS 115 -1.446 15.013 -6.837 986 HG2 LYS 115 2HG LYS 115 0.415 13.888 -8.928 987 HG3 LYS 115 3HG LYS 115 -0.911 15.014 -9.223 988 HD2 LYS 115 2HD LYS 115 1.481 15.572 -7.454 989 HD3 LYS 115 3HD LYS 115 1.296 16.135 -9.116 990 HE2 LYS 115 2HE LYS 115 -0.650 17.439 -8.498 991 HE3 LYS 115 3HE LYS 115 -0.585 16.809 -6.851 992 HZ1 LYS 115 3HZ LYS 115 1.557 18.427 -8.117 993 HZ2 LYS 115 1HZ LYS 115 1.499 17.910 -6.509 994 HZ3 LYS 115 2HZ LYS 115 0.379 19.044 -7.071 995 H SER 116 H SER 116 -1.369 11.651 -5.761 996 HA SER 116 HA SER 116 -2.798 12.409 -3.464 997 HB2 SER 116 2HB SER 116 -3.473 10.536 -4.944 998 HB3 SER 116 3HB SER 116 -2.094 9.599 -4.374 999 HG SER 116 HG SER 116 -3.925 10.634 -2.502 1000 H LEU 117 H LEU 117 0.252 10.675 -3.841 1001 HA LEU 117 HA LEU 117 0.645 9.994 -1.126 1002 HB2 LEU 117 2HB LEU 117 1.819 8.932 -3.021 1003 HB3 LEU 117 3HB LEU 117 2.688 10.426 -3.314 1004 HG LEU 117 HG LEU 117 3.798 10.216 -1.123 1005 HD11 LEU 117 1HD1 LEU 117 2.334 7.584 -0.932 1006 HD12 LEU 117 2HD1 LEU 117 2.083 8.999 0.091 1007 HD13 LEU 117 3HD1 LEU 117 3.615 8.129 0.151 1008 HD21 LEU 117 3HD2 LEU 117 5.241 8.316 -1.688 1009 HD22 LEU 117 1HD2 LEU 117 4.889 9.309 -3.102 1010 HD23 LEU 117 2HD2 LEU 117 4.056 7.770 -2.875 1011 H GLU 118 H GLU 118 2.013 12.677 -3.063 1012 HA GLU 118 HA GLU 118 3.500 13.962 -1.121 1013 HB2 GLU 118 2HB GLU 118 1.921 15.180 -3.404 1014 HB3 GLU 118 3HB GLU 118 3.126 16.048 -2.463 1015 HG2 GLU 118 2HG GLU 118 4.860 14.514 -3.223 1016 HG3 GLU 118 3HG GLU 118 3.663 13.590 -4.129 1017 H ARG 119 H ARG 119 0.018 14.181 -1.699 1018 HA ARG 119 HA ARG 119 -0.480 16.241 0.209 1019 HB2 ARG 119 2HB ARG 119 -2.265 14.194 -1.105 1020 HB3 ARG 119 3HB ARG 119 -2.876 15.353 0.067 1021 HG2 ARG 119 2HG ARG 119 -1.501 16.071 -2.521 1022 HG3 ARG 119 3HG ARG 119 -3.246 16.082 -2.249 1023 HD2 ARG 119 2HD ARG 119 -2.905 17.743 -0.434 1024 HD3 ARG 119 3HD ARG 119 -1.189 17.783 -0.832 1025 HE ARG 119 HE ARG 119 -2.359 18.390 -3.184 1026 HH11 ARG 119 1HH1 ARG 119 -2.766 19.631 -0.002 1027 HH12 ARG 119 2HH1 ARG 119 -3.182 21.214 -0.547 1028 HH21 ARG 119 1HH2 ARG 119 -2.876 20.440 -3.879 1029 HH22 ARG 119 2HH2 ARG 119 -3.221 21.674 -2.718 1030 H LEU 120 H LEU 120 -0.996 12.697 0.402 1031 HA LEU 120 HA LEU 120 -1.889 12.614 3.045 1032 HB2 LEU 120 2HB LEU 120 -0.351 10.553 1.462 1033 HB3 LEU 120 3HB LEU 120 -1.095 10.231 3.018 1034 HG LEU 120 HG LEU 120 -2.566 11.031 0.497 1035 HD11 LEU 120 1HD1 LEU 120 -3.445 8.749 0.536 1036 HD12 LEU 120 2HD1 LEU 120 -2.427 8.376 1.927 1037 HD13 LEU 120 3HD1 LEU 120 -1.689 8.762 0.372 1038 HD21 LEU 120 3HD2 LEU 120 -3.633 10.262 3.218 1039 HD22 LEU 120 1HD2 LEU 120 -4.602 10.559 1.774 1040 HD23 LEU 120 2HD2 LEU 120 -3.678 11.873 2.501 1041 H ILE 121 H ILE 121 1.433 12.390 1.796 1042 HA ILE 121 HA ILE 121 2.814 11.915 4.155 1043 HB ILE 121 HB ILE 121 3.656 13.578 1.769 1044 HG12 ILE 121 2HG1 ILE 121 4.260 10.699 2.526 1045 HG13 ILE 121 3HG1 ILE 121 3.129 11.211 1.279 1046 HG21 ILE 121 1HG2 ILE 121 5.035 14.199 3.662 1047 HG22 ILE 121 2HG2 ILE 121 5.978 13.216 2.544 1048 HG23 ILE 121 3HG2 ILE 121 5.350 12.502 4.029 1049 HD11 ILE 121 3HD1 ILE 121 4.950 12.165 -0.010 1050 HD12 ILE 121 1HD1 ILE 121 5.254 10.464 0.343 1051 HD13 ILE 121 2HD1 ILE 121 6.098 11.719 1.252 1052 H ARG 122 H ARG 122 1.393 14.922 3.011 1053 HA ARG 122 HA ARG 122 2.637 16.525 5.083 1054 HB2 ARG 122 2HB ARG 122 0.530 17.121 3.000 1055 HB3 ARG 122 3HB ARG 122 1.024 18.301 4.208 1056 HG2 ARG 122 2HG ARG 122 2.939 16.983 2.287 1057 HG3 ARG 122 3HG ARG 122 2.149 18.533 1.984 1058 HD2 ARG 122 2HD ARG 122 3.868 17.955 4.403 1059 HD3 ARG 122 3HD ARG 122 4.470 18.703 2.923 1060 HE ARG 122 HE ARG 122 2.621 20.428 3.426 1061 HH11 ARG 122 1HH1 ARG 122 4.434 18.781 5.855 1062 HH12 ARG 122 2HH1 ARG 122 4.374 20.115 6.951 1063 HH21 ARG 122 1HH2 ARG 122 2.549 22.115 4.848 1064 HH22 ARG 122 2HH2 ARG 122 3.314 21.973 6.393 1065 H GLU 123 H GLU 123 -0.434 14.874 4.607 1066 HA GLU 123 HA GLU 123 -1.739 16.158 6.823 1067 HB2 GLU 123 2HB GLU 123 -2.474 13.661 5.278 1068 HB3 GLU 123 3HB GLU 123 -3.490 14.410 6.504 1069 HG2 GLU 123 2HG GLU 123 -3.334 16.530 5.062 1070 HG3 GLU 123 3HG GLU 123 -2.736 15.457 3.797 1071 H VAL 124 H VAL 124 -0.581 12.778 6.376 1072 HA VAL 124 HA VAL 124 -0.852 12.220 9.182 1073 HB VAL 124 HB VAL 124 -1.100 10.417 7.543 1074 HG11 VAL 124 1HG1 VAL 124 0.845 9.464 6.387 1075 HG12 VAL 124 2HG1 VAL 124 1.848 10.779 6.996 1076 HG13 VAL 124 3HG1 VAL 124 0.528 11.121 5.879 1077 HG21 VAL 124 3HG2 VAL 124 -0.452 9.856 9.832 1078 HG22 VAL 124 1HG2 VAL 124 1.251 9.981 9.393 1079 HG23 VAL 124 2HG2 VAL 124 0.246 8.717 8.682 1080 H GLY 125 H GLY 125 1.881 12.977 7.040 1081 HA2 GLY 125 2HA GLY 125 3.853 12.680 9.125 1082 HA3 GLY 125 3HA GLY 125 4.123 13.312 7.511 1083 H SER 126 H SER 126 1.633 14.733 9.486 1084 HA SER 126 HA SER 126 3.106 17.238 9.621 1085 HB2 SER 126 2HB SER 126 0.736 17.320 9.021 1086 HB3 SER 126 3HB SER 126 0.301 16.529 10.535 1087 HG SER 126 HG SER 126 0.849 19.157 10.035 1088 H LEU 127 H LEU 127 1.990 14.712 11.805 1089 HA LEU 127 HA LEU 127 3.713 15.776 13.909 1090 HB2 LEU 127 2HB LEU 127 2.037 15.754 15.621 1091 HB3 LEU 127 3HB LEU 127 1.483 16.777 14.311 1092 HG LEU 127 HG LEU 127 0.537 13.934 14.760 1093 HD11 LEU 127 1HD1 LEU 127 -0.150 15.367 16.612 1094 HD12 LEU 127 2HD1 LEU 127 -1.529 14.927 15.606 1095 HD13 LEU 127 3HD1 LEU 127 -0.821 16.537 15.472 1096 HD21 LEU 127 3HD2 LEU 127 0.319 14.614 12.445 1097 HD22 LEU 127 1HD2 LEU 127 -0.465 16.119 12.928 1098 HD23 LEU 127 2HD2 LEU 127 -1.270 14.574 13.204 1099 H GLU 128 H GLU 128 2.939 13.186 12.116 1100 HA GLU 128 HA GLU 128 2.662 11.154 14.127 1101 HB2 GLU 128 2HB GLU 128 2.110 11.200 11.464 1102 HB3 GLU 128 3HB GLU 128 3.646 10.349 11.442 1103 HG2 GLU 128 2HG GLU 128 1.022 9.517 12.591 1104 HG3 GLU 128 3HG GLU 128 2.152 8.604 11.597 1105 H HIS 129 H HIS 129 4.252 10.312 15.334 1106 HA HIS 129 HA HIS 129 6.833 9.697 14.252 1107 HB2 HIS 129 2HB HIS 129 7.017 12.160 14.721 1108 HB3 HIS 129 3HB HIS 129 6.749 11.809 16.423 1109 HD1 HIS 129 HD1 HIS 129 8.862 11.773 17.683 1110 HD2 HIS 129 HD2 HIS 129 9.404 10.485 13.774 1111 HE1 HIS 129 HE1 HIS 129 11.306 11.264 17.480 1112 HE2 HIS 129 HE2 HIS 129 11.643 10.723 15.050 1113 H HIS 130 H HIS 130 5.205 7.881 15.213 1114 HA HIS 130 HA HIS 130 5.412 7.338 17.997 1115 HB2 HIS 130 2HB HIS 130 4.673 5.683 15.602 1116 HB3 HIS 130 3HB HIS 130 4.914 4.903 17.160 1117 HD1 HIS 130 HD1 HIS 130 2.519 6.968 15.244 1118 HD2 HIS 130 HD2 HIS 130 2.988 5.617 19.147 1119 HE1 HIS 130 HE1 HIS 130 0.276 7.261 16.335 1120 HE2 HIS 130 HE2 HIS 130 0.614 6.558 18.723 1121 H HIS 131 H HIS 131 6.626 5.714 19.067 1122 HA HIS 131 HA HIS 131 9.183 4.996 17.767 1123 HB2 HIS 131 2HB HIS 131 8.512 5.373 20.697 1124 HB3 HIS 131 3HB HIS 131 10.050 4.756 20.106 1125 HD1 HIS 131 HD1 HIS 131 11.770 6.441 19.387 1126 HD2 HIS 131 HD2 HIS 131 8.027 8.138 20.009 1127 HE1 HIS 131 HE1 HIS 131 12.125 8.918 19.242 1128 HE2 HIS 131 HE2 HIS 131 9.903 9.910 19.872 1129 H HIS 132 H HIS 132 10.055 2.941 19.374 1130 HA HIS 132 HA HIS 132 8.415 0.820 18.310 1131 HB2 HIS 132 2HB HIS 132 10.183 -0.702 19.080 1132 HB3 HIS 132 3HB HIS 132 10.834 0.639 18.153 1133 HD1 HIS 132 HD1 HIS 132 13.081 1.073 19.097 1134 HD2 HIS 132 HD2 HIS 132 10.277 0.402 22.092 1135 HE1 HIS 132 HE1 HIS 132 14.308 1.401 21.256 1136 HE2 HIS 132 HE2 HIS 132 12.554 1.167 23.037 1137 H HIS 133 H HIS 133 7.631 2.495 20.835 1138 HA HIS 133 HA HIS 133 7.363 0.411 22.840 1139 HB2 HIS 133 2HB HIS 133 7.882 2.684 23.579 1140 HB3 HIS 133 3HB HIS 133 6.404 3.286 22.833 1141 HD1 HIS 133 HD1 HIS 133 4.931 3.921 24.740 1142 HD2 HIS 133 HD2 HIS 133 6.796 0.262 25.372 1143 HE1 HIS 133 HE1 HIS 133 3.954 3.027 26.870 1144 HE2 HIS 133 HE2 HIS 133 5.229 0.911 27.322 1145 H HIS 134 H HIS 134 5.818 -1.063 22.597 1146 HA HIS 134 HA HIS 134 3.053 -0.217 22.343 1147 HB2 HIS 134 2HB HIS 134 3.764 -0.530 19.984 1148 HB3 HIS 134 3HB HIS 134 4.217 -2.191 20.350 1149 HD1 HIS 134 HD1 HIS 134 2.246 -3.865 20.850 1150 HD2 HIS 134 HD2 HIS 134 1.062 -0.114 19.501 1151 HE1 HIS 134 HE1 HIS 134 -0.157 -4.117 20.182 1152 HE2 HIS 134 HE2 HIS 134 -0.891 -1.815 19.497 Start of MODEL 9 1 H1 MET 1 1H MET 1 4.403 7.202 10.636 2 H2 MET 1 2H MET 1 3.644 7.671 12.073 3 H3 MET 1 3H MET 1 2.733 6.995 10.821 4 HA MET 1 HA MET 1 4.822 5.637 12.421 5 HB2 MET 1 2HB MET 1 2.713 5.991 13.638 6 HB3 MET 1 3HB MET 1 1.821 5.221 12.332 7 HG2 MET 1 2HG MET 1 2.955 3.114 12.769 8 HG3 MET 1 3HG MET 1 3.908 3.876 14.043 9 HE1 MET 1 3HE MET 1 1.515 1.531 16.064 10 HE2 MET 1 1HE MET 1 3.190 1.985 15.747 11 HE3 MET 1 2HE MET 1 2.236 1.198 14.489 12 H ASN 2 H ASN 2 2.113 4.860 10.150 13 HA ASN 2 HA ASN 2 3.947 3.260 8.557 14 HB2 ASN 2 2HB ASN 2 3.226 1.713 10.346 15 HB3 ASN 2 3HB ASN 2 1.547 1.978 9.891 16 HD21 ASN 2 1HD2 ASN 2 4.298 1.615 7.703 17 HD22 ASN 2 2HD2 ASN 2 3.737 0.150 6.986 18 H ILE 3 H ILE 3 3.310 2.946 6.471 19 HA ILE 3 HA ILE 3 0.557 3.571 5.671 20 HB ILE 3 HB ILE 3 1.665 5.654 5.270 21 HG12 ILE 3 2HG1 ILE 3 1.488 4.144 2.642 22 HG13 ILE 3 3HG1 ILE 3 0.133 4.880 3.491 23 HG21 ILE 3 1HG2 ILE 3 3.794 4.127 3.773 24 HG22 ILE 3 2HG2 ILE 3 3.973 4.874 5.360 25 HG23 ILE 3 3HG2 ILE 3 3.698 5.881 3.938 26 HD11 ILE 3 3HD1 ILE 3 1.136 7.086 3.181 27 HD12 ILE 3 1HD1 ILE 3 0.869 6.264 1.645 28 HD13 ILE 3 2HD1 ILE 3 2.492 6.347 2.328 29 H VAL 4 H VAL 4 -0.228 2.075 4.293 30 HA VAL 4 HA VAL 4 1.676 0.116 3.162 31 HB VAL 4 HB VAL 4 -1.226 -0.322 3.921 32 HG11 VAL 4 1HG1 VAL 4 -0.552 -1.785 2.108 33 HG12 VAL 4 2HG1 VAL 4 -0.707 -2.716 3.599 34 HG13 VAL 4 3HG1 VAL 4 0.892 -2.273 2.999 35 HG21 VAL 4 3HG2 VAL 4 1.302 -1.160 5.355 36 HG22 VAL 4 1HG2 VAL 4 -0.332 -1.668 5.784 37 HG23 VAL 4 2HG2 VAL 4 0.124 0.030 5.911 38 H ILE 5 H ILE 5 1.808 -0.012 1.000 39 HA ILE 5 HA ILE 5 -0.404 1.050 -0.652 40 HB ILE 5 HB ILE 5 2.469 0.537 -1.465 41 HG12 ILE 5 2HG1 ILE 5 1.072 3.168 -0.880 42 HG13 ILE 5 3HG1 ILE 5 2.252 2.390 0.170 43 HG21 ILE 5 1HG2 ILE 5 0.217 1.908 -2.942 44 HG22 ILE 5 2HG2 ILE 5 0.930 0.345 -3.342 45 HG23 ILE 5 3HG2 ILE 5 1.892 1.816 -3.489 46 HD11 ILE 5 3HD1 ILE 5 3.957 2.651 -1.548 47 HD12 ILE 5 1HD1 ILE 5 3.242 4.200 -1.103 48 HD13 ILE 5 2HD1 ILE 5 2.774 3.414 -2.610 49 H VAL 6 H VAL 6 -1.741 -0.506 -1.364 50 HA VAL 6 HA VAL 6 -0.765 -3.228 -1.831 51 HB VAL 6 HB VAL 6 -3.602 -2.160 -1.904 52 HG11 VAL 6 1HG1 VAL 6 -4.274 -4.518 -1.775 53 HG12 VAL 6 2HG1 VAL 6 -2.581 -5.006 -1.865 54 HG13 VAL 6 3HG1 VAL 6 -3.338 -4.192 -3.235 55 HG21 VAL 6 3HG2 VAL 6 -2.595 -1.955 0.325 56 HG22 VAL 6 1HG2 VAL 6 -2.164 -3.665 0.292 57 HG23 VAL 6 2HG2 VAL 6 -3.860 -3.181 0.305 58 H VAL 7 H VAL 7 -0.197 -3.877 -3.830 59 HA VAL 7 HA VAL 7 -1.227 -2.368 -6.162 60 HB VAL 7 HB VAL 7 1.429 -3.807 -5.910 61 HG11 VAL 7 1HG1 VAL 7 0.342 -2.077 -8.139 62 HG12 VAL 7 2HG1 VAL 7 0.599 -3.822 -8.203 63 HG13 VAL 7 3HG1 VAL 7 1.978 -2.733 -8.051 64 HG21 VAL 7 3HG2 VAL 7 0.807 -0.847 -5.894 65 HG22 VAL 7 1HG2 VAL 7 2.423 -1.554 -5.930 66 HG23 VAL 7 2HG2 VAL 7 1.384 -1.803 -4.528 67 H PHE 8 H PHE 8 -2.655 -3.510 -7.335 68 HA PHE 8 HA PHE 8 -2.610 -6.428 -7.361 69 HB2 PHE 8 2HB PHE 8 -4.484 -4.405 -8.597 70 HB3 PHE 8 3HB PHE 8 -4.660 -6.139 -8.821 71 HD1 PHE 8 HD2 PHE 8 -4.555 -3.496 -6.200 72 HD2 PHE 8 HD1 PHE 8 -5.831 -7.423 -7.261 73 HE1 PHE 8 HE2 PHE 8 -5.877 -3.627 -4.129 74 HE2 PHE 8 HE1 PHE 8 -7.156 -7.552 -5.193 75 HZ PHE 8 HZ PHE 8 -7.180 -5.654 -3.625 76 H SER 9 H SER 9 -1.136 -4.020 -9.165 77 HA SER 9 HA SER 9 -1.368 -4.897 -11.826 78 HB2 SER 9 2HB SER 9 -0.463 -2.721 -11.433 79 HB3 SER 9 3HB SER 9 0.831 -3.366 -10.424 80 HG SER 9 HG SER 9 0.771 -3.026 -13.099 81 H THR 10 H THR 10 0.805 -5.959 -9.277 82 HA THR 10 HA THR 10 2.287 -7.649 -9.056 83 HB THR 10 HB THR 10 1.906 -9.759 -10.086 84 HG1 THR 10 HG1 THR 10 0.299 -8.421 -12.036 85 HG21 THR 10 3HG2 THR 10 -0.504 -10.094 -9.761 86 HG22 THR 10 1HG2 THR 10 -0.755 -8.350 -9.801 87 HG23 THR 10 2HG2 THR 10 0.180 -9.076 -8.492 88 H ASP 11 H ASP 11 2.524 -5.642 -11.644 89 HA ASP 11 HA ASP 11 4.816 -6.980 -12.868 90 HB2 ASP 11 2HB ASP 11 3.189 -5.830 -14.322 91 HB3 ASP 11 3HB ASP 11 3.528 -4.309 -13.502 92 H GLU 12 H GLU 12 6.887 -6.576 -12.296 93 HA GLU 12 HA GLU 12 7.396 -5.013 -9.971 94 HB2 GLU 12 2HB GLU 12 9.417 -6.265 -11.839 95 HB3 GLU 12 3HB GLU 12 9.737 -5.664 -10.219 96 HG2 GLU 12 2HG GLU 12 9.574 -7.925 -9.856 97 HG3 GLU 12 3HG GLU 12 7.937 -7.390 -9.493 98 H GLU 13 H GLU 13 7.749 -4.301 -13.402 99 HA GLU 13 HA GLU 13 9.592 -2.131 -12.914 100 HB2 GLU 13 2HB GLU 13 9.948 -2.082 -15.144 101 HB3 GLU 13 3HB GLU 13 9.167 -3.648 -15.101 102 HG2 GLU 13 2HG GLU 13 8.197 -2.554 -16.908 103 HG3 GLU 13 3HG GLU 13 7.002 -2.396 -15.624 104 H THR 14 H THR 14 6.109 -2.417 -13.540 105 HA THR 14 HA THR 14 5.474 0.326 -13.372 106 HB THR 14 HB THR 14 3.818 -2.018 -12.372 107 HG1 THR 14 HG1 THR 14 4.311 -0.973 -14.900 108 HG21 THR 14 3HG2 THR 14 1.890 -0.488 -12.704 109 HG22 THR 14 1HG2 THR 14 3.018 0.828 -13.027 110 HG23 THR 14 2HG2 THR 14 2.987 0.062 -11.438 111 H LEU 15 H LEU 15 5.780 -2.171 -10.870 112 HA LEU 15 HA LEU 15 5.354 -0.583 -8.603 113 HB2 LEU 15 2HB LEU 15 5.443 -3.015 -8.524 114 HB3 LEU 15 3HB LEU 15 7.135 -2.994 -8.982 115 HG LEU 15 HG LEU 15 7.683 -1.872 -6.841 116 HD11 LEU 15 1HD1 LEU 15 4.756 -2.281 -6.234 117 HD12 LEU 15 2HD1 LEU 15 5.587 -0.736 -6.422 118 HD13 LEU 15 3HD1 LEU 15 5.984 -1.790 -5.066 119 HD21 LEU 15 3HD2 LEU 15 7.857 -4.295 -7.012 120 HD22 LEU 15 1HD2 LEU 15 6.160 -4.466 -6.564 121 HD23 LEU 15 2HD2 LEU 15 7.319 -3.825 -5.400 122 H ARG 16 H ARG 16 8.299 -1.164 -10.476 123 HA ARG 16 HA ARG 16 10.214 0.057 -8.892 124 HB2 ARG 16 2HB ARG 16 10.798 -1.180 -10.887 125 HB3 ARG 16 3HB ARG 16 9.966 -0.017 -11.906 126 HG2 ARG 16 2HG ARG 16 11.610 1.680 -11.385 127 HG3 ARG 16 3HG ARG 16 12.410 0.595 -10.247 128 HD2 ARG 16 2HD ARG 16 13.550 0.743 -12.454 129 HD3 ARG 16 3HD ARG 16 13.054 -0.892 -12.021 130 HE ARG 16 HE ARG 16 11.074 0.400 -13.600 131 HH11 ARG 16 1HH1 ARG 16 14.172 -1.085 -13.858 132 HH12 ARG 16 2HH1 ARG 16 13.891 -1.636 -15.470 133 HH21 ARG 16 1HH2 ARG 16 10.736 -0.301 -15.687 134 HH22 ARG 16 2HH2 ARG 16 11.970 -1.209 -16.489 135 H LYS 17 H LYS 17 7.868 1.547 -11.070 136 HA LYS 17 HA LYS 17 8.772 4.195 -11.038 137 HB2 LYS 17 2HB LYS 17 5.900 3.221 -11.054 138 HB3 LYS 17 3HB LYS 17 6.439 4.824 -11.526 139 HG2 LYS 17 2HG LYS 17 7.182 2.252 -12.920 140 HG3 LYS 17 3HG LYS 17 5.950 3.397 -13.459 141 HD2 LYS 17 2HD LYS 17 7.755 5.145 -13.567 142 HD3 LYS 17 3HD LYS 17 8.927 3.866 -13.245 143 HE2 LYS 17 2HE LYS 17 7.020 3.920 -15.587 144 HE3 LYS 17 3HE LYS 17 8.712 4.409 -15.652 145 HZ1 LYS 17 3HZ LYS 17 9.292 2.131 -14.935 146 HZ2 LYS 17 1HZ LYS 17 8.528 2.184 -16.439 147 HZ3 LYS 17 2HZ LYS 17 7.665 1.690 -15.077 148 H PHE 18 H PHE 18 6.368 2.662 -8.882 149 HA PHE 18 HA PHE 18 5.985 4.822 -7.138 150 HB2 PHE 18 2HB PHE 18 5.830 1.862 -6.496 151 HB3 PHE 18 3HB PHE 18 5.118 3.158 -5.541 152 HD1 PHE 18 HD1 PHE 18 4.858 1.193 -8.620 153 HD2 PHE 18 HD2 PHE 18 3.099 4.283 -6.276 154 HE1 PHE 18 HE1 PHE 18 2.801 1.034 -9.954 155 HE2 PHE 18 HE2 PHE 18 1.040 4.125 -7.612 156 HZ PHE 18 HZ PHE 18 0.893 2.499 -9.454 157 H LYS 19 H LYS 19 8.275 2.124 -6.975 158 HA LYS 19 HA LYS 19 9.400 2.610 -4.477 159 HB2 LYS 19 2HB LYS 19 10.741 1.502 -6.957 160 HB3 LYS 19 3HB LYS 19 11.370 1.363 -5.321 161 HG2 LYS 19 2HG LYS 19 9.499 -0.006 -4.659 162 HG3 LYS 19 3HG LYS 19 8.722 0.231 -6.222 163 HD2 LYS 19 2HD LYS 19 9.694 -1.914 -6.334 164 HD3 LYS 19 3HD LYS 19 10.781 -0.873 -7.249 165 HE2 LYS 19 2HE LYS 19 11.206 -1.678 -4.368 166 HE3 LYS 19 3HE LYS 19 11.932 -2.499 -5.746 167 HZ1 LYS 19 3HZ LYS 19 13.478 -0.955 -4.785 168 HZ2 LYS 19 1HZ LYS 19 12.387 0.325 -4.949 169 HZ3 LYS 19 2HZ LYS 19 13.041 -0.407 -6.325 170 H ASP 20 H ASP 20 10.415 3.908 -7.652 171 HA ASP 20 HA ASP 20 12.622 5.360 -6.626 172 HB2 ASP 20 2HB ASP 20 12.381 4.739 -9.011 173 HB3 ASP 20 3HB ASP 20 11.064 5.901 -9.163 174 H ILE 21 H ILE 21 9.260 6.327 -7.327 175 HA ILE 21 HA ILE 21 9.457 9.044 -6.692 176 HB ILE 21 HB ILE 21 7.099 7.192 -6.242 177 HG12 ILE 21 2HG1 ILE 21 7.763 9.046 -8.555 178 HG13 ILE 21 3HG1 ILE 21 7.870 7.290 -8.586 179 HG21 ILE 21 1HG2 ILE 21 6.837 9.214 -4.911 180 HG22 ILE 21 2HG2 ILE 21 5.717 9.238 -6.272 181 HG23 ILE 21 3HG2 ILE 21 7.184 10.216 -6.322 182 HD11 ILE 21 3HD1 ILE 21 5.343 8.885 -8.214 183 HD12 ILE 21 1HD1 ILE 21 5.464 7.126 -8.282 184 HD13 ILE 21 2HD1 ILE 21 5.867 8.094 -9.700 185 H ILE 22 H ILE 22 8.733 6.292 -4.542 186 HA ILE 22 HA ILE 22 8.411 7.694 -2.144 187 HB ILE 22 HB ILE 22 9.520 4.914 -2.604 188 HG12 ILE 22 2HG1 ILE 22 6.740 5.846 -1.817 189 HG13 ILE 22 3HG1 ILE 22 7.208 5.295 -3.422 190 HG21 ILE 22 1HG2 ILE 22 10.209 5.722 -0.407 191 HG22 ILE 22 2HG2 ILE 22 8.985 4.462 -0.251 192 HG23 ILE 22 3HG2 ILE 22 8.541 6.155 -0.026 193 HD11 ILE 22 3HD1 ILE 22 6.035 3.557 -2.219 194 HD12 ILE 22 1HD1 ILE 22 7.208 3.640 -0.907 195 HD13 ILE 22 2HD1 ILE 22 7.708 3.080 -2.502 196 H LYS 23 H LYS 23 11.391 6.336 -3.578 197 HA LYS 23 HA LYS 23 13.165 7.167 -1.553 198 HB2 LYS 23 2HB LYS 23 13.704 6.780 -4.509 199 HB3 LYS 23 3HB LYS 23 14.944 6.950 -3.273 200 HG2 LYS 23 2HG LYS 23 14.055 4.901 -2.180 201 HG3 LYS 23 3HG LYS 23 12.945 4.711 -3.537 202 HD2 LYS 23 2HD LYS 23 15.964 4.748 -3.719 203 HD3 LYS 23 3HD LYS 23 14.955 3.304 -3.769 204 HE2 LYS 23 2HE LYS 23 15.427 3.728 -6.017 205 HE3 LYS 23 3HE LYS 23 13.816 4.407 -5.800 206 HZ1 LYS 23 3HZ LYS 23 14.874 6.603 -5.539 207 HZ2 LYS 23 1HZ LYS 23 15.179 5.918 -7.053 208 HZ3 LYS 23 2HZ LYS 23 16.378 5.913 -5.858 209 H LYS 24 H LYS 24 12.124 8.803 -4.530 210 HA LYS 24 HA LYS 24 13.760 11.064 -4.388 211 HB2 LYS 24 2HB LYS 24 12.450 10.488 -6.368 212 HB3 LYS 24 3HB LYS 24 10.954 10.802 -5.500 213 HG2 LYS 24 2HG LYS 24 11.525 13.164 -5.325 214 HG3 LYS 24 3HG LYS 24 13.067 12.867 -6.132 215 HD2 LYS 24 2HD LYS 24 10.317 12.457 -7.333 216 HD3 LYS 24 3HD LYS 24 11.417 13.789 -7.691 217 HE2 LYS 24 2HE LYS 24 13.060 12.177 -8.567 218 HE3 LYS 24 3HE LYS 24 11.932 10.863 -8.238 219 HZ1 LYS 24 3HZ LYS 24 11.515 13.104 -10.143 220 HZ2 LYS 24 1HZ LYS 24 10.368 11.914 -9.788 221 HZ3 LYS 24 2HZ LYS 24 11.819 11.492 -10.541 222 H ASN 25 H ASN 25 10.673 10.396 -2.815 223 HA ASN 25 HA ASN 25 10.340 13.031 -1.742 224 HB2 ASN 25 2HB ASN 25 9.061 10.397 -0.973 225 HB3 ASN 25 3HB ASN 25 8.555 11.973 -0.364 226 HD21 ASN 25 1HD2 ASN 25 7.099 9.994 -1.983 227 HD22 ASN 25 2HD2 ASN 25 6.599 10.839 -3.400 228 H GLY 26 H GLY 26 12.504 10.606 -0.919 229 HA2 GLY 26 2HA GLY 26 14.199 11.039 0.715 230 HA3 GLY 26 3HA GLY 26 13.021 11.920 1.667 231 H PHE 27 H PHE 27 11.682 9.028 0.547 232 HA PHE 27 HA PHE 27 12.196 7.731 3.154 233 HB2 PHE 27 2HB PHE 27 9.855 7.424 1.253 234 HB3 PHE 27 3HB PHE 27 10.059 6.515 2.746 235 HD1 PHE 27 HD2 PHE 27 9.432 9.866 1.331 236 HD2 PHE 27 HD1 PHE 27 9.548 7.485 4.862 237 HE1 PHE 27 HE2 PHE 27 8.299 11.659 2.575 238 HE2 PHE 27 HE1 PHE 27 8.416 9.277 6.110 239 HZ PHE 27 HZ PHE 27 7.790 11.366 4.969 240 H LYS 28 H LYS 28 11.916 5.263 3.038 241 HA LYS 28 HA LYS 28 13.269 4.186 0.640 242 HB2 LYS 28 2HB LYS 28 13.302 3.224 3.511 243 HB3 LYS 28 3HB LYS 28 13.881 2.245 2.171 244 HG2 LYS 28 2HG LYS 28 15.775 3.260 3.178 245 HG3 LYS 28 3HG LYS 28 15.507 4.075 1.635 246 HD2 LYS 28 2HD LYS 28 14.341 5.902 2.861 247 HD3 LYS 28 3HD LYS 28 14.741 5.095 4.378 248 HE2 LYS 28 2HE LYS 28 16.735 6.115 2.351 249 HE3 LYS 28 3HE LYS 28 16.301 6.924 3.857 250 HZ1 LYS 28 3HZ LYS 28 18.368 5.635 3.999 251 HZ2 LYS 28 1HZ LYS 28 17.506 4.217 3.691 252 HZ3 LYS 28 2HZ LYS 28 17.207 5.110 5.099 253 H VAL 29 H VAL 29 12.711 1.740 0.328 254 HA VAL 29 HA VAL 29 9.770 1.466 0.529 255 HB VAL 29 HB VAL 29 11.541 0.426 -1.695 256 HG11 VAL 29 1HG1 VAL 29 9.549 -0.934 -1.378 257 HG12 VAL 29 2HG1 VAL 29 9.415 0.001 -2.866 258 HG13 VAL 29 3HG1 VAL 29 8.529 0.506 -1.428 259 HG21 VAL 29 3HG2 VAL 29 11.446 2.872 -1.708 260 HG22 VAL 29 1HG2 VAL 29 9.683 2.813 -1.690 261 HG23 VAL 29 2HG2 VAL 29 10.575 2.192 -3.081 262 H ARG 30 H ARG 30 8.901 -0.460 1.152 263 HA ARG 30 HA ARG 30 10.670 -2.813 1.446 264 HB2 ARG 30 2HB ARG 30 8.450 -1.938 3.318 265 HB3 ARG 30 3HB ARG 30 9.277 -3.487 3.413 266 HG2 ARG 30 2HG ARG 30 10.591 -0.791 3.726 267 HG3 ARG 30 3HG ARG 30 10.113 -1.859 5.046 268 HD2 ARG 30 2HD ARG 30 11.643 -3.586 4.186 269 HD3 ARG 30 3HD ARG 30 12.133 -2.494 2.889 270 HE ARG 30 HE ARG 30 12.694 -1.024 5.036 271 HH11 ARG 30 1HH1 ARG 30 13.380 -4.322 4.330 272 HH12 ARG 30 2HH1 ARG 30 14.806 -4.352 5.305 273 HH21 ARG 30 1HH2 ARG 30 14.559 -1.065 6.262 274 HH22 ARG 30 2HH2 ARG 30 15.471 -2.527 6.377 275 H THR 31 H THR 31 10.035 -3.888 -0.396 276 HA THR 31 HA THR 31 7.239 -4.079 -1.137 277 HB THR 31 HB THR 31 8.095 -5.533 -3.009 278 HG1 THR 31 HG1 THR 31 10.057 -6.282 -2.816 279 HG21 THR 31 3HG2 THR 31 9.423 -2.828 -2.705 280 HG22 THR 31 1HG2 THR 31 7.789 -3.117 -3.310 281 HG23 THR 31 2HG2 THR 31 9.184 -3.698 -4.221 282 H VAL 32 H VAL 32 5.938 -5.882 -1.112 283 HA VAL 32 HA VAL 32 6.951 -8.315 0.230 284 HB VAL 32 HB VAL 32 4.336 -6.905 0.848 285 HG11 VAL 32 1HG1 VAL 32 4.012 -8.667 2.542 286 HG12 VAL 32 2HG1 VAL 32 5.447 -9.492 1.940 287 HG13 VAL 32 3HG1 VAL 32 4.034 -9.314 0.902 288 HG21 VAL 32 3HG2 VAL 32 6.299 -5.833 1.880 289 HG22 VAL 32 1HG2 VAL 32 6.745 -7.369 2.621 290 HG23 VAL 32 2HG2 VAL 32 5.243 -6.567 3.084 291 H ARG 33 H ARG 33 6.257 -10.222 -0.657 292 HA ARG 33 HA ARG 33 4.011 -10.127 -2.583 293 HB2 ARG 33 2HB ARG 33 5.140 -11.963 -3.828 294 HB3 ARG 33 3HB ARG 33 6.074 -10.472 -3.808 295 HG2 ARG 33 2HG ARG 33 7.473 -11.382 -2.011 296 HG3 ARG 33 3HG ARG 33 6.547 -12.881 -2.057 297 HD2 ARG 33 2HD ARG 33 7.285 -13.298 -4.330 298 HD3 ARG 33 3HD ARG 33 8.141 -11.755 -4.361 299 HE ARG 33 HE ARG 33 9.164 -13.101 -2.206 300 HH11 ARG 33 1HH1 ARG 33 8.926 -13.747 -5.591 301 HH12 ARG 33 2HH1 ARG 33 10.396 -14.657 -5.622 302 HH21 ARG 33 1HH2 ARG 33 11.014 -14.283 -2.259 303 HH22 ARG 33 2HH2 ARG 33 11.551 -14.988 -3.743 304 H SER 34 H SER 34 5.295 -11.573 0.249 305 HA SER 34 HA SER 34 3.060 -13.490 0.323 306 HB2 SER 34 2HB SER 34 4.502 -15.249 1.235 307 HB3 SER 34 3HB SER 34 5.109 -14.733 -0.338 308 HG SER 34 HG SER 34 6.613 -13.392 0.820 309 HA PRO 35 HA PRO 35 1.909 -12.109 4.302 310 HB2 PRO 35 2HB PRO 35 1.983 -14.516 5.781 311 HB3 PRO 35 3HB PRO 35 0.608 -13.868 4.884 312 HG2 PRO 35 2HG PRO 35 2.618 -15.916 4.060 313 HG3 PRO 35 3HG PRO 35 0.882 -15.838 3.704 314 HD2 PRO 35 2HD PRO 35 2.677 -15.207 1.837 315 HD3 PRO 35 3HD PRO 35 1.182 -14.259 2.001 316 H GLN 36 H GLN 36 4.508 -14.551 4.750 317 HA GLN 36 HA GLN 36 5.376 -13.689 7.246 318 HB2 GLN 36 2HB GLN 36 7.547 -14.799 6.687 319 HB3 GLN 36 3HB GLN 36 6.131 -15.797 6.391 320 HG2 GLN 36 2HG GLN 36 6.273 -15.316 4.001 321 HG3 GLN 36 3HG GLN 36 7.670 -14.280 4.287 322 HE21 GLN 36 1HE2 GLN 36 6.500 -17.564 4.290 323 HE22 GLN 36 2HE2 GLN 36 8.053 -18.318 4.240 324 H GLU 37 H GLU 37 6.446 -12.542 4.049 325 HA GLU 37 HA GLU 37 8.526 -10.865 4.944 326 HB2 GLU 37 2HB GLU 37 6.745 -10.554 2.523 327 HB3 GLU 37 3HB GLU 37 8.256 -9.692 2.782 328 HG2 GLU 37 2HG GLU 37 9.519 -11.715 2.617 329 HG3 GLU 37 3HG GLU 37 8.048 -12.694 2.613 330 H LEU 38 H LEU 38 5.062 -10.251 4.478 331 HA LEU 38 HA LEU 38 5.034 -7.491 4.970 332 HB2 LEU 38 2HB LEU 38 3.095 -8.701 4.112 333 HB3 LEU 38 3HB LEU 38 2.939 -9.572 5.626 334 HG LEU 38 HG LEU 38 2.410 -7.443 6.783 335 HD11 LEU 38 1HD1 LEU 38 2.488 -6.245 4.012 336 HD12 LEU 38 2HD1 LEU 38 3.603 -5.896 5.334 337 HD13 LEU 38 3HD1 LEU 38 1.906 -5.437 5.468 338 HD21 LEU 38 3HD2 LEU 38 0.596 -8.849 5.968 339 HD22 LEU 38 1HD2 LEU 38 0.655 -8.046 4.398 340 HD23 LEU 38 2HD2 LEU 38 0.168 -7.144 5.835 341 H LYS 39 H LYS 39 4.649 -10.203 7.235 342 HA LYS 39 HA LYS 39 4.341 -8.779 9.605 343 HB2 LYS 39 2HB LYS 39 3.993 -11.178 9.499 344 HB3 LYS 39 3HB LYS 39 5.687 -11.445 9.108 345 HG2 LYS 39 2HG LYS 39 6.302 -10.557 11.337 346 HG3 LYS 39 3HG LYS 39 4.585 -10.412 11.719 347 HD2 LYS 39 2HD LYS 39 4.300 -12.818 11.463 348 HD3 LYS 39 3HD LYS 39 5.990 -12.988 10.986 349 HE2 LYS 39 2HE LYS 39 6.662 -12.118 13.209 350 HE3 LYS 39 3HE LYS 39 4.960 -12.079 13.677 351 HZ1 LYS 39 3HZ LYS 39 6.127 -14.083 14.439 352 HZ2 LYS 39 1HZ LYS 39 6.424 -14.519 12.834 353 HZ3 LYS 39 2HZ LYS 39 4.835 -14.448 13.413 354 H ASP 40 H ASP 40 7.406 -10.244 8.466 355 HA ASP 40 HA ASP 40 9.063 -9.064 10.366 356 HB2 ASP 40 2HB ASP 40 9.637 -10.070 7.578 357 HB3 ASP 40 3HB ASP 40 10.906 -9.519 8.669 358 H SER 41 H SER 41 8.182 -7.825 7.139 359 HA SER 41 HA SER 41 9.900 -5.627 7.044 360 HB2 SER 41 2HB SER 41 7.112 -5.905 5.892 361 HB3 SER 41 3HB SER 41 8.214 -4.585 5.503 362 HG SER 41 HG SER 41 8.237 -7.225 4.676 363 H ILE 42 H ILE 42 6.555 -5.746 8.318 364 HA ILE 42 HA ILE 42 6.476 -3.055 9.185 365 HB ILE 42 HB ILE 42 4.932 -5.443 10.233 366 HG12 ILE 42 2HG1 ILE 42 4.193 -3.320 8.193 367 HG13 ILE 42 3HG1 ILE 42 4.606 -4.991 7.823 368 HG21 ILE 42 1HG2 ILE 42 4.417 -2.488 10.620 369 HG22 ILE 42 2HG2 ILE 42 4.900 -3.638 11.866 370 HG23 ILE 42 3HG2 ILE 42 3.322 -3.787 11.097 371 HD11 ILE 42 3HD1 ILE 42 2.212 -4.630 7.744 372 HD12 ILE 42 1HD1 ILE 42 2.224 -4.072 9.417 373 HD13 ILE 42 2HD1 ILE 42 2.634 -5.746 9.041 374 H GLU 43 H GLU 43 7.408 -6.045 10.874 375 HA GLU 43 HA GLU 43 7.964 -4.960 13.399 376 HB2 GLU 43 2HB GLU 43 9.353 -7.255 11.988 377 HB3 GLU 43 3HB GLU 43 9.442 -6.922 13.712 378 HG2 GLU 43 2HG GLU 43 6.852 -7.492 12.288 379 HG3 GLU 43 3HG GLU 43 7.857 -8.754 12.995 380 H GLU 44 H GLU 44 9.836 -4.922 10.425 381 HA GLU 44 HA GLU 44 12.204 -3.792 11.605 382 HB2 GLU 44 2HB GLU 44 11.277 -3.938 8.725 383 HB3 GLU 44 3HB GLU 44 12.837 -3.298 9.221 384 HG2 GLU 44 2HG GLU 44 13.420 -5.493 10.170 385 HG3 GLU 44 3HG GLU 44 11.864 -6.126 9.630 386 H LEU 45 H LEU 45 9.342 -2.491 9.965 387 HA LEU 45 HA LEU 45 10.252 0.162 9.661 388 HB2 LEU 45 2HB LEU 45 7.425 -0.862 9.974 389 HB3 LEU 45 3HB LEU 45 7.855 0.747 9.422 390 HG LEU 45 HG LEU 45 8.454 -1.848 7.994 391 HD11 LEU 45 1HD1 LEU 45 6.110 -1.202 7.876 392 HD12 LEU 45 2HD1 LEU 45 6.894 -1.017 6.308 393 HD13 LEU 45 3HD1 LEU 45 6.566 0.403 7.303 394 HD21 LEU 45 3HD2 LEU 45 9.324 -0.470 6.183 395 HD22 LEU 45 1HD2 LEU 45 10.253 -0.218 7.661 396 HD23 LEU 45 2HD2 LEU 45 9.070 0.986 7.147 397 H VAL 46 H VAL 46 8.213 -1.267 12.220 398 HA VAL 46 HA VAL 46 7.661 1.041 13.655 399 HB VAL 46 HB VAL 46 6.518 -1.070 14.067 400 HG11 VAL 46 1HG1 VAL 46 7.552 -2.876 15.352 401 HG12 VAL 46 2HG1 VAL 46 9.080 -1.997 15.371 402 HG13 VAL 46 3HG1 VAL 46 8.422 -2.586 13.846 403 HG21 VAL 46 3HG2 VAL 46 7.889 -0.080 16.577 404 HG22 VAL 46 1HG2 VAL 46 6.371 -0.975 16.503 405 HG23 VAL 46 2HG2 VAL 46 6.469 0.652 15.829 406 H LYS 47 H LYS 47 10.654 -0.790 13.646 407 HA LYS 47 HA LYS 47 11.694 0.932 15.821 408 HB2 LYS 47 2HB LYS 47 12.499 -1.894 15.092 409 HB3 LYS 47 3HB LYS 47 13.336 -0.902 16.277 410 HG2 LYS 47 2HG LYS 47 10.434 -1.696 16.476 411 HG3 LYS 47 3HG LYS 47 11.758 -2.560 17.252 412 HD2 LYS 47 2HD LYS 47 11.377 0.382 17.735 413 HD3 LYS 47 3HD LYS 47 10.397 -0.793 18.607 414 HE2 LYS 47 2HE LYS 47 12.322 -0.188 19.944 415 HE3 LYS 47 3HE LYS 47 12.457 -1.868 19.438 416 HZ1 LYS 47 3HZ LYS 47 14.553 -0.655 19.252 417 HZ2 LYS 47 1HZ LYS 47 13.852 0.412 18.144 418 HZ3 LYS 47 2HZ LYS 47 14.030 -1.219 17.749 419 H LYS 48 H LYS 48 12.961 -1.003 13.086 420 HA LYS 48 HA LYS 48 15.433 0.354 12.987 421 HB2 LYS 48 2HB LYS 48 14.049 -1.331 10.890 422 HB3 LYS 48 3HB LYS 48 15.730 -0.817 10.811 423 HG2 LYS 48 2HG LYS 48 16.292 -2.125 12.738 424 HG3 LYS 48 3HG LYS 48 14.594 -2.502 13.040 425 HD2 LYS 48 2HD LYS 48 15.789 -4.381 11.970 426 HD3 LYS 48 3HD LYS 48 14.473 -3.770 10.969 427 HE2 LYS 48 2HE LYS 48 16.117 -2.465 9.656 428 HE3 LYS 48 3HE LYS 48 17.414 -3.163 10.626 429 HZ1 LYS 48 3HZ LYS 48 16.835 -5.336 9.818 430 HZ2 LYS 48 1HZ LYS 48 17.093 -4.309 8.502 431 HZ3 LYS 48 2HZ LYS 48 15.519 -4.720 8.953 432 H TYR 49 H TYR 49 12.540 0.679 10.891 433 HA TYR 49 HA TYR 49 13.541 3.302 10.033 434 HB2 TYR 49 2HB TYR 49 13.182 0.921 8.285 435 HB3 TYR 49 3HB TYR 49 12.652 2.468 7.634 436 HD1 TYR 49 HD1 TYR 49 15.572 0.497 8.710 437 HD2 TYR 49 HD2 TYR 49 14.238 4.228 7.150 438 HE1 TYR 49 HE1 TYR 49 17.888 1.071 8.103 439 HE2 TYR 49 HE2 TYR 49 16.540 4.802 6.532 440 HH TYR 49 HH TYR 49 18.830 4.211 7.222 441 H ASN 50 H ASN 50 11.864 4.232 11.247 442 HA ASN 50 HA ASN 50 9.102 3.779 10.752 443 HB2 ASN 50 2HB ASN 50 9.933 4.924 12.775 444 HB3 ASN 50 3HB ASN 50 10.510 6.263 11.787 445 HD21 ASN 50 1HD2 ASN 50 9.239 7.796 12.775 446 HD22 ASN 50 2HD2 ASN 50 7.523 7.844 12.607 447 H ALA 51 H ALA 51 11.494 5.952 9.322 448 HA ALA 51 HA ALA 51 9.574 7.222 7.558 449 HB1 ALA 51 3HB ALA 51 11.481 8.486 6.715 450 HB2 ALA 51 1HB ALA 51 12.585 7.461 7.635 451 HB3 ALA 51 2HB ALA 51 11.447 8.511 8.477 452 H THR 52 H THR 52 9.235 4.701 6.970 453 HA THR 52 HA THR 52 10.329 4.420 4.273 454 HB THR 52 HB THR 52 10.629 2.270 6.388 455 HG1 THR 52 HG1 THR 52 12.259 4.098 5.826 456 HG21 THR 52 3HG2 THR 52 11.062 2.056 3.403 457 HG22 THR 52 1HG2 THR 52 9.834 1.210 4.343 458 HG23 THR 52 2HG2 THR 52 11.542 0.842 4.588 459 H ILE 53 H ILE 53 8.875 3.550 2.845 460 HA ILE 53 HA ILE 53 6.195 2.997 3.913 461 HB ILE 53 HB ILE 53 7.066 3.549 1.065 462 HG12 ILE 53 2HG1 ILE 53 5.713 5.339 3.110 463 HG13 ILE 53 3HG1 ILE 53 7.365 5.499 2.526 464 HG21 ILE 53 1HG2 ILE 53 4.288 3.344 2.249 465 HG22 ILE 53 2HG2 ILE 53 5.034 2.194 1.139 466 HG23 ILE 53 3HG2 ILE 53 4.667 3.830 0.594 467 HD11 ILE 53 3HD1 ILE 53 6.511 5.977 0.279 468 HD12 ILE 53 1HD1 ILE 53 5.921 7.130 1.476 469 HD13 ILE 53 2HD1 ILE 53 4.860 5.850 0.888 470 H VAL 54 H VAL 54 5.118 1.081 3.625 471 HA VAL 54 HA VAL 54 6.654 -1.136 2.440 472 HB VAL 54 HB VAL 54 6.036 -1.519 4.756 473 HG11 VAL 54 1HG1 VAL 54 3.162 -1.193 3.884 474 HG12 VAL 54 2HG1 VAL 54 4.075 -0.061 4.881 475 HG13 VAL 54 3HG1 VAL 54 3.712 -1.676 5.490 476 HG21 VAL 54 3HG2 VAL 54 6.086 -3.461 3.260 477 HG22 VAL 54 1HG2 VAL 54 4.373 -3.243 2.906 478 HG23 VAL 54 2HG2 VAL 54 4.890 -3.672 4.537 479 H VAL 55 H VAL 55 6.012 -2.083 0.609 480 HA VAL 55 HA VAL 55 3.339 -1.415 -0.465 481 HB VAL 55 HB VAL 55 5.836 -2.033 -2.069 482 HG11 VAL 55 1HG1 VAL 55 3.086 -1.094 -2.904 483 HG12 VAL 55 2HG1 VAL 55 3.824 -2.657 -3.255 484 HG13 VAL 55 3HG1 VAL 55 4.485 -1.189 -3.972 485 HG21 VAL 55 3HG2 VAL 55 4.513 0.635 -1.531 486 HG22 VAL 55 1HG2 VAL 55 5.851 0.360 -2.646 487 HG23 VAL 55 2HG2 VAL 55 6.079 0.105 -0.915 488 H VAL 56 H VAL 56 2.012 -3.107 -0.476 489 HA VAL 56 HA VAL 56 3.099 -5.835 -0.530 490 HB VAL 56 HB VAL 56 0.277 -4.922 0.093 491 HG11 VAL 56 1HG1 VAL 56 -0.008 -7.186 1.019 492 HG12 VAL 56 2HG1 VAL 56 1.611 -7.611 0.464 493 HG13 VAL 56 3HG1 VAL 56 0.351 -7.222 -0.707 494 HG21 VAL 56 3HG2 VAL 56 0.863 -5.368 2.450 495 HG22 VAL 56 1HG2 VAL 56 1.835 -4.067 1.757 496 HG23 VAL 56 2HG2 VAL 56 2.530 -5.675 1.963 497 H VAL 57 H VAL 57 3.306 -6.645 -2.537 498 HA VAL 57 HA VAL 57 1.443 -5.996 -4.665 499 HB VAL 57 HB VAL 57 3.699 -8.022 -4.672 500 HG11 VAL 57 1HG1 VAL 57 3.584 -7.780 -7.119 501 HG12 VAL 57 2HG1 VAL 57 2.193 -6.706 -6.939 502 HG13 VAL 57 3HG1 VAL 57 2.076 -8.397 -6.446 503 HG21 VAL 57 3HG2 VAL 57 4.569 -5.800 -4.157 504 HG22 VAL 57 1HG2 VAL 57 3.718 -5.126 -5.550 505 HG23 VAL 57 2HG2 VAL 57 5.032 -6.278 -5.792 506 H VAL 58 H VAL 58 -0.403 -7.111 -5.035 507 HA VAL 58 HA VAL 58 -0.737 -9.654 -3.578 508 HB VAL 58 HB VAL 58 -3.146 -9.123 -3.425 509 HG11 VAL 58 1HG1 VAL 58 -2.929 -7.364 -1.722 510 HG12 VAL 58 2HG1 VAL 58 -1.307 -6.996 -2.307 511 HG13 VAL 58 3HG1 VAL 58 -1.645 -8.567 -1.580 512 HG21 VAL 58 3HG2 VAL 58 -3.358 -7.675 -5.384 513 HG22 VAL 58 1HG2 VAL 58 -2.338 -6.458 -4.614 514 HG23 VAL 58 2HG2 VAL 58 -3.921 -6.842 -3.935 515 H ASP 59 H ASP 59 -1.296 -11.438 -4.625 516 HA ASP 59 HA ASP 59 -1.796 -11.391 -7.487 517 HB2 ASP 59 2HB ASP 59 -1.760 -13.891 -7.242 518 HB3 ASP 59 3HB ASP 59 -0.299 -13.096 -6.660 519 H ASP 60 H ASP 60 -3.591 -12.125 -4.532 520 HA ASP 60 HA ASP 60 -6.087 -12.130 -6.097 521 HB2 ASP 60 2HB ASP 60 -5.366 -14.472 -5.464 522 HB3 ASP 60 3HB ASP 60 -5.555 -14.007 -3.777 523 H LYS 61 H LYS 61 -8.013 -11.542 -4.829 524 HA LYS 61 HA LYS 61 -7.464 -9.295 -3.183 525 HB2 LYS 61 2HB LYS 61 -9.909 -9.084 -2.951 526 HB3 LYS 61 3HB LYS 61 -9.398 -9.276 -4.616 527 HG2 LYS 61 2HG LYS 61 -11.275 -10.613 -4.514 528 HG3 LYS 61 3HG LYS 61 -9.976 -11.778 -4.271 529 HD2 LYS 61 2HD LYS 61 -11.818 -12.184 -2.719 530 HD3 LYS 61 3HD LYS 61 -10.363 -11.706 -1.847 531 HE2 LYS 61 2HE LYS 61 -12.302 -10.585 -0.909 532 HE3 LYS 61 3HE LYS 61 -11.241 -9.407 -1.676 533 HZ1 LYS 61 3HZ LYS 61 -12.701 -9.354 -3.585 534 HZ2 LYS 61 1HZ LYS 61 -13.586 -9.020 -2.183 535 HZ3 LYS 61 2HZ LYS 61 -13.691 -10.544 -2.909 536 H GLU 62 H GLU 62 -8.004 -12.636 -2.426 537 HA GLU 62 HA GLU 62 -8.694 -12.325 0.316 538 HB2 GLU 62 2HB GLU 62 -7.430 -14.590 -1.222 539 HB3 GLU 62 3HB GLU 62 -7.777 -14.702 0.498 540 HG2 GLU 62 2HG GLU 62 -9.820 -14.163 -1.652 541 HG3 GLU 62 3HG GLU 62 -9.519 -15.727 -0.899 542 H TRP 63 H TRP 63 -5.568 -12.743 -1.328 543 HA TRP 63 HA TRP 63 -3.948 -12.539 0.984 544 HB2 TRP 63 2HB TRP 63 -2.932 -13.394 -0.989 545 HB3 TRP 63 3HB TRP 63 -3.443 -12.015 -1.948 546 HD1 TRP 63 HD1 TRP 63 -1.166 -11.180 -2.773 547 HE1 TRP 63 HE1 TRP 63 0.940 -10.221 -1.664 548 HE3 TRP 63 HE3 TRP 63 -2.253 -12.266 2.116 549 HZ2 TRP 63 HZ2 TRP 63 2.007 -9.964 0.928 550 HZ3 TRP 63 HZ3 TRP 63 -0.626 -11.626 3.846 551 HH2 TRP 63 HH2 TRP 63 1.461 -10.499 3.262 552 H ALA 64 H ALA 64 -5.130 -10.093 -1.313 553 HA ALA 64 HA ALA 64 -4.009 -7.815 -0.165 554 HB1 ALA 64 3HB ALA 64 -5.819 -6.567 -1.237 555 HB2 ALA 64 1HB ALA 64 -6.711 -8.067 -1.492 556 HB3 ALA 64 2HB ALA 64 -5.174 -7.805 -2.316 557 H GLU 65 H GLU 65 -7.117 -9.397 0.617 558 HA GLU 65 HA GLU 65 -7.813 -7.584 2.696 559 HB2 GLU 65 2HB GLU 65 -9.480 -8.983 1.520 560 HB3 GLU 65 3HB GLU 65 -8.782 -10.421 2.256 561 HG2 GLU 65 2HG GLU 65 -9.422 -9.664 4.458 562 HG3 GLU 65 3HG GLU 65 -9.998 -8.133 3.799 563 H LYS 66 H LYS 66 -6.047 -10.639 2.638 564 HA LYS 66 HA LYS 66 -5.907 -11.081 5.417 565 HB2 LYS 66 2HB LYS 66 -5.292 -12.755 3.674 566 HB3 LYS 66 3HB LYS 66 -3.840 -11.824 3.330 567 HG2 LYS 66 2HG LYS 66 -3.042 -12.212 5.608 568 HG3 LYS 66 3HG LYS 66 -4.510 -13.124 5.967 569 HD2 LYS 66 2HD LYS 66 -3.890 -14.714 4.143 570 HD3 LYS 66 3HD LYS 66 -2.365 -13.842 3.963 571 HE2 LYS 66 2HE LYS 66 -2.056 -15.819 5.345 572 HE3 LYS 66 3HE LYS 66 -1.804 -14.355 6.299 573 HZ1 LYS 66 3HZ LYS 66 -4.283 -15.996 6.270 574 HZ2 LYS 66 1HZ LYS 66 -4.040 -14.598 7.187 575 HZ3 LYS 66 2HZ LYS 66 -3.123 -15.979 7.504 576 H ALA 67 H ALA 67 -3.849 -9.203 3.234 577 HA ALA 67 HA ALA 67 -1.895 -8.381 5.067 578 HB1 ALA 67 3HB ALA 67 -2.991 -6.803 2.735 579 HB2 ALA 67 1HB ALA 67 -1.741 -8.042 2.629 580 HB3 ALA 67 2HB ALA 67 -1.435 -6.559 3.531 581 H ILE 68 H ILE 68 -4.958 -6.790 4.156 582 HA ILE 68 HA ILE 68 -4.821 -4.657 5.997 583 HB ILE 68 HB ILE 68 -7.344 -6.010 5.001 584 HG12 ILE 68 2HG1 ILE 68 -5.931 -5.441 3.097 585 HG13 ILE 68 3HG1 ILE 68 -7.303 -4.341 3.168 586 HG21 ILE 68 1HG2 ILE 68 -6.856 -3.190 5.977 587 HG22 ILE 68 2HG2 ILE 68 -7.735 -4.456 6.838 588 HG23 ILE 68 3HG2 ILE 68 -8.378 -3.807 5.330 589 HD11 ILE 68 3HD1 ILE 68 -4.486 -3.735 4.045 590 HD12 ILE 68 1HD1 ILE 68 -5.855 -2.631 4.167 591 HD13 ILE 68 2HD1 ILE 68 -5.285 -3.155 2.585 592 H ARG 69 H ARG 69 -6.104 -7.935 6.302 593 HA ARG 69 HA ARG 69 -7.276 -7.721 8.850 594 HB2 ARG 69 2HB ARG 69 -7.549 -9.606 7.182 595 HB3 ARG 69 3HB ARG 69 -5.957 -10.178 7.651 596 HG2 ARG 69 2HG ARG 69 -8.183 -9.868 9.655 597 HG3 ARG 69 3HG ARG 69 -8.009 -11.321 8.674 598 HD2 ARG 69 2HD ARG 69 -5.693 -11.571 9.575 599 HD3 ARG 69 3HD ARG 69 -6.009 -10.207 10.648 600 HE ARG 69 HE ARG 69 -7.987 -12.236 10.910 601 HH11 ARG 69 1HH1 ARG 69 -4.787 -11.385 11.881 602 HH12 ARG 69 2HH1 ARG 69 -4.842 -12.391 13.285 603 HH21 ARG 69 1HH2 ARG 69 -8.033 -13.496 12.725 604 HH22 ARG 69 2HH2 ARG 69 -6.650 -13.548 13.762 605 H PHE 70 H PHE 70 -3.962 -8.535 7.846 606 HA PHE 70 HA PHE 70 -2.944 -9.090 10.422 607 HB2 PHE 70 2HB PHE 70 -1.781 -9.720 8.332 608 HB3 PHE 70 3HB PHE 70 -1.461 -8.019 8.004 609 HD1 PHE 70 HD1 PHE 70 -0.782 -10.761 10.412 610 HD2 PHE 70 HD2 PHE 70 0.428 -6.952 8.931 611 HE1 PHE 70 HE1 PHE 70 1.299 -10.913 11.717 612 HE2 PHE 70 HE2 PHE 70 2.506 -7.102 10.236 613 HZ PHE 70 HZ PHE 70 2.945 -9.084 11.629 614 H VAL 71 H VAL 71 -2.912 -6.069 8.504 615 HA VAL 71 HA VAL 71 -1.686 -4.416 10.410 616 HB VAL 71 HB VAL 71 -3.824 -3.621 8.417 617 HG11 VAL 71 1HG1 VAL 71 -2.818 -1.379 8.572 618 HG12 VAL 71 2HG1 VAL 71 -1.732 -1.961 9.835 619 HG13 VAL 71 3HG1 VAL 71 -3.472 -1.914 10.120 620 HG21 VAL 71 3HG2 VAL 71 -1.957 -4.750 7.316 621 HG22 VAL 71 1HG2 VAL 71 -0.814 -3.671 8.116 622 HG23 VAL 71 2HG2 VAL 71 -1.955 -3.031 6.934 623 H LYS 72 H LYS 72 -5.113 -5.179 9.913 624 HA LYS 72 HA LYS 72 -6.237 -3.720 12.014 625 HB2 LYS 72 2HB LYS 72 -7.506 -4.886 10.227 626 HB3 LYS 72 3HB LYS 72 -7.075 -6.431 10.933 627 HG2 LYS 72 2HG LYS 72 -8.594 -4.393 12.529 628 HG3 LYS 72 3HG LYS 72 -9.422 -5.441 11.376 629 HD2 LYS 72 2HD LYS 72 -8.396 -7.407 12.581 630 HD3 LYS 72 3HD LYS 72 -7.830 -6.272 13.808 631 HE2 LYS 72 2HE LYS 72 -9.901 -7.300 14.529 632 HE3 LYS 72 3HE LYS 72 -10.162 -5.584 14.216 633 HZ1 LYS 72 3HZ LYS 72 -11.088 -6.176 12.052 634 HZ2 LYS 72 1HZ LYS 72 -11.951 -6.909 13.307 635 HZ3 LYS 72 2HZ LYS 72 -10.865 -7.815 12.387 636 H SER 73 H SER 73 -4.696 -6.903 11.983 637 HA SER 73 HA SER 73 -5.242 -7.598 14.684 638 HB2 SER 73 2HB SER 73 -2.981 -8.544 12.896 639 HB3 SER 73 3HB SER 73 -3.496 -9.313 14.398 640 HG SER 73 HG SER 73 -5.301 -8.892 12.259 641 H LEU 74 H LEU 74 -2.721 -5.686 13.181 642 HA LEU 74 HA LEU 74 -0.966 -5.470 15.391 643 HB2 LEU 74 2HB LEU 74 -1.550 -3.430 13.233 644 HB3 LEU 74 3HB LEU 74 -0.155 -3.418 14.295 645 HG LEU 74 HG LEU 74 -0.742 -5.592 12.277 646 HD11 LEU 74 1HD1 LEU 74 1.063 -4.583 10.952 647 HD12 LEU 74 2HD1 LEU 74 1.159 -3.251 12.105 648 HD13 LEU 74 3HD1 LEU 74 -0.306 -3.484 11.148 649 HD21 LEU 74 3HD2 LEU 74 1.578 -6.268 12.698 650 HD22 LEU 74 1HD2 LEU 74 0.605 -6.360 14.165 651 HD23 LEU 74 2HD2 LEU 74 1.722 -5.016 13.933 652 H GLY 75 H GLY 75 -3.979 -3.876 14.583 653 HA2 GLY 75 2HA GLY 75 -5.387 -2.591 15.896 654 HA3 GLY 75 3HA GLY 75 -4.256 -2.773 17.229 655 H ALA 76 H ALA 76 -2.891 -1.631 14.311 656 HA ALA 76 HA ALA 76 -2.554 1.029 15.521 657 HB1 ALA 76 3HB ALA 76 -0.967 -0.297 13.318 658 HB2 ALA 76 1HB ALA 76 -0.505 -0.213 15.018 659 HB3 ALA 76 2HB ALA 76 -0.612 1.263 14.059 660 H GLN 77 H GLN 77 -2.922 2.933 14.353 661 HA GLN 77 HA GLN 77 -4.817 2.682 12.144 662 HB2 GLN 77 2HB GLN 77 -5.100 5.157 12.464 663 HB3 GLN 77 3HB GLN 77 -5.498 4.187 13.876 664 HG2 GLN 77 2HG GLN 77 -3.247 4.715 14.803 665 HG3 GLN 77 3HG GLN 77 -2.986 5.798 13.437 666 HE21 GLN 77 1HE2 GLN 77 -2.795 7.594 14.776 667 HE22 GLN 77 2HE2 GLN 77 -4.158 8.295 15.574 668 H VAL 78 H VAL 78 -3.943 2.458 10.179 669 HA VAL 78 HA VAL 78 -1.548 4.052 9.496 670 HB VAL 78 HB VAL 78 -0.769 2.319 8.059 671 HG11 VAL 78 1HG1 VAL 78 -1.732 1.074 10.638 672 HG12 VAL 78 2HG1 VAL 78 -0.249 2.003 10.418 673 HG13 VAL 78 3HG1 VAL 78 -0.440 0.447 9.611 674 HG21 VAL 78 3HG2 VAL 78 -3.340 0.829 8.625 675 HG22 VAL 78 1HG2 VAL 78 -1.986 0.225 7.667 676 HG23 VAL 78 2HG2 VAL 78 -2.910 1.618 7.107 677 H LEU 79 H LEU 79 -1.294 4.542 7.186 678 HA LEU 79 HA LEU 79 -3.867 5.178 5.907 679 HB2 LEU 79 2HB LEU 79 -2.290 7.028 6.309 680 HB3 LEU 79 3HB LEU 79 -1.078 6.202 5.350 681 HG LEU 79 HG LEU 79 -2.420 6.484 3.334 682 HD11 LEU 79 1HD1 LEU 79 -4.647 6.340 4.331 683 HD12 LEU 79 2HD1 LEU 79 -4.480 7.794 3.349 684 HD13 LEU 79 3HD1 LEU 79 -4.409 7.905 5.108 685 HD21 LEU 79 3HD2 LEU 79 -2.151 9.065 4.878 686 HD22 LEU 79 1HD2 LEU 79 -2.267 8.904 3.126 687 HD23 LEU 79 2HD2 LEU 79 -0.863 8.264 3.977 688 H ILE 80 H ILE 80 -4.450 4.272 3.955 689 HA ILE 80 HA ILE 80 -2.555 2.295 2.826 690 HB ILE 80 HB ILE 80 -5.574 2.089 2.955 691 HG12 ILE 80 2HG1 ILE 80 -3.439 0.547 4.461 692 HG13 ILE 80 3HG1 ILE 80 -4.459 1.803 5.153 693 HG21 ILE 80 1HG2 ILE 80 -4.680 1.010 0.958 694 HG22 ILE 80 2HG2 ILE 80 -5.244 -0.200 2.110 695 HG23 ILE 80 3HG2 ILE 80 -3.518 0.118 1.942 696 HD11 ILE 80 3HD1 ILE 80 -6.426 0.434 4.759 697 HD12 ILE 80 1HD1 ILE 80 -5.237 -0.418 5.743 698 HD13 ILE 80 2HD1 ILE 80 -5.421 -0.821 4.036 699 H ILE 81 H ILE 81 -2.126 2.356 0.701 700 HA ILE 81 HA ILE 81 -3.858 3.967 -1.084 701 HB ILE 81 HB ILE 81 -0.871 3.501 -1.370 702 HG12 ILE 81 2HG1 ILE 81 -2.366 6.025 -0.591 703 HG13 ILE 81 3HG1 ILE 81 -1.393 5.036 0.493 704 HG21 ILE 81 1HG2 ILE 81 -0.984 5.098 -3.211 705 HG22 ILE 81 2HG2 ILE 81 -2.727 5.253 -2.991 706 HG23 ILE 81 3HG2 ILE 81 -2.037 3.719 -3.519 707 HD11 ILE 81 3HD1 ILE 81 0.593 5.554 -0.848 708 HD12 ILE 81 1HD1 ILE 81 -0.174 6.998 -0.188 709 HD13 ILE 81 2HD1 ILE 81 -0.396 6.582 -1.887 710 H ILE 82 H ILE 82 -4.763 2.834 -2.751 711 HA ILE 82 HA ILE 82 -3.667 0.148 -3.326 712 HB ILE 82 HB ILE 82 -6.550 1.032 -3.613 713 HG12 ILE 82 2HG1 ILE 82 -5.217 -0.718 -1.521 714 HG13 ILE 82 3HG1 ILE 82 -5.900 0.883 -1.254 715 HG21 ILE 82 1HG2 ILE 82 -5.914 -0.707 -5.215 716 HG22 ILE 82 2HG2 ILE 82 -7.009 -1.349 -3.992 717 HG23 ILE 82 3HG2 ILE 82 -5.282 -1.701 -3.901 718 HD11 ILE 82 3HD1 ILE 82 -7.433 -1.588 -2.034 719 HD12 ILE 82 1HD1 ILE 82 -8.124 0.016 -1.775 720 HD13 ILE 82 2HD1 ILE 82 -7.378 -0.850 -0.433 721 H TYR 83 H TYR 83 -3.222 -0.422 -5.391 722 HA TYR 83 HA TYR 83 -3.937 1.446 -7.566 723 HB2 TYR 83 2HB TYR 83 -1.580 1.762 -6.918 724 HB3 TYR 83 3HB TYR 83 -1.274 0.049 -7.171 725 HD1 TYR 83 HD2 TYR 83 -1.928 3.268 -8.824 726 HD2 TYR 83 HD1 TYR 83 -1.013 -0.850 -9.426 727 HE1 TYR 83 HE2 TYR 83 -1.361 3.738 -11.160 728 HE2 TYR 83 HE1 TYR 83 -0.440 -0.379 -11.774 729 HH TYR 83 HH TYR 83 -1.084 1.455 -13.509 730 H ASP 84 H ASP 84 -5.227 0.414 -8.966 731 HA ASP 84 HA ASP 84 -4.376 -2.125 -10.097 732 HB2 ASP 84 2HB ASP 84 -5.842 -2.813 -8.225 733 HB3 ASP 84 3HB ASP 84 -7.143 -1.827 -8.889 734 H GLN 85 H GLN 85 -5.421 -2.638 -12.094 735 HA GLN 85 HA GLN 85 -6.273 -0.248 -13.555 736 HB2 GLN 85 2HB GLN 85 -5.493 -2.994 -14.564 737 HB3 GLN 85 3HB GLN 85 -5.821 -1.589 -15.572 738 HG2 GLN 85 2HG GLN 85 -3.890 -0.442 -14.669 739 HG3 GLN 85 3HG GLN 85 -3.600 -1.762 -13.538 740 HE21 GLN 85 1HE2 GLN 85 -2.763 -3.711 -14.314 741 HE22 GLN 85 2HE2 GLN 85 -1.992 -3.822 -15.858 742 H ASP 86 H ASP 86 -7.500 -3.323 -12.455 743 HA ASP 86 HA ASP 86 -9.888 -3.192 -14.113 744 HB2 ASP 86 2HB ASP 86 -9.096 -5.122 -11.909 745 HB3 ASP 86 3HB ASP 86 -10.505 -5.296 -12.953 746 H GLN 87 H GLN 87 -10.980 -1.340 -13.450 747 HA GLN 87 HA GLN 87 -11.261 -0.356 -10.879 748 HB2 GLN 87 2HB GLN 87 -13.187 -0.103 -13.199 749 HB3 GLN 87 3HB GLN 87 -13.245 0.878 -11.741 750 HG2 GLN 87 2HG GLN 87 -11.007 1.751 -12.247 751 HG3 GLN 87 3HG GLN 87 -10.974 0.788 -13.725 752 HE21 GLN 87 1HE2 GLN 87 -12.304 1.395 -15.451 753 HE22 GLN 87 2HE2 GLN 87 -13.024 2.960 -15.544 754 H ASN 88 H ASN 88 -13.236 -2.796 -12.497 755 HA ASN 88 HA ASN 88 -15.344 -3.026 -10.686 756 HB2 ASN 88 2HB ASN 88 -15.062 -4.218 -12.915 757 HB3 ASN 88 3HB ASN 88 -14.012 -5.359 -12.085 758 HD21 ASN 88 1HD2 ASN 88 -16.436 -5.950 -13.432 759 HD22 ASN 88 2HD2 ASN 88 -17.528 -6.602 -12.264 760 H ARG 89 H ARG 89 -12.237 -4.796 -10.680 761 HA ARG 89 HA ARG 89 -12.635 -6.110 -8.186 762 HB2 ARG 89 2HB ARG 89 -10.035 -5.441 -9.596 763 HB3 ARG 89 3HB ARG 89 -10.226 -6.614 -8.300 764 HG2 ARG 89 2HG ARG 89 -11.613 -8.005 -9.735 765 HG3 ARG 89 3HG ARG 89 -11.501 -6.806 -11.027 766 HD2 ARG 89 2HD ARG 89 -9.080 -7.124 -11.135 767 HD3 ARG 89 3HD ARG 89 -9.162 -8.287 -9.812 768 HE ARG 89 HE ARG 89 -10.853 -9.197 -11.819 769 HH11 ARG 89 1HH1 ARG 89 -7.487 -8.576 -11.407 770 HH12 ARG 89 2HH1 ARG 89 -7.018 -9.843 -12.488 771 HH21 ARG 89 1HH2 ARG 89 -10.215 -10.818 -13.219 772 HH22 ARG 89 2HH2 ARG 89 -8.527 -11.089 -13.486 773 H LEU 90 H LEU 90 -10.752 -3.251 -9.115 774 HA LEU 90 HA LEU 90 -9.531 -2.513 -6.806 775 HB2 LEU 90 2HB LEU 90 -9.243 -1.331 -8.906 776 HB3 LEU 90 3HB LEU 90 -10.885 -0.721 -8.828 777 HG LEU 90 HG LEU 90 -10.277 0.611 -6.824 778 HD11 LEU 90 1HD1 LEU 90 -8.459 -0.770 -5.976 779 HD12 LEU 90 2HD1 LEU 90 -7.924 0.892 -6.224 780 HD13 LEU 90 3HD1 LEU 90 -7.473 -0.360 -7.383 781 HD21 LEU 90 3HD2 LEU 90 -8.921 2.278 -8.005 782 HD22 LEU 90 1HD2 LEU 90 -10.204 1.633 -9.029 783 HD23 LEU 90 2HD2 LEU 90 -8.541 1.084 -9.249 784 H GLU 91 H GLU 91 -12.791 -1.314 -7.714 785 HA GLU 91 HA GLU 91 -13.156 -0.024 -5.195 786 HB2 GLU 91 2HB GLU 91 -15.153 -0.658 -7.374 787 HB3 GLU 91 3HB GLU 91 -15.486 0.361 -5.979 788 HG2 GLU 91 2HG GLU 91 -13.632 1.864 -6.714 789 HG3 GLU 91 3HG GLU 91 -13.495 0.894 -8.180 790 H GLU 92 H GLU 92 -14.053 -3.201 -6.419 791 HA GLU 92 HA GLU 92 -15.936 -3.956 -4.484 792 HB2 GLU 92 2HB GLU 92 -15.412 -5.260 -6.528 793 HB3 GLU 92 3HB GLU 92 -13.855 -5.697 -5.848 794 HG2 GLU 92 2HG GLU 92 -16.291 -6.377 -4.279 795 HG3 GLU 92 3HG GLU 92 -15.973 -7.300 -5.743 796 H PHE 93 H PHE 93 -12.404 -4.422 -4.474 797 HA PHE 93 HA PHE 93 -12.295 -5.363 -1.784 798 HB2 PHE 93 2HB PHE 93 -10.541 -5.947 -3.352 799 HB3 PHE 93 3HB PHE 93 -10.142 -4.250 -3.601 800 HD1 PHE 93 HD1 PHE 93 -10.520 -6.609 -0.717 801 HD2 PHE 93 HD2 PHE 93 -8.226 -3.521 -2.551 802 HE1 PHE 93 HE1 PHE 93 -8.885 -6.737 1.113 803 HE2 PHE 93 HE2 PHE 93 -6.590 -3.646 -0.718 804 HZ PHE 93 HZ PHE 93 -6.919 -5.253 1.117 805 H SER 94 H SER 94 -11.646 -2.189 -3.267 806 HA SER 94 HA SER 94 -10.725 -0.828 -1.017 807 HB2 SER 94 2HB SER 94 -12.305 0.224 -3.374 808 HB3 SER 94 3HB SER 94 -11.548 1.259 -2.163 809 HG SER 94 HG SER 94 -10.335 -0.433 -4.067 810 H ARG 95 H ARG 95 -14.034 -1.606 -1.922 811 HA ARG 95 HA ARG 95 -15.403 0.048 -0.111 812 HB2 ARG 95 2HB ARG 95 -16.497 -1.259 -1.915 813 HB3 ARG 95 3HB ARG 95 -16.167 -2.738 -1.026 814 HG2 ARG 95 2HG ARG 95 -18.422 -2.233 -0.599 815 HG3 ARG 95 3HG ARG 95 -17.551 -1.767 0.862 816 HD2 ARG 95 2HD ARG 95 -18.467 0.104 -1.333 817 HD3 ARG 95 3HD ARG 95 -19.245 -0.101 0.234 818 HE ARG 95 HE ARG 95 -16.643 1.180 -0.258 819 HH11 ARG 95 1HH1 ARG 95 -19.241 0.458 1.898 820 HH12 ARG 95 2HH1 ARG 95 -18.741 1.645 3.050 821 HH21 ARG 95 1HH2 ARG 95 -16.018 2.677 1.229 822 HH22 ARG 95 2HH2 ARG 95 -16.946 2.890 2.677 823 H GLU 96 H GLU 96 -14.264 -3.302 0.286 824 HA GLU 96 HA GLU 96 -15.077 -3.597 2.979 825 HB2 GLU 96 2HB GLU 96 -13.007 -5.068 1.340 826 HB3 GLU 96 3HB GLU 96 -13.499 -5.560 2.955 827 HG2 GLU 96 2HG GLU 96 -15.378 -5.305 0.613 828 HG3 GLU 96 3HG GLU 96 -14.612 -6.810 1.119 829 H VAL 97 H VAL 97 -12.211 -2.184 1.556 830 HA VAL 97 HA VAL 97 -10.576 -2.260 3.886 831 HB VAL 97 HB VAL 97 -10.451 -0.280 1.595 832 HG11 VAL 97 1HG1 VAL 97 -8.106 0.023 2.278 833 HG12 VAL 97 2HG1 VAL 97 -8.374 -1.041 3.659 834 HG13 VAL 97 3HG1 VAL 97 -9.224 0.501 3.556 835 HG21 VAL 97 3HG2 VAL 97 -8.725 -1.754 0.670 836 HG22 VAL 97 1HG2 VAL 97 -10.272 -2.589 0.813 837 HG23 VAL 97 2HG2 VAL 97 -8.992 -2.899 1.986 838 H ARG 98 H ARG 98 -12.473 0.442 2.477 839 HA ARG 98 HA ARG 98 -12.079 2.215 4.643 840 HB2 ARG 98 2HB ARG 98 -12.978 2.681 2.245 841 HB3 ARG 98 3HB ARG 98 -14.550 2.273 2.909 842 HG2 ARG 98 2HG ARG 98 -12.805 4.409 4.114 843 HG3 ARG 98 3HG ARG 98 -13.929 4.737 2.799 844 HD2 ARG 98 2HD ARG 98 -15.803 4.068 4.166 845 HD3 ARG 98 3HD ARG 98 -14.725 3.549 5.460 846 HE ARG 98 HE ARG 98 -14.034 6.056 5.376 847 HH11 ARG 98 1HH1 ARG 98 -17.227 4.795 5.050 848 HH12 ARG 98 2HH1 ARG 98 -17.965 6.231 5.668 849 HH21 ARG 98 1HH2 ARG 98 -14.988 7.867 6.168 850 HH22 ARG 98 2HH2 ARG 98 -16.711 7.953 6.281 851 H ARG 99 H ARG 99 -14.498 -0.254 4.015 852 HA ARG 99 HA ARG 99 -16.365 0.188 6.005 853 HB2 ARG 99 2HB ARG 99 -16.584 -1.531 4.289 854 HB3 ARG 99 3HB ARG 99 -15.240 -2.428 4.975 855 HG2 ARG 99 2HG ARG 99 -16.570 -2.823 7.014 856 HG3 ARG 99 3HG ARG 99 -17.923 -1.966 6.271 857 HD2 ARG 99 2HD ARG 99 -17.987 -3.612 4.462 858 HD3 ARG 99 3HD ARG 99 -16.610 -4.457 5.167 859 HE ARG 99 HE ARG 99 -18.883 -4.197 6.924 860 HH11 ARG 99 1HH1 ARG 99 -17.370 -6.147 4.499 861 HH12 ARG 99 2HH1 ARG 99 -18.174 -7.586 5.019 862 HH21 ARG 99 1HH2 ARG 99 -19.931 -6.061 7.534 863 HH22 ARG 99 2HH2 ARG 99 -19.605 -7.540 6.694 864 H ARG 100 H ARG 100 -13.083 -0.951 6.334 865 HA ARG 100 HA ARG 100 -13.508 -1.854 9.085 866 HB2 ARG 100 2HB ARG 100 -11.057 -1.978 7.313 867 HB3 ARG 100 3HB ARG 100 -11.185 -2.686 8.922 868 HG2 ARG 100 2HG ARG 100 -12.947 -4.172 8.162 869 HG3 ARG 100 3HG ARG 100 -12.909 -3.427 6.565 870 HD2 ARG 100 2HD ARG 100 -10.674 -4.250 6.178 871 HD3 ARG 100 3HD ARG 100 -10.575 -4.863 7.832 872 HE ARG 100 HE ARG 100 -12.205 -6.523 7.259 873 HH11 ARG 100 1HH1 ARG 100 -10.984 -4.764 4.561 874 HH12 ARG 100 2HH1 ARG 100 -11.424 -5.992 3.433 875 HH21 ARG 100 1HH2 ARG 100 -12.796 -8.066 5.799 876 HH22 ARG 100 2HH2 ARG 100 -12.444 -7.842 4.119 877 H GLY 101 H GLY 101 -13.188 1.093 7.914 878 HA2 GLY 101 2HA GLY 101 -12.895 2.994 9.259 879 HA3 GLY 101 3HA GLY 101 -11.961 2.036 10.389 880 H PHE 102 H PHE 102 -10.345 1.113 7.877 881 HA PHE 102 HA PHE 102 -8.230 2.987 8.239 882 HB2 PHE 102 2HB PHE 102 -8.613 0.683 6.327 883 HB3 PHE 102 3HB PHE 102 -7.172 1.690 6.300 884 HD1 PHE 102 HD1 PHE 102 -5.840 1.891 8.498 885 HD2 PHE 102 HD2 PHE 102 -8.708 -1.179 7.762 886 HE1 PHE 102 HE1 PHE 102 -4.788 0.497 10.229 887 HE2 PHE 102 HE2 PHE 102 -7.658 -2.574 9.501 888 HZ PHE 102 HZ PHE 102 -5.688 -1.739 10.734 889 H GLU 103 H GLU 103 -7.399 4.556 6.871 890 HA GLU 103 HA GLU 103 -9.232 5.732 4.981 891 HB2 GLU 103 2HB GLU 103 -6.427 6.509 5.809 892 HB3 GLU 103 3HB GLU 103 -7.386 7.413 4.644 893 HG2 GLU 103 2HG GLU 103 -9.123 7.714 6.410 894 HG3 GLU 103 3HG GLU 103 -8.012 6.964 7.557 895 H VAL 104 H VAL 104 -9.483 4.647 3.125 896 HA VAL 104 HA VAL 104 -7.180 3.526 1.728 897 HB VAL 104 HB VAL 104 -9.090 2.079 1.835 898 HG11 VAL 104 1HG1 VAL 104 -10.682 4.272 0.497 899 HG12 VAL 104 2HG1 VAL 104 -10.841 3.743 2.173 900 HG13 VAL 104 3HG1 VAL 104 -11.264 2.646 0.859 901 HG21 VAL 104 3HG2 VAL 104 -8.829 3.200 -0.962 902 HG22 VAL 104 1HG2 VAL 104 -9.483 1.617 -0.542 903 HG23 VAL 104 2HG2 VAL 104 -7.784 1.981 -0.230 904 H ARG 105 H ARG 105 -6.161 4.519 0.132 905 HA ARG 105 HA ARG 105 -7.485 6.747 -1.294 906 HB2 ARG 105 2HB ARG 105 -4.513 6.330 -0.843 907 HB3 ARG 105 3HB ARG 105 -5.261 7.716 -1.625 908 HG2 ARG 105 2HG ARG 105 -5.614 6.930 1.267 909 HG3 ARG 105 3HG ARG 105 -4.574 8.223 0.669 910 HD2 ARG 105 2HD ARG 105 -6.464 9.471 -0.117 911 HD3 ARG 105 3HD ARG 105 -7.555 8.124 0.207 912 HE ARG 105 HE ARG 105 -6.231 8.976 2.573 913 HH11 ARG 105 1HH1 ARG 105 -8.747 9.882 0.404 914 HH12 ARG 105 2HH1 ARG 105 -9.682 10.648 1.641 915 HH21 ARG 105 1HH2 ARG 105 -7.453 9.982 4.161 916 HH22 ARG 105 2HH2 ARG 105 -8.959 10.709 3.721 917 H THR 106 H THR 106 -7.918 6.346 -3.370 918 HA THR 106 HA THR 106 -6.731 3.976 -4.635 919 HB THR 106 HB THR 106 -8.580 4.268 -6.320 920 HG1 THR 106 HG1 THR 106 -9.715 6.053 -6.246 921 HG21 THR 106 3HG2 THR 106 -8.841 2.713 -4.445 922 HG22 THR 106 1HG2 THR 106 -10.377 3.493 -4.824 923 HG23 THR 106 2HG2 THR 106 -9.441 4.021 -3.426 924 H VAL 107 H VAL 107 -5.292 4.107 -6.252 925 HA VAL 107 HA VAL 107 -5.150 6.582 -7.859 926 HB VAL 107 HB VAL 107 -2.657 6.326 -7.948 927 HG11 VAL 107 1HG1 VAL 107 -3.831 6.780 -5.199 928 HG12 VAL 107 2HG1 VAL 107 -3.686 7.985 -6.478 929 HG13 VAL 107 3HG1 VAL 107 -2.236 7.310 -5.735 930 HG21 VAL 107 3HG2 VAL 107 -3.099 4.367 -5.685 931 HG22 VAL 107 1HG2 VAL 107 -1.537 4.976 -6.233 932 HG23 VAL 107 2HG2 VAL 107 -2.512 3.964 -7.296 933 H THR 108 H THR 108 -4.755 6.325 -10.044 934 HA THR 108 HA THR 108 -4.682 3.532 -11.028 935 HB THR 108 HB THR 108 -5.889 4.347 -13.043 936 HG1 THR 108 HG1 THR 108 -6.033 6.434 -13.328 937 HG21 THR 108 3HG2 THR 108 -7.318 4.962 -10.445 938 HG22 THR 108 1HG2 THR 108 -7.136 3.357 -11.156 939 HG23 THR 108 2HG2 THR 108 -8.081 4.589 -11.992 940 H SER 109 H SER 109 -2.625 6.005 -10.710 941 HA SER 109 HA SER 109 -0.954 5.162 -12.898 942 HB2 SER 109 2HB SER 109 -2.298 6.730 -14.163 943 HB3 SER 109 3HB SER 109 -2.119 7.962 -12.916 944 HG SER 109 HG SER 109 -0.697 8.338 -14.647 945 HA PRO 110 HA PRO 110 2.355 6.240 -10.086 946 HB2 PRO 110 2HB PRO 110 3.648 7.356 -12.551 947 HB3 PRO 110 3HB PRO 110 4.313 6.262 -11.329 948 HG2 PRO 110 2HG PRO 110 3.538 5.305 -13.677 949 HG3 PRO 110 3HG PRO 110 3.184 4.407 -12.188 950 HD2 PRO 110 2HD PRO 110 1.357 6.061 -13.887 951 HD3 PRO 110 3HD PRO 110 1.023 4.557 -13.002 952 H ASP 111 H ASP 111 1.513 8.704 -12.540 953 HA ASP 111 HA ASP 111 2.495 10.926 -11.083 954 HB2 ASP 111 2HB ASP 111 0.439 10.713 -13.291 955 HB3 ASP 111 3HB ASP 111 0.975 12.254 -12.624 956 H ASP 112 H ASP 112 -0.860 9.706 -11.450 957 HA ASP 112 HA ASP 112 -2.092 11.413 -9.615 958 HB2 ASP 112 2HB ASP 112 -2.744 8.556 -10.372 959 HB3 ASP 112 3HB ASP 112 -3.796 9.561 -9.376 960 H PHE 113 H PHE 113 -0.257 8.470 -9.085 961 HA PHE 113 HA PHE 113 -0.742 8.164 -6.325 962 HB2 PHE 113 2HB PHE 113 0.251 6.346 -7.524 963 HB3 PHE 113 3HB PHE 113 1.581 7.355 -8.083 964 HD1 PHE 113 HD1 PHE 113 0.078 5.896 -5.007 965 HD2 PHE 113 HD2 PHE 113 3.582 7.438 -6.881 966 HE1 PHE 113 HE1 PHE 113 1.427 5.181 -3.079 967 HE2 PHE 113 HE2 PHE 113 4.933 6.726 -4.953 968 HZ PHE 113 HZ PHE 113 3.854 5.595 -3.049 969 H LYS 114 H LYS 114 1.924 9.821 -8.037 970 HA LYS 114 HA LYS 114 3.329 10.662 -5.764 971 HB2 LYS 114 2HB LYS 114 4.242 10.710 -8.068 972 HB3 LYS 114 3HB LYS 114 3.181 12.061 -8.445 973 HG2 LYS 114 2HG LYS 114 4.314 13.395 -6.682 974 HG3 LYS 114 3HG LYS 114 5.423 12.049 -6.420 975 HD2 LYS 114 2HD LYS 114 6.511 13.631 -7.853 976 HD3 LYS 114 3HD LYS 114 6.089 12.221 -8.827 977 HE2 LYS 114 2HE LYS 114 5.555 14.174 -10.102 978 HE3 LYS 114 3HE LYS 114 4.038 13.448 -9.576 979 HZ1 LYS 114 3HZ LYS 114 3.991 15.091 -7.747 980 HZ2 LYS 114 1HZ LYS 114 3.944 15.810 -9.279 981 HZ3 LYS 114 2HZ LYS 114 5.376 15.814 -8.386 982 H LYS 115 H LYS 115 1.019 12.571 -7.742 983 HA LYS 115 HA LYS 115 1.130 14.902 -6.191 984 HB2 LYS 115 2HB LYS 115 -0.994 15.533 -7.296 985 HB3 LYS 115 3HB LYS 115 0.209 14.928 -8.423 986 HG2 LYS 115 2HG LYS 115 -1.628 13.842 -9.209 987 HG3 LYS 115 3HG LYS 115 -1.066 12.647 -8.046 988 HD2 LYS 115 2HD LYS 115 -3.440 12.889 -7.793 989 HD3 LYS 115 3HD LYS 115 -2.670 13.619 -6.384 990 HE2 LYS 115 2HE LYS 115 -2.942 15.843 -7.389 991 HE3 LYS 115 3HE LYS 115 -3.699 15.108 -8.804 992 HZ1 LYS 115 3HZ LYS 115 -4.749 15.161 -6.032 993 HZ2 LYS 115 1HZ LYS 115 -5.421 14.223 -7.269 994 HZ3 LYS 115 2HZ LYS 115 -5.407 15.906 -7.399 995 H SER 116 H SER 116 -0.643 11.951 -5.657 996 HA SER 116 HA SER 116 -2.260 13.015 -3.513 997 HB2 SER 116 2HB SER 116 -1.673 10.160 -4.358 998 HB3 SER 116 3HB SER 116 -2.800 10.602 -3.076 999 HG SER 116 HG SER 116 -3.072 10.780 -5.824 1000 H LEU 117 H LEU 117 0.642 10.989 -3.749 1001 HA LEU 117 HA LEU 117 0.969 10.460 -1.017 1002 HB2 LEU 117 2HB LEU 117 2.092 9.261 -2.907 1003 HB3 LEU 117 3HB LEU 117 3.140 10.653 -3.112 1004 HG LEU 117 HG LEU 117 3.991 10.303 -0.795 1005 HD11 LEU 117 1HD1 LEU 117 2.079 9.133 0.151 1006 HD12 LEU 117 2HD1 LEU 117 3.547 8.170 0.326 1007 HD13 LEU 117 3HD1 LEU 117 2.370 7.760 -0.922 1008 HD21 LEU 117 3HD2 LEU 117 5.214 9.423 -2.735 1009 HD22 LEU 117 1HD2 LEU 117 4.308 7.912 -2.616 1010 HD23 LEU 117 2HD2 LEU 117 5.402 8.390 -1.318 1011 H GLU 118 H GLU 118 2.199 13.119 -3.022 1012 HA GLU 118 HA GLU 118 3.920 14.324 -1.177 1013 HB2 GLU 118 2HB GLU 118 2.239 15.621 -3.340 1014 HB3 GLU 118 3HB GLU 118 3.566 16.411 -2.496 1015 HG2 GLU 118 2HG GLU 118 5.126 14.742 -3.372 1016 HG3 GLU 118 3HG GLU 118 3.804 13.937 -4.210 1017 H ARG 119 H ARG 119 0.466 14.247 -1.240 1018 HA ARG 119 HA ARG 119 0.202 16.272 0.855 1019 HB2 ARG 119 2HB ARG 119 -1.753 14.570 -0.688 1020 HB3 ARG 119 3HB ARG 119 -2.256 15.449 0.751 1021 HG2 ARG 119 2HG ARG 119 -1.007 16.727 -1.679 1022 HG3 ARG 119 3HG ARG 119 -2.743 16.634 -1.368 1023 HD2 ARG 119 2HD ARG 119 -2.455 17.901 0.697 1024 HD3 ARG 119 3HD ARG 119 -0.713 17.970 0.426 1025 HE ARG 119 HE ARG 119 -1.781 19.084 -1.814 1026 HH11 ARG 119 1HH1 ARG 119 -2.134 19.682 1.550 1027 HH12 ARG 119 2HH1 ARG 119 -2.364 21.379 1.341 1028 HH21 ARG 119 1HH2 ARG 119 -2.097 21.255 -2.081 1029 HH22 ARG 119 2HH2 ARG 119 -2.361 22.260 -0.695 1030 H LEU 120 H LEU 120 -0.463 12.819 0.422 1031 HA LEU 120 HA LEU 120 -1.384 12.188 2.945 1032 HB2 LEU 120 2HB LEU 120 0.248 10.458 1.080 1033 HB3 LEU 120 3HB LEU 120 -0.721 9.868 2.418 1034 HG LEU 120 HG LEU 120 -1.783 11.272 -0.045 1035 HD11 LEU 120 1HD1 LEU 120 -1.026 9.009 -0.521 1036 HD12 LEU 120 2HD1 LEU 120 -2.785 9.114 -0.589 1037 HD13 LEU 120 3HD1 LEU 120 -1.999 8.388 0.814 1038 HD21 LEU 120 3HD2 LEU 120 -4.002 10.723 0.838 1039 HD22 LEU 120 1HD2 LEU 120 -3.122 11.809 1.914 1040 HD23 LEU 120 2HD2 LEU 120 -3.260 10.095 2.309 1041 H ILE 121 H ILE 121 1.987 12.310 1.837 1042 HA ILE 121 HA ILE 121 3.282 11.202 4.034 1043 HB ILE 121 HB ILE 121 4.174 13.443 2.208 1044 HG12 ILE 121 2HG1 ILE 121 4.899 10.497 2.289 1045 HG13 ILE 121 3HG1 ILE 121 3.785 11.238 1.145 1046 HG21 ILE 121 1HG2 ILE 121 5.420 13.628 4.291 1047 HG22 ILE 121 2HG2 ILE 121 6.467 13.020 3.010 1048 HG23 ILE 121 3HG2 ILE 121 5.829 11.913 4.226 1049 HD11 ILE 121 3HD1 ILE 121 5.956 10.856 0.137 1050 HD12 ILE 121 1HD1 ILE 121 6.727 11.836 1.385 1051 HD13 ILE 121 2HD1 ILE 121 5.612 12.582 0.239 1052 H ARG 122 H ARG 122 2.247 14.569 3.560 1053 HA ARG 122 HA ARG 122 3.440 15.624 5.902 1054 HB2 ARG 122 2HB ARG 122 0.951 16.705 4.570 1055 HB3 ARG 122 3HB ARG 122 2.155 17.598 5.491 1056 HG2 ARG 122 2HG ARG 122 3.805 17.195 3.727 1057 HG3 ARG 122 3HG ARG 122 2.599 16.295 2.807 1058 HD2 ARG 122 2HD ARG 122 1.177 18.398 2.873 1059 HD3 ARG 122 3HD ARG 122 2.607 19.234 3.480 1060 HE ARG 122 HE ARG 122 3.141 17.785 1.078 1061 HH11 ARG 122 1HH1 ARG 122 1.922 20.756 2.330 1062 HH12 ARG 122 2HH1 ARG 122 2.093 21.584 0.824 1063 HH21 ARG 122 1HH2 ARG 122 3.385 18.866 -0.832 1064 HH22 ARG 122 2HH2 ARG 122 2.925 20.528 -0.949 1065 H GLU 123 H GLU 123 0.360 14.070 5.297 1066 HA GLU 123 HA GLU 123 -0.783 14.825 7.844 1067 HB2 GLU 123 2HB GLU 123 -1.775 12.890 5.736 1068 HB3 GLU 123 3HB GLU 123 -2.705 13.470 7.113 1069 HG2 GLU 123 2HG GLU 123 -2.594 15.750 6.255 1070 HG3 GLU 123 3HG GLU 123 -1.618 15.203 4.894 1071 H VAL 124 H VAL 124 0.549 11.857 6.411 1072 HA VAL 124 HA VAL 124 -0.065 10.233 8.701 1073 HB VAL 124 HB VAL 124 0.107 9.322 6.383 1074 HG11 VAL 124 1HG1 VAL 124 3.082 9.681 6.776 1075 HG12 VAL 124 2HG1 VAL 124 2.070 10.541 5.615 1076 HG13 VAL 124 3HG1 VAL 124 2.314 8.802 5.452 1077 HG21 VAL 124 3HG2 VAL 124 1.215 7.225 7.015 1078 HG22 VAL 124 1HG2 VAL 124 0.181 7.828 8.313 1079 HG23 VAL 124 2HG2 VAL 124 1.932 8.026 8.415 1080 H GLY 125 H GLY 125 2.693 12.160 7.720 1081 HA2 GLY 125 2HA GLY 125 3.901 11.829 10.329 1082 HA3 GLY 125 3HA GLY 125 4.826 11.085 9.035 1083 H SER 126 H SER 126 3.628 14.132 10.329 1084 HA SER 126 HA SER 126 5.297 15.680 8.484 1085 HB2 SER 126 2HB SER 126 3.093 16.592 8.856 1086 HB3 SER 126 3HB SER 126 3.316 16.549 10.604 1087 HG SER 126 HG SER 126 3.852 18.544 9.012 1088 H LEU 127 H LEU 127 6.641 17.440 9.349 1089 HA LEU 127 HA LEU 127 8.268 16.502 11.582 1090 HB2 LEU 127 2HB LEU 127 9.819 18.339 10.869 1091 HB3 LEU 127 3HB LEU 127 9.519 17.107 9.661 1092 HG LEU 127 HG LEU 127 7.789 18.749 8.674 1093 HD11 LEU 127 1HD1 LEU 127 7.653 20.304 10.536 1094 HD12 LEU 127 2HD1 LEU 127 8.231 21.121 9.085 1095 HD13 LEU 127 3HD1 LEU 127 9.365 20.690 10.365 1096 HD21 LEU 127 3HD2 LEU 127 9.914 18.191 7.609 1097 HD22 LEU 127 1HD2 LEU 127 10.726 19.437 8.557 1098 HD23 LEU 127 2HD2 LEU 127 9.500 19.888 7.370 1099 H GLU 128 H GLU 128 5.708 18.644 11.105 1100 HA GLU 128 HA GLU 128 6.498 20.533 13.179 1101 HB2 GLU 128 2HB GLU 128 5.381 21.426 11.224 1102 HB3 GLU 128 3HB GLU 128 4.019 20.337 11.453 1103 HG2 GLU 128 2HG GLU 128 3.377 21.481 13.472 1104 HG3 GLU 128 3HG GLU 128 4.817 22.494 13.403 1105 H HIS 129 H HIS 129 6.294 19.882 15.223 1106 HA HIS 129 HA HIS 129 3.994 18.198 15.990 1107 HB2 HIS 129 2HB HIS 129 6.626 18.680 17.408 1108 HB3 HIS 129 3HB HIS 129 5.318 17.681 18.038 1109 HD1 HIS 129 HD1 HIS 129 4.945 15.366 16.911 1110 HD2 HIS 129 HD2 HIS 129 8.110 17.539 15.322 1111 HE1 HIS 129 HE1 HIS 129 6.220 13.748 15.474 1112 HE2 HIS 129 HE2 HIS 129 8.053 15.112 14.433 1113 H HIS 130 H HIS 130 4.917 21.381 16.010 1114 HA HIS 130 HA HIS 130 2.804 22.015 17.925 1115 HB2 HIS 130 2HB HIS 130 4.933 22.106 19.224 1116 HB3 HIS 130 3HB HIS 130 5.537 23.318 18.101 1117 HD1 HIS 130 HD1 HIS 130 4.619 25.709 18.326 1118 HD2 HIS 130 HD2 HIS 130 2.996 23.027 21.054 1119 HE1 HIS 130 HE1 HIS 130 3.381 27.112 19.995 1120 HE2 HIS 130 HE2 HIS 130 2.322 25.469 21.571 1121 H HIS 131 H HIS 131 1.500 23.571 17.133 1122 HA HIS 131 HA HIS 131 2.282 24.758 14.570 1123 HB2 HIS 131 2HB HIS 131 -0.457 24.658 15.854 1124 HB3 HIS 131 3HB HIS 131 -0.089 25.132 14.198 1125 HD1 HIS 131 HD1 HIS 131 0.282 23.257 12.484 1126 HD2 HIS 131 HD2 HIS 131 -0.265 21.863 16.361 1127 HE1 HIS 131 HE1 HIS 131 -0.038 20.782 12.268 1128 HE2 HIS 131 HE2 HIS 131 -0.132 19.943 14.637 1129 H HIS 132 H HIS 132 2.819 26.825 14.380 1130 HA HIS 132 HA HIS 132 2.184 28.710 16.552 1131 HB2 HIS 132 2HB HIS 132 4.566 28.464 15.942 1132 HB3 HIS 132 3HB HIS 132 4.191 28.934 14.288 1133 HD1 HIS 132 HD1 HIS 132 3.644 31.455 13.866 1134 HD2 HIS 132 HD2 HIS 132 4.784 30.568 17.766 1135 HE1 HIS 132 HE1 HIS 132 4.147 33.667 14.942 1136 HE2 HIS 132 HE2 HIS 132 4.735 33.115 17.322 1137 H HIS 133 H HIS 133 0.429 29.971 16.218 1138 HA HIS 133 HA HIS 133 0.002 31.288 13.674 1139 HB2 HIS 133 2HB HIS 133 -1.042 29.066 13.308 1140 HB3 HIS 133 3HB HIS 133 -2.088 29.341 14.695 1141 HD1 HIS 133 HD1 HIS 133 -3.912 31.262 14.413 1142 HD2 HIS 133 HD2 HIS 133 -1.890 30.188 10.941 1143 HE1 HIS 133 HE1 HIS 133 -5.274 32.200 12.523 1144 HE2 HIS 133 HE2 HIS 133 -4.115 31.411 10.436 1145 H HIS 134 H HIS 134 -1.128 33.166 13.875 1146 HA HIS 134 HA HIS 134 -2.213 33.864 16.517 1147 HB2 HIS 134 2HB HIS 134 -0.598 35.444 15.613 1148 HB3 HIS 134 3HB HIS 134 -1.512 35.581 14.115 1149 HD1 HIS 134 HD1 HIS 134 -1.907 36.396 17.814 1150 HD2 HIS 134 HD2 HIS 134 -3.337 37.612 14.104 1151 HE1 HIS 134 HE1 HIS 134 -3.326 38.416 18.266 1152 HE2 HIS 134 HE2 HIS 134 -4.228 39.103 16.022 Start of MODEL 10 1 H1 MET 1 1H MET 1 4.483 8.959 10.280 2 H2 MET 1 2H MET 1 3.382 9.625 11.376 3 H3 MET 1 3H MET 1 2.968 9.489 9.742 4 HA MET 1 HA MET 1 3.450 7.250 11.617 5 HB2 MET 1 2HB MET 1 1.322 8.493 11.966 6 HB3 MET 1 3HB MET 1 0.881 8.162 10.295 7 HG2 MET 1 2HG MET 1 -0.180 6.661 11.989 8 HG3 MET 1 3HG MET 1 0.702 5.830 10.709 9 HE1 MET 1 3HE MET 1 0.710 3.586 12.197 10 HE2 MET 1 1HE MET 1 -0.176 4.441 13.461 11 HE3 MET 1 2HE MET 1 1.286 3.539 13.863 12 H ASN 2 H ASN 2 2.838 5.132 10.695 13 HA ASN 2 HA ASN 2 4.235 4.645 8.297 14 HB2 ASN 2 2HB ASN 2 4.038 3.000 10.122 15 HB3 ASN 2 3HB ASN 2 2.321 2.817 9.775 16 HD21 ASN 2 1HD2 ASN 2 2.512 0.630 9.289 17 HD22 ASN 2 2HD2 ASN 2 3.291 0.067 7.857 18 H ILE 3 H ILE 3 3.541 3.796 6.300 19 HA ILE 3 HA ILE 3 0.711 4.035 5.589 20 HB ILE 3 HB ILE 3 1.527 6.208 4.991 21 HG12 ILE 3 2HG1 ILE 3 1.389 4.482 2.496 22 HG13 ILE 3 3HG1 ILE 3 0.009 5.143 3.365 23 HG21 ILE 3 1HG2 ILE 3 3.758 4.844 3.475 24 HG22 ILE 3 2HG2 ILE 3 3.919 5.735 4.989 25 HG23 ILE 3 3HG2 ILE 3 3.443 6.579 3.516 26 HD11 ILE 3 3HD1 ILE 3 0.734 7.403 2.813 27 HD12 ILE 3 1HD1 ILE 3 0.506 6.426 1.362 28 HD13 ILE 3 2HD1 ILE 3 2.134 6.748 1.960 29 H VAL 4 H VAL 4 0.065 2.382 4.351 30 HA VAL 4 HA VAL 4 2.117 0.596 3.206 31 HB VAL 4 HB VAL 4 -0.767 -0.060 3.867 32 HG11 VAL 4 1HG1 VAL 4 -0.019 -2.408 3.644 33 HG12 VAL 4 2HG1 VAL 4 1.560 -1.834 3.108 34 HG13 VAL 4 3HG1 VAL 4 0.126 -1.500 2.137 35 HG21 VAL 4 3HG2 VAL 4 1.741 -0.606 5.466 36 HG22 VAL 4 1HG2 VAL 4 0.150 -1.288 5.814 37 HG23 VAL 4 2HG2 VAL 4 0.406 0.453 5.921 38 H ILE 5 H ILE 5 2.058 0.022 1.046 39 HA ILE 5 HA ILE 5 -0.121 1.190 -0.589 40 HB ILE 5 HB ILE 5 2.773 0.801 -1.402 41 HG12 ILE 5 2HG1 ILE 5 1.197 3.342 -0.872 42 HG13 ILE 5 3HG1 ILE 5 2.442 2.673 0.178 43 HG21 ILE 5 1HG2 ILE 5 1.241 0.468 -3.280 44 HG22 ILE 5 2HG2 ILE 5 2.145 1.970 -3.468 45 HG23 ILE 5 3HG2 ILE 5 0.464 2.014 -2.936 46 HD11 ILE 5 3HD1 ILE 5 4.110 3.034 -1.551 47 HD12 ILE 5 1HD1 ILE 5 3.273 4.534 -1.153 48 HD13 ILE 5 2HD1 ILE 5 2.866 3.664 -2.631 49 H VAL 6 H VAL 6 -1.385 -0.304 -1.495 50 HA VAL 6 HA VAL 6 -0.383 -3.035 -1.907 51 HB VAL 6 HB VAL 6 -3.230 -1.999 -2.030 52 HG11 VAL 6 1HG1 VAL 6 -3.876 -4.365 -1.966 53 HG12 VAL 6 2HG1 VAL 6 -2.176 -4.833 -2.016 54 HG13 VAL 6 3HG1 VAL 6 -2.903 -4.004 -3.392 55 HG21 VAL 6 3HG2 VAL 6 -1.795 -3.496 0.172 56 HG22 VAL 6 1HG2 VAL 6 -3.519 -3.118 0.147 57 HG23 VAL 6 2HG2 VAL 6 -2.332 -1.816 0.228 58 H VAL 7 H VAL 7 0.427 -3.443 -3.881 59 HA VAL 7 HA VAL 7 -0.704 -2.029 -6.224 60 HB VAL 7 HB VAL 7 2.043 -3.278 -5.948 61 HG11 VAL 7 1HG1 VAL 7 0.853 -1.558 -8.129 62 HG12 VAL 7 2HG1 VAL 7 1.315 -3.254 -8.252 63 HG13 VAL 7 3HG1 VAL 7 2.552 -2.021 -8.018 64 HG21 VAL 7 3HG2 VAL 7 1.246 -0.364 -5.839 65 HG22 VAL 7 1HG2 VAL 7 2.897 -0.985 -5.824 66 HG23 VAL 7 2HG2 VAL 7 1.811 -1.337 -4.480 67 H PHE 8 H PHE 8 -1.872 -3.222 -7.603 68 HA PHE 8 HA PHE 8 -1.906 -6.119 -7.368 69 HB2 PHE 8 2HB PHE 8 -3.608 -4.104 -8.813 70 HB3 PHE 8 3HB PHE 8 -3.747 -5.818 -9.182 71 HD1 PHE 8 HD2 PHE 8 -3.934 -3.390 -6.358 72 HD2 PHE 8 HD1 PHE 8 -5.107 -7.195 -7.886 73 HE1 PHE 8 HE2 PHE 8 -5.478 -3.679 -4.463 74 HE2 PHE 8 HE1 PHE 8 -6.651 -7.481 -5.995 75 HZ PHE 8 HZ PHE 8 -6.840 -5.722 -4.281 76 H SER 9 H SER 9 0.432 -4.695 -8.725 77 HA SER 9 HA SER 9 0.326 -6.200 -11.270 78 HB2 SER 9 2HB SER 9 1.925 -4.593 -12.226 79 HB3 SER 9 3HB SER 9 0.464 -3.770 -11.682 80 HG SER 9 HG SER 9 2.850 -3.956 -10.148 81 H THR 10 H THR 10 1.384 -8.061 -10.916 82 HA THR 10 HA THR 10 3.262 -8.501 -8.871 83 HB THR 10 HB THR 10 3.694 -10.686 -9.906 84 HG1 THR 10 HG1 THR 10 3.681 -10.494 -12.057 85 HG21 THR 10 3HG2 THR 10 0.767 -9.915 -10.032 86 HG22 THR 10 1HG2 THR 10 1.644 -10.391 -8.575 87 HG23 THR 10 2HG2 THR 10 1.404 -11.552 -9.880 88 H ASP 11 H ASP 11 3.763 -7.677 -12.273 89 HA ASP 11 HA ASP 11 6.531 -8.284 -12.368 90 HB2 ASP 11 2HB ASP 11 4.908 -6.369 -14.058 91 HB3 ASP 11 3HB ASP 11 6.538 -6.925 -14.435 92 H GLU 12 H GLU 12 8.188 -7.282 -11.440 93 HA GLU 12 HA GLU 12 7.917 -4.952 -9.885 94 HB2 GLU 12 2HB GLU 12 10.427 -5.052 -9.706 95 HB3 GLU 12 3HB GLU 12 9.578 -6.516 -9.241 96 HG2 GLU 12 2HG GLU 12 11.484 -7.192 -10.454 97 HG3 GLU 12 3HG GLU 12 10.104 -7.435 -11.518 98 H GLU 13 H GLU 13 8.383 -5.226 -13.238 99 HA GLU 13 HA GLU 13 9.925 -2.991 -13.871 100 HB2 GLU 13 2HB GLU 13 9.240 -4.687 -15.504 101 HB3 GLU 13 3HB GLU 13 7.568 -4.157 -15.372 102 HG2 GLU 13 2HG GLU 13 8.251 -1.940 -16.255 103 HG3 GLU 13 3HG GLU 13 9.881 -2.572 -16.478 104 H THR 14 H THR 14 6.352 -3.170 -13.632 105 HA THR 14 HA THR 14 5.975 -0.343 -13.836 106 HB THR 14 HB THR 14 4.101 -2.483 -12.782 107 HG1 THR 14 HG1 THR 14 4.492 -2.728 -14.992 108 HG21 THR 14 3HG2 THR 14 2.305 -0.832 -13.078 109 HG22 THR 14 1HG2 THR 14 3.499 0.393 -13.509 110 HG23 THR 14 2HG2 THR 14 3.479 -0.286 -11.880 111 H LEU 15 H LEU 15 6.180 -2.605 -11.127 112 HA LEU 15 HA LEU 15 5.585 -0.893 -9.007 113 HB2 LEU 15 2HB LEU 15 5.812 -3.317 -8.781 114 HB3 LEU 15 3HB LEU 15 7.528 -3.205 -9.127 115 HG LEU 15 HG LEU 15 7.830 -1.891 -7.033 116 HD11 LEU 15 1HD1 LEU 15 4.929 -2.578 -6.554 117 HD12 LEU 15 2HD1 LEU 15 5.595 -0.966 -6.820 118 HD13 LEU 15 3HD1 LEU 15 6.029 -1.873 -5.371 119 HD21 LEU 15 3HD2 LEU 15 8.268 -4.277 -7.039 120 HD22 LEU 15 1HD2 LEU 15 6.565 -4.618 -6.721 121 HD23 LEU 15 2HD2 LEU 15 7.545 -3.800 -5.506 122 H ARG 16 H ARG 16 8.578 -1.358 -10.783 123 HA ARG 16 HA ARG 16 10.403 -0.015 -9.164 124 HB2 ARG 16 2HB ARG 16 10.886 -1.374 -11.225 125 HB3 ARG 16 3HB ARG 16 10.335 -0.015 -12.191 126 HG2 ARG 16 2HG ARG 16 12.140 1.369 -11.207 127 HG3 ARG 16 3HG ARG 16 12.720 -0.057 -10.342 128 HD2 ARG 16 2HD ARG 16 12.594 0.371 -13.326 129 HD3 ARG 16 3HD ARG 16 14.033 0.173 -12.327 130 HE ARG 16 HE ARG 16 12.997 -2.154 -11.886 131 HH11 ARG 16 1HH1 ARG 16 12.800 -0.425 -14.856 132 HH12 ARG 16 2HH1 ARG 16 12.716 -1.861 -15.813 133 HH21 ARG 16 1HH2 ARG 16 12.845 -3.994 -13.119 134 HH22 ARG 16 2HH2 ARG 16 12.741 -3.857 -14.841 135 H LYS 17 H LYS 17 8.085 1.242 -11.510 136 HA LYS 17 HA LYS 17 9.039 3.909 -11.599 137 HB2 LYS 17 2HB LYS 17 6.215 2.927 -12.093 138 HB3 LYS 17 3HB LYS 17 6.898 4.456 -12.633 139 HG2 LYS 17 2HG LYS 17 7.730 1.703 -13.533 140 HG3 LYS 17 3HG LYS 17 6.817 2.887 -14.469 141 HD2 LYS 17 2HD LYS 17 9.637 3.274 -13.450 142 HD3 LYS 17 3HD LYS 17 9.214 2.795 -15.093 143 HE2 LYS 17 2HE LYS 17 8.374 5.378 -13.766 144 HE3 LYS 17 3HE LYS 17 9.717 5.208 -14.896 145 HZ1 LYS 17 3HZ LYS 17 6.864 4.663 -15.503 146 HZ2 LYS 17 1HZ LYS 17 8.149 4.483 -16.585 147 HZ3 LYS 17 2HZ LYS 17 7.745 6.014 -16.003 148 H PHE 18 H PHE 18 6.708 2.277 -9.492 149 HA PHE 18 HA PHE 18 5.817 4.611 -8.136 150 HB2 PHE 18 2HB PHE 18 5.863 1.734 -7.180 151 HB3 PHE 18 3HB PHE 18 4.989 3.047 -6.395 152 HD1 PHE 18 HD2 PHE 18 3.562 4.454 -8.340 153 HD2 PHE 18 HD1 PHE 18 4.473 0.294 -8.304 154 HE1 PHE 18 HE2 PHE 18 1.615 4.016 -9.778 155 HE2 PHE 18 HE1 PHE 18 2.530 -0.148 -9.744 156 HZ PHE 18 HZ PHE 18 1.097 1.714 -10.482 157 H LYS 19 H LYS 19 8.450 2.316 -7.520 158 HA LYS 19 HA LYS 19 9.356 3.298 -5.065 159 HB2 LYS 19 2HB LYS 19 11.033 2.229 -7.354 160 HB3 LYS 19 3HB LYS 19 11.566 2.389 -5.686 161 HG2 LYS 19 2HG LYS 19 9.855 0.752 -5.001 162 HG3 LYS 19 3HG LYS 19 9.376 0.572 -6.692 163 HD2 LYS 19 2HD LYS 19 11.661 -0.186 -7.239 164 HD3 LYS 19 3HD LYS 19 12.106 -0.039 -5.539 165 HE2 LYS 19 2HE LYS 19 10.391 -1.722 -4.969 166 HE3 LYS 19 3HE LYS 19 10.018 -1.898 -6.685 167 HZ1 LYS 19 3HZ LYS 19 12.294 -2.637 -7.057 168 HZ2 LYS 19 1HZ LYS 19 11.521 -3.628 -5.925 169 HZ3 LYS 19 2HZ LYS 19 12.640 -2.472 -5.411 170 H ASP 20 H ASP 20 10.196 4.336 -8.355 171 HA ASP 20 HA ASP 20 12.057 6.322 -7.735 172 HB2 ASP 20 2HB ASP 20 11.674 5.474 -10.004 173 HB3 ASP 20 3HB ASP 20 10.074 6.209 -10.025 174 H ILE 21 H ILE 21 8.518 6.520 -7.926 175 HA ILE 21 HA ILE 21 8.337 9.327 -7.475 176 HB ILE 21 HB ILE 21 6.255 7.178 -6.995 177 HG12 ILE 21 2HG1 ILE 21 6.715 8.988 -9.390 178 HG13 ILE 21 3HG1 ILE 21 7.075 7.267 -9.326 179 HG21 ILE 21 1HG2 ILE 21 5.696 9.211 -5.779 180 HG22 ILE 21 2HG2 ILE 21 4.615 9.016 -7.158 181 HG23 ILE 21 3HG2 ILE 21 5.941 10.178 -7.234 182 HD11 ILE 21 3HD1 ILE 21 4.343 8.512 -9.118 183 HD12 ILE 21 1HD1 ILE 21 4.695 6.785 -9.028 184 HD13 ILE 21 2HD1 ILE 21 5.013 7.675 -10.518 185 H ILE 22 H ILE 22 8.171 6.518 -5.290 186 HA ILE 22 HA ILE 22 7.583 7.905 -2.913 187 HB ILE 22 HB ILE 22 9.146 5.342 -3.312 188 HG12 ILE 22 2HG1 ILE 22 6.261 5.832 -2.507 189 HG13 ILE 22 3HG1 ILE 22 6.796 5.290 -4.094 190 HG21 ILE 22 1HG2 ILE 22 9.738 6.290 -1.159 191 HG22 ILE 22 2HG2 ILE 22 8.692 4.891 -0.924 192 HG23 ILE 22 3HG2 ILE 22 8.037 6.520 -0.760 193 HD11 ILE 22 3HD1 ILE 22 5.928 3.450 -2.790 194 HD12 ILE 22 1HD1 ILE 22 7.096 3.775 -1.509 195 HD13 ILE 22 2HD1 ILE 22 7.651 3.232 -3.093 196 H LYS 23 H LYS 23 10.734 7.045 -4.349 197 HA LYS 23 HA LYS 23 12.362 8.091 -2.311 198 HB2 LYS 23 2HB LYS 23 12.950 7.818 -5.266 199 HB3 LYS 23 3HB LYS 23 14.158 8.132 -4.027 200 HG2 LYS 23 2HG LYS 23 12.442 5.662 -4.261 201 HG3 LYS 23 3HG LYS 23 14.155 5.786 -4.658 202 HD2 LYS 23 2HD LYS 23 12.958 6.210 -1.912 203 HD3 LYS 23 3HD LYS 23 13.768 4.741 -2.455 204 HE2 LYS 23 2HE LYS 23 15.035 7.479 -2.251 205 HE3 LYS 23 3HE LYS 23 15.251 6.160 -1.102 206 HZ1 LYS 23 3HZ LYS 23 16.090 6.179 -3.951 207 HZ2 LYS 23 1HZ LYS 23 16.213 4.839 -2.924 208 HZ3 LYS 23 2HZ LYS 23 17.103 6.240 -2.602 209 H LYS 24 H LYS 24 10.705 9.700 -4.939 210 HA LYS 24 HA LYS 24 12.057 12.140 -5.023 211 HB2 LYS 24 2HB LYS 24 10.326 11.579 -6.632 212 HB3 LYS 24 3HB LYS 24 9.106 11.553 -5.365 213 HG2 LYS 24 2HG LYS 24 9.434 13.965 -5.014 214 HG3 LYS 24 3HG LYS 24 10.639 13.981 -6.304 215 HD2 LYS 24 2HD LYS 24 8.914 13.218 -7.899 216 HD3 LYS 24 3HD LYS 24 7.717 13.254 -6.602 217 HE2 LYS 24 2HE LYS 24 7.586 15.265 -7.995 218 HE3 LYS 24 3HE LYS 24 8.056 15.660 -6.342 219 HZ1 LYS 24 3HZ LYS 24 10.334 15.862 -7.050 220 HZ2 LYS 24 1HZ LYS 24 9.360 16.859 -8.005 221 HZ3 LYS 24 2HZ LYS 24 9.935 15.394 -8.626 222 H ASN 25 H ASN 25 9.757 10.928 -2.666 223 HA ASN 25 HA ASN 25 9.602 13.524 -1.316 224 HB2 ASN 25 2HB ASN 25 8.202 10.926 -0.630 225 HB3 ASN 25 3HB ASN 25 7.855 12.513 0.050 226 HD21 ASN 25 1HD2 ASN 25 7.514 10.448 -2.709 227 HD22 ASN 25 2HD2 ASN 25 6.374 11.427 -3.551 228 H GLY 26 H GLY 26 11.620 10.874 -1.244 229 HA2 GLY 26 2HA GLY 26 13.527 10.672 0.076 230 HA3 GLY 26 3HA GLY 26 12.856 11.841 1.193 231 H PHE 27 H PHE 27 11.330 8.786 0.175 232 HA PHE 27 HA PHE 27 11.656 7.808 2.951 233 HB2 PHE 27 2HB PHE 27 9.297 7.520 1.085 234 HB3 PHE 27 3HB PHE 27 9.496 6.530 2.527 235 HD1 PHE 27 HD2 PHE 27 9.229 10.057 1.382 236 HD2 PHE 27 HD1 PHE 27 8.791 7.316 4.616 237 HE1 PHE 27 HE2 PHE 27 8.189 11.820 2.736 238 HE2 PHE 27 HE1 PHE 27 7.746 9.081 5.976 239 HZ PHE 27 HZ PHE 27 7.444 11.339 5.033 240 H LYS 28 H LYS 28 11.921 5.562 3.288 241 HA LYS 28 HA LYS 28 13.324 4.179 1.159 242 HB2 LYS 28 2HB LYS 28 12.657 3.247 3.968 243 HB3 LYS 28 3HB LYS 28 13.774 2.461 2.862 244 HG2 LYS 28 2HG LYS 28 14.112 5.188 4.113 245 HG3 LYS 28 3HG LYS 28 14.979 3.714 4.546 246 HD2 LYS 28 2HD LYS 28 15.818 3.673 2.140 247 HD3 LYS 28 3HD LYS 28 15.178 5.310 1.993 248 HE2 LYS 28 2HE LYS 28 17.299 4.377 3.937 249 HE3 LYS 28 3HE LYS 28 17.554 5.378 2.508 250 HZ1 LYS 28 3HZ LYS 28 16.190 7.101 3.533 251 HZ2 LYS 28 1HZ LYS 28 17.515 6.710 4.509 252 HZ3 LYS 28 2HZ LYS 28 15.976 6.139 4.906 253 H VAL 29 H VAL 29 12.709 2.197 0.208 254 HA VAL 29 HA VAL 29 9.805 1.632 0.353 255 HB VAL 29 HB VAL 29 11.718 0.963 -1.902 256 HG11 VAL 29 1HG1 VAL 29 9.773 -0.525 -1.770 257 HG12 VAL 29 2HG1 VAL 29 9.698 0.505 -3.199 258 HG13 VAL 29 3HG1 VAL 29 8.697 0.871 -1.793 259 HG21 VAL 29 3HG2 VAL 29 9.729 3.232 -1.694 260 HG22 VAL 29 1HG2 VAL 29 10.659 2.810 -3.133 261 HG23 VAL 29 2HG2 VAL 29 11.486 3.383 -1.685 262 H ARG 30 H ARG 30 9.122 -0.307 1.099 263 HA ARG 30 HA ARG 30 10.976 -2.614 1.005 264 HB2 ARG 30 2HB ARG 30 10.481 -1.440 3.326 265 HB3 ARG 30 3HB ARG 30 8.979 -2.343 3.235 266 HG2 ARG 30 2HG ARG 30 11.574 -3.783 2.875 267 HG3 ARG 30 3HG ARG 30 11.069 -3.304 4.492 268 HD2 ARG 30 2HD ARG 30 10.100 -5.352 4.463 269 HD3 ARG 30 3HD ARG 30 8.801 -4.472 3.669 270 HE ARG 30 HE ARG 30 9.701 -5.306 1.539 271 HH11 ARG 30 1HH1 ARG 30 10.805 -6.880 4.406 272 HH12 ARG 30 2HH1 ARG 30 10.991 -8.412 3.625 273 HH21 ARG 30 1HH2 ARG 30 9.950 -7.295 0.556 274 HH22 ARG 30 2HH2 ARG 30 10.498 -8.648 1.475 275 H THR 31 H THR 31 10.074 -3.674 -0.720 276 HA THR 31 HA THR 31 7.181 -3.802 -1.052 277 HB THR 31 HB THR 31 7.662 -4.949 -3.180 278 HG1 THR 31 HG1 THR 31 9.825 -5.762 -2.126 279 HG21 THR 31 3HG2 THR 31 8.824 -3.098 -4.302 280 HG22 THR 31 1HG2 THR 31 9.364 -2.490 -2.738 281 HG23 THR 31 2HG2 THR 31 7.646 -2.501 -3.133 282 H VAL 32 H VAL 32 5.900 -5.537 -0.695 283 HA VAL 32 HA VAL 32 7.167 -8.002 0.335 284 HB VAL 32 HB VAL 32 4.649 -6.602 1.262 285 HG11 VAL 32 1HG1 VAL 32 4.389 -8.470 2.876 286 HG12 VAL 32 2HG1 VAL 32 5.656 -9.347 2.023 287 HG13 VAL 32 3HG1 VAL 32 4.146 -8.963 1.202 288 HG21 VAL 32 3HG2 VAL 32 6.729 -5.714 2.187 289 HG22 VAL 32 1HG2 VAL 32 7.198 -7.332 2.717 290 HG23 VAL 32 2HG2 VAL 32 5.793 -6.542 3.432 291 H ARG 33 H ARG 33 6.588 -9.895 -0.580 292 HA ARG 33 HA ARG 33 4.068 -10.004 -2.133 293 HB2 ARG 33 2HB ARG 33 5.892 -10.298 -3.661 294 HB3 ARG 33 3HB ARG 33 6.682 -11.454 -2.597 295 HG2 ARG 33 2HG ARG 33 5.018 -13.116 -3.035 296 HG3 ARG 33 3HG ARG 33 4.005 -11.955 -3.893 297 HD2 ARG 33 2HD ARG 33 6.770 -12.764 -4.793 298 HD3 ARG 33 3HD ARG 33 5.288 -13.532 -5.363 299 HE ARG 33 HE ARG 33 5.077 -10.762 -5.737 300 HH11 ARG 33 1HH1 ARG 33 6.825 -13.458 -6.993 301 HH12 ARG 33 2HH1 ARG 33 6.993 -12.748 -8.561 302 HH21 ARG 33 1HH2 ARG 33 5.282 -9.883 -7.745 303 HH22 ARG 33 2HH2 ARG 33 6.108 -10.754 -8.991 304 H SER 34 H SER 34 6.201 -11.747 0.084 305 HA SER 34 HA SER 34 4.115 -13.762 0.578 306 HB2 SER 34 2HB SER 34 7.040 -13.673 1.376 307 HB3 SER 34 3HB SER 34 5.923 -14.953 1.853 308 HG SER 34 HG SER 34 7.183 -14.527 -0.542 309 HA PRO 35 HA PRO 35 2.643 -11.862 4.295 310 HB2 PRO 35 2HB PRO 35 2.271 -14.199 5.804 311 HB3 PRO 35 3HB PRO 35 1.095 -13.473 4.705 312 HG2 PRO 35 2HG PRO 35 2.989 -15.733 4.234 313 HG3 PRO 35 3HG PRO 35 1.327 -15.517 3.653 314 HD2 PRO 35 2HD PRO 35 3.423 -15.134 2.029 315 HD3 PRO 35 3HD PRO 35 1.985 -14.094 1.927 316 H GLN 36 H GLN 36 5.238 -14.268 4.566 317 HA GLN 36 HA GLN 36 6.141 -13.708 7.148 318 HB2 GLN 36 2HB GLN 36 7.009 -15.575 5.862 319 HB3 GLN 36 3HB GLN 36 7.718 -14.483 4.682 320 HG2 GLN 36 2HG GLN 36 9.244 -13.626 6.403 321 HG3 GLN 36 3HG GLN 36 8.535 -14.738 7.574 322 HE21 GLN 36 1HE2 GLN 36 8.988 -16.936 7.409 323 HE22 GLN 36 2HE2 GLN 36 10.289 -17.533 6.446 324 H GLU 37 H GLU 37 7.086 -12.159 4.076 325 HA GLU 37 HA GLU 37 9.039 -10.422 5.068 326 HB2 GLU 37 2HB GLU 37 7.158 -9.928 2.748 327 HB3 GLU 37 3HB GLU 37 8.692 -9.117 3.025 328 HG2 GLU 37 2HG GLU 37 9.868 -11.243 2.728 329 HG3 GLU 37 3HG GLU 37 8.328 -12.058 2.460 330 H LEU 38 H LEU 38 5.538 -10.001 4.817 331 HA LEU 38 HA LEU 38 5.462 -7.297 5.679 332 HB2 LEU 38 2HB LEU 38 3.600 -8.411 4.497 333 HB3 LEU 38 3HB LEU 38 3.328 -9.435 5.894 334 HG LEU 38 HG LEU 38 2.729 -7.440 7.232 335 HD11 LEU 38 1HD1 LEU 38 4.063 -5.779 6.018 336 HD12 LEU 38 2HD1 LEU 38 2.376 -5.287 6.146 337 HD13 LEU 38 3HD1 LEU 38 2.993 -5.935 4.625 338 HD21 LEU 38 3HD2 LEU 38 1.160 -7.745 4.667 339 HD22 LEU 38 1HD2 LEU 38 0.568 -7.006 6.156 340 HD23 LEU 38 2HD2 LEU 38 0.974 -8.722 6.124 341 H LYS 39 H LYS 39 5.427 -10.380 7.419 342 HA LYS 39 HA LYS 39 4.863 -9.263 9.975 343 HB2 LYS 39 2HB LYS 39 4.585 -11.679 9.421 344 HB3 LYS 39 3HB LYS 39 6.338 -11.838 9.362 345 HG2 LYS 39 2HG LYS 39 6.456 -11.143 11.728 346 HG3 LYS 39 3HG LYS 39 4.695 -11.063 11.772 347 HD2 LYS 39 2HD LYS 39 4.595 -13.476 11.230 348 HD3 LYS 39 3HD LYS 39 6.360 -13.536 11.251 349 HE2 LYS 39 2HE LYS 39 6.314 -12.764 13.609 350 HE3 LYS 39 3HE LYS 39 4.553 -12.834 13.567 351 HZ1 LYS 39 3HZ LYS 39 5.457 -14.804 14.575 352 HZ2 LYS 39 1HZ LYS 39 6.409 -15.124 13.213 353 HZ3 LYS 39 2HZ LYS 39 4.721 -15.218 13.108 354 H ASP 40 H ASP 40 7.883 -9.993 8.247 355 HA ASP 40 HA ASP 40 9.777 -9.523 10.202 356 HB2 ASP 40 2HB ASP 40 9.944 -8.629 7.307 357 HB3 ASP 40 3HB ASP 40 11.309 -8.830 8.399 358 H SER 41 H SER 41 8.158 -7.129 8.144 359 HA SER 41 HA SER 41 9.507 -4.833 9.046 360 HB2 SER 41 2HB SER 41 7.759 -3.557 8.001 361 HB3 SER 41 3HB SER 41 7.988 -5.005 7.019 362 HG SER 41 HG SER 41 6.086 -5.773 7.667 363 H ILE 42 H ILE 42 6.370 -6.163 10.096 364 HA ILE 42 HA ILE 42 5.819 -4.288 12.103 365 HB ILE 42 HB ILE 42 4.957 -7.188 11.944 366 HG12 ILE 42 2HG1 ILE 42 3.608 -4.635 11.001 367 HG13 ILE 42 3HG1 ILE 42 4.315 -5.873 9.968 368 HG21 ILE 42 1HG2 ILE 42 3.100 -6.539 13.417 369 HG22 ILE 42 2HG2 ILE 42 3.784 -4.919 13.566 370 HG23 ILE 42 3HG2 ILE 42 4.660 -6.308 14.207 371 HD11 ILE 42 3HD1 ILE 42 1.907 -6.054 10.015 372 HD12 ILE 42 1HD1 ILE 42 1.928 -6.214 11.771 373 HD13 ILE 42 2HD1 ILE 42 2.642 -7.473 10.761 374 H GLU 43 H GLU 43 7.700 -7.284 12.228 375 HA GLU 43 HA GLU 43 8.054 -7.322 15.050 376 HB2 GLU 43 2HB GLU 43 9.748 -8.567 12.868 377 HB3 GLU 43 3HB GLU 43 9.909 -8.910 14.586 378 HG2 GLU 43 2HG GLU 43 7.560 -9.721 14.589 379 HG3 GLU 43 3HG GLU 43 7.525 -9.500 12.841 380 H GLU 44 H GLU 44 9.522 -5.431 12.563 381 HA GLU 44 HA GLU 44 11.770 -4.649 14.247 382 HB2 GLU 44 2HB GLU 44 10.946 -3.864 11.455 383 HB3 GLU 44 3HB GLU 44 12.286 -3.099 12.297 384 HG2 GLU 44 2HG GLU 44 12.060 -6.036 11.651 385 HG3 GLU 44 3HG GLU 44 13.045 -4.857 10.784 386 H LEU 45 H LEU 45 8.560 -3.534 13.619 387 HA LEU 45 HA LEU 45 8.801 -0.792 14.074 388 HB2 LEU 45 2HB LEU 45 6.560 -2.652 14.881 389 HB3 LEU 45 3HB LEU 45 6.453 -0.902 14.920 390 HG LEU 45 HG LEU 45 6.847 -2.593 12.441 391 HD11 LEU 45 1HD1 LEU 45 4.605 -1.834 11.838 392 HD12 LEU 45 2HD1 LEU 45 4.472 -0.983 13.378 393 HD13 LEU 45 3HD1 LEU 45 4.588 -2.744 13.348 394 HD21 LEU 45 3HD2 LEU 45 6.611 -0.502 11.199 395 HD22 LEU 45 1HD2 LEU 45 8.012 -0.445 12.268 396 HD23 LEU 45 2HD2 LEU 45 6.530 0.399 12.713 397 H VAL 46 H VAL 46 8.674 -3.439 16.420 398 HA VAL 46 HA VAL 46 8.555 -1.919 18.779 399 HB VAL 46 HB VAL 46 8.246 -4.347 18.796 400 HG11 VAL 46 1HG1 VAL 46 11.209 -4.539 18.229 401 HG12 VAL 46 2HG1 VAL 46 9.913 -4.951 17.106 402 HG13 VAL 46 3HG1 VAL 46 10.130 -5.890 18.584 403 HG21 VAL 46 3HG2 VAL 46 10.602 -3.506 20.494 404 HG22 VAL 46 1HG2 VAL 46 9.549 -4.888 20.798 405 HG23 VAL 46 2HG2 VAL 46 8.900 -3.250 20.885 406 H LYS 47 H LYS 47 11.237 -2.664 16.651 407 HA LYS 47 HA LYS 47 13.326 -1.756 18.390 408 HB2 LYS 47 2HB LYS 47 13.434 -1.871 15.367 409 HB3 LYS 47 3HB LYS 47 14.777 -1.984 16.496 410 HG2 LYS 47 2HG LYS 47 12.588 -4.045 16.269 411 HG3 LYS 47 3HG LYS 47 14.125 -4.135 15.409 412 HD2 LYS 47 2HD LYS 47 15.305 -4.126 17.589 413 HD3 LYS 47 3HD LYS 47 13.739 -4.119 18.409 414 HE2 LYS 47 2HE LYS 47 14.696 -6.381 18.281 415 HE3 LYS 47 3HE LYS 47 13.174 -6.260 17.401 416 HZ1 LYS 47 3HZ LYS 47 14.403 -6.091 15.336 417 HZ2 LYS 47 1HZ LYS 47 14.850 -7.497 16.166 418 HZ3 LYS 47 2HZ LYS 47 15.875 -6.152 16.171 419 H LYS 48 H LYS 48 12.393 -0.376 15.238 420 HA LYS 48 HA LYS 48 12.226 2.313 16.399 421 HB2 LYS 48 2HB LYS 48 14.039 1.571 14.089 422 HB3 LYS 48 3HB LYS 48 13.652 3.219 14.557 423 HG2 LYS 48 2HG LYS 48 14.740 2.879 16.711 424 HG3 LYS 48 3HG LYS 48 15.099 1.205 16.277 425 HD2 LYS 48 2HD LYS 48 17.046 2.680 15.942 426 HD3 LYS 48 3HD LYS 48 16.499 1.961 14.426 427 HE2 LYS 48 2HE LYS 48 15.223 4.079 13.986 428 HE3 LYS 48 3HE LYS 48 16.001 4.773 15.409 429 HZ1 LYS 48 3HZ LYS 48 17.425 3.726 13.026 430 HZ2 LYS 48 1HZ LYS 48 18.136 4.467 14.370 431 HZ3 LYS 48 2HZ LYS 48 17.130 5.358 13.344 432 H TYR 49 H TYR 49 10.371 3.219 15.673 433 HA TYR 49 HA TYR 49 9.056 2.328 13.283 434 HB2 TYR 49 2HB TYR 49 7.481 4.237 13.725 435 HB3 TYR 49 3HB TYR 49 7.646 3.105 15.059 436 HD1 TYR 49 HD2 TYR 49 9.188 3.773 17.007 437 HD2 TYR 49 HD1 TYR 49 7.840 6.554 14.072 438 HE1 TYR 49 HE2 TYR 49 9.703 5.629 18.532 439 HE2 TYR 49 HE1 TYR 49 8.355 8.413 15.595 440 HH TYR 49 HH TYR 49 10.256 8.068 18.339 441 H ASN 50 H ASN 50 10.906 2.630 11.859 442 HA ASN 50 HA ASN 50 11.865 5.305 11.317 443 HB2 ASN 50 2HB ASN 50 13.375 3.339 11.257 444 HB3 ASN 50 3HB ASN 50 12.476 2.706 9.881 445 HD21 ASN 50 1HD2 ASN 50 14.280 2.757 8.543 446 HD22 ASN 50 2HD2 ASN 50 14.934 4.238 7.937 447 H ALA 51 H ALA 51 11.791 6.351 9.246 448 HA ALA 51 HA ALA 51 9.210 6.285 8.032 449 HB1 ALA 51 3HB ALA 51 10.062 8.061 6.582 450 HB2 ALA 51 1HB ALA 51 11.698 7.760 7.170 451 HB3 ALA 51 2HB ALA 51 10.462 8.364 8.273 452 H THR 52 H THR 52 9.171 4.052 7.320 453 HA THR 52 HA THR 52 10.376 3.731 4.640 454 HB THR 52 HB THR 52 10.111 1.545 6.730 455 HG1 THR 52 HG1 THR 52 11.977 3.232 6.608 456 HG21 THR 52 3HG2 THR 52 11.144 1.405 3.888 457 HG22 THR 52 1HG2 THR 52 9.654 0.677 4.486 458 HG23 THR 52 2HG2 THR 52 11.215 0.098 5.068 459 H ILE 53 H ILE 53 8.844 3.521 3.139 460 HA ILE 53 HA ILE 53 6.111 2.884 3.896 461 HB ILE 53 HB ILE 53 7.266 3.570 1.179 462 HG12 ILE 53 2HG1 ILE 53 5.787 5.271 3.214 463 HG13 ILE 53 3HG1 ILE 53 7.480 5.434 2.758 464 HG21 ILE 53 1HG2 ILE 53 4.391 3.368 2.098 465 HG22 ILE 53 2HG2 ILE 53 5.211 2.282 0.974 466 HG23 ILE 53 3HG2 ILE 53 4.920 3.961 0.525 467 HD11 ILE 53 3HD1 ILE 53 6.777 6.048 0.483 468 HD12 ILE 53 1HD1 ILE 53 6.157 7.152 1.707 469 HD13 ILE 53 2HD1 ILE 53 5.094 5.941 0.993 470 H VAL 54 H VAL 54 5.441 0.833 3.991 471 HA VAL 54 HA VAL 54 6.862 -1.253 2.540 472 HB VAL 54 HB VAL 54 6.316 -1.724 4.847 473 HG11 VAL 54 1HG1 VAL 54 4.013 -1.965 5.641 474 HG12 VAL 54 2HG1 VAL 54 3.410 -1.413 4.078 475 HG13 VAL 54 3HG1 VAL 54 4.340 -0.317 5.101 476 HG21 VAL 54 3HG2 VAL 54 6.377 -3.612 3.307 477 HG22 VAL 54 1HG2 VAL 54 4.657 -3.416 2.968 478 HG23 VAL 54 2HG2 VAL 54 5.190 -3.891 4.581 479 H VAL 55 H VAL 55 6.300 -1.872 0.582 480 HA VAL 55 HA VAL 55 3.604 -1.237 -0.423 481 HB VAL 55 HB VAL 55 6.129 -1.799 -1.997 482 HG11 VAL 55 1HG1 VAL 55 4.853 -0.909 -3.910 483 HG12 VAL 55 2HG1 VAL 55 3.418 -0.815 -2.890 484 HG13 VAL 55 3HG1 VAL 55 4.139 -2.383 -3.254 485 HG21 VAL 55 3HG2 VAL 55 6.166 0.609 -2.465 486 HG22 VAL 55 1HG2 VAL 55 6.313 0.290 -0.736 487 HG23 VAL 55 2HG2 VAL 55 4.776 0.840 -1.405 488 H VAL 56 H VAL 56 2.316 -2.981 -0.139 489 HA VAL 56 HA VAL 56 3.333 -5.682 -0.462 490 HB VAL 56 HB VAL 56 0.501 -4.766 0.108 491 HG11 VAL 56 1HG1 VAL 56 0.151 -7.072 0.901 492 HG12 VAL 56 2HG1 VAL 56 1.779 -7.496 0.371 493 HG13 VAL 56 3HG1 VAL 56 0.561 -7.018 -0.813 494 HG21 VAL 56 3HG2 VAL 56 2.651 -5.692 2.027 495 HG22 VAL 56 1HG2 VAL 56 0.981 -5.315 2.450 496 HG23 VAL 56 2HG2 VAL 56 2.051 -4.041 1.862 497 H VAL 57 H VAL 57 3.584 -6.447 -2.464 498 HA VAL 57 HA VAL 57 1.864 -5.559 -4.650 499 HB VAL 57 HB VAL 57 4.200 -7.483 -4.745 500 HG11 VAL 57 1HG1 VAL 57 4.229 -6.943 -7.150 501 HG12 VAL 57 2HG1 VAL 57 2.781 -5.958 -6.938 502 HG13 VAL 57 3HG1 VAL 57 2.713 -7.700 -6.661 503 HG21 VAL 57 3HG2 VAL 57 4.899 -5.296 -3.897 504 HG22 VAL 57 1HG2 VAL 57 4.152 -4.512 -5.291 505 HG23 VAL 57 2HG2 VAL 57 5.533 -5.585 -5.518 506 H VAL 58 H VAL 58 -0.012 -6.589 -4.940 507 HA VAL 58 HA VAL 58 -0.232 -9.407 -4.109 508 HB VAL 58 HB VAL 58 -2.628 -9.031 -3.810 509 HG11 VAL 58 1HG1 VAL 58 -2.520 -7.491 -1.884 510 HG12 VAL 58 2HG1 VAL 58 -0.922 -6.962 -2.412 511 HG13 VAL 58 3HG1 VAL 58 -1.173 -8.631 -1.902 512 HG21 VAL 58 3HG2 VAL 58 -2.996 -7.349 -5.534 513 HG22 VAL 58 1HG2 VAL 58 -2.045 -6.178 -4.623 514 HG23 VAL 58 2HG2 VAL 58 -3.577 -6.765 -3.975 515 H ASP 59 H ASP 59 -1.211 -10.926 -5.395 516 HA ASP 59 HA ASP 59 -1.381 -10.370 -8.233 517 HB2 ASP 59 2HB ASP 59 -2.068 -12.919 -8.192 518 HB3 ASP 59 3HB ASP 59 -0.397 -12.436 -7.922 519 H ASP 60 H ASP 60 -3.638 -11.855 -5.882 520 HA ASP 60 HA ASP 60 -5.878 -10.677 -7.412 521 HB2 ASP 60 2HB ASP 60 -5.767 -13.336 -5.970 522 HB3 ASP 60 3HB ASP 60 -7.238 -12.633 -6.635 523 H LYS 61 H LYS 61 -7.963 -10.696 -6.008 524 HA LYS 61 HA LYS 61 -7.631 -8.979 -3.801 525 HB2 LYS 61 2HB LYS 61 -10.011 -10.709 -4.533 526 HB3 LYS 61 3HB LYS 61 -10.035 -9.419 -3.337 527 HG2 LYS 61 2HG LYS 61 -9.526 -7.777 -5.069 528 HG3 LYS 61 3HG LYS 61 -9.454 -9.063 -6.279 529 HD2 LYS 61 2HD LYS 61 -11.617 -7.912 -6.356 530 HD3 LYS 61 3HD LYS 61 -11.821 -9.590 -5.851 531 HE2 LYS 61 2HE LYS 61 -11.854 -8.789 -3.476 532 HE3 LYS 61 3HE LYS 61 -11.850 -7.135 -4.088 533 HZ1 LYS 61 3HZ LYS 61 -14.081 -7.949 -3.545 534 HZ2 LYS 61 1HZ LYS 61 -13.925 -9.168 -4.702 535 HZ3 LYS 61 2HZ LYS 61 -13.946 -7.546 -5.179 536 H GLU 62 H GLU 62 -7.720 -12.462 -4.008 537 HA GLU 62 HA GLU 62 -8.316 -13.209 -1.409 538 HB2 GLU 62 2HB GLU 62 -8.029 -14.784 -3.278 539 HB3 GLU 62 3HB GLU 62 -6.300 -14.471 -3.284 540 HG2 GLU 62 2HG GLU 62 -6.846 -16.588 -2.195 541 HG3 GLU 62 3HG GLU 62 -6.076 -15.457 -1.084 542 H TRP 63 H TRP 63 -4.987 -12.840 -2.683 543 HA TRP 63 HA TRP 63 -3.723 -12.926 -0.167 544 HB2 TRP 63 2HB TRP 63 -2.430 -13.403 -2.109 545 HB3 TRP 63 3HB TRP 63 -2.857 -11.876 -2.862 546 HD1 TRP 63 HD1 TRP 63 -0.518 -10.888 -3.200 547 HE1 TRP 63 HE1 TRP 63 1.388 -10.132 -1.657 548 HE3 TRP 63 HE3 TRP 63 -2.214 -12.842 1.216 549 HZ2 TRP 63 HZ2 TRP 63 2.090 -10.329 1.069 550 HZ3 TRP 63 HZ3 TRP 63 -0.860 -12.515 3.243 551 HH2 TRP 63 HH2 TRP 63 1.250 -11.284 3.170 552 H ALA 64 H ALA 64 -4.911 -10.182 -2.089 553 HA ALA 64 HA ALA 64 -3.965 -8.069 -0.535 554 HB1 ALA 64 3HB ALA 64 -6.635 -8.231 -1.941 555 HB2 ALA 64 1HB ALA 64 -5.104 -7.781 -2.694 556 HB3 ALA 64 2HB ALA 64 -5.806 -6.757 -1.440 557 H GLU 65 H GLU 65 -6.943 -9.969 -0.127 558 HA GLU 65 HA GLU 65 -7.922 -8.690 2.175 559 HB2 GLU 65 2HB GLU 65 -8.317 -11.436 1.008 560 HB3 GLU 65 3HB GLU 65 -9.041 -11.012 2.551 561 HG2 GLU 65 2HG GLU 65 -9.487 -9.449 0.015 562 HG3 GLU 65 3HG GLU 65 -10.536 -10.756 0.564 563 H LYS 66 H LYS 66 -5.910 -11.633 1.885 564 HA LYS 66 HA LYS 66 -5.648 -12.229 4.592 565 HB2 LYS 66 2HB LYS 66 -4.863 -13.687 2.747 566 HB3 LYS 66 3HB LYS 66 -3.544 -12.568 2.436 567 HG2 LYS 66 2HG LYS 66 -2.710 -14.440 3.688 568 HG3 LYS 66 3HG LYS 66 -2.679 -13.008 4.717 569 HD2 LYS 66 2HD LYS 66 -4.786 -13.743 5.774 570 HD3 LYS 66 3HD LYS 66 -4.781 -15.185 4.758 571 HE2 LYS 66 2HE LYS 66 -3.931 -15.719 6.967 572 HE3 LYS 66 3HE LYS 66 -2.639 -15.869 5.775 573 HZ1 LYS 66 3HZ LYS 66 -1.787 -13.736 6.448 574 HZ2 LYS 66 1HZ LYS 66 -1.927 -14.730 7.809 575 HZ3 LYS 66 2HZ LYS 66 -3.065 -13.514 7.530 576 H ALA 67 H ALA 67 -3.726 -10.013 2.598 577 HA ALA 67 HA ALA 67 -1.835 -9.240 4.516 578 HB1 ALA 67 3HB ALA 67 -2.975 -7.609 2.243 579 HB2 ALA 67 1HB ALA 67 -1.607 -8.719 2.142 580 HB3 ALA 67 2HB ALA 67 -1.485 -7.255 3.120 581 H ILE 68 H ILE 68 -4.902 -7.596 3.631 582 HA ILE 68 HA ILE 68 -4.758 -5.569 5.574 583 HB ILE 68 HB ILE 68 -7.242 -6.808 4.361 584 HG12 ILE 68 2HG1 ILE 68 -5.716 -5.939 2.653 585 HG13 ILE 68 3HG1 ILE 68 -7.148 -4.923 2.771 586 HG21 ILE 68 1HG2 ILE 68 -8.346 -4.682 4.921 587 HG22 ILE 68 2HG2 ILE 68 -6.886 -4.152 5.758 588 HG23 ILE 68 3HG2 ILE 68 -7.792 -5.539 6.361 589 HD11 ILE 68 3HD1 ILE 68 -5.867 -3.301 4.092 590 HD12 ILE 68 1HD1 ILE 68 -5.155 -3.582 2.504 591 HD13 ILE 68 2HD1 ILE 68 -4.435 -4.319 3.934 592 H ARG 69 H ARG 69 -6.289 -8.774 5.718 593 HA ARG 69 HA ARG 69 -7.408 -8.579 8.289 594 HB2 ARG 69 2HB ARG 69 -6.386 -10.993 6.778 595 HB3 ARG 69 3HB ARG 69 -7.301 -11.093 8.275 596 HG2 ARG 69 2HG ARG 69 -8.309 -9.824 5.730 597 HG3 ARG 69 3HG ARG 69 -8.661 -11.474 6.244 598 HD2 ARG 69 2HD ARG 69 -9.392 -8.952 7.741 599 HD3 ARG 69 3HD ARG 69 -10.496 -9.963 6.808 600 HE ARG 69 HE ARG 69 -9.094 -11.331 8.928 601 HH11 ARG 69 1HH1 ARG 69 -11.952 -9.628 8.026 602 HH12 ARG 69 2HH1 ARG 69 -12.867 -10.260 9.347 603 HH21 ARG 69 1HH2 ARG 69 -10.273 -12.140 10.589 604 HH22 ARG 69 2HH2 ARG 69 -11.926 -11.674 10.788 605 H PHE 70 H PHE 70 -4.149 -9.433 7.242 606 HA PHE 70 HA PHE 70 -3.180 -10.235 9.804 607 HB2 PHE 70 2HB PHE 70 -2.117 -10.827 7.614 608 HB3 PHE 70 3HB PHE 70 -1.600 -9.154 7.452 609 HD1 PHE 70 HD1 PHE 70 -1.271 -12.161 9.598 610 HD2 PHE 70 HD2 PHE 70 0.410 -8.426 8.429 611 HE1 PHE 70 HE1 PHE 70 0.780 -12.696 10.846 612 HE2 PHE 70 HE2 PHE 70 2.464 -8.960 9.673 613 HZ PHE 70 HZ PHE 70 2.650 -11.097 10.883 614 H VAL 71 H VAL 71 -3.131 -7.165 8.021 615 HA VAL 71 HA VAL 71 -1.615 -5.698 9.909 616 HB VAL 71 HB VAL 71 -3.609 -4.694 7.857 617 HG11 VAL 71 1HG1 VAL 71 -1.463 -3.166 9.344 618 HG12 VAL 71 2HG1 VAL 71 -3.204 -3.002 9.582 619 HG13 VAL 71 3HG1 VAL 71 -2.473 -2.530 8.046 620 HG21 VAL 71 3HG2 VAL 71 -1.630 -4.257 6.469 621 HG22 VAL 71 1HG2 VAL 71 -1.775 -5.971 6.865 622 HG23 VAL 71 2HG2 VAL 71 -0.600 -4.966 7.714 623 H LYS 72 H LYS 72 -5.070 -6.399 9.710 624 HA LYS 72 HA LYS 72 -6.046 -4.368 11.361 625 HB2 LYS 72 2HB LYS 72 -7.478 -5.883 10.008 626 HB3 LYS 72 3HB LYS 72 -7.147 -7.178 11.154 627 HG2 LYS 72 2HG LYS 72 -8.200 -5.881 12.944 628 HG3 LYS 72 3HG LYS 72 -8.520 -4.570 11.808 629 HD2 LYS 72 2HD LYS 72 -9.950 -6.092 10.487 630 HD3 LYS 72 3HD LYS 72 -9.655 -7.373 11.667 631 HE2 LYS 72 2HE LYS 72 -10.672 -5.981 13.419 632 HE3 LYS 72 3HE LYS 72 -10.970 -4.709 12.235 633 HZ1 LYS 72 3HZ LYS 72 -12.387 -6.286 11.021 634 HZ2 LYS 72 1HZ LYS 72 -12.954 -5.976 12.583 635 HZ3 LYS 72 2HZ LYS 72 -12.156 -7.426 12.245 636 H SER 73 H SER 73 -4.444 -7.360 12.232 637 HA SER 73 HA SER 73 -5.226 -7.539 14.931 638 HB2 SER 73 2HB SER 73 -3.318 -9.008 15.254 639 HB3 SER 73 3HB SER 73 -4.057 -9.358 13.694 640 HG SER 73 HG SER 73 -2.341 -8.577 12.675 641 H LEU 74 H LEU 74 -3.138 -5.297 13.395 642 HA LEU 74 HA LEU 74 -1.531 -4.582 15.646 643 HB2 LEU 74 2HB LEU 74 -2.251 -2.993 13.177 644 HB3 LEU 74 3HB LEU 74 -0.991 -2.565 14.322 645 HG LEU 74 HG LEU 74 -1.006 -5.063 12.611 646 HD11 LEU 74 1HD1 LEU 74 -0.701 -3.009 11.298 647 HD12 LEU 74 2HD1 LEU 74 0.752 -4.008 11.328 648 HD13 LEU 74 3HD1 LEU 74 0.658 -2.561 12.333 649 HD21 LEU 74 3HD2 LEU 74 0.171 -5.419 14.705 650 HD22 LEU 74 1HD2 LEU 74 1.101 -3.940 14.463 651 HD23 LEU 74 2HD2 LEU 74 1.321 -5.310 13.375 652 H GLY 75 H GLY 75 -4.548 -3.275 14.270 653 HA2 GLY 75 2HA GLY 75 -6.126 -1.845 15.140 654 HA3 GLY 75 3HA GLY 75 -5.553 -2.345 16.722 655 H ALA 76 H ALA 76 -4.699 -0.170 14.025 656 HA ALA 76 HA ALA 76 -4.229 2.019 15.861 657 HB1 ALA 76 3HB ALA 76 -1.934 0.923 14.222 658 HB2 ALA 76 1HB ALA 76 -2.074 0.884 15.980 659 HB3 ALA 76 2HB ALA 76 -1.909 2.429 15.142 660 H GLN 77 H GLN 77 -3.151 3.917 14.412 661 HA GLN 77 HA GLN 77 -4.977 4.248 12.149 662 HB2 GLN 77 2HB GLN 77 -3.189 6.205 13.608 663 HB3 GLN 77 3HB GLN 77 -4.202 6.638 12.237 664 HG2 GLN 77 2HG GLN 77 -5.230 5.492 14.827 665 HG3 GLN 77 3HG GLN 77 -5.189 7.210 14.438 666 HE21 GLN 77 1HE2 GLN 77 -7.463 5.436 14.999 667 HE22 GLN 77 2HE2 GLN 77 -8.510 5.575 13.632 668 H VAL 78 H VAL 78 -4.211 3.435 10.272 669 HA VAL 78 HA VAL 78 -1.571 4.381 9.358 670 HB VAL 78 HB VAL 78 -1.216 2.247 8.143 671 HG11 VAL 78 1HG1 VAL 78 -0.562 0.893 10.070 672 HG12 VAL 78 2HG1 VAL 78 -1.567 1.888 11.123 673 HG13 VAL 78 3HG1 VAL 78 -0.159 2.591 10.328 674 HG21 VAL 78 3HG2 VAL 78 -3.628 1.288 9.689 675 HG22 VAL 78 1HG2 VAL 78 -2.548 0.265 8.742 676 HG23 VAL 78 2HG2 VAL 78 -3.523 1.497 7.941 677 H LEU 79 H LEU 79 -1.367 4.776 7.120 678 HA LEU 79 HA LEU 79 -3.928 5.129 5.704 679 HB2 LEU 79 2HB LEU 79 -2.595 7.152 6.019 680 HB3 LEU 79 3HB LEU 79 -1.216 6.391 5.249 681 HG LEU 79 HG LEU 79 -2.452 6.307 3.112 682 HD11 LEU 79 1HD1 LEU 79 -4.607 7.813 4.597 683 HD12 LEU 79 2HD1 LEU 79 -4.726 6.170 3.967 684 HD13 LEU 79 3HD1 LEU 79 -4.557 7.528 2.857 685 HD21 LEU 79 3HD2 LEU 79 -2.396 8.707 2.638 686 HD22 LEU 79 1HD2 LEU 79 -1.001 8.204 3.590 687 HD23 LEU 79 2HD2 LEU 79 -2.338 9.052 4.368 688 H ILE 80 H ILE 80 -4.289 4.188 3.702 689 HA ILE 80 HA ILE 80 -2.168 2.419 2.644 690 HB ILE 80 HB ILE 80 -5.129 1.786 2.802 691 HG12 ILE 80 2HG1 ILE 80 -2.783 0.531 4.261 692 HG13 ILE 80 3HG1 ILE 80 -3.950 1.632 4.981 693 HG21 ILE 80 1HG2 ILE 80 -4.539 -0.403 1.895 694 HG22 ILE 80 2HG2 ILE 80 -2.847 0.085 1.775 695 HG23 ILE 80 3HG2 ILE 80 -4.067 0.877 0.777 696 HD11 ILE 80 3HD1 ILE 80 -4.428 -0.671 5.568 697 HD12 ILE 80 1HD1 ILE 80 -4.558 -1.098 3.863 698 HD13 ILE 80 2HD1 ILE 80 -5.728 0.006 4.588 699 H ILE 81 H ILE 81 -1.783 2.568 0.493 700 HA ILE 81 HA ILE 81 -3.778 3.942 -1.215 701 HB ILE 81 HB ILE 81 -0.768 3.859 -1.574 702 HG12 ILE 81 2HG1 ILE 81 -2.629 6.142 -0.843 703 HG13 ILE 81 3HG1 ILE 81 -1.446 5.383 0.218 704 HG21 ILE 81 1HG2 ILE 81 -1.135 5.369 -3.477 705 HG22 ILE 81 2HG2 ILE 81 -2.880 5.225 -3.256 706 HG23 ILE 81 3HG2 ILE 81 -1.931 3.813 -3.723 707 HD11 ILE 81 3HD1 ILE 81 -0.849 6.995 -2.257 708 HD12 ILE 81 1HD1 ILE 81 0.355 6.199 -1.241 709 HD13 ILE 81 2HD1 ILE 81 -0.629 7.505 -0.584 710 H ILE 82 H ILE 82 -4.662 2.705 -2.784 711 HA ILE 82 HA ILE 82 -3.338 0.142 -3.450 712 HB ILE 82 HB ILE 82 -6.296 0.781 -3.620 713 HG12 ILE 82 2HG1 ILE 82 -4.775 -0.837 -1.546 714 HG13 ILE 82 3HG1 ILE 82 -5.517 0.737 -1.275 715 HG21 ILE 82 1HG2 ILE 82 -5.516 -0.936 -5.207 716 HG22 ILE 82 2HG2 ILE 82 -6.578 -1.614 -3.975 717 HG23 ILE 82 3HG2 ILE 82 -4.834 -1.858 -3.868 718 HD11 ILE 82 3HD1 ILE 82 -6.874 -1.068 -0.369 719 HD12 ILE 82 1HD1 ILE 82 -6.985 -1.804 -1.968 720 HD13 ILE 82 2HD1 ILE 82 -7.722 -0.228 -1.667 721 H TYR 83 H TYR 83 -2.949 -0.369 -5.555 722 HA TYR 83 HA TYR 83 -3.836 1.550 -7.625 723 HB2 TYR 83 2HB TYR 83 -1.513 1.886 -7.456 724 HB3 TYR 83 3HB TYR 83 -1.185 0.167 -7.250 725 HD1 TYR 83 HD2 TYR 83 -2.350 2.674 -9.766 726 HD2 TYR 83 HD1 TYR 83 -0.635 -1.172 -9.111 727 HE1 TYR 83 HE2 TYR 83 -1.935 2.448 -12.181 728 HE2 TYR 83 HE1 TYR 83 -0.222 -1.405 -11.520 729 HH TYR 83 HH TYR 83 -0.981 -0.552 -13.597 730 H ASP 84 H ASP 84 -5.065 0.759 -9.176 731 HA ASP 84 HA ASP 84 -4.387 -1.585 -10.630 732 HB2 ASP 84 2HB ASP 84 -5.602 -2.630 -8.691 733 HB3 ASP 84 3HB ASP 84 -7.045 -1.737 -9.166 734 H GLN 85 H GLN 85 -5.883 -1.902 -12.513 735 HA GLN 85 HA GLN 85 -6.536 0.730 -13.550 736 HB2 GLN 85 2HB GLN 85 -6.405 -1.993 -14.850 737 HB3 GLN 85 3HB GLN 85 -6.817 -0.520 -15.719 738 HG2 GLN 85 2HG GLN 85 -4.222 -1.001 -14.257 739 HG3 GLN 85 3HG GLN 85 -4.458 -1.185 -15.995 740 HE21 GLN 85 1HE2 GLN 85 -2.675 0.631 -14.508 741 HE22 GLN 85 2HE2 GLN 85 -3.104 2.229 -15.006 742 H ASP 86 H ASP 86 -8.262 -2.297 -12.858 743 HA ASP 86 HA ASP 86 -10.752 -1.244 -13.928 744 HB2 ASP 86 2HB ASP 86 -10.287 -3.588 -14.309 745 HB3 ASP 86 3HB ASP 86 -10.112 -3.875 -12.579 746 H GLN 87 H GLN 87 -12.298 -0.247 -12.788 747 HA GLN 87 HA GLN 87 -11.764 0.447 -10.051 748 HB2 GLN 87 2HB GLN 87 -14.128 1.141 -11.801 749 HB3 GLN 87 3HB GLN 87 -13.736 1.891 -10.259 750 HG2 GLN 87 2HG GLN 87 -12.152 2.045 -12.818 751 HG3 GLN 87 3HG GLN 87 -13.031 3.347 -12.021 752 HE21 GLN 87 1HE2 GLN 87 -10.176 1.378 -11.978 753 HE22 GLN 87 2HE2 GLN 87 -9.307 2.310 -10.817 754 H ASN 88 H ASN 88 -13.960 -1.799 -11.643 755 HA ASN 88 HA ASN 88 -15.775 -2.206 -9.539 756 HB2 ASN 88 2HB ASN 88 -14.817 -4.074 -11.711 757 HB3 ASN 88 3HB ASN 88 -16.076 -4.518 -10.563 758 HD21 ASN 88 1HD2 ASN 88 -18.046 -3.412 -10.620 759 HD22 ASN 88 2HD2 ASN 88 -18.551 -2.541 -12.022 760 H ARG 89 H ARG 89 -12.630 -3.744 -10.164 761 HA ARG 89 HA ARG 89 -12.741 -5.284 -7.709 762 HB2 ARG 89 2HB ARG 89 -10.517 -4.788 -9.701 763 HB3 ARG 89 3HB ARG 89 -10.348 -5.823 -8.290 764 HG2 ARG 89 2HG ARG 89 -12.090 -7.298 -9.127 765 HG3 ARG 89 3HG ARG 89 -12.338 -6.244 -10.519 766 HD2 ARG 89 2HD ARG 89 -9.732 -7.635 -9.881 767 HD3 ARG 89 3HD ARG 89 -10.944 -8.264 -10.995 768 HE ARG 89 HE ARG 89 -10.493 -6.436 -12.459 769 HH11 ARG 89 1HH1 ARG 89 -8.316 -6.642 -9.799 770 HH12 ARG 89 2HH1 ARG 89 -7.113 -5.666 -10.563 771 HH21 ARG 89 1HH2 ARG 89 -8.914 -5.226 -13.447 772 HH22 ARG 89 2HH2 ARG 89 -7.460 -4.862 -12.588 773 H LEU 90 H LEU 90 -11.039 -2.392 -8.862 774 HA LEU 90 HA LEU 90 -9.365 -1.985 -6.644 775 HB2 LEU 90 2HB LEU 90 -9.043 -0.929 -8.832 776 HB3 LEU 90 3HB LEU 90 -10.486 0.035 -8.592 777 HG LEU 90 HG LEU 90 -9.378 1.163 -6.668 778 HD11 LEU 90 1HD1 LEU 90 -7.827 -0.628 -6.059 779 HD12 LEU 90 2HD1 LEU 90 -6.980 0.894 -6.333 780 HD13 LEU 90 3HD1 LEU 90 -6.937 -0.372 -7.560 781 HD21 LEU 90 3HD2 LEU 90 -7.841 2.520 -8.014 782 HD22 LEU 90 1HD2 LEU 90 -9.336 2.185 -8.887 783 HD23 LEU 90 2HD2 LEU 90 -7.867 1.293 -9.282 784 H GLU 91 H GLU 91 -12.383 -0.195 -7.420 785 HA GLU 91 HA GLU 91 -12.313 1.273 -4.988 786 HB2 GLU 91 2HB GLU 91 -14.607 0.863 -6.916 787 HB3 GLU 91 3HB GLU 91 -14.571 2.051 -5.618 788 HG2 GLU 91 2HG GLU 91 -12.543 3.050 -6.700 789 HG3 GLU 91 3HG GLU 91 -12.805 1.956 -8.057 790 H GLU 92 H GLU 92 -14.285 -1.528 -5.999 791 HA GLU 92 HA GLU 92 -15.965 -1.796 -3.829 792 HB2 GLU 92 2HB GLU 92 -16.149 -3.247 -5.754 793 HB3 GLU 92 3HB GLU 92 -14.582 -3.969 -5.419 794 HG2 GLU 92 2HG GLU 92 -15.471 -4.948 -3.355 795 HG3 GLU 92 3HG GLU 92 -17.041 -4.216 -3.686 796 H PHE 93 H PHE 93 -12.726 -3.267 -4.128 797 HA PHE 93 HA PHE 93 -12.525 -4.321 -1.540 798 HB2 PHE 93 2HB PHE 93 -10.995 -4.790 -3.481 799 HB3 PHE 93 3HB PHE 93 -10.273 -3.203 -3.241 800 HD1 PHE 93 HD2 PHE 93 -8.848 -2.768 -1.290 801 HD2 PHE 93 HD1 PHE 93 -10.518 -6.624 -2.002 802 HE1 PHE 93 HE2 PHE 93 -7.268 -3.748 0.317 803 HE2 PHE 93 HE1 PHE 93 -8.933 -7.606 -0.400 804 HZ PHE 93 HZ PHE 93 -7.307 -6.170 0.761 805 H SER 94 H SER 94 -11.432 -1.192 -2.818 806 HA SER 94 HA SER 94 -10.283 -0.054 -0.581 807 HB2 SER 94 2HB SER 94 -10.084 1.055 -2.678 808 HB3 SER 94 3HB SER 94 -11.831 1.195 -2.855 809 HG SER 94 HG SER 94 -10.899 3.170 -2.212 810 H ARG 95 H ARG 95 -13.743 -0.119 -1.413 811 HA ARG 95 HA ARG 95 -14.545 1.826 0.470 812 HB2 ARG 95 2HB ARG 95 -16.180 -0.412 -0.739 813 HB3 ARG 95 3HB ARG 95 -16.835 0.976 0.118 814 HG2 ARG 95 2HG ARG 95 -15.348 1.006 -2.509 815 HG3 ARG 95 3HG ARG 95 -17.061 1.320 -2.253 816 HD2 ARG 95 2HD ARG 95 -16.014 3.435 -2.553 817 HD3 ARG 95 3HD ARG 95 -16.381 3.295 -0.835 818 HE ARG 95 HE ARG 95 -13.708 2.487 -1.595 819 HH11 ARG 95 1HH1 ARG 95 -15.709 5.082 -0.528 820 HH12 ARG 95 2HH1 ARG 95 -14.384 5.949 0.164 821 HH21 ARG 95 1HH2 ARG 95 -12.024 3.623 -0.687 822 HH22 ARG 95 2HH2 ARG 95 -12.339 5.148 0.070 823 H GLU 96 H GLU 96 -14.514 -1.758 0.747 824 HA GLU 96 HA GLU 96 -15.588 -1.708 3.368 825 HB2 GLU 96 2HB GLU 96 -15.642 -3.690 1.799 826 HB3 GLU 96 3HB GLU 96 -13.940 -3.947 2.185 827 HG2 GLU 96 2HG GLU 96 -14.495 -4.182 4.533 828 HG3 GLU 96 3HG GLU 96 -16.190 -3.882 4.180 829 H VAL 97 H VAL 97 -12.312 -1.464 2.106 830 HA VAL 97 HA VAL 97 -10.858 -1.912 4.455 831 HB VAL 97 HB VAL 97 -10.265 0.117 2.279 832 HG11 VAL 97 1HG1 VAL 97 -7.926 -0.025 3.059 833 HG12 VAL 97 2HG1 VAL 97 -8.452 -1.026 4.413 834 HG13 VAL 97 3HG1 VAL 97 -8.999 0.646 4.286 835 HG21 VAL 97 3HG2 VAL 97 -10.441 -2.161 1.417 836 HG22 VAL 97 1HG2 VAL 97 -9.306 -2.730 2.642 837 HG23 VAL 97 2HG2 VAL 97 -8.764 -1.619 1.383 838 H ARG 98 H ARG 98 -12.404 1.091 3.302 839 HA ARG 98 HA ARG 98 -11.846 2.704 5.543 840 HB2 ARG 98 2HB ARG 98 -14.244 2.708 3.692 841 HB3 ARG 98 3HB ARG 98 -13.925 3.959 4.883 842 HG2 ARG 98 2HG ARG 98 -12.158 3.259 2.544 843 HG3 ARG 98 3HG ARG 98 -13.243 4.645 2.646 844 HD2 ARG 98 2HD ARG 98 -10.806 4.111 4.352 845 HD3 ARG 98 3HD ARG 98 -10.983 5.355 3.115 846 HE ARG 98 HE ARG 98 -12.462 5.330 5.672 847 HH11 ARG 98 1HH1 ARG 98 -11.071 7.035 3.013 848 HH12 ARG 98 2HH1 ARG 98 -11.242 8.577 3.775 849 HH21 ARG 98 1HH2 ARG 98 -12.690 7.317 6.624 850 HH22 ARG 98 2HH2 ARG 98 -12.147 8.730 5.786 851 H ARG 99 H ARG 99 -14.550 0.524 4.866 852 HA ARG 99 HA ARG 99 -16.042 0.936 7.199 853 HB2 ARG 99 2HB ARG 99 -16.854 -0.227 5.183 854 HB3 ARG 99 3HB ARG 99 -15.785 -1.578 5.531 855 HG2 ARG 99 2HG ARG 99 -17.027 -2.095 7.544 856 HG3 ARG 99 3HG ARG 99 -18.038 -0.664 7.319 857 HD2 ARG 99 2HD ARG 99 -17.883 -3.056 5.478 858 HD3 ARG 99 3HD ARG 99 -19.213 -2.661 6.568 859 HE ARG 99 HE ARG 99 -19.087 -0.462 5.049 860 HH11 ARG 99 1HH1 ARG 99 -19.198 -3.811 4.203 861 HH12 ARG 99 2HH1 ARG 99 -19.928 -3.498 2.668 862 HH21 ARG 99 1HH2 ARG 99 -20.044 -0.097 3.078 863 HH22 ARG 99 2HH2 ARG 99 -20.397 -1.432 2.040 864 H ARG 100 H ARG 100 -13.149 -0.948 6.668 865 HA ARG 100 HA ARG 100 -13.335 -2.399 9.171 866 HB2 ARG 100 2HB ARG 100 -11.062 -2.146 7.184 867 HB3 ARG 100 3HB ARG 100 -11.083 -3.245 8.558 868 HG2 ARG 100 2HG ARG 100 -12.940 -4.466 7.625 869 HG3 ARG 100 3HG ARG 100 -13.095 -3.300 6.312 870 HD2 ARG 100 2HD ARG 100 -10.831 -3.930 5.530 871 HD3 ARG 100 3HD ARG 100 -10.760 -5.153 6.800 872 HE ARG 100 HE ARG 100 -13.051 -5.728 5.428 873 HH11 ARG 100 1HH1 ARG 100 -9.732 -5.400 4.513 874 HH12 ARG 100 2HH1 ARG 100 -9.888 -6.522 3.202 875 HH21 ARG 100 1HH2 ARG 100 -13.208 -7.127 3.738 876 HH22 ARG 100 2HH2 ARG 100 -11.809 -7.489 2.783 877 H GLY 101 H GLY 101 -12.712 0.760 8.593 878 HA2 GLY 101 2HA GLY 101 -12.184 2.277 10.319 879 HA3 GLY 101 3HA GLY 101 -11.313 1.006 11.155 880 H PHE 102 H PHE 102 -10.358 1.025 7.935 881 HA PHE 102 HA PHE 102 -7.883 2.452 8.630 882 HB2 PHE 102 2HB PHE 102 -8.517 0.574 6.340 883 HB3 PHE 102 3HB PHE 102 -6.964 1.369 6.572 884 HD1 PHE 102 HD1 PHE 102 -5.668 0.874 8.692 885 HD2 PHE 102 HD2 PHE 102 -8.995 -1.461 7.415 886 HE1 PHE 102 HE1 PHE 102 -4.902 -0.985 10.106 887 HE2 PHE 102 HE2 PHE 102 -8.234 -3.323 8.831 888 HZ PHE 102 HZ PHE 102 -6.182 -3.085 10.175 889 H GLU 103 H GLU 103 -6.965 4.040 7.284 890 HA GLU 103 HA GLU 103 -8.797 5.477 5.517 891 HB2 GLU 103 2HB GLU 103 -5.952 6.112 6.364 892 HB3 GLU 103 3HB GLU 103 -6.968 7.157 5.383 893 HG2 GLU 103 2HG GLU 103 -7.535 6.333 8.226 894 HG3 GLU 103 3HG GLU 103 -6.859 7.880 7.721 895 H VAL 104 H VAL 104 -8.785 5.189 3.323 896 HA VAL 104 HA VAL 104 -6.374 4.048 2.079 897 HB VAL 104 HB VAL 104 -7.908 2.179 2.522 898 HG11 VAL 104 1HG1 VAL 104 -10.038 3.346 2.452 899 HG12 VAL 104 2HG1 VAL 104 -10.043 1.997 1.318 900 HG13 VAL 104 3HG1 VAL 104 -9.843 3.645 0.724 901 HG21 VAL 104 3HG2 VAL 104 -6.417 2.086 0.584 902 HG22 VAL 104 1HG2 VAL 104 -7.662 2.832 -0.418 903 HG23 VAL 104 2HG2 VAL 104 -7.924 1.229 0.270 904 H ARG 105 H ARG 105 -5.925 4.657 0.030 905 HA ARG 105 HA ARG 105 -7.834 6.353 -1.443 906 HB2 ARG 105 2HB ARG 105 -4.890 6.848 -0.948 907 HB3 ARG 105 3HB ARG 105 -5.775 7.645 -2.240 908 HG2 ARG 105 2HG ARG 105 -6.414 7.847 0.705 909 HG3 ARG 105 3HG ARG 105 -5.561 9.061 -0.253 910 HD2 ARG 105 2HD ARG 105 -7.565 9.230 -1.720 911 HD3 ARG 105 3HD ARG 105 -8.409 8.130 -0.631 912 HE ARG 105 HE ARG 105 -7.821 9.972 1.105 913 HH11 ARG 105 1HH1 ARG 105 -8.715 10.471 -2.190 914 HH12 ARG 105 2HH1 ARG 105 -9.428 12.014 -1.870 915 HH21 ARG 105 1HH2 ARG 105 -8.760 11.943 1.498 916 HH22 ARG 105 2HH2 ARG 105 -9.442 12.844 0.181 917 H THR 106 H THR 106 -7.988 5.918 -3.616 918 HA THR 106 HA THR 106 -6.352 3.673 -4.622 919 HB THR 106 HB THR 106 -8.192 3.311 -6.268 920 HG1 THR 106 HG1 THR 106 -9.627 4.846 -6.461 921 HG21 THR 106 3HG2 THR 106 -9.045 3.268 -3.365 922 HG22 THR 106 1HG2 THR 106 -8.127 2.011 -4.197 923 HG23 THR 106 2HG2 THR 106 -9.791 2.348 -4.673 924 H VAL 107 H VAL 107 -5.386 3.746 -6.620 925 HA VAL 107 HA VAL 107 -5.700 6.174 -8.255 926 HB VAL 107 HB VAL 107 -3.264 6.251 -8.690 927 HG11 VAL 107 1HG1 VAL 107 -4.000 6.503 -5.767 928 HG12 VAL 107 2HG1 VAL 107 -4.241 7.731 -7.009 929 HG13 VAL 107 3HG1 VAL 107 -2.609 7.254 -6.548 930 HG21 VAL 107 3HG2 VAL 107 -2.721 3.907 -8.163 931 HG22 VAL 107 1HG2 VAL 107 -3.045 4.214 -6.456 932 HG23 VAL 107 2HG2 VAL 107 -1.699 5.024 -7.260 933 H THR 108 H THR 108 -5.654 5.855 -10.437 934 HA THR 108 HA THR 108 -5.645 3.065 -11.363 935 HB THR 108 HB THR 108 -6.711 3.888 -13.396 936 HG1 THR 108 HG1 THR 108 -6.770 6.509 -12.312 937 HG21 THR 108 3HG2 THR 108 -7.970 5.104 -10.926 938 HG22 THR 108 1HG2 THR 108 -8.155 3.434 -11.464 939 HG23 THR 108 2HG2 THR 108 -8.799 4.751 -12.443 940 H SER 109 H SER 109 -3.648 5.854 -11.466 941 HA SER 109 HA SER 109 -1.858 4.560 -13.395 942 HB2 SER 109 2HB SER 109 -3.287 6.121 -14.697 943 HB3 SER 109 3HB SER 109 -2.747 7.447 -13.668 944 HG SER 109 HG SER 109 -1.452 7.479 -15.448 945 HA PRO 110 HA PRO 110 1.465 5.771 -10.670 946 HB2 PRO 110 2HB PRO 110 2.825 6.598 -13.210 947 HB3 PRO 110 3HB PRO 110 3.432 5.597 -11.883 948 HG2 PRO 110 2HG PRO 110 2.639 4.461 -14.145 949 HG3 PRO 110 3HG PRO 110 2.242 3.717 -12.583 950 HD2 PRO 110 2HD PRO 110 0.489 5.273 -14.444 951 HD3 PRO 110 3HD PRO 110 0.092 3.873 -13.424 952 H ASP 111 H ASP 111 0.586 8.023 -13.293 953 HA ASP 111 HA ASP 111 1.692 10.358 -12.175 954 HB2 ASP 111 2HB ASP 111 0.875 10.160 -14.509 955 HB3 ASP 111 3HB ASP 111 -0.781 10.117 -13.911 956 H ASP 112 H ASP 112 -1.611 9.020 -11.885 957 HA ASP 112 HA ASP 112 -2.595 10.893 -10.023 958 HB2 ASP 112 2HB ASP 112 -3.344 8.001 -10.514 959 HB3 ASP 112 3HB ASP 112 -4.244 9.076 -9.447 960 H PHE 113 H PHE 113 -0.851 7.841 -9.577 961 HA PHE 113 HA PHE 113 -0.901 7.659 -6.795 962 HB2 PHE 113 2HB PHE 113 -0.023 5.858 -8.174 963 HB3 PHE 113 3HB PHE 113 1.290 6.884 -8.739 964 HD1 PHE 113 HD1 PHE 113 -0.092 5.194 -5.739 965 HD2 PHE 113 HD2 PHE 113 3.303 7.047 -7.528 966 HE1 PHE 113 HE1 PHE 113 1.320 4.401 -3.885 967 HE2 PHE 113 HE2 PHE 113 4.715 6.257 -5.678 968 HZ PHE 113 HZ PHE 113 3.726 4.933 -3.853 969 H LYS 114 H LYS 114 1.472 9.313 -8.869 970 HA LYS 114 HA LYS 114 3.087 10.494 -6.945 971 HB2 LYS 114 2HB LYS 114 3.736 10.637 -9.219 972 HB3 LYS 114 3HB LYS 114 2.211 11.364 -9.697 973 HG2 LYS 114 2HG LYS 114 2.868 13.398 -8.373 974 HG3 LYS 114 3HG LYS 114 4.460 12.660 -8.169 975 HD2 LYS 114 2HD LYS 114 4.824 12.647 -10.548 976 HD3 LYS 114 3HD LYS 114 3.167 13.171 -10.851 977 HE2 LYS 114 2HE LYS 114 3.654 15.305 -9.717 978 HE3 LYS 114 3HE LYS 114 5.321 14.779 -9.469 979 HZ1 LYS 114 3HZ LYS 114 4.012 15.130 -12.109 980 HZ2 LYS 114 1HZ LYS 114 5.621 14.683 -11.852 981 HZ3 LYS 114 2HZ LYS 114 5.088 16.224 -11.403 982 H LYS 115 H LYS 115 0.319 12.042 -8.581 983 HA LYS 115 HA LYS 115 0.342 14.433 -7.162 984 HB2 LYS 115 2HB LYS 115 -1.976 13.018 -8.490 985 HB3 LYS 115 3HB LYS 115 -2.004 14.698 -7.961 986 HG2 LYS 115 2HG LYS 115 -0.198 15.236 -9.504 987 HG3 LYS 115 3HG LYS 115 -0.102 13.550 -10.006 988 HD2 LYS 115 2HD LYS 115 -2.502 15.349 -10.361 989 HD3 LYS 115 3HD LYS 115 -1.330 14.954 -11.617 990 HE2 LYS 115 2HE LYS 115 -1.927 12.521 -11.226 991 HE3 LYS 115 3HE LYS 115 -3.268 13.099 -10.239 992 HZ1 LYS 115 3HZ LYS 115 -4.001 12.657 -12.477 993 HZ2 LYS 115 1HZ LYS 115 -2.826 13.693 -13.114 994 HZ3 LYS 115 2HZ LYS 115 -4.089 14.317 -12.179 995 H SER 116 H SER 116 -1.267 11.394 -6.345 996 HA SER 116 HA SER 116 -2.679 12.478 -4.080 997 HB2 SER 116 2HB SER 116 -2.071 9.589 -4.781 998 HB3 SER 116 3HB SER 116 -3.239 10.133 -3.575 999 HG SER 116 HG SER 116 -3.383 10.177 -6.362 1000 H LEU 117 H LEU 117 0.245 10.500 -4.500 1001 HA LEU 117 HA LEU 117 0.779 9.955 -1.811 1002 HB2 LEU 117 2HB LEU 117 1.837 8.828 -3.754 1003 HB3 LEU 117 3HB LEU 117 2.777 10.276 -4.057 1004 HG LEU 117 HG LEU 117 3.816 9.993 -1.789 1005 HD11 LEU 117 1HD1 LEU 117 2.440 7.308 -1.871 1006 HD12 LEU 117 2HD1 LEU 117 2.061 8.634 -0.771 1007 HD13 LEU 117 3HD1 LEU 117 3.629 7.834 -0.677 1008 HD21 LEU 117 3HD2 LEU 117 4.989 9.280 -3.804 1009 HD22 LEU 117 1HD2 LEU 117 4.188 7.710 -3.732 1010 HD23 LEU 117 2HD2 LEU 117 5.320 8.182 -2.465 1011 H GLU 118 H GLU 118 1.912 12.668 -3.833 1012 HA GLU 118 HA GLU 118 3.740 13.832 -2.112 1013 HB2 GLU 118 2HB GLU 118 1.817 15.237 -3.980 1014 HB3 GLU 118 3HB GLU 118 3.212 15.995 -3.223 1015 HG2 GLU 118 2HG GLU 118 4.645 14.283 -4.376 1016 HG3 GLU 118 3HG GLU 118 3.206 13.787 -5.268 1017 H ARG 119 H ARG 119 0.227 14.415 -2.217 1018 HA ARG 119 HA ARG 119 0.242 16.346 -0.112 1019 HB2 ARG 119 2HB ARG 119 -2.075 14.682 -1.135 1020 HB3 ARG 119 3HB ARG 119 -2.201 16.135 -0.154 1021 HG2 ARG 119 2HG ARG 119 -1.164 15.957 -2.981 1022 HG3 ARG 119 3HG ARG 119 -2.707 16.637 -2.462 1023 HD2 ARG 119 2HD ARG 119 0.048 17.692 -1.806 1024 HD3 ARG 119 3HD ARG 119 -1.119 18.411 -2.915 1025 HE ARG 119 HE ARG 119 -2.115 18.120 -0.233 1026 HH11 ARG 119 1HH1 ARG 119 -0.368 20.142 -2.398 1027 HH12 ARG 119 2HH1 ARG 119 -0.640 21.569 -1.467 1028 HH21 ARG 119 1HH2 ARG 119 -2.450 19.955 0.974 1029 HH22 ARG 119 2HH2 ARG 119 -1.793 21.461 0.434 1030 H LEU 120 H LEU 120 -0.777 12.937 -0.234 1031 HA LEU 120 HA LEU 120 -1.667 12.667 2.377 1032 HB2 LEU 120 2HB LEU 120 -0.380 10.602 0.590 1033 HB3 LEU 120 3HB LEU 120 -1.256 10.232 2.064 1034 HG LEU 120 HG LEU 120 -2.443 11.539 -0.396 1035 HD11 LEU 120 1HD1 LEU 120 -1.896 9.193 -0.774 1036 HD12 LEU 120 2HD1 LEU 120 -3.640 9.434 -0.696 1037 HD13 LEU 120 3HD1 LEU 120 -2.784 8.740 0.681 1038 HD21 LEU 120 3HD2 LEU 120 -3.765 10.617 2.163 1039 HD22 LEU 120 1HD2 LEU 120 -4.595 11.228 0.733 1040 HD23 LEU 120 2HD2 LEU 120 -3.535 12.291 1.656 1041 H ILE 121 H ILE 121 1.628 12.122 1.136 1042 HA ILE 121 HA ILE 121 2.776 11.060 3.437 1043 HB ILE 121 HB ILE 121 3.930 12.628 1.152 1044 HG12 ILE 121 2HG1 ILE 121 4.181 9.762 2.101 1045 HG13 ILE 121 3HG1 ILE 121 3.277 10.331 0.705 1046 HG21 ILE 121 1HG2 ILE 121 5.306 13.273 3.026 1047 HG22 ILE 121 2HG2 ILE 121 6.197 12.143 2.008 1048 HG23 ILE 121 3HG2 ILE 121 5.481 11.590 3.523 1049 HD11 ILE 121 3HD1 ILE 121 5.358 9.277 0.048 1050 HD12 ILE 121 1HD1 ILE 121 6.269 10.425 1.029 1051 HD13 ILE 121 2HD1 ILE 121 5.361 10.988 -0.375 1052 H ARG 122 H ARG 122 2.465 14.506 2.549 1053 HA ARG 122 HA ARG 122 3.920 15.454 4.800 1054 HB2 ARG 122 2HB ARG 122 2.050 16.768 2.848 1055 HB3 ARG 122 3HB ARG 122 2.603 17.648 4.266 1056 HG2 ARG 122 2HG ARG 122 3.983 18.174 2.344 1057 HG3 ARG 122 3HG ARG 122 4.929 17.324 3.566 1058 HD2 ARG 122 2HD ARG 122 4.619 15.221 2.289 1059 HD3 ARG 122 3HD ARG 122 3.762 16.133 1.047 1060 HE ARG 122 HE ARG 122 6.489 16.954 1.687 1061 HH11 ARG 122 1HH1 ARG 122 4.328 15.353 -0.457 1062 HH12 ARG 122 2HH1 ARG 122 5.473 15.311 -1.753 1063 HH21 ARG 122 1HH2 ARG 122 7.955 16.890 -0.007 1064 HH22 ARG 122 2HH2 ARG 122 7.475 16.178 -1.510 1065 H GLU 123 H GLU 123 0.480 14.792 4.291 1066 HA GLU 123 HA GLU 123 -0.371 15.956 6.762 1067 HB2 GLU 123 2HB GLU 123 -1.774 13.939 4.995 1068 HB3 GLU 123 3HB GLU 123 -2.523 14.843 6.305 1069 HG2 GLU 123 2HG GLU 123 -1.359 16.001 3.778 1070 HG3 GLU 123 3HG GLU 123 -3.071 15.810 4.151 1071 H VAL 124 H VAL 124 0.563 12.679 5.797 1072 HA VAL 124 HA VAL 124 -0.167 11.564 8.379 1073 HB VAL 124 HB VAL 124 -0.377 10.262 6.241 1074 HG11 VAL 124 1HG1 VAL 124 1.601 9.186 5.300 1075 HG12 VAL 124 2HG1 VAL 124 2.632 10.095 6.406 1076 HG13 VAL 124 3HG1 VAL 124 1.701 10.941 5.169 1077 HG21 VAL 124 3HG2 VAL 124 1.335 9.033 8.406 1078 HG22 VAL 124 1HG2 VAL 124 0.415 8.135 7.195 1079 HG23 VAL 124 2HG2 VAL 124 -0.426 9.125 8.387 1080 H GLY 125 H GLY 125 2.642 12.958 6.920 1081 HA2 GLY 125 2HA GLY 125 4.494 11.851 8.880 1082 HA3 GLY 125 3HA GLY 125 4.880 12.994 7.605 1083 H SER 126 H SER 126 3.569 15.187 7.981 1084 HA SER 126 HA SER 126 4.253 16.073 10.700 1085 HB2 SER 126 2HB SER 126 4.067 18.380 9.745 1086 HB3 SER 126 3HB SER 126 5.279 17.388 8.940 1087 HG SER 126 HG SER 126 2.702 17.370 7.874 1088 H LEU 127 H LEU 127 2.592 15.786 12.065 1089 HA LEU 127 HA LEU 127 -0.141 16.360 11.133 1090 HB2 LEU 127 2HB LEU 127 -0.814 15.091 13.233 1091 HB3 LEU 127 3HB LEU 127 -0.072 14.169 11.944 1092 HG LEU 127 HG LEU 127 2.110 14.325 13.233 1093 HD11 LEU 127 1HD1 LEU 127 1.573 16.192 14.692 1094 HD12 LEU 127 2HD1 LEU 127 1.968 14.757 15.637 1095 HD13 LEU 127 3HD1 LEU 127 0.285 15.254 15.449 1096 HD21 LEU 127 3HD2 LEU 127 1.530 12.499 14.731 1097 HD22 LEU 127 1HD2 LEU 127 0.739 12.300 13.169 1098 HD23 LEU 127 2HD2 LEU 127 -0.183 12.878 14.558 1099 H GLU 128 H GLU 128 2.279 17.870 12.795 1100 HA GLU 128 HA GLU 128 0.384 19.462 14.397 1101 HB2 GLU 128 2HB GLU 128 2.364 20.267 15.664 1102 HB3 GLU 128 3HB GLU 128 2.107 18.538 15.802 1103 HG2 GLU 128 2HG GLU 128 4.068 19.674 13.831 1104 HG3 GLU 128 3HG GLU 128 4.503 19.402 15.515 1105 H HIS 129 H HIS 129 0.108 21.607 13.983 1106 HA HIS 129 HA HIS 129 1.243 22.582 11.474 1107 HB2 HIS 129 2HB HIS 129 -1.218 22.683 11.912 1108 HB3 HIS 129 3HB HIS 129 -0.909 23.831 13.209 1109 HD1 HIS 129 HD1 HIS 129 -1.497 23.630 9.613 1110 HD2 HIS 129 HD2 HIS 129 0.209 26.363 12.236 1111 HE1 HIS 129 HE1 HIS 129 -1.366 25.788 8.347 1112 HE2 HIS 129 HE2 HIS 129 -0.549 27.465 10.025 1113 H HIS 130 H HIS 130 3.126 23.663 11.590 1114 HA HIS 130 HA HIS 130 3.303 25.971 13.360 1115 HB2 HIS 130 2HB HIS 130 5.597 25.377 14.119 1116 HB3 HIS 130 3HB HIS 130 4.365 24.275 14.720 1117 HD1 HIS 130 HD1 HIS 130 7.481 24.389 12.784 1118 HD2 HIS 130 HD2 HIS 130 4.399 21.686 13.443 1119 HE1 HIS 130 HE1 HIS 130 8.359 22.174 12.014 1120 HE2 HIS 130 HE2 HIS 130 6.556 20.527 12.609 1121 H HIS 131 H HIS 131 4.959 27.502 12.737 1122 HA HIS 131 HA HIS 131 5.071 27.865 9.934 1123 HB2 HIS 131 2HB HIS 131 6.638 29.269 12.112 1124 HB3 HIS 131 3HB HIS 131 6.519 29.812 10.443 1125 HD1 HIS 131 HD1 HIS 131 4.160 30.720 9.674 1126 HD2 HIS 131 HD2 HIS 131 4.526 29.945 13.739 1127 HE1 HIS 131 HE1 HIS 131 2.226 31.888 10.758 1128 HE2 HIS 131 HE2 HIS 131 2.387 31.290 13.195 1129 H HIS 132 H HIS 132 6.486 27.148 8.456 1130 HA HIS 132 HA HIS 132 8.744 25.553 9.289 1131 HB2 HIS 132 2HB HIS 132 7.710 26.284 6.540 1132 HB3 HIS 132 3HB HIS 132 9.067 25.197 6.828 1133 HD1 HIS 132 HD1 HIS 132 6.851 23.919 5.354 1134 HD2 HIS 132 HD2 HIS 132 6.842 24.129 9.505 1135 HE1 HIS 132 HE1 HIS 132 5.328 22.080 6.122 1136 HE2 HIS 132 HE2 HIS 132 5.477 22.122 8.632 1137 H HIS 133 H HIS 133 8.291 28.849 8.651 1138 HA HIS 133 HA HIS 133 11.011 29.411 7.850 1139 HB2 HIS 133 2HB HIS 133 9.092 30.919 7.284 1140 HB3 HIS 133 3HB HIS 133 8.936 31.307 8.992 1141 HD1 HIS 133 HD1 HIS 133 11.132 31.912 6.016 1142 HD2 HIS 133 HD2 HIS 133 10.807 33.126 9.977 1143 HE1 HIS 133 HE1 HIS 133 12.689 33.866 6.254 1144 HE2 HIS 133 HE2 HIS 133 12.633 34.438 8.700 1145 H HIS 134 H HIS 134 11.871 28.012 9.592 1146 HA HIS 134 HA HIS 134 11.865 29.241 12.273 1147 HB2 HIS 134 2HB HIS 134 11.140 26.911 12.182 1148 HB3 HIS 134 3HB HIS 134 12.631 26.448 11.375 1149 HD1 HIS 134 HD1 HIS 134 11.552 27.939 14.710 1150 HD2 HIS 134 HD2 HIS 134 14.547 25.569 13.079 1151 HE1 HIS 134 HE1 HIS 134 12.944 27.185 16.653 1152 HE2 HIS 134 HE2 HIS 134 14.608 25.586 15.660 Start of MODEL 11 1 H1 MET 1 1H MET 1 -0.837 4.947 11.730 2 H2 MET 1 2H MET 1 -0.976 6.604 11.430 3 H3 MET 1 3H MET 1 -1.021 6.029 13.017 4 HA MET 1 HA MET 1 1.091 7.056 12.502 5 HB2 MET 1 2HB MET 1 2.539 5.086 13.187 6 HB3 MET 1 3HB MET 1 1.171 5.448 14.228 7 HG2 MET 1 2HG MET 1 -0.080 3.603 13.314 8 HG3 MET 1 3HG MET 1 1.178 3.293 12.119 9 HE1 MET 1 3HE MET 1 1.667 4.251 15.921 10 HE2 MET 1 1HE MET 1 1.760 2.651 16.655 11 HE3 MET 1 2HE MET 1 0.243 3.209 15.943 12 H ASN 2 H ASN 2 1.096 3.896 10.738 13 HA ASN 2 HA ASN 2 3.237 4.971 9.052 14 HB2 ASN 2 2HB ASN 2 2.245 2.121 9.313 15 HB3 ASN 2 3HB ASN 2 3.680 2.642 8.434 16 HD21 ASN 2 1HD2 ASN 2 3.476 0.773 10.637 17 HD22 ASN 2 2HD2 ASN 2 4.472 1.401 11.896 18 H ILE 3 H ILE 3 3.242 3.924 6.746 19 HA ILE 3 HA ILE 3 0.549 4.071 5.552 20 HB ILE 3 HB ILE 3 1.650 6.165 5.049 21 HG12 ILE 3 2HG1 ILE 3 1.697 4.353 2.615 22 HG13 ILE 3 3HG1 ILE 3 0.264 5.129 3.277 23 HG21 ILE 3 1HG2 ILE 3 3.913 4.533 3.893 24 HG22 ILE 3 2HG2 ILE 3 3.970 5.488 5.375 25 HG23 ILE 3 3HG2 ILE 3 3.765 6.289 3.818 26 HD11 ILE 3 3HD1 ILE 3 1.231 7.322 2.774 27 HD12 ILE 3 1HD1 ILE 3 1.076 6.315 1.334 28 HD13 ILE 3 2HD1 ILE 3 2.653 6.528 2.093 29 H VAL 4 H VAL 4 0.034 2.444 4.196 30 HA VAL 4 HA VAL 4 2.181 0.628 3.269 31 HB VAL 4 HB VAL 4 -0.605 -0.180 4.154 32 HG11 VAL 4 1HG1 VAL 4 0.211 -2.490 3.876 33 HG12 VAL 4 2HG1 VAL 4 1.724 -1.867 3.220 34 HG13 VAL 4 3HG1 VAL 4 0.211 -1.600 2.355 35 HG21 VAL 4 3HG2 VAL 4 2.068 -0.628 5.495 36 HG22 VAL 4 1HG2 VAL 4 0.532 -1.319 6.020 37 HG23 VAL 4 2HG2 VAL 4 0.774 0.427 6.066 38 H ILE 5 H ILE 5 2.224 0.285 1.116 39 HA ILE 5 HA ILE 5 -0.059 1.248 -0.491 40 HB ILE 5 HB ILE 5 2.803 0.766 -1.360 41 HG12 ILE 5 2HG1 ILE 5 1.372 3.388 -0.818 42 HG13 ILE 5 3HG1 ILE 5 2.525 2.637 0.279 43 HG21 ILE 5 1HG2 ILE 5 2.149 2.018 -3.387 44 HG22 ILE 5 2HG2 ILE 5 0.483 2.057 -2.808 45 HG23 ILE 5 3HG2 ILE 5 1.243 0.516 -3.206 46 HD11 ILE 5 3HD1 ILE 5 4.273 2.866 -1.416 47 HD12 ILE 5 1HD1 ILE 5 3.557 4.419 -0.986 48 HD13 ILE 5 2HD1 ILE 5 3.111 3.632 -2.499 49 H VAL 6 H VAL 6 -1.388 -0.314 -1.199 50 HA VAL 6 HA VAL 6 -0.370 -3.031 -1.646 51 HB VAL 6 HB VAL 6 -3.240 -2.055 -1.630 52 HG11 VAL 6 1HG1 VAL 6 -3.806 -4.454 -1.440 53 HG12 VAL 6 2HG1 VAL 6 -2.101 -4.859 -1.646 54 HG13 VAL 6 3HG1 VAL 6 -2.986 -4.075 -2.955 55 HG21 VAL 6 3HG2 VAL 6 -3.393 -3.115 0.586 56 HG22 VAL 6 1HG2 VAL 6 -2.222 -1.796 0.573 57 HG23 VAL 6 2HG2 VAL 6 -1.666 -3.471 0.532 58 H VAL 7 H VAL 7 0.270 -3.538 -3.638 59 HA VAL 7 HA VAL 7 -0.999 -2.208 -5.956 60 HB VAL 7 HB VAL 7 1.765 -3.445 -5.778 61 HG11 VAL 7 1HG1 VAL 7 0.457 -1.886 -8.012 62 HG12 VAL 7 2HG1 VAL 7 0.834 -3.608 -8.027 63 HG13 VAL 7 3HG1 VAL 7 2.137 -2.421 -7.980 64 HG21 VAL 7 3HG2 VAL 7 0.928 -0.538 -5.844 65 HG22 VAL 7 1HG2 VAL 7 2.589 -1.129 -5.916 66 HG23 VAL 7 2HG2 VAL 7 1.621 -1.395 -4.466 67 H PHE 8 H PHE 8 -2.160 -3.446 -7.324 68 HA PHE 8 HA PHE 8 -2.058 -6.360 -7.029 69 HB2 PHE 8 2HB PHE 8 -4.031 -4.531 -8.400 70 HB3 PHE 8 3HB PHE 8 -4.120 -6.286 -8.496 71 HD1 PHE 8 HD2 PHE 8 -4.304 -3.403 -6.182 72 HD2 PHE 8 HD1 PHE 8 -5.018 -7.567 -6.725 73 HE1 PHE 8 HE2 PHE 8 -5.583 -3.462 -4.082 74 HE2 PHE 8 HE1 PHE 8 -6.299 -7.626 -4.629 75 HZ PHE 8 HZ PHE 8 -6.583 -5.573 -3.305 76 H SER 9 H SER 9 -0.980 -3.939 -9.193 77 HA SER 9 HA SER 9 -0.979 -5.461 -11.600 78 HB2 SER 9 2HB SER 9 0.572 -3.754 -12.478 79 HB3 SER 9 3HB SER 9 -0.800 -3.011 -11.661 80 HG SER 9 HG SER 9 1.771 -3.428 -10.515 81 H THR 10 H THR 10 -0.033 -7.434 -11.491 82 HA THR 10 HA THR 10 2.273 -8.078 -9.995 83 HB THR 10 HB THR 10 2.328 -10.192 -11.284 84 HG1 THR 10 HG1 THR 10 1.677 -9.873 -13.300 85 HG21 THR 10 3HG2 THR 10 0.094 -11.011 -10.651 86 HG22 THR 10 1HG2 THR 10 -0.461 -9.348 -10.449 87 HG23 THR 10 2HG2 THR 10 0.785 -9.999 -9.382 88 H ASP 11 H ASP 11 2.022 -6.453 -12.995 89 HA ASP 11 HA ASP 11 4.567 -7.209 -14.079 90 HB2 ASP 11 2HB ASP 11 2.900 -4.750 -14.683 91 HB3 ASP 11 3HB ASP 11 4.206 -5.398 -15.675 92 H GLU 12 H GLU 12 6.360 -6.798 -12.909 93 HA GLU 12 HA GLU 12 6.437 -4.933 -10.807 94 HB2 GLU 12 2HB GLU 12 8.873 -5.511 -10.664 95 HB3 GLU 12 3HB GLU 12 7.772 -6.876 -10.614 96 HG2 GLU 12 2HG GLU 12 9.591 -7.528 -11.965 97 HG3 GLU 12 3HG GLU 12 8.245 -7.227 -13.059 98 H GLU 13 H GLU 13 7.300 -4.483 -14.165 99 HA GLU 13 HA GLU 13 9.131 -2.390 -13.896 100 HB2 GLU 13 2HB GLU 13 8.605 -1.730 -16.164 101 HB3 GLU 13 3HB GLU 13 8.675 -3.480 -16.059 102 HG2 GLU 13 2HG GLU 13 6.363 -3.712 -16.311 103 HG3 GLU 13 3HG GLU 13 6.055 -2.026 -15.890 104 H THR 14 H THR 14 5.605 -2.318 -13.716 105 HA THR 14 HA THR 14 5.391 0.535 -13.644 106 HB THR 14 HB THR 14 3.446 -1.556 -12.621 107 HG1 THR 14 HG1 THR 14 2.404 -0.834 -14.706 108 HG21 THR 14 3HG2 THR 14 1.753 0.230 -12.822 109 HG22 THR 14 1HG2 THR 14 3.027 1.382 -13.217 110 HG23 THR 14 2HG2 THR 14 2.982 0.630 -11.622 111 H LEU 15 H LEU 15 5.529 -1.978 -11.136 112 HA LEU 15 HA LEU 15 5.385 -0.343 -8.861 113 HB2 LEU 15 2HB LEU 15 5.261 -2.766 -8.719 114 HB3 LEU 15 3HB LEU 15 6.899 -2.919 -9.325 115 HG LEU 15 HG LEU 15 7.706 -1.751 -7.251 116 HD11 LEU 15 1HD1 LEU 15 4.852 -2.137 -6.352 117 HD12 LEU 15 2HD1 LEU 15 5.655 -0.594 -6.650 118 HD13 LEU 15 3HD1 LEU 15 6.198 -1.630 -5.330 119 HD21 LEU 15 3HD2 LEU 15 7.798 -4.185 -7.477 120 HD22 LEU 15 1HD2 LEU 15 6.166 -4.314 -6.820 121 HD23 LEU 15 2HD2 LEU 15 7.480 -3.707 -5.811 122 H ARG 16 H ARG 16 8.033 -1.084 -11.016 123 HA ARG 16 HA ARG 16 10.233 -0.193 -9.582 124 HB2 ARG 16 2HB ARG 16 10.052 -1.335 -11.892 125 HB3 ARG 16 3HB ARG 16 9.899 0.290 -12.539 126 HG2 ARG 16 2HG ARG 16 12.088 0.867 -11.608 127 HG3 ARG 16 3HG ARG 16 12.235 -0.765 -10.950 128 HD2 ARG 16 2HD ARG 16 12.080 0.026 -13.860 129 HD3 ARG 16 3HD ARG 16 13.469 -0.655 -13.013 130 HE ARG 16 HE ARG 16 11.520 -2.542 -12.719 131 HH11 ARG 16 1HH1 ARG 16 12.971 -0.973 -15.430 132 HH12 ARG 16 2HH1 ARG 16 12.691 -2.318 -16.479 133 HH21 ARG 16 1HH2 ARG 16 11.164 -4.249 -14.091 134 HH22 ARG 16 2HH2 ARG 16 11.671 -4.130 -15.740 135 H LYS 17 H LYS 17 7.930 1.691 -11.520 136 HA LYS 17 HA LYS 17 9.209 4.213 -11.254 137 HB2 LYS 17 2HB LYS 17 6.348 3.423 -11.830 138 HB3 LYS 17 3HB LYS 17 6.835 5.106 -11.712 139 HG2 LYS 17 2HG LYS 17 6.724 4.398 -14.029 140 HG3 LYS 17 3HG LYS 17 8.385 4.796 -13.585 141 HD2 LYS 17 2HD LYS 17 8.951 2.461 -13.401 142 HD3 LYS 17 3HD LYS 17 7.267 1.989 -13.634 143 HE2 LYS 17 2HE LYS 17 8.898 3.474 -15.695 144 HE3 LYS 17 3HE LYS 17 8.732 1.719 -15.654 145 HZ1 LYS 17 3HZ LYS 17 6.380 1.931 -15.979 146 HZ2 LYS 17 1HZ LYS 17 7.173 2.803 -17.191 147 HZ3 LYS 17 2HZ LYS 17 6.460 3.616 -15.890 148 H PHE 18 H PHE 18 6.684 2.595 -9.343 149 HA PHE 18 HA PHE 18 6.032 4.675 -7.603 150 HB2 PHE 18 2HB PHE 18 6.121 1.710 -6.983 151 HB3 PHE 18 3HB PHE 18 5.273 2.923 -6.034 152 HD1 PHE 18 HD1 PHE 18 4.349 4.448 -8.651 153 HD2 PHE 18 HD2 PHE 18 4.096 0.414 -7.299 154 HE1 PHE 18 HE1 PHE 18 2.338 4.112 -10.019 155 HE2 PHE 18 HE2 PHE 18 2.085 0.080 -8.675 156 HZ PHE 18 HZ PHE 18 1.205 1.931 -10.035 157 H LYS 19 H LYS 19 8.556 2.194 -7.276 158 HA LYS 19 HA LYS 19 9.493 2.945 -4.740 159 HB2 LYS 19 2HB LYS 19 11.093 1.723 -7.004 160 HB3 LYS 19 3HB LYS 19 11.536 1.719 -5.300 161 HG2 LYS 19 2HG LYS 19 9.448 0.412 -4.842 162 HG3 LYS 19 3HG LYS 19 9.215 0.289 -6.587 163 HD2 LYS 19 2HD LYS 19 11.618 -0.721 -5.053 164 HD3 LYS 19 3HD LYS 19 10.291 -1.716 -5.650 165 HE2 LYS 19 2HE LYS 19 10.863 -1.085 -7.955 166 HE3 LYS 19 3HE LYS 19 12.193 -0.096 -7.353 167 HZ1 LYS 19 3HZ LYS 19 12.979 -2.254 -8.094 168 HZ2 LYS 19 1HZ LYS 19 11.932 -3.036 -7.022 169 HZ3 LYS 19 2HZ LYS 19 13.200 -2.094 -6.427 170 H ASP 20 H ASP 20 10.151 4.280 -7.906 171 HA ASP 20 HA ASP 20 12.386 5.881 -7.048 172 HB2 ASP 20 2HB ASP 20 10.720 5.885 -9.572 173 HB3 ASP 20 3HB ASP 20 12.109 6.936 -9.321 174 H ILE 21 H ILE 21 8.938 6.455 -7.627 175 HA ILE 21 HA ILE 21 8.878 9.228 -7.166 176 HB ILE 21 HB ILE 21 6.754 7.158 -6.533 177 HG12 ILE 21 2HG1 ILE 21 7.140 8.895 -8.993 178 HG13 ILE 21 3HG1 ILE 21 7.471 7.170 -8.903 179 HG21 ILE 21 1HG2 ILE 21 6.334 9.251 -5.348 180 HG22 ILE 21 2HG2 ILE 21 5.156 9.015 -6.636 181 HG23 ILE 21 3HG2 ILE 21 6.486 10.153 -6.857 182 HD11 ILE 21 3HD1 ILE 21 5.359 7.602 -10.010 183 HD12 ILE 21 1HD1 ILE 21 4.770 8.467 -8.592 184 HD13 ILE 21 2HD1 ILE 21 5.100 6.738 -8.497 185 H ILE 22 H ILE 22 8.525 6.502 -4.910 186 HA ILE 22 HA ILE 22 8.155 7.976 -2.549 187 HB ILE 22 HB ILE 22 9.449 5.258 -2.893 188 HG12 ILE 22 2HG1 ILE 22 6.585 6.028 -2.256 189 HG13 ILE 22 3HG1 ILE 22 7.156 5.398 -3.796 190 HG21 ILE 22 1HG2 ILE 22 10.006 6.204 -0.719 191 HG22 ILE 22 2HG2 ILE 22 8.852 4.883 -0.534 192 HG23 ILE 22 3HG2 ILE 22 8.303 6.555 -0.415 193 HD11 ILE 22 3HD1 ILE 22 6.040 3.684 -2.503 194 HD12 ILE 22 1HD1 ILE 22 7.169 3.925 -1.171 195 HD13 ILE 22 2HD1 ILE 22 7.746 3.291 -2.713 196 H LYS 23 H LYS 23 11.184 6.649 -3.940 197 HA LYS 23 HA LYS 23 12.917 7.464 -1.911 198 HB2 LYS 23 2HB LYS 23 13.409 6.983 -4.845 199 HB3 LYS 23 3HB LYS 23 14.707 7.424 -3.744 200 HG2 LYS 23 2HG LYS 23 14.070 5.420 -2.355 201 HG3 LYS 23 3HG LYS 23 13.004 4.939 -3.677 202 HD2 LYS 23 2HD LYS 23 15.982 5.409 -3.935 203 HD3 LYS 23 3HD LYS 23 15.226 3.827 -3.744 204 HE2 LYS 23 2HE LYS 23 14.623 5.719 -6.020 205 HE3 LYS 23 3HE LYS 23 15.820 4.428 -6.104 206 HZ1 LYS 23 3HZ LYS 23 14.124 2.807 -5.771 207 HZ2 LYS 23 1HZ LYS 23 13.634 3.823 -7.032 208 HZ3 LYS 23 2HZ LYS 23 12.951 3.996 -5.496 209 H LYS 24 H LYS 24 11.609 9.371 -4.573 210 HA LYS 24 HA LYS 24 13.397 11.517 -4.594 211 HB2 LYS 24 2HB LYS 24 11.461 11.183 -6.178 212 HB3 LYS 24 3HB LYS 24 10.391 11.764 -4.908 213 HG2 LYS 24 2HG LYS 24 12.082 13.819 -4.936 214 HG3 LYS 24 3HG LYS 24 12.350 13.255 -6.583 215 HD2 LYS 24 2HD LYS 24 10.648 14.917 -6.691 216 HD3 LYS 24 3HD LYS 24 9.845 13.361 -6.914 217 HE2 LYS 24 2HE LYS 24 9.102 13.366 -4.610 218 HE3 LYS 24 3HE LYS 24 10.017 14.837 -4.282 219 HZ1 LYS 24 3HZ LYS 24 7.674 15.301 -4.610 220 HZ2 LYS 24 1HZ LYS 24 7.720 14.607 -6.150 221 HZ3 LYS 24 2HZ LYS 24 8.589 16.026 -5.829 222 H ASN 25 H ASN 25 10.797 10.776 -2.361 223 HA ASN 25 HA ASN 25 10.884 13.390 -1.095 224 HB2 ASN 25 2HB ASN 25 9.267 10.922 -0.412 225 HB3 ASN 25 3HB ASN 25 9.044 12.518 0.294 226 HD21 ASN 25 1HD2 ASN 25 8.577 10.547 -2.525 227 HD22 ASN 25 2HD2 ASN 25 7.538 11.647 -3.355 228 H GLY 26 H GLY 26 12.820 10.747 -0.850 229 HA2 GLY 26 2HA GLY 26 14.608 10.545 0.659 230 HA3 GLY 26 3HA GLY 26 13.746 11.557 1.802 231 H PHE 27 H PHE 27 11.903 8.987 0.469 232 HA PHE 27 HA PHE 27 12.181 7.475 2.988 233 HB2 PHE 27 2HB PHE 27 9.852 7.617 1.056 234 HB3 PHE 27 3HB PHE 27 9.906 6.591 2.486 235 HD1 PHE 27 HD2 PHE 27 9.602 10.029 1.255 236 HD2 PHE 27 HD1 PHE 27 9.664 7.537 4.710 237 HE1 PHE 27 HE2 PHE 27 8.698 11.877 2.603 238 HE2 PHE 27 HE1 PHE 27 8.761 9.384 6.061 239 HZ PHE 27 HZ PHE 27 8.277 11.557 5.008 240 H LYS 28 H LYS 28 12.407 5.238 2.960 241 HA LYS 28 HA LYS 28 13.390 4.122 0.420 242 HB2 LYS 28 2HB LYS 28 13.863 3.142 3.247 243 HB3 LYS 28 3HB LYS 28 14.635 2.526 1.790 244 HG2 LYS 28 2HG LYS 28 14.919 5.340 2.849 245 HG3 LYS 28 3HG LYS 28 16.092 4.042 3.079 246 HD2 LYS 28 2HD LYS 28 16.672 4.002 0.801 247 HD3 LYS 28 3HD LYS 28 15.216 4.875 0.319 248 HE2 LYS 28 2HE LYS 28 17.323 6.225 0.224 249 HE3 LYS 28 3HE LYS 28 16.052 6.921 1.229 250 HZ1 LYS 28 3HZ LYS 28 17.162 6.180 3.182 251 HZ2 LYS 28 1HZ LYS 28 18.294 7.002 2.234 252 HZ3 LYS 28 2HZ LYS 28 18.309 5.312 2.288 253 H VAL 29 H VAL 29 12.695 2.117 -0.341 254 HA VAL 29 HA VAL 29 9.949 1.488 0.490 255 HB VAL 29 HB VAL 29 11.342 0.738 -2.089 256 HG11 VAL 29 1HG1 VAL 29 8.405 0.780 -1.368 257 HG12 VAL 29 2HG1 VAL 29 9.404 -0.664 -1.544 258 HG13 VAL 29 3HG1 VAL 29 9.082 0.361 -2.944 259 HG21 VAL 29 3HG2 VAL 29 9.520 3.084 -1.534 260 HG22 VAL 29 1HG2 VAL 29 10.159 2.619 -3.110 261 HG23 VAL 29 2HG2 VAL 29 11.256 3.170 -1.843 262 H ARG 30 H ARG 30 9.350 -0.462 1.258 263 HA ARG 30 HA ARG 30 11.200 -2.750 0.940 264 HB2 ARG 30 2HB ARG 30 9.072 -2.366 3.066 265 HB3 ARG 30 3HB ARG 30 10.150 -3.747 2.928 266 HG2 ARG 30 2HG ARG 30 12.060 -2.087 3.199 267 HG3 ARG 30 3HG ARG 30 10.831 -0.918 3.681 268 HD2 ARG 30 2HD ARG 30 11.717 -1.884 5.677 269 HD3 ARG 30 3HD ARG 30 10.101 -2.554 5.446 270 HE ARG 30 HE ARG 30 11.940 -4.289 4.253 271 HH11 ARG 30 1HH1 ARG 30 11.063 -3.207 7.410 272 HH12 ARG 30 2HH1 ARG 30 11.639 -4.650 8.172 273 HH21 ARG 30 1HH2 ARG 30 12.647 -6.122 5.252 274 HH22 ARG 30 2HH2 ARG 30 12.508 -6.277 6.974 275 H THR 31 H THR 31 10.523 -3.871 -0.814 276 HA THR 31 HA THR 31 7.737 -4.006 -1.557 277 HB THR 31 HB THR 31 8.478 -5.428 -3.428 278 HG1 THR 31 HG1 THR 31 10.318 -6.330 -2.113 279 HG21 THR 31 3HG2 THR 31 9.900 -3.761 -4.559 280 HG22 THR 31 1HG2 THR 31 10.176 -2.958 -3.013 281 HG23 THR 31 2HG2 THR 31 8.553 -3.007 -3.706 282 H VAL 32 H VAL 32 6.312 -5.425 -0.850 283 HA VAL 32 HA VAL 32 7.221 -7.983 0.304 284 HB VAL 32 HB VAL 32 4.658 -6.427 0.745 285 HG11 VAL 32 1HG1 VAL 32 4.067 -8.155 2.395 286 HG12 VAL 32 2HG1 VAL 32 5.471 -9.102 1.904 287 HG13 VAL 32 3HG1 VAL 32 4.159 -8.811 0.763 288 HG21 VAL 32 3HG2 VAL 32 6.604 -5.508 1.908 289 HG22 VAL 32 1HG2 VAL 32 6.931 -7.084 2.629 290 HG23 VAL 32 2HG2 VAL 32 5.458 -6.209 3.049 291 H ARG 33 H ARG 33 6.656 -9.854 -0.628 292 HA ARG 33 HA ARG 33 4.388 -9.913 -2.523 293 HB2 ARG 33 2HB ARG 33 6.685 -10.013 -3.625 294 HB3 ARG 33 3HB ARG 33 6.919 -11.556 -2.818 295 HG2 ARG 33 2HG ARG 33 6.224 -11.944 -5.080 296 HG3 ARG 33 3HG ARG 33 4.923 -12.429 -3.990 297 HD2 ARG 33 2HD ARG 33 3.730 -10.369 -4.429 298 HD3 ARG 33 3HD ARG 33 5.062 -9.771 -5.419 299 HE ARG 33 HE ARG 33 4.312 -12.125 -6.595 300 HH11 ARG 33 1HH1 ARG 33 2.668 -9.230 -5.741 301 HH12 ARG 33 2HH1 ARG 33 1.558 -9.339 -7.062 302 HH21 ARG 33 1HH2 ARG 33 2.909 -12.251 -8.289 303 HH22 ARG 33 2HH2 ARG 33 1.696 -11.042 -8.489 304 H SER 34 H SER 34 6.418 -11.656 -0.234 305 HA SER 34 HA SER 34 4.339 -13.710 0.153 306 HB2 SER 34 2HB SER 34 7.184 -13.660 1.217 307 HB3 SER 34 3HB SER 34 6.059 -15.016 1.285 308 HG SER 34 HG SER 34 7.748 -14.325 -0.679 309 HA PRO 35 HA PRO 35 2.853 -11.887 3.939 310 HB2 PRO 35 2HB PRO 35 2.667 -14.267 5.439 311 HB3 PRO 35 3HB PRO 35 1.401 -13.557 4.434 312 HG2 PRO 35 2HG PRO 35 3.319 -15.751 3.798 313 HG3 PRO 35 3HG PRO 35 1.630 -15.551 3.297 314 HD2 PRO 35 2HD PRO 35 3.647 -15.091 1.597 315 HD3 PRO 35 3HD PRO 35 2.186 -14.078 1.579 316 H GLN 36 H GLN 36 5.507 -14.217 4.137 317 HA GLN 36 HA GLN 36 6.450 -13.738 6.705 318 HB2 GLN 36 2HB GLN 36 7.235 -15.512 5.139 319 HB3 GLN 36 3HB GLN 36 8.110 -14.287 4.234 320 HG2 GLN 36 2HG GLN 36 9.652 -15.441 5.639 321 HG3 GLN 36 3HG GLN 36 9.443 -13.807 6.267 322 HE21 GLN 36 1HE2 GLN 36 8.705 -17.182 6.777 323 HE22 GLN 36 2HE2 GLN 36 8.291 -17.030 8.448 324 H GLU 37 H GLU 37 6.997 -11.877 3.757 325 HA GLU 37 HA GLU 37 9.023 -10.163 4.775 326 HB2 GLU 37 2HB GLU 37 7.055 -9.607 2.544 327 HB3 GLU 37 3HB GLU 37 8.591 -8.797 2.805 328 HG2 GLU 37 2HG GLU 37 8.253 -11.714 2.130 329 HG3 GLU 37 3HG GLU 37 8.667 -10.441 0.986 330 H LEU 38 H LEU 38 5.517 -9.655 4.306 331 HA LEU 38 HA LEU 38 5.337 -7.077 5.386 332 HB2 LEU 38 2HB LEU 38 3.532 -8.153 4.120 333 HB3 LEU 38 3HB LEU 38 3.286 -9.301 5.421 334 HG LEU 38 HG LEU 38 2.581 -7.445 6.906 335 HD11 LEU 38 1HD1 LEU 38 2.077 -5.248 5.905 336 HD12 LEU 38 2HD1 LEU 38 2.869 -5.764 4.416 337 HD13 LEU 38 3HD1 LEU 38 3.802 -5.614 5.906 338 HD21 LEU 38 3HD2 LEU 38 1.034 -7.600 4.315 339 HD22 LEU 38 1HD2 LEU 38 0.404 -7.075 5.877 340 HD23 LEU 38 2HD2 LEU 38 0.920 -8.746 5.650 341 H LYS 39 H LYS 39 4.954 -10.230 6.954 342 HA LYS 39 HA LYS 39 4.387 -9.505 9.555 343 HB2 LYS 39 2HB LYS 39 4.329 -11.801 8.970 344 HB3 LYS 39 3HB LYS 39 5.988 -11.779 8.391 345 HG2 LYS 39 2HG LYS 39 6.728 -11.399 10.749 346 HG3 LYS 39 3HG LYS 39 5.054 -11.648 11.252 347 HD2 LYS 39 2HD LYS 39 5.068 -13.901 10.547 348 HD3 LYS 39 3HD LYS 39 6.535 -13.675 9.590 349 HE2 LYS 39 2HE LYS 39 6.341 -13.606 12.606 350 HE3 LYS 39 3HE LYS 39 7.020 -14.912 11.633 351 HZ1 LYS 39 3HZ LYS 39 8.088 -12.170 11.986 352 HZ2 LYS 39 1HZ LYS 39 8.635 -13.210 10.768 353 HZ3 LYS 39 2HZ LYS 39 8.825 -13.636 12.394 354 H ASP 40 H ASP 40 7.677 -10.261 8.365 355 HA ASP 40 HA ASP 40 9.014 -9.378 10.654 356 HB2 ASP 40 2HB ASP 40 9.849 -9.929 7.833 357 HB3 ASP 40 3HB ASP 40 11.003 -9.208 8.953 358 H SER 41 H SER 41 8.240 -7.602 7.680 359 HA SER 41 HA SER 41 9.742 -5.312 8.124 360 HB2 SER 41 2HB SER 41 8.513 -5.693 6.030 361 HB3 SER 41 3HB SER 41 6.982 -5.462 6.875 362 HG SER 41 HG SER 41 7.273 -3.451 6.299 363 H ILE 42 H ILE 42 6.477 -6.042 9.316 364 HA ILE 42 HA ILE 42 6.090 -3.534 10.601 365 HB ILE 42 HB ILE 42 4.724 -6.192 11.086 366 HG12 ILE 42 2HG1 ILE 42 3.884 -3.782 9.443 367 HG13 ILE 42 3HG1 ILE 42 4.487 -5.299 8.787 368 HG21 ILE 42 1HG2 ILE 42 2.935 -4.895 12.158 369 HG22 ILE 42 2HG2 ILE 42 3.890 -3.424 11.975 370 HG23 ILE 42 3HG2 ILE 42 4.461 -4.720 13.025 371 HD11 ILE 42 3HD1 ILE 42 2.084 -5.159 8.595 372 HD12 ILE 42 1HD1 ILE 42 1.932 -4.926 10.336 373 HD13 ILE 42 2HD1 ILE 42 2.535 -6.457 9.699 374 H GLU 43 H GLU 43 7.225 -6.697 11.822 375 HA GLU 43 HA GLU 43 7.375 -5.815 14.538 376 HB2 GLU 43 2HB GLU 43 8.532 -7.927 14.990 377 HB3 GLU 43 3HB GLU 43 7.070 -8.165 14.048 378 HG2 GLU 43 2HG GLU 43 8.487 -8.317 12.013 379 HG3 GLU 43 3HG GLU 43 9.908 -8.258 13.053 380 H GLU 44 H GLU 44 9.542 -5.522 11.848 381 HA GLU 44 HA GLU 44 11.802 -4.726 13.464 382 HB2 GLU 44 2HB GLU 44 11.199 -4.344 10.521 383 HB3 GLU 44 3HB GLU 44 12.704 -3.854 11.285 384 HG2 GLU 44 2HG GLU 44 13.167 -6.178 11.885 385 HG3 GLU 44 3HG GLU 44 11.650 -6.675 11.136 386 H LEU 45 H LEU 45 9.345 -3.018 11.524 387 HA LEU 45 HA LEU 45 10.251 -0.403 12.059 388 HB2 LEU 45 2HB LEU 45 7.532 -1.430 11.252 389 HB3 LEU 45 3HB LEU 45 7.923 0.277 11.358 390 HG LEU 45 HG LEU 45 9.239 -1.717 9.500 391 HD11 LEU 45 1HD1 LEU 45 8.102 -0.479 7.715 392 HD12 LEU 45 2HD1 LEU 45 7.286 0.513 8.925 393 HD13 LEU 45 3HD1 LEU 45 6.953 -1.216 8.833 394 HD21 LEU 45 3HD2 LEU 45 10.315 0.261 8.499 395 HD22 LEU 45 1HD2 LEU 45 10.811 0.008 10.173 396 HD23 LEU 45 2HD2 LEU 45 9.637 1.266 9.781 397 H VAL 46 H VAL 46 8.177 -2.526 13.946 398 HA VAL 46 HA VAL 46 7.129 -0.518 15.667 399 HB VAL 46 HB VAL 46 6.174 -2.820 15.488 400 HG11 VAL 46 1HG1 VAL 46 7.165 -4.640 16.789 401 HG12 VAL 46 2HG1 VAL 46 8.546 -3.616 17.180 402 HG13 VAL 46 3HG1 VAL 46 8.253 -4.100 15.511 403 HG21 VAL 46 3HG2 VAL 46 5.597 -3.042 17.861 404 HG22 VAL 46 1HG2 VAL 46 5.552 -1.356 17.343 405 HG23 VAL 46 2HG2 VAL 46 6.919 -1.953 18.286 406 H LYS 47 H LYS 47 10.194 -2.143 15.527 407 HA LYS 47 HA LYS 47 11.016 -1.290 18.187 408 HB2 LYS 47 2HB LYS 47 12.599 -2.624 15.972 409 HB3 LYS 47 3HB LYS 47 13.167 -2.360 17.616 410 HG2 LYS 47 2HG LYS 47 10.828 -4.098 16.822 411 HG3 LYS 47 3HG LYS 47 12.441 -4.670 17.260 412 HD2 LYS 47 2HD LYS 47 12.167 -3.717 19.509 413 HD3 LYS 47 3HD LYS 47 10.560 -3.134 19.070 414 HE2 LYS 47 2HE LYS 47 9.835 -5.457 18.692 415 HE3 LYS 47 3HE LYS 47 11.436 -6.026 19.159 416 HZ1 LYS 47 3HZ LYS 47 9.812 -6.183 20.964 417 HZ2 LYS 47 1HZ LYS 47 9.592 -4.506 20.926 418 HZ3 LYS 47 2HZ LYS 47 11.092 -5.149 21.363 419 H LYS 48 H LYS 48 11.739 -0.489 14.798 420 HA LYS 48 HA LYS 48 12.531 2.196 15.661 421 HB2 LYS 48 2HB LYS 48 14.487 2.190 14.124 422 HB3 LYS 48 3HB LYS 48 14.663 1.086 15.479 423 HG2 LYS 48 2HG LYS 48 14.308 -0.813 14.113 424 HG3 LYS 48 3HG LYS 48 13.723 0.171 12.769 425 HD2 LYS 48 2HD LYS 48 16.005 -0.619 12.360 426 HD3 LYS 48 3HD LYS 48 15.954 1.139 12.490 427 HE2 LYS 48 2HE LYS 48 16.701 0.938 14.851 428 HE3 LYS 48 3HE LYS 48 16.849 -0.805 14.624 429 HZ1 LYS 48 3HZ LYS 48 18.973 0.298 14.350 430 HZ2 LYS 48 1HZ LYS 48 18.344 1.275 13.120 431 HZ3 LYS 48 2HZ LYS 48 18.484 -0.390 12.886 432 H TYR 49 H TYR 49 11.756 3.770 14.366 433 HA TYR 49 HA TYR 49 10.754 3.025 11.690 434 HB2 TYR 49 2HB TYR 49 8.789 4.494 12.056 435 HB3 TYR 49 3HB TYR 49 8.828 3.138 13.175 436 HD1 TYR 49 HD2 TYR 49 9.783 3.604 15.547 437 HD2 TYR 49 HD1 TYR 49 8.541 6.686 12.879 438 HE1 TYR 49 HE2 TYR 49 9.593 5.160 17.440 439 HE2 TYR 49 HE1 TYR 49 8.350 8.247 14.770 440 HH TYR 49 HH TYR 49 9.599 7.533 17.885 441 H ASN 50 H ASN 50 11.996 4.093 10.264 442 HA ASN 50 HA ASN 50 12.347 6.978 10.554 443 HB2 ASN 50 2HB ASN 50 14.290 5.929 11.716 444 HB3 ASN 50 3HB ASN 50 14.730 5.138 10.208 445 HD21 ASN 50 1HD2 ASN 50 14.602 8.149 11.934 446 HD22 ASN 50 2HD2 ASN 50 15.604 9.036 10.843 447 H ALA 51 H ALA 51 11.305 7.494 8.694 448 HA ALA 51 HA ALA 51 10.913 7.815 6.470 449 HB1 ALA 51 3HB ALA 51 13.139 8.839 6.769 450 HB2 ALA 51 1HB ALA 51 12.878 8.240 5.131 451 HB3 ALA 51 2HB ALA 51 13.881 7.324 6.256 452 H THR 52 H THR 52 10.359 5.121 7.191 453 HA THR 52 HA THR 52 11.229 3.639 4.780 454 HB THR 52 HB THR 52 10.488 2.458 7.473 455 HG1 THR 52 HG1 THR 52 12.698 3.596 6.921 456 HG21 THR 52 3HG2 THR 52 11.539 1.136 4.960 457 HG22 THR 52 1HG2 THR 52 9.910 0.968 5.613 458 HG23 THR 52 2HG2 THR 52 11.289 0.338 6.512 459 H ILE 53 H ILE 53 9.667 3.104 3.384 460 HA ILE 53 HA ILE 53 6.874 2.902 4.345 461 HB ILE 53 HB ILE 53 7.848 3.793 1.616 462 HG12 ILE 53 2HG1 ILE 53 6.441 5.307 3.839 463 HG13 ILE 53 3HG1 ILE 53 8.107 5.532 3.321 464 HG21 ILE 53 1HG2 ILE 53 5.487 4.170 1.072 465 HG22 ILE 53 2HG2 ILE 53 5.015 3.502 2.634 466 HG23 ILE 53 3HG2 ILE 53 5.794 2.472 1.434 467 HD11 ILE 53 3HD1 ILE 53 5.642 6.123 1.696 468 HD12 ILE 53 1HD1 ILE 53 7.306 6.312 1.140 469 HD13 ILE 53 2HD1 ILE 53 6.703 7.300 2.470 470 H VAL 54 H VAL 54 5.694 1.095 3.763 471 HA VAL 54 HA VAL 54 7.210 -1.018 2.364 472 HB VAL 54 HB VAL 54 6.708 -1.513 4.719 473 HG11 VAL 54 1HG1 VAL 54 3.807 -1.371 3.885 474 HG12 VAL 54 2HG1 VAL 54 4.635 -0.281 4.997 475 HG13 VAL 54 3HG1 VAL 54 4.397 -1.973 5.435 476 HG21 VAL 54 3HG2 VAL 54 6.949 -3.341 3.127 477 HG22 VAL 54 1HG2 VAL 54 5.222 -3.279 2.769 478 HG23 VAL 54 2HG2 VAL 54 5.773 -3.751 4.377 479 H VAL 55 H VAL 55 6.380 -2.035 0.623 480 HA VAL 55 HA VAL 55 3.682 -1.241 -0.296 481 HB VAL 55 HB VAL 55 6.105 -1.813 -2.026 482 HG11 VAL 55 1HG1 VAL 55 4.689 -1.025 -3.886 483 HG12 VAL 55 2HG1 VAL 55 3.317 -0.917 -2.783 484 HG13 VAL 55 3HG1 VAL 55 4.049 -2.483 -3.131 485 HG21 VAL 55 3HG2 VAL 55 4.722 0.810 -1.432 486 HG22 VAL 55 1HG2 VAL 55 6.038 0.577 -2.585 487 HG23 VAL 55 2HG2 VAL 55 6.320 0.325 -0.862 488 H VAL 56 H VAL 56 2.344 -2.940 -0.171 489 HA VAL 56 HA VAL 56 3.382 -5.667 -0.403 490 HB VAL 56 HB VAL 56 0.585 -4.752 0.318 491 HG11 VAL 56 1HG1 VAL 56 0.283 -7.040 1.163 492 HG12 VAL 56 2HG1 VAL 56 1.894 -7.468 0.583 493 HG13 VAL 56 3HG1 VAL 56 0.628 -7.030 -0.567 494 HG21 VAL 56 3HG2 VAL 56 2.842 -5.638 2.127 495 HG22 VAL 56 1HG2 VAL 56 1.201 -5.237 2.636 496 HG23 VAL 56 2HG2 VAL 56 2.244 -3.987 1.956 497 H VAL 57 H VAL 57 3.612 -6.278 -2.487 498 HA VAL 57 HA VAL 57 1.537 -5.618 -4.456 499 HB VAL 57 HB VAL 57 4.179 -7.031 -4.917 500 HG11 VAL 57 1HG1 VAL 57 3.826 -6.430 -7.266 501 HG12 VAL 57 2HG1 VAL 57 2.280 -5.689 -6.853 502 HG13 VAL 57 3HG1 VAL 57 2.503 -7.428 -6.662 503 HG21 VAL 57 3HG2 VAL 57 4.576 -4.798 -4.014 504 HG22 VAL 57 1HG2 VAL 57 3.500 -4.099 -5.224 505 HG23 VAL 57 2HG2 VAL 57 5.013 -4.858 -5.721 506 H VAL 58 H VAL 58 -0.107 -7.022 -4.666 507 HA VAL 58 HA VAL 58 0.287 -9.809 -3.781 508 HB VAL 58 HB VAL 58 -2.114 -9.912 -3.424 509 HG11 VAL 58 1HG1 VAL 58 -2.333 -8.249 -1.630 510 HG12 VAL 58 2HG1 VAL 58 -0.924 -7.391 -2.256 511 HG13 VAL 58 3HG1 VAL 58 -0.747 -9.022 -1.609 512 HG21 VAL 58 3HG2 VAL 58 -2.188 -7.078 -4.478 513 HG22 VAL 58 1HG2 VAL 58 -3.551 -7.949 -3.771 514 HG23 VAL 58 2HG2 VAL 58 -2.840 -8.504 -5.286 515 H ASP 59 H ASP 59 -1.301 -11.408 -4.863 516 HA ASP 59 HA ASP 59 -1.277 -11.058 -7.787 517 HB2 ASP 59 2HB ASP 59 -1.635 -13.530 -6.080 518 HB3 ASP 59 3HB ASP 59 -1.744 -13.522 -7.833 519 H ASP 60 H ASP 60 -3.420 -11.700 -5.061 520 HA ASP 60 HA ASP 60 -5.756 -11.178 -6.759 521 HB2 ASP 60 2HB ASP 60 -6.945 -13.064 -5.498 522 HB3 ASP 60 3HB ASP 60 -5.768 -13.544 -6.717 523 H LYS 61 H LYS 61 -7.803 -10.941 -5.343 524 HA LYS 61 HA LYS 61 -7.311 -8.877 -3.438 525 HB2 LYS 61 2HB LYS 61 -9.338 -8.971 -4.894 526 HB3 LYS 61 3HB LYS 61 -9.915 -10.341 -3.951 527 HG2 LYS 61 2HG LYS 61 -9.942 -8.903 -1.935 528 HG3 LYS 61 3HG LYS 61 -9.439 -7.537 -2.930 529 HD2 LYS 61 2HD LYS 61 -11.784 -7.333 -2.688 530 HD3 LYS 61 3HD LYS 61 -11.523 -7.948 -4.320 531 HE2 LYS 61 2HE LYS 61 -13.356 -9.144 -3.330 532 HE3 LYS 61 3HE LYS 61 -11.985 -10.242 -3.472 533 HZ1 LYS 61 3HZ LYS 61 -12.752 -8.806 -0.980 534 HZ2 LYS 61 1HZ LYS 61 -11.528 -9.965 -1.134 535 HZ3 LYS 61 2HZ LYS 61 -13.148 -10.410 -1.326 536 H GLU 62 H GLU 62 -7.760 -12.314 -3.143 537 HA GLU 62 HA GLU 62 -8.758 -12.436 -0.511 538 HB2 GLU 62 2HB GLU 62 -8.821 -14.373 -1.979 539 HB3 GLU 62 3HB GLU 62 -7.064 -14.427 -2.040 540 HG2 GLU 62 2HG GLU 62 -7.040 -14.879 0.403 541 HG3 GLU 62 3HG GLU 62 -8.801 -14.943 0.369 542 H TRP 63 H TRP 63 -5.372 -12.918 -1.613 543 HA TRP 63 HA TRP 63 -4.213 -12.851 0.946 544 HB2 TRP 63 2HB TRP 63 -2.881 -13.671 -0.836 545 HB3 TRP 63 3HB TRP 63 -3.130 -12.226 -1.802 546 HD1 TRP 63 HD1 TRP 63 -0.697 -11.436 -2.123 547 HE1 TRP 63 HE1 TRP 63 1.201 -10.681 -0.564 548 HE3 TRP 63 HE3 TRP 63 -2.740 -12.778 2.381 549 HZ2 TRP 63 HZ2 TRP 63 1.763 -10.645 2.192 550 HZ3 TRP 63 HZ3 TRP 63 -1.451 -12.341 4.428 551 HH2 TRP 63 HH2 TRP 63 0.752 -11.297 4.336 552 H ALA 64 H ALA 64 -5.010 -10.229 -1.291 553 HA ALA 64 HA ALA 64 -3.787 -8.110 0.072 554 HB1 ALA 64 3HB ALA 64 -6.346 -8.011 -1.531 555 HB2 ALA 64 1HB ALA 64 -4.715 -7.944 -2.203 556 HB3 ALA 64 2HB ALA 64 -5.289 -6.651 -1.152 557 H GLU 65 H GLU 65 -7.106 -9.401 0.439 558 HA GLU 65 HA GLU 65 -7.818 -7.527 2.474 559 HB2 GLU 65 2HB GLU 65 -9.868 -8.789 2.714 560 HB3 GLU 65 3HB GLU 65 -9.495 -8.600 1.009 561 HG2 GLU 65 2HG GLU 65 -8.638 -10.895 0.945 562 HG3 GLU 65 3HG GLU 65 -9.036 -11.083 2.652 563 H LYS 66 H LYS 66 -6.559 -10.834 2.519 564 HA LYS 66 HA LYS 66 -6.733 -11.285 5.297 565 HB2 LYS 66 2HB LYS 66 -4.802 -12.327 3.220 566 HB3 LYS 66 3HB LYS 66 -4.771 -12.858 4.898 567 HG2 LYS 66 2HG LYS 66 -7.028 -13.729 4.700 568 HG3 LYS 66 3HG LYS 66 -7.141 -13.123 3.045 569 HD2 LYS 66 2HD LYS 66 -5.358 -14.625 2.345 570 HD3 LYS 66 3HD LYS 66 -5.142 -15.183 4.005 571 HE2 LYS 66 2HE LYS 66 -7.329 -16.192 4.009 572 HE3 LYS 66 3HE LYS 66 -7.705 -15.488 2.437 573 HZ1 LYS 66 3HZ LYS 66 -5.627 -17.541 2.982 574 HZ2 LYS 66 1HZ LYS 66 -5.916 -16.825 1.480 575 HZ3 LYS 66 2HZ LYS 66 -7.101 -17.793 2.188 576 H ALA 67 H ALA 67 -4.231 -9.692 3.339 577 HA ALA 67 HA ALA 67 -2.380 -9.132 5.361 578 HB1 ALA 67 3HB ALA 67 -3.091 -7.428 2.967 579 HB2 ALA 67 1HB ALA 67 -1.926 -8.752 2.984 580 HB3 ALA 67 2HB ALA 67 -1.618 -7.294 3.928 581 H ILE 68 H ILE 68 -5.248 -7.299 4.320 582 HA ILE 68 HA ILE 68 -5.016 -5.155 6.131 583 HB ILE 68 HB ILE 68 -7.551 -6.346 4.974 584 HG12 ILE 68 2HG1 ILE 68 -6.001 -5.713 3.202 585 HG13 ILE 68 3HG1 ILE 68 -7.328 -4.557 3.256 586 HG21 ILE 68 1HG2 ILE 68 -7.053 -3.606 6.153 587 HG22 ILE 68 2HG2 ILE 68 -8.026 -4.889 6.873 588 HG23 ILE 68 3HG2 ILE 68 -8.543 -4.132 5.366 589 HD11 ILE 68 3HD1 ILE 68 -4.563 -4.140 4.373 590 HD12 ILE 68 1HD1 ILE 68 -5.891 -2.982 4.460 591 HD13 ILE 68 2HD1 ILE 68 -5.218 -3.438 2.895 592 H ARG 69 H ARG 69 -6.451 -8.374 6.510 593 HA ARG 69 HA ARG 69 -7.648 -7.940 9.042 594 HB2 ARG 69 2HB ARG 69 -6.523 -10.558 8.014 595 HB3 ARG 69 3HB ARG 69 -7.745 -10.352 9.263 596 HG2 ARG 69 2HG ARG 69 -9.176 -9.252 7.461 597 HG3 ARG 69 3HG ARG 69 -8.004 -9.885 6.305 598 HD2 ARG 69 2HD ARG 69 -9.859 -11.412 6.463 599 HD3 ARG 69 3HD ARG 69 -8.436 -12.166 7.184 600 HE ARG 69 HE ARG 69 -9.380 -11.667 9.365 601 HH11 ARG 69 1HH1 ARG 69 -11.512 -11.446 6.662 602 HH12 ARG 69 2HH1 ARG 69 -12.934 -11.592 7.634 603 HH21 ARG 69 1HH2 ARG 69 -11.207 -11.890 10.592 604 HH22 ARG 69 2HH2 ARG 69 -12.763 -11.850 9.838 605 H PHE 70 H PHE 70 -4.415 -9.016 8.087 606 HA PHE 70 HA PHE 70 -3.362 -9.500 10.653 607 HB2 PHE 70 2HB PHE 70 -2.288 -10.146 8.479 608 HB3 PHE 70 3HB PHE 70 -1.857 -8.459 8.234 609 HD1 PHE 70 HD1 PHE 70 -1.158 -11.505 10.141 610 HD2 PHE 70 HD2 PHE 70 -0.083 -7.423 9.546 611 HE1 PHE 70 HE1 PHE 70 0.925 -11.870 11.399 612 HE2 PHE 70 HE2 PHE 70 1.999 -7.788 10.806 613 HZ PHE 70 HZ PHE 70 2.507 -10.011 11.730 614 H VAL 71 H VAL 71 -3.395 -6.536 8.672 615 HA VAL 71 HA VAL 71 -2.076 -4.833 10.482 616 HB VAL 71 HB VAL 71 -4.238 -4.110 8.484 617 HG11 VAL 71 1HG1 VAL 71 -3.287 -1.848 8.559 618 HG12 VAL 71 2HG1 VAL 71 -2.168 -2.359 9.821 619 HG13 VAL 71 3HG1 VAL 71 -3.902 -2.340 10.136 620 HG21 VAL 71 3HG2 VAL 71 -2.375 -3.543 6.983 621 HG22 VAL 71 1HG2 VAL 71 -2.354 -5.248 7.427 622 HG23 VAL 71 2HG2 VAL 71 -1.228 -4.126 8.189 623 H LYS 72 H LYS 72 -5.538 -5.588 10.129 624 HA LYS 72 HA LYS 72 -6.530 -3.880 12.121 625 HB2 LYS 72 2HB LYS 72 -7.838 -5.221 10.387 626 HB3 LYS 72 3HB LYS 72 -7.665 -6.609 11.446 627 HG2 LYS 72 2HG LYS 72 -8.929 -4.040 12.377 628 HG3 LYS 72 3HG LYS 72 -9.850 -5.295 11.551 629 HD2 LYS 72 2HD LYS 72 -9.281 -6.898 13.301 630 HD3 LYS 72 3HD LYS 72 -8.287 -5.687 14.112 631 HE2 LYS 72 2HE LYS 72 -11.274 -5.555 13.683 632 HE3 LYS 72 3HE LYS 72 -10.455 -5.896 15.205 633 HZ1 LYS 72 3HZ LYS 72 -11.102 -3.620 15.190 634 HZ2 LYS 72 1HZ LYS 72 -10.395 -3.357 13.679 635 HZ3 LYS 72 2HZ LYS 72 -9.422 -3.667 15.022 636 H SER 73 H SER 73 -5.116 -7.106 12.323 637 HA SER 73 HA SER 73 -5.718 -7.685 15.017 638 HB2 SER 73 2HB SER 73 -3.337 -8.577 13.362 639 HB3 SER 73 3HB SER 73 -3.836 -9.298 14.892 640 HG SER 73 HG SER 73 -5.449 -9.164 12.546 641 H LEU 74 H LEU 74 -3.395 -5.521 13.634 642 HA LEU 74 HA LEU 74 -1.643 -5.336 15.887 643 HB2 LEU 74 2HB LEU 74 -2.133 -3.334 13.671 644 HB3 LEU 74 3HB LEU 74 -0.772 -3.330 14.777 645 HG LEU 74 HG LEU 74 -1.345 -5.496 12.743 646 HD11 LEU 74 1HD1 LEU 74 0.594 -4.596 11.542 647 HD12 LEU 74 2HD1 LEU 74 0.700 -3.276 12.706 648 HD13 LEU 74 3HD1 LEU 74 -0.712 -3.416 11.657 649 HD21 LEU 74 3HD2 LEU 74 1.044 -5.072 14.545 650 HD22 LEU 74 1HD2 LEU 74 0.890 -6.320 13.310 651 HD23 LEU 74 2HD2 LEU 74 -0.170 -6.338 14.718 652 H GLY 75 H GLY 75 -4.527 -3.564 14.856 653 HA2 GLY 75 2HA GLY 75 -6.004 -2.373 16.217 654 HA3 GLY 75 3HA GLY 75 -4.850 -2.471 17.537 655 H ALA 76 H ALA 76 -3.142 -1.432 14.921 656 HA ALA 76 HA ALA 76 -3.348 1.383 15.758 657 HB1 ALA 76 3HB ALA 76 -1.125 1.663 14.820 658 HB2 ALA 76 1HB ALA 76 -1.149 0.006 14.211 659 HB3 ALA 76 2HB ALA 76 -1.141 0.307 15.950 660 H GLN 77 H GLN 77 -3.873 2.996 14.334 661 HA GLN 77 HA GLN 77 -5.040 2.231 11.807 662 HB2 GLN 77 2HB GLN 77 -5.621 4.622 11.583 663 HB3 GLN 77 3HB GLN 77 -6.147 3.945 13.117 664 HG2 GLN 77 2HG GLN 77 -4.391 5.037 14.298 665 HG3 GLN 77 3HG GLN 77 -3.605 5.528 12.799 666 HE21 GLN 77 1HE2 GLN 77 -6.279 6.114 14.952 667 HE22 GLN 77 2HE2 GLN 77 -6.700 7.665 14.311 668 H VAL 78 H VAL 78 -4.200 2.427 9.817 669 HA VAL 78 HA VAL 78 -1.757 4.019 9.419 670 HB VAL 78 HB VAL 78 -0.863 2.248 7.900 671 HG11 VAL 78 1HG1 VAL 78 -0.008 0.791 9.669 672 HG12 VAL 78 2HG1 VAL 78 -1.265 1.365 10.766 673 HG13 VAL 78 3HG1 VAL 78 -0.020 2.475 10.191 674 HG21 VAL 78 3HG2 VAL 78 -2.963 1.070 7.438 675 HG22 VAL 78 1HG2 VAL 78 -3.039 0.533 9.118 676 HG23 VAL 78 2HG2 VAL 78 -1.741 -0.034 8.067 677 H LEU 79 H LEU 79 -1.417 4.753 7.261 678 HA LEU 79 HA LEU 79 -3.899 5.083 5.750 679 HB2 LEU 79 2HB LEU 79 -2.603 7.077 6.284 680 HB3 LEU 79 3HB LEU 79 -1.194 6.405 5.485 681 HG LEU 79 HG LEU 79 -2.297 6.562 3.315 682 HD11 LEU 79 1HD1 LEU 79 -4.494 7.651 3.086 683 HD12 LEU 79 2HD1 LEU 79 -4.657 7.677 4.844 684 HD13 LEU 79 3HD1 LEU 79 -4.597 6.137 3.984 685 HD21 LEU 79 3HD2 LEU 79 -2.534 9.135 4.880 686 HD22 LEU 79 1HD2 LEU 79 -2.402 8.991 3.127 687 HD23 LEU 79 2HD2 LEU 79 -1.055 8.505 4.155 688 H ILE 80 H ILE 80 -4.311 4.015 3.902 689 HA ILE 80 HA ILE 80 -2.129 2.405 2.721 690 HB ILE 80 HB ILE 80 -5.076 1.713 2.870 691 HG12 ILE 80 2HG1 ILE 80 -2.716 0.498 4.342 692 HG13 ILE 80 3HG1 ILE 80 -3.890 1.595 5.058 693 HG21 ILE 80 1HG2 ILE 80 -4.381 -0.497 2.015 694 HG22 ILE 80 2HG2 ILE 80 -2.738 0.113 1.816 695 HG23 ILE 80 3HG2 ILE 80 -4.053 0.797 0.861 696 HD11 ILE 80 3HD1 ILE 80 -5.658 -0.050 4.660 697 HD12 ILE 80 1HD1 ILE 80 -4.360 -0.697 5.663 698 HD13 ILE 80 2HD1 ILE 80 -4.465 -1.149 3.962 699 H ILE 81 H ILE 81 -1.909 2.340 0.504 700 HA ILE 81 HA ILE 81 -3.886 3.841 -1.112 701 HB ILE 81 HB ILE 81 -0.892 3.720 -1.581 702 HG12 ILE 81 2HG1 ILE 81 -2.713 6.004 -0.756 703 HG13 ILE 81 3HG1 ILE 81 -1.468 5.247 0.233 704 HG21 ILE 81 1HG2 ILE 81 -2.102 3.694 -3.694 705 HG22 ILE 81 2HG2 ILE 81 -1.320 5.257 -3.461 706 HG23 ILE 81 3HG2 ILE 81 -3.055 5.091 -3.189 707 HD11 ILE 81 3HD1 ILE 81 -1.042 6.890 -2.250 708 HD12 ILE 81 1HD1 ILE 81 0.235 6.067 -1.351 709 HD13 ILE 81 2HD1 ILE 81 -0.688 7.361 -0.588 710 H ILE 82 H ILE 82 -4.739 2.780 -2.821 711 HA ILE 82 HA ILE 82 -3.686 0.075 -3.409 712 HB ILE 82 HB ILE 82 -6.523 1.098 -3.690 713 HG12 ILE 82 2HG1 ILE 82 -5.377 -0.891 -1.708 714 HG13 ILE 82 3HG1 ILE 82 -5.771 0.784 -1.336 715 HG21 ILE 82 1HG2 ILE 82 -6.004 -0.590 -5.368 716 HG22 ILE 82 2HG2 ILE 82 -7.106 -1.243 -4.157 717 HG23 ILE 82 3HG2 ILE 82 -5.395 -1.669 -4.113 718 HD11 ILE 82 3HD1 ILE 82 -7.735 -1.319 -2.227 719 HD12 ILE 82 1HD1 ILE 82 -8.114 0.354 -1.815 720 HD13 ILE 82 2HD1 ILE 82 -7.506 -0.743 -0.574 721 H TYR 83 H TYR 83 -3.071 -0.399 -5.440 722 HA TYR 83 HA TYR 83 -3.851 1.441 -7.626 723 HB2 TYR 83 2HB TYR 83 -1.470 1.669 -7.111 724 HB3 TYR 83 3HB TYR 83 -1.244 -0.068 -7.279 725 HD1 TYR 83 HD2 TYR 83 -2.108 3.017 -9.166 726 HD2 TYR 83 HD1 TYR 83 -0.831 -1.040 -9.407 727 HE1 TYR 83 HE2 TYR 83 -1.635 3.312 -11.560 728 HE2 TYR 83 HE1 TYR 83 -0.356 -0.752 -11.800 729 HH TYR 83 HH TYR 83 -0.240 2.290 -13.301 730 H ASP 84 H ASP 84 -5.206 0.514 -9.009 731 HA ASP 84 HA ASP 84 -4.602 -2.111 -10.118 732 HB2 ASP 84 2HB ASP 84 -6.215 -2.362 -8.114 733 HB3 ASP 84 3HB ASP 84 -7.415 -1.582 -9.139 734 H GLN 85 H GLN 85 -6.032 -2.553 -12.072 735 HA GLN 85 HA GLN 85 -6.275 -0.028 -13.563 736 HB2 GLN 85 2HB GLN 85 -5.809 -2.871 -14.454 737 HB3 GLN 85 3HB GLN 85 -6.180 -1.575 -15.583 738 HG2 GLN 85 2HG GLN 85 -3.854 -1.458 -13.676 739 HG3 GLN 85 3HG GLN 85 -3.738 -2.150 -15.291 740 HE21 GLN 85 1HE2 GLN 85 -2.255 -0.602 -15.957 741 HE22 GLN 85 2HE2 GLN 85 -2.698 1.037 -16.261 742 H ASP 86 H ASP 86 -8.286 -2.443 -12.231 743 HA ASP 86 HA ASP 86 -10.483 -1.771 -14.086 744 HB2 ASP 86 2HB ASP 86 -9.998 -4.191 -13.687 745 HB3 ASP 86 3HB ASP 86 -10.393 -3.957 -11.985 746 H GLN 87 H GLN 87 -12.207 -0.580 -13.410 747 HA GLN 87 HA GLN 87 -11.847 1.031 -11.113 748 HB2 GLN 87 2HB GLN 87 -14.185 0.748 -13.001 749 HB3 GLN 87 3HB GLN 87 -14.112 1.956 -11.724 750 HG2 GLN 87 2HG GLN 87 -12.050 1.706 -13.908 751 HG3 GLN 87 3HG GLN 87 -13.452 2.769 -13.997 752 HE21 GLN 87 1HE2 GLN 87 -12.093 4.577 -14.146 753 HE22 GLN 87 2HE2 GLN 87 -11.249 5.191 -12.773 754 H ASN 88 H ASN 88 -14.565 -1.240 -11.781 755 HA ASN 88 HA ASN 88 -15.735 -1.068 -9.244 756 HB2 ASN 88 2HB ASN 88 -16.713 -2.124 -11.340 757 HB3 ASN 88 3HB ASN 88 -15.750 -3.550 -10.979 758 HD21 ASN 88 1HD2 ASN 88 -18.625 -3.274 -11.142 759 HD22 ASN 88 2HD2 ASN 88 -19.252 -3.763 -9.610 760 H ARG 89 H ARG 89 -13.326 -3.363 -10.464 761 HA ARG 89 HA ARG 89 -12.955 -4.893 -8.137 762 HB2 ARG 89 2HB ARG 89 -11.942 -5.945 -9.865 763 HB3 ARG 89 3HB ARG 89 -11.610 -4.446 -10.708 764 HG2 ARG 89 2HG ARG 89 -9.514 -5.306 -10.325 765 HG3 ARG 89 3HG ARG 89 -9.700 -4.153 -9.010 766 HD2 ARG 89 2HD ARG 89 -10.141 -5.912 -7.441 767 HD3 ARG 89 3HD ARG 89 -10.249 -7.110 -8.738 768 HE ARG 89 HE ARG 89 -7.764 -5.664 -8.061 769 HH11 ARG 89 1HH1 ARG 89 -9.407 -8.561 -8.949 770 HH12 ARG 89 2HH1 ARG 89 -7.943 -9.439 -9.197 771 HH21 ARG 89 1HH2 ARG 89 -5.917 -6.780 -8.408 772 HH22 ARG 89 2HH2 ARG 89 -5.973 -8.435 -8.899 773 H LEU 90 H LEU 90 -11.288 -1.935 -9.215 774 HA LEU 90 HA LEU 90 -9.457 -1.708 -7.091 775 HB2 LEU 90 2HB LEU 90 -9.303 -0.389 -9.151 776 HB3 LEU 90 3HB LEU 90 -10.792 0.442 -8.749 777 HG LEU 90 HG LEU 90 -9.665 1.450 -6.772 778 HD11 LEU 90 1HD1 LEU 90 -7.960 -0.263 -6.407 779 HD12 LEU 90 2HD1 LEU 90 -7.239 1.335 -6.573 780 HD13 LEU 90 3HD1 LEU 90 -7.167 0.194 -7.916 781 HD21 LEU 90 3HD2 LEU 90 -8.301 3.043 -8.038 782 HD22 LEU 90 1HD2 LEU 90 -9.808 2.681 -8.874 783 HD23 LEU 90 2HD2 LEU 90 -8.299 1.951 -9.423 784 H GLU 91 H GLU 91 -12.702 -0.308 -7.494 785 HA GLU 91 HA GLU 91 -12.875 0.960 -4.989 786 HB2 GLU 91 2HB GLU 91 -15.039 -0.121 -6.806 787 HB3 GLU 91 3HB GLU 91 -15.360 0.853 -5.377 788 HG2 GLU 91 2HG GLU 91 -14.123 2.714 -6.340 789 HG3 GLU 91 3HG GLU 91 -13.736 1.739 -7.758 790 H GLU 92 H GLU 92 -13.756 -2.315 -6.017 791 HA GLU 92 HA GLU 92 -15.215 -3.196 -3.851 792 HB2 GLU 92 2HB GLU 92 -14.866 -4.505 -5.910 793 HB3 GLU 92 3HB GLU 92 -13.195 -4.794 -5.444 794 HG2 GLU 92 2HG GLU 92 -14.477 -6.754 -4.952 795 HG3 GLU 92 3HG GLU 92 -14.008 -5.997 -3.430 796 H PHE 93 H PHE 93 -11.664 -3.633 -4.222 797 HA PHE 93 HA PHE 93 -11.300 -4.617 -1.597 798 HB2 PHE 93 2HB PHE 93 -9.653 -4.962 -3.414 799 HB3 PHE 93 3HB PHE 93 -9.249 -3.248 -3.354 800 HD1 PHE 93 HD1 PHE 93 -9.785 -5.810 -0.690 801 HD2 PHE 93 HD2 PHE 93 -7.120 -3.007 -2.473 802 HE1 PHE 93 HE1 PHE 93 -8.127 -6.271 1.063 803 HE2 PHE 93 HE2 PHE 93 -5.460 -3.467 -0.719 804 HZ PHE 93 HZ PHE 93 -5.963 -5.101 1.051 805 H SER 94 H SER 94 -11.291 -1.339 -2.908 806 HA SER 94 HA SER 94 -10.404 0.032 -0.609 807 HB2 SER 94 2HB SER 94 -10.663 1.170 -2.769 808 HB3 SER 94 3HB SER 94 -12.408 0.944 -2.698 809 HG SER 94 HG SER 94 -11.254 3.026 -1.896 810 H ARG 95 H ARG 95 -13.588 -1.202 -1.516 811 HA ARG 95 HA ARG 95 -15.031 -0.128 0.681 812 HB2 ARG 95 2HB ARG 95 -15.631 -2.701 -0.806 813 HB3 ARG 95 3HB ARG 95 -16.767 -1.730 0.120 814 HG2 ARG 95 2HG ARG 95 -15.438 -0.963 -2.475 815 HG3 ARG 95 3HG ARG 95 -17.130 -1.393 -2.237 816 HD2 ARG 95 2HD ARG 95 -15.771 0.984 -0.958 817 HD3 ARG 95 3HD ARG 95 -16.725 1.057 -2.440 818 HE ARG 95 HE ARG 95 -18.660 0.422 -1.141 819 HH11 ARG 95 1HH1 ARG 95 -15.901 1.367 0.695 820 HH12 ARG 95 2HH1 ARG 95 -16.837 1.796 2.083 821 HH21 ARG 95 1HH2 ARG 95 -19.845 0.996 0.628 822 HH22 ARG 95 2HH2 ARG 95 -19.049 1.586 2.041 823 H GLU 96 H GLU 96 -13.389 -3.222 0.141 824 HA GLU 96 HA GLU 96 -13.927 -4.533 2.524 825 HB2 GLU 96 2HB GLU 96 -11.318 -4.554 0.978 826 HB3 GLU 96 3HB GLU 96 -11.829 -5.770 2.140 827 HG2 GLU 96 2HG GLU 96 -13.405 -5.158 -0.347 828 HG3 GLU 96 3HG GLU 96 -12.087 -6.325 -0.324 829 H VAL 97 H VAL 97 -11.215 -2.319 1.834 830 HA VAL 97 HA VAL 97 -10.097 -2.421 4.442 831 HB VAL 97 HB VAL 97 -9.769 -0.245 2.363 832 HG11 VAL 97 1HG1 VAL 97 -8.040 -0.995 4.726 833 HG12 VAL 97 2HG1 VAL 97 -9.006 0.472 4.558 834 HG13 VAL 97 3HG1 VAL 97 -7.627 0.197 3.493 835 HG21 VAL 97 3HG2 VAL 97 -9.204 -2.436 1.445 836 HG22 VAL 97 1HG2 VAL 97 -8.133 -2.751 2.810 837 HG23 VAL 97 2HG2 VAL 97 -7.753 -1.461 1.668 838 H ARG 98 H ARG 98 -12.079 0.128 2.862 839 HA ARG 98 HA ARG 98 -12.158 1.861 5.078 840 HB2 ARG 98 2HB ARG 98 -14.078 1.574 2.762 841 HB3 ARG 98 3HB ARG 98 -14.180 2.862 3.955 842 HG2 ARG 98 2HG ARG 98 -11.831 3.500 3.323 843 HG3 ARG 98 3HG ARG 98 -11.955 2.349 1.991 844 HD2 ARG 98 2HD ARG 98 -12.452 4.636 1.257 845 HD3 ARG 98 3HD ARG 98 -13.857 3.581 1.085 846 HE ARG 98 HE ARG 98 -14.959 4.833 2.655 847 HH11 ARG 98 1HH1 ARG 98 -11.631 5.695 2.705 848 HH12 ARG 98 2HH1 ARG 98 -11.872 7.014 3.792 849 HH21 ARG 98 1HH2 ARG 98 -15.265 6.523 4.044 850 HH22 ARG 98 2HH2 ARG 98 -13.915 7.482 4.540 851 H ARG 99 H ARG 99 -14.244 -0.846 4.216 852 HA ARG 99 HA ARG 99 -16.343 -0.328 6.015 853 HB2 ARG 99 2HB ARG 99 -16.361 -2.003 4.128 854 HB3 ARG 99 3HB ARG 99 -15.392 -3.066 5.137 855 HG2 ARG 99 2HG ARG 99 -17.736 -3.698 5.212 856 HG3 ARG 99 3HG ARG 99 -17.197 -3.138 6.797 857 HD2 ARG 99 2HD ARG 99 -18.228 -0.975 6.419 858 HD3 ARG 99 3HD ARG 99 -18.684 -1.448 4.782 859 HE ARG 99 HE ARG 99 -19.905 -3.320 6.256 860 HH11 ARG 99 1HH1 ARG 99 -19.784 0.103 6.613 861 HH12 ARG 99 2HH1 ARG 99 -21.388 0.200 7.253 862 HH21 ARG 99 1HH2 ARG 99 -21.953 -3.187 7.086 863 HH22 ARG 99 2HH2 ARG 99 -22.610 -1.643 7.510 864 H ARG 100 H ARG 100 -13.166 -1.679 6.520 865 HA ARG 100 HA ARG 100 -13.821 -2.662 9.184 866 HB2 ARG 100 2HB ARG 100 -11.130 -2.550 7.803 867 HB3 ARG 100 3HB ARG 100 -11.511 -3.431 9.278 868 HG2 ARG 100 2HG ARG 100 -13.254 -4.667 7.815 869 HG3 ARG 100 3HG ARG 100 -12.328 -4.023 6.457 870 HD2 ARG 100 2HD ARG 100 -11.563 -6.264 7.016 871 HD3 ARG 100 3HD ARG 100 -10.295 -5.080 7.353 872 HE ARG 100 HE ARG 100 -11.413 -5.258 9.741 873 HH11 ARG 100 1HH1 ARG 100 -10.611 -7.797 7.551 874 HH12 ARG 100 2HH1 ARG 100 -10.391 -8.950 8.823 875 HH21 ARG 100 1HH2 ARG 100 -11.149 -6.744 11.338 876 HH22 ARG 100 2HH2 ARG 100 -10.674 -8.361 10.940 877 H GLY 101 H GLY 101 -13.103 0.326 7.918 878 HA2 GLY 101 2HA GLY 101 -13.044 2.289 9.210 879 HA3 GLY 101 3HA GLY 101 -12.534 1.345 10.596 880 H PHE 102 H PHE 102 -10.847 1.039 7.535 881 HA PHE 102 HA PHE 102 -8.597 2.579 8.671 882 HB2 PHE 102 2HB PHE 102 -8.683 0.278 6.735 883 HB3 PHE 102 3HB PHE 102 -7.285 1.345 6.795 884 HD1 PHE 102 HD1 PHE 102 -6.208 1.705 9.123 885 HD2 PHE 102 HD2 PHE 102 -8.785 -1.558 8.174 886 HE1 PHE 102 HE1 PHE 102 -5.272 0.416 11.001 887 HE2 PHE 102 HE2 PHE 102 -7.851 -2.845 10.053 888 HZ PHE 102 HZ PHE 102 -6.092 -1.858 11.469 889 H GLU 103 H GLU 103 -7.467 4.069 7.438 890 HA GLU 103 HA GLU 103 -8.978 5.441 5.390 891 HB2 GLU 103 2HB GLU 103 -6.382 5.995 6.826 892 HB3 GLU 103 3HB GLU 103 -6.867 6.954 5.436 893 HG2 GLU 103 2HG GLU 103 -7.429 7.999 7.594 894 HG3 GLU 103 3HG GLU 103 -8.832 7.723 6.568 895 H VAL 104 H VAL 104 -8.857 4.904 3.298 896 HA VAL 104 HA VAL 104 -6.265 4.043 2.209 897 HB VAL 104 HB VAL 104 -7.634 2.031 2.599 898 HG11 VAL 104 1HG1 VAL 104 -9.564 3.258 0.623 899 HG12 VAL 104 2HG1 VAL 104 -9.856 3.003 2.344 900 HG13 VAL 104 3HG1 VAL 104 -9.649 1.619 1.272 901 HG21 VAL 104 3HG2 VAL 104 -6.000 2.071 0.787 902 HG22 VAL 104 1HG2 VAL 104 -7.224 2.691 -0.320 903 HG23 VAL 104 2HG2 VAL 104 -7.390 1.073 0.363 904 H ARG 105 H ARG 105 -5.804 4.662 0.136 905 HA ARG 105 HA ARG 105 -7.748 6.413 -1.237 906 HB2 ARG 105 2HB ARG 105 -4.753 6.857 -1.071 907 HB3 ARG 105 3HB ARG 105 -5.933 7.936 -1.799 908 HG2 ARG 105 2HG ARG 105 -5.690 7.261 1.134 909 HG3 ARG 105 3HG ARG 105 -5.216 8.775 0.366 910 HD2 ARG 105 2HD ARG 105 -7.447 9.403 -0.030 911 HD3 ARG 105 3HD ARG 105 -8.046 7.761 0.220 912 HE ARG 105 HE ARG 105 -6.809 8.893 2.556 913 HH11 ARG 105 1HH1 ARG 105 -9.742 8.803 0.750 914 HH12 ARG 105 2HH1 ARG 105 -10.735 9.024 2.150 915 HH21 ARG 105 1HH2 ARG 105 -8.100 9.182 4.339 916 HH22 ARG 105 2HH2 ARG 105 -9.820 9.228 4.153 917 H THR 106 H THR 106 -8.075 5.909 -3.353 918 HA THR 106 HA THR 106 -6.396 3.775 -4.510 919 HB THR 106 HB THR 106 -8.346 3.299 -5.990 920 HG1 THR 106 HG1 THR 106 -9.845 4.785 -6.071 921 HG21 THR 106 3HG2 THR 106 -8.941 3.241 -3.025 922 HG22 THR 106 1HG2 THR 106 -8.044 2.018 -3.928 923 HG23 THR 106 2HG2 THR 106 -9.759 2.276 -4.253 924 H VAL 107 H VAL 107 -5.542 3.918 -6.552 925 HA VAL 107 HA VAL 107 -6.053 6.347 -8.142 926 HB VAL 107 HB VAL 107 -3.623 6.527 -8.664 927 HG11 VAL 107 1HG1 VAL 107 -4.309 6.805 -5.733 928 HG12 VAL 107 2HG1 VAL 107 -4.604 8.004 -6.991 929 HG13 VAL 107 3HG1 VAL 107 -2.951 7.580 -6.547 930 HG21 VAL 107 3HG2 VAL 107 -3.290 4.527 -6.419 931 HG22 VAL 107 1HG2 VAL 107 -1.985 5.402 -7.223 932 HG23 VAL 107 2HG2 VAL 107 -2.953 4.237 -8.126 933 H THR 108 H THR 108 -5.874 6.099 -10.388 934 HA THR 108 HA THR 108 -5.695 3.301 -11.334 935 HB THR 108 HB THR 108 -6.978 3.981 -13.285 936 HG1 THR 108 HG1 THR 108 -6.658 6.017 -13.832 937 HG21 THR 108 3HG2 THR 108 -9.092 4.627 -12.214 938 HG22 THR 108 1HG2 THR 108 -8.216 5.064 -10.745 939 HG23 THR 108 2HG2 THR 108 -8.258 3.385 -11.282 940 H SER 109 H SER 109 -3.587 5.705 -11.054 941 HA SER 109 HA SER 109 -2.051 4.945 -13.394 942 HB2 SER 109 2HB SER 109 -3.453 6.721 -14.331 943 HB3 SER 109 3HB SER 109 -2.976 7.812 -13.033 944 HG SER 109 HG SER 109 -1.780 8.188 -14.937 945 HA PRO 110 HA PRO 110 1.359 5.505 -10.558 946 HB2 PRO 110 2HB PRO 110 2.811 6.376 -13.027 947 HB3 PRO 110 3HB PRO 110 3.275 5.176 -11.813 948 HG2 PRO 110 2HG PRO 110 2.351 4.381 -14.165 949 HG3 PRO 110 3HG PRO 110 1.836 3.552 -12.683 950 HD2 PRO 110 2HD PRO 110 0.354 5.554 -14.352 951 HD3 PRO 110 3HD PRO 110 -0.252 4.093 -13.542 952 H ASP 111 H ASP 111 0.740 8.056 -12.974 953 HA ASP 111 HA ASP 111 2.185 10.092 -11.612 954 HB2 ASP 111 2HB ASP 111 1.587 10.192 -14.019 955 HB3 ASP 111 3HB ASP 111 -0.105 10.392 -13.576 956 H ASP 112 H ASP 112 -1.303 9.302 -11.708 957 HA ASP 112 HA ASP 112 -2.213 11.116 -9.790 958 HB2 ASP 112 2HB ASP 112 -3.152 8.305 -10.423 959 HB3 ASP 112 3HB ASP 112 -4.037 9.426 -9.392 960 H PHE 113 H PHE 113 -0.837 7.872 -9.376 961 HA PHE 113 HA PHE 113 -0.992 7.639 -6.602 962 HB2 PHE 113 2HB PHE 113 -0.314 5.736 -7.870 963 HB3 PHE 113 3HB PHE 113 1.029 6.607 -8.599 964 HD1 PHE 113 HD1 PHE 113 -0.196 5.085 -5.451 965 HD2 PHE 113 HD2 PHE 113 3.144 6.710 -7.543 966 HE1 PHE 113 HE1 PHE 113 1.314 4.248 -3.697 967 HE2 PHE 113 HE2 PHE 113 4.652 5.876 -5.792 968 HZ PHE 113 HZ PHE 113 3.740 4.645 -3.867 969 H LYS 114 H LYS 114 1.572 9.085 -8.589 970 HA LYS 114 HA LYS 114 3.372 9.838 -6.623 971 HB2 LYS 114 2HB LYS 114 3.931 10.027 -8.953 972 HB3 LYS 114 3HB LYS 114 2.629 11.174 -9.230 973 HG2 LYS 114 2HG LYS 114 3.800 12.810 -7.796 974 HG3 LYS 114 3HG LYS 114 5.128 11.660 -7.608 975 HD2 LYS 114 2HD LYS 114 5.568 11.721 -9.989 976 HD3 LYS 114 3HD LYS 114 4.165 12.759 -10.255 977 HE2 LYS 114 2HE LYS 114 5.223 14.512 -8.889 978 HE3 LYS 114 3HE LYS 114 6.634 13.477 -8.668 979 HZ1 LYS 114 3HZ LYS 114 6.917 15.127 -10.443 980 HZ2 LYS 114 1HZ LYS 114 5.638 14.432 -11.298 981 HZ3 LYS 114 2HZ LYS 114 7.048 13.547 -11.020 982 H LYS 115 H LYS 115 0.798 11.895 -8.020 983 HA LYS 115 HA LYS 115 1.179 14.091 -6.320 984 HB2 LYS 115 2HB LYS 115 -1.346 13.204 -7.737 985 HB3 LYS 115 3HB LYS 115 -1.092 14.794 -7.029 986 HG2 LYS 115 2HG LYS 115 0.516 13.600 -9.286 987 HG3 LYS 115 3HG LYS 115 -0.758 14.811 -9.453 988 HD2 LYS 115 2HD LYS 115 0.548 16.392 -8.125 989 HD3 LYS 115 3HD LYS 115 1.807 15.177 -7.892 990 HE2 LYS 115 2HE LYS 115 2.260 15.153 -10.283 991 HE3 LYS 115 3HE LYS 115 0.949 16.299 -10.563 992 HZ1 LYS 115 3HZ LYS 115 2.142 17.948 -9.285 993 HZ2 LYS 115 1HZ LYS 115 3.122 17.376 -10.539 994 HZ3 LYS 115 2HZ LYS 115 3.385 16.850 -8.955 995 H SER 116 H SER 116 -0.914 11.257 -5.935 996 HA SER 116 HA SER 116 -2.224 12.096 -3.568 997 HB2 SER 116 2HB SER 116 -1.614 9.283 -4.532 998 HB3 SER 116 3HB SER 116 -2.740 9.686 -3.237 999 HG SER 116 HG SER 116 -2.979 10.043 -5.999 1000 H LEU 117 H LEU 117 0.621 10.003 -4.025 1001 HA LEU 117 HA LEU 117 1.152 9.445 -1.339 1002 HB2 LEU 117 2HB LEU 117 2.161 8.212 -3.182 1003 HB3 LEU 117 3HB LEU 117 3.045 9.641 -3.684 1004 HG LEU 117 HG LEU 117 4.267 9.569 -1.486 1005 HD11 LEU 117 1HD1 LEU 117 2.987 6.848 -1.238 1006 HD12 LEU 117 2HD1 LEU 117 2.616 8.252 -0.237 1007 HD13 LEU 117 3HD1 LEU 117 4.223 7.529 -0.178 1008 HD21 LEU 117 3HD2 LEU 117 5.770 7.770 -2.149 1009 HD22 LEU 117 1HD2 LEU 117 5.262 8.712 -3.550 1010 HD23 LEU 117 2HD2 LEU 117 4.544 7.130 -3.246 1011 H GLU 118 H GLU 118 2.746 11.883 -3.416 1012 HA GLU 118 HA GLU 118 4.419 12.956 -1.451 1013 HB2 GLU 118 2HB GLU 118 3.290 14.331 -3.903 1014 HB3 GLU 118 3HB GLU 118 4.687 14.872 -2.978 1015 HG2 GLU 118 2HG GLU 118 5.856 12.779 -3.541 1016 HG3 GLU 118 3HG GLU 118 4.466 12.271 -4.496 1017 H ARG 119 H ARG 119 1.072 13.801 -2.269 1018 HA ARG 119 HA ARG 119 0.947 16.016 -0.469 1019 HB2 ARG 119 2HB ARG 119 -1.125 14.387 -1.894 1020 HB3 ARG 119 3HB ARG 119 -1.619 15.444 -0.578 1021 HG2 ARG 119 2HG ARG 119 -0.268 17.253 -1.905 1022 HG3 ARG 119 3HG ARG 119 -0.509 16.148 -3.262 1023 HD2 ARG 119 2HD ARG 119 -2.283 17.856 -3.140 1024 HD3 ARG 119 3HD ARG 119 -2.925 16.227 -2.924 1025 HE ARG 119 HE ARG 119 -2.344 17.332 -0.402 1026 HH11 ARG 119 1HH1 ARG 119 -4.592 17.776 -2.990 1027 HH12 ARG 119 2HH1 ARG 119 -5.839 18.340 -1.934 1028 HH21 ARG 119 1HH2 ARG 119 -3.960 18.048 0.920 1029 HH22 ARG 119 2HH2 ARG 119 -5.490 18.490 0.242 1030 H LEU 120 H LEU 120 -0.292 12.669 -0.175 1031 HA LEU 120 HA LEU 120 -1.513 12.891 2.286 1032 HB2 LEU 120 2HB LEU 120 -0.132 10.519 1.038 1033 HB3 LEU 120 3HB LEU 120 -1.093 10.406 2.502 1034 HG LEU 120 HG LEU 120 -2.127 11.314 -0.193 1035 HD11 LEU 120 1HD1 LEU 120 -1.571 8.933 -0.170 1036 HD12 LEU 120 2HD1 LEU 120 -3.312 9.192 -0.260 1037 HD13 LEU 120 3HD1 LEU 120 -2.571 8.710 1.267 1038 HD21 LEU 120 3HD2 LEU 120 -4.344 11.162 0.842 1039 HD22 LEU 120 1HD2 LEU 120 -3.334 12.363 1.650 1040 HD23 LEU 120 2HD2 LEU 120 -3.596 10.786 2.395 1041 H ILE 121 H ILE 121 1.905 12.092 1.687 1042 HA ILE 121 HA ILE 121 2.692 11.553 4.310 1043 HB ILE 121 HB ILE 121 4.297 12.920 2.134 1044 HG12 ILE 121 2HG1 ILE 121 4.109 10.001 2.937 1045 HG13 ILE 121 3HG1 ILE 121 3.404 10.711 1.489 1046 HG21 ILE 121 1HG2 ILE 121 5.235 11.555 4.663 1047 HG22 ILE 121 2HG2 ILE 121 5.346 13.275 4.297 1048 HG23 ILE 121 3HG2 ILE 121 6.283 12.114 3.359 1049 HD11 ILE 121 3HD1 ILE 121 5.440 9.526 0.962 1050 HD12 ILE 121 1HD1 ILE 121 6.340 10.505 2.119 1051 HD13 ILE 121 2HD1 ILE 121 5.653 11.254 0.678 1052 H ARG 122 H ARG 122 2.311 14.675 2.684 1053 HA ARG 122 HA ARG 122 3.159 16.167 5.026 1054 HB2 ARG 122 2HB ARG 122 2.037 17.023 2.355 1055 HB3 ARG 122 3HB ARG 122 2.439 18.159 3.637 1056 HG2 ARG 122 2HG ARG 122 4.775 17.413 3.562 1057 HG3 ARG 122 3HG ARG 122 4.366 16.281 2.270 1058 HD2 ARG 122 2HD ARG 122 5.394 18.410 1.463 1059 HD3 ARG 122 3HD ARG 122 3.800 18.081 0.782 1060 HE ARG 122 HE ARG 122 2.970 19.674 2.571 1061 HH11 ARG 122 1HH1 ARG 122 6.155 19.935 1.277 1062 HH12 ARG 122 2HH1 ARG 122 6.219 21.649 1.513 1063 HH21 ARG 122 1HH2 ARG 122 3.073 21.846 2.881 1064 HH22 ARG 122 2HH2 ARG 122 4.493 22.719 2.413 1065 H GLU 123 H GLU 123 0.143 15.081 3.622 1066 HA GLU 123 HA GLU 123 -1.627 16.817 4.985 1067 HB2 GLU 123 2HB GLU 123 -2.121 13.954 4.120 1068 HB3 GLU 123 3HB GLU 123 -3.359 15.124 4.548 1069 HG2 GLU 123 2HG GLU 123 -1.483 15.327 2.198 1070 HG3 GLU 123 3HG GLU 123 -3.164 14.810 2.131 1071 H VAL 124 H VAL 124 -0.233 13.671 5.875 1072 HA VAL 124 HA VAL 124 -1.429 13.833 8.539 1073 HB VAL 124 HB VAL 124 -1.400 11.650 7.416 1074 HG11 VAL 124 1HG1 VAL 124 0.631 11.850 6.116 1075 HG12 VAL 124 2HG1 VAL 124 0.716 10.414 7.137 1076 HG13 VAL 124 3HG1 VAL 124 1.607 11.869 7.584 1077 HG21 VAL 124 3HG2 VAL 124 -1.414 11.713 9.854 1078 HG22 VAL 124 1HG2 VAL 124 0.350 11.739 9.883 1079 HG23 VAL 124 2HG2 VAL 124 -0.502 10.317 9.277 1080 H GLY 125 H GLY 125 1.776 14.052 7.020 1081 HA2 GLY 125 2HA GLY 125 3.533 15.403 7.838 1082 HA3 GLY 125 3HA GLY 125 2.767 15.419 9.418 1083 H SER 126 H SER 126 3.947 12.844 7.235 1084 HA SER 126 HA SER 126 4.814 11.234 9.460 1085 HB2 SER 126 2HB SER 126 5.200 10.831 6.482 1086 HB3 SER 126 3HB SER 126 5.517 9.619 7.722 1087 HG SER 126 HG SER 126 3.496 9.116 7.511 1088 H LEU 127 H LEU 127 6.276 13.878 8.811 1089 HA LEU 127 HA LEU 127 8.957 12.789 9.128 1090 HB2 LEU 127 2HB LEU 127 9.949 14.102 7.344 1091 HB3 LEU 127 3HB LEU 127 8.747 13.000 6.708 1092 HG LEU 127 HG LEU 127 8.259 15.954 7.158 1093 HD11 LEU 127 1HD1 LEU 127 8.909 14.519 4.581 1094 HD12 LEU 127 2HD1 LEU 127 9.994 15.594 5.462 1095 HD13 LEU 127 3HD1 LEU 127 8.509 16.229 4.757 1096 HD21 LEU 127 3HD2 LEU 127 6.205 14.654 7.175 1097 HD22 LEU 127 1HD2 LEU 127 6.658 13.874 5.659 1098 HD23 LEU 127 2HD2 LEU 127 6.311 15.603 5.694 1099 H GLU 128 H GLU 128 6.991 15.746 8.947 1100 HA GLU 128 HA GLU 128 9.015 17.375 10.177 1101 HB2 GLU 128 2HB GLU 128 6.120 17.965 9.523 1102 HB3 GLU 128 3HB GLU 128 7.310 19.162 10.024 1103 HG2 GLU 128 2HG GLU 128 8.610 18.780 8.033 1104 HG3 GLU 128 3HG GLU 128 7.551 17.456 7.551 1105 H HIS 129 H HIS 129 8.493 15.311 11.961 1106 HA HIS 129 HA HIS 129 6.602 16.119 13.968 1107 HB2 HIS 129 2HB HIS 129 7.765 14.294 15.343 1108 HB3 HIS 129 3HB HIS 129 6.946 13.794 13.870 1109 HD1 HIS 129 HD1 HIS 129 8.354 12.781 12.017 1110 HD2 HIS 129 HD2 HIS 129 10.617 14.153 15.222 1111 HE1 HIS 129 HE1 HIS 129 10.671 11.892 11.635 1112 HE2 HIS 129 HE2 HIS 129 12.053 12.871 13.493 1113 H HIS 130 H HIS 130 7.378 18.310 14.194 1114 HA HIS 130 HA HIS 130 9.877 18.989 15.314 1115 HB2 HIS 130 2HB HIS 130 8.616 21.128 16.000 1116 HB3 HIS 130 3HB HIS 130 8.706 20.750 14.283 1117 HD1 HIS 130 HD1 HIS 130 6.510 20.101 13.086 1118 HD2 HIS 130 HD2 HIS 130 6.032 20.994 17.123 1119 HE1 HIS 130 HE1 HIS 130 4.042 20.318 13.440 1120 HE2 HIS 130 HE2 HIS 130 3.791 21.060 15.825 1121 H HIS 131 H HIS 131 10.668 18.722 17.308 1122 HA HIS 131 HA HIS 131 9.008 17.464 19.326 1123 HB2 HIS 131 2HB HIS 131 11.947 18.191 19.405 1124 HB3 HIS 131 3HB HIS 131 11.107 17.168 20.565 1125 HD1 HIS 131 HD1 HIS 131 10.865 14.727 19.991 1126 HD2 HIS 131 HD2 HIS 131 12.279 16.988 16.804 1127 HE1 HIS 131 HE1 HIS 131 11.570 13.070 18.252 1128 HE2 HIS 131 HE2 HIS 131 12.649 14.454 16.454 1129 H HIS 132 H HIS 132 7.676 18.871 20.382 1130 HA HIS 132 HA HIS 132 8.945 20.810 22.145 1131 HB2 HIS 132 2HB HIS 132 8.384 22.056 20.034 1132 HB3 HIS 132 3HB HIS 132 6.689 21.683 20.318 1133 HD1 HIS 132 HD1 HIS 132 9.546 23.649 21.817 1134 HD2 HIS 132 HD2 HIS 132 5.407 23.372 22.092 1135 HE1 HIS 132 HE1 HIS 132 8.835 25.596 23.223 1136 HE2 HIS 132 HE2 HIS 132 6.327 25.514 23.216 1137 H HIS 133 H HIS 133 8.008 20.779 24.110 1138 HA HIS 133 HA HIS 133 5.336 19.534 24.382 1139 HB2 HIS 133 2HB HIS 133 7.661 19.205 26.293 1140 HB3 HIS 133 3HB HIS 133 6.094 18.410 26.395 1141 HD1 HIS 133 HD1 HIS 133 9.447 17.923 25.158 1142 HD2 HIS 133 HD2 HIS 133 5.663 16.582 24.090 1143 HE1 HIS 133 HE1 HIS 133 9.832 15.900 23.726 1144 HE2 HIS 133 HE2 HIS 133 7.531 15.004 23.252 1145 H HIS 134 H HIS 134 4.429 19.939 26.679 1146 HA HIS 134 HA HIS 134 5.237 22.490 27.854 1147 HB2 HIS 134 2HB HIS 134 2.856 23.302 27.910 1148 HB3 HIS 134 3HB HIS 134 3.587 23.276 26.312 1149 HD1 HIS 134 HD1 HIS 134 2.695 21.485 24.637 1150 HD2 HIS 134 HD2 HIS 134 0.618 21.695 28.225 1151 HE1 HIS 134 HE1 HIS 134 0.561 20.220 24.251 1152 HE2 HIS 134 HE2 HIS 134 -0.768 20.570 26.356 Start of MODEL 12 1 H1 MET 1 1H MET 1 1.869 7.057 11.203 2 H2 MET 1 2H MET 1 2.320 7.443 12.786 3 H3 MET 1 3H MET 1 2.198 5.827 12.314 4 HA MET 1 HA MET 1 4.152 7.795 11.267 5 HB2 MET 1 2HB MET 1 5.838 6.517 12.510 6 HB3 MET 1 3HB MET 1 4.617 7.180 13.588 7 HG2 MET 1 2HG MET 1 4.863 4.324 12.658 8 HG3 MET 1 3HG MET 1 5.138 4.948 14.284 9 HE1 MET 1 3HE MET 1 3.302 2.450 13.870 10 HE2 MET 1 1HE MET 1 1.901 2.861 14.862 11 HE3 MET 1 2HE MET 1 3.527 3.226 15.438 12 H ASN 2 H ASN 2 2.264 5.560 10.011 13 HA ASN 2 HA ASN 2 4.344 4.572 8.224 14 HB2 ASN 2 2HB ASN 2 4.174 2.863 10.024 15 HB3 ASN 2 3HB ASN 2 2.471 2.646 9.631 16 HD21 ASN 2 1HD2 ASN 2 2.805 0.470 9.101 17 HD22 ASN 2 2HD2 ASN 2 3.609 -0.003 7.650 18 H ILE 3 H ILE 3 3.532 3.633 6.258 19 HA ILE 3 HA ILE 3 0.699 4.076 5.637 20 HB ILE 3 HB ILE 3 1.660 6.161 4.960 21 HG12 ILE 3 2HG1 ILE 3 1.388 4.400 2.500 22 HG13 ILE 3 3HG1 ILE 3 0.059 5.171 3.360 23 HG21 ILE 3 1HG2 ILE 3 3.767 4.596 3.468 24 HG22 ILE 3 2HG2 ILE 3 4.009 5.516 4.954 25 HG23 ILE 3 3HG2 ILE 3 3.585 6.351 3.458 26 HD11 ILE 3 3HD1 ILE 3 2.285 6.603 1.922 27 HD12 ILE 3 1HD1 ILE 3 0.927 7.364 2.754 28 HD13 ILE 3 2HD1 ILE 3 0.643 6.371 1.325 29 H VAL 4 H VAL 4 -0.127 2.541 4.299 30 HA VAL 4 HA VAL 4 1.744 0.482 3.302 31 HB VAL 4 HB VAL 4 -1.167 0.169 4.085 32 HG11 VAL 4 1HG1 VAL 4 -0.764 -2.246 3.817 33 HG12 VAL 4 2HG1 VAL 4 0.858 -1.902 3.215 34 HG13 VAL 4 3HG1 VAL 4 -0.552 -1.374 2.298 35 HG21 VAL 4 3HG2 VAL 4 1.357 -0.736 5.483 36 HG22 VAL 4 1HG2 VAL 4 -0.288 -1.132 5.983 37 HG23 VAL 4 2HG2 VAL 4 0.267 0.543 6.023 38 H ILE 5 H ILE 5 1.889 0.195 1.159 39 HA ILE 5 HA ILE 5 -0.244 1.295 -0.570 40 HB ILE 5 HB ILE 5 2.648 0.743 -1.277 41 HG12 ILE 5 2HG1 ILE 5 1.267 3.405 -0.792 42 HG13 ILE 5 3HG1 ILE 5 2.329 2.604 0.362 43 HG21 ILE 5 1HG2 ILE 5 1.157 0.564 -3.206 44 HG22 ILE 5 2HG2 ILE 5 2.167 2.002 -3.331 45 HG23 ILE 5 3HG2 ILE 5 0.478 2.152 -2.846 46 HD11 ILE 5 3HD1 ILE 5 3.135 3.566 -2.374 47 HD12 ILE 5 1HD1 ILE 5 4.190 2.815 -1.177 48 HD13 ILE 5 2HD1 ILE 5 3.461 4.386 -0.848 49 H VAL 6 H VAL 6 -1.594 -0.275 -1.240 50 HA VAL 6 HA VAL 6 -0.646 -3.010 -1.656 51 HB VAL 6 HB VAL 6 -3.455 -1.901 -1.913 52 HG11 VAL 6 1HG1 VAL 6 -4.160 -4.257 -1.749 53 HG12 VAL 6 2HG1 VAL 6 -2.468 -4.756 -1.754 54 HG13 VAL 6 3HG1 VAL 6 -3.158 -3.966 -3.171 55 HG21 VAL 6 3HG2 VAL 6 -2.667 -1.626 0.359 56 HG22 VAL 6 1HG2 VAL 6 -2.108 -3.296 0.407 57 HG23 VAL 6 2HG2 VAL 6 -3.835 -2.946 0.305 58 H VAL 7 H VAL 7 0.054 -3.662 -3.594 59 HA VAL 7 HA VAL 7 -0.819 -2.189 -6.011 60 HB VAL 7 HB VAL 7 1.792 -3.651 -5.531 61 HG11 VAL 7 1HG1 VAL 7 1.132 -3.758 -7.878 62 HG12 VAL 7 2HG1 VAL 7 2.514 -2.681 -7.668 63 HG13 VAL 7 3HG1 VAL 7 0.900 -2.010 -7.905 64 HG21 VAL 7 3HG2 VAL 7 1.223 -0.690 -5.714 65 HG22 VAL 7 1HG2 VAL 7 2.820 -1.427 -5.556 66 HG23 VAL 7 2HG2 VAL 7 1.644 -1.576 -4.249 67 H PHE 8 H PHE 8 -2.275 -3.370 -7.150 68 HA PHE 8 HA PHE 8 -2.269 -6.269 -7.077 69 HB2 PHE 8 2HB PHE 8 -4.057 -4.216 -8.366 70 HB3 PHE 8 3HB PHE 8 -4.218 -5.925 -8.749 71 HD1 PHE 8 HD2 PHE 8 -4.433 -3.436 -6.016 72 HD2 PHE 8 HD1 PHE 8 -5.292 -7.420 -7.262 73 HE1 PHE 8 HE2 PHE 8 -5.849 -3.752 -4.030 74 HE2 PHE 8 HE1 PHE 8 -6.710 -7.739 -5.275 75 HZ PHE 8 HZ PHE 8 -6.988 -5.905 -3.657 76 H SER 9 H SER 9 -0.380 -4.221 -8.763 77 HA SER 9 HA SER 9 -0.375 -5.840 -11.223 78 HB2 SER 9 2HB SER 9 1.070 -4.093 -12.177 79 HB3 SER 9 3HB SER 9 -0.420 -3.397 -11.539 80 HG SER 9 HG SER 9 2.024 -3.494 -10.095 81 H THR 10 H THR 10 0.946 -7.530 -11.246 82 HA THR 10 HA THR 10 3.096 -7.827 -9.338 83 HB THR 10 HB THR 10 3.428 -10.039 -10.276 84 HG1 THR 10 HG1 THR 10 3.172 -10.026 -12.406 85 HG21 THR 10 3HG2 THR 10 1.191 -11.002 -9.971 86 HG22 THR 10 1HG2 THR 10 0.475 -9.395 -10.115 87 HG23 THR 10 2HG2 THR 10 1.525 -9.775 -8.750 88 H ASP 11 H ASP 11 2.811 -6.889 -12.675 89 HA ASP 11 HA ASP 11 5.413 -7.597 -13.534 90 HB2 ASP 11 2HB ASP 11 3.459 -5.570 -14.642 91 HB3 ASP 11 3HB ASP 11 4.929 -6.095 -15.465 92 H GLU 12 H GLU 12 7.309 -6.553 -13.555 93 HA GLU 12 HA GLU 12 7.962 -4.775 -11.532 94 HB2 GLU 12 2HB GLU 12 9.473 -5.166 -14.125 95 HB3 GLU 12 3HB GLU 12 10.131 -4.511 -12.633 96 HG2 GLU 12 2HG GLU 12 9.759 -6.675 -11.531 97 HG3 GLU 12 3HG GLU 12 9.131 -7.324 -13.047 98 H GLU 13 H GLU 13 7.193 -4.054 -14.915 99 HA GLU 13 HA GLU 13 8.262 -1.515 -15.120 100 HB2 GLU 13 2HB GLU 13 6.721 -1.139 -16.978 101 HB3 GLU 13 3HB GLU 13 7.421 -2.748 -17.037 102 HG2 GLU 13 2HG GLU 13 5.343 -3.676 -16.101 103 HG3 GLU 13 3HG GLU 13 4.646 -2.054 -16.084 104 H THR 14 H THR 14 5.143 -2.405 -13.700 105 HA THR 14 HA THR 14 4.352 0.370 -13.358 106 HB THR 14 HB THR 14 3.083 -2.153 -12.252 107 HG1 THR 14 HG1 THR 14 2.096 -2.251 -14.129 108 HG21 THR 14 3HG2 THR 14 1.121 -0.728 -11.824 109 HG22 THR 14 1HG2 THR 14 2.044 0.689 -12.330 110 HG23 THR 14 2HG2 THR 14 2.518 -0.205 -10.885 111 H LEU 15 H LEU 15 5.399 -2.282 -11.202 112 HA LEU 15 HA LEU 15 5.279 -0.835 -8.793 113 HB2 LEU 15 2HB LEU 15 5.502 -3.293 -8.946 114 HB3 LEU 15 3HB LEU 15 7.147 -3.099 -9.522 115 HG LEU 15 HG LEU 15 7.805 -2.115 -7.371 116 HD11 LEU 15 1HD1 LEU 15 5.684 -1.064 -6.762 117 HD12 LEU 15 2HD1 LEU 15 6.264 -2.114 -5.469 118 HD13 LEU 15 3HD1 LEU 15 4.954 -2.652 -6.523 119 HD21 LEU 15 3HD2 LEU 15 8.010 -4.526 -7.655 120 HD22 LEU 15 1HD2 LEU 15 6.353 -4.750 -7.094 121 HD23 LEU 15 2HD2 LEU 15 7.583 -4.135 -5.990 122 H ARG 16 H ARG 16 7.668 -0.935 -11.307 123 HA ARG 16 HA ARG 16 9.889 0.267 -10.211 124 HB2 ARG 16 2HB ARG 16 9.809 -0.533 -12.508 125 HB3 ARG 16 3HB ARG 16 8.619 0.686 -12.930 126 HG2 ARG 16 2HG ARG 16 10.734 1.350 -13.809 127 HG3 ARG 16 3HG ARG 16 10.324 2.437 -12.482 128 HD2 ARG 16 2HD ARG 16 11.833 1.248 -11.000 129 HD3 ARG 16 3HD ARG 16 12.172 0.057 -12.258 130 HE ARG 16 HE ARG 16 12.783 2.609 -13.242 131 HH11 ARG 16 1HH1 ARG 16 13.948 0.324 -10.936 132 HH12 ARG 16 2HH1 ARG 16 15.582 0.870 -11.077 133 HH21 ARG 16 1HH2 ARG 16 14.869 3.314 -13.384 134 HH22 ARG 16 2HH2 ARG 16 16.094 2.579 -12.411 135 H LYS 17 H LYS 17 6.915 1.837 -11.374 136 HA LYS 17 HA LYS 17 7.711 4.510 -11.009 137 HB2 LYS 17 2HB LYS 17 5.014 3.169 -11.065 138 HB3 LYS 17 3HB LYS 17 5.151 4.884 -10.723 139 HG2 LYS 17 2HG LYS 17 4.682 4.713 -13.022 140 HG3 LYS 17 3HG LYS 17 6.395 5.114 -12.906 141 HD2 LYS 17 2HD LYS 17 6.962 2.742 -13.253 142 HD3 LYS 17 3HD LYS 17 5.245 2.356 -13.382 143 HE2 LYS 17 2HE LYS 17 5.103 3.913 -15.323 144 HE3 LYS 17 3HE LYS 17 6.848 4.131 -15.229 145 HZ1 LYS 17 3HZ LYS 17 6.400 2.504 -16.874 146 HZ2 LYS 17 1HZ LYS 17 5.383 1.628 -15.842 147 HZ3 LYS 17 2HZ LYS 17 7.043 1.685 -15.541 148 H PHE 18 H PHE 18 5.930 2.346 -8.798 149 HA PHE 18 HA PHE 18 5.557 4.203 -6.732 150 HB2 PHE 18 2HB PHE 18 5.825 1.196 -6.468 151 HB3 PHE 18 3HB PHE 18 5.077 2.280 -5.296 152 HD1 PHE 18 HD2 PHE 18 3.310 3.958 -6.667 153 HD2 PHE 18 HD1 PHE 18 4.266 -0.089 -7.574 154 HE1 PHE 18 HE2 PHE 18 1.151 3.710 -7.816 155 HE2 PHE 18 HE1 PHE 18 2.112 -0.341 -8.736 156 HZ PHE 18 HZ PHE 18 0.551 1.558 -8.854 157 H LYS 19 H LYS 19 8.176 1.824 -7.200 158 HA LYS 19 HA LYS 19 9.606 2.370 -4.844 159 HB2 LYS 19 2HB LYS 19 10.518 1.359 -7.541 160 HB3 LYS 19 3HB LYS 19 11.605 1.497 -6.166 161 HG2 LYS 19 2HG LYS 19 10.269 -0.085 -4.903 162 HG3 LYS 19 3HG LYS 19 9.094 -0.178 -6.219 163 HD2 LYS 19 2HD LYS 19 10.766 -1.147 -7.692 164 HD3 LYS 19 3HD LYS 19 12.010 -0.955 -6.457 165 HE2 LYS 19 2HE LYS 19 9.541 -2.659 -6.109 166 HE3 LYS 19 3HE LYS 19 11.087 -3.280 -6.685 167 HZ1 LYS 19 3HZ LYS 19 10.768 -1.891 -4.085 168 HZ2 LYS 19 1HZ LYS 19 12.106 -2.767 -4.626 169 HZ3 LYS 19 2HZ LYS 19 10.663 -3.570 -4.255 170 H ASP 20 H ASP 20 10.034 3.765 -8.110 171 HA ASP 20 HA ASP 20 12.200 5.437 -7.446 172 HB2 ASP 20 2HB ASP 20 11.703 4.901 -9.761 173 HB3 ASP 20 3HB ASP 20 10.143 5.713 -9.649 174 H ILE 21 H ILE 21 8.696 6.109 -7.481 175 HA ILE 21 HA ILE 21 8.876 8.860 -6.925 176 HB ILE 21 HB ILE 21 6.649 6.915 -6.292 177 HG12 ILE 21 2HG1 ILE 21 6.966 8.950 -8.523 178 HG13 ILE 21 3HG1 ILE 21 7.218 7.217 -8.697 179 HG21 ILE 21 1HG2 ILE 21 6.472 8.857 -4.814 180 HG22 ILE 21 2HG2 ILE 21 5.200 8.892 -6.034 181 HG23 ILE 21 3HG2 ILE 21 6.606 9.942 -6.200 182 HD11 ILE 21 3HD1 ILE 21 4.860 6.835 -8.144 183 HD12 ILE 21 1HD1 ILE 21 5.059 7.860 -9.565 184 HD13 ILE 21 2HD1 ILE 21 4.622 8.579 -8.015 185 H ILE 22 H ILE 22 8.415 6.123 -4.639 186 HA ILE 22 HA ILE 22 8.363 7.591 -2.274 187 HB ILE 22 HB ILE 22 9.552 4.843 -2.732 188 HG12 ILE 22 2HG1 ILE 22 6.820 5.697 -1.722 189 HG13 ILE 22 3HG1 ILE 22 7.158 5.059 -3.327 190 HG21 ILE 22 1HG2 ILE 22 10.419 5.759 -0.664 191 HG22 ILE 22 2HG2 ILE 22 9.234 4.503 -0.305 192 HG23 ILE 22 3HG2 ILE 22 8.793 6.205 -0.146 193 HD11 ILE 22 3HD1 ILE 22 7.449 3.580 -0.718 194 HD12 ILE 22 1HD1 ILE 22 7.866 2.936 -2.307 195 HD13 ILE 22 2HD1 ILE 22 6.194 3.350 -1.935 196 H LYS 23 H LYS 23 11.205 6.338 -4.030 197 HA LYS 23 HA LYS 23 13.158 7.455 -2.287 198 HB2 LYS 23 2HB LYS 23 13.320 6.711 -5.218 199 HB3 LYS 23 3HB LYS 23 14.703 7.196 -4.247 200 HG2 LYS 23 2HG LYS 23 14.277 5.259 -2.751 201 HG3 LYS 23 3HG LYS 23 12.984 4.750 -3.842 202 HD2 LYS 23 2HD LYS 23 15.094 3.548 -4.282 203 HD3 LYS 23 3HD LYS 23 14.583 4.514 -5.669 204 HE2 LYS 23 2HE LYS 23 16.147 6.300 -4.951 205 HE3 LYS 23 3HE LYS 23 16.696 5.260 -3.639 206 HZ1 LYS 23 3HZ LYS 23 16.881 4.561 -6.511 207 HZ2 LYS 23 1HZ LYS 23 17.539 3.702 -5.213 208 HZ3 LYS 23 2HZ LYS 23 18.141 5.230 -5.607 209 H LYS 24 H LYS 24 11.275 8.760 -4.904 210 HA LYS 24 HA LYS 24 12.847 11.087 -5.411 211 HB2 LYS 24 2HB LYS 24 11.100 10.024 -6.937 212 HB3 LYS 24 3HB LYS 24 9.882 10.778 -5.919 213 HG2 LYS 24 2HG LYS 24 10.857 12.992 -6.458 214 HG3 LYS 24 3HG LYS 24 11.992 12.192 -7.547 215 HD2 LYS 24 2HD LYS 24 8.981 12.318 -7.788 216 HD3 LYS 24 3HD LYS 24 10.176 13.035 -8.869 217 HE2 LYS 24 2HE LYS 24 9.657 10.086 -8.450 218 HE3 LYS 24 3HE LYS 24 9.249 11.034 -9.878 219 HZ1 LYS 24 3HZ LYS 24 11.624 11.414 -10.232 220 HZ2 LYS 24 1HZ LYS 24 11.245 9.766 -10.249 221 HZ3 LYS 24 2HZ LYS 24 11.990 10.447 -8.896 222 H ASN 25 H ASN 25 10.172 10.345 -3.216 223 HA ASN 25 HA ASN 25 9.945 13.023 -2.196 224 HB2 ASN 25 2HB ASN 25 9.123 10.478 -0.773 225 HB3 ASN 25 3HB ASN 25 8.503 12.103 -0.503 226 HD21 ASN 25 1HD2 ASN 25 7.227 13.060 -2.227 227 HD22 ASN 25 2HD2 ASN 25 6.322 12.035 -3.275 228 H GLY 26 H GLY 26 11.637 10.077 -1.182 229 HA2 GLY 26 2HA GLY 26 13.939 10.503 -0.307 230 HA3 GLY 26 3HA GLY 26 13.210 11.711 0.738 231 H PHE 27 H PHE 27 11.733 8.578 0.106 232 HA PHE 27 HA PHE 27 12.232 7.845 2.925 233 HB2 PHE 27 2HB PHE 27 9.820 7.273 1.182 234 HB3 PHE 27 3HB PHE 27 10.074 6.558 2.771 235 HD1 PHE 27 HD2 PHE 27 9.758 9.850 1.050 236 HD2 PHE 27 HD1 PHE 27 9.328 7.663 4.681 237 HE1 PHE 27 HE2 PHE 27 8.692 11.801 2.101 238 HE2 PHE 27 HE1 PHE 27 8.260 9.612 5.734 239 HZ PHE 27 HZ PHE 27 7.942 11.686 4.443 240 H LYS 28 H LYS 28 11.886 5.383 3.270 241 HA LYS 28 HA LYS 28 13.511 3.949 1.274 242 HB2 LYS 28 2HB LYS 28 12.922 3.284 4.172 243 HB3 LYS 28 3HB LYS 28 13.927 2.317 3.105 244 HG2 LYS 28 2HG LYS 28 14.580 5.197 3.666 245 HG3 LYS 28 3HG LYS 28 15.069 3.914 4.768 246 HD2 LYS 28 2HD LYS 28 16.928 4.299 3.355 247 HD3 LYS 28 3HD LYS 28 16.194 2.805 2.783 248 HE2 LYS 28 2HE LYS 28 16.845 4.207 0.911 249 HE3 LYS 28 3HE LYS 28 15.091 4.056 0.976 250 HZ1 LYS 28 3HZ LYS 28 15.701 6.318 0.529 251 HZ2 LYS 28 1HZ LYS 28 16.695 6.377 1.894 252 HZ3 LYS 28 2HZ LYS 28 15.025 6.242 2.078 253 H VAL 29 H VAL 29 12.845 1.983 0.388 254 HA VAL 29 HA VAL 29 9.926 1.558 0.498 255 HB VAL 29 HB VAL 29 11.864 0.622 -1.631 256 HG11 VAL 29 1HG1 VAL 29 9.813 -0.694 -1.534 257 HG12 VAL 29 2HG1 VAL 29 9.846 0.295 -2.993 258 HG13 VAL 29 3HG1 VAL 29 8.844 0.778 -1.623 259 HG21 VAL 29 3HG2 VAL 29 10.078 3.059 -1.633 260 HG22 VAL 29 1HG2 VAL 29 11.023 2.477 -3.002 261 HG23 VAL 29 2HG2 VAL 29 11.840 3.058 -1.552 262 H ARG 30 H ARG 30 9.091 -0.286 1.330 263 HA ARG 30 HA ARG 30 10.730 -2.754 1.196 264 HB2 ARG 30 2HB ARG 30 8.807 -1.858 3.348 265 HB3 ARG 30 3HB ARG 30 9.309 -3.535 3.178 266 HG2 ARG 30 2HG ARG 30 11.247 -1.258 3.544 267 HG3 ARG 30 3HG ARG 30 10.571 -2.182 4.885 268 HD2 ARG 30 2HD ARG 30 12.021 -3.499 2.594 269 HD3 ARG 30 3HD ARG 30 12.867 -2.899 4.018 270 HE ARG 30 HE ARG 30 11.384 -4.447 5.316 271 HH11 ARG 30 1HH1 ARG 30 12.120 -5.109 2.000 272 HH12 ARG 30 2HH1 ARG 30 11.928 -6.816 2.206 273 HH21 ARG 30 1HH2 ARG 30 11.151 -6.628 5.534 274 HH22 ARG 30 2HH2 ARG 30 11.392 -7.664 4.166 275 H THR 31 H THR 31 9.905 -3.559 -0.724 276 HA THR 31 HA THR 31 7.020 -3.675 -1.133 277 HB THR 31 HB THR 31 7.643 -4.788 -3.329 278 HG1 THR 31 HG1 THR 31 9.765 -5.480 -2.660 279 HG21 THR 31 3HG2 THR 31 7.117 -2.406 -3.201 280 HG22 THR 31 1HG2 THR 31 8.417 -2.687 -4.361 281 HG23 THR 31 2HG2 THR 31 8.787 -2.046 -2.760 282 H VAL 32 H VAL 32 6.034 -5.184 0.056 283 HA VAL 32 HA VAL 32 7.293 -7.806 0.453 284 HB VAL 32 HB VAL 32 4.951 -6.483 1.847 285 HG11 VAL 32 1HG1 VAL 32 4.615 -8.901 1.792 286 HG12 VAL 32 2HG1 VAL 32 5.014 -8.364 3.424 287 HG13 VAL 32 3HG1 VAL 32 6.239 -9.155 2.432 288 HG21 VAL 32 3HG2 VAL 32 7.123 -5.495 2.394 289 HG22 VAL 32 1HG2 VAL 32 7.752 -7.088 2.819 290 HG23 VAL 32 2HG2 VAL 32 6.458 -6.365 3.776 291 H ARG 33 H ARG 33 6.533 -9.628 -0.459 292 HA ARG 33 HA ARG 33 3.705 -9.794 -1.253 293 HB2 ARG 33 2HB ARG 33 5.085 -9.294 -3.287 294 HB3 ARG 33 3HB ARG 33 5.985 -10.778 -3.001 295 HG2 ARG 33 2HG ARG 33 3.913 -12.077 -3.287 296 HG3 ARG 33 3HG ARG 33 3.031 -10.583 -3.596 297 HD2 ARG 33 2HD ARG 33 4.314 -10.182 -5.601 298 HD3 ARG 33 3HD ARG 33 5.355 -11.567 -5.258 299 HE ARG 33 HE ARG 33 2.614 -12.324 -5.424 300 HH11 ARG 33 1HH1 ARG 33 5.321 -11.486 -7.406 301 HH12 ARG 33 2HH1 ARG 33 4.788 -12.467 -8.723 302 HH21 ARG 33 1HH2 ARG 33 1.960 -13.570 -7.096 303 HH22 ARG 33 2HH2 ARG 33 2.899 -13.644 -8.546 304 H SER 34 H SER 34 5.413 -10.795 0.991 305 HA SER 34 HA SER 34 4.623 -13.612 0.832 306 HB2 SER 34 2HB SER 34 6.911 -13.798 0.194 307 HB3 SER 34 3HB SER 34 7.432 -12.670 1.445 308 HG SER 34 HG SER 34 7.320 -15.279 1.612 309 HA PRO 35 HA PRO 35 3.023 -12.967 4.882 310 HB2 PRO 35 2HB PRO 35 3.457 -15.509 5.919 311 HB3 PRO 35 3HB PRO 35 2.087 -15.047 4.906 312 HG2 PRO 35 2HG PRO 35 4.647 -16.394 4.131 313 HG3 PRO 35 3HG PRO 35 2.994 -16.731 3.584 314 HD2 PRO 35 2HD PRO 35 4.703 -15.358 2.040 315 HD3 PRO 35 3HD PRO 35 2.979 -14.919 2.114 316 H GLN 36 H GLN 36 6.119 -14.781 4.810 317 HA GLN 36 HA GLN 36 6.890 -14.173 7.451 318 HB2 GLN 36 2HB GLN 36 9.165 -14.815 6.767 319 HB3 GLN 36 3HB GLN 36 7.962 -15.972 6.218 320 HG2 GLN 36 2HG GLN 36 8.091 -15.137 3.970 321 HG3 GLN 36 3HG GLN 36 9.139 -13.812 4.475 322 HE21 GLN 36 1HE2 GLN 36 9.594 -15.952 2.510 323 HE22 GLN 36 2HE2 GLN 36 11.036 -16.753 3.020 324 H GLU 37 H GLU 37 7.384 -12.426 4.424 325 HA GLU 37 HA GLU 37 9.122 -10.441 5.504 326 HB2 GLU 37 2HB GLU 37 7.452 -10.578 2.998 327 HB3 GLU 37 3HB GLU 37 8.374 -9.140 3.412 328 HG2 GLU 37 2HG GLU 37 9.526 -11.899 3.030 329 HG3 GLU 37 3HG GLU 37 9.570 -10.592 1.845 330 H LEU 38 H LEU 38 5.609 -10.638 5.113 331 HA LEU 38 HA LEU 38 4.994 -8.015 5.953 332 HB2 LEU 38 2HB LEU 38 3.381 -9.562 4.878 333 HB3 LEU 38 3HB LEU 38 3.373 -10.544 6.331 334 HG LEU 38 HG LEU 38 2.406 -8.648 7.596 335 HD11 LEU 38 1HD1 LEU 38 3.311 -6.814 6.257 336 HD12 LEU 38 2HD1 LEU 38 1.560 -6.691 6.409 337 HD13 LEU 38 3HD1 LEU 38 2.274 -7.277 4.906 338 HD21 LEU 38 3HD2 LEU 38 0.863 -9.433 5.117 339 HD22 LEU 38 1HD2 LEU 38 0.169 -8.732 6.579 340 HD23 LEU 38 2HD2 LEU 38 0.923 -10.325 6.638 341 H LYS 39 H LYS 39 5.262 -11.050 7.786 342 HA LYS 39 HA LYS 39 4.906 -9.944 10.364 343 HB2 LYS 39 2HB LYS 39 4.689 -12.333 9.928 344 HB3 LYS 39 3HB LYS 39 6.384 -12.433 9.473 345 HG2 LYS 39 2HG LYS 39 7.043 -11.888 11.761 346 HG3 LYS 39 3HG LYS 39 5.346 -11.742 12.222 347 HD2 LYS 39 2HD LYS 39 6.280 -13.919 12.879 348 HD3 LYS 39 3HD LYS 39 4.981 -14.100 11.699 349 HE2 LYS 39 2HE LYS 39 6.633 -14.390 9.915 350 HE3 LYS 39 3HE LYS 39 7.940 -14.170 11.077 351 HZ1 LYS 39 3HZ LYS 39 7.505 -16.513 10.568 352 HZ2 LYS 39 1HZ LYS 39 5.933 -16.360 11.167 353 HZ3 LYS 39 2HZ LYS 39 7.256 -16.172 12.205 354 H ASP 40 H ASP 40 7.787 -10.410 8.362 355 HA ASP 40 HA ASP 40 9.761 -9.734 10.239 356 HB2 ASP 40 2HB ASP 40 10.150 -10.738 7.968 357 HB3 ASP 40 3HB ASP 40 9.815 -9.162 7.260 358 H SER 41 H SER 41 7.884 -7.709 8.018 359 HA SER 41 HA SER 41 9.066 -5.232 8.587 360 HB2 SER 41 2HB SER 41 7.510 -5.589 6.702 361 HB3 SER 41 3HB SER 41 6.178 -5.787 7.839 362 HG SER 41 HG SER 41 7.146 -3.531 8.539 363 H ILE 42 H ILE 42 6.690 -7.086 10.383 364 HA ILE 42 HA ILE 42 5.890 -5.030 12.176 365 HB ILE 42 HB ILE 42 5.903 -8.029 12.606 366 HG12 ILE 42 2HG1 ILE 42 3.704 -6.154 11.681 367 HG13 ILE 42 3HG1 ILE 42 4.545 -7.330 10.677 368 HG21 ILE 42 1HG2 ILE 42 4.427 -5.864 14.122 369 HG22 ILE 42 2HG2 ILE 42 5.792 -6.802 14.727 370 HG23 ILE 42 3HG2 ILE 42 4.261 -7.603 14.376 371 HD11 ILE 42 3HD1 ILE 42 2.344 -8.110 11.341 372 HD12 ILE 42 1HD1 ILE 42 2.794 -7.967 13.039 373 HD13 ILE 42 2HD1 ILE 42 3.611 -9.140 12.005 374 H GLU 43 H GLU 43 8.409 -7.564 12.401 375 HA GLU 43 HA GLU 43 9.429 -6.816 14.919 376 HB2 GLU 43 2HB GLU 43 10.820 -8.085 12.551 377 HB3 GLU 43 3HB GLU 43 11.583 -7.868 14.119 378 HG2 GLU 43 2HG GLU 43 9.749 -9.248 15.113 379 HG3 GLU 43 3HG GLU 43 9.195 -9.583 13.471 380 H GLU 44 H GLU 44 9.994 -5.538 11.695 381 HA GLU 44 HA GLU 44 12.214 -3.923 12.301 382 HB2 GLU 44 2HB GLU 44 11.002 -4.532 10.008 383 HB3 GLU 44 3HB GLU 44 10.209 -2.987 10.286 384 HG2 GLU 44 2HG GLU 44 12.113 -2.636 8.880 385 HG3 GLU 44 3HG GLU 44 12.442 -1.922 10.458 386 H LEU 45 H LEU 45 8.774 -3.422 12.775 387 HA LEU 45 HA LEU 45 8.692 -0.691 13.335 388 HB2 LEU 45 2HB LEU 45 7.105 -2.918 14.631 389 HB3 LEU 45 3HB LEU 45 6.708 -1.213 14.738 390 HG LEU 45 HG LEU 45 6.739 -2.835 12.181 391 HD11 LEU 45 1HD1 LEU 45 4.296 -2.599 12.263 392 HD12 LEU 45 2HD1 LEU 45 4.429 -1.845 13.853 393 HD13 LEU 45 3HD1 LEU 45 4.923 -3.523 13.627 394 HD21 LEU 45 3HD2 LEU 45 5.844 0.002 12.703 395 HD22 LEU 45 1HD2 LEU 45 5.674 -0.871 11.181 396 HD23 LEU 45 2HD2 LEU 45 7.279 -0.484 11.800 397 H VAL 46 H VAL 46 9.443 -3.400 15.523 398 HA VAL 46 HA VAL 46 9.924 -1.619 17.762 399 HB VAL 46 HB VAL 46 8.958 -3.842 18.168 400 HG11 VAL 46 1HG1 VAL 46 10.293 -5.875 17.953 401 HG12 VAL 46 2HG1 VAL 46 11.624 -4.941 17.268 402 HG13 VAL 46 3HG1 VAL 46 10.103 -5.081 16.388 403 HG21 VAL 46 3HG2 VAL 46 10.400 -4.512 20.043 404 HG22 VAL 46 1HG2 VAL 46 10.207 -2.760 19.969 405 HG23 VAL 46 2HG2 VAL 46 11.699 -3.507 19.403 406 H LYS 47 H LYS 47 11.828 -3.195 15.288 407 HA LYS 47 HA LYS 47 14.356 -2.736 16.626 408 HB2 LYS 47 2HB LYS 47 13.701 -3.691 13.832 409 HB3 LYS 47 3HB LYS 47 15.339 -3.536 14.453 410 HG2 LYS 47 2HG LYS 47 13.196 -5.332 15.595 411 HG3 LYS 47 3HG LYS 47 14.523 -5.846 14.551 412 HD2 LYS 47 2HD LYS 47 16.133 -5.065 16.258 413 HD3 LYS 47 3HD LYS 47 14.784 -4.626 17.308 414 HE2 LYS 47 2HE LYS 47 14.070 -6.971 17.372 415 HE3 LYS 47 3HE LYS 47 15.398 -7.410 16.299 416 HZ1 LYS 47 3HZ LYS 47 15.972 -7.892 18.572 417 HZ2 LYS 47 1HZ LYS 47 15.663 -6.296 19.040 418 HZ3 LYS 47 2HZ LYS 47 16.954 -6.635 18.007 419 H LYS 48 H LYS 48 13.693 -1.769 13.252 420 HA LYS 48 HA LYS 48 14.319 1.028 13.931 421 HB2 LYS 48 2HB LYS 48 15.600 -0.280 11.529 422 HB3 LYS 48 3HB LYS 48 15.957 1.288 12.229 423 HG2 LYS 48 2HG LYS 48 17.781 0.083 12.919 424 HG3 LYS 48 3HG LYS 48 16.709 -0.134 14.306 425 HD2 LYS 48 2HD LYS 48 17.712 -2.262 13.685 426 HD3 LYS 48 3HD LYS 48 15.975 -2.302 13.374 427 HE2 LYS 48 2HE LYS 48 16.483 -1.724 10.981 428 HE3 LYS 48 3HE LYS 48 18.193 -1.940 11.355 429 HZ1 LYS 48 3HZ LYS 48 17.329 -3.935 10.401 430 HZ2 LYS 48 1HZ LYS 48 16.063 -3.998 11.523 431 HZ3 LYS 48 2HZ LYS 48 17.661 -4.236 12.031 432 H TYR 49 H TYR 49 12.522 2.090 13.240 433 HA TYR 49 HA TYR 49 11.685 1.637 10.472 434 HB2 TYR 49 2HB TYR 49 10.273 0.333 12.268 435 HB3 TYR 49 3HB TYR 49 9.522 1.904 12.534 436 HD1 TYR 49 HD1 TYR 49 10.258 -0.640 9.940 437 HD2 TYR 49 HD2 TYR 49 7.849 2.699 11.040 438 HE1 TYR 49 HE1 TYR 49 8.800 -1.054 8.000 439 HE2 TYR 49 HE2 TYR 49 6.389 2.291 9.102 440 HH TYR 49 HH TYR 49 6.445 1.211 6.951 441 H ASN 50 H ASN 50 12.732 3.637 10.107 442 HA ASN 50 HA ASN 50 11.054 5.958 10.825 443 HB2 ASN 50 2HB ASN 50 14.075 5.976 10.532 444 HB3 ASN 50 3HB ASN 50 13.059 7.361 10.920 445 HD21 ASN 50 1HD2 ASN 50 12.145 7.505 12.985 446 HD22 ASN 50 2HD2 ASN 50 12.735 6.563 14.305 447 H ALA 51 H ALA 51 10.186 6.882 9.067 448 HA ALA 51 HA ALA 51 9.804 7.556 6.925 449 HB1 ALA 51 3HB ALA 51 11.876 8.811 7.302 450 HB2 ALA 51 1HB ALA 51 11.716 8.318 5.616 451 HB3 ALA 51 2HB ALA 51 12.814 7.448 6.690 452 H THR 52 H THR 52 9.863 4.672 7.490 453 HA THR 52 HA THR 52 10.741 3.564 4.901 454 HB THR 52 HB THR 52 9.975 2.071 7.429 455 HG1 THR 52 HG1 THR 52 12.152 3.394 7.008 456 HG21 THR 52 3HG2 THR 52 9.578 0.725 5.439 457 HG22 THR 52 1HG2 THR 52 11.004 0.126 6.286 458 HG23 THR 52 2HG2 THR 52 11.188 1.103 4.830 459 H ILE 53 H ILE 53 9.184 3.498 3.406 460 HA ILE 53 HA ILE 53 6.382 3.153 4.181 461 HB ILE 53 HB ILE 53 7.596 3.799 1.482 462 HG12 ILE 53 2HG1 ILE 53 6.163 5.543 3.508 463 HG13 ILE 53 3HG1 ILE 53 7.866 5.634 3.072 464 HG21 ILE 53 1HG2 ILE 53 5.497 2.605 1.213 465 HG22 ILE 53 2HG2 ILE 53 5.290 4.300 0.779 466 HG23 ILE 53 3HG2 ILE 53 4.698 3.713 2.333 467 HD11 ILE 53 3HD1 ILE 53 6.600 7.418 2.042 468 HD12 ILE 53 1HD1 ILE 53 5.536 6.247 1.263 469 HD13 ILE 53 2HD1 ILE 53 7.239 6.328 0.812 470 H VAL 54 H VAL 54 5.320 1.267 3.949 471 HA VAL 54 HA VAL 54 6.757 -0.957 2.678 472 HB VAL 54 HB VAL 54 6.103 -1.272 5.018 473 HG11 VAL 54 1HG1 VAL 54 3.256 -1.079 4.033 474 HG12 VAL 54 2HG1 VAL 54 4.078 0.068 5.091 475 HG13 VAL 54 3HG1 VAL 54 3.754 -1.572 5.653 476 HG21 VAL 54 3HG2 VAL 54 6.345 -3.215 3.576 477 HG22 VAL 54 1HG2 VAL 54 4.650 -3.099 3.098 478 HG23 VAL 54 2HG2 VAL 54 5.072 -3.487 4.766 479 H VAL 55 H VAL 55 6.144 -1.751 0.803 480 HA VAL 55 HA VAL 55 3.493 -1.060 -0.294 481 HB VAL 55 HB VAL 55 6.025 -1.806 -1.781 482 HG11 VAL 55 1HG1 VAL 55 4.815 -1.081 -3.793 483 HG12 VAL 55 2HG1 VAL 55 3.362 -0.832 -2.823 484 HG13 VAL 55 3HG1 VAL 55 4.030 -2.454 -3.011 485 HG21 VAL 55 3HG2 VAL 55 4.720 0.897 -1.426 486 HG22 VAL 55 1HG2 VAL 55 6.110 0.553 -2.457 487 HG23 VAL 55 2HG2 VAL 55 6.243 0.373 -0.706 488 H VAL 56 H VAL 56 2.115 -2.740 -0.080 489 HA VAL 56 HA VAL 56 3.096 -5.483 -0.031 490 HB VAL 56 HB VAL 56 0.259 -4.465 0.290 491 HG11 VAL 56 1HG1 VAL 56 -0.181 -6.669 1.296 492 HG12 VAL 56 2HG1 VAL 56 1.472 -7.163 0.924 493 HG13 VAL 56 3HG1 VAL 56 0.342 -6.811 -0.383 494 HG21 VAL 56 3HG2 VAL 56 0.607 -4.744 2.696 495 HG22 VAL 56 1HG2 VAL 56 1.754 -3.582 2.028 496 HG23 VAL 56 2HG2 VAL 56 2.280 -5.221 2.412 497 H VAL 57 H VAL 57 3.609 -6.164 -2.042 498 HA VAL 57 HA VAL 57 1.948 -5.634 -4.346 499 HB VAL 57 HB VAL 57 4.294 -7.537 -4.085 500 HG11 VAL 57 1HG1 VAL 57 4.441 -7.341 -6.536 501 HG12 VAL 57 2HG1 VAL 57 2.977 -6.357 -6.540 502 HG13 VAL 57 3HG1 VAL 57 2.906 -8.043 -6.024 503 HG21 VAL 57 3HG2 VAL 57 5.647 -5.737 -5.056 504 HG22 VAL 57 1HG2 VAL 57 4.937 -5.242 -3.518 505 HG23 VAL 57 2HG2 VAL 57 4.247 -4.666 -5.036 506 H VAL 58 H VAL 58 0.241 -6.814 -4.969 507 HA VAL 58 HA VAL 58 -0.077 -9.535 -3.869 508 HB VAL 58 HB VAL 58 -2.454 -9.140 -3.521 509 HG11 VAL 58 1HG1 VAL 58 -2.330 -7.547 -1.660 510 HG12 VAL 58 2HG1 VAL 58 -0.765 -6.985 -2.244 511 HG13 VAL 58 3HG1 VAL 58 -0.948 -8.642 -1.670 512 HG21 VAL 58 3HG2 VAL 58 -2.887 -7.533 -5.296 513 HG22 VAL 58 1HG2 VAL 58 -1.919 -6.316 -4.461 514 HG23 VAL 58 2HG2 VAL 58 -3.428 -6.886 -3.747 515 H ASP 59 H ASP 59 -0.546 -11.076 -5.326 516 HA ASP 59 HA ASP 59 -1.371 -10.330 -8.033 517 HB2 ASP 59 2HB ASP 59 -1.057 -12.816 -8.467 518 HB3 ASP 59 3HB ASP 59 0.390 -11.928 -7.996 519 H ASP 60 H ASP 60 -2.484 -12.604 -5.498 520 HA ASP 60 HA ASP 60 -5.200 -12.508 -6.618 521 HB2 ASP 60 2HB ASP 60 -4.034 -14.711 -6.081 522 HB3 ASP 60 3HB ASP 60 -4.180 -14.280 -4.381 523 H LYS 61 H LYS 61 -6.996 -11.910 -5.303 524 HA LYS 61 HA LYS 61 -6.475 -9.739 -3.559 525 HB2 LYS 61 2HB LYS 61 -8.489 -9.831 -4.941 526 HB3 LYS 61 3HB LYS 61 -9.062 -11.233 -4.048 527 HG2 LYS 61 2HG LYS 61 -9.309 -9.912 -2.040 528 HG3 LYS 61 3HG LYS 61 -8.596 -8.509 -2.834 529 HD2 LYS 61 2HD LYS 61 -11.168 -9.850 -3.696 530 HD3 LYS 61 3HD LYS 61 -11.075 -8.411 -2.678 531 HE2 LYS 61 2HE LYS 61 -9.871 -7.245 -4.502 532 HE3 LYS 61 3HE LYS 61 -10.089 -8.666 -5.522 533 HZ1 LYS 61 3HZ LYS 61 -11.760 -6.873 -5.865 534 HZ2 LYS 61 1HZ LYS 61 -12.334 -7.159 -4.300 535 HZ3 LYS 61 2HZ LYS 61 -12.440 -8.371 -5.473 536 H GLU 62 H GLU 62 -6.898 -13.135 -2.980 537 HA GLU 62 HA GLU 62 -7.633 -13.229 -0.307 538 HB2 GLU 62 2HB GLU 62 -7.385 -15.223 -1.702 539 HB3 GLU 62 3HB GLU 62 -5.651 -14.979 -1.796 540 HG2 GLU 62 2HG GLU 62 -7.011 -15.416 0.842 541 HG3 GLU 62 3HG GLU 62 -6.582 -16.769 -0.198 542 H TRP 63 H TRP 63 -4.318 -13.018 -1.609 543 HA TRP 63 HA TRP 63 -3.012 -12.710 0.869 544 HB2 TRP 63 2HB TRP 63 -1.727 -13.368 -1.042 545 HB3 TRP 63 3HB TRP 63 -2.218 -11.946 -1.951 546 HD1 TRP 63 HD1 TRP 63 -0.162 -10.478 -2.273 547 HE1 TRP 63 HE1 TRP 63 1.780 -9.648 -0.814 548 HE3 TRP 63 HE3 TRP 63 -1.227 -13.040 2.029 549 HZ2 TRP 63 HZ2 TRP 63 2.744 -10.029 1.809 550 HZ3 TRP 63 HZ3 TRP 63 0.262 -12.753 3.968 551 HH2 TRP 63 HH2 TRP 63 2.207 -11.276 3.856 552 H ALA 64 H ALA 64 -4.387 -10.330 -1.363 553 HA ALA 64 HA ALA 64 -3.469 -7.980 -0.141 554 HB1 ALA 64 3HB ALA 64 -6.103 -8.414 -1.556 555 HB2 ALA 64 1HB ALA 64 -4.566 -8.040 -2.337 556 HB3 ALA 64 2HB ALA 64 -5.318 -6.861 -1.264 557 H GLU 65 H GLU 65 -6.642 -9.570 0.318 558 HA GLU 65 HA GLU 65 -7.465 -8.009 2.511 559 HB2 GLU 65 2HB GLU 65 -8.260 -10.767 1.568 560 HB3 GLU 65 3HB GLU 65 -9.017 -9.995 2.955 561 HG2 GLU 65 2HG GLU 65 -8.914 -8.579 0.319 562 HG3 GLU 65 3HG GLU 65 -10.121 -9.829 0.615 563 H LYS 66 H LYS 66 -5.631 -11.030 2.352 564 HA LYS 66 HA LYS 66 -5.555 -11.700 5.061 565 HB2 LYS 66 2HB LYS 66 -4.669 -13.136 3.264 566 HB3 LYS 66 3HB LYS 66 -3.370 -11.992 2.978 567 HG2 LYS 66 2HG LYS 66 -2.361 -13.693 4.201 568 HG3 LYS 66 3HG LYS 66 -2.671 -12.444 5.404 569 HD2 LYS 66 2HD LYS 66 -4.620 -14.694 4.949 570 HD3 LYS 66 3HD LYS 66 -3.217 -14.901 5.993 571 HE2 LYS 66 2HE LYS 66 -5.356 -12.797 6.336 572 HE3 LYS 66 3HE LYS 66 -5.244 -14.296 7.254 573 HZ1 LYS 66 3HZ LYS 66 -3.191 -12.146 7.233 574 HZ2 LYS 66 1HZ LYS 66 -3.136 -13.567 8.150 575 HZ3 LYS 66 2HZ LYS 66 -4.327 -12.407 8.461 576 H ALA 67 H ALA 67 -3.592 -9.390 3.243 577 HA ALA 67 HA ALA 67 -1.922 -8.642 5.439 578 HB1 ALA 67 3HB ALA 67 -2.518 -7.125 2.895 579 HB2 ALA 67 1HB ALA 67 -1.239 -8.323 3.102 580 HB3 ALA 67 2HB ALA 67 -1.188 -6.811 4.011 581 H ILE 68 H ILE 68 -4.626 -6.915 3.825 582 HA ILE 68 HA ILE 68 -4.736 -4.697 5.517 583 HB ILE 68 HB ILE 68 -7.061 -6.003 4.077 584 HG12 ILE 68 2HG1 ILE 68 -5.232 -5.471 2.538 585 HG13 ILE 68 3HG1 ILE 68 -6.580 -4.366 2.282 586 HG21 ILE 68 1HG2 ILE 68 -6.755 -3.174 5.100 587 HG22 ILE 68 2HG2 ILE 68 -7.811 -4.414 5.777 588 HG23 ILE 68 3HG2 ILE 68 -8.112 -3.789 4.156 589 HD11 ILE 68 3HD1 ILE 68 -4.444 -3.216 2.177 590 HD12 ILE 68 1HD1 ILE 68 -4.061 -3.747 3.813 591 HD13 ILE 68 2HD1 ILE 68 -5.405 -2.639 3.536 592 H ARG 69 H ARG 69 -6.634 -7.699 5.737 593 HA ARG 69 HA ARG 69 -8.064 -7.145 8.071 594 HB2 ARG 69 2HB ARG 69 -7.102 -9.730 6.844 595 HB3 ARG 69 3HB ARG 69 -8.113 -9.704 8.280 596 HG2 ARG 69 2HG ARG 69 -9.932 -8.747 7.108 597 HG3 ARG 69 3HG ARG 69 -8.918 -8.341 5.722 598 HD2 ARG 69 2HD ARG 69 -10.374 -10.301 5.308 599 HD3 ARG 69 3HD ARG 69 -8.659 -10.679 5.163 600 HE ARG 69 HE ARG 69 -10.143 -11.288 7.634 601 HH11 ARG 69 1HH1 ARG 69 -8.236 -12.318 4.951 602 HH12 ARG 69 2HH1 ARG 69 -8.018 -13.914 5.573 603 HH21 ARG 69 1HH2 ARG 69 -9.845 -13.330 8.433 604 HH22 ARG 69 2HH2 ARG 69 -8.907 -14.477 7.537 605 H PHE 70 H PHE 70 -4.827 -8.512 7.659 606 HA PHE 70 HA PHE 70 -4.370 -9.105 10.404 607 HB2 PHE 70 2HB PHE 70 -3.120 -10.135 8.516 608 HB3 PHE 70 3HB PHE 70 -2.346 -8.584 8.210 609 HD1 PHE 70 HD1 PHE 70 -3.027 -10.281 11.457 610 HD2 PHE 70 HD2 PHE 70 -0.092 -8.964 8.663 611 HE1 PHE 70 HE1 PHE 70 -1.247 -10.892 13.041 612 HE2 PHE 70 HE2 PHE 70 1.690 -9.571 10.244 613 HZ PHE 70 HZ PHE 70 1.115 -10.534 12.440 614 H VAL 71 H VAL 71 -3.617 -6.280 8.377 615 HA VAL 71 HA VAL 71 -2.171 -4.796 10.282 616 HB VAL 71 HB VAL 71 -3.945 -3.766 8.049 617 HG11 VAL 71 1HG1 VAL 71 -2.627 -1.696 8.200 618 HG12 VAL 71 2HG1 VAL 71 -1.790 -2.335 9.614 619 HG13 VAL 71 3HG1 VAL 71 -3.521 -2.010 9.688 620 HG21 VAL 71 3HG2 VAL 71 -2.185 -5.208 7.206 621 HG22 VAL 71 1HG2 VAL 71 -0.972 -4.322 8.129 622 HG23 VAL 71 2HG2 VAL 71 -1.824 -3.532 6.801 623 H LYS 72 H LYS 72 -5.674 -4.956 9.646 624 HA LYS 72 HA LYS 72 -6.462 -3.019 11.541 625 HB2 LYS 72 2HB LYS 72 -7.974 -3.876 9.798 626 HB3 LYS 72 3HB LYS 72 -7.996 -5.449 10.586 627 HG2 LYS 72 2HG LYS 72 -9.132 -4.542 12.503 628 HG3 LYS 72 3HG LYS 72 -8.969 -2.900 11.879 629 HD2 LYS 72 2HD LYS 72 -10.419 -3.462 9.993 630 HD3 LYS 72 3HD LYS 72 -10.553 -5.123 10.576 631 HE2 LYS 72 2HE LYS 72 -12.518 -3.755 11.167 632 HE3 LYS 72 3HE LYS 72 -11.674 -4.364 12.588 633 HZ1 LYS 72 3HZ LYS 72 -12.318 -2.041 12.836 634 HZ2 LYS 72 1HZ LYS 72 -11.405 -1.623 11.477 635 HZ3 LYS 72 2HZ LYS 72 -10.635 -2.206 12.863 636 H SER 73 H SER 73 -5.676 -6.434 11.889 637 HA SER 73 HA SER 73 -6.570 -6.800 14.544 638 HB2 SER 73 2HB SER 73 -5.932 -8.706 13.152 639 HB3 SER 73 3HB SER 73 -4.264 -8.140 13.095 640 HG SER 73 HG SER 73 -5.352 -8.509 15.631 641 H LEU 74 H LEU 74 -3.618 -5.403 13.238 642 HA LEU 74 HA LEU 74 -2.089 -5.299 15.610 643 HB2 LEU 74 2HB LEU 74 -2.032 -3.395 13.260 644 HB3 LEU 74 3HB LEU 74 -0.766 -3.584 14.461 645 HG LEU 74 HG LEU 74 -1.632 -5.729 12.503 646 HD11 LEU 74 1HD1 LEU 74 -0.526 -3.845 11.390 647 HD12 LEU 74 2HD1 LEU 74 0.480 -5.293 11.370 648 HD13 LEU 74 3HD1 LEU 74 0.838 -3.987 12.500 649 HD21 LEU 74 3HD2 LEU 74 -0.771 -6.677 14.565 650 HD22 LEU 74 1HD2 LEU 74 0.653 -5.641 14.479 651 HD23 LEU 74 2HD2 LEU 74 0.400 -6.896 13.265 652 H GLY 75 H GLY 75 -4.425 -3.018 14.215 653 HA2 GLY 75 2HA GLY 75 -5.799 -1.549 15.420 654 HA3 GLY 75 3HA GLY 75 -4.811 -1.815 16.845 655 H ALA 76 H ALA 76 -2.948 -1.077 14.099 656 HA ALA 76 HA ALA 76 -2.500 1.653 15.090 657 HB1 ALA 76 3HB ALA 76 -0.416 1.583 13.814 658 HB2 ALA 76 1HB ALA 76 -0.852 -0.002 13.173 659 HB3 ALA 76 2HB ALA 76 -0.540 0.196 14.897 660 H GLN 77 H GLN 77 -3.442 3.316 14.056 661 HA GLN 77 HA GLN 77 -4.807 3.013 11.584 662 HB2 GLN 77 2HB GLN 77 -5.165 5.473 11.709 663 HB3 GLN 77 3HB GLN 77 -5.632 4.622 13.173 664 HG2 GLN 77 2HG GLN 77 -3.591 5.353 14.279 665 HG3 GLN 77 3HG GLN 77 -3.053 6.146 12.800 666 HE21 GLN 77 1HE2 GLN 77 -3.565 7.266 15.455 667 HE22 GLN 77 2HE2 GLN 77 -4.734 8.514 15.219 668 H VAL 78 H VAL 78 -3.674 2.574 9.802 669 HA VAL 78 HA VAL 78 -1.460 4.391 9.070 670 HB VAL 78 HB VAL 78 -0.580 2.613 7.613 671 HG11 VAL 78 1HG1 VAL 78 -0.982 1.729 10.476 672 HG12 VAL 78 2HG1 VAL 78 0.290 2.795 9.878 673 HG13 VAL 78 3HG1 VAL 78 0.247 1.106 9.374 674 HG21 VAL 78 3HG2 VAL 78 -2.792 0.912 8.779 675 HG22 VAL 78 1HG2 VAL 78 -1.465 0.314 7.781 676 HG23 VAL 78 2HG2 VAL 78 -2.646 1.434 7.101 677 H LEU 79 H LEU 79 -1.344 5.109 6.910 678 HA LEU 79 HA LEU 79 -3.924 5.331 5.587 679 HB2 LEU 79 2HB LEU 79 -2.600 7.335 5.895 680 HB3 LEU 79 3HB LEU 79 -1.241 6.614 5.059 681 HG LEU 79 HG LEU 79 -2.302 6.805 2.941 682 HD11 LEU 79 1HD1 LEU 79 -4.532 6.033 3.527 683 HD12 LEU 79 2HD1 LEU 79 -4.628 7.571 2.669 684 HD13 LEU 79 3HD1 LEU 79 -4.837 7.522 4.420 685 HD21 LEU 79 3HD2 LEU 79 -2.784 9.186 2.784 686 HD22 LEU 79 1HD2 LEU 79 -1.407 8.906 3.851 687 HD23 LEU 79 2HD2 LEU 79 -2.994 9.275 4.532 688 H ILE 80 H ILE 80 -4.508 4.239 3.790 689 HA ILE 80 HA ILE 80 -2.498 2.418 2.622 690 HB ILE 80 HB ILE 80 -5.500 2.056 2.762 691 HG12 ILE 80 2HG1 ILE 80 -3.283 0.652 4.289 692 HG13 ILE 80 3HG1 ILE 80 -4.377 1.854 4.962 693 HG21 ILE 80 1HG2 ILE 80 -5.041 -0.234 1.958 694 HG22 ILE 80 2HG2 ILE 80 -3.340 0.192 1.760 695 HG23 ILE 80 3HG2 ILE 80 -4.570 0.993 0.782 696 HD11 ILE 80 3HD1 ILE 80 -5.029 -0.403 5.583 697 HD12 ILE 80 1HD1 ILE 80 -5.179 -0.838 3.881 698 HD13 ILE 80 2HD1 ILE 80 -6.263 0.362 4.584 699 H ILE 81 H ILE 81 -2.007 2.590 0.533 700 HA ILE 81 HA ILE 81 -3.854 4.041 -1.274 701 HB ILE 81 HB ILE 81 -0.870 3.636 -1.630 702 HG12 ILE 81 2HG1 ILE 81 -2.411 6.121 -0.819 703 HG13 ILE 81 3HG1 ILE 81 -1.353 5.181 0.230 704 HG21 ILE 81 1HG2 ILE 81 -2.044 3.798 -3.753 705 HG22 ILE 81 2HG2 ILE 81 -1.119 5.271 -3.468 706 HG23 ILE 81 3HG2 ILE 81 -2.863 5.265 -3.215 707 HD11 ILE 81 3HD1 ILE 81 -0.520 6.733 -2.215 708 HD12 ILE 81 1HD1 ILE 81 0.554 5.763 -1.204 709 HD13 ILE 81 2HD1 ILE 81 -0.242 7.186 -0.535 710 H ILE 82 H ILE 82 -4.831 2.810 -2.798 711 HA ILE 82 HA ILE 82 -3.712 0.121 -3.322 712 HB ILE 82 HB ILE 82 -6.613 0.983 -3.467 713 HG12 ILE 82 2HG1 ILE 82 -5.188 -0.775 -1.445 714 HG13 ILE 82 3HG1 ILE 82 -5.739 0.871 -1.152 715 HG21 ILE 82 1HG2 ILE 82 -6.082 -0.787 -5.071 716 HG22 ILE 82 2HG2 ILE 82 -7.088 -1.408 -3.763 717 HG23 ILE 82 3HG2 ILE 82 -5.358 -1.752 -3.782 718 HD11 ILE 82 3HD1 ILE 82 -7.489 -1.506 -1.754 719 HD12 ILE 82 1HD1 ILE 82 -8.052 0.144 -1.483 720 HD13 ILE 82 2HD1 ILE 82 -7.257 -0.742 -0.182 721 H TYR 83 H TYR 83 -3.133 -0.380 -5.331 722 HA TYR 83 HA TYR 83 -4.147 1.262 -7.576 723 HB2 TYR 83 2HB TYR 83 -1.775 1.647 -7.307 724 HB3 TYR 83 3HB TYR 83 -1.454 -0.082 -7.227 725 HD1 TYR 83 HD2 TYR 83 -2.340 2.712 -9.469 726 HD2 TYR 83 HD1 TYR 83 -1.336 -1.423 -9.238 727 HE1 TYR 83 HE2 TYR 83 -1.994 2.662 -11.902 728 HE2 TYR 83 HE1 TYR 83 -0.988 -1.477 -11.667 729 HH TYR 83 HH TYR 83 -1.679 -0.239 -13.659 730 H ASP 84 H ASP 84 -5.441 0.198 -8.930 731 HA ASP 84 HA ASP 84 -4.770 -2.550 -9.693 732 HB2 ASP 84 2HB ASP 84 -6.565 -2.732 -7.980 733 HB3 ASP 84 3HB ASP 84 -7.598 -1.710 -8.976 734 H GLN 85 H GLN 85 -5.814 -3.207 -11.705 735 HA GLN 85 HA GLN 85 -5.598 -1.078 -13.642 736 HB2 GLN 85 2HB GLN 85 -6.148 -4.031 -13.988 737 HB3 GLN 85 3HB GLN 85 -5.746 -2.912 -15.287 738 HG2 GLN 85 2HG GLN 85 -3.553 -2.524 -14.269 739 HG3 GLN 85 3HG GLN 85 -3.962 -3.634 -12.962 740 HE21 GLN 85 1HE2 GLN 85 -3.036 -3.346 -16.285 741 HE22 GLN 85 2HE2 GLN 85 -2.716 -5.022 -16.551 742 H ASP 86 H ASP 86 -8.187 -2.665 -12.014 743 HA ASP 86 HA ASP 86 -10.138 -1.883 -14.077 744 HB2 ASP 86 2HB ASP 86 -10.254 -3.852 -11.792 745 HB3 ASP 86 3HB ASP 86 -11.701 -3.336 -12.653 746 H GLN 87 H GLN 87 -12.327 -1.215 -13.172 747 HA GLN 87 HA GLN 87 -11.975 0.770 -11.025 748 HB2 GLN 87 2HB GLN 87 -14.149 0.505 -13.116 749 HB3 GLN 87 3HB GLN 87 -14.078 1.763 -11.889 750 HG2 GLN 87 2HG GLN 87 -12.004 2.606 -12.844 751 HG3 GLN 87 3HG GLN 87 -12.025 1.319 -14.052 752 HE21 GLN 87 1HE2 GLN 87 -12.103 2.778 -15.769 753 HE22 GLN 87 2HE2 GLN 87 -13.517 3.694 -16.139 754 H ASN 88 H ASN 88 -14.496 -1.517 -12.162 755 HA ASN 88 HA ASN 88 -16.024 -1.436 -9.803 756 HB2 ASN 88 2HB ASN 88 -16.903 -2.250 -11.958 757 HB3 ASN 88 3HB ASN 88 -15.862 -3.666 -11.851 758 HD21 ASN 88 1HD2 ASN 88 -17.553 -2.265 -9.104 759 HD22 ASN 88 2HD2 ASN 88 -18.637 -3.586 -8.879 760 H ARG 89 H ARG 89 -13.642 -3.899 -10.869 761 HA ARG 89 HA ARG 89 -13.707 -5.490 -8.566 762 HB2 ARG 89 2HB ARG 89 -12.582 -6.135 -10.678 763 HB3 ARG 89 3HB ARG 89 -11.324 -4.948 -10.360 764 HG2 ARG 89 2HG ARG 89 -10.672 -6.165 -8.341 765 HG3 ARG 89 3HG ARG 89 -11.945 -7.348 -8.637 766 HD2 ARG 89 2HD ARG 89 -9.840 -8.247 -9.390 767 HD3 ARG 89 3HD ARG 89 -10.861 -7.920 -10.790 768 HE ARG 89 HE ARG 89 -9.241 -5.681 -10.342 769 HH11 ARG 89 1HH1 ARG 89 -8.909 -8.986 -11.292 770 HH12 ARG 89 2HH1 ARG 89 -7.483 -8.679 -12.217 771 HH21 ARG 89 1HH2 ARG 89 -7.434 -5.320 -11.532 772 HH22 ARG 89 2HH2 ARG 89 -6.680 -6.621 -12.383 773 H LEU 90 H LEU 90 -11.815 -2.583 -9.264 774 HA LEU 90 HA LEU 90 -10.252 -2.536 -6.918 775 HB2 LEU 90 2HB LEU 90 -9.736 -1.167 -8.869 776 HB3 LEU 90 3HB LEU 90 -11.229 -0.269 -8.665 777 HG LEU 90 HG LEU 90 -10.389 0.673 -6.554 778 HD11 LEU 90 1HD1 LEU 90 -8.028 0.352 -5.921 779 HD12 LEU 90 2HD1 LEU 90 -7.879 -0.889 -7.167 780 HD13 LEU 90 3HD1 LEU 90 -8.971 -1.133 -5.802 781 HD21 LEU 90 3HD2 LEU 90 -8.463 1.008 -8.857 782 HD22 LEU 90 1HD2 LEU 90 -8.664 2.121 -7.503 783 HD23 LEU 90 2HD2 LEU 90 -9.985 1.875 -8.645 784 H GLU 91 H GLU 91 -13.369 -0.973 -7.660 785 HA GLU 91 HA GLU 91 -13.859 0.232 -5.191 786 HB2 GLU 91 2HB GLU 91 -15.721 -0.904 -7.279 787 HB3 GLU 91 3HB GLU 91 -16.319 -0.096 -5.839 788 HG2 GLU 91 2HG GLU 91 -14.478 1.171 -7.860 789 HG3 GLU 91 3HG GLU 91 -16.233 1.347 -7.847 790 H GLU 92 H GLU 92 -14.841 -3.003 -6.315 791 HA GLU 92 HA GLU 92 -16.251 -3.851 -4.090 792 HB2 GLU 92 2HB GLU 92 -16.273 -5.055 -6.190 793 HB3 GLU 92 3HB GLU 92 -14.567 -5.439 -6.040 794 HG2 GLU 92 2HG GLU 92 -16.208 -6.393 -3.799 795 HG3 GLU 92 3HG GLU 92 -16.635 -7.092 -5.359 796 H PHE 93 H PHE 93 -12.754 -3.805 -4.578 797 HA PHE 93 HA PHE 93 -12.218 -5.205 -2.095 798 HB2 PHE 93 2HB PHE 93 -10.680 -5.489 -3.969 799 HB3 PHE 93 3HB PHE 93 -10.356 -3.759 -3.998 800 HD1 PHE 93 HD1 PHE 93 -10.158 -6.698 -1.703 801 HD2 PHE 93 HD2 PHE 93 -8.493 -2.953 -2.864 802 HE1 PHE 93 HE1 PHE 93 -8.299 -7.036 -0.130 803 HE2 PHE 93 HE2 PHE 93 -6.631 -3.292 -1.292 804 HZ PHE 93 HZ PHE 93 -6.534 -5.337 0.078 805 H SER 94 H SER 94 -11.627 -1.895 -3.298 806 HA SER 94 HA SER 94 -10.550 -0.811 -0.960 807 HB2 SER 94 2HB SER 94 -12.138 0.608 -3.119 808 HB3 SER 94 3HB SER 94 -11.101 1.399 -1.933 809 HG SER 94 HG SER 94 -10.437 -0.019 -4.214 810 H ARG 95 H ARG 95 -13.923 -1.073 -1.977 811 HA ARG 95 HA ARG 95 -15.157 0.537 -0.074 812 HB2 ARG 95 2HB ARG 95 -16.287 -0.505 -2.022 813 HB3 ARG 95 3HB ARG 95 -16.188 -2.068 -1.230 814 HG2 ARG 95 2HG ARG 95 -17.590 0.194 0.141 815 HG3 ARG 95 3HG ARG 95 -18.398 -0.678 -1.159 816 HD2 ARG 95 2HD ARG 95 -18.094 -2.782 0.058 817 HD3 ARG 95 3HD ARG 95 -17.272 -1.918 1.358 818 HE ARG 95 HE ARG 95 -19.787 -0.754 0.971 819 HH11 ARG 95 1HH1 ARG 95 -18.451 -3.749 2.043 820 HH12 ARG 95 2HH1 ARG 95 -19.750 -4.052 3.145 821 HH21 ARG 95 1HH2 ARG 95 -21.442 -1.165 2.380 822 HH22 ARG 95 2HH2 ARG 95 -21.430 -2.611 3.326 823 H GLU 96 H GLU 96 -14.368 -2.941 0.150 824 HA GLU 96 HA GLU 96 -15.268 -3.326 2.783 825 HB2 GLU 96 2HB GLU 96 -13.035 -4.735 1.303 826 HB3 GLU 96 3HB GLU 96 -13.719 -5.278 2.828 827 HG2 GLU 96 2HG GLU 96 -15.176 -5.047 0.198 828 HG3 GLU 96 3HG GLU 96 -14.641 -6.536 0.977 829 H VAL 97 H VAL 97 -11.972 -2.599 1.599 830 HA VAL 97 HA VAL 97 -10.646 -2.435 4.037 831 HB VAL 97 HB VAL 97 -10.146 -0.719 1.588 832 HG11 VAL 97 1HG1 VAL 97 -8.284 -1.440 3.865 833 HG12 VAL 97 2HG1 VAL 97 -8.990 0.148 3.566 834 HG13 VAL 97 3HG1 VAL 97 -7.845 -0.535 2.415 835 HG21 VAL 97 3HG2 VAL 97 -10.149 -3.102 1.054 836 HG22 VAL 97 1HG2 VAL 97 -8.999 -3.410 2.356 837 HG23 VAL 97 2HG2 VAL 97 -8.515 -2.444 0.961 838 H ARG 98 H ARG 98 -12.531 0.056 2.368 839 HA ARG 98 HA ARG 98 -12.047 2.168 4.195 840 HB2 ARG 98 2HB ARG 98 -13.045 2.315 1.842 841 HB3 ARG 98 3HB ARG 98 -14.567 1.805 2.557 842 HG2 ARG 98 2HG ARG 98 -14.582 4.191 2.337 843 HG3 ARG 98 3HG ARG 98 -14.466 3.796 4.055 844 HD2 ARG 98 2HD ARG 98 -12.066 4.196 4.001 845 HD3 ARG 98 3HD ARG 98 -12.141 4.519 2.271 846 HE ARG 98 HE ARG 98 -13.784 6.237 3.919 847 HH11 ARG 98 1HH1 ARG 98 -10.811 5.782 2.269 848 HH12 ARG 98 2HH1 ARG 98 -10.346 7.443 2.393 849 HH21 ARG 98 1HH2 ARG 98 -13.216 8.384 4.039 850 HH22 ARG 98 2HH2 ARG 98 -11.703 8.900 3.376 851 H ARG 99 H ARG 99 -14.663 -0.223 3.947 852 HA ARG 99 HA ARG 99 -16.198 0.653 6.141 853 HB2 ARG 99 2HB ARG 99 -16.749 -1.018 4.218 854 HB3 ARG 99 3HB ARG 99 -16.037 -2.232 5.266 855 HG2 ARG 99 2HG ARG 99 -18.320 -0.462 6.125 856 HG3 ARG 99 3HG ARG 99 -18.555 -2.010 5.318 857 HD2 ARG 99 2HD ARG 99 -17.134 -1.578 7.950 858 HD3 ARG 99 3HD ARG 99 -18.763 -2.216 7.747 859 HE ARG 99 HE ARG 99 -16.861 -3.763 6.309 860 HH11 ARG 99 1HH1 ARG 99 -18.103 -3.192 9.470 861 HH12 ARG 99 2HH1 ARG 99 -17.716 -4.782 10.029 862 HH21 ARG 99 1HH2 ARG 99 -16.334 -5.795 7.051 863 HH22 ARG 99 2HH2 ARG 99 -16.704 -6.229 8.686 864 H ARG 100 H ARG 100 -13.357 -1.413 5.940 865 HA ARG 100 HA ARG 100 -13.481 -2.496 8.560 866 HB2 ARG 100 2HB ARG 100 -11.016 -2.006 6.865 867 HB3 ARG 100 3HB ARG 100 -11.114 -3.062 8.266 868 HG2 ARG 100 2HG ARG 100 -12.831 -4.409 7.005 869 HG3 ARG 100 3HG ARG 100 -12.446 -3.432 5.590 870 HD2 ARG 100 2HD ARG 100 -10.044 -4.137 5.884 871 HD3 ARG 100 3HD ARG 100 -10.601 -5.273 7.110 872 HE ARG 100 HE ARG 100 -10.719 -5.615 4.295 873 HH11 ARG 100 1HH1 ARG 100 -12.511 -6.327 7.171 874 HH12 ARG 100 2HH1 ARG 100 -13.251 -7.726 6.474 875 HH21 ARG 100 1HH2 ARG 100 -11.668 -7.401 3.436 876 HH22 ARG 100 2HH2 ARG 100 -12.779 -8.329 4.389 877 H GLY 101 H GLY 101 -12.991 0.685 7.582 878 HA2 GLY 101 2HA GLY 101 -12.961 2.450 9.169 879 HA3 GLY 101 3HA GLY 101 -12.140 1.397 10.306 880 H PHE 102 H PHE 102 -10.919 1.493 7.054 881 HA PHE 102 HA PHE 102 -8.603 3.016 8.051 882 HB2 PHE 102 2HB PHE 102 -8.844 0.721 6.163 883 HB3 PHE 102 3HB PHE 102 -7.544 1.876 5.892 884 HD1 PHE 102 HD1 PHE 102 -6.026 2.424 7.888 885 HD2 PHE 102 HD2 PHE 102 -8.553 -1.007 7.709 886 HE1 PHE 102 HE1 PHE 102 -4.645 1.314 9.601 887 HE2 PHE 102 HE2 PHE 102 -7.175 -2.116 9.418 888 HZ PHE 102 HZ PHE 102 -5.217 -0.959 10.366 889 H GLU 103 H GLU 103 -7.863 4.785 7.080 890 HA GLU 103 HA GLU 103 -9.288 6.089 4.972 891 HB2 GLU 103 2HB GLU 103 -8.079 7.359 6.695 892 HB3 GLU 103 3HB GLU 103 -6.556 6.651 6.173 893 HG2 GLU 103 2HG GLU 103 -6.747 8.901 5.351 894 HG3 GLU 103 3HG GLU 103 -6.784 7.762 4.009 895 H VAL 104 H VAL 104 -8.990 5.876 2.789 896 HA VAL 104 HA VAL 104 -6.584 4.514 1.827 897 HB VAL 104 HB VAL 104 -8.132 2.697 2.268 898 HG11 VAL 104 1HG1 VAL 104 -10.050 4.081 0.381 899 HG12 VAL 104 2HG1 VAL 104 -10.248 3.920 2.126 900 HG13 VAL 104 3HG1 VAL 104 -10.274 2.484 1.101 901 HG21 VAL 104 3HG2 VAL 104 -7.856 3.239 -0.693 902 HG22 VAL 104 1HG2 VAL 104 -8.185 1.668 0.041 903 HG23 VAL 104 2HG2 VAL 104 -6.648 2.478 0.345 904 H ARG 105 H ARG 105 -5.886 5.133 -0.108 905 HA ARG 105 HA ARG 105 -7.622 6.836 -1.779 906 HB2 ARG 105 2HB ARG 105 -4.677 6.972 -1.178 907 HB3 ARG 105 3HB ARG 105 -5.305 7.661 -2.668 908 HG2 ARG 105 2HG ARG 105 -6.524 8.421 -0.034 909 HG3 ARG 105 3HG ARG 105 -5.022 9.176 -0.575 910 HD2 ARG 105 2HD ARG 105 -7.064 10.474 -1.176 911 HD3 ARG 105 3HD ARG 105 -6.084 10.012 -2.565 912 HE ARG 105 HE ARG 105 -8.364 8.317 -1.874 913 HH11 ARG 105 1HH1 ARG 105 -7.035 10.737 -3.946 914 HH12 ARG 105 2HH1 ARG 105 -8.185 10.444 -5.200 915 HH21 ARG 105 1HH2 ARG 105 -9.817 7.942 -3.519 916 HH22 ARG 105 2HH2 ARG 105 -9.716 8.871 -4.978 917 H THR 106 H THR 106 -8.125 6.088 -3.736 918 HA THR 106 HA THR 106 -6.745 3.713 -4.771 919 HB THR 106 HB THR 106 -8.639 3.545 -6.357 920 HG1 THR 106 HG1 THR 106 -10.408 4.999 -6.099 921 HG21 THR 106 3HG2 THR 106 -9.477 3.878 -3.466 922 HG22 THR 106 1HG2 THR 106 -8.826 2.412 -4.203 923 HG23 THR 106 2HG2 THR 106 -10.400 3.028 -4.704 924 H VAL 107 H VAL 107 -5.440 3.757 -6.527 925 HA VAL 107 HA VAL 107 -5.468 6.162 -8.242 926 HB VAL 107 HB VAL 107 -2.999 6.043 -8.423 927 HG11 VAL 107 1HG1 VAL 107 -4.022 6.405 -5.601 928 HG12 VAL 107 2HG1 VAL 107 -4.023 7.627 -6.873 929 HG13 VAL 107 3HG1 VAL 107 -2.495 7.024 -6.231 930 HG21 VAL 107 3HG2 VAL 107 -1.720 4.743 -6.761 931 HG22 VAL 107 1HG2 VAL 107 -2.651 3.703 -7.841 932 HG23 VAL 107 2HG2 VAL 107 -3.220 4.005 -6.197 933 H THR 108 H THR 108 -5.401 5.816 -10.392 934 HA THR 108 HA THR 108 -4.731 3.102 -11.375 935 HB THR 108 HB THR 108 -6.203 3.587 -13.332 936 HG1 THR 108 HG1 THR 108 -7.747 5.487 -12.330 937 HG21 THR 108 3HG2 THR 108 -7.604 3.781 -10.654 938 HG22 THR 108 1HG2 THR 108 -7.074 2.287 -11.431 939 HG23 THR 108 2HG2 THR 108 -8.338 3.269 -12.174 940 H SER 109 H SER 109 -3.430 6.040 -11.125 941 HA SER 109 HA SER 109 -1.852 5.759 -13.583 942 HB2 SER 109 2HB SER 109 -3.049 8.405 -12.694 943 HB3 SER 109 3HB SER 109 -1.983 8.159 -14.074 944 HG SER 109 HG SER 109 -4.551 8.110 -14.129 945 HA PRO 110 HA PRO 110 1.558 6.374 -10.821 946 HB2 PRO 110 2HB PRO 110 3.362 7.563 -12.539 947 HB3 PRO 110 3HB PRO 110 3.024 5.830 -12.490 948 HG2 PRO 110 2HG PRO 110 1.937 7.920 -14.345 949 HG3 PRO 110 3HG PRO 110 2.496 6.276 -14.711 950 HD2 PRO 110 2HD PRO 110 -0.121 6.860 -14.520 951 HD3 PRO 110 3HD PRO 110 0.523 5.301 -13.959 952 H ASP 111 H ASP 111 0.777 9.212 -12.866 953 HA ASP 111 HA ASP 111 2.019 11.148 -11.249 954 HB2 ASP 111 2HB ASP 111 -0.350 11.423 -13.114 955 HB3 ASP 111 3HB ASP 111 0.544 12.775 -12.419 956 H ASP 112 H ASP 112 -1.361 9.976 -11.222 957 HA ASP 112 HA ASP 112 -2.310 11.602 -9.154 958 HB2 ASP 112 2HB ASP 112 -3.077 8.804 -9.988 959 HB3 ASP 112 3HB ASP 112 -3.926 9.681 -8.716 960 H PHE 113 H PHE 113 -0.809 8.373 -8.946 961 HA PHE 113 HA PHE 113 -0.808 8.111 -6.163 962 HB2 PHE 113 2HB PHE 113 -0.226 6.226 -7.551 963 HB3 PHE 113 3HB PHE 113 1.161 7.080 -8.222 964 HD1 PHE 113 HD1 PHE 113 -0.173 5.437 -5.190 965 HD2 PHE 113 HD2 PHE 113 3.247 7.147 -7.069 966 HE1 PHE 113 HE1 PHE 113 1.265 4.505 -3.424 967 HE2 PHE 113 HE2 PHE 113 4.684 6.216 -5.306 968 HZ PHE 113 HZ PHE 113 3.695 4.900 -3.481 969 H LYS 114 H LYS 114 1.674 9.524 -8.280 970 HA LYS 114 HA LYS 114 3.562 10.171 -6.323 971 HB2 LYS 114 2HB LYS 114 4.033 10.185 -8.729 972 HB3 LYS 114 3HB LYS 114 2.984 11.579 -8.941 973 HG2 LYS 114 2HG LYS 114 4.489 12.920 -7.542 974 HG3 LYS 114 3HG LYS 114 5.541 11.517 -7.338 975 HD2 LYS 114 2HD LYS 114 6.398 13.035 -9.066 976 HD3 LYS 114 3HD LYS 114 5.966 11.467 -9.750 977 HE2 LYS 114 2HE LYS 114 3.923 12.356 -10.652 978 HE3 LYS 114 3HE LYS 114 4.157 13.885 -9.807 979 HZ1 LYS 114 3HZ LYS 114 5.926 12.832 -11.946 980 HZ2 LYS 114 1HZ LYS 114 6.087 14.320 -11.161 981 HZ3 LYS 114 2HZ LYS 114 4.750 14.030 -12.151 982 H LYS 115 H LYS 115 1.060 12.290 -7.755 983 HA LYS 115 HA LYS 115 1.760 14.525 -6.136 984 HB2 LYS 115 2HB LYS 115 -0.656 13.985 -7.867 985 HB3 LYS 115 3HB LYS 115 -0.365 15.518 -7.052 986 HG2 LYS 115 2HG LYS 115 1.375 14.235 -9.156 987 HG3 LYS 115 3HG LYS 115 0.367 15.675 -9.343 988 HD2 LYS 115 2HD LYS 115 1.723 16.885 -7.746 989 HD3 LYS 115 3HD LYS 115 2.669 15.439 -7.397 990 HE2 LYS 115 2HE LYS 115 3.426 15.434 -9.766 991 HE3 LYS 115 3HE LYS 115 2.580 16.965 -9.997 992 HZ1 LYS 115 3HZ LYS 115 4.975 17.205 -9.517 993 HZ2 LYS 115 1HZ LYS 115 4.718 16.530 -7.986 994 HZ3 LYS 115 2HZ LYS 115 3.993 18.004 -8.394 995 H SER 116 H SER 116 -0.691 11.994 -5.791 996 HA SER 116 HA SER 116 -1.995 13.163 -3.552 997 HB2 SER 116 2HB SER 116 -2.892 10.936 -3.086 998 HB3 SER 116 3HB SER 116 -2.971 11.254 -4.818 999 HG SER 116 HG SER 116 -1.326 9.870 -5.164 1000 H LEU 117 H LEU 117 0.573 10.691 -3.761 1001 HA LEU 117 HA LEU 117 1.115 10.357 -1.068 1002 HB2 LEU 117 2HB LEU 117 2.070 8.981 -2.873 1003 HB3 LEU 117 3HB LEU 117 3.087 10.322 -3.360 1004 HG LEU 117 HG LEU 117 4.264 10.210 -1.186 1005 HD11 LEU 117 1HD1 LEU 117 2.532 7.787 -0.699 1006 HD12 LEU 117 2HD1 LEU 117 2.486 9.308 0.195 1007 HD13 LEU 117 3HD1 LEU 117 3.913 8.274 0.284 1008 HD21 LEU 117 3HD2 LEU 117 5.486 8.138 -1.615 1009 HD22 LEU 117 1HD2 LEU 117 5.153 9.001 -3.117 1010 HD23 LEU 117 2HD2 LEU 117 4.192 7.585 -2.681 1011 H GLU 118 H GLU 118 2.590 12.762 -3.283 1012 HA GLU 118 HA GLU 118 4.357 14.004 -1.565 1013 HB2 GLU 118 2HB GLU 118 2.642 15.179 -3.761 1014 HB3 GLU 118 3HB GLU 118 3.829 16.139 -2.890 1015 HG2 GLU 118 2HG GLU 118 5.586 14.529 -3.629 1016 HG3 GLU 118 3HG GLU 118 4.364 13.714 -4.603 1017 H ARG 119 H ARG 119 0.848 14.444 -1.716 1018 HA ARG 119 HA ARG 119 0.889 16.525 0.309 1019 HB2 ARG 119 2HB ARG 119 -0.794 16.615 -1.462 1020 HB3 ARG 119 3HB ARG 119 -1.436 15.056 -0.958 1021 HG2 ARG 119 2HG ARG 119 -2.076 16.016 1.205 1022 HG3 ARG 119 3HG ARG 119 -1.435 17.579 0.698 1023 HD2 ARG 119 2HD ARG 119 -3.067 17.651 -1.129 1024 HD3 ARG 119 3HD ARG 119 -3.706 16.084 -0.619 1025 HE ARG 119 HE ARG 119 -3.883 17.672 1.603 1026 HH11 ARG 119 1HH1 ARG 119 -5.058 17.874 -1.636 1027 HH12 ARG 119 2HH1 ARG 119 -6.478 18.750 -1.174 1028 HH21 ARG 119 1HH2 ARG 119 -5.714 18.805 2.164 1029 HH22 ARG 119 2HH2 ARG 119 -6.838 19.272 0.935 1030 H LEU 120 H LEU 120 -0.002 13.092 0.134 1031 HA LEU 120 HA LEU 120 -1.181 12.806 2.638 1032 HB2 LEU 120 2HB LEU 120 0.509 10.787 1.151 1033 HB3 LEU 120 3HB LEU 120 -0.579 10.418 2.479 1034 HG LEU 120 HG LEU 120 -1.377 11.463 -0.246 1035 HD11 LEU 120 1HD1 LEU 120 -0.726 9.119 -0.278 1036 HD12 LEU 120 2HD1 LEU 120 -2.464 9.292 -0.515 1037 HD13 LEU 120 3HD1 LEU 120 -1.835 8.778 1.051 1038 HD21 LEU 120 3HD2 LEU 120 -3.107 10.781 2.131 1039 HD22 LEU 120 1HD2 LEU 120 -3.694 11.170 0.513 1040 HD23 LEU 120 2HD2 LEU 120 -2.841 12.390 1.458 1041 H ILE 121 H ILE 121 2.246 12.723 1.751 1042 HA ILE 121 HA ILE 121 3.355 12.118 4.257 1043 HB ILE 121 HB ILE 121 4.446 13.984 2.128 1044 HG12 ILE 121 2HG1 ILE 121 5.014 11.038 2.571 1045 HG13 ILE 121 3HG1 ILE 121 3.913 11.663 1.351 1046 HG21 ILE 121 1HG2 ILE 121 5.608 14.329 4.225 1047 HG22 ILE 121 2HG2 ILE 121 6.659 13.471 3.099 1048 HG23 ILE 121 3HG2 ILE 121 5.861 12.592 4.402 1049 HD11 ILE 121 3HD1 ILE 121 6.875 12.173 1.496 1050 HD12 ILE 121 1HD1 ILE 121 5.780 12.835 0.282 1051 HD13 ILE 121 2HD1 ILE 121 6.046 11.096 0.375 1052 H ARG 122 H ARG 122 2.293 15.214 2.895 1053 HA ARG 122 HA ARG 122 3.095 16.846 5.085 1054 HB2 ARG 122 2HB ARG 122 1.010 17.298 2.934 1055 HB3 ARG 122 3HB ARG 122 1.566 18.534 4.056 1056 HG2 ARG 122 2HG ARG 122 3.771 18.484 3.133 1057 HG3 ARG 122 3HG ARG 122 3.381 17.075 2.144 1058 HD2 ARG 122 2HD ARG 122 3.399 19.261 0.905 1059 HD3 ARG 122 3HD ARG 122 1.900 18.343 0.771 1060 HE ARG 122 HE ARG 122 0.938 19.882 2.415 1061 HH11 ARG 122 1HH1 ARG 122 3.832 20.898 0.827 1062 HH12 ARG 122 2HH1 ARG 122 3.469 22.580 1.035 1063 HH21 ARG 122 1HH2 ARG 122 0.505 22.038 2.671 1064 HH22 ARG 122 2HH2 ARG 122 1.619 23.215 2.060 1065 H GLU 123 H GLU 123 0.283 14.892 4.458 1066 HA GLU 123 HA GLU 123 -1.414 16.129 6.423 1067 HB2 GLU 123 2HB GLU 123 -1.663 13.433 5.066 1068 HB3 GLU 123 3HB GLU 123 -2.922 14.226 6.001 1069 HG2 GLU 123 2HG GLU 123 -1.737 15.245 3.422 1070 HG3 GLU 123 3HG GLU 123 -3.291 14.436 3.595 1071 H VAL 124 H VAL 124 0.333 13.007 6.300 1072 HA VAL 124 HA VAL 124 -0.357 12.471 9.088 1073 HB VAL 124 HB VAL 124 -0.574 10.670 7.411 1074 HG11 VAL 124 1HG1 VAL 124 1.426 9.580 6.493 1075 HG12 VAL 124 2HG1 VAL 124 2.439 10.825 7.228 1076 HG13 VAL 124 3HG1 VAL 124 1.295 11.257 5.956 1077 HG21 VAL 124 3HG2 VAL 124 -0.231 10.090 9.773 1078 HG22 VAL 124 1HG2 VAL 124 1.515 10.094 9.523 1079 HG23 VAL 124 2HG2 VAL 124 0.511 8.896 8.708 1080 H GLY 125 H GLY 125 2.424 13.503 7.242 1081 HA2 GLY 125 2HA GLY 125 4.331 12.714 9.305 1082 HA3 GLY 125 3HA GLY 125 4.709 13.454 7.762 1083 H SER 126 H SER 126 3.829 14.046 11.096 1084 HA SER 126 HA SER 126 3.919 16.924 10.849 1085 HB2 SER 126 2HB SER 126 3.763 16.941 13.308 1086 HB3 SER 126 3HB SER 126 2.545 15.884 12.601 1087 HG SER 126 HG SER 126 4.068 15.207 14.497 1088 H LEU 127 H LEU 127 5.616 18.303 11.334 1089 HA LEU 127 HA LEU 127 8.218 17.060 11.036 1090 HB2 LEU 127 2HB LEU 127 9.013 19.436 10.740 1091 HB3 LEU 127 3HB LEU 127 7.865 18.841 9.561 1092 HG LEU 127 HG LEU 127 6.073 20.051 10.993 1093 HD11 LEU 127 1HD1 LEU 127 6.879 22.021 12.199 1094 HD12 LEU 127 2HD1 LEU 127 8.544 21.485 11.962 1095 HD13 LEU 127 3HD1 LEU 127 7.437 20.524 12.944 1096 HD21 LEU 127 3HD2 LEU 127 6.477 22.160 9.795 1097 HD22 LEU 127 1HD2 LEU 127 6.687 20.751 8.756 1098 HD23 LEU 127 2HD2 LEU 127 8.098 21.603 9.382 1099 H GLU 128 H GLU 128 6.482 18.693 13.593 1100 HA GLU 128 HA GLU 128 8.853 18.343 15.322 1101 HB2 GLU 128 2HB GLU 128 8.539 20.738 14.865 1102 HB3 GLU 128 3HB GLU 128 6.879 20.637 15.441 1103 HG2 GLU 128 2HG GLU 128 7.792 19.915 17.667 1104 HG3 GLU 128 3HG GLU 128 9.401 20.275 17.051 1105 H HIS 129 H HIS 129 8.498 17.002 16.972 1106 HA HIS 129 HA HIS 129 5.763 16.731 18.026 1107 HB2 HIS 129 2HB HIS 129 6.694 14.761 19.293 1108 HB3 HIS 129 3HB HIS 129 6.693 14.590 17.545 1109 HD1 HIS 129 HD1 HIS 129 9.080 15.274 20.409 1110 HD2 HIS 129 HD2 HIS 129 9.144 14.046 16.436 1111 HE1 HIS 129 HE1 HIS 129 11.438 14.532 19.969 1112 HE2 HIS 129 HE2 HIS 129 11.428 13.694 17.600 1113 H HIS 130 H HIS 130 5.663 18.681 19.135 1114 HA HIS 130 HA HIS 130 6.932 18.742 21.741 1115 HB2 HIS 130 2HB HIS 130 8.687 19.738 20.407 1116 HB3 HIS 130 3HB HIS 130 7.547 20.816 19.618 1117 HD1 HIS 130 HD1 HIS 130 7.825 23.113 20.403 1118 HD2 HIS 130 HD2 HIS 130 8.583 20.385 23.445 1119 HE1 HIS 130 HE1 HIS 130 8.413 24.493 22.409 1120 HE2 HIS 130 HE2 HIS 130 9.067 22.825 24.166 1121 H HIS 131 H HIS 131 4.174 18.803 20.375 1122 HA HIS 131 HA HIS 131 3.166 21.306 21.563 1123 HB2 HIS 131 2HB HIS 131 1.170 21.037 20.133 1124 HB3 HIS 131 3HB HIS 131 2.657 21.169 19.206 1125 HD1 HIS 131 HD1 HIS 131 -0.298 19.072 19.644 1126 HD2 HIS 131 HD2 HIS 131 3.529 18.629 18.083 1127 HE1 HIS 131 HE1 HIS 131 -0.388 17.014 18.211 1128 HE2 HIS 131 HE2 HIS 131 1.870 16.906 17.111 1129 H HIS 132 H HIS 132 2.662 20.920 23.604 1130 HA HIS 132 HA HIS 132 1.090 18.535 24.301 1131 HB2 HIS 132 2HB HIS 132 1.621 19.197 26.671 1132 HB3 HIS 132 3HB HIS 132 3.020 18.777 25.691 1133 HD1 HIS 132 HD1 HIS 132 4.913 20.284 26.137 1134 HD2 HIS 132 HD2 HIS 132 1.279 22.259 26.531 1135 HE1 HIS 132 HE1 HIS 132 5.493 22.632 26.792 1136 HE2 HIS 132 HE2 HIS 132 3.280 23.768 27.159 1137 H HIS 133 H HIS 133 -0.739 18.801 25.807 1138 HA HIS 133 HA HIS 133 -2.191 21.327 25.291 1139 HB2 HIS 133 2HB HIS 133 -3.344 18.565 25.762 1140 HB3 HIS 133 3HB HIS 133 -4.261 20.024 25.405 1141 HD1 HIS 133 HD1 HIS 133 -2.170 17.384 23.804 1142 HD2 HIS 133 HD2 HIS 133 -4.200 20.845 22.706 1143 HE1 HIS 133 HE1 HIS 133 -2.270 17.340 21.298 1144 HE2 HIS 133 HE2 HIS 133 -3.617 19.364 20.665 1145 H HIS 134 H HIS 134 -4.247 21.190 27.016 1146 HA HIS 134 HA HIS 134 -3.208 20.463 29.671 1147 HB2 HIS 134 2HB HIS 134 -4.300 22.571 30.596 1148 HB3 HIS 134 3HB HIS 134 -2.822 22.801 29.673 1149 HD1 HIS 134 HD1 HIS 134 -6.554 23.298 29.407 1150 HD2 HIS 134 HD2 HIS 134 -3.066 24.415 27.451 1151 HE1 HIS 134 HE1 HIS 134 -7.240 25.076 27.773 1152 HE2 HIS 134 HE2 HIS 134 -5.131 25.679 26.542 Start of MODEL 13 1 H1 MET 1 1H MET 1 7.506 7.755 9.425 2 H2 MET 1 2H MET 1 7.381 6.116 9.046 3 H3 MET 1 3H MET 1 6.711 6.705 10.481 4 HA MET 1 HA MET 1 5.115 8.016 9.269 5 HB2 MET 1 2HB MET 1 6.503 6.838 6.854 6 HB3 MET 1 3HB MET 1 4.931 7.623 6.775 7 HG2 MET 1 2HG MET 1 6.813 9.095 6.129 8 HG3 MET 1 3HG MET 1 5.865 9.715 7.481 9 HE1 MET 1 3HE MET 1 9.549 10.911 8.245 10 HE2 MET 1 1HE MET 1 7.876 11.434 8.031 11 HE3 MET 1 2HE MET 1 8.776 10.769 6.666 12 H ASN 2 H ASN 2 5.882 4.908 7.651 13 HA ASN 2 HA ASN 2 4.815 2.910 7.585 14 HB2 ASN 2 2HB ASN 2 4.634 3.075 10.062 15 HB3 ASN 2 3HB ASN 2 3.091 3.905 9.870 16 HD21 ASN 2 1HD2 ASN 2 2.014 2.273 11.002 17 HD22 ASN 2 2HD2 ASN 2 1.700 0.732 10.296 18 H ILE 3 H ILE 3 3.878 2.945 5.641 19 HA ILE 3 HA ILE 3 1.030 3.521 5.491 20 HB ILE 3 HB ILE 3 1.913 5.655 4.825 21 HG12 ILE 3 2HG1 ILE 3 1.133 4.117 2.327 22 HG13 ILE 3 3HG1 ILE 3 0.003 4.775 3.506 23 HG21 ILE 3 1HG2 ILE 3 3.667 4.162 2.876 24 HG22 ILE 3 2HG2 ILE 3 4.191 5.042 4.311 25 HG23 ILE 3 3HG2 ILE 3 3.493 5.915 2.947 26 HD11 ILE 3 3HD1 ILE 3 0.823 7.039 2.982 27 HD12 ILE 3 1HD1 ILE 3 0.133 6.216 1.584 28 HD13 ILE 3 2HD1 ILE 3 1.884 6.345 1.753 29 H VAL 4 H VAL 4 0.012 1.998 4.308 30 HA VAL 4 HA VAL 4 1.677 -0.061 3.045 31 HB VAL 4 HB VAL 4 -1.263 -0.174 3.763 32 HG11 VAL 4 1HG1 VAL 4 -0.986 -2.610 3.543 33 HG12 VAL 4 2HG1 VAL 4 0.676 -2.364 3.001 34 HG13 VAL 4 3HG1 VAL 4 -0.667 -1.766 2.026 35 HG21 VAL 4 3HG2 VAL 4 -0.564 -1.504 5.711 36 HG22 VAL 4 1HG2 VAL 4 0.081 0.137 5.771 37 HG23 VAL 4 2HG2 VAL 4 1.126 -1.205 5.302 38 H ILE 5 H ILE 5 1.957 0.098 0.891 39 HA ILE 5 HA ILE 5 -0.237 1.143 -0.785 40 HB ILE 5 HB ILE 5 2.667 0.669 -1.525 41 HG12 ILE 5 2HG1 ILE 5 1.200 3.273 -0.968 42 HG13 ILE 5 3HG1 ILE 5 2.363 2.508 0.112 43 HG21 ILE 5 1HG2 ILE 5 1.238 0.461 -3.464 44 HG22 ILE 5 2HG2 ILE 5 2.110 1.990 -3.550 45 HG23 ILE 5 3HG2 ILE 5 0.413 1.969 -3.068 46 HD11 ILE 5 3HD1 ILE 5 3.382 4.332 -1.103 47 HD12 ILE 5 1HD1 ILE 5 2.940 3.587 -2.640 48 HD13 ILE 5 2HD1 ILE 5 4.108 2.796 -1.580 49 H VAL 6 H VAL 6 -1.577 -0.468 -1.407 50 HA VAL 6 HA VAL 6 -0.556 -3.149 -1.947 51 HB VAL 6 HB VAL 6 -3.420 -2.170 -2.086 52 HG11 VAL 6 1HG1 VAL 6 -4.000 -4.547 -1.887 53 HG12 VAL 6 2HG1 VAL 6 -2.287 -4.968 -1.903 54 HG13 VAL 6 3HG1 VAL 6 -3.030 -4.239 -3.327 55 HG21 VAL 6 3HG2 VAL 6 -1.994 -3.524 0.212 56 HG22 VAL 6 1HG2 VAL 6 -3.709 -3.119 0.151 57 HG23 VAL 6 2HG2 VAL 6 -2.499 -1.835 0.163 58 H VAL 7 H VAL 7 0.162 -3.637 -3.930 59 HA VAL 7 HA VAL 7 -0.944 -2.196 -6.260 60 HB VAL 7 HB VAL 7 1.693 -3.670 -6.029 61 HG11 VAL 7 1HG1 VAL 7 0.585 -1.952 -8.258 62 HG12 VAL 7 2HG1 VAL 7 0.882 -3.690 -8.314 63 HG13 VAL 7 3HG1 VAL 7 2.235 -2.568 -8.176 64 HG21 VAL 7 3HG2 VAL 7 1.133 -0.698 -6.027 65 HG22 VAL 7 1HG2 VAL 7 2.730 -1.446 -6.052 66 HG23 VAL 7 2HG2 VAL 7 1.680 -1.657 -4.650 67 H PHE 8 H PHE 8 -2.399 -3.334 -7.405 68 HA PHE 8 HA PHE 8 -2.374 -6.249 -7.396 69 HB2 PHE 8 2HB PHE 8 -4.264 -4.216 -8.589 70 HB3 PHE 8 3HB PHE 8 -4.449 -5.949 -8.831 71 HD1 PHE 8 HD2 PHE 8 -4.259 -3.349 -6.168 72 HD2 PHE 8 HD1 PHE 8 -5.593 -7.247 -7.263 73 HE1 PHE 8 HE2 PHE 8 -5.519 -3.511 -4.061 74 HE2 PHE 8 HE1 PHE 8 -6.851 -7.409 -5.157 75 HZ PHE 8 HZ PHE 8 -6.815 -5.541 -3.554 76 H SER 9 H SER 9 -0.712 -4.023 -9.152 77 HA SER 9 HA SER 9 -0.919 -5.371 -11.734 78 HB2 SER 9 2HB SER 9 -0.646 -2.890 -11.641 79 HB3 SER 9 3HB SER 9 0.954 -3.119 -10.934 80 HG SER 9 HG SER 9 1.243 -2.892 -13.125 81 H THR 10 H THR 10 0.081 -7.262 -11.909 82 HA THR 10 HA THR 10 2.367 -8.015 -10.338 83 HB THR 10 HB THR 10 2.310 -10.124 -11.635 84 HG1 THR 10 HG1 THR 10 0.965 -10.367 -13.352 85 HG21 THR 10 3HG2 THR 10 0.084 -10.884 -10.926 86 HG22 THR 10 1HG2 THR 10 -0.424 -9.210 -10.709 87 HG23 THR 10 2HG2 THR 10 0.841 -9.888 -9.682 88 H ASP 11 H ASP 11 2.085 -6.207 -13.152 89 HA ASP 11 HA ASP 11 4.506 -7.133 -14.432 90 HB2 ASP 11 2HB ASP 11 2.755 -4.726 -14.991 91 HB3 ASP 11 3HB ASP 11 4.109 -5.242 -15.995 92 H GLU 12 H GLU 12 6.489 -6.536 -13.927 93 HA GLU 12 HA GLU 12 7.144 -5.061 -11.683 94 HB2 GLU 12 2HB GLU 12 8.644 -6.701 -12.651 95 HB3 GLU 12 3HB GLU 12 8.858 -5.710 -14.088 96 HG2 GLU 12 2HG GLU 12 9.935 -3.977 -12.718 97 HG3 GLU 12 3HG GLU 12 9.738 -4.993 -11.292 98 H GLU 13 H GLU 13 6.941 -3.915 -15.032 99 HA GLU 13 HA GLU 13 8.343 -1.533 -14.841 100 HB2 GLU 13 2HB GLU 13 7.150 -0.788 -16.784 101 HB3 GLU 13 3HB GLU 13 7.409 -2.515 -16.934 102 HG2 GLU 13 2HG GLU 13 5.245 -2.623 -17.481 103 HG3 GLU 13 3HG GLU 13 4.928 -2.414 -15.761 104 H THR 14 H THR 14 5.023 -2.201 -13.834 105 HA THR 14 HA THR 14 4.301 0.488 -13.250 106 HB THR 14 HB THR 14 3.163 -2.047 -12.035 107 HG1 THR 14 HG1 THR 14 2.972 -0.985 -14.552 108 HG21 THR 14 3HG2 THR 14 1.152 -0.693 -11.657 109 HG22 THR 14 1HG2 THR 14 1.981 0.724 -12.302 110 HG23 THR 14 2HG2 THR 14 2.540 -0.019 -10.803 111 H LEU 15 H LEU 15 5.255 -2.201 -11.100 112 HA LEU 15 HA LEU 15 5.347 -0.748 -8.710 113 HB2 LEU 15 2HB LEU 15 5.396 -3.208 -8.843 114 HB3 LEU 15 3HB LEU 15 7.013 -3.140 -9.519 115 HG LEU 15 HG LEU 15 7.839 -2.133 -7.411 116 HD11 LEU 15 1HD1 LEU 15 5.765 -1.073 -6.678 117 HD12 LEU 15 2HD1 LEU 15 6.430 -2.121 -5.427 118 HD13 LEU 15 3HD1 LEU 15 5.048 -2.660 -6.384 119 HD21 LEU 15 3HD2 LEU 15 8.011 -4.535 -7.740 120 HD22 LEU 15 1HD2 LEU 15 6.387 -4.765 -7.090 121 HD23 LEU 15 2HD2 LEU 15 7.681 -4.172 -6.046 122 H ARG 16 H ARG 16 7.742 -1.108 -11.256 123 HA ARG 16 HA ARG 16 9.994 -0.033 -9.956 124 HB2 ARG 16 2HB ARG 16 10.045 -1.224 -12.131 125 HB3 ARG 16 3HB ARG 16 9.246 0.146 -12.887 126 HG2 ARG 16 2HG ARG 16 11.170 1.562 -12.412 127 HG3 ARG 16 3HG ARG 16 11.968 0.223 -11.583 128 HD2 ARG 16 2HD ARG 16 11.918 -1.069 -13.695 129 HD3 ARG 16 3HD ARG 16 11.203 0.325 -14.505 130 HE ARG 16 HE ARG 16 13.360 1.485 -13.713 131 HH11 ARG 16 1HH1 ARG 16 13.132 -1.820 -14.655 132 HH12 ARG 16 2HH1 ARG 16 14.762 -1.880 -15.226 133 HH21 ARG 16 1HH2 ARG 16 15.442 1.400 -14.446 134 HH22 ARG 16 2HH2 ARG 16 16.062 -0.075 -15.103 135 H LYS 17 H LYS 17 7.371 1.523 -11.750 136 HA LYS 17 HA LYS 17 8.379 4.166 -11.645 137 HB2 LYS 17 2HB LYS 17 5.548 3.146 -11.942 138 HB3 LYS 17 3HB LYS 17 6.039 4.817 -12.204 139 HG2 LYS 17 2HG LYS 17 7.353 4.240 -14.087 140 HG3 LYS 17 3HG LYS 17 7.258 2.517 -13.719 141 HD2 LYS 17 2HD LYS 17 4.840 2.572 -14.178 142 HD3 LYS 17 3HD LYS 17 4.966 4.286 -14.586 143 HE2 LYS 17 2HE LYS 17 6.396 3.796 -16.457 144 HE3 LYS 17 3HE LYS 17 6.507 2.099 -15.991 145 HZ1 LYS 17 3HZ LYS 17 3.987 3.441 -16.796 146 HZ2 LYS 17 1HZ LYS 17 4.211 1.788 -16.507 147 HZ3 LYS 17 2HZ LYS 17 4.952 2.525 -17.837 148 H PHE 18 H PHE 18 5.997 2.477 -9.577 149 HA PHE 18 HA PHE 18 5.527 4.574 -7.772 150 HB2 PHE 18 2HB PHE 18 5.331 1.577 -7.494 151 HB3 PHE 18 3HB PHE 18 4.948 2.648 -6.150 152 HD1 PHE 18 HD1 PHE 18 4.128 2.246 -9.779 153 HD2 PHE 18 HD2 PHE 18 2.756 3.289 -5.884 154 HE1 PHE 18 HE1 PHE 18 1.849 2.532 -10.660 155 HE2 PHE 18 HE2 PHE 18 0.477 3.577 -6.759 156 HZ PHE 18 HZ PHE 18 0.020 3.197 -9.151 157 H LYS 19 H LYS 19 7.881 1.887 -7.506 158 HA LYS 19 HA LYS 19 9.054 2.666 -5.088 159 HB2 LYS 19 2HB LYS 19 10.247 1.196 -7.447 160 HB3 LYS 19 3HB LYS 19 11.075 1.394 -5.908 161 HG2 LYS 19 2HG LYS 19 9.216 0.199 -4.793 162 HG3 LYS 19 3HG LYS 19 8.474 -0.064 -6.371 163 HD2 LYS 19 2HD LYS 19 11.224 -1.037 -5.566 164 HD3 LYS 19 3HD LYS 19 9.763 -2.025 -5.563 165 HE2 LYS 19 2HE LYS 19 9.530 -1.621 -7.998 166 HE3 LYS 19 3HE LYS 19 11.043 -0.715 -7.970 167 HZ1 LYS 19 3HZ LYS 19 11.202 -3.106 -8.673 168 HZ2 LYS 19 1HZ LYS 19 10.847 -3.537 -7.080 169 HZ3 LYS 19 2HZ LYS 19 12.246 -2.655 -7.423 170 H ASP 20 H ASP 20 9.724 3.724 -8.394 171 HA ASP 20 HA ASP 20 12.067 5.182 -7.911 172 HB2 ASP 20 2HB ASP 20 11.204 4.606 -10.164 173 HB3 ASP 20 3HB ASP 20 9.908 5.778 -9.951 174 H ILE 21 H ILE 21 8.676 6.275 -7.917 175 HA ILE 21 HA ILE 21 9.089 8.952 -7.219 176 HB ILE 21 HB ILE 21 6.747 7.183 -6.455 177 HG12 ILE 21 2HG1 ILE 21 7.071 8.980 -8.879 178 HG13 ILE 21 3HG1 ILE 21 7.294 7.234 -8.905 179 HG21 ILE 21 1HG2 ILE 21 6.803 9.284 -5.189 180 HG22 ILE 21 2HG2 ILE 21 5.456 9.253 -6.326 181 HG23 ILE 21 3HG2 ILE 21 6.901 10.193 -6.698 182 HD11 ILE 21 3HD1 ILE 21 4.971 6.907 -8.296 183 HD12 ILE 21 1HD1 ILE 21 5.105 7.900 -9.747 184 HD13 ILE 21 2HD1 ILE 21 4.734 8.653 -8.196 185 H ILE 22 H ILE 22 8.657 6.096 -5.150 186 HA ILE 22 HA ILE 22 8.710 7.348 -2.647 187 HB ILE 22 HB ILE 22 9.734 4.594 -3.388 188 HG12 ILE 22 2HG1 ILE 22 7.037 5.483 -2.313 189 HG13 ILE 22 3HG1 ILE 22 7.358 4.988 -3.972 190 HG21 ILE 22 1HG2 ILE 22 10.623 5.294 -1.231 191 HG22 ILE 22 2HG2 ILE 22 9.406 4.037 -1.012 192 HG23 ILE 22 3HG2 ILE 22 9.003 5.722 -0.681 193 HD11 ILE 22 3HD1 ILE 22 7.592 3.249 -1.527 194 HD12 ILE 22 1HD1 ILE 22 7.939 2.749 -3.182 195 HD13 ILE 22 2HD1 ILE 22 6.298 3.209 -2.725 196 H LYS 23 H LYS 23 11.440 6.105 -4.605 197 HA LYS 23 HA LYS 23 13.500 6.762 -2.800 198 HB2 LYS 23 2HB LYS 23 13.728 6.882 -5.819 199 HB3 LYS 23 3HB LYS 23 15.038 6.676 -4.665 200 HG2 LYS 23 2HG LYS 23 13.849 4.502 -3.993 201 HG3 LYS 23 3HG LYS 23 12.933 4.704 -5.487 202 HD2 LYS 23 2HD LYS 23 15.909 4.321 -5.160 203 HD3 LYS 23 3HD LYS 23 14.768 3.293 -6.025 204 HE2 LYS 23 2HE LYS 23 15.605 6.088 -6.824 205 HE3 LYS 23 3HE LYS 23 16.150 4.591 -7.575 206 HZ1 LYS 23 3HZ LYS 23 13.396 5.685 -7.583 207 HZ2 LYS 23 1HZ LYS 23 13.809 4.156 -8.173 208 HZ3 LYS 23 2HZ LYS 23 14.440 5.543 -8.904 209 H LYS 24 H LYS 24 12.040 8.650 -5.420 210 HA LYS 24 HA LYS 24 13.654 10.903 -5.371 211 HB2 LYS 24 2HB LYS 24 12.070 10.617 -7.132 212 HB3 LYS 24 3HB LYS 24 10.721 10.579 -6.007 213 HG2 LYS 24 2HG LYS 24 11.009 12.927 -5.511 214 HG3 LYS 24 3HG LYS 24 12.455 12.992 -6.520 215 HD2 LYS 24 2HD LYS 24 9.711 12.260 -7.555 216 HD3 LYS 24 3HD LYS 24 10.378 13.892 -7.607 217 HE2 LYS 24 2HE LYS 24 11.608 11.458 -8.906 218 HE3 LYS 24 3HE LYS 24 10.664 12.692 -9.739 219 HZ1 LYS 24 3HZ LYS 24 12.333 14.335 -9.087 220 HZ2 LYS 24 1HZ LYS 24 13.014 13.093 -10.010 221 HZ3 LYS 24 2HZ LYS 24 13.245 13.128 -8.338 222 H ASN 25 H ASN 25 10.791 10.214 -3.376 223 HA ASN 25 HA ASN 25 10.947 12.749 -2.002 224 HB2 ASN 25 2HB ASN 25 9.245 10.291 -1.569 225 HB3 ASN 25 3HB ASN 25 9.108 11.754 -0.595 226 HD21 ASN 25 1HD2 ASN 25 7.270 10.409 -2.531 227 HD22 ASN 25 2HD2 ASN 25 6.815 11.657 -3.631 228 H GLY 26 H GLY 26 12.764 9.983 -1.721 229 HA2 GLY 26 2HA GLY 26 14.465 9.540 -0.222 230 HA3 GLY 26 3HA GLY 26 13.944 10.916 0.732 231 H PHE 27 H PHE 27 12.199 7.936 -0.180 232 HA PHE 27 HA PHE 27 12.005 7.255 2.698 233 HB2 PHE 27 2HB PHE 27 9.965 6.887 0.493 234 HB3 PHE 27 3HB PHE 27 9.847 6.077 2.051 235 HD1 PHE 27 HD2 PHE 27 9.971 9.429 0.452 236 HD2 PHE 27 HD1 PHE 27 8.906 7.166 3.899 237 HE1 PHE 27 HE2 PHE 27 8.821 11.394 1.384 238 HE2 PHE 27 HE1 PHE 27 7.758 9.128 4.834 239 HZ PHE 27 HZ PHE 27 7.714 11.245 3.579 240 H LYS 28 H LYS 28 11.847 4.940 3.188 241 HA LYS 28 HA LYS 28 13.478 3.345 1.341 242 HB2 LYS 28 2HB LYS 28 12.673 2.751 4.200 243 HB3 LYS 28 3HB LYS 28 13.833 1.842 3.240 244 HG2 LYS 28 2HG LYS 28 14.120 4.688 4.207 245 HG3 LYS 28 3HG LYS 28 15.015 3.276 4.774 246 HD2 LYS 28 2HD LYS 28 16.101 3.039 2.626 247 HD3 LYS 28 3HD LYS 28 15.109 4.326 1.938 248 HE2 LYS 28 2HE LYS 28 17.305 5.188 2.431 249 HE3 LYS 28 3HE LYS 28 16.135 5.923 3.526 250 HZ1 LYS 28 3HZ LYS 28 17.947 3.669 4.188 251 HZ2 LYS 28 1HZ LYS 28 16.833 4.375 5.246 252 HZ3 LYS 28 2HZ LYS 28 18.145 5.272 4.677 253 H VAL 29 H VAL 29 12.754 1.527 0.332 254 HA VAL 29 HA VAL 29 9.846 1.181 0.317 255 HB VAL 29 HB VAL 29 11.869 0.056 -1.633 256 HG11 VAL 29 1HG1 VAL 29 9.747 -1.133 -1.646 257 HG12 VAL 29 2HG1 VAL 29 9.920 -0.182 -3.120 258 HG13 VAL 29 3HG1 VAL 29 8.870 0.387 -1.824 259 HG21 VAL 29 3HG2 VAL 29 10.239 2.594 -1.856 260 HG22 VAL 29 1HG2 VAL 29 11.261 1.909 -3.121 261 HG23 VAL 29 2HG2 VAL 29 11.986 2.501 -1.625 262 H ARG 30 H ARG 30 8.871 -0.546 1.155 263 HA ARG 30 HA ARG 30 10.413 -3.031 1.598 264 HB2 ARG 30 2HB ARG 30 8.519 -1.574 3.247 265 HB3 ARG 30 3HB ARG 30 7.929 -3.201 2.954 266 HG2 ARG 30 2HG ARG 30 9.207 -3.061 5.022 267 HG3 ARG 30 3HG ARG 30 9.978 -4.140 3.860 268 HD2 ARG 30 2HD ARG 30 11.634 -2.501 3.324 269 HD3 ARG 30 3HD ARG 30 10.779 -1.258 4.240 270 HE ARG 30 HE ARG 30 11.641 -2.122 6.193 271 HH11 ARG 30 1HH1 ARG 30 12.305 -4.323 3.616 272 HH12 ARG 30 2HH1 ARG 30 13.452 -5.221 4.548 273 HH21 ARG 30 1HH2 ARG 30 13.095 -3.284 7.367 274 HH22 ARG 30 2HH2 ARG 30 13.891 -4.642 6.648 275 H THR 31 H THR 31 10.130 -4.068 -0.388 276 HA THR 31 HA THR 31 7.493 -4.214 -1.604 277 HB THR 31 HB THR 31 8.566 -5.574 -3.362 278 HG1 THR 31 HG1 THR 31 10.193 -6.688 -2.429 279 HG21 THR 31 3HG2 THR 31 10.162 -3.103 -2.655 280 HG22 THR 31 1HG2 THR 31 8.617 -3.112 -3.508 281 HG23 THR 31 2HG2 THR 31 10.039 -3.844 -4.250 282 H VAL 32 H VAL 32 6.091 -5.451 -0.491 283 HA VAL 32 HA VAL 32 6.969 -8.023 0.611 284 HB VAL 32 HB VAL 32 4.394 -6.484 1.017 285 HG11 VAL 32 1HG1 VAL 32 4.015 -8.885 1.251 286 HG12 VAL 32 2HG1 VAL 32 3.921 -8.083 2.818 287 HG13 VAL 32 3HG1 VAL 32 5.363 -9.001 2.381 288 HG21 VAL 32 3HG2 VAL 32 6.353 -5.397 2.016 289 HG22 VAL 32 1HG2 VAL 32 6.746 -6.888 2.873 290 HG23 VAL 32 2HG2 VAL 32 5.260 -6.018 3.254 291 H ARG 33 H ARG 33 6.410 -9.928 -0.240 292 HA ARG 33 HA ARG 33 4.070 -10.080 -2.049 293 HB2 ARG 33 2HB ARG 33 6.299 -10.514 -3.146 294 HB3 ARG 33 3HB ARG 33 6.512 -11.879 -2.057 295 HG2 ARG 33 2HG ARG 33 4.129 -12.544 -3.096 296 HG3 ARG 33 3HG ARG 33 4.767 -11.601 -4.443 297 HD2 ARG 33 2HD ARG 33 5.392 -13.854 -4.843 298 HD3 ARG 33 3HD ARG 33 6.853 -13.031 -4.293 299 HE ARG 33 HE ARG 33 5.208 -14.560 -2.391 300 HH11 ARG 33 1HH1 ARG 33 8.229 -14.027 -3.961 301 HH12 ARG 33 2HH1 ARG 33 9.058 -15.201 -3.005 302 HH21 ARG 33 1HH2 ARG 33 6.283 -16.056 -1.163 303 HH22 ARG 33 2HH2 ARG 33 7.969 -16.336 -1.434 304 H SER 34 H SER 34 5.785 -11.367 0.689 305 HA SER 34 HA SER 34 3.707 -13.432 1.107 306 HB2 SER 34 2HB SER 34 6.617 -13.561 1.958 307 HB3 SER 34 3HB SER 34 5.411 -14.833 2.150 308 HG SER 34 HG SER 34 6.609 -13.860 -0.214 309 HA PRO 35 HA PRO 35 2.624 -11.683 5.027 310 HB2 PRO 35 2HB PRO 35 2.609 -13.977 6.619 311 HB3 PRO 35 3HB PRO 35 1.267 -13.403 5.625 312 HG2 PRO 35 2HG PRO 35 3.315 -15.497 5.024 313 HG3 PRO 35 3HG PRO 35 1.582 -15.481 4.645 314 HD2 PRO 35 2HD PRO 35 3.414 -14.968 2.762 315 HD3 PRO 35 3HD PRO 35 1.874 -14.080 2.804 316 H GLN 36 H GLN 36 5.297 -14.055 5.194 317 HA GLN 36 HA GLN 36 6.426 -13.144 7.599 318 HB2 GLN 36 2HB GLN 36 8.486 -14.270 6.883 319 HB3 GLN 36 3HB GLN 36 7.072 -15.273 6.597 320 HG2 GLN 36 2HG GLN 36 7.129 -14.768 4.238 321 HG3 GLN 36 3HG GLN 36 8.449 -13.624 4.481 322 HE21 GLN 36 1HE2 GLN 36 10.524 -14.419 4.902 323 HE22 GLN 36 2HE2 GLN 36 10.947 -16.070 4.606 324 H GLU 37 H GLU 37 6.762 -11.937 4.311 325 HA GLU 37 HA GLU 37 8.946 -10.160 4.884 326 HB2 GLU 37 2HB GLU 37 6.982 -10.122 2.577 327 HB3 GLU 37 3HB GLU 37 8.494 -9.225 2.659 328 HG2 GLU 37 2HG GLU 37 9.743 -11.334 2.728 329 HG3 GLU 37 3HG GLU 37 8.227 -12.231 2.638 330 H LEU 38 H LEU 38 5.426 -9.849 4.714 331 HA LEU 38 HA LEU 38 5.229 -7.073 5.161 332 HB2 LEU 38 2HB LEU 38 3.329 -8.509 4.476 333 HB3 LEU 38 3HB LEU 38 3.345 -9.271 6.053 334 HG LEU 38 HG LEU 38 2.755 -7.095 7.094 335 HD11 LEU 38 1HD1 LEU 38 3.705 -5.588 5.448 336 HD12 LEU 38 2HD1 LEU 38 1.986 -5.252 5.656 337 HD13 LEU 38 3HD1 LEU 38 2.547 -6.139 4.236 338 HD21 LEU 38 3HD2 LEU 38 1.000 -8.693 6.549 339 HD22 LEU 38 1HD2 LEU 38 0.874 -8.028 4.920 340 HD23 LEU 38 2HD2 LEU 38 0.427 -7.042 6.313 341 H LYS 39 H LYS 39 5.090 -9.783 7.459 342 HA LYS 39 HA LYS 39 5.015 -8.262 9.813 343 HB2 LYS 39 2HB LYS 39 4.468 -10.692 9.628 344 HB3 LYS 39 3HB LYS 39 6.185 -11.033 9.449 345 HG2 LYS 39 2HG LYS 39 6.617 -10.157 11.674 346 HG3 LYS 39 3HG LYS 39 4.917 -9.725 11.855 347 HD2 LYS 39 2HD LYS 39 5.363 -11.792 13.031 348 HD3 LYS 39 3HD LYS 39 4.316 -12.114 11.648 349 HE2 LYS 39 2HE LYS 39 6.189 -12.971 10.376 350 HE3 LYS 39 3HE LYS 39 7.312 -12.526 11.663 351 HZ1 LYS 39 3HZ LYS 39 6.214 -14.105 13.120 352 HZ2 LYS 39 1HZ LYS 39 6.774 -14.881 11.724 353 HZ3 LYS 39 2HZ LYS 39 5.130 -14.528 11.894 354 H ASP 40 H ASP 40 7.743 -9.475 7.916 355 HA ASP 40 HA ASP 40 9.881 -8.993 9.596 356 HB2 ASP 40 2HB ASP 40 10.139 -10.098 7.458 357 HB3 ASP 40 3HB ASP 40 9.665 -8.641 6.596 358 H SER 41 H SER 41 8.026 -6.669 7.717 359 HA SER 41 HA SER 41 9.719 -4.423 8.435 360 HB2 SER 41 2HB SER 41 8.541 -4.412 6.280 361 HB3 SER 41 3HB SER 41 6.987 -4.495 7.110 362 HG SER 41 HG SER 41 7.081 -2.399 7.138 363 H ILE 42 H ILE 42 6.453 -5.557 9.273 364 HA ILE 42 HA ILE 42 5.709 -3.407 10.907 365 HB ILE 42 HB ILE 42 4.752 -6.274 10.968 366 HG12 ILE 42 2HG1 ILE 42 3.633 -3.799 9.616 367 HG13 ILE 42 3HG1 ILE 42 4.437 -5.139 8.808 368 HG21 ILE 42 1HG2 ILE 42 3.467 -3.822 12.182 369 HG22 ILE 42 2HG2 ILE 42 4.220 -5.143 13.074 370 HG23 ILE 42 3HG2 ILE 42 2.764 -5.439 12.125 371 HD11 ILE 42 3HD1 ILE 42 2.033 -5.269 8.547 372 HD12 ILE 42 1HD1 ILE 42 1.827 -5.292 10.298 373 HD13 ILE 42 2HD1 ILE 42 2.635 -6.635 9.488 374 H GLU 43 H GLU 43 7.378 -6.429 11.783 375 HA GLU 43 HA GLU 43 7.224 -6.226 14.564 376 HB2 GLU 43 2HB GLU 43 9.516 -7.329 12.917 377 HB3 GLU 43 3HB GLU 43 9.255 -7.634 14.628 378 HG2 GLU 43 2HG GLU 43 7.376 -8.445 12.416 379 HG3 GLU 43 3HG GLU 43 8.554 -9.502 13.184 380 H GLU 44 H GLU 44 9.322 -4.543 12.298 381 HA GLU 44 HA GLU 44 10.833 -3.301 14.465 382 HB2 GLU 44 2HB GLU 44 11.049 -2.999 11.465 383 HB3 GLU 44 3HB GLU 44 12.053 -2.131 12.619 384 HG2 GLU 44 2HG GLU 44 12.766 -4.399 13.502 385 HG3 GLU 44 3HG GLU 44 11.979 -5.089 12.082 386 H LEU 45 H LEU 45 8.213 -2.497 12.274 387 HA LEU 45 HA LEU 45 8.351 0.304 12.390 388 HB2 LEU 45 2HB LEU 45 6.045 -1.578 11.943 389 HB3 LEU 45 3HB LEU 45 5.833 0.163 11.916 390 HG LEU 45 HG LEU 45 7.688 -1.376 10.085 391 HD11 LEU 45 1HD1 LEU 45 5.354 -1.868 9.585 392 HD12 LEU 45 2HD1 LEU 45 6.061 -0.857 8.326 393 HD13 LEU 45 3HD1 LEU 45 4.986 -0.143 9.528 394 HD21 LEU 45 3HD2 LEU 45 6.896 1.542 10.156 395 HD22 LEU 45 1HD2 LEU 45 7.816 0.775 8.859 396 HD23 LEU 45 2HD2 LEU 45 8.494 0.871 10.484 397 H VAL 46 H VAL 46 7.228 -1.946 14.790 398 HA VAL 46 HA VAL 46 5.753 -0.074 16.367 399 HB VAL 46 HB VAL 46 5.509 -2.547 16.562 400 HG11 VAL 46 1HG1 VAL 46 8.173 -2.423 17.982 401 HG12 VAL 46 2HG1 VAL 46 7.861 -3.176 16.419 402 HG13 VAL 46 3HG1 VAL 46 7.119 -3.836 17.875 403 HG21 VAL 46 3HG2 VAL 46 6.231 -1.139 19.137 404 HG22 VAL 46 1HG2 VAL 46 5.267 -2.612 19.002 405 HG23 VAL 46 2HG2 VAL 46 4.665 -1.099 18.328 406 H LYS 47 H LYS 47 9.030 -0.367 15.720 407 HA LYS 47 HA LYS 47 9.792 1.195 18.114 408 HB2 LYS 47 2HB LYS 47 11.560 -0.605 16.432 409 HB3 LYS 47 3HB LYS 47 12.067 0.308 17.848 410 HG2 LYS 47 2HG LYS 47 10.067 -1.952 17.818 411 HG3 LYS 47 3HG LYS 47 11.739 -2.046 18.373 412 HD2 LYS 47 2HD LYS 47 11.249 -0.409 20.134 413 HD3 LYS 47 3HD LYS 47 9.577 -0.308 19.578 414 HE2 LYS 47 2HE LYS 47 9.800 -1.773 21.532 415 HE3 LYS 47 3HE LYS 47 9.239 -2.661 20.113 416 HZ1 LYS 47 3HZ LYS 47 12.054 -2.587 21.060 417 HZ2 LYS 47 1HZ LYS 47 11.451 -3.509 19.778 418 HZ3 LYS 47 2HZ LYS 47 10.969 -3.848 21.359 419 H LYS 48 H LYS 48 10.760 0.623 14.728 420 HA LYS 48 HA LYS 48 11.839 3.307 14.490 421 HB2 LYS 48 2HB LYS 48 11.617 1.098 12.436 422 HB3 LYS 48 3HB LYS 48 12.481 2.613 12.221 423 HG2 LYS 48 2HG LYS 48 13.992 1.967 14.077 424 HG3 LYS 48 3HG LYS 48 13.161 0.409 14.167 425 HD2 LYS 48 2HD LYS 48 13.804 -0.088 11.864 426 HD3 LYS 48 3HD LYS 48 14.579 1.491 11.722 427 HE2 LYS 48 2HE LYS 48 16.282 -0.149 12.106 428 HE3 LYS 48 3HE LYS 48 16.123 0.825 13.567 429 HZ1 LYS 48 3HZ LYS 48 14.937 -1.866 13.148 430 HZ2 LYS 48 1HZ LYS 48 14.805 -0.938 14.557 431 HZ3 LYS 48 2HZ LYS 48 16.311 -1.527 14.070 432 H TYR 49 H TYR 49 10.149 4.761 14.466 433 HA TYR 49 HA TYR 49 7.899 4.388 12.645 434 HB2 TYR 49 2HB TYR 49 8.571 6.754 14.419 435 HB3 TYR 49 3HB TYR 49 7.041 6.467 13.599 436 HD1 TYR 49 HD1 TYR 49 9.277 5.199 16.267 437 HD2 TYR 49 HD2 TYR 49 5.364 5.095 14.589 438 HE1 TYR 49 HE1 TYR 49 8.456 4.018 18.265 439 HE2 TYR 49 HE2 TYR 49 4.536 3.910 16.582 440 HH TYR 49 HH TYR 49 6.362 3.649 19.458 441 H ASN 50 H ASN 50 10.729 4.799 11.714 442 HA ASN 50 HA ASN 50 11.112 7.432 10.758 443 HB2 ASN 50 2HB ASN 50 12.400 4.837 9.886 444 HB3 ASN 50 3HB ASN 50 12.993 6.449 9.496 445 HD21 ASN 50 1HD2 ASN 50 13.942 7.687 11.104 446 HD22 ASN 50 2HD2 ASN 50 14.460 7.005 12.608 447 H ALA 51 H ALA 51 11.923 7.419 8.243 448 HA ALA 51 HA ALA 51 9.499 7.506 6.731 449 HB1 ALA 51 3HB ALA 51 10.912 8.363 4.927 450 HB2 ALA 51 1HB ALA 51 12.354 7.939 5.847 451 HB3 ALA 51 2HB ALA 51 11.255 9.179 6.452 452 H THR 52 H THR 52 9.156 5.081 7.104 453 HA THR 52 HA THR 52 10.344 3.552 4.869 454 HB THR 52 HB THR 52 9.168 2.447 7.441 455 HG1 THR 52 HG1 THR 52 11.303 2.013 7.993 456 HG21 THR 52 3HG2 THR 52 10.063 0.289 6.661 457 HG22 THR 52 1HG2 THR 52 10.565 1.046 5.149 458 HG23 THR 52 2HG2 THR 52 8.852 0.923 5.547 459 H ILE 53 H ILE 53 9.010 2.820 3.326 460 HA ILE 53 HA ILE 53 6.091 2.923 3.789 461 HB ILE 53 HB ILE 53 7.593 3.283 1.183 462 HG12 ILE 53 2HG1 ILE 53 6.041 5.254 2.892 463 HG13 ILE 53 3HG1 ILE 53 7.779 5.252 2.613 464 HG21 ILE 53 1HG2 ILE 53 4.624 3.331 1.747 465 HG22 ILE 53 2HG2 ILE 53 5.499 2.151 0.772 466 HG23 ILE 53 3HG2 ILE 53 5.369 3.822 0.226 467 HD11 ILE 53 3HD1 ILE 53 5.655 5.755 0.539 468 HD12 ILE 53 1HD1 ILE 53 7.396 5.744 0.248 469 HD13 ILE 53 2HD1 ILE 53 6.684 6.967 1.302 470 H VAL 54 H VAL 54 4.998 1.034 3.600 471 HA VAL 54 HA VAL 54 6.487 -1.302 2.610 472 HB VAL 54 HB VAL 54 5.779 -1.605 4.875 473 HG11 VAL 54 1HG1 VAL 54 2.965 -0.989 3.965 474 HG12 VAL 54 2HG1 VAL 54 3.986 0.042 4.968 475 HG13 VAL 54 3HG1 VAL 54 3.434 -1.517 5.581 476 HG21 VAL 54 3HG2 VAL 54 5.646 -3.578 3.439 477 HG22 VAL 54 1HG2 VAL 54 3.971 -3.191 3.043 478 HG23 VAL 54 2HG2 VAL 54 4.408 -3.631 4.694 479 H VAL 55 H VAL 55 6.106 -1.755 0.557 480 HA VAL 55 HA VAL 55 3.462 -1.245 -0.620 481 HB VAL 55 HB VAL 55 6.061 -1.936 -2.017 482 HG11 VAL 55 1HG1 VAL 55 3.446 -0.893 -3.121 483 HG12 VAL 55 2HG1 VAL 55 4.074 -2.530 -3.315 484 HG13 VAL 55 3HG1 VAL 55 4.923 -1.168 -4.046 485 HG21 VAL 55 3HG2 VAL 55 4.752 0.766 -1.654 486 HG22 VAL 55 1HG2 VAL 55 6.202 0.434 -2.603 487 HG23 VAL 55 2HG2 VAL 55 6.224 0.217 -0.853 488 H VAL 56 H VAL 56 2.116 -2.959 -0.486 489 HA VAL 56 HA VAL 56 3.182 -5.680 -0.525 490 HB VAL 56 HB VAL 56 0.316 -4.776 -0.130 491 HG11 VAL 56 1HG1 VAL 56 0.002 -7.043 0.813 492 HG12 VAL 56 2HG1 VAL 56 1.651 -7.451 0.334 493 HG13 VAL 56 3HG1 VAL 56 0.441 -7.071 -0.894 494 HG21 VAL 56 3HG2 VAL 56 0.710 -5.183 2.266 495 HG22 VAL 56 1HG2 VAL 56 1.749 -3.901 1.644 496 HG23 VAL 56 2HG2 VAL 56 2.411 -5.511 1.929 497 H VAL 57 H VAL 57 3.628 -6.368 -2.542 498 HA VAL 57 HA VAL 57 1.877 -5.761 -4.786 499 HB VAL 57 HB VAL 57 4.333 -7.534 -4.722 500 HG11 VAL 57 1HG1 VAL 57 4.374 -7.141 -7.156 501 HG12 VAL 57 2HG1 VAL 57 2.859 -6.248 -7.028 502 HG13 VAL 57 3HG1 VAL 57 2.903 -7.970 -6.641 503 HG21 VAL 57 3HG2 VAL 57 5.559 -5.603 -5.604 504 HG22 VAL 57 1HG2 VAL 57 4.889 -5.260 -4.008 505 HG23 VAL 57 2HG2 VAL 57 4.111 -4.607 -5.450 506 H VAL 58 H VAL 58 0.114 -6.967 -5.156 507 HA VAL 58 HA VAL 58 0.024 -9.683 -4.017 508 HB VAL 58 HB VAL 58 -2.397 -9.455 -3.899 509 HG11 VAL 58 1HG1 VAL 58 -2.530 -7.721 -2.175 510 HG12 VAL 58 2HG1 VAL 58 -0.982 -7.064 -2.708 511 HG13 VAL 58 3HG1 VAL 58 -1.060 -8.678 -2.003 512 HG21 VAL 58 3HG2 VAL 58 -3.512 -7.320 -4.417 513 HG22 VAL 58 1HG2 VAL 58 -2.784 -8.040 -5.852 514 HG23 VAL 58 2HG2 VAL 58 -1.991 -6.685 -5.047 515 H ASP 59 H ASP 59 -0.177 -11.394 -5.308 516 HA ASP 59 HA ASP 59 -0.929 -11.022 -8.119 517 HB2 ASP 59 2HB ASP 59 -0.103 -13.330 -8.432 518 HB3 ASP 59 3HB ASP 59 1.121 -12.278 -7.733 519 H ASP 60 H ASP 60 -1.949 -12.628 -5.167 520 HA ASP 60 HA ASP 60 -4.488 -13.384 -6.458 521 HB2 ASP 60 2HB ASP 60 -3.268 -14.219 -3.816 522 HB3 ASP 60 3HB ASP 60 -4.901 -14.648 -4.320 523 H LYS 61 H LYS 61 -6.292 -12.243 -6.076 524 HA LYS 61 HA LYS 61 -6.321 -9.818 -4.681 525 HB2 LYS 61 2HB LYS 61 -7.924 -10.711 -6.493 526 HB3 LYS 61 3HB LYS 61 -8.792 -11.487 -5.180 527 HG2 LYS 61 2HG LYS 61 -8.240 -8.547 -5.063 528 HG3 LYS 61 3HG LYS 61 -9.544 -9.153 -6.077 529 HD2 LYS 61 2HD LYS 61 -9.271 -9.678 -3.110 530 HD3 LYS 61 3HD LYS 61 -10.301 -8.438 -3.828 531 HE2 LYS 61 2HE LYS 61 -11.438 -10.294 -5.116 532 HE3 LYS 61 3HE LYS 61 -10.547 -11.431 -4.103 533 HZ1 LYS 61 3HZ LYS 61 -12.731 -11.052 -3.202 534 HZ2 LYS 61 1HZ LYS 61 -12.480 -9.381 -3.165 535 HZ3 LYS 61 2HZ LYS 61 -11.584 -10.397 -2.154 536 H GLU 62 H GLU 62 -7.196 -13.075 -3.643 537 HA GLU 62 HA GLU 62 -8.263 -12.569 -1.119 538 HB2 GLU 62 2HB GLU 62 -7.471 -14.847 -0.526 539 HB3 GLU 62 3HB GLU 62 -8.273 -14.795 -2.091 540 HG2 GLU 62 2HG GLU 62 -6.179 -14.887 -3.248 541 HG3 GLU 62 3HG GLU 62 -5.282 -14.714 -1.741 542 H TRP 63 H TRP 63 -4.866 -12.679 -2.130 543 HA TRP 63 HA TRP 63 -3.713 -12.658 0.453 544 HB2 TRP 63 2HB TRP 63 -2.336 -13.330 -1.370 545 HB3 TRP 63 3HB TRP 63 -2.655 -11.847 -2.258 546 HD1 TRP 63 HD1 TRP 63 -0.347 -10.758 -2.461 547 HE1 TRP 63 HE1 TRP 63 1.489 -10.025 -0.826 548 HE3 TRP 63 HE3 TRP 63 -2.220 -12.798 1.848 549 HZ2 TRP 63 HZ2 TRP 63 2.079 -10.271 1.918 550 HZ3 TRP 63 HZ3 TRP 63 -0.951 -12.500 3.935 551 HH2 TRP 63 HH2 TRP 63 1.156 -11.261 3.966 552 H ALA 64 H ALA 64 -4.591 -10.003 -1.754 553 HA ALA 64 HA ALA 64 -3.614 -7.849 -0.271 554 HB1 ALA 64 3HB ALA 64 -6.159 -7.921 -1.901 555 HB2 ALA 64 1HB ALA 64 -4.539 -7.654 -2.545 556 HB3 ALA 64 2HB ALA 64 -5.252 -6.481 -1.440 557 H GLU 65 H GLU 65 -6.765 -9.469 -0.055 558 HA GLU 65 HA GLU 65 -7.798 -7.883 2.066 559 HB2 GLU 65 2HB GLU 65 -8.562 -10.715 1.295 560 HB3 GLU 65 3HB GLU 65 -9.543 -9.578 2.213 561 HG2 GLU 65 2HG GLU 65 -9.792 -8.150 0.295 562 HG3 GLU 65 3HG GLU 65 -8.661 -9.130 -0.635 563 H LYS 66 H LYS 66 -6.048 -10.957 1.973 564 HA LYS 66 HA LYS 66 -6.261 -11.608 4.713 565 HB2 LYS 66 2HB LYS 66 -5.604 -13.208 2.951 566 HB3 LYS 66 3HB LYS 66 -4.084 -12.351 2.743 567 HG2 LYS 66 2HG LYS 66 -3.371 -12.973 4.962 568 HG3 LYS 66 3HG LYS 66 -4.943 -13.707 5.300 569 HD2 LYS 66 2HD LYS 66 -4.557 -15.321 3.474 570 HD3 LYS 66 3HD LYS 66 -2.971 -14.606 3.190 571 HE2 LYS 66 2HE LYS 66 -2.214 -15.298 5.377 572 HE3 LYS 66 3HE LYS 66 -3.830 -15.879 5.791 573 HZ1 LYS 66 3HZ LYS 66 -2.171 -16.966 3.579 574 HZ2 LYS 66 1HZ LYS 66 -3.660 -17.566 4.118 575 HZ3 LYS 66 2HZ LYS 66 -2.296 -17.665 5.113 576 H ALA 67 H ALA 67 -3.904 -9.670 2.925 577 HA ALA 67 HA ALA 67 -2.040 -9.204 4.955 578 HB1 ALA 67 3HB ALA 67 -2.912 -7.326 2.751 579 HB2 ALA 67 1HB ALA 67 -1.656 -8.558 2.630 580 HB3 ALA 67 2HB ALA 67 -1.434 -7.178 3.704 581 H ILE 68 H ILE 68 -5.002 -7.380 4.145 582 HA ILE 68 HA ILE 68 -4.806 -5.449 6.185 583 HB ILE 68 HB ILE 68 -7.333 -6.566 4.940 584 HG12 ILE 68 2HG1 ILE 68 -5.811 -5.715 3.228 585 HG13 ILE 68 3HG1 ILE 68 -7.175 -4.617 3.409 586 HG21 ILE 68 1HG2 ILE 68 -8.339 -4.401 5.571 587 HG22 ILE 68 2HG2 ILE 68 -6.853 -3.976 6.421 588 HG23 ILE 68 3HG2 ILE 68 -7.825 -5.339 6.974 589 HD11 ILE 68 3HD1 ILE 68 -4.419 -4.219 4.558 590 HD12 ILE 68 1HD1 ILE 68 -5.781 -3.113 4.733 591 HD13 ILE 68 2HD1 ILE 68 -5.089 -3.412 3.140 592 H ARG 69 H ARG 69 -6.196 -8.699 6.185 593 HA ARG 69 HA ARG 69 -7.384 -8.727 8.720 594 HB2 ARG 69 2HB ARG 69 -7.691 -10.529 7.115 595 HB3 ARG 69 3HB ARG 69 -5.987 -10.938 7.194 596 HG2 ARG 69 2HG ARG 69 -7.269 -12.555 8.426 597 HG3 ARG 69 3HG ARG 69 -6.279 -11.622 9.546 598 HD2 ARG 69 2HD ARG 69 -9.062 -10.683 9.039 599 HD3 ARG 69 3HD ARG 69 -8.854 -12.144 10.001 600 HE ARG 69 HE ARG 69 -7.182 -10.478 11.242 601 HH11 ARG 69 1HH1 ARG 69 -10.367 -9.917 10.084 602 HH12 ARG 69 2HH1 ARG 69 -10.798 -8.898 11.411 603 HH21 ARG 69 1HH2 ARG 69 -7.751 -9.182 12.961 604 HH22 ARG 69 2HH2 ARG 69 -9.341 -8.501 13.029 605 H PHE 70 H PHE 70 -4.024 -9.401 7.766 606 HA PHE 70 HA PHE 70 -3.072 -9.950 10.383 607 HB2 PHE 70 2HB PHE 70 -1.892 -10.598 8.283 608 HB3 PHE 70 3HB PHE 70 -1.501 -8.903 8.013 609 HD1 PHE 70 HD1 PHE 70 -0.967 -11.750 10.331 610 HD2 PHE 70 HD2 PHE 70 0.373 -7.904 9.067 611 HE1 PHE 70 HE1 PHE 70 1.067 -12.015 11.687 612 HE2 PHE 70 HE2 PHE 70 2.407 -8.171 10.430 613 HZ PHE 70 HZ PHE 70 2.754 -10.227 11.739 614 H VAL 71 H VAL 71 -3.153 -6.967 8.439 615 HA VAL 71 HA VAL 71 -1.784 -5.298 10.252 616 HB VAL 71 HB VAL 71 -3.923 -4.533 8.243 617 HG11 VAL 71 1HG1 VAL 71 -2.938 -2.277 8.349 618 HG12 VAL 71 2HG1 VAL 71 -1.869 -2.811 9.648 619 HG13 VAL 71 3HG1 VAL 71 -3.614 -2.773 9.901 620 HG21 VAL 71 3HG2 VAL 71 -2.042 -5.659 7.182 621 HG22 VAL 71 1HG2 VAL 71 -0.904 -4.586 8.001 622 HG23 VAL 71 2HG2 VAL 71 -2.014 -3.941 6.791 623 H LYS 72 H LYS 72 -5.241 -6.088 9.996 624 HA LYS 72 HA LYS 72 -6.221 -4.292 11.916 625 HB2 LYS 72 2HB LYS 72 -7.493 -5.871 10.281 626 HB3 LYS 72 3HB LYS 72 -7.367 -7.062 11.566 627 HG2 LYS 72 2HG LYS 72 -8.613 -4.340 11.959 628 HG3 LYS 72 3HG LYS 72 -9.530 -5.758 11.455 629 HD2 LYS 72 2HD LYS 72 -8.902 -6.911 13.523 630 HD3 LYS 72 3HD LYS 72 -7.941 -5.518 14.017 631 HE2 LYS 72 2HE LYS 72 -9.969 -4.136 14.058 632 HE3 LYS 72 3HE LYS 72 -10.928 -5.535 13.576 633 HZ1 LYS 72 3HZ LYS 72 -10.220 -6.642 15.629 634 HZ2 LYS 72 1HZ LYS 72 -11.070 -5.214 15.941 635 HZ3 LYS 72 2HZ LYS 72 -9.387 -5.248 16.100 636 H SER 73 H SER 73 -4.653 -7.418 12.257 637 HA SER 73 HA SER 73 -5.181 -7.997 14.936 638 HB2 SER 73 2HB SER 73 -2.590 -8.519 13.442 639 HB3 SER 73 3HB SER 73 -3.125 -9.344 14.905 640 HG SER 73 HG SER 73 -4.140 -9.526 12.276 641 H LEU 74 H LEU 74 -3.073 -5.594 13.557 642 HA LEU 74 HA LEU 74 -1.502 -5.095 15.904 643 HB2 LEU 74 2HB LEU 74 -2.032 -3.262 13.561 644 HB3 LEU 74 3HB LEU 74 -0.714 -3.129 14.711 645 HG LEU 74 HG LEU 74 -1.077 -5.418 12.767 646 HD11 LEU 74 1HD1 LEU 74 -0.594 -3.370 11.569 647 HD12 LEU 74 2HD1 LEU 74 0.818 -4.427 11.559 648 HD13 LEU 74 3HD1 LEU 74 0.771 -3.033 12.639 649 HD21 LEU 74 3HD2 LEU 74 0.119 -6.082 14.780 650 HD22 LEU 74 1HD2 LEU 74 1.217 -4.712 14.604 651 HD23 LEU 74 2HD2 LEU 74 1.220 -6.006 13.406 652 H GLY 75 H GLY 75 -4.389 -3.599 14.470 653 HA2 GLY 75 2HA GLY 75 -6.100 -2.452 15.570 654 HA3 GLY 75 3HA GLY 75 -5.148 -2.473 17.044 655 H ALA 76 H ALA 76 -2.955 -1.350 15.020 656 HA ALA 76 HA ALA 76 -3.345 1.384 15.862 657 HB1 ALA 76 3HB ALA 76 -1.121 0.214 14.189 658 HB2 ALA 76 1HB ALA 76 -1.132 0.298 15.951 659 HB3 ALA 76 2HB ALA 76 -1.120 1.781 14.999 660 H GLN 77 H GLN 77 -4.154 3.015 14.692 661 HA GLN 77 HA GLN 77 -5.239 2.735 12.116 662 HB2 GLN 77 2HB GLN 77 -5.335 5.275 12.164 663 HB3 GLN 77 3HB GLN 77 -6.133 4.445 13.492 664 HG2 GLN 77 2HG GLN 77 -4.264 4.925 14.963 665 HG3 GLN 77 3HG GLN 77 -3.377 5.664 13.631 666 HE21 GLN 77 1HE2 GLN 77 -6.116 6.015 15.784 667 HE22 GLN 77 2HE2 GLN 77 -6.323 7.714 15.539 668 H VAL 78 H VAL 78 -4.199 2.476 10.256 669 HA VAL 78 HA VAL 78 -1.709 3.992 9.750 670 HB VAL 78 HB VAL 78 -0.845 2.145 8.419 671 HG11 VAL 78 1HG1 VAL 78 -1.708 1.224 11.165 672 HG12 VAL 78 2HG1 VAL 78 -0.278 2.187 10.790 673 HG13 VAL 78 3HG1 VAL 78 -0.399 0.527 10.208 674 HG21 VAL 78 3HG2 VAL 78 -2.935 1.194 7.603 675 HG22 VAL 78 1HG2 VAL 78 -3.344 0.643 9.229 676 HG23 VAL 78 2HG2 VAL 78 -1.962 -0.054 8.383 677 H LEU 79 H LEU 79 -1.313 4.498 7.475 678 HA LEU 79 HA LEU 79 -3.816 4.955 6.012 679 HB2 LEU 79 2HB LEU 79 -2.319 6.871 6.429 680 HB3 LEU 79 3HB LEU 79 -1.045 6.068 5.533 681 HG LEU 79 HG LEU 79 -2.347 6.231 3.468 682 HD11 LEU 79 1HD1 LEU 79 -4.419 7.669 5.131 683 HD12 LEU 79 2HD1 LEU 79 -4.596 6.067 4.414 684 HD13 LEU 79 3HD1 LEU 79 -4.438 7.482 3.376 685 HD21 LEU 79 3HD2 LEU 79 -2.280 8.671 3.197 686 HD22 LEU 79 1HD2 LEU 79 -0.849 8.063 4.030 687 HD23 LEU 79 2HD2 LEU 79 -2.132 8.856 4.945 688 H ILE 80 H ILE 80 -4.265 4.075 4.039 689 HA ILE 80 HA ILE 80 -2.295 2.193 2.887 690 HB ILE 80 HB ILE 80 -5.287 1.758 3.122 691 HG12 ILE 80 2HG1 ILE 80 -3.007 0.358 4.556 692 HG13 ILE 80 3HG1 ILE 80 -4.095 1.534 5.285 693 HG21 ILE 80 1HG2 ILE 80 -4.359 0.764 1.089 694 HG22 ILE 80 2HG2 ILE 80 -4.839 -0.485 2.238 695 HG23 ILE 80 3HG2 ILE 80 -3.135 -0.072 2.045 696 HD11 ILE 80 3HD1 ILE 80 -4.882 -1.157 4.185 697 HD12 ILE 80 1HD1 ILE 80 -5.976 0.024 4.905 698 HD13 ILE 80 2HD1 ILE 80 -4.719 -0.726 5.888 699 H ILE 81 H ILE 81 -2.179 2.091 0.652 700 HA ILE 81 HA ILE 81 -4.034 3.779 -0.916 701 HB ILE 81 HB ILE 81 -1.076 3.372 -1.452 702 HG12 ILE 81 2HG1 ILE 81 -2.570 5.871 -0.593 703 HG13 ILE 81 3HG1 ILE 81 -1.537 4.900 0.451 704 HG21 ILE 81 1HG2 ILE 81 -1.365 4.957 -3.286 705 HG22 ILE 81 2HG2 ILE 81 -3.088 5.079 -2.932 706 HG23 ILE 81 3HG2 ILE 81 -2.412 3.556 -3.511 707 HD11 ILE 81 3HD1 ILE 81 -0.663 6.432 -1.987 708 HD12 ILE 81 1HD1 ILE 81 0.382 5.432 -0.977 709 HD13 ILE 81 2HD1 ILE 81 -0.376 6.875 -0.305 710 H ILE 82 H ILE 82 -5.143 2.638 -2.413 711 HA ILE 82 HA ILE 82 -4.147 -0.034 -3.186 712 HB ILE 82 HB ILE 82 -6.957 1.077 -3.445 713 HG12 ILE 82 2HG1 ILE 82 -5.836 -0.864 -1.396 714 HG13 ILE 82 3HG1 ILE 82 -6.251 0.816 -1.080 715 HG21 ILE 82 1HG2 ILE 82 -5.873 -1.720 -3.829 716 HG22 ILE 82 2HG2 ILE 82 -6.515 -0.654 -5.081 717 HG23 ILE 82 3HG2 ILE 82 -7.583 -1.286 -3.829 718 HD11 ILE 82 3HD1 ILE 82 -8.189 -1.323 -1.933 719 HD12 ILE 82 1HD1 ILE 82 -8.586 0.349 -1.534 720 HD13 ILE 82 2HD1 ILE 82 -7.963 -0.734 -0.287 721 H TYR 83 H TYR 83 -3.786 -0.559 -5.320 722 HA TYR 83 HA TYR 83 -4.452 1.460 -7.367 723 HB2 TYR 83 2HB TYR 83 -2.112 1.791 -6.892 724 HB3 TYR 83 3HB TYR 83 -1.788 0.066 -7.031 725 HD1 TYR 83 HD2 TYR 83 -2.822 3.066 -8.983 726 HD2 TYR 83 HD1 TYR 83 -1.276 -0.902 -9.138 727 HE1 TYR 83 HE2 TYR 83 -2.337 3.350 -11.377 728 HE2 TYR 83 HE1 TYR 83 -0.799 -0.625 -11.530 729 HH TYR 83 HH TYR 83 -0.859 2.382 -13.088 730 H ASP 84 H ASP 84 -5.923 0.494 -8.592 731 HA ASP 84 HA ASP 84 -5.194 -2.060 -9.896 732 HB2 ASP 84 2HB ASP 84 -7.940 -1.009 -9.180 733 HB3 ASP 84 3HB ASP 84 -7.678 -2.349 -10.288 734 H GLN 85 H GLN 85 -5.316 -2.126 -12.127 735 HA GLN 85 HA GLN 85 -5.747 0.298 -13.615 736 HB2 GLN 85 2HB GLN 85 -5.546 -2.565 -14.587 737 HB3 GLN 85 3HB GLN 85 -5.504 -1.140 -15.616 738 HG2 GLN 85 2HG GLN 85 -3.272 -1.489 -15.463 739 HG3 GLN 85 3HG GLN 85 -3.464 -0.530 -13.997 740 HE21 GLN 85 1HE2 GLN 85 -1.457 -2.526 -14.666 741 HE22 GLN 85 2HE2 GLN 85 -1.546 -3.732 -13.438 742 H ASP 86 H ASP 86 -7.701 -2.249 -12.444 743 HA ASP 86 HA ASP 86 -10.011 -1.394 -14.071 744 HB2 ASP 86 2HB ASP 86 -9.455 -3.998 -12.626 745 HB3 ASP 86 3HB ASP 86 -10.996 -3.601 -13.379 746 H GLN 87 H GLN 87 -11.276 0.015 -12.978 747 HA GLN 87 HA GLN 87 -11.039 0.462 -10.202 748 HB2 GLN 87 2HB GLN 87 -13.192 1.389 -12.113 749 HB3 GLN 87 3HB GLN 87 -12.977 1.990 -10.472 750 HG2 GLN 87 2HG GLN 87 -10.661 2.700 -11.130 751 HG3 GLN 87 3HG GLN 87 -11.076 2.283 -12.791 752 HE21 GLN 87 1HE2 GLN 87 -12.598 3.559 -13.889 753 HE22 GLN 87 2HE2 GLN 87 -13.012 5.143 -13.340 754 H ASN 88 H ASN 88 -12.938 -1.865 -11.878 755 HA ASN 88 HA ASN 88 -15.083 -2.239 -10.118 756 HB2 ASN 88 2HB ASN 88 -14.802 -3.423 -12.300 757 HB3 ASN 88 3HB ASN 88 -13.545 -4.415 -11.572 758 HD21 ASN 88 1HD2 ASN 88 -16.001 -5.298 -12.760 759 HD22 ASN 88 2HD2 ASN 88 -16.886 -6.125 -11.528 760 H ARG 89 H ARG 89 -11.902 -3.901 -10.062 761 HA ARG 89 HA ARG 89 -12.375 -5.091 -7.499 762 HB2 ARG 89 2HB ARG 89 -9.846 -4.808 -9.142 763 HB3 ARG 89 3HB ARG 89 -9.901 -5.640 -7.594 764 HG2 ARG 89 2HG ARG 89 -10.037 -7.317 -9.249 765 HG3 ARG 89 3HG ARG 89 -11.664 -7.149 -8.587 766 HD2 ARG 89 2HD ARG 89 -12.226 -5.672 -10.521 767 HD3 ARG 89 3HD ARG 89 -10.637 -6.028 -11.198 768 HE ARG 89 HE ARG 89 -12.597 -8.161 -10.658 769 HH11 ARG 89 1HH1 ARG 89 -10.368 -6.597 -12.765 770 HH12 ARG 89 2HH1 ARG 89 -10.687 -7.670 -14.082 771 HH21 ARG 89 1HH2 ARG 89 -12.978 -9.558 -12.341 772 HH22 ARG 89 2HH2 ARG 89 -12.147 -9.337 -13.843 773 H LEU 90 H LEU 90 -10.610 -2.241 -8.627 774 HA LEU 90 HA LEU 90 -9.393 -1.317 -6.349 775 HB2 LEU 90 2HB LEU 90 -9.361 -0.190 -8.562 776 HB3 LEU 90 3HB LEU 90 -11.007 0.345 -8.296 777 HG LEU 90 HG LEU 90 -10.203 1.651 -6.315 778 HD11 LEU 90 1HD1 LEU 90 -8.194 0.416 -5.791 779 HD12 LEU 90 2HD1 LEU 90 -7.781 2.093 -6.141 780 HD13 LEU 90 3HD1 LEU 90 -7.485 0.842 -7.348 781 HD21 LEU 90 3HD2 LEU 90 -8.915 2.326 -8.964 782 HD22 LEU 90 1HD2 LEU 90 -9.184 3.449 -7.631 783 HD23 LEU 90 2HD2 LEU 90 -10.559 2.735 -8.473 784 H GLU 91 H GLU 91 -12.782 -0.702 -7.289 785 HA GLU 91 HA GLU 91 -13.451 0.598 -4.854 786 HB2 GLU 91 2HB GLU 91 -15.027 -0.411 -7.192 787 HB3 GLU 91 3HB GLU 91 -15.874 0.058 -5.723 788 HG2 GLU 91 2HG GLU 91 -13.961 1.851 -7.211 789 HG3 GLU 91 3HG GLU 91 -15.709 1.851 -7.442 790 H GLU 92 H GLU 92 -13.876 -2.769 -5.958 791 HA GLU 92 HA GLU 92 -15.456 -3.708 -3.864 792 HB2 GLU 92 2HB GLU 92 -14.865 -5.079 -5.820 793 HB3 GLU 92 3HB GLU 92 -13.200 -5.175 -5.257 794 HG2 GLU 92 2HG GLU 92 -14.003 -6.328 -3.213 795 HG3 GLU 92 3HG GLU 92 -15.633 -6.311 -3.882 796 H PHE 93 H PHE 93 -11.894 -3.642 -4.037 797 HA PHE 93 HA PHE 93 -11.544 -4.505 -1.333 798 HB2 PHE 93 2HB PHE 93 -9.896 -4.823 -3.221 799 HB3 PHE 93 3HB PHE 93 -9.521 -3.109 -3.103 800 HD1 PHE 93 HD1 PHE 93 -10.121 -5.556 -0.355 801 HD2 PHE 93 HD2 PHE 93 -7.301 -3.085 -2.383 802 HE1 PHE 93 HE1 PHE 93 -8.432 -6.075 1.358 803 HE2 PHE 93 HE2 PHE 93 -5.615 -3.597 -0.670 804 HZ PHE 93 HZ PHE 93 -6.178 -5.093 1.201 805 H SER 94 H SER 94 -11.613 -1.351 -2.939 806 HA SER 94 HA SER 94 -10.865 0.314 -0.817 807 HB2 SER 94 2HB SER 94 -11.189 1.207 -3.061 808 HB3 SER 94 3HB SER 94 -12.906 0.812 -3.006 809 HG SER 94 HG SER 94 -11.932 3.073 -2.400 810 H ARG 95 H ARG 95 -14.072 -0.999 -1.622 811 HA ARG 95 HA ARG 95 -15.563 0.192 0.426 812 HB2 ARG 95 2HB ARG 95 -15.886 -2.152 -1.345 813 HB3 ARG 95 3HB ARG 95 -16.753 -2.274 0.174 814 HG2 ARG 95 2HG ARG 95 -18.347 -1.338 -1.167 815 HG3 ARG 95 3HG ARG 95 -17.635 0.103 -0.450 816 HD2 ARG 95 2HD ARG 95 -16.827 -1.008 -3.137 817 HD3 ARG 95 3HD ARG 95 -18.072 0.219 -2.926 818 HE ARG 95 HE ARG 95 -15.264 0.620 -2.925 819 HH11 ARG 95 1HH1 ARG 95 -18.149 1.739 -1.428 820 HH12 ARG 95 2HH1 ARG 95 -17.565 3.354 -1.252 821 HH21 ARG 95 1HH2 ARG 95 -14.545 2.727 -2.763 822 HH22 ARG 95 2HH2 ARG 95 -15.557 3.909 -1.999 823 H GLU 96 H GLU 96 -13.756 -2.868 0.382 824 HA GLU 96 HA GLU 96 -14.399 -3.746 2.955 825 HB2 GLU 96 2HB GLU 96 -12.010 -4.263 1.191 826 HB3 GLU 96 3HB GLU 96 -12.150 -4.990 2.787 827 HG2 GLU 96 2HG GLU 96 -14.055 -5.348 0.481 828 HG3 GLU 96 3HG GLU 96 -12.913 -6.540 1.105 829 H VAL 97 H VAL 97 -11.405 -2.036 1.956 830 HA VAL 97 HA VAL 97 -10.306 -1.805 4.509 831 HB VAL 97 HB VAL 97 -9.978 0.178 2.246 832 HG11 VAL 97 1HG1 VAL 97 -7.785 0.620 3.299 833 HG12 VAL 97 2HG1 VAL 97 -8.234 -0.449 4.631 834 HG13 VAL 97 3HG1 VAL 97 -9.137 1.040 4.350 835 HG21 VAL 97 3HG2 VAL 97 -9.506 -2.101 1.492 836 HG22 VAL 97 1HG2 VAL 97 -8.409 -2.336 2.854 837 HG23 VAL 97 2HG2 VAL 97 -8.019 -1.159 1.600 838 H ARG 98 H ARG 98 -12.368 0.546 2.773 839 HA ARG 98 HA ARG 98 -12.574 2.484 4.787 840 HB2 ARG 98 2HB ARG 98 -14.352 1.668 2.505 841 HB3 ARG 98 3HB ARG 98 -14.926 2.857 3.664 842 HG2 ARG 98 2HG ARG 98 -13.130 4.352 3.122 843 HG3 ARG 98 3HG ARG 98 -12.356 3.133 2.109 844 HD2 ARG 98 2HD ARG 98 -14.003 3.300 0.445 845 HD3 ARG 98 3HD ARG 98 -15.147 4.089 1.527 846 HE ARG 98 HE ARG 98 -13.571 6.045 1.432 847 HH11 ARG 98 1HH1 ARG 98 -13.587 3.747 -1.126 848 HH12 ARG 98 2HH1 ARG 98 -13.240 4.933 -2.338 849 HH21 ARG 98 1HH2 ARG 98 -13.116 7.565 -0.144 850 HH22 ARG 98 2HH2 ARG 98 -12.999 7.060 -1.795 851 H ARG 99 H ARG 99 -14.514 -0.439 4.243 852 HA ARG 99 HA ARG 99 -16.413 0.059 6.293 853 HB2 ARG 99 2HB ARG 99 -16.886 -1.424 4.406 854 HB3 ARG 99 3HB ARG 99 -15.633 -2.535 4.929 855 HG2 ARG 99 2HG ARG 99 -17.729 -1.970 6.931 856 HG3 ARG 99 3HG ARG 99 -18.273 -2.817 5.484 857 HD2 ARG 99 2HD ARG 99 -15.953 -3.697 7.211 858 HD3 ARG 99 3HD ARG 99 -17.596 -4.323 7.355 859 HE ARG 99 HE ARG 99 -16.048 -4.590 4.856 860 HH11 ARG 99 1HH1 ARG 99 -17.926 -5.981 7.393 861 HH12 ARG 99 2HH1 ARG 99 -18.018 -7.523 6.624 862 HH21 ARG 99 1HH2 ARG 99 -16.146 -6.595 3.896 863 HH22 ARG 99 2HH2 ARG 99 -17.015 -7.869 4.677 864 H ARG 100 H ARG 100 -13.305 -1.608 6.278 865 HA ARG 100 HA ARG 100 -13.708 -2.756 8.909 866 HB2 ARG 100 2HB ARG 100 -11.173 -2.666 7.257 867 HB3 ARG 100 3HB ARG 100 -11.492 -3.709 8.642 868 HG2 ARG 100 2HG ARG 100 -13.342 -4.763 7.360 869 HG3 ARG 100 3HG ARG 100 -12.884 -3.772 5.975 870 HD2 ARG 100 2HD ARG 100 -10.651 -4.825 5.990 871 HD3 ARG 100 3HD ARG 100 -11.165 -5.851 7.333 872 HE ARG 100 HE ARG 100 -12.840 -6.000 4.973 873 HH11 ARG 100 1HH1 ARG 100 -10.155 -7.346 6.660 874 HH12 ARG 100 2HH1 ARG 100 -10.255 -8.855 5.828 875 HH21 ARG 100 1HH2 ARG 100 -12.957 -7.923 3.920 876 HH22 ARG 100 2HH2 ARG 100 -11.815 -9.175 4.278 877 H GLY 101 H GLY 101 -13.012 0.316 7.950 878 HA2 GLY 101 2HA GLY 101 -12.688 2.108 9.400 879 HA3 GLY 101 3HA GLY 101 -12.212 0.981 10.657 880 H PHE 102 H PHE 102 -10.660 0.939 7.501 881 HA PHE 102 HA PHE 102 -8.287 2.223 8.716 882 HB2 PHE 102 2HB PHE 102 -8.526 0.138 6.554 883 HB3 PHE 102 3HB PHE 102 -7.061 1.091 6.748 884 HD1 PHE 102 HD1 PHE 102 -5.772 0.947 8.882 885 HD2 PHE 102 HD2 PHE 102 -8.991 -1.704 7.990 886 HE1 PHE 102 HE1 PHE 102 -4.951 -0.618 10.592 887 HE2 PHE 102 HE2 PHE 102 -8.173 -3.270 9.708 888 HZ PHE 102 HZ PHE 102 -6.147 -2.728 11.007 889 H GLU 103 H GLU 103 -7.237 3.886 7.686 890 HA GLU 103 HA GLU 103 -8.761 5.496 5.863 891 HB2 GLU 103 2HB GLU 103 -5.925 5.806 6.893 892 HB3 GLU 103 3HB GLU 103 -6.823 7.040 6.017 893 HG2 GLU 103 2HG GLU 103 -8.441 7.196 7.812 894 HG3 GLU 103 3HG GLU 103 -7.655 5.873 8.675 895 H VAL 104 H VAL 104 -8.774 5.284 3.688 896 HA VAL 104 HA VAL 104 -6.414 4.101 2.374 897 HB VAL 104 HB VAL 104 -8.087 2.355 2.608 898 HG11 VAL 104 1HG1 VAL 104 -9.933 4.164 1.043 899 HG12 VAL 104 2HG1 VAL 104 -10.095 3.742 2.748 900 HG13 VAL 104 3HG1 VAL 104 -10.269 2.496 1.512 901 HG21 VAL 104 3HG2 VAL 104 -7.841 3.337 -0.241 902 HG22 VAL 104 1HG2 VAL 104 -8.291 1.702 0.246 903 HG23 VAL 104 2HG2 VAL 104 -6.683 2.320 0.619 904 H ARG 105 H ARG 105 -5.729 5.041 0.567 905 HA ARG 105 HA ARG 105 -7.449 6.967 -0.868 906 HB2 ARG 105 2HB ARG 105 -4.437 6.655 -1.072 907 HB3 ARG 105 3HB ARG 105 -5.413 7.933 -1.776 908 HG2 ARG 105 2HG ARG 105 -5.056 7.489 1.188 909 HG3 ARG 105 3HG ARG 105 -4.109 8.615 0.220 910 HD2 ARG 105 2HD ARG 105 -5.748 9.956 1.202 911 HD3 ARG 105 3HD ARG 105 -6.362 9.666 -0.423 912 HE ARG 105 HE ARG 105 -7.745 7.860 0.687 913 HH11 ARG 105 1HH1 ARG 105 -6.764 10.725 2.352 914 HH12 ARG 105 2HH1 ARG 105 -8.087 10.643 3.466 915 HH21 ARG 105 1HH2 ARG 105 -9.401 7.765 2.124 916 HH22 ARG 105 2HH2 ARG 105 -9.555 8.977 3.349 917 H THR 106 H THR 106 -7.933 6.546 -3.037 918 HA THR 106 HA THR 106 -6.832 4.036 -4.156 919 HB THR 106 HB THR 106 -8.865 4.004 -5.630 920 HG1 THR 106 HG1 THR 106 -9.481 6.201 -5.483 921 HG21 THR 106 3HG2 THR 106 -9.319 3.962 -2.641 922 HG22 THR 106 1HG2 THR 106 -8.795 2.613 -3.649 923 HG23 THR 106 2HG2 THR 106 -10.420 3.275 -3.837 924 H VAL 107 H VAL 107 -5.363 4.296 -5.700 925 HA VAL 107 HA VAL 107 -5.493 6.701 -7.418 926 HB VAL 107 HB VAL 107 -3.069 6.396 -7.821 927 HG11 VAL 107 1HG1 VAL 107 -3.844 6.619 -4.906 928 HG12 VAL 107 2HG1 VAL 107 -3.793 7.931 -6.084 929 HG13 VAL 107 3HG1 VAL 107 -2.301 7.130 -5.595 930 HG21 VAL 107 3HG2 VAL 107 -3.265 4.219 -5.726 931 HG22 VAL 107 1HG2 VAL 107 -1.770 4.854 -6.416 932 HG23 VAL 107 2HG2 VAL 107 -2.913 3.983 -7.438 933 H THR 108 H THR 108 -5.263 6.492 -9.647 934 HA THR 108 HA THR 108 -5.494 3.725 -10.683 935 HB THR 108 HB THR 108 -6.937 4.651 -12.505 936 HG1 THR 108 HG1 THR 108 -7.681 6.727 -12.372 937 HG21 THR 108 3HG2 THR 108 -7.968 5.079 -9.691 938 HG22 THR 108 1HG2 THR 108 -7.951 3.547 -10.565 939 HG23 THR 108 2HG2 THR 108 -8.964 4.875 -11.132 940 H SER 109 H SER 109 -3.368 6.158 -10.607 941 HA SER 109 HA SER 109 -2.045 5.258 -13.025 942 HB2 SER 109 2HB SER 109 -2.869 8.155 -12.690 943 HB3 SER 109 3HB SER 109 -1.640 7.620 -13.832 944 HG SER 109 HG SER 109 -3.912 6.154 -14.078 945 HA PRO 110 HA PRO 110 1.622 5.749 -10.549 946 HB2 PRO 110 2HB PRO 110 2.932 6.737 -13.044 947 HB3 PRO 110 3HB PRO 110 3.404 5.413 -11.972 948 HG2 PRO 110 2HG PRO 110 2.299 4.899 -14.338 949 HG3 PRO 110 3HG PRO 110 1.879 3.928 -12.913 950 HD2 PRO 110 2HD PRO 110 0.321 6.115 -14.246 951 HD3 PRO 110 3HD PRO 110 -0.253 4.584 -13.549 952 H ASP 111 H ASP 111 1.275 8.388 -12.963 953 HA ASP 111 HA ASP 111 2.615 10.340 -11.411 954 HB2 ASP 111 2HB ASP 111 2.206 10.387 -13.917 955 HB3 ASP 111 3HB ASP 111 0.552 10.877 -13.562 956 H ASP 112 H ASP 112 -0.789 9.433 -11.696 957 HA ASP 112 HA ASP 112 -1.970 11.392 -10.096 958 HB2 ASP 112 2HB ASP 112 -3.274 9.784 -11.389 959 HB3 ASP 112 3HB ASP 112 -2.672 8.458 -10.406 960 H PHE 113 H PHE 113 -0.598 8.247 -9.159 961 HA PHE 113 HA PHE 113 -0.863 8.476 -6.383 962 HB2 PHE 113 2HB PHE 113 -0.288 6.353 -7.279 963 HB3 PHE 113 3HB PHE 113 1.104 7.001 -8.137 964 HD1 PHE 113 HD1 PHE 113 -0.205 6.215 -4.751 965 HD2 PHE 113 HD2 PHE 113 3.232 7.052 -7.132 966 HE1 PHE 113 HE1 PHE 113 1.256 5.589 -2.871 967 HE2 PHE 113 HE2 PHE 113 4.688 6.424 -5.255 968 HZ PHE 113 HZ PHE 113 3.702 5.693 -3.123 969 H LYS 114 H LYS 114 1.792 9.486 -8.506 970 HA LYS 114 HA LYS 114 3.684 10.318 -6.680 971 HB2 LYS 114 2HB LYS 114 4.001 10.235 -9.128 972 HB3 LYS 114 3HB LYS 114 2.964 11.643 -9.306 973 HG2 LYS 114 2HG LYS 114 4.615 12.918 -7.899 974 HG3 LYS 114 3HG LYS 114 5.684 11.517 -8.009 975 HD2 LYS 114 2HD LYS 114 4.639 13.189 -10.302 976 HD3 LYS 114 3HD LYS 114 6.298 13.136 -9.704 977 HE2 LYS 114 2HE LYS 114 6.490 10.806 -10.390 978 HE3 LYS 114 3HE LYS 114 4.809 10.805 -10.922 979 HZ1 LYS 114 3HZ LYS 114 6.992 12.461 -12.063 980 HZ2 LYS 114 1HZ LYS 114 5.372 12.502 -12.554 981 HZ3 LYS 114 2HZ LYS 114 6.289 11.101 -12.785 982 H LYS 115 H LYS 115 1.295 12.468 -8.237 983 HA LYS 115 HA LYS 115 1.939 14.711 -6.639 984 HB2 LYS 115 2HB LYS 115 -0.476 14.121 -8.361 985 HB3 LYS 115 3HB LYS 115 -0.162 15.684 -7.611 986 HG2 LYS 115 2HG LYS 115 1.918 15.898 -8.844 987 HG3 LYS 115 3HG LYS 115 1.693 14.299 -9.548 988 HD2 LYS 115 2HD LYS 115 -0.214 16.608 -9.947 989 HD3 LYS 115 3HD LYS 115 1.096 16.204 -11.058 990 HE2 LYS 115 2HE LYS 115 0.068 13.909 -11.265 991 HE3 LYS 115 3HE LYS 115 -1.316 14.526 -10.362 992 HZ1 LYS 115 3HZ LYS 115 -0.320 15.606 -12.944 993 HZ2 LYS 115 1HZ LYS 115 -1.661 16.179 -12.085 994 HZ3 LYS 115 2HZ LYS 115 -1.683 14.623 -12.751 995 H SER 116 H SER 116 -0.614 12.256 -6.333 996 HA SER 116 HA SER 116 -1.981 13.401 -4.147 997 HB2 SER 116 2HB SER 116 -1.616 10.459 -4.810 998 HB3 SER 116 3HB SER 116 -2.813 11.113 -3.693 999 HG SER 116 HG SER 116 -3.062 10.785 -6.298 1000 H LEU 117 H LEU 117 0.857 11.296 -4.288 1001 HA LEU 117 HA LEU 117 1.083 10.702 -1.553 1002 HB2 LEU 117 2HB LEU 117 2.291 9.573 -3.451 1003 HB3 LEU 117 3HB LEU 117 3.353 10.966 -3.533 1004 HG LEU 117 HG LEU 117 4.063 10.495 -1.175 1005 HD11 LEU 117 1HD1 LEU 117 2.115 9.241 -0.425 1006 HD12 LEU 117 2HD1 LEU 117 3.583 8.285 -0.224 1007 HD13 LEU 117 3HD1 LEU 117 2.484 7.944 -1.564 1008 HD21 LEU 117 3HD2 LEU 117 5.511 8.611 -1.746 1009 HD22 LEU 117 1HD2 LEU 117 5.417 9.765 -3.077 1010 HD23 LEU 117 2HD2 LEU 117 4.508 8.253 -3.152 1011 H GLU 118 H GLU 118 2.281 13.471 -3.421 1012 HA GLU 118 HA GLU 118 4.032 14.665 -1.657 1013 HB2 GLU 118 2HB GLU 118 1.949 16.044 -3.370 1014 HB3 GLU 118 3HB GLU 118 3.303 16.858 -2.601 1015 HG2 GLU 118 2HG GLU 118 4.856 15.485 -3.938 1016 HG3 GLU 118 3HG GLU 118 3.473 14.740 -4.742 1017 H ARG 119 H ARG 119 0.503 14.714 -1.545 1018 HA ARG 119 HA ARG 119 0.404 16.551 0.691 1019 HB2 ARG 119 2HB ARG 119 -1.742 14.899 -0.669 1020 HB3 ARG 119 3HB ARG 119 -2.058 15.992 0.668 1021 HG2 ARG 119 2HG ARG 119 -2.656 17.132 -1.323 1022 HG3 ARG 119 3HG ARG 119 -1.154 17.857 -0.753 1023 HD2 ARG 119 2HD ARG 119 0.112 16.592 -2.402 1024 HD3 ARG 119 3HD ARG 119 -1.355 15.764 -2.928 1025 HE ARG 119 HE ARG 119 -2.006 18.326 -3.329 1026 HH11 ARG 119 1HH1 ARG 119 0.774 16.517 -4.246 1027 HH12 ARG 119 2HH1 ARG 119 1.100 17.501 -5.627 1028 HH21 ARG 119 1HH2 ARG 119 -1.617 19.550 -5.130 1029 HH22 ARG 119 2HH2 ARG 119 -0.248 19.192 -6.134 1030 H LEU 120 H LEU 120 -0.189 13.088 0.170 1031 HA LEU 120 HA LEU 120 -0.997 12.339 2.718 1032 HB2 LEU 120 2HB LEU 120 0.667 10.747 0.759 1033 HB3 LEU 120 3HB LEU 120 -0.220 10.075 2.115 1034 HG LEU 120 HG LEU 120 -1.476 11.498 -0.242 1035 HD11 LEU 120 1HD1 LEU 120 -0.505 9.375 -0.921 1036 HD12 LEU 120 2HD1 LEU 120 -2.265 9.278 -0.913 1037 HD13 LEU 120 3HD1 LEU 120 -1.337 8.550 0.400 1038 HD21 LEU 120 3HD2 LEU 120 -3.589 10.618 0.665 1039 HD22 LEU 120 1HD2 LEU 120 -2.804 11.742 1.772 1040 HD23 LEU 120 2HD2 LEU 120 -2.719 10.007 2.073 1041 H ILE 121 H ILE 121 2.296 12.667 1.440 1042 HA ILE 121 HA ILE 121 3.750 11.624 3.573 1043 HB ILE 121 HB ILE 121 4.469 13.888 1.697 1044 HG12 ILE 121 2HG1 ILE 121 5.242 10.953 1.717 1045 HG13 ILE 121 3HG1 ILE 121 4.073 11.695 0.631 1046 HG21 ILE 121 1HG2 ILE 121 6.255 12.397 3.629 1047 HG22 ILE 121 2HG2 ILE 121 5.836 14.109 3.686 1048 HG23 ILE 121 3HG2 ILE 121 6.820 13.488 2.364 1049 HD11 ILE 121 3HD1 ILE 121 7.022 12.291 0.738 1050 HD12 ILE 121 1HD1 ILE 121 5.855 13.067 -0.333 1051 HD13 ILE 121 2HD1 ILE 121 6.183 11.341 -0.488 1052 H ARG 122 H ARG 122 2.338 14.841 3.198 1053 HA ARG 122 HA ARG 122 3.590 15.905 5.565 1054 HB2 ARG 122 2HB ARG 122 1.320 16.983 3.880 1055 HB3 ARG 122 3HB ARG 122 2.141 17.870 5.160 1056 HG2 ARG 122 2HG ARG 122 4.238 17.754 3.919 1057 HG3 ARG 122 3HG ARG 122 3.443 16.824 2.647 1058 HD2 ARG 122 2HD ARG 122 1.959 18.718 2.189 1059 HD3 ARG 122 3HD ARG 122 2.748 19.648 3.466 1060 HE ARG 122 HE ARG 122 4.762 18.882 1.755 1061 HH11 ARG 122 1HH1 ARG 122 1.847 20.695 1.480 1062 HH12 ARG 122 2HH1 ARG 122 2.463 21.697 0.212 1063 HH21 ARG 122 1HH2 ARG 122 5.543 20.160 0.131 1064 HH22 ARG 122 2HH2 ARG 122 4.534 21.386 -0.557 1065 H GLU 123 H GLU 123 0.599 14.267 4.849 1066 HA GLU 123 HA GLU 123 -0.737 14.953 7.285 1067 HB2 GLU 123 2HB GLU 123 -1.210 12.671 5.350 1068 HB3 GLU 123 3HB GLU 123 -2.281 13.097 6.679 1069 HG2 GLU 123 2HG GLU 123 -2.650 15.306 5.658 1070 HG3 GLU 123 3HG GLU 123 -1.610 14.845 4.311 1071 H VAL 124 H VAL 124 1.050 12.055 6.205 1072 HA VAL 124 HA VAL 124 0.853 10.852 8.848 1073 HB VAL 124 HB VAL 124 0.649 9.473 6.797 1074 HG11 VAL 124 1HG1 VAL 124 2.298 10.635 5.401 1075 HG12 VAL 124 2HG1 VAL 124 2.614 8.902 5.474 1076 HG13 VAL 124 3HG1 VAL 124 3.598 10.019 6.423 1077 HG21 VAL 124 3HG2 VAL 124 2.087 7.624 7.546 1078 HG22 VAL 124 1HG2 VAL 124 1.270 8.413 8.895 1079 HG23 VAL 124 2HG2 VAL 124 2.973 8.743 8.582 1080 H GLY 125 H GLY 125 3.220 12.634 6.994 1081 HA2 GLY 125 2HA GLY 125 5.219 12.191 9.139 1082 HA3 GLY 125 3HA GLY 125 5.654 12.372 7.448 1083 H SER 126 H SER 126 6.353 13.925 9.927 1084 HA SER 126 HA SER 126 6.149 16.556 8.755 1085 HB2 SER 126 2HB SER 126 4.888 16.061 11.475 1086 HB3 SER 126 3HB SER 126 5.091 17.634 10.705 1087 HG SER 126 HG SER 126 3.816 16.367 8.914 1088 H LEU 127 H LEU 127 7.241 18.207 10.311 1089 HA LEU 127 HA LEU 127 9.851 17.398 10.868 1090 HB2 LEU 127 2HB LEU 127 9.251 19.731 10.529 1091 HB3 LEU 127 3HB LEU 127 8.282 19.726 11.992 1092 HG LEU 127 HG LEU 127 10.333 19.380 13.335 1093 HD11 LEU 127 1HD1 LEU 127 12.532 19.677 12.278 1094 HD12 LEU 127 2HD1 LEU 127 11.763 19.683 10.691 1095 HD13 LEU 127 3HD1 LEU 127 11.708 18.233 11.693 1096 HD21 LEU 127 3HD2 LEU 127 10.429 21.768 11.487 1097 HD22 LEU 127 1HD2 LEU 127 11.250 21.633 13.044 1098 HD23 LEU 127 2HD2 LEU 127 9.488 21.638 12.975 1099 H GLU 128 H GLU 128 7.112 17.797 13.102 1100 HA GLU 128 HA GLU 128 8.233 15.752 14.838 1101 HB2 GLU 128 2HB GLU 128 9.272 17.753 15.761 1102 HB3 GLU 128 3HB GLU 128 7.713 18.565 15.840 1103 HG2 GLU 128 2HG GLU 128 6.970 16.788 17.455 1104 HG3 GLU 128 3HG GLU 128 8.629 16.195 17.466 1105 H HIS 129 H HIS 129 6.477 14.386 14.853 1106 HA HIS 129 HA HIS 129 3.790 15.226 15.228 1107 HB2 HIS 129 2HB HIS 129 5.188 12.614 15.843 1108 HB3 HIS 129 3HB HIS 129 3.477 12.861 16.180 1109 HD1 HIS 129 HD1 HIS 129 1.890 13.141 14.094 1110 HD2 HIS 129 HD2 HIS 129 5.822 12.137 13.183 1111 HE1 HIS 129 HE1 HIS 129 1.855 12.388 11.705 1112 HE2 HIS 129 HE2 HIS 129 4.205 11.655 11.215 1113 H HIS 130 H HIS 130 3.379 16.608 16.809 1114 HA HIS 130 HA HIS 130 5.023 17.351 18.825 1115 HB2 HIS 130 2HB HIS 130 2.008 17.530 18.903 1116 HB3 HIS 130 3HB HIS 130 3.128 18.526 19.830 1117 HD1 HIS 130 HD1 HIS 130 1.543 18.210 16.510 1118 HD2 HIS 130 HD2 HIS 130 4.614 20.415 18.236 1119 HE1 HIS 130 HE1 HIS 130 2.036 20.060 14.891 1120 HE2 HIS 130 HE2 HIS 130 3.940 21.337 15.912 1121 H HIS 131 H HIS 131 1.992 15.653 19.744 1122 HA HIS 131 HA HIS 131 3.544 14.335 21.886 1123 HB2 HIS 131 2HB HIS 131 2.227 16.280 22.757 1124 HB3 HIS 131 3HB HIS 131 0.756 15.468 22.234 1125 HD1 HIS 131 HD1 HIS 131 -0.151 13.607 23.732 1126 HD2 HIS 131 HD2 HIS 131 3.544 15.053 24.962 1127 HE1 HIS 131 HE1 HIS 131 0.243 12.600 25.994 1128 HE2 HIS 131 HE2 HIS 131 2.558 13.346 26.638 1129 H HIS 132 H HIS 132 2.836 12.293 22.562 1130 HA HIS 132 HA HIS 132 1.585 10.667 20.604 1131 HB2 HIS 132 2HB HIS 132 2.461 10.196 23.443 1132 HB3 HIS 132 3HB HIS 132 1.537 8.971 22.583 1133 HD1 HIS 132 HD1 HIS 132 2.778 7.499 20.975 1134 HD2 HIS 132 HD2 HIS 132 5.060 10.726 22.272 1135 HE1 HIS 132 HE1 HIS 132 5.109 7.054 20.155 1136 HE2 HIS 132 HE2 HIS 132 6.469 9.014 20.942 1137 H HIS 133 H HIS 133 -0.530 11.259 20.143 1138 HA HIS 133 HA HIS 133 -2.607 11.461 22.050 1139 HB2 HIS 133 2HB HIS 133 -2.628 10.581 19.150 1140 HB3 HIS 133 3HB HIS 133 -4.095 10.766 20.106 1141 HD1 HIS 133 HD1 HIS 133 -1.726 12.669 18.047 1142 HD2 HIS 133 HD2 HIS 133 -4.556 13.497 20.978 1143 HE1 HIS 133 HE1 HIS 133 -2.153 15.129 17.894 1144 HE2 HIS 133 HE2 HIS 133 -3.971 15.577 19.564 1145 H HIS 134 H HIS 134 -1.254 8.715 20.286 1146 HA HIS 134 HA HIS 134 -1.460 7.053 22.572 1147 HB2 HIS 134 2HB HIS 134 -2.880 5.261 21.566 1148 HB3 HIS 134 3HB HIS 134 -3.763 6.743 21.906 1149 HD1 HIS 134 HD1 HIS 134 -2.434 4.697 19.049 1150 HD2 HIS 134 HD2 HIS 134 -4.922 7.960 19.692 1151 HE1 HIS 134 HE1 HIS 134 -3.563 5.122 16.851 1152 HE2 HIS 134 HE2 HIS 134 -5.233 6.934 17.338 Start of MODEL 14 1 H1 MET 1 1H MET 1 7.172 3.814 7.874 2 H2 MET 1 2H MET 1 7.439 2.905 9.271 3 H3 MET 1 3H MET 1 7.883 4.532 9.235 4 HA MET 1 HA MET 1 5.867 4.232 10.500 5 HB2 MET 1 2HB MET 1 5.515 5.640 7.842 6 HB3 MET 1 3HB MET 1 4.411 5.822 9.200 7 HG2 MET 1 2HG MET 1 7.320 6.605 9.113 8 HG3 MET 1 3HG MET 1 5.923 7.684 9.151 9 HE1 MET 1 3HE MET 1 6.998 9.002 11.219 10 HE2 MET 1 1HE MET 1 8.393 7.924 11.151 11 HE3 MET 1 2HE MET 1 7.565 8.199 12.684 12 H ASN 2 H ASN 2 3.630 3.619 10.586 13 HA ASN 2 HA ASN 2 3.018 1.266 9.062 14 HB2 ASN 2 2HB ASN 2 1.277 2.822 10.994 15 HB3 ASN 2 3HB ASN 2 0.930 1.214 10.365 16 HD21 ASN 2 1HD2 ASN 2 2.134 -0.539 11.116 17 HD22 ASN 2 2HD2 ASN 2 3.096 -0.438 12.544 18 H ILE 3 H ILE 3 3.031 2.116 6.932 19 HA ILE 3 HA ILE 3 0.397 3.091 6.108 20 HB ILE 3 HB ILE 3 1.631 5.141 6.100 21 HG12 ILE 3 2HG1 ILE 3 1.581 4.040 3.271 22 HG13 ILE 3 3HG1 ILE 3 0.217 4.764 4.116 23 HG21 ILE 3 1HG2 ILE 3 3.807 3.744 4.537 24 HG22 ILE 3 2HG2 ILE 3 3.889 4.206 6.238 25 HG23 ILE 3 3HG2 ILE 3 3.782 5.448 4.992 26 HD11 ILE 3 3HD1 ILE 3 1.387 6.902 4.178 27 HD12 ILE 3 1HD1 ILE 3 1.213 6.307 2.528 28 HD13 ILE 3 2HD1 ILE 3 2.766 6.176 3.351 29 H VAL 4 H VAL 4 -0.372 1.690 4.628 30 HA VAL 4 HA VAL 4 1.575 -0.104 3.322 31 HB VAL 4 HB VAL 4 -1.343 -0.633 3.934 32 HG11 VAL 4 1HG1 VAL 4 -0.782 -2.976 3.372 33 HG12 VAL 4 2HG1 VAL 4 0.827 -2.454 2.868 34 HG13 VAL 4 3HG1 VAL 4 -0.600 -1.889 1.996 35 HG21 VAL 4 3HG2 VAL 4 1.157 -1.608 5.337 36 HG22 VAL 4 1HG2 VAL 4 -0.486 -2.172 5.663 37 HG23 VAL 4 2HG2 VAL 4 -0.050 -0.494 5.986 38 H ILE 5 H ILE 5 1.787 -0.041 1.190 39 HA ILE 5 HA ILE 5 -0.403 1.075 -0.458 40 HB ILE 5 HB ILE 5 2.551 0.919 -1.120 41 HG12 ILE 5 2HG1 ILE 5 0.841 3.326 -0.415 42 HG13 ILE 5 3HG1 ILE 5 2.009 2.567 0.662 43 HG21 ILE 5 1HG2 ILE 5 1.131 0.754 -3.109 44 HG22 ILE 5 2HG2 ILE 5 1.987 2.295 -3.070 45 HG23 ILE 5 3HG2 ILE 5 0.279 2.225 -2.634 46 HD11 ILE 5 3HD1 ILE 5 3.809 3.164 -0.885 47 HD12 ILE 5 1HD1 ILE 5 2.915 4.580 -0.331 48 HD13 ILE 5 2HD1 ILE 5 2.632 3.935 -1.948 49 H VAL 6 H VAL 6 -1.494 -0.396 -1.627 50 HA VAL 6 HA VAL 6 -0.326 -3.054 -2.065 51 HB VAL 6 HB VAL 6 -3.180 -2.125 -2.484 52 HG11 VAL 6 1HG1 VAL 6 -2.018 -4.916 -2.417 53 HG12 VAL 6 2HG1 VAL 6 -2.614 -4.075 -3.850 54 HG13 VAL 6 3HG1 VAL 6 -3.729 -4.514 -2.555 55 HG21 VAL 6 3HG2 VAL 6 -1.968 -3.653 -0.172 56 HG22 VAL 6 1HG2 VAL 6 -3.681 -3.288 -0.384 57 HG23 VAL 6 2HG2 VAL 6 -2.526 -1.979 -0.130 58 H VAL 7 H VAL 7 0.212 -3.829 -4.051 59 HA VAL 7 HA VAL 7 -0.402 -2.145 -6.409 60 HB VAL 7 HB VAL 7 2.020 -3.921 -5.993 61 HG11 VAL 7 1HG1 VAL 7 1.320 -2.064 -8.276 62 HG12 VAL 7 2HG1 VAL 7 1.368 -3.826 -8.339 63 HG13 VAL 7 3HG1 VAL 7 2.855 -2.912 -8.081 64 HG21 VAL 7 3HG2 VAL 7 1.808 -0.904 -6.017 65 HG22 VAL 7 1HG2 VAL 7 3.302 -1.836 -5.888 66 HG23 VAL 7 2HG2 VAL 7 2.100 -1.910 -4.598 67 H PHE 8 H PHE 8 -2.066 -3.131 -7.475 68 HA PHE 8 HA PHE 8 -2.115 -6.015 -7.852 69 HB2 PHE 8 2HB PHE 8 -3.911 -3.778 -8.806 70 HB3 PHE 8 3HB PHE 8 -4.111 -5.434 -9.363 71 HD1 PHE 8 HD2 PHE 8 -4.215 -3.248 -6.378 72 HD2 PHE 8 HD1 PHE 8 -5.163 -7.070 -8.008 73 HE1 PHE 8 HE2 PHE 8 -5.584 -3.755 -4.399 74 HE2 PHE 8 HE1 PHE 8 -6.529 -7.577 -6.027 75 HZ PHE 8 HZ PHE 8 -6.742 -5.920 -4.222 76 H SER 9 H SER 9 0.192 -5.540 -8.796 77 HA SER 9 HA SER 9 -0.063 -6.049 -11.644 78 HB2 SER 9 2HB SER 9 0.252 -3.597 -11.606 79 HB3 SER 9 3HB SER 9 1.727 -3.800 -10.662 80 HG SER 9 HG SER 9 1.226 -4.454 -13.358 81 H THR 10 H THR 10 1.019 -7.847 -11.937 82 HA THR 10 HA THR 10 2.860 -8.880 -9.999 83 HB THR 10 HB THR 10 3.003 -10.854 -11.440 84 HG1 THR 10 HG1 THR 10 1.618 -9.185 -13.301 85 HG21 THR 10 3HG2 THR 10 0.623 -11.466 -11.470 86 HG22 THR 10 1HG2 THR 10 0.184 -9.773 -11.242 87 HG23 THR 10 2HG2 THR 10 1.051 -10.640 -9.971 88 H ASP 11 H ASP 11 3.328 -6.834 -12.650 89 HA ASP 11 HA ASP 11 5.858 -7.825 -13.556 90 HB2 ASP 11 2HB ASP 11 4.392 -5.223 -13.992 91 HB3 ASP 11 3HB ASP 11 5.985 -5.535 -14.679 92 H GLU 12 H GLU 12 7.737 -7.676 -12.533 93 HA GLU 12 HA GLU 12 8.261 -6.171 -10.234 94 HB2 GLU 12 2HB GLU 12 10.633 -6.691 -10.626 95 HB3 GLU 12 3HB GLU 12 9.617 -8.106 -10.870 96 HG2 GLU 12 2HG GLU 12 9.778 -7.861 -13.274 97 HG3 GLU 12 3HG GLU 12 10.690 -6.364 -13.089 98 H GLU 13 H GLU 13 8.685 -5.383 -13.639 99 HA GLU 13 HA GLU 13 10.146 -3.003 -13.403 100 HB2 GLU 13 2HB GLU 13 8.036 -3.736 -15.457 101 HB3 GLU 13 3HB GLU 13 9.181 -2.412 -15.615 102 HG2 GLU 13 2HG GLU 13 9.930 -5.322 -15.394 103 HG3 GLU 13 3HG GLU 13 9.826 -4.412 -16.898 104 H THR 14 H THR 14 6.604 -3.472 -13.539 105 HA THR 14 HA THR 14 5.778 -0.835 -13.266 106 HB THR 14 HB THR 14 4.443 -3.277 -12.057 107 HG1 THR 14 HG1 THR 14 3.417 -3.478 -14.004 108 HG21 THR 14 3HG2 THR 14 2.363 -1.946 -12.263 109 HG22 THR 14 1HG2 THR 14 3.326 -0.552 -12.750 110 HG23 THR 14 2HG2 THR 14 3.511 -1.230 -11.132 111 H LEU 15 H LEU 15 6.451 -3.193 -10.686 112 HA LEU 15 HA LEU 15 5.959 -1.561 -8.473 113 HB2 LEU 15 2HB LEU 15 6.275 -3.968 -8.304 114 HB3 LEU 15 3HB LEU 15 7.947 -3.810 -8.808 115 HG LEU 15 HG LEU 15 8.461 -2.579 -6.731 116 HD11 LEU 15 1HD1 LEU 15 6.277 -1.569 -6.325 117 HD12 LEU 15 2HD1 LEU 15 6.821 -2.481 -4.918 118 HD13 LEU 15 3HD1 LEU 15 5.591 -3.158 -5.985 119 HD21 LEU 15 3HD2 LEU 15 8.765 -4.999 -6.804 120 HD22 LEU 15 1HD2 LEU 15 7.097 -5.235 -6.280 121 HD23 LEU 15 2HD2 LEU 15 8.265 -4.475 -5.197 122 H ARG 16 H ARG 16 8.955 -2.005 -10.342 123 HA ARG 16 HA ARG 16 10.651 -0.429 -8.764 124 HB2 ARG 16 2HB ARG 16 11.526 -1.891 -10.493 125 HB3 ARG 16 3HB ARG 16 10.728 -0.949 -11.746 126 HG2 ARG 16 2HG ARG 16 12.150 0.964 -11.239 127 HG3 ARG 16 3HG ARG 16 12.923 0.058 -9.938 128 HD2 ARG 16 2HD ARG 16 13.829 -1.529 -11.537 129 HD3 ARG 16 3HD ARG 16 12.970 -0.728 -12.857 130 HE ARG 16 HE ARG 16 14.438 1.276 -11.875 131 HH11 ARG 16 1HH1 ARG 16 15.314 -1.943 -12.746 132 HH12 ARG 16 2HH1 ARG 16 16.936 -1.498 -13.139 133 HH21 ARG 16 1HH2 ARG 16 16.497 1.822 -12.385 134 HH22 ARG 16 2HH2 ARG 16 17.595 0.613 -12.949 135 H LYS 17 H LYS 17 8.498 0.514 -11.428 136 HA LYS 17 HA LYS 17 9.328 3.230 -11.530 137 HB2 LYS 17 2HB LYS 17 6.937 1.739 -12.567 138 HB3 LYS 17 3HB LYS 17 6.956 3.494 -12.630 139 HG2 LYS 17 2HG LYS 17 7.682 2.495 -14.743 140 HG3 LYS 17 3HG LYS 17 8.961 3.458 -14.004 141 HD2 LYS 17 2HD LYS 17 10.021 1.419 -13.163 142 HD3 LYS 17 3HD LYS 17 8.726 0.448 -13.861 143 HE2 LYS 17 2HE LYS 17 10.633 2.195 -15.420 144 HE3 LYS 17 3HE LYS 17 10.762 0.445 -15.250 145 HZ1 LYS 17 3HZ LYS 17 9.723 1.004 -17.331 146 HZ2 LYS 17 1HZ LYS 17 8.539 1.920 -16.550 147 HZ3 LYS 17 2HZ LYS 17 8.589 0.246 -16.336 148 H PHE 18 H PHE 18 7.127 1.547 -9.410 149 HA PHE 18 HA PHE 18 5.912 3.989 -8.423 150 HB2 PHE 18 2HB PHE 18 5.702 1.102 -7.582 151 HB3 PHE 18 3HB PHE 18 4.976 2.397 -6.635 152 HD1 PHE 18 HD2 PHE 18 3.793 4.194 -8.454 153 HD2 PHE 18 HD1 PHE 18 4.089 -0.045 -8.782 154 HE1 PHE 18 HE2 PHE 18 1.810 4.172 -9.908 155 HE2 PHE 18 HE1 PHE 18 2.107 -0.068 -10.240 156 HZ PHE 18 HZ PHE 18 0.965 2.039 -10.803 157 H LYS 19 H LYS 19 8.292 1.632 -7.160 158 HA LYS 19 HA LYS 19 8.691 2.934 -4.691 159 HB2 LYS 19 2HB LYS 19 10.753 1.661 -4.483 160 HB3 LYS 19 3HB LYS 19 9.467 0.637 -5.103 161 HG2 LYS 19 2HG LYS 19 10.388 0.674 -7.300 162 HG3 LYS 19 3HG LYS 19 11.537 1.935 -6.856 163 HD2 LYS 19 2HD LYS 19 12.609 -0.278 -6.975 164 HD3 LYS 19 3HD LYS 19 12.689 0.408 -5.354 165 HE2 LYS 19 2HE LYS 19 10.758 -0.991 -4.699 166 HE3 LYS 19 3HE LYS 19 10.751 -1.709 -6.309 167 HZ1 LYS 19 3HZ LYS 19 12.979 -2.557 -5.900 168 HZ2 LYS 19 1HZ LYS 19 11.910 -3.109 -4.713 169 HZ3 LYS 19 2HZ LYS 19 12.992 -1.861 -4.360 170 H ASP 20 H ASP 20 9.950 3.584 -7.885 171 HA ASP 20 HA ASP 20 12.053 5.317 -7.279 172 HB2 ASP 20 2HB ASP 20 11.564 4.524 -9.560 173 HB3 ASP 20 3HB ASP 20 10.099 5.502 -9.590 174 H ILE 21 H ILE 21 8.574 5.949 -7.475 175 HA ILE 21 HA ILE 21 8.683 8.749 -7.089 176 HB ILE 21 HB ILE 21 6.462 6.822 -6.357 177 HG12 ILE 21 2HG1 ILE 21 6.866 8.459 -8.883 178 HG13 ILE 21 3HG1 ILE 21 7.140 6.725 -8.748 179 HG21 ILE 21 1HG2 ILE 21 6.211 8.980 -5.237 180 HG22 ILE 21 2HG2 ILE 21 4.982 8.773 -6.484 181 HG23 ILE 21 3HG2 ILE 21 6.373 9.813 -6.784 182 HD11 ILE 21 3HD1 ILE 21 5.007 7.230 -9.807 183 HD12 ILE 21 1HD1 ILE 21 4.496 8.114 -8.368 184 HD13 ILE 21 2HD1 ILE 21 4.782 6.374 -8.281 185 H ILE 22 H ILE 22 8.123 6.095 -4.771 186 HA ILE 22 HA ILE 22 7.787 7.624 -2.459 187 HB ILE 22 HB ILE 22 8.990 4.852 -2.662 188 HG12 ILE 22 2HG1 ILE 22 6.108 5.723 -2.283 189 HG13 ILE 22 3HG1 ILE 22 6.781 5.030 -3.754 190 HG21 ILE 22 1HG2 ILE 22 9.392 5.872 -0.477 191 HG22 ILE 22 2HG2 ILE 22 8.215 4.566 -0.348 192 HG23 ILE 22 3HG2 ILE 22 7.675 6.245 -0.321 193 HD11 ILE 22 3HD1 ILE 22 6.580 3.637 -1.092 194 HD12 ILE 22 1HD1 ILE 22 7.210 2.942 -2.588 195 HD13 ILE 22 2HD1 ILE 22 5.509 3.400 -2.474 196 H LYS 23 H LYS 23 10.802 6.068 -3.641 197 HA LYS 23 HA LYS 23 12.469 7.130 -1.617 198 HB2 LYS 23 2HB LYS 23 14.345 6.480 -3.019 199 HB3 LYS 23 3HB LYS 23 13.125 5.217 -3.039 200 HG2 LYS 23 2HG LYS 23 12.349 6.005 -5.228 201 HG3 LYS 23 3HG LYS 23 13.579 7.269 -5.206 202 HD2 LYS 23 2HD LYS 23 14.131 4.296 -5.143 203 HD3 LYS 23 3HD LYS 23 14.247 5.324 -6.572 204 HE2 LYS 23 2HE LYS 23 15.900 5.564 -4.051 205 HE3 LYS 23 3HE LYS 23 16.453 4.948 -5.608 206 HZ1 LYS 23 3HZ LYS 23 15.924 7.179 -6.540 207 HZ2 LYS 23 1HZ LYS 23 17.171 7.186 -5.394 208 HZ3 LYS 23 2HZ LYS 23 15.629 7.724 -4.967 209 H LYS 24 H LYS 24 11.460 8.370 -4.741 210 HA LYS 24 HA LYS 24 13.162 10.622 -4.893 211 HB2 LYS 24 2HB LYS 24 11.788 9.630 -6.744 212 HB3 LYS 24 3HB LYS 24 10.363 10.347 -6.010 213 HG2 LYS 24 2HG LYS 24 11.225 12.570 -6.406 214 HG3 LYS 24 3HG LYS 24 12.744 11.904 -7.015 215 HD2 LYS 24 2HD LYS 24 10.002 11.581 -8.256 216 HD3 LYS 24 3HD LYS 24 11.339 12.543 -8.890 217 HE2 LYS 24 2HE LYS 24 12.670 10.516 -9.201 218 HE3 LYS 24 3HE LYS 24 11.369 9.540 -8.521 219 HZ1 LYS 24 3HZ LYS 24 9.960 10.363 -10.383 220 HZ2 LYS 24 1HZ LYS 24 11.250 9.376 -10.858 221 HZ3 LYS 24 2HZ LYS 24 11.345 11.051 -11.069 222 H ASN 25 H ASN 25 10.072 10.093 -3.273 223 HA ASN 25 HA ASN 25 9.738 12.814 -2.418 224 HB2 ASN 25 2HB ASN 25 8.532 10.256 -1.333 225 HB3 ASN 25 3HB ASN 25 8.025 11.881 -0.884 226 HD21 ASN 25 1HD2 ASN 25 8.351 12.902 -3.625 227 HD22 ASN 25 2HD2 ASN 25 7.013 12.271 -4.508 228 H GLY 26 H GLY 26 11.678 10.184 -1.340 229 HA2 GLY 26 2HA GLY 26 13.581 10.743 0.050 230 HA3 GLY 26 3HA GLY 26 12.546 11.829 0.958 231 H PHE 27 H PHE 27 11.067 8.830 0.240 232 HA PHE 27 HA PHE 27 11.507 7.955 3.027 233 HB2 PHE 27 2HB PHE 27 9.250 7.328 1.106 234 HB3 PHE 27 3HB PHE 27 9.390 6.678 2.735 235 HD1 PHE 27 HD2 PHE 27 8.878 9.767 0.780 236 HD2 PHE 27 HD1 PHE 27 8.753 7.957 4.634 237 HE1 PHE 27 HE2 PHE 27 7.694 11.730 1.662 238 HE2 PHE 27 HE1 PHE 27 7.568 9.922 5.520 239 HZ PHE 27 HZ PHE 27 7.037 11.812 4.033 240 H LYS 28 H LYS 28 11.508 5.576 3.410 241 HA LYS 28 HA LYS 28 13.195 4.219 1.446 242 HB2 LYS 28 2HB LYS 28 12.342 3.322 4.214 243 HB3 LYS 28 3HB LYS 28 13.494 2.490 3.184 244 HG2 LYS 28 2HG LYS 28 14.806 3.631 4.739 245 HG3 LYS 28 3HG LYS 28 14.888 4.631 3.288 246 HD2 LYS 28 2HD LYS 28 13.334 6.207 4.193 247 HD3 LYS 28 3HD LYS 28 12.937 5.139 5.539 248 HE2 LYS 28 2HE LYS 28 14.391 6.907 6.307 249 HE3 LYS 28 3HE LYS 28 15.256 5.373 6.364 250 HZ1 LYS 28 3HZ LYS 28 16.320 5.965 4.262 251 HZ2 LYS 28 1HZ LYS 28 16.651 7.101 5.469 252 HZ3 LYS 28 2HZ LYS 28 15.519 7.453 4.269 253 H VAL 29 H VAL 29 12.698 2.162 0.554 254 HA VAL 29 HA VAL 29 9.800 1.637 0.384 255 HB VAL 29 HB VAL 29 11.970 0.859 -1.580 256 HG11 VAL 29 1HG1 VAL 29 10.069 -0.664 -1.648 257 HG12 VAL 29 2HG1 VAL 29 10.107 0.341 -3.097 258 HG13 VAL 29 3HG1 VAL 29 8.960 0.698 -1.802 259 HG21 VAL 29 3HG2 VAL 29 11.690 3.281 -1.507 260 HG22 VAL 29 1HG2 VAL 29 9.946 3.104 -1.709 261 HG23 VAL 29 2HG2 VAL 29 11.039 2.633 -3.012 262 H ARG 30 H ARG 30 8.996 -0.212 1.166 263 HA ARG 30 HA ARG 30 10.780 -2.561 1.443 264 HB2 ARG 30 2HB ARG 30 10.194 -1.644 3.649 265 HB3 ARG 30 3HB ARG 30 8.488 -1.734 3.247 266 HG2 ARG 30 2HG ARG 30 9.160 -3.561 4.715 267 HG3 ARG 30 3HG ARG 30 8.607 -4.159 3.151 268 HD2 ARG 30 2HD ARG 30 10.608 -5.350 3.933 269 HD3 ARG 30 3HD ARG 30 10.909 -4.480 2.429 270 HE ARG 30 HE ARG 30 11.975 -2.738 3.865 271 HH11 ARG 30 1HH1 ARG 30 11.761 -5.995 4.960 272 HH12 ARG 30 2HH1 ARG 30 13.149 -5.861 5.977 273 HH21 ARG 30 1HH2 ARG 30 13.760 -2.581 5.154 274 HH22 ARG 30 2HH2 ARG 30 14.282 -3.948 6.074 275 H THR 31 H THR 31 10.213 -3.992 -0.128 276 HA THR 31 HA THR 31 7.440 -4.010 -1.096 277 HB THR 31 HB THR 31 8.289 -5.337 -2.993 278 HG1 THR 31 HG1 THR 31 10.116 -6.216 -1.621 279 HG21 THR 31 3HG2 THR 31 9.676 -3.583 -4.011 280 HG22 THR 31 1HG2 THR 31 9.918 -2.852 -2.424 281 HG23 THR 31 2HG2 THR 31 8.307 -2.891 -3.140 282 H VAL 32 H VAL 32 6.045 -5.455 -0.367 283 HA VAL 32 HA VAL 32 6.960 -7.953 0.863 284 HB VAL 32 HB VAL 32 4.210 -6.680 0.771 285 HG11 VAL 32 1HG1 VAL 32 4.026 -9.115 0.911 286 HG12 VAL 32 2HG1 VAL 32 3.544 -8.355 2.427 287 HG13 VAL 32 3HG1 VAL 32 5.123 -9.124 2.292 288 HG21 VAL 32 3HG2 VAL 32 4.598 -6.246 3.164 289 HG22 VAL 32 1HG2 VAL 32 5.776 -5.424 2.139 290 HG23 VAL 32 2HG2 VAL 32 6.230 -6.891 3.004 291 H ARG 33 H ARG 33 6.661 -9.933 -0.043 292 HA ARG 33 HA ARG 33 5.041 -10.124 -2.509 293 HB2 ARG 33 2HB ARG 33 6.705 -11.782 -3.336 294 HB3 ARG 33 3HB ARG 33 7.364 -10.163 -3.141 295 HG2 ARG 33 2HG ARG 33 8.511 -10.782 -1.140 296 HG3 ARG 33 3HG ARG 33 7.689 -12.342 -1.082 297 HD2 ARG 33 2HD ARG 33 9.582 -11.464 -3.266 298 HD3 ARG 33 3HD ARG 33 10.023 -12.494 -1.904 299 HE ARG 33 HE ARG 33 7.865 -13.716 -3.114 300 HH11 ARG 33 1HH1 ARG 33 11.045 -12.801 -4.074 301 HH12 ARG 33 2HH1 ARG 33 11.189 -14.097 -5.204 302 HH21 ARG 33 1HH2 ARG 33 8.085 -15.389 -4.560 303 HH22 ARG 33 2HH2 ARG 33 9.549 -15.543 -5.467 304 H SER 34 H SER 34 5.517 -11.347 0.615 305 HA SER 34 HA SER 34 3.705 -13.575 0.157 306 HB2 SER 34 2HB SER 34 6.506 -14.040 1.241 307 HB3 SER 34 3HB SER 34 5.222 -15.247 1.199 308 HG SER 34 HG SER 34 5.202 -14.819 -1.155 309 HA PRO 35 HA PRO 35 2.021 -12.806 4.156 310 HB2 PRO 35 2HB PRO 35 2.473 -15.273 5.474 311 HB3 PRO 35 3HB PRO 35 1.034 -14.801 4.570 312 HG2 PRO 35 2HG PRO 35 3.377 -16.422 3.690 313 HG3 PRO 35 3HG PRO 35 1.668 -16.576 3.239 314 HD2 PRO 35 2HD PRO 35 3.438 -15.518 1.541 315 HD3 PRO 35 3HD PRO 35 1.799 -14.838 1.678 316 H GLN 36 H GLN 36 4.963 -14.822 4.649 317 HA GLN 36 HA GLN 36 5.627 -13.758 7.159 318 HB2 GLN 36 2HB GLN 36 7.911 -14.649 6.750 319 HB3 GLN 36 3HB GLN 36 6.639 -15.822 6.447 320 HG2 GLN 36 2HG GLN 36 6.957 -15.762 4.141 321 HG3 GLN 36 3HG GLN 36 7.790 -14.209 4.197 322 HE21 GLN 36 1HE2 GLN 36 9.967 -14.152 4.595 323 HE22 GLN 36 2HE2 GLN 36 10.955 -15.569 4.710 324 H GLU 37 H GLU 37 6.254 -12.507 3.951 325 HA GLU 37 HA GLU 37 8.448 -10.839 4.553 326 HB2 GLU 37 2HB GLU 37 6.336 -10.420 2.427 327 HB3 GLU 37 3HB GLU 37 7.945 -9.712 2.448 328 HG2 GLU 37 2HG GLU 37 7.369 -12.666 2.266 329 HG3 GLU 37 3HG GLU 37 7.703 -11.618 0.890 330 H LEU 38 H LEU 38 4.943 -10.165 4.544 331 HA LEU 38 HA LEU 38 5.146 -7.422 5.230 332 HB2 LEU 38 2HB LEU 38 3.096 -8.409 4.310 333 HB3 LEU 38 3HB LEU 38 2.902 -9.383 5.757 334 HG LEU 38 HG LEU 38 2.606 -7.302 7.088 335 HD11 LEU 38 1HD1 LEU 38 3.855 -5.776 5.635 336 HD12 LEU 38 2HD1 LEU 38 2.231 -5.180 5.971 337 HD13 LEU 38 3HD1 LEU 38 2.596 -5.912 4.408 338 HD21 LEU 38 3HD2 LEU 38 0.656 -8.514 6.296 339 HD22 LEU 38 1HD2 LEU 38 0.702 -7.636 4.767 340 HD23 LEU 38 2HD2 LEU 38 0.351 -6.779 6.268 341 H LYS 39 H LYS 39 4.514 -10.288 7.254 342 HA LYS 39 HA LYS 39 4.500 -9.079 9.763 343 HB2 LYS 39 2HB LYS 39 3.850 -11.385 9.461 344 HB3 LYS 39 3HB LYS 39 5.457 -11.819 8.898 345 HG2 LYS 39 2HG LYS 39 6.369 -11.392 11.121 346 HG3 LYS 39 3HG LYS 39 4.772 -10.906 11.693 347 HD2 LYS 39 2HD LYS 39 3.905 -13.132 11.306 348 HD3 LYS 39 3HD LYS 39 5.428 -13.637 10.573 349 HE2 LYS 39 2HE LYS 39 5.141 -12.714 13.434 350 HE3 LYS 39 3HE LYS 39 5.118 -14.402 12.928 351 HZ1 LYS 39 3HZ LYS 39 7.378 -12.548 12.415 352 HZ2 LYS 39 1HZ LYS 39 7.345 -14.215 12.137 353 HZ3 LYS 39 2HZ LYS 39 7.308 -13.619 13.719 354 H ASP 40 H ASP 40 7.243 -10.470 7.998 355 HA ASP 40 HA ASP 40 9.270 -10.062 9.848 356 HB2 ASP 40 2HB ASP 40 9.479 -11.476 7.854 357 HB3 ASP 40 3HB ASP 40 9.421 -10.052 6.822 358 H SER 41 H SER 41 8.145 -7.895 7.260 359 HA SER 41 HA SER 41 10.100 -5.888 7.588 360 HB2 SER 41 2HB SER 41 8.689 -4.470 6.254 361 HB3 SER 41 3HB SER 41 8.512 -6.107 5.630 362 HG SER 41 HG SER 41 6.531 -6.263 6.617 363 H ILE 42 H ILE 42 6.817 -6.152 8.956 364 HA ILE 42 HA ILE 42 6.893 -3.764 10.449 365 HB ILE 42 HB ILE 42 5.289 -6.281 10.942 366 HG12 ILE 42 2HG1 ILE 42 4.609 -3.697 9.501 367 HG13 ILE 42 3HG1 ILE 42 4.886 -5.258 8.740 368 HG21 ILE 42 1HG2 ILE 42 4.893 -3.502 12.067 369 HG22 ILE 42 2HG2 ILE 42 5.388 -4.931 12.975 370 HG23 ILE 42 3HG2 ILE 42 3.778 -4.855 12.261 371 HD11 ILE 42 3HD1 ILE 42 2.906 -6.140 9.901 372 HD12 ILE 42 1HD1 ILE 42 2.530 -4.781 8.840 373 HD13 ILE 42 2HD1 ILE 42 2.619 -4.539 10.584 374 H GLU 43 H GLU 43 7.960 -7.043 11.243 375 HA GLU 43 HA GLU 43 8.514 -6.629 13.977 376 HB2 GLU 43 2HB GLU 43 9.844 -8.501 12.003 377 HB3 GLU 43 3HB GLU 43 10.058 -8.573 13.749 378 HG2 GLU 43 2HG GLU 43 7.620 -8.961 13.990 379 HG3 GLU 43 3HG GLU 43 7.483 -8.993 12.236 380 H GLU 44 H GLU 44 10.192 -5.566 11.130 381 HA GLU 44 HA GLU 44 12.496 -4.657 12.672 382 HB2 GLU 44 2HB GLU 44 11.776 -4.577 9.755 383 HB3 GLU 44 3HB GLU 44 13.066 -3.558 10.380 384 HG2 GLU 44 2HG GLU 44 12.947 -6.560 10.625 385 HG3 GLU 44 3HG GLU 44 13.904 -5.667 9.443 386 H LEU 45 H LEU 45 9.607 -3.294 11.148 387 HA LEU 45 HA LEU 45 10.176 -0.579 11.446 388 HB2 LEU 45 2HB LEU 45 7.529 -2.025 11.587 389 HB3 LEU 45 3HB LEU 45 7.674 -0.276 11.552 390 HG LEU 45 HG LEU 45 8.578 -2.168 9.366 391 HD11 LEU 45 1HD1 LEU 45 6.754 -1.211 8.065 392 HD12 LEU 45 2HD1 LEU 45 6.264 -0.234 9.450 393 HD13 LEU 45 3HD1 LEU 45 6.150 -1.992 9.525 394 HD21 LEU 45 3HD2 LEU 45 9.000 -0.151 8.052 395 HD22 LEU 45 1HD2 LEU 45 10.015 -0.198 9.493 396 HD23 LEU 45 2HD2 LEU 45 8.598 0.852 9.445 397 H VAL 46 H VAL 46 9.128 -2.914 13.857 398 HA VAL 46 HA VAL 46 8.342 -1.088 15.867 399 HB VAL 46 HB VAL 46 7.843 -3.541 15.874 400 HG11 VAL 46 1HG1 VAL 46 9.485 -5.100 16.792 401 HG12 VAL 46 2HG1 VAL 46 10.692 -3.815 16.837 402 HG13 VAL 46 3HG1 VAL 46 10.060 -4.378 15.289 403 HG21 VAL 46 3HG2 VAL 46 9.116 -2.445 18.389 404 HG22 VAL 46 1HG2 VAL 46 7.999 -3.809 18.317 405 HG23 VAL 46 2HG2 VAL 46 7.450 -2.194 17.865 406 H LYS 47 H LYS 47 11.467 -1.776 14.642 407 HA LYS 47 HA LYS 47 12.707 -0.414 16.956 408 HB2 LYS 47 2HB LYS 47 14.154 -1.857 14.721 409 HB3 LYS 47 3HB LYS 47 14.859 -1.209 16.191 410 HG2 LYS 47 2HG LYS 47 14.717 -3.300 16.966 411 HG3 LYS 47 3HG LYS 47 12.999 -2.962 17.186 412 HD2 LYS 47 2HD LYS 47 12.437 -4.007 15.124 413 HD3 LYS 47 3HD LYS 47 14.123 -4.065 14.611 414 HE2 LYS 47 2HE LYS 47 14.561 -5.614 16.541 415 HE3 LYS 47 3HE LYS 47 12.818 -5.662 16.814 416 HZ1 LYS 47 3HZ LYS 47 12.516 -6.573 14.617 417 HZ2 LYS 47 1HZ LYS 47 13.608 -7.534 15.476 418 HZ3 LYS 47 2HZ LYS 47 14.171 -6.467 14.295 419 H LYS 48 H LYS 48 12.630 -0.436 13.402 420 HA LYS 48 HA LYS 48 14.262 1.899 13.141 421 HB2 LYS 48 2HB LYS 48 12.712 0.205 11.201 422 HB3 LYS 48 3HB LYS 48 13.450 1.713 10.682 423 HG2 LYS 48 2HG LYS 48 14.882 -0.204 10.185 424 HG3 LYS 48 3HG LYS 48 15.653 0.893 11.331 425 HD2 LYS 48 2HD LYS 48 14.846 -0.634 13.175 426 HD3 LYS 48 3HD LYS 48 14.345 -1.769 11.921 427 HE2 LYS 48 2HE LYS 48 17.163 -0.736 12.262 428 HE3 LYS 48 3HE LYS 48 16.580 -2.261 12.925 429 HZ1 LYS 48 3HZ LYS 48 16.161 -3.066 10.728 430 HZ2 LYS 48 1HZ LYS 48 17.754 -2.509 10.799 431 HZ3 LYS 48 2HZ LYS 48 16.564 -1.578 10.036 432 H TYR 49 H TYR 49 10.790 1.318 12.539 433 HA TYR 49 HA TYR 49 8.968 2.637 12.789 434 HB2 TYR 49 2HB TYR 49 10.937 4.428 14.196 435 HB3 TYR 49 3HB TYR 49 9.235 4.840 14.038 436 HD1 TYR 49 HD2 TYR 49 7.627 2.762 14.736 437 HD2 TYR 49 HD1 TYR 49 11.558 3.476 16.208 438 HE1 TYR 49 HE2 TYR 49 7.095 1.484 16.765 439 HE2 TYR 49 HE1 TYR 49 11.030 2.201 18.245 440 HH TYR 49 HH TYR 49 9.032 1.555 19.540 441 H ASN 50 H ASN 50 11.610 4.903 11.914 442 HA ASN 50 HA ASN 50 9.923 6.970 11.214 443 HB2 ASN 50 2HB ASN 50 12.451 6.910 11.775 444 HB3 ASN 50 3HB ASN 50 12.675 6.744 10.036 445 HD21 ASN 50 1HD2 ASN 50 13.400 8.924 11.869 446 HD22 ASN 50 2HD2 ASN 50 12.645 10.338 11.224 447 H ALA 51 H ALA 51 11.824 7.180 8.529 448 HA ALA 51 HA ALA 51 9.462 7.518 6.988 449 HB1 ALA 51 3HB ALA 51 11.414 8.994 6.846 450 HB2 ALA 51 1HB ALA 51 10.932 8.368 5.268 451 HB3 ALA 51 2HB ALA 51 12.334 7.689 6.096 452 H THR 52 H THR 52 10.362 4.598 7.635 453 HA THR 52 HA THR 52 10.714 3.479 4.986 454 HB THR 52 HB THR 52 10.119 2.020 7.575 455 HG1 THR 52 HG1 THR 52 12.642 1.716 6.894 456 HG21 THR 52 3HG2 THR 52 11.298 1.045 4.960 457 HG22 THR 52 1HG2 THR 52 9.695 0.652 5.584 458 HG23 THR 52 2HG2 THR 52 11.134 0.085 6.430 459 H ILE 53 H ILE 53 9.096 3.104 3.602 460 HA ILE 53 HA ILE 53 6.336 2.785 4.612 461 HB ILE 53 HB ILE 53 7.301 3.629 1.864 462 HG12 ILE 53 2HG1 ILE 53 5.929 5.177 4.089 463 HG13 ILE 53 3HG1 ILE 53 7.586 5.391 3.534 464 HG21 ILE 53 1HG2 ILE 53 5.250 2.335 1.670 465 HG22 ILE 53 2HG2 ILE 53 4.921 4.039 1.351 466 HG23 ILE 53 3HG2 ILE 53 4.475 3.331 2.906 467 HD11 ILE 53 3HD1 ILE 53 6.743 6.144 1.359 468 HD12 ILE 53 1HD1 ILE 53 6.168 7.149 2.689 469 HD13 ILE 53 2HD1 ILE 53 5.091 5.964 1.952 470 H VAL 54 H VAL 54 5.110 1.003 4.042 471 HA VAL 54 HA VAL 54 6.603 -1.205 2.793 472 HB VAL 54 HB VAL 54 5.950 -1.705 5.053 473 HG11 VAL 54 1HG1 VAL 54 3.104 -1.142 4.217 474 HG12 VAL 54 2HG1 VAL 54 4.087 -0.152 5.295 475 HG13 VAL 54 3HG1 VAL 54 3.614 -1.779 5.781 476 HG21 VAL 54 3HG2 VAL 54 5.897 -3.562 3.481 477 HG22 VAL 54 1HG2 VAL 54 4.217 -3.204 3.081 478 HG23 VAL 54 2HG2 VAL 54 4.639 -3.760 4.702 479 H VAL 55 H VAL 55 6.071 -1.844 0.851 480 HA VAL 55 HA VAL 55 3.394 -1.268 -0.249 481 HB VAL 55 HB VAL 55 6.003 -1.630 -1.752 482 HG11 VAL 55 1HG1 VAL 55 4.749 -0.837 -3.711 483 HG12 VAL 55 2HG1 VAL 55 3.269 -0.814 -2.749 484 HG13 VAL 55 3HG1 VAL 55 4.088 -2.343 -3.072 485 HG21 VAL 55 3HG2 VAL 55 4.448 0.896 -1.173 486 HG22 VAL 55 1HG2 VAL 55 5.870 0.780 -2.210 487 HG23 VAL 55 2HG2 VAL 55 6.009 0.453 -0.482 488 H VAL 56 H VAL 56 2.149 -3.034 -0.482 489 HA VAL 56 HA VAL 56 3.394 -5.692 -0.556 490 HB VAL 56 HB VAL 56 0.485 -4.967 -0.119 491 HG11 VAL 56 1HG1 VAL 56 0.276 -7.281 0.711 492 HG12 VAL 56 2HG1 VAL 56 1.949 -7.588 0.247 493 HG13 VAL 56 3HG1 VAL 56 0.744 -7.224 -0.989 494 HG21 VAL 56 3HG2 VAL 56 2.619 -5.688 1.900 495 HG22 VAL 56 1HG2 VAL 56 0.906 -5.451 2.254 496 HG23 VAL 56 2HG2 VAL 56 1.885 -4.100 1.686 497 H VAL 57 H VAL 57 3.728 -6.549 -2.522 498 HA VAL 57 HA VAL 57 2.033 -5.868 -4.795 499 HB VAL 57 HB VAL 57 4.352 -7.815 -4.669 500 HG11 VAL 57 1HG1 VAL 57 4.419 -7.544 -7.111 501 HG12 VAL 57 2HG1 VAL 57 2.986 -6.518 -7.036 502 HG13 VAL 57 3HG1 VAL 57 2.881 -8.216 -6.572 503 HG21 VAL 57 3HG2 VAL 57 5.688 -5.990 -5.662 504 HG22 VAL 57 1HG2 VAL 57 5.105 -5.592 -4.045 505 HG23 VAL 57 2HG2 VAL 57 4.317 -4.899 -5.464 506 H VAL 58 H VAL 58 0.328 -7.069 -5.470 507 HA VAL 58 HA VAL 58 -0.052 -9.688 -4.162 508 HB VAL 58 HB VAL 58 -2.460 -9.231 -4.030 509 HG11 VAL 58 1HG1 VAL 58 -2.379 -7.521 -2.252 510 HG12 VAL 58 2HG1 VAL 58 -0.738 -7.100 -2.745 511 HG13 VAL 58 3HG1 VAL 58 -1.080 -8.705 -2.096 512 HG21 VAL 58 3HG2 VAL 58 -2.649 -7.696 -5.936 513 HG22 VAL 58 1HG2 VAL 58 -1.756 -6.468 -5.039 514 HG23 VAL 58 2HG2 VAL 58 -3.343 -6.994 -4.475 515 H ASP 59 H ASP 59 -0.880 -11.379 -5.297 516 HA ASP 59 HA ASP 59 -1.347 -11.044 -8.170 517 HB2 ASP 59 2HB ASP 59 -1.284 -13.576 -6.498 518 HB3 ASP 59 3HB ASP 59 -1.386 -13.503 -8.252 519 H ASP 60 H ASP 60 -2.987 -12.861 -5.564 520 HA ASP 60 HA ASP 60 -5.584 -12.443 -6.850 521 HB2 ASP 60 2HB ASP 60 -4.805 -14.104 -4.435 522 HB3 ASP 60 3HB ASP 60 -6.410 -14.057 -5.157 523 H LYS 61 H LYS 61 -7.370 -11.490 -5.786 524 HA LYS 61 HA LYS 61 -6.875 -9.243 -4.185 525 HB2 LYS 61 2HB LYS 61 -9.459 -10.786 -4.520 526 HB3 LYS 61 3HB LYS 61 -9.332 -9.188 -3.797 527 HG2 LYS 61 2HG LYS 61 -8.434 -8.337 -5.956 528 HG3 LYS 61 3HG LYS 61 -8.725 -9.931 -6.657 529 HD2 LYS 61 2HD LYS 61 -10.813 -8.089 -5.475 530 HD3 LYS 61 3HD LYS 61 -10.559 -8.410 -7.190 531 HE2 LYS 61 2HE LYS 61 -11.147 -10.762 -6.843 532 HE3 LYS 61 3HE LYS 61 -11.372 -10.459 -5.120 533 HZ1 LYS 61 3HZ LYS 61 -13.482 -10.467 -6.219 534 HZ2 LYS 61 1HZ LYS 61 -12.973 -9.303 -7.338 535 HZ3 LYS 61 2HZ LYS 61 -13.152 -8.890 -5.709 536 H GLU 62 H GLU 62 -7.761 -12.548 -3.257 537 HA GLU 62 HA GLU 62 -8.287 -12.057 -0.534 538 HB2 GLU 62 2HB GLU 62 -7.303 -14.550 -1.926 539 HB3 GLU 62 3HB GLU 62 -7.723 -14.502 -0.219 540 HG2 GLU 62 2HG GLU 62 -10.010 -13.765 -0.856 541 HG3 GLU 62 3HG GLU 62 -9.563 -13.979 -2.548 542 H TRP 63 H TRP 63 -5.231 -12.397 -2.223 543 HA TRP 63 HA TRP 63 -3.634 -12.633 0.138 544 HB2 TRP 63 2HB TRP 63 -2.634 -13.368 -1.892 545 HB3 TRP 63 3HB TRP 63 -3.004 -11.861 -2.714 546 HD1 TRP 63 HD1 TRP 63 -0.638 -11.138 -3.384 547 HE1 TRP 63 HE1 TRP 63 1.490 -10.450 -2.123 548 HE3 TRP 63 HE3 TRP 63 -1.973 -12.622 1.333 549 HZ2 TRP 63 HZ2 TRP 63 2.481 -10.535 0.512 550 HZ3 TRP 63 HZ3 TRP 63 -0.369 -12.283 3.164 551 HH2 TRP 63 HH2 TRP 63 1.814 -11.261 2.762 552 H ALA 64 H ALA 64 -4.651 -9.876 -1.885 553 HA ALA 64 HA ALA 64 -3.468 -7.829 -0.368 554 HB1 ALA 64 3HB ALA 64 -6.100 -7.758 -1.854 555 HB2 ALA 64 1HB ALA 64 -4.512 -7.442 -2.555 556 HB3 ALA 64 2HB ALA 64 -5.168 -6.354 -1.330 557 H GLU 65 H GLU 65 -6.555 -9.516 0.013 558 HA GLU 65 HA GLU 65 -7.555 -8.130 2.247 559 HB2 GLU 65 2HB GLU 65 -8.747 -9.827 0.738 560 HB3 GLU 65 3HB GLU 65 -7.960 -11.077 1.685 561 HG2 GLU 65 2HG GLU 65 -9.826 -8.995 2.817 562 HG3 GLU 65 3HG GLU 65 -10.316 -10.613 2.333 563 H LYS 66 H LYS 66 -5.570 -11.066 2.023 564 HA LYS 66 HA LYS 66 -5.383 -11.667 4.744 565 HB2 LYS 66 2HB LYS 66 -4.711 -13.104 2.763 566 HB3 LYS 66 3HB LYS 66 -3.217 -12.182 2.697 567 HG2 LYS 66 2HG LYS 66 -2.629 -12.933 4.937 568 HG3 LYS 66 3HG LYS 66 -4.159 -13.805 5.060 569 HD2 LYS 66 2HD LYS 66 -3.442 -15.120 3.021 570 HD3 LYS 66 3HD LYS 66 -1.852 -14.377 3.194 571 HE2 LYS 66 2HE LYS 66 -1.909 -16.589 4.227 572 HE3 LYS 66 3HE LYS 66 -1.647 -15.332 5.438 573 HZ1 LYS 66 3HZ LYS 66 -3.287 -17.068 6.078 574 HZ2 LYS 66 1HZ LYS 66 -4.304 -16.518 4.847 575 HZ3 LYS 66 2HZ LYS 66 -3.903 -15.496 6.138 576 H ALA 67 H ALA 67 -3.409 -9.515 2.740 577 HA ALA 67 HA ALA 67 -1.462 -8.802 4.631 578 HB1 ALA 67 3HB ALA 67 -2.672 -7.033 2.498 579 HB2 ALA 67 1HB ALA 67 -1.364 -8.191 2.240 580 HB3 ALA 67 2HB ALA 67 -1.116 -6.801 3.298 581 H ILE 68 H ILE 68 -4.565 -7.188 3.889 582 HA ILE 68 HA ILE 68 -4.482 -5.307 5.994 583 HB ILE 68 HB ILE 68 -6.947 -6.513 4.706 584 HG12 ILE 68 2HG1 ILE 68 -5.441 -5.598 3.004 585 HG13 ILE 68 3HG1 ILE 68 -6.866 -4.578 3.170 586 HG21 ILE 68 1HG2 ILE 68 -7.463 -5.298 6.755 587 HG22 ILE 68 2HG2 ILE 68 -8.051 -4.413 5.347 588 HG23 ILE 68 3HG2 ILE 68 -6.577 -3.892 6.164 589 HD11 ILE 68 3HD1 ILE 68 -4.878 -3.236 2.918 590 HD12 ILE 68 1HD1 ILE 68 -4.135 -4.023 4.310 591 HD13 ILE 68 2HD1 ILE 68 -5.559 -3.005 4.528 592 H ARG 69 H ARG 69 -5.529 -8.645 5.869 593 HA ARG 69 HA ARG 69 -6.959 -8.815 8.277 594 HB2 ARG 69 2HB ARG 69 -6.905 -10.542 6.461 595 HB3 ARG 69 3HB ARG 69 -5.284 -10.981 6.976 596 HG2 ARG 69 2HG ARG 69 -6.879 -12.560 7.846 597 HG3 ARG 69 3HG ARG 69 -6.177 -11.636 9.176 598 HD2 ARG 69 2HD ARG 69 -8.607 -11.936 9.432 599 HD3 ARG 69 3HD ARG 69 -8.155 -10.238 9.294 600 HE ARG 69 HE ARG 69 -8.771 -10.953 6.742 601 HH11 ARG 69 1HH1 ARG 69 -10.465 -11.185 9.739 602 HH12 ARG 69 2HH1 ARG 69 -12.013 -10.984 8.996 603 HH21 ARG 69 1HH2 ARG 69 -10.752 -10.693 5.818 604 HH22 ARG 69 2HH2 ARG 69 -12.180 -10.713 6.796 605 H PHE 70 H PHE 70 -3.511 -8.780 7.643 606 HA PHE 70 HA PHE 70 -2.809 -9.395 10.397 607 HB2 PHE 70 2HB PHE 70 -1.358 -10.018 8.433 608 HB3 PHE 70 3HB PHE 70 -1.037 -8.306 8.188 609 HD1 PHE 70 HD1 PHE 70 -0.422 -11.210 10.345 610 HD2 PHE 70 HD2 PHE 70 0.445 -7.090 9.681 611 HE1 PHE 70 HE1 PHE 70 1.450 -11.349 11.934 612 HE2 PHE 70 HE2 PHE 70 2.318 -7.228 11.269 613 HZ PHE 70 HZ PHE 70 2.822 -9.357 12.399 614 H VAL 71 H VAL 71 -2.903 -6.551 8.283 615 HA VAL 71 HA VAL 71 -1.762 -4.642 9.970 616 HB VAL 71 HB VAL 71 -3.913 -4.266 7.868 617 HG11 VAL 71 1HG1 VAL 71 -3.174 -1.927 7.750 618 HG12 VAL 71 2HG1 VAL 71 -2.083 -2.203 9.109 619 HG13 VAL 71 3HG1 VAL 71 -3.827 -2.322 9.342 620 HG21 VAL 71 3HG2 VAL 71 -1.879 -5.312 7.005 621 HG22 VAL 71 1HG2 VAL 71 -0.905 -4.007 7.684 622 HG23 VAL 71 2HG2 VAL 71 -2.053 -3.671 6.386 623 H LYS 72 H LYS 72 -5.013 -5.962 10.011 624 HA LYS 72 HA LYS 72 -6.387 -3.951 11.368 625 HB2 LYS 72 2HB LYS 72 -8.024 -5.615 11.963 626 HB3 LYS 72 3HB LYS 72 -7.444 -5.950 10.336 627 HG2 LYS 72 2HG LYS 72 -6.009 -7.721 11.186 628 HG3 LYS 72 3HG LYS 72 -6.519 -7.361 12.837 629 HD2 LYS 72 2HD LYS 72 -8.844 -7.936 12.215 630 HD3 LYS 72 3HD LYS 72 -8.289 -8.354 10.593 631 HE2 LYS 72 2HE LYS 72 -8.536 -10.357 11.939 632 HE3 LYS 72 3HE LYS 72 -6.839 -10.095 11.553 633 HZ1 LYS 72 3HZ LYS 72 -7.147 -10.742 13.858 634 HZ2 LYS 72 1HZ LYS 72 -8.149 -9.409 14.131 635 HZ3 LYS 72 2HZ LYS 72 -6.515 -9.178 13.765 636 H SER 73 H SER 73 -3.910 -5.988 12.592 637 HA SER 73 HA SER 73 -4.761 -5.959 15.349 638 HB2 SER 73 2HB SER 73 -3.389 -7.803 14.429 639 HB3 SER 73 3HB SER 73 -2.055 -6.676 14.189 640 HG SER 73 HG SER 73 -1.781 -6.503 16.349 641 H LEU 74 H LEU 74 -3.013 -3.773 13.342 642 HA LEU 74 HA LEU 74 -1.191 -2.666 15.170 643 HB2 LEU 74 2HB LEU 74 -2.560 -1.357 12.813 644 HB3 LEU 74 3HB LEU 74 -1.171 -0.696 13.657 645 HG LEU 74 HG LEU 74 -1.217 -3.295 12.106 646 HD11 LEU 74 1HD1 LEU 74 0.271 -2.118 10.543 647 HD12 LEU 74 2HD1 LEU 74 0.049 -0.628 11.463 648 HD13 LEU 74 3HD1 LEU 74 -1.322 -1.368 10.634 649 HD21 LEU 74 3HD2 LEU 74 1.071 -1.893 13.497 650 HD22 LEU 74 1HD2 LEU 74 1.204 -3.327 12.479 651 HD23 LEU 74 2HD2 LEU 74 0.318 -3.407 14.000 652 H GLY 75 H GLY 75 -4.571 -1.807 14.523 653 HA2 GLY 75 2HA GLY 75 -6.058 -0.449 15.636 654 HA3 GLY 75 3HA GLY 75 -5.155 -0.882 17.076 655 H ALA 76 H ALA 76 -4.740 1.257 14.232 656 HA ALA 76 HA ALA 76 -4.472 3.597 15.874 657 HB1 ALA 76 3HB ALA 76 -1.991 2.579 14.480 658 HB2 ALA 76 1HB ALA 76 -2.258 2.603 16.224 659 HB3 ALA 76 2HB ALA 76 -2.147 4.117 15.329 660 H GLN 77 H GLN 77 -3.818 5.545 14.504 661 HA GLN 77 HA GLN 77 -5.353 5.613 12.111 662 HB2 GLN 77 2HB GLN 77 -3.320 7.617 13.127 663 HB3 GLN 77 3HB GLN 77 -4.499 7.912 11.857 664 HG2 GLN 77 2HG GLN 77 -6.311 7.547 13.504 665 HG3 GLN 77 3HG GLN 77 -5.089 7.360 14.762 666 HE21 GLN 77 1HE2 GLN 77 -3.889 9.172 15.405 667 HE22 GLN 77 2HE2 GLN 77 -4.418 10.778 15.059 668 H VAL 78 H VAL 78 -4.692 4.452 10.386 669 HA VAL 78 HA VAL 78 -1.980 4.964 9.357 670 HB VAL 78 HB VAL 78 -1.779 2.645 8.588 671 HG11 VAL 78 1HG1 VAL 78 -0.816 3.221 10.744 672 HG12 VAL 78 2HG1 VAL 78 -1.426 1.567 10.772 673 HG13 VAL 78 3HG1 VAL 78 -2.343 2.858 11.549 674 HG21 VAL 78 3HG2 VAL 78 -4.369 2.163 10.070 675 HG22 VAL 78 1HG2 VAL 78 -3.336 0.910 9.380 676 HG23 VAL 78 2HG2 VAL 78 -4.132 2.077 8.324 677 H LEU 79 H LEU 79 -1.837 5.383 7.212 678 HA LEU 79 HA LEU 79 -4.332 5.475 5.674 679 HB2 LEU 79 2HB LEU 79 -1.631 6.758 5.234 680 HB3 LEU 79 3HB LEU 79 -2.908 6.805 4.038 681 HG LEU 79 HG LEU 79 -2.876 8.894 5.234 682 HD11 LEU 79 1HD1 LEU 79 -5.065 8.083 4.573 683 HD12 LEU 79 2HD1 LEU 79 -5.169 8.983 6.087 684 HD13 LEU 79 3HD1 LEU 79 -5.231 7.220 6.104 685 HD21 LEU 79 3HD2 LEU 79 -3.264 9.049 7.644 686 HD22 LEU 79 1HD2 LEU 79 -1.776 8.174 7.285 687 HD23 LEU 79 2HD2 LEU 79 -3.224 7.290 7.770 688 H ILE 80 H ILE 80 -4.748 4.109 4.047 689 HA ILE 80 HA ILE 80 -2.554 2.387 3.062 690 HB ILE 80 HB ILE 80 -5.513 1.746 3.237 691 HG12 ILE 80 2HG1 ILE 80 -3.157 0.622 4.784 692 HG13 ILE 80 3HG1 ILE 80 -4.349 1.748 5.425 693 HG21 ILE 80 1HG2 ILE 80 -4.868 -0.517 2.512 694 HG22 ILE 80 2HG2 ILE 80 -3.207 0.035 2.288 695 HG23 ILE 80 3HG2 ILE 80 -4.499 0.696 1.286 696 HD11 ILE 80 3HD1 ILE 80 -6.092 0.059 5.133 697 HD12 ILE 80 1HD1 ILE 80 -4.783 -0.523 6.163 698 HD13 ILE 80 2HD1 ILE 80 -4.894 -1.064 4.488 699 H ILE 81 H ILE 81 -2.063 2.545 0.945 700 HA ILE 81 HA ILE 81 -3.985 3.906 -0.846 701 HB ILE 81 HB ILE 81 -0.973 3.731 -1.131 702 HG12 ILE 81 2HG1 ILE 81 -2.738 6.079 -0.355 703 HG13 ILE 81 3HG1 ILE 81 -1.650 5.210 0.721 704 HG21 ILE 81 1HG2 ILE 81 -2.073 3.821 -3.295 705 HG22 ILE 81 2HG2 ILE 81 -1.288 5.364 -2.960 706 HG23 ILE 81 3HG2 ILE 81 -3.035 5.207 -2.778 707 HD11 ILE 81 3HD1 ILE 81 -0.847 6.860 -1.668 708 HD12 ILE 81 1HD1 ILE 81 0.258 5.957 -0.629 709 HD13 ILE 81 2HD1 ILE 81 -0.669 7.303 0.031 710 H ILE 82 H ILE 82 -4.942 2.601 -2.292 711 HA ILE 82 HA ILE 82 -3.597 0.070 -3.011 712 HB ILE 82 HB ILE 82 -6.543 0.759 -3.171 713 HG12 ILE 82 2HG1 ILE 82 -5.035 -1.060 -1.263 714 HG13 ILE 82 3HG1 ILE 82 -5.720 0.509 -0.849 715 HG21 ILE 82 1HG2 ILE 82 -5.893 -0.834 -4.904 716 HG22 ILE 82 2HG2 ILE 82 -6.853 -1.638 -3.664 717 HG23 ILE 82 3HG2 ILE 82 -5.103 -1.851 -3.700 718 HD11 ILE 82 3HD1 ILE 82 -7.958 -0.355 -1.305 719 HD12 ILE 82 1HD1 ILE 82 -7.127 -1.299 -0.067 720 HD13 ILE 82 2HD1 ILE 82 -7.265 -1.926 -1.708 721 H TYR 83 H TYR 83 -2.831 -0.152 -5.001 722 HA TYR 83 HA TYR 83 -3.841 1.571 -7.166 723 HB2 TYR 83 2HB TYR 83 -1.497 1.880 -6.969 724 HB3 TYR 83 3HB TYR 83 -1.203 0.155 -6.768 725 HD1 TYR 83 HD2 TYR 83 -2.438 2.641 -9.276 726 HD2 TYR 83 HD1 TYR 83 -0.601 -1.152 -8.625 727 HE1 TYR 83 HE2 TYR 83 -2.050 2.413 -11.692 728 HE2 TYR 83 HE1 TYR 83 -0.215 -1.384 -11.042 729 HH TYR 83 HH TYR 83 -0.792 1.252 -13.261 730 H ASP 84 H ASP 84 -5.246 0.654 -8.500 731 HA ASP 84 HA ASP 84 -4.726 -2.097 -9.424 732 HB2 ASP 84 2HB ASP 84 -6.656 -2.225 -7.959 733 HB3 ASP 84 3HB ASP 84 -7.422 -0.875 -8.788 734 H GLN 85 H GLN 85 -5.591 -2.545 -11.582 735 HA GLN 85 HA GLN 85 -4.942 -0.315 -13.328 736 HB2 GLN 85 2HB GLN 85 -5.476 -3.236 -13.903 737 HB3 GLN 85 3HB GLN 85 -4.929 -2.059 -15.096 738 HG2 GLN 85 2HG GLN 85 -2.858 -1.740 -13.917 739 HG3 GLN 85 3HG GLN 85 -3.414 -2.742 -12.577 740 HE21 GLN 85 1HE2 GLN 85 -3.467 -4.973 -12.823 741 HE22 GLN 85 2HE2 GLN 85 -2.631 -5.772 -14.108 742 H ASP 86 H ASP 86 -7.756 -1.262 -11.946 743 HA ASP 86 HA ASP 86 -9.336 -0.100 -14.160 744 HB2 ASP 86 2HB ASP 86 -10.225 -2.210 -12.170 745 HB3 ASP 86 3HB ASP 86 -11.274 -1.431 -13.351 746 H GLN 87 H GLN 87 -11.638 0.549 -13.025 747 HA GLN 87 HA GLN 87 -10.964 2.238 -10.701 748 HB2 GLN 87 2HB GLN 87 -13.229 2.478 -12.698 749 HB3 GLN 87 3HB GLN 87 -13.014 3.528 -11.303 750 HG2 GLN 87 2HG GLN 87 -10.841 4.258 -12.223 751 HG3 GLN 87 3HG GLN 87 -11.132 3.256 -13.645 752 HE21 GLN 87 1HE2 GLN 87 -10.790 6.160 -13.424 753 HE22 GLN 87 2HE2 GLN 87 -12.213 6.848 -14.116 754 H ASN 88 H ASN 88 -13.686 0.295 -11.974 755 HA ASN 88 HA ASN 88 -15.182 0.194 -9.604 756 HB2 ASN 88 2HB ASN 88 -16.068 -0.426 -11.830 757 HB3 ASN 88 3HB ASN 88 -15.056 -1.868 -11.826 758 HD21 ASN 88 1HD2 ASN 88 -16.834 -0.553 -9.080 759 HD22 ASN 88 2HD2 ASN 88 -17.914 -1.890 -8.921 760 H ARG 89 H ARG 89 -12.954 -2.260 -10.926 761 HA ARG 89 HA ARG 89 -12.923 -4.098 -8.853 762 HB2 ARG 89 2HB ARG 89 -10.705 -3.178 -10.694 763 HB3 ARG 89 3HB ARG 89 -10.558 -4.576 -9.640 764 HG2 ARG 89 2HG ARG 89 -12.877 -4.462 -11.509 765 HG3 ARG 89 3HG ARG 89 -11.277 -4.807 -12.169 766 HD2 ARG 89 2HD ARG 89 -12.594 -6.328 -9.912 767 HD3 ARG 89 3HD ARG 89 -12.525 -6.855 -11.595 768 HE ARG 89 HE ARG 89 -9.930 -6.287 -10.597 769 HH11 ARG 89 1HH1 ARG 89 -12.411 -8.682 -10.485 770 HH12 ARG 89 2HH1 ARG 89 -11.291 -9.971 -10.199 771 HH21 ARG 89 1HH2 ARG 89 -8.525 -7.950 -10.234 772 HH22 ARG 89 2HH2 ARG 89 -9.122 -9.563 -10.065 773 H LEU 90 H LEU 90 -10.749 -1.320 -9.281 774 HA LEU 90 HA LEU 90 -9.249 -1.412 -6.993 775 HB2 LEU 90 2HB LEU 90 -8.885 0.166 -8.803 776 HB3 LEU 90 3HB LEU 90 -10.381 0.993 -8.424 777 HG LEU 90 HG LEU 90 -9.446 1.778 -6.309 778 HD11 LEU 90 1HD1 LEU 90 -7.978 -0.110 -5.817 779 HD12 LEU 90 2HD1 LEU 90 -7.100 1.416 -5.750 780 HD13 LEU 90 3HD1 LEU 90 -6.919 0.357 -7.149 781 HD21 LEU 90 3HD2 LEU 90 -7.652 2.307 -8.684 782 HD22 LEU 90 1HD2 LEU 90 -7.748 3.299 -7.227 783 HD23 LEU 90 2HD2 LEU 90 -9.148 3.157 -8.289 784 H GLU 91 H GLU 91 -12.345 0.371 -7.324 785 HA GLU 91 HA GLU 91 -12.392 1.038 -4.535 786 HB2 GLU 91 2HB GLU 91 -14.548 1.315 -6.638 787 HB3 GLU 91 3HB GLU 91 -14.621 1.998 -5.018 788 HG2 GLU 91 2HG GLU 91 -12.507 3.258 -5.570 789 HG3 GLU 91 3HG GLU 91 -12.717 2.727 -7.236 790 H GLU 92 H GLU 92 -13.448 -1.704 -6.311 791 HA GLU 92 HA GLU 92 -15.546 -2.662 -4.713 792 HB2 GLU 92 2HB GLU 92 -14.922 -3.688 -6.854 793 HB3 GLU 92 3HB GLU 92 -13.388 -4.213 -6.174 794 HG2 GLU 92 2HG GLU 92 -14.719 -5.578 -4.517 795 HG3 GLU 92 3HG GLU 92 -16.146 -5.197 -5.479 796 H PHE 93 H PHE 93 -12.074 -3.484 -4.518 797 HA PHE 93 HA PHE 93 -12.320 -4.817 -1.999 798 HB2 PHE 93 2HB PHE 93 -10.557 -5.409 -3.597 799 HB3 PHE 93 3HB PHE 93 -9.860 -3.800 -3.450 800 HD1 PHE 93 HD1 PHE 93 -10.839 -6.680 -1.273 801 HD2 PHE 93 HD2 PHE 93 -8.054 -3.542 -2.029 802 HE1 PHE 93 HE1 PHE 93 -9.453 -7.460 0.604 803 HE2 PHE 93 HE2 PHE 93 -6.666 -4.322 -0.154 804 HZ PHE 93 HZ PHE 93 -7.366 -6.281 1.166 805 H SER 94 H SER 94 -11.293 -1.569 -2.977 806 HA SER 94 HA SER 94 -10.282 -0.656 -0.535 807 HB2 SER 94 2HB SER 94 -11.698 0.907 -2.711 808 HB3 SER 94 3HB SER 94 -10.793 1.637 -1.386 809 HG SER 94 HG SER 94 -9.881 0.347 -3.661 810 H ARG 95 H ARG 95 -13.641 -0.775 -1.678 811 HA ARG 95 HA ARG 95 -14.901 0.637 0.362 812 HB2 ARG 95 2HB ARG 95 -16.067 -0.217 -1.630 813 HB3 ARG 95 3HB ARG 95 -15.881 -1.862 -1.050 814 HG2 ARG 95 2HG ARG 95 -17.336 0.130 0.651 815 HG3 ARG 95 3HG ARG 95 -18.147 -0.575 -0.746 816 HD2 ARG 95 2HD ARG 95 -17.694 -2.827 0.154 817 HD3 ARG 95 3HD ARG 95 -16.927 -2.101 1.563 818 HE ARG 95 HE ARG 95 -19.437 -1.012 1.503 819 HH11 ARG 95 1HH1 ARG 95 -18.195 -4.225 1.564 820 HH12 ARG 95 2HH1 ARG 95 -19.533 -4.843 2.464 821 HH21 ARG 95 1HH2 ARG 95 -21.148 -1.823 2.660 822 HH22 ARG 95 2HH2 ARG 95 -21.189 -3.504 3.073 823 H GLU 96 H GLU 96 -13.950 -2.793 0.310 824 HA GLU 96 HA GLU 96 -14.934 -3.495 2.848 825 HB2 GLU 96 2HB GLU 96 -12.575 -4.630 1.320 826 HB3 GLU 96 3HB GLU 96 -13.300 -5.377 2.738 827 HG2 GLU 96 2HG GLU 96 -14.611 -4.927 0.062 828 HG3 GLU 96 3HG GLU 96 -14.102 -6.469 0.750 829 H VAL 97 H VAL 97 -11.653 -2.463 1.890 830 HA VAL 97 HA VAL 97 -10.457 -2.500 4.409 831 HB VAL 97 HB VAL 97 -9.883 -0.554 2.156 832 HG11 VAL 97 1HG1 VAL 97 -7.617 -0.441 3.129 833 HG12 VAL 97 2HG1 VAL 97 -8.159 -1.441 4.476 834 HG13 VAL 97 3HG1 VAL 97 -8.851 0.162 4.238 835 HG21 VAL 97 3HG2 VAL 97 -9.784 -2.870 1.388 836 HG22 VAL 97 1HG2 VAL 97 -8.701 -3.282 2.721 837 HG23 VAL 97 2HG2 VAL 97 -8.166 -2.169 1.458 838 H ARG 98 H ARG 98 -12.163 0.185 2.795 839 HA ARG 98 HA ARG 98 -11.846 2.094 4.828 840 HB2 ARG 98 2HB ARG 98 -12.593 2.622 2.525 841 HB3 ARG 98 3HB ARG 98 -14.134 1.842 2.857 842 HG2 ARG 98 2HG ARG 98 -14.435 4.206 3.058 843 HG3 ARG 98 3HG ARG 98 -14.518 3.506 4.676 844 HD2 ARG 98 2HD ARG 98 -12.026 4.082 4.858 845 HD3 ARG 98 3HD ARG 98 -12.278 5.087 3.429 846 HE ARG 98 HE ARG 98 -13.933 5.495 5.822 847 HH11 ARG 98 1HH1 ARG 98 -11.695 6.735 3.508 848 HH12 ARG 98 2HH1 ARG 98 -11.697 8.314 4.209 849 HH21 ARG 98 1HH2 ARG 98 -13.934 7.525 6.688 850 HH22 ARG 98 2HH2 ARG 98 -12.944 8.758 5.985 851 H ARG 99 H ARG 99 -14.364 -0.358 4.333 852 HA ARG 99 HA ARG 99 -16.018 0.548 6.484 853 HB2 ARG 99 2HB ARG 99 -15.977 -2.041 4.932 854 HB3 ARG 99 3HB ARG 99 -17.179 -1.666 6.157 855 HG2 ARG 99 2HG ARG 99 -16.713 0.043 3.715 856 HG3 ARG 99 3HG ARG 99 -17.890 -1.268 3.780 857 HD2 ARG 99 2HD ARG 99 -19.023 0.816 4.198 858 HD3 ARG 99 3HD ARG 99 -18.997 -0.127 5.687 859 HE ARG 99 HE ARG 99 -16.961 1.943 5.294 860 HH11 ARG 99 1HH1 ARG 99 -19.780 0.837 6.936 861 HH12 ARG 99 2HH1 ARG 99 -19.660 2.030 8.182 862 HH21 ARG 99 1HH2 ARG 99 -16.798 3.458 6.921 863 HH22 ARG 99 2HH2 ARG 99 -17.984 3.487 8.179 864 H ARG 100 H ARG 100 -13.099 -1.148 6.493 865 HA ARG 100 HA ARG 100 -13.600 -2.435 9.071 866 HB2 ARG 100 2HB ARG 100 -11.079 -2.258 7.397 867 HB3 ARG 100 3HB ARG 100 -11.228 -3.166 8.897 868 HG2 ARG 100 2HG ARG 100 -12.952 -4.580 7.856 869 HG3 ARG 100 3HG ARG 100 -12.762 -3.682 6.351 870 HD2 ARG 100 2HD ARG 100 -10.371 -4.375 6.302 871 HD3 ARG 100 3HD ARG 100 -10.669 -5.371 7.729 872 HE ARG 100 HE ARG 100 -12.462 -5.954 5.577 873 HH11 ARG 100 1HH1 ARG 100 -9.326 -6.639 6.844 874 HH12 ARG 100 2HH1 ARG 100 -9.187 -8.124 5.969 875 HH21 ARG 100 1HH2 ARG 100 -12.264 -7.853 4.480 876 HH22 ARG 100 2HH2 ARG 100 -10.824 -8.798 4.661 877 H GLY 101 H GLY 101 -13.202 0.651 8.234 878 HA2 GLY 101 2HA GLY 101 -12.961 2.389 9.822 879 HA3 GLY 101 3HA GLY 101 -11.997 1.325 10.825 880 H PHE 102 H PHE 102 -10.696 0.843 7.907 881 HA PHE 102 HA PHE 102 -8.510 2.691 8.458 882 HB2 PHE 102 2HB PHE 102 -8.733 0.386 6.509 883 HB3 PHE 102 3HB PHE 102 -7.281 1.357 6.748 884 HD1 PHE 102 HD1 PHE 102 -6.438 1.514 9.221 885 HD2 PHE 102 HD2 PHE 102 -8.980 -1.570 7.743 886 HE1 PHE 102 HE1 PHE 102 -5.749 0.061 11.082 887 HE2 PHE 102 HE2 PHE 102 -8.288 -3.032 9.601 888 HZ PHE 102 HZ PHE 102 -6.673 -2.212 11.274 889 H GLU 103 H GLU 103 -8.380 4.596 7.490 890 HA GLU 103 HA GLU 103 -10.047 5.319 5.288 891 HB2 GLU 103 2HB GLU 103 -7.766 6.821 6.604 892 HB3 GLU 103 3HB GLU 103 -8.882 7.511 5.429 893 HG2 GLU 103 2HG GLU 103 -10.754 7.073 6.951 894 HG3 GLU 103 3HG GLU 103 -9.635 6.394 8.129 895 H VAL 104 H VAL 104 -9.599 4.172 3.492 896 HA VAL 104 HA VAL 104 -6.861 3.990 2.480 897 HB VAL 104 HB VAL 104 -8.148 1.922 2.560 898 HG11 VAL 104 1HG1 VAL 104 -10.397 2.869 2.339 899 HG12 VAL 104 2HG1 VAL 104 -10.131 1.566 1.180 900 HG13 VAL 104 3HG1 VAL 104 -10.078 3.247 0.645 901 HG21 VAL 104 3HG2 VAL 104 -6.484 2.196 0.764 902 HG22 VAL 104 1HG2 VAL 104 -7.745 2.816 -0.302 903 HG23 VAL 104 2HG2 VAL 104 -7.815 1.149 0.273 904 H ARG 105 H ARG 105 -6.203 4.773 0.485 905 HA ARG 105 HA ARG 105 -8.091 6.505 -0.973 906 HB2 ARG 105 2HB ARG 105 -5.172 6.754 -0.413 907 HB3 ARG 105 3HB ARG 105 -5.745 7.343 -1.966 908 HG2 ARG 105 2HG ARG 105 -6.651 8.254 0.766 909 HG3 ARG 105 3HG ARG 105 -5.690 9.163 -0.405 910 HD2 ARG 105 2HD ARG 105 -8.593 8.377 -0.572 911 HD3 ARG 105 3HD ARG 105 -7.897 9.996 -0.607 912 HE ARG 105 HE ARG 105 -6.842 8.918 -2.815 913 HH11 ARG 105 1HH1 ARG 105 -10.084 9.039 -1.648 914 HH12 ARG 105 2HH1 ARG 105 -10.766 8.896 -3.229 915 HH21 ARG 105 1HH2 ARG 105 -7.745 8.715 -4.829 916 HH22 ARG 105 2HH2 ARG 105 -9.469 8.717 -4.999 917 H THR 106 H THR 106 -8.511 6.144 -3.064 918 HA THR 106 HA THR 106 -7.385 3.740 -4.309 919 HB THR 106 HB THR 106 -9.252 3.940 -5.914 920 HG1 THR 106 HG1 THR 106 -9.482 6.238 -5.847 921 HG21 THR 106 3HG2 THR 106 -10.173 4.164 -3.040 922 HG22 THR 106 1HG2 THR 106 -9.598 2.689 -3.820 923 HG23 THR 106 2HG2 THR 106 -11.085 3.458 -4.375 924 H VAL 107 H VAL 107 -5.788 3.936 -5.776 925 HA VAL 107 HA VAL 107 -5.653 6.417 -7.386 926 HB VAL 107 HB VAL 107 -3.204 6.109 -7.532 927 HG11 VAL 107 1HG1 VAL 107 -4.302 6.325 -4.723 928 HG12 VAL 107 2HG1 VAL 107 -4.109 7.642 -5.882 929 HG13 VAL 107 3HG1 VAL 107 -2.686 6.829 -5.228 930 HG21 VAL 107 3HG2 VAL 107 -3.608 3.938 -5.463 931 HG22 VAL 107 1HG2 VAL 107 -2.056 4.566 -6.019 932 HG23 VAL 107 2HG2 VAL 107 -3.103 3.690 -7.133 933 H THR 108 H THR 108 -5.434 6.251 -9.556 934 HA THR 108 HA THR 108 -5.851 3.581 -10.707 935 HB THR 108 HB THR 108 -6.613 4.832 -12.728 936 HG1 THR 108 HG1 THR 108 -6.619 7.017 -12.730 937 HG21 THR 108 3HG2 THR 108 -7.971 5.591 -10.127 938 HG22 THR 108 1HG2 THR 108 -8.275 4.139 -11.083 939 HG23 THR 108 2HG2 THR 108 -8.699 5.726 -11.729 940 H SER 109 H SER 109 -3.926 6.524 -11.388 941 HA SER 109 HA SER 109 -2.080 4.838 -12.975 942 HB2 SER 109 2HB SER 109 -2.747 7.764 -13.405 943 HB3 SER 109 3HB SER 109 -1.602 6.820 -14.358 944 HG SER 109 HG SER 109 -4.392 6.786 -14.352 945 HA PRO 110 HA PRO 110 1.491 5.848 -10.536 946 HB2 PRO 110 2HB PRO 110 2.607 7.072 -13.040 947 HB3 PRO 110 3HB PRO 110 3.361 5.941 -11.908 948 HG2 PRO 110 2HG PRO 110 2.405 5.065 -14.225 949 HG3 PRO 110 3HG PRO 110 2.184 4.113 -12.744 950 HD2 PRO 110 2HD PRO 110 0.206 5.768 -14.249 951 HD3 PRO 110 3HD PRO 110 -0.040 4.266 -13.332 952 H ASP 111 H ASP 111 0.573 8.478 -12.798 953 HA ASP 111 HA ASP 111 1.720 10.559 -11.267 954 HB2 ASP 111 2HB ASP 111 -0.497 10.616 -13.321 955 HB3 ASP 111 3HB ASP 111 0.259 12.057 -12.641 956 H ASP 112 H ASP 112 -1.615 9.296 -11.345 957 HA ASP 112 HA ASP 112 -2.747 11.052 -9.476 958 HB2 ASP 112 2HB ASP 112 -3.405 8.132 -9.978 959 HB3 ASP 112 3HB ASP 112 -4.436 9.272 -9.118 960 H PHE 113 H PHE 113 -1.298 7.839 -8.954 961 HA PHE 113 HA PHE 113 -1.352 7.723 -6.176 962 HB2 PHE 113 2HB PHE 113 -0.715 5.779 -7.402 963 HB3 PHE 113 3HB PHE 113 0.603 6.625 -8.203 964 HD1 PHE 113 HD1 PHE 113 -0.527 5.497 -4.835 965 HD2 PHE 113 HD2 PHE 113 2.766 6.442 -7.367 966 HE1 PHE 113 HE1 PHE 113 1.028 4.680 -3.117 967 HE2 PHE 113 HE2 PHE 113 4.324 5.625 -5.649 968 HZ PHE 113 HZ PHE 113 3.456 4.744 -3.521 969 H LYS 114 H LYS 114 1.216 8.996 -8.256 970 HA LYS 114 HA LYS 114 3.072 9.769 -6.346 971 HB2 LYS 114 2HB LYS 114 3.601 9.661 -8.683 972 HB3 LYS 114 3HB LYS 114 2.403 10.883 -9.068 973 HG2 LYS 114 2HG LYS 114 3.740 12.591 -7.994 974 HG3 LYS 114 3HG LYS 114 4.912 11.377 -7.467 975 HD2 LYS 114 2HD LYS 114 5.633 12.622 -9.502 976 HD3 LYS 114 3HD LYS 114 5.509 10.880 -9.758 977 HE2 LYS 114 2HE LYS 114 3.220 11.273 -10.719 978 HE3 LYS 114 3HE LYS 114 3.539 13.004 -10.617 979 HZ1 LYS 114 3HZ LYS 114 5.201 11.079 -12.145 980 HZ2 LYS 114 1HZ LYS 114 5.351 12.764 -12.138 981 HZ3 LYS 114 2HZ LYS 114 3.984 12.040 -12.823 982 H LYS 115 H LYS 115 0.721 11.942 -7.960 983 HA LYS 115 HA LYS 115 1.313 14.185 -6.352 984 HB2 LYS 115 2HB LYS 115 -1.141 13.565 -8.004 985 HB3 LYS 115 3HB LYS 115 -0.796 15.135 -7.284 986 HG2 LYS 115 2HG LYS 115 1.260 15.287 -8.613 987 HG3 LYS 115 3HG LYS 115 0.899 13.721 -9.342 988 HD2 LYS 115 2HD LYS 115 -0.857 16.172 -9.530 989 HD3 LYS 115 3HD LYS 115 0.255 15.623 -10.785 990 HE2 LYS 115 2HE LYS 115 -0.995 13.533 -10.994 991 HE3 LYS 115 3HE LYS 115 -2.088 14.043 -9.707 992 HZ1 LYS 115 3HZ LYS 115 -2.979 14.392 -11.957 993 HZ2 LYS 115 1HZ LYS 115 -1.732 15.488 -12.270 994 HZ3 LYS 115 2HZ LYS 115 -2.874 15.824 -11.066 995 H SER 116 H SER 116 -1.144 11.647 -6.003 996 HA SER 116 HA SER 116 -2.546 12.827 -3.841 997 HB2 SER 116 2HB SER 116 -2.199 9.914 -4.596 998 HB3 SER 116 3HB SER 116 -3.294 10.477 -3.334 999 HG SER 116 HG SER 116 -3.391 11.165 -6.097 1000 H LEU 117 H LEU 117 0.128 10.477 -3.900 1001 HA LEU 117 HA LEU 117 0.384 10.044 -1.162 1002 HB2 LEU 117 2HB LEU 117 1.530 8.684 -2.829 1003 HB3 LEU 117 3HB LEU 117 2.522 10.051 -3.298 1004 HG LEU 117 HG LEU 117 3.586 10.037 -1.063 1005 HD11 LEU 117 1HD1 LEU 117 1.951 7.541 -0.600 1006 HD12 LEU 117 2HD1 LEU 117 1.758 9.083 0.233 1007 HD13 LEU 117 3HD1 LEU 117 3.235 8.146 0.448 1008 HD21 LEU 117 3HD2 LEU 117 4.913 8.012 -1.376 1009 HD22 LEU 117 1HD2 LEU 117 4.617 8.814 -2.918 1010 HD23 LEU 117 2HD2 LEU 117 3.699 7.372 -2.484 1011 H GLU 118 H GLU 118 2.202 12.386 -3.168 1012 HA GLU 118 HA GLU 118 3.731 13.526 -1.146 1013 HB2 GLU 118 2HB GLU 118 2.649 14.875 -3.631 1014 HB3 GLU 118 3HB GLU 118 3.962 15.488 -2.633 1015 HG2 GLU 118 2HG GLU 118 5.213 13.368 -3.140 1016 HG3 GLU 118 3HG GLU 118 3.943 12.975 -4.296 1017 H ARG 119 H ARG 119 0.394 14.253 -2.046 1018 HA ARG 119 HA ARG 119 0.185 16.478 -0.218 1019 HB2 ARG 119 2HB ARG 119 -1.842 14.950 -1.846 1020 HB3 ARG 119 3HB ARG 119 -2.312 16.214 -0.716 1021 HG2 ARG 119 2HG ARG 119 -0.984 17.842 -1.945 1022 HG3 ARG 119 3HG ARG 119 -0.449 16.582 -3.059 1023 HD2 ARG 119 2HD ARG 119 -3.337 17.358 -2.646 1024 HD3 ARG 119 3HD ARG 119 -2.308 18.018 -3.918 1025 HE ARG 119 HE ARG 119 -2.093 15.688 -4.738 1026 HH11 ARG 119 1HH1 ARG 119 -4.765 16.480 -2.702 1027 HH12 ARG 119 2HH1 ARG 119 -5.808 15.313 -3.433 1028 HH21 ARG 119 1HH2 ARG 119 -3.455 14.187 -5.666 1029 HH22 ARG 119 2HH2 ARG 119 -5.076 14.039 -5.092 1030 H LEU 120 H LEU 120 -0.601 13.028 -0.110 1031 HA LEU 120 HA LEU 120 -2.040 13.083 2.334 1032 HB2 LEU 120 2HB LEU 120 -0.482 10.859 1.013 1033 HB3 LEU 120 3HB LEU 120 -1.464 10.632 2.448 1034 HG LEU 120 HG LEU 120 -2.475 11.494 -0.270 1035 HD11 LEU 120 1HD1 LEU 120 -1.811 9.141 -0.185 1036 HD12 LEU 120 2HD1 LEU 120 -3.557 9.316 -0.338 1037 HD13 LEU 120 3HD1 LEU 120 -2.848 8.894 1.221 1038 HD21 LEU 120 3HD2 LEU 120 -4.712 11.260 0.706 1039 HD22 LEU 120 1HD2 LEU 120 -3.779 12.521 1.511 1040 HD23 LEU 120 2HD2 LEU 120 -3.993 10.950 2.288 1041 H ILE 121 H ILE 121 1.383 12.961 1.598 1042 HA ILE 121 HA ILE 121 2.462 12.309 4.080 1043 HB ILE 121 HB ILE 121 3.512 14.343 2.089 1044 HG12 ILE 121 2HG1 ILE 121 4.201 11.406 2.415 1045 HG13 ILE 121 3HG1 ILE 121 3.132 12.047 1.174 1046 HG21 ILE 121 1HG2 ILE 121 4.970 12.887 4.302 1047 HG22 ILE 121 2HG2 ILE 121 4.576 14.606 4.279 1048 HG23 ILE 121 3HG2 ILE 121 5.711 13.946 3.102 1049 HD11 ILE 121 3HD1 ILE 121 4.975 13.314 0.224 1050 HD12 ILE 121 1HD1 ILE 121 5.361 11.595 0.311 1051 HD13 ILE 121 2HD1 ILE 121 6.050 12.714 1.487 1052 H ARG 122 H ARG 122 1.272 15.445 2.914 1053 HA ARG 122 HA ARG 122 1.929 17.006 5.160 1054 HB2 ARG 122 2HB ARG 122 -0.253 17.253 3.094 1055 HB3 ARG 122 3HB ARG 122 -0.079 18.421 4.394 1056 HG2 ARG 122 2HG ARG 122 2.021 17.786 2.322 1057 HG3 ARG 122 3HG ARG 122 0.947 19.185 2.309 1058 HD2 ARG 122 2HD ARG 122 1.973 19.518 4.744 1059 HD3 ARG 122 3HD ARG 122 3.306 18.608 4.034 1060 HE ARG 122 HE ARG 122 2.273 21.078 2.800 1061 HH11 ARG 122 1HH1 ARG 122 4.910 19.154 3.889 1062 HH12 ARG 122 2HH1 ARG 122 6.087 20.356 3.484 1063 HH21 ARG 122 1HH2 ARG 122 3.781 22.600 2.285 1064 HH22 ARG 122 2HH2 ARG 122 5.457 22.283 2.573 1065 H GLU 123 H GLU 123 -0.663 14.719 4.669 1066 HA GLU 123 HA GLU 123 -2.234 15.677 6.902 1067 HB2 GLU 123 2HB GLU 123 -2.526 13.158 5.250 1068 HB3 GLU 123 3HB GLU 123 -3.699 13.753 6.419 1069 HG2 GLU 123 2HG GLU 123 -2.890 15.050 3.821 1070 HG3 GLU 123 3HG GLU 123 -4.444 14.317 4.216 1071 H VAL 124 H VAL 124 -0.508 12.615 6.214 1072 HA VAL 124 HA VAL 124 -0.821 11.635 8.874 1073 HB VAL 124 HB VAL 124 -0.560 10.076 7.032 1074 HG11 VAL 124 1HG1 VAL 124 1.574 9.756 5.872 1075 HG12 VAL 124 2HG1 VAL 124 2.252 11.138 6.731 1076 HG13 VAL 124 3HG1 VAL 124 0.926 11.371 5.593 1077 HG21 VAL 124 3HG2 VAL 124 0.118 9.322 9.252 1078 HG22 VAL 124 1HG2 VAL 124 1.759 9.902 8.966 1079 HG23 VAL 124 2HG2 VAL 124 1.115 8.568 8.010 1080 H GLY 125 H GLY 125 1.981 13.067 7.171 1081 HA2 GLY 125 2HA GLY 125 3.502 13.043 9.687 1082 HA3 GLY 125 3HA GLY 125 4.157 13.335 8.085 1083 H SER 126 H SER 126 1.291 14.940 9.334 1084 HA SER 126 HA SER 126 2.180 17.533 8.702 1085 HB2 SER 126 2HB SER 126 -0.200 16.991 8.948 1086 HB3 SER 126 3HB SER 126 0.028 16.696 10.672 1087 HG SER 126 HG SER 126 -0.104 19.091 9.259 1088 H LEU 127 H LEU 127 1.374 16.644 12.045 1089 HA LEU 127 HA LEU 127 4.012 17.645 12.912 1090 HB2 LEU 127 2HB LEU 127 3.108 18.703 14.816 1091 HB3 LEU 127 3HB LEU 127 2.107 19.212 13.473 1092 HG LEU 127 HG LEU 127 1.347 17.079 15.487 1093 HD11 LEU 127 1HD1 LEU 127 -0.192 18.724 16.400 1094 HD12 LEU 127 2HD1 LEU 127 0.384 19.929 15.248 1095 HD13 LEU 127 3HD1 LEU 127 1.469 19.310 16.494 1096 HD21 LEU 127 3HD2 LEU 127 0.234 16.658 13.399 1097 HD22 LEU 127 1HD2 LEU 127 -0.216 18.357 13.240 1098 HD23 LEU 127 2HD2 LEU 127 -0.929 17.369 14.514 1099 H GLU 128 H GLU 128 1.969 15.075 12.692 1100 HA GLU 128 HA GLU 128 2.826 13.737 15.154 1101 HB2 GLU 128 2HB GLU 128 0.465 13.602 14.709 1102 HB3 GLU 128 3HB GLU 128 0.744 13.099 13.052 1103 HG2 GLU 128 2HG GLU 128 0.001 11.212 14.297 1104 HG3 GLU 128 3HG GLU 128 1.702 10.973 13.909 1105 H HIS 129 H HIS 129 4.625 12.521 15.061 1106 HA HIS 129 HA HIS 129 5.490 11.345 12.516 1107 HB2 HIS 129 2HB HIS 129 6.849 11.641 15.201 1108 HB3 HIS 129 3HB HIS 129 7.522 10.648 13.910 1109 HD1 HIS 129 HD1 HIS 129 8.583 11.840 11.924 1110 HD2 HIS 129 HD2 HIS 129 6.909 14.441 14.699 1111 HE1 HIS 129 HE1 HIS 129 9.384 14.122 11.268 1112 HE2 HIS 129 HE2 HIS 129 8.187 15.692 12.829 1113 H HIS 130 H HIS 130 3.129 10.419 13.833 1114 HA HIS 130 HA HIS 130 2.008 8.534 14.352 1115 HB2 HIS 130 2HB HIS 130 3.107 8.086 12.048 1116 HB3 HIS 130 3HB HIS 130 4.153 6.975 12.929 1117 HD1 HIS 130 HD1 HIS 130 3.034 4.832 13.917 1118 HD2 HIS 130 HD2 HIS 130 0.479 7.240 11.695 1119 HE1 HIS 130 HE1 HIS 130 0.994 3.429 13.483 1120 HE2 HIS 130 HE2 HIS 130 -0.608 4.984 12.318 1121 H HIS 131 H HIS 131 2.566 8.821 16.622 1122 HA HIS 131 HA HIS 131 4.649 7.662 18.010 1123 HB2 HIS 131 2HB HIS 131 2.769 9.134 18.906 1124 HB3 HIS 131 3HB HIS 131 1.793 7.674 19.018 1125 HD1 HIS 131 HD1 HIS 131 4.867 9.277 20.490 1126 HD2 HIS 131 HD2 HIS 131 2.306 6.091 21.234 1127 HE1 HIS 131 HE1 HIS 131 5.486 8.440 22.772 1128 HE2 HIS 131 HE2 HIS 131 3.832 6.610 23.262 1129 H HIS 132 H HIS 132 5.193 5.632 18.679 1130 HA HIS 132 HA HIS 132 4.543 3.534 17.024 1131 HB2 HIS 132 2HB HIS 132 5.996 2.214 18.255 1132 HB3 HIS 132 3HB HIS 132 6.551 3.836 18.637 1133 HD1 HIS 132 HD1 HIS 132 5.791 0.733 20.198 1134 HD2 HIS 132 HD2 HIS 132 5.327 4.721 21.274 1135 HE1 HIS 132 HE1 HIS 132 5.526 0.727 22.692 1136 HE2 HIS 132 HE2 HIS 132 5.069 3.125 23.295 1137 H HIS 133 H HIS 133 3.363 1.668 17.150 1138 HA HIS 133 HA HIS 133 1.539 1.245 19.401 1139 HB2 HIS 133 2HB HIS 133 0.737 1.608 16.522 1140 HB3 HIS 133 3HB HIS 133 -0.220 0.575 17.578 1141 HD1 HIS 133 HD1 HIS 133 0.871 4.187 17.218 1142 HD2 HIS 133 HD2 HIS 133 -1.919 1.901 19.287 1143 HE1 HIS 133 HE1 HIS 133 -0.674 5.831 18.303 1144 HE2 HIS 133 HE2 HIS 133 -2.415 4.436 19.452 1145 H HIS 134 H HIS 134 0.318 -0.985 18.902 1146 HA HIS 134 HA HIS 134 2.357 -2.896 17.950 1147 HB2 HIS 134 2HB HIS 134 1.563 -4.412 19.849 1148 HB3 HIS 134 3HB HIS 134 2.551 -3.025 20.295 1149 HD1 HIS 134 HD1 HIS 134 -1.040 -4.189 20.350 1150 HD2 HIS 134 HD2 HIS 134 1.372 -1.262 22.043 1151 HE1 HIS 134 HE1 HIS 134 -2.441 -3.113 22.132 1152 HE2 HIS 134 HE2 HIS 134 -0.902 -1.468 23.251 Start of MODEL 15 1 H1 MET 1 1H MET 1 -1.698 5.882 11.663 2 H2 MET 1 2H MET 1 -1.792 7.276 12.608 3 H3 MET 1 3H MET 1 -0.728 6.038 13.041 4 HA MET 1 HA MET 1 -0.575 7.663 10.570 5 HB2 MET 1 2HB MET 1 1.474 8.645 11.618 6 HB3 MET 1 3HB MET 1 -0.024 9.073 12.427 7 HG2 MET 1 2HG MET 1 0.435 7.381 14.148 8 HG3 MET 1 3HG MET 1 1.958 6.994 13.344 9 HE1 MET 1 3HE MET 1 3.252 7.410 15.654 10 HE2 MET 1 1HE MET 1 1.725 7.806 16.440 11 HE3 MET 1 2HE MET 1 3.104 8.896 16.594 12 H ASN 2 H ASN 2 -0.015 6.211 9.086 13 HA ASN 2 HA ASN 2 2.612 5.301 8.842 14 HB2 ASN 2 2HB ASN 2 1.911 3.632 10.584 15 HB3 ASN 2 3HB ASN 2 0.675 3.048 9.475 16 HD21 ASN 2 1HD2 ASN 2 1.575 0.987 9.431 17 HD22 ASN 2 2HD2 ASN 2 3.040 0.647 8.587 18 H ILE 3 H ILE 3 2.813 3.849 6.809 19 HA ILE 3 HA ILE 3 0.472 4.173 5.060 20 HB ILE 3 HB ILE 3 1.794 6.117 4.588 21 HG12 ILE 3 2HG1 ILE 3 2.238 4.053 2.405 22 HG13 ILE 3 3HG1 ILE 3 0.757 4.969 2.656 23 HG21 ILE 3 1HG2 ILE 3 4.142 4.271 4.135 24 HG22 ILE 3 2HG2 ILE 3 3.928 5.373 5.494 25 HG23 ILE 3 3HG2 ILE 3 4.130 6.014 3.865 26 HD11 ILE 3 3HD1 ILE 3 1.981 7.045 2.194 27 HD12 ILE 3 1HD1 ILE 3 2.040 5.910 0.844 28 HD13 ILE 3 2HD1 ILE 3 3.442 6.100 1.899 29 H VAL 4 H VAL 4 -0.026 2.375 4.065 30 HA VAL 4 HA VAL 4 2.089 0.475 3.248 31 HB VAL 4 HB VAL 4 -0.686 -0.274 4.228 32 HG11 VAL 4 1HG1 VAL 4 0.166 -1.807 2.529 33 HG12 VAL 4 2HG1 VAL 4 0.127 -2.587 4.110 34 HG13 VAL 4 3HG1 VAL 4 1.660 -2.017 3.446 35 HG21 VAL 4 3HG2 VAL 4 0.457 -1.256 6.176 36 HG22 VAL 4 1HG2 VAL 4 0.693 0.488 6.087 37 HG23 VAL 4 2HG2 VAL 4 1.990 -0.602 5.599 38 H ILE 5 H ILE 5 2.089 0.092 1.092 39 HA ILE 5 HA ILE 5 -0.244 1.019 -0.461 40 HB ILE 5 HB ILE 5 2.602 0.564 -1.391 41 HG12 ILE 5 2HG1 ILE 5 1.089 3.142 -0.856 42 HG13 ILE 5 3HG1 ILE 5 2.381 2.488 0.146 43 HG21 ILE 5 1HG2 ILE 5 1.026 0.198 -3.201 44 HG22 ILE 5 2HG2 ILE 5 1.878 1.723 -3.451 45 HG23 ILE 5 3HG2 ILE 5 0.220 1.727 -2.845 46 HD11 ILE 5 3HD1 ILE 5 3.950 2.760 -1.709 47 HD12 ILE 5 1HD1 ILE 5 3.187 4.286 -1.260 48 HD13 ILE 5 2HD1 ILE 5 2.651 3.426 -2.701 49 H VAL 6 H VAL 6 -1.561 -0.465 -1.270 50 HA VAL 6 HA VAL 6 -0.618 -3.219 -1.703 51 HB VAL 6 HB VAL 6 -3.447 -2.130 -1.645 52 HG11 VAL 6 1HG1 VAL 6 -4.127 -4.501 -1.517 53 HG12 VAL 6 2HG1 VAL 6 -2.447 -4.977 -1.762 54 HG13 VAL 6 3HG1 VAL 6 -3.314 -4.115 -3.032 55 HG21 VAL 6 3HG2 VAL 6 -2.426 -1.978 0.547 56 HG22 VAL 6 1HG2 VAL 6 -1.890 -3.658 0.447 57 HG23 VAL 6 2HG2 VAL 6 -3.612 -3.284 0.536 58 H VAL 7 H VAL 7 0.104 -3.600 -3.727 59 HA VAL 7 HA VAL 7 -1.127 -2.132 -5.981 60 HB VAL 7 HB VAL 7 1.603 -3.432 -5.813 61 HG11 VAL 7 1HG1 VAL 7 2.046 -2.331 -7.969 62 HG12 VAL 7 2HG1 VAL 7 0.365 -1.801 -8.037 63 HG13 VAL 7 3HG1 VAL 7 0.752 -3.521 -8.088 64 HG21 VAL 7 3HG2 VAL 7 0.821 -0.512 -5.825 65 HG22 VAL 7 1HG2 VAL 7 2.470 -1.139 -5.860 66 HG23 VAL 7 2HG2 VAL 7 1.452 -1.416 -4.446 67 H PHE 8 H PHE 8 -2.509 -3.279 -7.195 68 HA PHE 8 HA PHE 8 -2.413 -6.180 -7.281 69 HB2 PHE 8 2HB PHE 8 -4.285 -4.133 -8.473 70 HB3 PHE 8 3HB PHE 8 -4.401 -5.843 -8.871 71 HD1 PHE 8 HD2 PHE 8 -4.708 -3.370 -6.142 72 HD2 PHE 8 HD1 PHE 8 -5.340 -7.409 -7.350 73 HE1 PHE 8 HE2 PHE 8 -6.075 -3.760 -4.132 74 HE2 PHE 8 HE1 PHE 8 -6.709 -7.799 -5.345 75 HZ PHE 8 HZ PHE 8 -7.076 -5.974 -3.732 76 H SER 9 H SER 9 -0.120 -5.764 -8.248 77 HA SER 9 HA SER 9 -0.219 -6.756 -10.916 78 HB2 SER 9 2HB SER 9 1.033 -4.985 -12.066 79 HB3 SER 9 3HB SER 9 -0.490 -4.349 -11.448 80 HG SER 9 HG SER 9 2.032 -4.078 -10.161 81 H THR 10 H THR 10 1.126 -8.416 -10.444 82 HA THR 10 HA THR 10 3.339 -8.207 -8.665 83 HB THR 10 HB THR 10 3.934 -10.501 -9.447 84 HG1 THR 10 HG1 THR 10 2.336 -11.485 -10.873 85 HG21 THR 10 3HG2 THR 10 1.915 -11.592 -8.577 86 HG22 THR 10 1HG2 THR 10 1.019 -10.083 -8.756 87 HG23 THR 10 2HG2 THR 10 2.351 -10.187 -7.604 88 H ASP 11 H ASP 11 3.029 -7.532 -12.021 89 HA ASP 11 HA ASP 11 5.763 -7.859 -12.752 90 HB2 ASP 11 2HB ASP 11 3.621 -6.100 -13.977 91 HB3 ASP 11 3HB ASP 11 5.177 -6.473 -14.716 92 H GLU 12 H GLU 12 7.330 -6.800 -11.664 93 HA GLU 12 HA GLU 12 6.898 -4.446 -10.184 94 HB2 GLU 12 2HB GLU 12 8.672 -6.064 -9.628 95 HB3 GLU 12 3HB GLU 12 9.550 -5.602 -11.081 96 HG2 GLU 12 2HG GLU 12 9.813 -3.332 -10.214 97 HG3 GLU 12 3HG GLU 12 8.896 -3.765 -8.775 98 H GLU 13 H GLU 13 7.368 -4.723 -13.550 99 HA GLU 13 HA GLU 13 8.818 -2.439 -14.189 100 HB2 GLU 13 2HB GLU 13 8.121 -3.960 -15.927 101 HB3 GLU 13 3HB GLU 13 6.423 -3.624 -15.610 102 HG2 GLU 13 2HG GLU 13 6.642 -1.384 -16.437 103 HG3 GLU 13 3HG GLU 13 8.391 -1.552 -16.566 104 H THR 14 H THR 14 5.299 -2.667 -13.585 105 HA THR 14 HA THR 14 4.827 0.143 -13.703 106 HB THR 14 HB THR 14 3.183 -1.952 -12.244 107 HG1 THR 14 HG1 THR 14 1.991 -1.384 -14.464 108 HG21 THR 14 3HG2 THR 14 1.319 -0.382 -12.577 109 HG22 THR 14 1HG2 THR 14 2.427 0.781 -13.304 110 HG23 THR 14 2HG2 THR 14 2.600 0.342 -11.603 111 H LEU 15 H LEU 15 5.417 -2.114 -11.032 112 HA LEU 15 HA LEU 15 5.158 -0.349 -8.875 113 HB2 LEU 15 2HB LEU 15 5.287 -2.771 -8.609 114 HB3 LEU 15 3HB LEU 15 6.946 -2.768 -9.181 115 HG LEU 15 HG LEU 15 7.605 -1.453 -7.175 116 HD11 LEU 15 1HD1 LEU 15 4.737 -1.895 -6.343 117 HD12 LEU 15 2HD1 LEU 15 5.493 -0.347 -6.718 118 HD13 LEU 15 3HD1 LEU 15 6.018 -1.265 -5.307 119 HD21 LEU 15 3HD2 LEU 15 7.824 -3.883 -7.184 120 HD22 LEU 15 1HD2 LEU 15 6.170 -4.049 -6.593 121 HD23 LEU 15 2HD2 LEU 15 7.401 -3.299 -5.575 122 H ARG 16 H ARG 16 7.796 -0.846 -11.106 123 HA ARG 16 HA ARG 16 9.911 0.343 -9.722 124 HB2 ARG 16 2HB ARG 16 10.241 -0.890 -11.807 125 HB3 ARG 16 3HB ARG 16 9.326 0.318 -12.698 126 HG2 ARG 16 2HG ARG 16 11.678 0.635 -13.095 127 HG3 ARG 16 3HG ARG 16 11.058 1.994 -12.157 128 HD2 ARG 16 2HD ARG 16 11.907 0.849 -10.096 129 HD3 ARG 16 3HD ARG 16 12.669 -0.349 -11.145 130 HE ARG 16 HE ARG 16 13.350 2.432 -11.650 131 HH11 ARG 16 1HH1 ARG 16 14.241 -0.546 -10.154 132 HH12 ARG 16 2HH1 ARG 16 15.894 -0.076 -9.971 133 HH21 ARG 16 1HH2 ARG 16 15.479 2.993 -11.440 134 HH22 ARG 16 2HH2 ARG 16 16.587 1.896 -10.690 135 H LYS 17 H LYS 17 7.456 1.783 -11.834 136 HA LYS 17 HA LYS 17 8.399 4.425 -11.816 137 HB2 LYS 17 2HB LYS 17 5.499 3.562 -11.994 138 HB3 LYS 17 3HB LYS 17 6.191 5.066 -12.585 139 HG2 LYS 17 2HG LYS 17 6.746 2.302 -13.650 140 HG3 LYS 17 3HG LYS 17 5.768 3.552 -14.419 141 HD2 LYS 17 2HD LYS 17 8.721 3.775 -13.813 142 HD3 LYS 17 3HD LYS 17 8.040 3.373 -15.388 143 HE2 LYS 17 2HE LYS 17 6.902 5.557 -15.437 144 HE3 LYS 17 3HE LYS 17 7.611 5.953 -13.872 145 HZ1 LYS 17 3HZ LYS 17 9.806 5.811 -14.865 146 HZ2 LYS 17 1HZ LYS 17 8.857 6.935 -15.701 147 HZ3 LYS 17 2HZ LYS 17 9.137 5.404 -16.363 148 H PHE 18 H PHE 18 6.509 2.644 -9.462 149 HA PHE 18 HA PHE 18 5.780 4.926 -7.878 150 HB2 PHE 18 2HB PHE 18 5.898 2.014 -7.051 151 HB3 PHE 18 3HB PHE 18 5.056 3.304 -6.203 152 HD1 PHE 18 HD1 PHE 18 3.784 4.672 -8.568 153 HD2 PHE 18 HD2 PHE 18 4.142 0.549 -7.548 154 HE1 PHE 18 HE1 PHE 18 1.732 4.176 -9.834 155 HE2 PHE 18 HE2 PHE 18 2.099 0.054 -8.820 156 HZ PHE 18 HZ PHE 18 0.891 1.868 -9.964 157 H LYS 19 H LYS 19 8.364 2.492 -7.731 158 HA LYS 19 HA LYS 19 9.471 3.315 -5.267 159 HB2 LYS 19 2HB LYS 19 10.902 1.988 -7.583 160 HB3 LYS 19 3HB LYS 19 11.459 2.043 -5.915 161 HG2 LYS 19 2HG LYS 19 9.319 0.802 -5.313 162 HG3 LYS 19 3HG LYS 19 9.110 0.537 -7.042 163 HD2 LYS 19 2HD LYS 19 11.483 -0.344 -5.384 164 HD3 LYS 19 3HD LYS 19 10.183 -1.385 -5.960 165 HE2 LYS 19 2HE LYS 19 10.834 -0.917 -8.279 166 HE3 LYS 19 3HE LYS 19 12.126 0.140 -7.708 167 HZ1 LYS 19 3HZ LYS 19 12.991 -2.027 -8.260 168 HZ2 LYS 19 1HZ LYS 19 11.901 -2.781 -7.210 169 HZ3 LYS 19 2HZ LYS 19 13.121 -1.785 -6.592 170 H ASP 20 H ASP 20 10.248 4.260 -8.614 171 HA ASP 20 HA ASP 20 12.361 6.016 -8.088 172 HB2 ASP 20 2HB ASP 20 10.311 5.847 -10.286 173 HB3 ASP 20 3HB ASP 20 11.449 7.189 -10.246 174 H ILE 21 H ILE 21 8.937 6.446 -7.622 175 HA ILE 21 HA ILE 21 9.105 9.301 -7.195 176 HB ILE 21 HB ILE 21 6.868 7.341 -6.618 177 HG12 ILE 21 2HG1 ILE 21 7.171 9.333 -8.888 178 HG13 ILE 21 3HG1 ILE 21 7.500 7.610 -9.028 179 HG21 ILE 21 1HG2 ILE 21 6.667 9.310 -5.199 180 HG22 ILE 21 2HG2 ILE 21 5.426 9.330 -6.451 181 HG23 ILE 21 3HG2 ILE 21 6.846 10.363 -6.604 182 HD11 ILE 21 3HD1 ILE 21 4.836 8.845 -8.365 183 HD12 ILE 21 1HD1 ILE 21 5.168 7.119 -8.522 184 HD13 ILE 21 2HD1 ILE 21 5.320 8.178 -9.926 185 H ILE 22 H ILE 22 8.415 6.490 -5.088 186 HA ILE 22 HA ILE 22 8.261 7.815 -2.654 187 HB ILE 22 HB ILE 22 9.266 5.011 -3.183 188 HG12 ILE 22 2HG1 ILE 22 6.502 6.017 -2.426 189 HG13 ILE 22 3HG1 ILE 22 6.982 5.470 -4.028 190 HG21 ILE 22 1HG2 ILE 22 9.964 5.692 -0.976 191 HG22 ILE 22 2HG2 ILE 22 8.615 4.567 -0.823 192 HG23 ILE 22 3HG2 ILE 22 8.350 6.296 -0.608 193 HD11 ILE 22 3HD1 ILE 22 5.733 3.755 -2.859 194 HD12 ILE 22 1HD1 ILE 22 6.899 3.782 -1.536 195 HD13 ILE 22 2HD1 ILE 22 7.396 3.230 -3.137 196 H LYS 23 H LYS 23 11.165 6.239 -4.051 197 HA LYS 23 HA LYS 23 12.986 6.940 -2.052 198 HB2 LYS 23 2HB LYS 23 13.420 6.619 -5.030 199 HB3 LYS 23 3HB LYS 23 14.726 6.765 -3.863 200 HG2 LYS 23 2HG LYS 23 14.093 4.695 -2.809 201 HG3 LYS 23 3HG LYS 23 12.651 4.577 -3.820 202 HD2 LYS 23 2HD LYS 23 14.033 4.334 -5.810 203 HD3 LYS 23 3HD LYS 23 15.499 4.538 -4.848 204 HE2 LYS 23 2HE LYS 23 13.503 2.300 -4.468 205 HE3 LYS 23 3HE LYS 23 14.975 2.166 -5.429 206 HZ1 LYS 23 3HZ LYS 23 16.290 2.564 -3.479 207 HZ2 LYS 23 1HZ LYS 23 15.218 1.296 -3.161 208 HZ3 LYS 23 2HZ LYS 23 14.911 2.833 -2.536 209 H LYS 24 H LYS 24 11.880 8.768 -4.855 210 HA LYS 24 HA LYS 24 13.745 10.901 -4.642 211 HB2 LYS 24 2HB LYS 24 12.501 10.221 -6.702 212 HB3 LYS 24 3HB LYS 24 11.041 10.895 -5.996 213 HG2 LYS 24 2HG LYS 24 12.001 13.112 -6.017 214 HG3 LYS 24 3HG LYS 24 13.545 12.472 -6.584 215 HD2 LYS 24 2HD LYS 24 10.981 12.132 -8.139 216 HD3 LYS 24 3HD LYS 24 12.023 13.539 -8.334 217 HE2 LYS 24 2HE LYS 24 12.467 11.855 -10.052 218 HE3 LYS 24 3HE LYS 24 13.871 12.100 -9.018 219 HZ1 LYS 24 3HZ LYS 24 13.345 9.741 -9.569 220 HZ2 LYS 24 1HZ LYS 24 11.942 9.877 -8.637 221 HZ3 LYS 24 2HZ LYS 24 13.461 10.062 -7.917 222 H ASN 25 H ASN 25 10.680 10.267 -3.104 223 HA ASN 25 HA ASN 25 10.366 12.996 -2.158 224 HB2 ASN 25 2HB ASN 25 8.823 10.481 -1.484 225 HB3 ASN 25 3HB ASN 25 8.377 12.113 -0.991 226 HD21 ASN 25 1HD2 ASN 25 6.906 10.224 -2.643 227 HD22 ASN 25 2HD2 ASN 25 6.632 11.025 -4.146 228 H GLY 26 H GLY 26 12.402 10.585 -1.245 229 HA2 GLY 26 2HA GLY 26 13.912 10.682 0.532 230 HA3 GLY 26 3HA GLY 26 12.891 11.875 1.313 231 H PHE 27 H PHE 27 11.954 8.633 0.208 232 HA PHE 27 HA PHE 27 11.756 7.758 3.019 233 HB2 PHE 27 2HB PHE 27 9.651 7.414 0.869 234 HB3 PHE 27 3HB PHE 27 9.632 6.557 2.408 235 HD1 PHE 27 HD1 PHE 27 9.247 7.780 4.509 236 HD2 PHE 27 HD2 PHE 27 9.020 9.724 0.722 237 HE1 PHE 27 HE1 PHE 27 8.062 9.668 5.551 238 HE2 PHE 27 HE2 PHE 27 7.834 11.612 1.762 239 HZ PHE 27 HZ PHE 27 7.354 11.586 4.177 240 H LYS 28 H LYS 28 11.666 5.406 3.287 241 HA LYS 28 HA LYS 28 13.430 4.054 1.387 242 HB2 LYS 28 2HB LYS 28 12.331 3.064 4.032 243 HB3 LYS 28 3HB LYS 28 13.635 2.335 3.102 244 HG2 LYS 28 2HG LYS 28 15.026 4.303 3.473 245 HG3 LYS 28 3HG LYS 28 13.713 5.075 4.363 246 HD2 LYS 28 2HD LYS 28 13.799 3.217 6.012 247 HD3 LYS 28 3HD LYS 28 15.184 2.550 5.144 248 HE2 LYS 28 2HE LYS 28 15.045 5.250 6.493 249 HE3 LYS 28 3HE LYS 28 15.918 3.835 7.078 250 HZ1 LYS 28 3HZ LYS 28 16.487 5.299 4.559 251 HZ2 LYS 28 1HZ LYS 28 17.317 3.936 5.113 252 HZ3 LYS 28 2HZ LYS 28 17.398 5.383 5.979 253 H VAL 29 H VAL 29 12.796 2.465 0.001 254 HA VAL 29 HA VAL 29 9.942 1.787 -0.085 255 HB VAL 29 HB VAL 29 12.083 1.176 -2.137 256 HG11 VAL 29 1HG1 VAL 29 10.197 0.741 -3.644 257 HG12 VAL 29 2HG1 VAL 29 9.069 1.021 -2.318 258 HG13 VAL 29 3HG1 VAL 29 10.181 -0.347 -2.258 259 HG21 VAL 29 3HG2 VAL 29 11.767 3.595 -1.867 260 HG22 VAL 29 1HG2 VAL 29 10.035 3.394 -2.130 261 HG23 VAL 29 2HG2 VAL 29 11.171 3.033 -3.429 262 H ARG 30 H ARG 30 9.289 -0.045 0.867 263 HA ARG 30 HA ARG 30 11.107 -2.380 0.842 264 HB2 ARG 30 2HB ARG 30 10.758 -1.547 3.106 265 HB3 ARG 30 3HB ARG 30 9.016 -1.631 2.897 266 HG2 ARG 30 2HG ARG 30 9.087 -4.032 2.768 267 HG3 ARG 30 3HG ARG 30 10.850 -4.022 2.785 268 HD2 ARG 30 2HD ARG 30 10.879 -3.188 5.043 269 HD3 ARG 30 3HD ARG 30 9.127 -2.970 5.030 270 HE ARG 30 HE ARG 30 8.864 -5.320 5.122 271 HH11 ARG 30 1HH1 ARG 30 12.144 -4.321 5.399 272 HH12 ARG 30 2HH1 ARG 30 12.652 -5.815 6.096 273 HH21 ARG 30 1HH2 ARG 30 9.523 -7.225 6.033 274 HH22 ARG 30 2HH2 ARG 30 11.185 -7.442 6.458 275 H THR 31 H THR 31 10.445 -3.783 -0.665 276 HA THR 31 HA THR 31 7.638 -4.021 -1.408 277 HB THR 31 HB THR 31 8.417 -5.578 -3.148 278 HG1 THR 31 HG1 THR 31 10.730 -5.538 -1.603 279 HG21 THR 31 3HG2 THR 31 9.795 -4.002 -4.439 280 HG22 THR 31 1HG2 THR 31 10.094 -3.067 -2.974 281 HG23 THR 31 2HG2 THR 31 8.460 -3.179 -3.631 282 H VAL 32 H VAL 32 6.313 -5.746 -1.029 283 HA VAL 32 HA VAL 32 7.387 -8.062 0.462 284 HB VAL 32 HB VAL 32 4.821 -6.561 1.069 285 HG11 VAL 32 1HG1 VAL 32 4.446 -8.952 1.306 286 HG12 VAL 32 2HG1 VAL 32 4.489 -8.181 2.889 287 HG13 VAL 32 3HG1 VAL 32 5.882 -9.102 2.320 288 HG21 VAL 32 3HG2 VAL 32 6.803 -5.460 1.965 289 HG22 VAL 32 1HG2 VAL 32 7.319 -6.967 2.725 290 HG23 VAL 32 2HG2 VAL 32 5.847 -6.162 3.270 291 H ARG 33 H ARG 33 6.684 -10.042 -0.225 292 HA ARG 33 HA ARG 33 4.520 -10.112 -2.249 293 HB2 ARG 33 2HB ARG 33 5.630 -12.047 -3.261 294 HB3 ARG 33 3HB ARG 33 6.707 -10.659 -3.226 295 HG2 ARG 33 2HG ARG 33 7.921 -11.576 -1.354 296 HG3 ARG 33 3HG ARG 33 6.770 -12.905 -1.213 297 HD2 ARG 33 2HD ARG 33 8.598 -12.389 -3.563 298 HD3 ARG 33 3HD ARG 33 8.837 -13.613 -2.315 299 HE ARG 33 HE ARG 33 6.318 -13.819 -3.706 300 HH11 ARG 33 1HH1 ARG 33 9.617 -14.812 -3.627 301 HH12 ARG 33 2HH1 ARG 33 9.338 -16.167 -4.664 302 HH21 ARG 33 1HH2 ARG 33 5.975 -15.559 -5.007 303 HH22 ARG 33 2HH2 ARG 33 7.294 -16.598 -5.429 304 H SER 34 H SER 34 5.657 -11.374 0.753 305 HA SER 34 HA SER 34 3.361 -13.212 0.911 306 HB2 SER 34 2HB SER 34 6.177 -13.902 1.814 307 HB3 SER 34 3HB SER 34 4.756 -14.935 1.961 308 HG SER 34 HG SER 34 6.383 -14.473 -0.194 309 HA PRO 35 HA PRO 35 2.619 -11.556 4.957 310 HB2 PRO 35 2HB PRO 35 2.213 -13.832 6.485 311 HB3 PRO 35 3HB PRO 35 0.998 -13.083 5.447 312 HG2 PRO 35 2HG PRO 35 2.767 -15.434 4.900 313 HG3 PRO 35 3HG PRO 35 1.060 -15.192 4.481 314 HD2 PRO 35 2HD PRO 35 3.014 -14.909 2.655 315 HD3 PRO 35 3HD PRO 35 1.567 -13.880 2.637 316 H GLN 36 H GLN 36 5.163 -13.892 4.550 317 HA GLN 36 HA GLN 36 6.420 -13.775 7.052 318 HB2 GLN 36 2HB GLN 36 7.082 -15.420 5.410 319 HB3 GLN 36 3HB GLN 36 7.572 -14.168 4.278 320 HG2 GLN 36 2HG GLN 36 9.505 -15.209 5.296 321 HG3 GLN 36 3HG GLN 36 9.394 -13.517 5.776 322 HE21 GLN 36 1HE2 GLN 36 10.634 -13.824 7.616 323 HE22 GLN 36 2HE2 GLN 36 10.057 -14.692 8.994 324 H GLU 37 H GLU 37 7.298 -11.880 4.110 325 HA GLU 37 HA GLU 37 9.130 -10.199 5.437 326 HB2 GLU 37 2HB GLU 37 7.527 -9.436 2.983 327 HB3 GLU 37 3HB GLU 37 9.054 -8.740 3.505 328 HG2 GLU 37 2HG GLU 37 9.722 -10.134 1.803 329 HG3 GLU 37 3HG GLU 37 9.962 -11.160 3.217 330 H LEU 38 H LEU 38 5.651 -9.966 5.019 331 HA LEU 38 HA LEU 38 5.266 -7.320 5.905 332 HB2 LEU 38 2HB LEU 38 3.502 -8.658 4.838 333 HB3 LEU 38 3HB LEU 38 3.450 -9.719 6.234 334 HG LEU 38 HG LEU 38 2.689 -7.809 7.630 335 HD11 LEU 38 1HD1 LEU 38 3.667 -5.991 6.321 336 HD12 LEU 38 2HD1 LEU 38 1.939 -5.749 6.563 337 HD13 LEU 38 3HD1 LEU 38 2.538 -6.321 5.006 338 HD21 LEU 38 3HD2 LEU 38 1.060 -9.346 6.668 339 HD22 LEU 38 1HD2 LEU 38 0.983 -8.369 5.201 340 HD23 LEU 38 2HD2 LEU 38 0.413 -7.707 6.734 341 H LYS 39 H LYS 39 5.078 -10.371 7.762 342 HA LYS 39 HA LYS 39 4.874 -9.238 10.323 343 HB2 LYS 39 2HB LYS 39 4.409 -11.575 9.981 344 HB3 LYS 39 3HB LYS 39 6.034 -11.872 9.381 345 HG2 LYS 39 2HG LYS 39 6.959 -11.456 11.585 346 HG3 LYS 39 3HG LYS 39 5.355 -11.064 12.209 347 HD2 LYS 39 2HD LYS 39 6.160 -13.738 11.049 348 HD3 LYS 39 3HD LYS 39 6.090 -13.367 12.771 349 HE2 LYS 39 2HE LYS 39 3.681 -12.874 12.544 350 HE3 LYS 39 3HE LYS 39 3.768 -13.303 10.836 351 HZ1 LYS 39 3HZ LYS 39 2.933 -15.129 12.179 352 HZ2 LYS 39 1HZ LYS 39 4.347 -15.131 13.105 353 HZ3 LYS 39 2HZ LYS 39 4.409 -15.545 11.470 354 H ASP 40 H ASP 40 7.724 -10.182 8.439 355 HA ASP 40 HA ASP 40 9.715 -9.547 10.302 356 HB2 ASP 40 2HB ASP 40 10.140 -10.868 8.291 357 HB3 ASP 40 3HB ASP 40 9.781 -9.478 7.274 358 H SER 41 H SER 41 7.868 -7.498 8.126 359 HA SER 41 HA SER 41 9.398 -5.132 8.289 360 HB2 SER 41 2HB SER 41 6.380 -5.344 8.040 361 HB3 SER 41 3HB SER 41 7.365 -3.947 7.613 362 HG SER 41 HG SER 41 6.967 -6.335 6.253 363 H ILE 42 H ILE 42 6.620 -6.231 10.228 364 HA ILE 42 HA ILE 42 6.551 -4.015 11.983 365 HB ILE 42 HB ILE 42 5.570 -6.837 12.495 366 HG12 ILE 42 2HG1 ILE 42 4.084 -4.442 11.365 367 HG13 ILE 42 3HG1 ILE 42 4.637 -5.825 10.426 368 HG21 ILE 42 1HG2 ILE 42 4.812 -4.223 13.814 369 HG22 ILE 42 2HG2 ILE 42 5.717 -5.545 14.553 370 HG23 ILE 42 3HG2 ILE 42 4.029 -5.778 14.102 371 HD11 ILE 42 3HD1 ILE 42 2.597 -5.888 12.639 372 HD12 ILE 42 1HD1 ILE 42 3.154 -7.282 11.714 373 HD13 ILE 42 2HD1 ILE 42 2.270 -5.986 10.910 374 H GLU 43 H GLU 43 8.190 -7.157 12.186 375 HA GLU 43 HA GLU 43 9.131 -7.050 14.792 376 HB2 GLU 43 2HB GLU 43 10.172 -8.341 12.300 377 HB3 GLU 43 3HB GLU 43 11.159 -8.368 13.754 378 HG2 GLU 43 2HG GLU 43 8.356 -9.450 13.499 379 HG3 GLU 43 3HG GLU 43 9.840 -10.401 13.540 380 H GLU 44 H GLU 44 10.323 -5.281 11.999 381 HA GLU 44 HA GLU 44 12.634 -4.257 13.408 382 HB2 GLU 44 2HB GLU 44 11.314 -3.361 10.835 383 HB3 GLU 44 3HB GLU 44 12.808 -2.686 11.470 384 HG2 GLU 44 2HG GLU 44 13.876 -4.883 11.270 385 HG3 GLU 44 3HG GLU 44 12.377 -5.546 10.619 386 H LEU 45 H LEU 45 9.522 -2.902 12.333 387 HA LEU 45 HA LEU 45 9.906 -0.299 13.279 388 HB2 LEU 45 2HB LEU 45 7.316 -1.801 12.881 389 HB3 LEU 45 3HB LEU 45 7.459 -0.060 13.057 390 HG LEU 45 HG LEU 45 8.601 -1.704 10.785 391 HD11 LEU 45 1HD1 LEU 45 6.174 -1.528 10.676 392 HD12 LEU 45 2HD1 LEU 45 6.932 -0.563 9.408 393 HD13 LEU 45 3HD1 LEU 45 6.279 0.225 10.846 394 HD21 LEU 45 3HD2 LEU 45 9.132 0.477 9.766 395 HD22 LEU 45 1HD2 LEU 45 10.027 0.198 11.259 396 HD23 LEU 45 2HD2 LEU 45 8.635 1.281 11.257 397 H VAL 46 H VAL 46 8.841 -3.153 15.009 398 HA VAL 46 HA VAL 46 7.714 -1.733 17.223 399 HB VAL 46 HB VAL 46 7.032 -4.035 16.651 400 HG11 VAL 46 1HG1 VAL 46 8.399 -5.944 17.203 401 HG12 VAL 46 2HG1 VAL 46 9.694 -4.894 17.772 402 HG13 VAL 46 3HG1 VAL 46 9.260 -4.910 16.062 403 HG21 VAL 46 3HG2 VAL 46 6.554 -3.191 18.875 404 HG22 VAL 46 1HG2 VAL 46 8.140 -3.715 19.443 405 HG23 VAL 46 2HG2 VAL 46 6.940 -4.910 18.953 406 H LYS 47 H LYS 47 10.962 -2.457 16.339 407 HA LYS 47 HA LYS 47 11.898 -1.680 19.030 408 HB2 LYS 47 2HB LYS 47 13.444 -2.773 16.664 409 HB3 LYS 47 3HB LYS 47 14.201 -2.177 18.133 410 HG2 LYS 47 2HG LYS 47 14.159 -4.448 18.508 411 HG3 LYS 47 3HG LYS 47 12.681 -3.925 19.321 412 HD2 LYS 47 2HD LYS 47 11.394 -4.537 17.310 413 HD3 LYS 47 3HD LYS 47 12.879 -5.112 16.551 414 HE2 LYS 47 2HE LYS 47 13.141 -6.757 18.378 415 HE3 LYS 47 3HE LYS 47 11.612 -6.208 19.068 416 HZ1 LYS 47 3HZ LYS 47 11.294 -8.194 17.746 417 HZ2 LYS 47 1HZ LYS 47 11.968 -7.443 16.388 418 HZ3 LYS 47 2HZ LYS 47 10.501 -6.893 17.025 419 H LYS 48 H LYS 48 12.202 -0.771 15.605 420 HA LYS 48 HA LYS 48 12.624 2.016 16.417 421 HB2 LYS 48 2HB LYS 48 14.385 0.513 14.466 422 HB3 LYS 48 3HB LYS 48 14.356 2.266 14.604 423 HG2 LYS 48 2HG LYS 48 15.101 2.107 16.924 424 HG3 LYS 48 3HG LYS 48 15.122 0.346 16.800 425 HD2 LYS 48 2HD LYS 48 16.856 0.454 15.103 426 HD3 LYS 48 3HD LYS 48 16.782 2.217 15.096 427 HE2 LYS 48 2HE LYS 48 18.700 1.394 16.382 428 HE3 LYS 48 3HE LYS 48 17.566 2.276 17.405 429 HZ1 LYS 48 3HZ LYS 48 16.677 0.158 18.167 430 HZ2 LYS 48 1HZ LYS 48 18.335 0.258 18.473 431 HZ3 LYS 48 2HZ LYS 48 17.771 -0.682 17.189 432 H TYR 49 H TYR 49 10.982 3.089 15.533 433 HA TYR 49 HA TYR 49 9.753 2.233 13.057 434 HB2 TYR 49 2HB TYR 49 8.291 4.319 13.492 435 HB3 TYR 49 3HB TYR 49 8.153 2.957 14.594 436 HD1 TYR 49 HD2 TYR 49 9.196 3.093 16.864 437 HD2 TYR 49 HD1 TYR 49 9.037 6.475 14.274 438 HE1 TYR 49 HE2 TYR 49 9.619 4.576 18.779 439 HE2 TYR 49 HE1 TYR 49 9.461 7.960 16.187 440 HH TYR 49 HH TYR 49 9.173 7.925 18.643 441 H ASN 50 H ASN 50 11.041 2.589 11.345 442 HA ASN 50 HA ASN 50 12.349 5.185 10.965 443 HB2 ASN 50 2HB ASN 50 12.543 2.611 9.373 444 HB3 ASN 50 3HB ASN 50 13.488 4.064 9.067 445 HD21 ASN 50 1HD2 ASN 50 14.290 1.323 9.819 446 HD22 ASN 50 2HD2 ASN 50 15.263 1.508 11.231 447 H ALA 51 H ALA 51 12.190 6.301 8.882 448 HA ALA 51 HA ALA 51 9.500 6.488 7.919 449 HB1 ALA 51 3HB ALA 51 10.942 8.460 8.068 450 HB2 ALA 51 1HB ALA 51 10.353 8.222 6.422 451 HB3 ALA 51 2HB ALA 51 12.009 7.780 6.839 452 H THR 52 H THR 52 9.299 4.225 7.255 453 HA THR 52 HA THR 52 10.414 3.701 4.561 454 HB THR 52 HB THR 52 9.710 1.656 6.693 455 HG1 THR 52 HG1 THR 52 11.901 1.396 6.921 456 HG21 THR 52 3HG2 THR 52 9.293 0.807 4.428 457 HG22 THR 52 1HG2 THR 52 10.687 0.008 5.159 458 HG23 THR 52 2HG2 THR 52 10.926 1.268 3.948 459 H ILE 53 H ILE 53 8.938 3.550 2.981 460 HA ILE 53 HA ILE 53 6.122 3.109 3.659 461 HB ILE 53 HB ILE 53 7.378 3.878 1.007 462 HG12 ILE 53 2HG1 ILE 53 5.893 5.506 3.093 463 HG13 ILE 53 3HG1 ILE 53 7.581 5.679 2.630 464 HG21 ILE 53 1HG2 ILE 53 5.306 2.641 0.675 465 HG22 ILE 53 2HG2 ILE 53 5.073 4.343 0.277 466 HG23 ILE 53 3HG2 ILE 53 4.467 3.704 1.805 467 HD11 ILE 53 3HD1 ILE 53 6.276 7.455 1.670 468 HD12 ILE 53 1HD1 ILE 53 5.177 6.294 0.925 469 HD13 ILE 53 2HD1 ILE 53 6.851 6.395 0.385 470 H VAL 54 H VAL 54 5.555 1.031 3.808 471 HA VAL 54 HA VAL 54 6.962 -1.007 2.285 472 HB VAL 54 HB VAL 54 6.588 -1.491 4.612 473 HG11 VAL 54 1HG1 VAL 54 3.634 -1.222 4.052 474 HG12 VAL 54 2HG1 VAL 54 4.622 -0.124 5.019 475 HG13 VAL 54 3HG1 VAL 54 4.350 -1.778 5.566 476 HG21 VAL 54 3HG2 VAL 54 6.565 -3.399 3.096 477 HG22 VAL 54 1HG2 VAL 54 4.824 -3.227 2.874 478 HG23 VAL 54 2HG2 VAL 54 5.473 -3.676 4.451 479 H VAL 55 H VAL 55 6.309 -1.697 0.384 480 HA VAL 55 HA VAL 55 3.516 -1.313 -0.451 481 HB VAL 55 HB VAL 55 5.946 -1.895 -2.168 482 HG11 VAL 55 1HG1 VAL 55 4.474 -1.223 -4.038 483 HG12 VAL 55 2HG1 VAL 55 3.121 -1.125 -2.914 484 HG13 VAL 55 3HG1 VAL 55 3.907 -2.676 -3.216 485 HG21 VAL 55 3HG2 VAL 55 4.512 0.726 -1.691 486 HG22 VAL 55 1HG2 VAL 55 5.816 0.461 -2.851 487 HG23 VAL 55 2HG2 VAL 55 6.128 0.304 -1.123 488 H VAL 56 H VAL 56 2.310 -3.071 -0.068 489 HA VAL 56 HA VAL 56 3.412 -5.757 -0.304 490 HB VAL 56 HB VAL 56 0.572 -4.911 0.343 491 HG11 VAL 56 1HG1 VAL 56 0.329 -7.193 1.228 492 HG12 VAL 56 2HG1 VAL 56 1.962 -7.578 0.681 493 HG13 VAL 56 3HG1 VAL 56 0.703 -7.199 -0.496 494 HG21 VAL 56 3HG2 VAL 56 2.144 -4.061 2.014 495 HG22 VAL 56 1HG2 VAL 56 2.823 -5.677 2.215 496 HG23 VAL 56 2HG2 VAL 56 1.153 -5.356 2.686 497 H VAL 57 H VAL 57 3.632 -6.512 -2.323 498 HA VAL 57 HA VAL 57 1.868 -5.685 -4.466 499 HB VAL 57 HB VAL 57 4.081 -7.758 -4.530 500 HG11 VAL 57 1HG1 VAL 57 4.059 -7.369 -6.955 501 HG12 VAL 57 2HG1 VAL 57 2.700 -6.260 -6.766 502 HG13 VAL 57 3HG1 VAL 57 2.503 -7.972 -6.384 503 HG21 VAL 57 3HG2 VAL 57 5.488 -5.974 -5.471 504 HG22 VAL 57 1HG2 VAL 57 4.954 -5.583 -3.834 505 HG23 VAL 57 2HG2 VAL 57 4.181 -4.814 -5.221 506 H VAL 58 H VAL 58 -0.009 -6.661 -4.903 507 HA VAL 58 HA VAL 58 -0.414 -9.417 -3.929 508 HB VAL 58 HB VAL 58 -2.757 -8.878 -3.517 509 HG11 VAL 58 1HG1 VAL 58 -0.852 -6.930 -2.204 510 HG12 VAL 58 2HG1 VAL 58 -1.168 -8.588 -1.692 511 HG13 VAL 58 3HG1 VAL 58 -2.445 -7.375 -1.592 512 HG21 VAL 58 3HG2 VAL 58 -3.584 -6.577 -3.664 513 HG22 VAL 58 1HG2 VAL 58 -3.056 -7.159 -5.243 514 HG23 VAL 58 2HG2 VAL 58 -2.035 -6.053 -4.324 515 H ASP 59 H ASP 59 -1.594 -10.858 -5.161 516 HA ASP 59 HA ASP 59 -2.038 -10.083 -7.962 517 HB2 ASP 59 2HB ASP 59 -1.971 -12.482 -8.459 518 HB3 ASP 59 3HB ASP 59 -0.525 -11.978 -7.592 519 H ASP 60 H ASP 60 -3.645 -11.816 -5.286 520 HA ASP 60 HA ASP 60 -6.245 -11.326 -6.608 521 HB2 ASP 60 2HB ASP 60 -5.542 -13.739 -6.579 522 HB3 ASP 60 3HB ASP 60 -5.555 -13.677 -4.821 523 H LYS 61 H LYS 61 -8.091 -11.134 -5.143 524 HA LYS 61 HA LYS 61 -7.770 -9.265 -3.097 525 HB2 LYS 61 2HB LYS 61 -9.863 -9.757 -4.406 526 HB3 LYS 61 3HB LYS 61 -10.087 -11.195 -3.428 527 HG2 LYS 61 2HG LYS 61 -9.919 -8.457 -2.192 528 HG3 LYS 61 3HG LYS 61 -11.430 -9.091 -2.837 529 HD2 LYS 61 2HD LYS 61 -9.775 -10.317 -0.619 530 HD3 LYS 61 3HD LYS 61 -11.299 -9.454 -0.430 531 HE2 LYS 61 2HE LYS 61 -12.414 -11.193 -1.801 532 HE3 LYS 61 3HE LYS 61 -10.884 -12.067 -1.891 533 HZ1 LYS 61 3HZ LYS 61 -12.493 -11.520 0.539 534 HZ2 LYS 61 1HZ LYS 61 -10.932 -12.166 0.582 535 HZ3 LYS 61 2HZ LYS 61 -12.177 -13.024 -0.164 536 H GLU 62 H GLU 62 -8.005 -12.788 -2.912 537 HA GLU 62 HA GLU 62 -8.329 -13.066 -0.145 538 HB2 GLU 62 2HB GLU 62 -7.091 -14.896 -2.204 539 HB3 GLU 62 3HB GLU 62 -7.372 -15.378 -0.534 540 HG2 GLU 62 2HG GLU 62 -9.698 -15.265 -0.762 541 HG3 GLU 62 3HG GLU 62 -9.597 -14.306 -2.235 542 H TRP 63 H TRP 63 -5.385 -12.629 -2.048 543 HA TRP 63 HA TRP 63 -3.642 -12.952 0.227 544 HB2 TRP 63 2HB TRP 63 -2.675 -13.491 -1.869 545 HB3 TRP 63 3HB TRP 63 -3.234 -12.000 -2.609 546 HD1 TRP 63 HD1 TRP 63 -0.965 -11.069 -3.392 547 HE1 TRP 63 HE1 TRP 63 1.148 -10.206 -2.211 548 HE3 TRP 63 HE3 TRP 63 -1.946 -12.728 1.355 549 HZ2 TRP 63 HZ2 TRP 63 2.251 -10.225 0.380 550 HZ3 TRP 63 HZ3 TRP 63 -0.303 -12.260 3.121 551 HH2 TRP 63 HH2 TRP 63 1.751 -11.037 2.642 552 H ALA 64 H ALA 64 -4.767 -10.126 -1.673 553 HA ALA 64 HA ALA 64 -3.553 -8.098 -0.209 554 HB1 ALA 64 3HB ALA 64 -6.282 -8.042 -1.503 555 HB2 ALA 64 1HB ALA 64 -4.746 -7.712 -2.302 556 HB3 ALA 64 2HB ALA 64 -5.332 -6.630 -1.038 557 H GLU 65 H GLU 65 -6.831 -9.389 0.285 558 HA GLU 65 HA GLU 65 -7.480 -8.042 2.638 559 HB2 GLU 65 2HB GLU 65 -9.180 -9.183 1.385 560 HB3 GLU 65 3HB GLU 65 -8.368 -10.730 1.578 561 HG2 GLU 65 2HG GLU 65 -8.806 -10.609 4.015 562 HG3 GLU 65 3HG GLU 65 -9.710 -9.119 3.746 563 H LYS 66 H LYS 66 -5.743 -11.104 2.180 564 HA LYS 66 HA LYS 66 -5.656 -12.016 4.812 565 HB2 LYS 66 2HB LYS 66 -4.821 -13.184 2.700 566 HB3 LYS 66 3HB LYS 66 -3.353 -12.233 2.863 567 HG2 LYS 66 2HG LYS 66 -2.919 -14.367 3.810 568 HG3 LYS 66 3HG LYS 66 -3.059 -13.225 5.147 569 HD2 LYS 66 2HD LYS 66 -4.261 -15.148 5.814 570 HD3 LYS 66 3HD LYS 66 -5.477 -13.957 5.357 571 HE2 LYS 66 2HE LYS 66 -4.495 -16.190 3.569 572 HE3 LYS 66 3HE LYS 66 -5.962 -16.260 4.539 573 HZ1 LYS 66 3HZ LYS 66 -6.805 -14.350 3.276 574 HZ2 LYS 66 1HZ LYS 66 -6.485 -15.678 2.280 575 HZ3 LYS 66 2HZ LYS 66 -5.422 -14.367 2.312 576 H ALA 67 H ALA 67 -3.375 -9.867 3.122 577 HA ALA 67 HA ALA 67 -1.662 -9.387 5.320 578 HB1 ALA 67 3HB ALA 67 -0.762 -7.557 4.005 579 HB2 ALA 67 1HB ALA 67 -2.164 -7.604 2.935 580 HB3 ALA 67 2HB ALA 67 -1.038 -8.961 2.976 581 H ILE 68 H ILE 68 -4.347 -7.418 4.007 582 HA ILE 68 HA ILE 68 -4.176 -5.309 5.859 583 HB ILE 68 HB ILE 68 -6.674 -6.296 4.459 584 HG12 ILE 68 2HG1 ILE 68 -4.964 -5.901 2.801 585 HG13 ILE 68 3HG1 ILE 68 -6.099 -4.559 2.743 586 HG21 ILE 68 1HG2 ILE 68 -6.004 -3.584 5.617 587 HG22 ILE 68 2HG2 ILE 68 -7.192 -4.730 6.245 588 HG23 ILE 68 3HG2 ILE 68 -7.447 -3.967 4.676 589 HD11 ILE 68 3HD1 ILE 68 -3.376 -4.548 4.025 590 HD12 ILE 68 1HD1 ILE 68 -4.518 -3.206 4.056 591 HD13 ILE 68 2HD1 ILE 68 -3.846 -3.754 2.522 592 H ARG 69 H ARG 69 -5.944 -8.367 6.019 593 HA ARG 69 HA ARG 69 -7.425 -7.897 8.365 594 HB2 ARG 69 2HB ARG 69 -7.758 -9.829 6.813 595 HB3 ARG 69 3HB ARG 69 -6.263 -10.531 7.417 596 HG2 ARG 69 2HG ARG 69 -7.365 -10.441 9.730 597 HG3 ARG 69 3HG ARG 69 -8.873 -10.153 8.860 598 HD2 ARG 69 2HD ARG 69 -8.637 -12.518 9.341 599 HD3 ARG 69 3HD ARG 69 -8.517 -12.247 7.601 600 HE ARG 69 HE ARG 69 -5.933 -12.198 8.543 601 HH11 ARG 69 1HH1 ARG 69 -8.512 -14.476 8.573 602 HH12 ARG 69 2HH1 ARG 69 -7.452 -15.839 8.515 603 HH21 ARG 69 1HH2 ARG 69 -4.578 -13.954 8.494 604 HH22 ARG 69 2HH2 ARG 69 -5.250 -15.547 8.482 605 H PHE 70 H PHE 70 -4.139 -9.109 7.863 606 HA PHE 70 HA PHE 70 -3.545 -9.709 10.565 607 HB2 PHE 70 2HB PHE 70 -2.229 -10.544 8.638 608 HB3 PHE 70 3HB PHE 70 -1.655 -8.911 8.329 609 HD1 PHE 70 HD1 PHE 70 -1.733 -11.499 11.018 610 HD2 PHE 70 HD2 PHE 70 0.367 -8.233 9.257 611 HE1 PHE 70 HE1 PHE 70 0.164 -11.905 12.531 612 HE2 PHE 70 HE2 PHE 70 2.262 -8.634 10.774 613 HZ PHE 70 HZ PHE 70 2.164 -10.471 12.412 614 H VAL 71 H VAL 71 -3.031 -6.786 8.607 615 HA VAL 71 HA VAL 71 -1.689 -5.228 10.517 616 HB VAL 71 HB VAL 71 -3.571 -4.275 8.340 617 HG11 VAL 71 1HG1 VAL 71 -2.315 -2.160 8.458 618 HG12 VAL 71 2HG1 VAL 71 -1.406 -2.783 9.836 619 HG13 VAL 71 3HG1 VAL 71 -3.144 -2.516 9.972 620 HG21 VAL 71 3HG2 VAL 71 -1.545 -3.993 6.985 621 HG22 VAL 71 1HG2 VAL 71 -1.775 -5.677 7.457 622 HG23 VAL 71 2HG2 VAL 71 -0.575 -4.686 8.285 623 H LYS 72 H LYS 72 -5.135 -5.858 10.099 624 HA LYS 72 HA LYS 72 -6.171 -3.783 11.667 625 HB2 LYS 72 2HB LYS 72 -7.497 -5.317 10.183 626 HB3 LYS 72 3HB LYS 72 -7.359 -6.555 11.427 627 HG2 LYS 72 2HG LYS 72 -8.557 -5.120 13.005 628 HG3 LYS 72 3HG LYS 72 -8.663 -3.853 11.784 629 HD2 LYS 72 2HD LYS 72 -10.767 -5.032 11.899 630 HD3 LYS 72 3HD LYS 72 -9.988 -5.391 10.356 631 HE2 LYS 72 2HE LYS 72 -9.243 -7.540 11.201 632 HE3 LYS 72 3HE LYS 72 -9.898 -7.170 12.797 633 HZ1 LYS 72 3HZ LYS 72 -11.378 -8.602 11.557 634 HZ2 LYS 72 1HZ LYS 72 -11.480 -7.474 10.301 635 HZ3 LYS 72 2HZ LYS 72 -12.111 -7.105 11.828 636 H SER 73 H SER 73 -4.514 -6.658 12.647 637 HA SER 73 HA SER 73 -5.543 -6.766 15.323 638 HB2 SER 73 2HB SER 73 -4.588 -8.753 14.210 639 HB3 SER 73 3HB SER 73 -2.999 -7.989 14.214 640 HG SER 73 HG SER 73 -4.544 -8.537 16.539 641 H LEU 74 H LEU 74 -3.221 -4.778 13.798 642 HA LEU 74 HA LEU 74 -1.489 -4.296 16.012 643 HB2 LEU 74 2HB LEU 74 -2.038 -2.566 13.597 644 HB3 LEU 74 3HB LEU 74 -0.695 -2.370 14.708 645 HG LEU 74 HG LEU 74 -1.145 -4.735 12.872 646 HD11 LEU 74 1HD1 LEU 74 0.839 -3.931 11.699 647 HD12 LEU 74 2HD1 LEU 74 0.929 -2.542 12.781 648 HD13 LEU 74 3HD1 LEU 74 -0.441 -2.718 11.684 649 HD21 LEU 74 3HD2 LEU 74 1.086 -5.470 13.621 650 HD22 LEU 74 1HD2 LEU 74 -0.086 -5.454 14.940 651 HD23 LEU 74 2HD2 LEU 74 1.107 -4.162 14.806 652 H GLY 75 H GLY 75 -4.462 -2.755 14.878 653 HA2 GLY 75 2HA GLY 75 -5.993 -1.648 16.291 654 HA3 GLY 75 3HA GLY 75 -4.719 -1.430 17.478 655 H ALA 76 H ALA 76 -2.816 -0.259 15.617 656 HA ALA 76 HA ALA 76 -3.571 2.469 15.815 657 HB1 ALA 76 3HB ALA 76 -1.464 2.949 14.720 658 HB2 ALA 76 1HB ALA 76 -1.320 1.268 14.196 659 HB3 ALA 76 2HB ALA 76 -1.233 1.669 15.912 660 H GLN 77 H GLN 77 -4.400 3.894 14.321 661 HA GLN 77 HA GLN 77 -5.595 2.889 11.927 662 HB2 GLN 77 2HB GLN 77 -6.297 5.185 11.501 663 HB3 GLN 77 3HB GLN 77 -6.592 4.762 13.179 664 HG2 GLN 77 2HG GLN 77 -4.630 6.013 13.874 665 HG3 GLN 77 3HG GLN 77 -4.245 6.380 12.194 666 HE21 GLN 77 1HE2 GLN 77 -4.378 8.597 12.480 667 HE22 GLN 77 2HE2 GLN 77 -5.873 9.417 12.746 668 H VAL 78 H VAL 78 -4.758 2.750 9.920 669 HA VAL 78 HA VAL 78 -2.234 4.167 9.352 670 HB VAL 78 HB VAL 78 -1.405 2.190 8.133 671 HG11 VAL 78 1HG1 VAL 78 -2.122 1.560 11.003 672 HG12 VAL 78 2HG1 VAL 78 -0.765 2.560 10.483 673 HG13 VAL 78 3HG1 VAL 78 -0.804 0.847 10.068 674 HG21 VAL 78 3HG2 VAL 78 -3.809 0.767 9.291 675 HG22 VAL 78 1HG2 VAL 78 -2.488 0.011 8.401 676 HG23 VAL 78 2HG2 VAL 78 -3.562 1.149 7.586 677 H LEU 79 H LEU 79 -1.794 4.632 7.172 678 HA LEU 79 HA LEU 79 -4.155 4.972 5.502 679 HB2 LEU 79 2HB LEU 79 -2.811 6.924 5.736 680 HB3 LEU 79 3HB LEU 79 -1.339 6.046 5.371 681 HG LEU 79 HG LEU 79 -1.972 5.833 3.041 682 HD11 LEU 79 1HD1 LEU 79 -4.371 5.562 3.282 683 HD12 LEU 79 2HD1 LEU 79 -4.013 6.872 2.159 684 HD13 LEU 79 3HD1 LEU 79 -4.533 7.240 3.804 685 HD21 LEU 79 3HD2 LEU 79 -2.374 8.662 4.021 686 HD22 LEU 79 1HD2 LEU 79 -1.932 8.185 2.381 687 HD23 LEU 79 2HD2 LEU 79 -0.821 7.882 3.716 688 H ILE 80 H ILE 80 -4.678 3.339 4.221 689 HA ILE 80 HA ILE 80 -2.578 1.678 3.006 690 HB ILE 80 HB ILE 80 -5.556 1.163 3.238 691 HG12 ILE 80 2HG1 ILE 80 -3.237 -0.103 4.737 692 HG13 ILE 80 3HG1 ILE 80 -4.306 1.125 5.404 693 HG21 ILE 80 1HG2 ILE 80 -4.603 0.082 1.266 694 HG22 ILE 80 2HG2 ILE 80 -5.006 -1.121 2.490 695 HG23 ILE 80 3HG2 ILE 80 -3.328 -0.634 2.253 696 HD11 ILE 80 3HD1 ILE 80 -4.865 -1.145 6.144 697 HD12 ILE 80 1HD1 ILE 80 -5.186 -1.596 4.471 698 HD13 ILE 80 2HD1 ILE 80 -6.182 -0.377 5.260 699 H ILE 81 H ILE 81 -1.942 2.481 1.091 700 HA ILE 81 HA ILE 81 -3.889 3.756 -0.695 701 HB ILE 81 HB ILE 81 -0.879 3.561 -0.961 702 HG12 ILE 81 2HG1 ILE 81 -2.646 5.843 -0.015 703 HG13 ILE 81 3HG1 ILE 81 -1.529 4.912 0.977 704 HG21 ILE 81 1HG2 ILE 81 -1.992 3.806 -3.127 705 HG22 ILE 81 2HG2 ILE 81 -1.123 5.280 -2.699 706 HG23 ILE 81 3HG2 ILE 81 -2.878 5.210 -2.525 707 HD11 ILE 81 3HD1 ILE 81 -0.573 7.047 0.448 708 HD12 ILE 81 1HD1 ILE 81 -0.811 6.768 -1.276 709 HD13 ILE 81 2HD1 ILE 81 0.339 5.780 -0.373 710 H ILE 82 H ILE 82 -4.828 2.604 -2.265 711 HA ILE 82 HA ILE 82 -3.598 0.030 -3.036 712 HB ILE 82 HB ILE 82 -6.507 0.839 -3.257 713 HG12 ILE 82 2HG1 ILE 82 -5.159 -0.960 -1.217 714 HG13 ILE 82 3HG1 ILE 82 -5.744 0.668 -0.897 715 HG21 ILE 82 1HG2 ILE 82 -5.851 -0.852 -4.889 716 HG22 ILE 82 2HG2 ILE 82 -6.898 -1.553 -3.657 717 HG23 ILE 82 3HG2 ILE 82 -5.160 -1.845 -3.605 718 HD11 ILE 82 3HD1 ILE 82 -7.424 -1.702 -1.670 719 HD12 ILE 82 1HD1 ILE 82 -8.026 -0.071 -1.392 720 HD13 ILE 82 2HD1 ILE 82 -7.297 -0.978 -0.067 721 H TYR 83 H TYR 83 -3.092 -0.380 -5.111 722 HA TYR 83 HA TYR 83 -3.960 1.528 -7.195 723 HB2 TYR 83 2HB TYR 83 -1.571 1.735 -6.853 724 HB3 TYR 83 3HB TYR 83 -1.360 -0.010 -6.969 725 HD1 TYR 83 HD2 TYR 83 -2.349 2.999 -8.930 726 HD2 TYR 83 HD1 TYR 83 -0.990 -1.037 -9.081 727 HE1 TYR 83 HE2 TYR 83 -1.987 3.213 -11.348 728 HE2 TYR 83 HE1 TYR 83 -0.629 -0.827 -11.507 729 HH TYR 83 HH TYR 83 -1.274 0.491 -13.369 730 H ASP 84 H ASP 84 -5.198 0.717 -8.750 731 HA ASP 84 HA ASP 84 -4.660 -1.962 -9.783 732 HB2 ASP 84 2HB ASP 84 -6.520 -2.202 -8.121 733 HB3 ASP 84 3HB ASP 84 -7.475 -1.079 -9.082 734 H GLN 85 H GLN 85 -5.472 -2.275 -11.953 735 HA GLN 85 HA GLN 85 -5.100 0.082 -13.522 736 HB2 GLN 85 2HB GLN 85 -4.216 -2.083 -14.215 737 HB3 GLN 85 3HB GLN 85 -5.840 -2.741 -14.322 738 HG2 GLN 85 2HG GLN 85 -5.298 -0.348 -15.977 739 HG3 GLN 85 3HG GLN 85 -4.451 -1.824 -16.435 740 HE21 GLN 85 1HE2 GLN 85 -5.650 -3.599 -17.141 741 HE22 GLN 85 2HE2 GLN 85 -7.286 -3.447 -17.668 742 H ASP 86 H ASP 86 -7.953 -1.720 -12.521 743 HA ASP 86 HA ASP 86 -9.618 -0.092 -14.344 744 HB2 ASP 86 2HB ASP 86 -9.621 -2.565 -14.744 745 HB3 ASP 86 3HB ASP 86 -10.317 -2.783 -13.140 746 H GLN 87 H GLN 87 -11.305 1.095 -13.536 747 HA GLN 87 HA GLN 87 -11.214 1.860 -10.818 748 HB2 GLN 87 2HB GLN 87 -13.427 2.407 -12.803 749 HB3 GLN 87 3HB GLN 87 -13.141 3.275 -11.300 750 HG2 GLN 87 2HG GLN 87 -10.915 3.968 -12.228 751 HG3 GLN 87 3HG GLN 87 -11.410 3.260 -13.766 752 HE21 GLN 87 1HE2 GLN 87 -10.768 6.018 -13.226 753 HE22 GLN 87 2HE2 GLN 87 -12.185 6.935 -13.602 754 H ASN 88 H ASN 88 -13.479 -0.251 -12.577 755 HA ASN 88 HA ASN 88 -15.430 -0.492 -10.572 756 HB2 ASN 88 2HB ASN 88 -15.850 -1.254 -12.837 757 HB3 ASN 88 3HB ASN 88 -14.589 -2.472 -12.704 758 HD21 ASN 88 1HD2 ASN 88 -15.007 -4.360 -11.600 759 HD22 ASN 88 2HD2 ASN 88 -16.591 -4.811 -11.087 760 H ARG 89 H ARG 89 -12.428 -2.242 -11.088 761 HA ARG 89 HA ARG 89 -12.769 -4.062 -8.887 762 HB2 ARG 89 2HB ARG 89 -10.415 -3.267 -10.606 763 HB3 ARG 89 3HB ARG 89 -10.255 -4.410 -9.283 764 HG2 ARG 89 2HG ARG 89 -12.328 -4.885 -11.388 765 HG3 ARG 89 3HG ARG 89 -10.636 -5.258 -11.723 766 HD2 ARG 89 2HD ARG 89 -12.151 -6.305 -9.328 767 HD3 ARG 89 3HD ARG 89 -11.971 -7.189 -10.846 768 HE ARG 89 HE ARG 89 -9.420 -6.606 -10.195 769 HH11 ARG 89 1HH1 ARG 89 -11.968 -8.049 -8.358 770 HH12 ARG 89 2HH1 ARG 89 -10.873 -9.037 -7.454 771 HH21 ARG 89 1HH2 ARG 89 -8.057 -7.862 -9.030 772 HH22 ARG 89 2HH2 ARG 89 -8.693 -8.935 -7.827 773 H LEU 90 H LEU 90 -10.688 -1.212 -9.399 774 HA LEU 90 HA LEU 90 -9.452 -1.134 -6.919 775 HB2 LEU 90 2HB LEU 90 -8.763 0.163 -8.891 776 HB3 LEU 90 3HB LEU 90 -10.174 1.185 -8.717 777 HG LEU 90 HG LEU 90 -9.319 2.019 -6.566 778 HD11 LEU 90 1HD1 LEU 90 -8.066 0.031 -5.875 779 HD12 LEU 90 2HD1 LEU 90 -7.058 1.477 -5.832 780 HD13 LEU 90 3HD1 LEU 90 -6.888 0.325 -7.159 781 HD21 LEU 90 3HD2 LEU 90 -7.305 2.229 -8.811 782 HD22 LEU 90 1HD2 LEU 90 -7.468 3.340 -7.450 783 HD23 LEU 90 2HD2 LEU 90 -8.764 3.207 -8.638 784 H GLU 91 H GLU 91 -12.348 0.738 -7.901 785 HA GLU 91 HA GLU 91 -12.732 1.927 -5.354 786 HB2 GLU 91 2HB GLU 91 -14.719 1.578 -7.609 787 HB3 GLU 91 3HB GLU 91 -14.931 2.631 -6.217 788 HG2 GLU 91 2HG GLU 91 -12.904 3.887 -6.926 789 HG3 GLU 91 3HG GLU 91 -12.846 2.886 -8.377 790 H GLU 92 H GLU 92 -13.469 -1.225 -6.463 791 HA GLU 92 HA GLU 92 -15.623 -1.708 -4.593 792 HB2 GLU 92 2HB GLU 92 -15.591 -2.999 -6.632 793 HB3 GLU 92 3HB GLU 92 -13.963 -3.572 -6.303 794 HG2 GLU 92 2HG GLU 92 -15.641 -5.296 -5.884 795 HG3 GLU 92 3HG GLU 92 -14.760 -4.871 -4.419 796 H PHE 93 H PHE 93 -12.213 -2.778 -4.828 797 HA PHE 93 HA PHE 93 -12.216 -4.099 -2.320 798 HB2 PHE 93 2HB PHE 93 -10.596 -4.579 -4.145 799 HB3 PHE 93 3HB PHE 93 -9.825 -3.026 -3.840 800 HD1 PHE 93 HD1 PHE 93 -10.929 -5.986 -1.829 801 HD2 PHE 93 HD2 PHE 93 -7.867 -3.135 -2.628 802 HE1 PHE 93 HE1 PHE 93 -9.512 -7.033 -0.114 803 HE2 PHE 93 HE2 PHE 93 -6.445 -4.179 -0.913 804 HZ PHE 93 HZ PHE 93 -7.268 -6.128 0.349 805 H SER 94 H SER 94 -11.756 -0.751 -3.183 806 HA SER 94 HA SER 94 -10.440 0.185 -0.883 807 HB2 SER 94 2HB SER 94 -11.374 2.378 -1.395 808 HB3 SER 94 3HB SER 94 -10.901 1.583 -2.900 809 HG SER 94 HG SER 94 -13.160 2.646 -2.524 810 H ARG 95 H ARG 95 -13.909 -0.278 -1.510 811 HA ARG 95 HA ARG 95 -14.894 0.533 1.001 812 HB2 ARG 95 2HB ARG 95 -15.930 -1.368 -1.093 813 HB3 ARG 95 3HB ARG 95 -16.785 -1.165 0.426 814 HG2 ARG 95 2HG ARG 95 -17.679 0.194 -1.448 815 HG3 ARG 95 3HG ARG 95 -17.219 1.132 -0.028 816 HD2 ARG 95 2HD ARG 95 -15.428 2.114 -1.090 817 HD3 ARG 95 3HD ARG 95 -15.222 0.773 -2.215 818 HE ARG 95 HE ARG 95 -16.879 1.668 -3.580 819 HH11 ARG 95 1HH1 ARG 95 -16.538 3.565 -0.718 820 HH12 ARG 95 2HH1 ARG 95 -17.312 4.942 -1.416 821 HH21 ARG 95 1HH2 ARG 95 -17.870 3.435 -4.456 822 HH22 ARG 95 2HH2 ARG 95 -18.064 4.867 -3.507 823 H GLU 96 H GLU 96 -13.779 -2.633 -0.151 824 HA GLU 96 HA GLU 96 -14.398 -4.241 2.004 825 HB2 GLU 96 2HB GLU 96 -13.561 -5.040 -0.152 826 HB3 GLU 96 3HB GLU 96 -12.000 -4.301 0.160 827 HG2 GLU 96 2HG GLU 96 -11.816 -6.628 0.523 828 HG3 GLU 96 3HG GLU 96 -11.719 -5.823 2.085 829 H VAL 97 H VAL 97 -11.690 -2.022 1.576 830 HA VAL 97 HA VAL 97 -10.413 -2.792 4.063 831 HB VAL 97 HB VAL 97 -9.786 -0.520 2.159 832 HG11 VAL 97 1HG1 VAL 97 -7.609 -0.422 3.312 833 HG12 VAL 97 2HG1 VAL 97 -8.184 -1.611 4.481 834 HG13 VAL 97 3HG1 VAL 97 -8.947 -0.023 4.389 835 HG21 VAL 97 3HG2 VAL 97 -9.512 -2.729 1.139 836 HG22 VAL 97 1HG2 VAL 97 -8.485 -3.231 2.482 837 HG23 VAL 97 2HG2 VAL 97 -7.949 -1.952 1.392 838 H ARG 98 H ARG 98 -12.108 0.127 2.850 839 HA ARG 98 HA ARG 98 -11.890 1.665 5.189 840 HB2 ARG 98 2HB ARG 98 -12.642 2.501 2.940 841 HB3 ARG 98 3HB ARG 98 -14.196 1.730 3.224 842 HG2 ARG 98 2HG ARG 98 -14.349 4.084 3.725 843 HG3 ARG 98 3HG ARG 98 -14.518 3.149 5.211 844 HD2 ARG 98 2HD ARG 98 -12.138 3.576 5.719 845 HD3 ARG 98 3HD ARG 98 -12.018 4.560 4.261 846 HE ARG 98 HE ARG 98 -13.878 5.260 6.436 847 HH11 ARG 98 1HH1 ARG 98 -11.424 6.141 4.191 848 HH12 ARG 98 2HH1 ARG 98 -11.303 7.758 4.795 849 HH21 ARG 98 1HH2 ARG 98 -13.720 7.358 7.185 850 HH22 ARG 98 2HH2 ARG 98 -12.576 8.433 6.456 851 H ARG 99 H ARG 99 -14.186 -0.807 4.276 852 HA ARG 99 HA ARG 99 -16.154 -0.502 6.233 853 HB2 ARG 99 2HB ARG 99 -16.094 -2.004 4.165 854 HB3 ARG 99 3HB ARG 99 -15.161 -3.137 5.117 855 HG2 ARG 99 2HG ARG 99 -17.851 -2.221 6.067 856 HG3 ARG 99 3HG ARG 99 -17.717 -3.470 4.833 857 HD2 ARG 99 2HD ARG 99 -16.102 -4.610 6.523 858 HD3 ARG 99 3HD ARG 99 -16.854 -3.539 7.705 859 HE ARG 99 HE ARG 99 -18.295 -5.553 6.104 860 HH11 ARG 99 1HH1 ARG 99 -17.997 -3.626 8.940 861 HH12 ARG 99 2HH1 ARG 99 -19.330 -4.389 9.730 862 HH21 ARG 99 1HH2 ARG 99 -20.002 -6.524 7.121 863 HH22 ARG 99 2HH2 ARG 99 -20.465 -5.997 8.702 864 H ARG 100 H ARG 100 -12.889 -1.496 6.550 865 HA ARG 100 HA ARG 100 -13.337 -2.835 9.124 866 HB2 ARG 100 2HB ARG 100 -10.771 -2.607 7.537 867 HB3 ARG 100 3HB ARG 100 -11.094 -3.695 8.886 868 HG2 ARG 100 2HG ARG 100 -12.781 -4.859 7.558 869 HG3 ARG 100 3HG ARG 100 -12.495 -3.754 6.216 870 HD2 ARG 100 2HD ARG 100 -10.124 -4.571 6.165 871 HD3 ARG 100 3HD ARG 100 -10.588 -5.797 7.354 872 HE ARG 100 HE ARG 100 -11.969 -5.582 4.763 873 HH11 ARG 100 1HH1 ARG 100 -10.190 -7.473 7.032 874 HH12 ARG 100 2HH1 ARG 100 -10.504 -8.951 6.194 875 HH21 ARG 100 1HH2 ARG 100 -12.364 -7.472 3.727 876 HH22 ARG 100 2HH2 ARG 100 -11.704 -8.946 4.338 877 H GLY 101 H GLY 101 -12.688 0.264 8.045 878 HA2 GLY 101 2HA GLY 101 -12.731 1.996 9.719 879 HA3 GLY 101 3HA GLY 101 -11.761 0.974 10.756 880 H PHE 102 H PHE 102 -10.102 0.540 8.067 881 HA PHE 102 HA PHE 102 -8.139 2.515 8.841 882 HB2 PHE 102 2HB PHE 102 -8.092 0.290 6.805 883 HB3 PHE 102 3HB PHE 102 -6.745 1.401 7.030 884 HD1 PHE 102 HD1 PHE 102 -6.307 1.738 9.750 885 HD2 PHE 102 HD2 PHE 102 -7.710 -1.771 7.780 886 HE1 PHE 102 HE1 PHE 102 -5.433 0.359 11.587 887 HE2 PHE 102 HE2 PHE 102 -6.840 -3.149 9.621 888 HZ PHE 102 HZ PHE 102 -5.699 -2.082 11.525 889 H GLU 103 H GLU 103 -7.064 3.986 7.441 890 HA GLU 103 HA GLU 103 -8.838 5.413 5.684 891 HB2 GLU 103 2HB GLU 103 -5.913 5.858 6.342 892 HB3 GLU 103 3HB GLU 103 -6.901 6.957 5.389 893 HG2 GLU 103 2HG GLU 103 -8.365 7.314 7.323 894 HG3 GLU 103 3HG GLU 103 -7.364 6.216 8.275 895 H VAL 104 H VAL 104 -9.246 4.145 3.888 896 HA VAL 104 HA VAL 104 -6.997 3.212 2.273 897 HB VAL 104 HB VAL 104 -8.842 1.658 2.530 898 HG11 VAL 104 1HG1 VAL 104 -10.649 3.268 2.898 899 HG12 VAL 104 2HG1 VAL 104 -11.068 2.106 1.638 900 HG13 VAL 104 3HG1 VAL 104 -10.576 3.743 1.199 901 HG21 VAL 104 3HG2 VAL 104 -7.599 1.605 0.423 902 HG22 VAL 104 1HG2 VAL 104 -8.733 2.754 -0.285 903 HG23 VAL 104 2HG2 VAL 104 -9.283 1.145 0.178 904 H ARG 105 H ARG 105 -6.201 4.308 0.608 905 HA ARG 105 HA ARG 105 -7.889 6.289 -0.766 906 HB2 ARG 105 2HB ARG 105 -5.115 6.720 0.350 907 HB3 ARG 105 3HB ARG 105 -5.770 7.744 -0.925 908 HG2 ARG 105 2HG ARG 105 -7.614 8.410 0.505 909 HG3 ARG 105 3HG ARG 105 -7.076 7.304 1.766 910 HD2 ARG 105 2HD ARG 105 -5.046 8.614 2.078 911 HD3 ARG 105 3HD ARG 105 -5.512 9.683 0.753 912 HE ARG 105 HE ARG 105 -7.249 10.562 2.109 913 HH11 ARG 105 1HH1 ARG 105 -5.193 8.391 3.824 914 HH12 ARG 105 2HH1 ARG 105 -5.754 8.921 5.371 915 HH21 ARG 105 1HH2 ARG 105 -7.942 11.226 4.104 916 HH22 ARG 105 2HH2 ARG 105 -7.280 10.489 5.525 917 H THR 106 H THR 106 -7.864 6.143 -2.909 918 HA THR 106 HA THR 106 -6.325 3.884 -3.988 919 HB THR 106 HB THR 106 -8.077 3.789 -5.737 920 HG1 THR 106 HG1 THR 106 -9.588 5.304 -5.874 921 HG21 THR 106 3HG2 THR 106 -9.913 3.031 -4.277 922 HG22 THR 106 1HG2 THR 106 -9.137 3.817 -2.900 923 HG23 THR 106 2HG2 THR 106 -8.349 2.457 -3.702 924 H VAL 107 H VAL 107 -5.141 3.966 -5.822 925 HA VAL 107 HA VAL 107 -5.043 6.489 -7.348 926 HB VAL 107 HB VAL 107 -2.614 6.061 -7.764 927 HG11 VAL 107 1HG1 VAL 107 -3.402 6.427 -4.867 928 HG12 VAL 107 2HG1 VAL 107 -3.319 7.692 -6.093 929 HG13 VAL 107 3HG1 VAL 107 -1.847 6.872 -5.573 930 HG21 VAL 107 3HG2 VAL 107 -1.397 4.533 -6.274 931 HG22 VAL 107 1HG2 VAL 107 -2.562 3.664 -7.272 932 HG23 VAL 107 2HG2 VAL 107 -2.925 3.991 -5.578 933 H THR 108 H THR 108 -5.068 6.299 -9.560 934 HA THR 108 HA THR 108 -5.754 3.610 -10.551 935 HB THR 108 HB THR 108 -6.804 4.784 -12.458 936 HG1 THR 108 HG1 THR 108 -7.022 7.220 -11.854 937 HG21 THR 108 3HG2 THR 108 -7.673 5.841 -9.757 938 HG22 THR 108 1HG2 THR 108 -8.130 4.283 -10.446 939 HG23 THR 108 2HG2 THR 108 -8.664 5.777 -11.215 940 H SER 109 H SER 109 -3.314 6.025 -10.938 941 HA SER 109 HA SER 109 -1.977 4.418 -12.974 942 HB2 SER 109 2HB SER 109 -1.617 6.358 -14.477 943 HB3 SER 109 3HB SER 109 -3.328 5.966 -14.324 944 HG SER 109 HG SER 109 -3.663 7.761 -13.157 945 HA PRO 110 HA PRO 110 1.835 5.583 -10.928 946 HB2 PRO 110 2HB PRO 110 2.754 6.396 -13.662 947 HB3 PRO 110 3HB PRO 110 3.573 5.400 -12.454 948 HG2 PRO 110 2HG PRO 110 2.394 4.263 -14.551 949 HG3 PRO 110 3HG PRO 110 2.287 3.517 -12.945 950 HD2 PRO 110 2HD PRO 110 0.218 5.035 -14.472 951 HD3 PRO 110 3HD PRO 110 0.022 3.667 -13.357 952 H ASP 111 H ASP 111 0.550 7.843 -13.375 953 HA ASP 111 HA ASP 111 1.766 10.172 -12.256 954 HB2 ASP 111 2HB ASP 111 0.919 10.015 -14.598 955 HB3 ASP 111 3HB ASP 111 -0.727 9.984 -13.975 956 H ASP 112 H ASP 112 -1.553 8.861 -12.060 957 HA ASP 112 HA ASP 112 -2.691 10.675 -10.289 958 HB2 ASP 112 2HB ASP 112 -3.815 8.787 -11.558 959 HB3 ASP 112 3HB ASP 112 -3.219 7.693 -10.317 960 H PHE 113 H PHE 113 -0.670 7.875 -9.649 961 HA PHE 113 HA PHE 113 -0.823 7.884 -6.825 962 HB2 PHE 113 2HB PHE 113 -0.038 5.929 -8.031 963 HB3 PHE 113 3HB PHE 113 1.310 6.837 -8.703 964 HD1 PHE 113 HD1 PHE 113 -0.110 5.583 -5.502 965 HD2 PHE 113 HD2 PHE 113 3.363 6.933 -7.572 966 HE1 PHE 113 HE1 PHE 113 1.290 4.899 -3.599 967 HE2 PHE 113 HE2 PHE 113 4.763 6.251 -5.669 968 HZ PHE 113 HZ PHE 113 3.729 5.233 -3.681 969 H LYS 114 H LYS 114 1.581 9.262 -9.070 970 HA LYS 114 HA LYS 114 3.327 10.349 -7.184 971 HB2 LYS 114 2HB LYS 114 3.877 10.187 -9.558 972 HB3 LYS 114 3HB LYS 114 2.630 11.362 -9.949 973 HG2 LYS 114 2HG LYS 114 3.874 13.051 -8.607 974 HG3 LYS 114 3HG LYS 114 5.163 11.866 -8.390 975 HD2 LYS 114 2HD LYS 114 5.556 11.797 -10.780 976 HD3 LYS 114 3HD LYS 114 4.175 12.859 -11.069 977 HE2 LYS 114 2HE LYS 114 5.313 14.627 -9.757 978 HE3 LYS 114 3HE LYS 114 6.711 13.566 -9.591 979 HZ1 LYS 114 3HZ LYS 114 6.881 15.223 -11.405 980 HZ2 LYS 114 1HZ LYS 114 5.610 14.442 -12.200 981 HZ3 LYS 114 2HZ LYS 114 7.066 13.625 -11.928 982 H LYS 115 H LYS 115 0.518 11.874 -8.759 983 HA LYS 115 HA LYS 115 0.858 14.430 -7.583 984 HB2 LYS 115 2HB LYS 115 -1.724 13.226 -8.607 985 HB3 LYS 115 3HB LYS 115 -1.341 14.936 -8.455 986 HG2 LYS 115 2HG LYS 115 -0.003 12.986 -10.327 987 HG3 LYS 115 3HG LYS 115 -1.215 14.189 -10.774 988 HD2 LYS 115 2HD LYS 115 0.272 15.991 -10.233 989 HD3 LYS 115 3HD LYS 115 1.444 14.885 -9.513 990 HE2 LYS 115 2HE LYS 115 2.086 15.671 -11.781 991 HE3 LYS 115 3HE LYS 115 1.936 13.919 -11.664 992 HZ1 LYS 115 3HZ LYS 115 -0.201 14.033 -12.719 993 HZ2 LYS 115 1HZ LYS 115 0.926 14.840 -13.686 994 HZ3 LYS 115 2HZ LYS 115 -0.161 15.723 -12.739 995 H SER 116 H SER 116 -1.118 11.631 -6.653 996 HA SER 116 HA SER 116 -2.373 12.961 -4.448 997 HB2 SER 116 2HB SER 116 -2.137 9.996 -5.028 998 HB3 SER 116 3HB SER 116 -3.212 10.726 -3.836 999 HG SER 116 HG SER 116 -3.539 10.449 -6.514 1000 H LEU 117 H LEU 117 0.337 10.669 -4.715 1001 HA LEU 117 HA LEU 117 0.773 10.079 -2.056 1002 HB2 LEU 117 2HB LEU 117 1.969 9.027 -3.954 1003 HB3 LEU 117 3HB LEU 117 2.901 10.498 -4.162 1004 HG LEU 117 HG LEU 117 3.854 10.183 -1.885 1005 HD11 LEU 117 1HD1 LEU 117 2.395 7.541 -1.980 1006 HD12 LEU 117 2HD1 LEU 117 2.068 8.882 -0.882 1007 HD13 LEU 117 3HD1 LEU 117 3.596 8.011 -0.776 1008 HD21 LEU 117 3HD2 LEU 117 5.098 9.422 -3.825 1009 HD22 LEU 117 1HD2 LEU 117 4.254 7.874 -3.790 1010 HD23 LEU 117 2HD2 LEU 117 5.339 8.318 -2.473 1011 H GLU 118 H GLU 118 2.104 12.850 -3.876 1012 HA GLU 118 HA GLU 118 3.710 14.024 -1.972 1013 HB2 GLU 118 2HB GLU 118 1.889 15.312 -4.015 1014 HB3 GLU 118 3HB GLU 118 3.020 16.238 -3.038 1015 HG2 GLU 118 2HG GLU 118 3.777 14.009 -4.917 1016 HG3 GLU 118 3HG GLU 118 3.878 15.730 -5.286 1017 H ARG 119 H ARG 119 0.202 14.284 -2.258 1018 HA ARG 119 HA ARG 119 -0.012 16.158 -0.061 1019 HB2 ARG 119 2HB ARG 119 -2.155 14.733 -1.659 1020 HB3 ARG 119 3HB ARG 119 -2.422 16.068 -0.541 1021 HG2 ARG 119 2HG ARG 119 -1.158 17.565 -1.932 1022 HG3 ARG 119 3HG ARG 119 -0.682 16.243 -2.996 1023 HD2 ARG 119 2HD ARG 119 -3.043 15.932 -3.630 1024 HD3 ARG 119 3HD ARG 119 -3.487 17.292 -2.595 1025 HE ARG 119 HE ARG 119 -1.943 18.627 -4.082 1026 HH11 ARG 119 1HH1 ARG 119 -3.625 15.849 -5.229 1027 HH12 ARG 119 2HH1 ARG 119 -3.633 16.404 -6.866 1028 HH21 ARG 119 1HH2 ARG 119 -1.930 19.309 -6.171 1029 HH22 ARG 119 2HH2 ARG 119 -2.658 18.334 -7.401 1030 H LEU 120 H LEU 120 -0.554 12.714 -0.584 1031 HA LEU 120 HA LEU 120 -1.865 12.205 1.893 1032 HB2 LEU 120 2HB LEU 120 -0.246 10.252 0.245 1033 HB3 LEU 120 3HB LEU 120 -1.477 9.860 1.431 1034 HG LEU 120 HG LEU 120 -1.887 11.123 -1.281 1035 HD11 LEU 120 1HD1 LEU 120 -1.592 8.701 -1.299 1036 HD12 LEU 120 2HD1 LEU 120 -3.244 9.148 -1.725 1037 HD13 LEU 120 3HD1 LEU 120 -2.887 8.528 -0.113 1038 HD21 LEU 120 3HD2 LEU 120 -3.366 12.250 0.262 1039 HD22 LEU 120 1HD2 LEU 120 -3.913 10.706 0.915 1040 HD23 LEU 120 2HD2 LEU 120 -4.293 11.145 -0.750 1041 H ILE 121 H ILE 121 1.516 12.263 0.908 1042 HA ILE 121 HA ILE 121 2.740 11.199 3.183 1043 HB ILE 121 HB ILE 121 3.669 13.369 1.290 1044 HG12 ILE 121 2HG1 ILE 121 4.491 10.462 1.562 1045 HG13 ILE 121 3HG1 ILE 121 3.373 11.086 0.356 1046 HG21 ILE 121 1HG2 ILE 121 4.822 13.698 3.410 1047 HG22 ILE 121 2HG2 ILE 121 5.932 13.063 2.198 1048 HG23 ILE 121 3HG2 ILE 121 5.285 11.995 3.444 1049 HD11 ILE 121 3HD1 ILE 121 5.167 12.452 -0.595 1050 HD12 ILE 121 1HD1 ILE 121 5.576 10.735 -0.591 1051 HD13 ILE 121 2HD1 ILE 121 6.286 11.813 0.610 1052 H ARG 122 H ARG 122 1.448 14.426 2.597 1053 HA ARG 122 HA ARG 122 2.531 15.635 4.939 1054 HB2 ARG 122 2HB ARG 122 0.171 16.488 3.246 1055 HB3 ARG 122 3HB ARG 122 0.996 17.493 4.434 1056 HG2 ARG 122 2HG ARG 122 2.239 16.348 1.932 1057 HG3 ARG 122 3HG ARG 122 1.709 18.017 2.149 1058 HD2 ARG 122 2HD ARG 122 3.427 18.503 3.647 1059 HD3 ARG 122 3HD ARG 122 3.693 16.804 4.046 1060 HE ARG 122 HE ARG 122 4.308 17.116 1.358 1061 HH11 ARG 122 1HH1 ARG 122 5.447 18.370 4.347 1062 HH12 ARG 122 2HH1 ARG 122 7.091 18.444 3.818 1063 HH21 ARG 122 1HH2 ARG 122 6.415 17.182 0.692 1064 HH22 ARG 122 2HH2 ARG 122 7.636 17.774 1.764 1065 H GLU 123 H GLU 123 -0.302 13.717 4.331 1066 HA GLU 123 HA GLU 123 -1.659 14.476 6.766 1067 HB2 GLU 123 2HB GLU 123 -2.184 12.183 4.858 1068 HB3 GLU 123 3HB GLU 123 -3.252 12.688 6.165 1069 HG2 GLU 123 2HG GLU 123 -3.523 14.879 5.076 1070 HG3 GLU 123 3HG GLU 123 -2.482 14.338 3.761 1071 H VAL 124 H VAL 124 0.181 11.630 5.652 1072 HA VAL 124 HA VAL 124 -0.071 10.246 8.151 1073 HB VAL 124 HB VAL 124 0.295 8.987 6.091 1074 HG11 VAL 124 1HG1 VAL 124 1.724 10.574 4.899 1075 HG12 VAL 124 2HG1 VAL 124 2.456 8.972 4.946 1076 HG13 VAL 124 3HG1 VAL 124 3.045 10.239 6.020 1077 HG21 VAL 124 3HG2 VAL 124 2.077 7.477 6.886 1078 HG22 VAL 124 1HG2 VAL 124 0.980 7.953 8.181 1079 HG23 VAL 124 2HG2 VAL 124 2.571 8.698 8.056 1080 H GLY 125 H GLY 125 2.562 12.124 6.650 1081 HA2 GLY 125 2HA GLY 125 4.424 13.131 7.525 1082 HA3 GLY 125 3HA GLY 125 3.423 13.393 8.939 1083 H SER 126 H SER 126 4.483 10.210 7.777 1084 HA SER 126 HA SER 126 5.552 9.590 10.378 1085 HB2 SER 126 2HB SER 126 4.396 7.877 8.986 1086 HB3 SER 126 3HB SER 126 5.735 7.935 7.843 1087 HG SER 126 HG SER 126 6.519 6.428 9.097 1088 H LEU 127 H LEU 127 7.112 11.397 10.300 1089 HA LEU 127 HA LEU 127 9.745 10.363 9.802 1090 HB2 LEU 127 2HB LEU 127 10.447 12.334 8.377 1091 HB3 LEU 127 3HB LEU 127 9.462 11.118 7.590 1092 HG LEU 127 HG LEU 127 7.464 12.647 7.987 1093 HD11 LEU 127 1HD1 LEU 127 7.930 15.034 8.292 1094 HD12 LEU 127 2HD1 LEU 127 9.630 14.662 8.582 1095 HD13 LEU 127 3HD1 LEU 127 8.396 14.088 9.704 1096 HD21 LEU 127 3HD2 LEU 127 8.501 12.383 5.802 1097 HD22 LEU 127 1HD2 LEU 127 9.682 13.631 6.191 1098 HD23 LEU 127 2HD2 LEU 127 7.974 14.046 6.045 1099 H GLU 128 H GLU 128 7.867 11.734 11.862 1100 HA GLU 128 HA GLU 128 9.090 14.225 12.528 1101 HB2 GLU 128 2HB GLU 128 6.738 13.700 13.085 1102 HB3 GLU 128 3HB GLU 128 7.287 12.458 14.203 1103 HG2 GLU 128 2HG GLU 128 8.469 14.232 15.501 1104 HG3 GLU 128 3HG GLU 128 7.740 15.432 14.436 1105 H HIS 129 H HIS 129 10.445 14.745 14.232 1106 HA HIS 129 HA HIS 129 12.439 13.056 15.131 1107 HB2 HIS 129 2HB HIS 129 12.712 14.732 17.012 1108 HB3 HIS 129 3HB HIS 129 12.686 15.426 15.395 1109 HD1 HIS 129 HD1 HIS 129 10.818 17.050 14.836 1110 HD2 HIS 129 HD2 HIS 129 10.385 15.316 18.587 1111 HE1 HIS 129 HE1 HIS 129 8.959 18.311 15.946 1112 HE2 HIS 129 HE2 HIS 129 8.639 17.177 18.165 1113 H HIS 130 H HIS 130 12.420 11.316 16.448 1114 HA HIS 130 HA HIS 130 10.106 10.370 17.703 1115 HB2 HIS 130 2HB HIS 130 11.652 8.775 18.917 1116 HB3 HIS 130 3HB HIS 130 11.770 8.768 17.164 1117 HD1 HIS 130 HD1 HIS 130 13.609 10.313 20.120 1118 HD2 HIS 130 HD2 HIS 130 14.316 8.945 16.262 1119 HE1 HIS 130 HE1 HIS 130 16.088 10.478 19.794 1120 HE2 HIS 130 HE2 HIS 130 16.463 9.825 17.399 1121 H HIS 131 H HIS 131 9.076 11.598 19.152 1122 HA HIS 131 HA HIS 131 10.455 13.203 21.085 1123 HB2 HIS 131 2HB HIS 131 8.098 13.648 21.951 1124 HB3 HIS 131 3HB HIS 131 8.436 14.126 20.293 1125 HD1 HIS 131 HD1 HIS 131 7.046 13.046 18.451 1126 HD2 HIS 131 HD2 HIS 131 6.367 11.385 22.205 1127 HE1 HIS 131 HE1 HIS 131 5.044 11.556 18.181 1128 HE2 HIS 131 HE2 HIS 131 4.589 10.650 20.484 1129 H HIS 132 H HIS 132 11.642 11.957 22.442 1130 HA HIS 132 HA HIS 132 10.768 9.653 23.818 1131 HB2 HIS 132 2HB HIS 132 12.715 9.983 25.252 1132 HB3 HIS 132 3HB HIS 132 13.152 10.311 23.578 1133 HD1 HIS 132 HD1 HIS 132 13.096 11.834 26.925 1134 HD2 HIS 132 HD2 HIS 132 13.432 13.140 22.991 1135 HE1 HIS 132 HE1 HIS 132 13.945 14.189 27.069 1136 HE2 HIS 132 HE2 HIS 132 14.297 14.896 24.681 1137 H HIS 133 H HIS 133 10.189 9.392 26.064 1138 HA HIS 133 HA HIS 133 8.555 11.490 27.155 1139 HB2 HIS 133 2HB HIS 133 9.457 8.851 28.328 1140 HB3 HIS 133 3HB HIS 133 8.356 9.958 29.145 1141 HD1 HIS 133 HD1 HIS 133 6.198 10.617 27.384 1142 HD2 HIS 133 HD2 HIS 133 8.084 6.930 27.014 1143 HE1 HIS 133 HE1 HIS 133 4.567 9.144 26.177 1144 HE2 HIS 133 HE2 HIS 133 5.705 6.910 26.001 1145 H HIS 134 H HIS 134 8.894 12.118 29.546 1146 HA HIS 134 HA HIS 134 11.716 12.651 30.147 1147 HB2 HIS 134 2HB HIS 134 11.119 15.104 30.517 1148 HB3 HIS 134 3HB HIS 134 11.220 14.566 28.843 1149 HD1 HIS 134 HD1 HIS 134 8.781 15.768 31.412 1150 HD2 HIS 134 HD2 HIS 134 8.788 14.548 27.443 1151 HE1 HIS 134 HE1 HIS 134 6.529 16.403 30.511 1152 HE2 HIS 134 HE2 HIS 134 6.480 15.445 28.188 Start of MODEL 16 1 H1 MET 1 1H MET 1 7.108 2.746 9.103 2 H2 MET 1 2H MET 1 6.531 3.752 7.877 3 H3 MET 1 3H MET 1 7.839 2.721 7.576 4 HA MET 1 HA MET 1 5.839 1.852 6.587 5 HB2 MET 1 2HB MET 1 6.822 0.280 8.984 6 HB3 MET 1 3HB MET 1 5.855 -0.397 7.680 7 HG2 MET 1 2HG MET 1 7.619 0.092 6.085 8 HG3 MET 1 3HG MET 1 8.584 0.839 7.356 9 HE1 MET 1 3HE MET 1 8.056 -1.147 9.813 10 HE2 MET 1 1HE MET 1 9.646 -0.511 9.395 11 HE3 MET 1 2HE MET 1 9.425 -2.244 9.636 12 H ASN 2 H ASN 2 3.975 2.960 6.801 13 HA ASN 2 HA ASN 2 2.033 1.948 8.693 14 HB2 ASN 2 2HB ASN 2 2.911 3.848 9.970 15 HB3 ASN 2 3HB ASN 2 2.713 4.907 8.577 16 HD21 ASN 2 1HD2 ASN 2 1.068 3.176 11.107 17 HD22 ASN 2 2HD2 ASN 2 -0.447 3.990 10.945 18 H ILE 3 H ILE 3 2.662 4.491 6.284 19 HA ILE 3 HA ILE 3 0.238 4.131 4.871 20 HB ILE 3 HB ILE 3 1.480 6.164 4.549 21 HG12 ILE 3 2HG1 ILE 3 1.562 4.511 2.006 22 HG13 ILE 3 3HG1 ILE 3 0.168 5.394 2.619 23 HG21 ILE 3 1HG2 ILE 3 3.730 4.478 3.453 24 HG22 ILE 3 2HG2 ILE 3 3.724 5.348 4.986 25 HG23 ILE 3 3HG2 ILE 3 3.680 6.241 3.465 26 HD11 ILE 3 3HD1 ILE 3 2.767 6.620 1.720 27 HD12 ILE 3 1HD1 ILE 3 1.356 7.499 2.313 28 HD13 ILE 3 2HD1 ILE 3 1.259 6.586 0.806 29 H VAL 4 H VAL 4 -0.327 2.220 4.028 30 HA VAL 4 HA VAL 4 1.750 0.418 2.971 31 HB VAL 4 HB VAL 4 -1.123 -0.192 3.725 32 HG11 VAL 4 1HG1 VAL 4 -0.351 -1.674 1.959 33 HG12 VAL 4 2HG1 VAL 4 -0.452 -2.559 3.482 34 HG13 VAL 4 3HG1 VAL 4 1.117 -2.036 2.868 35 HG21 VAL 4 3HG2 VAL 4 -0.162 -1.372 5.644 36 HG22 VAL 4 1HG2 VAL 4 0.278 0.336 5.669 37 HG23 VAL 4 2HG2 VAL 4 1.457 -0.871 5.155 38 H ILE 5 H ILE 5 2.033 0.405 0.839 39 HA ILE 5 HA ILE 5 -0.122 1.290 -0.939 40 HB ILE 5 HB ILE 5 2.763 0.660 -1.615 41 HG12 ILE 5 2HG1 ILE 5 1.449 3.355 -1.139 42 HG13 ILE 5 3HG1 ILE 5 2.522 2.546 -0.001 43 HG21 ILE 5 1HG2 ILE 5 2.298 1.949 -3.675 44 HG22 ILE 5 2HG2 ILE 5 0.605 2.076 -3.196 45 HG23 ILE 5 3HG2 ILE 5 1.305 0.496 -3.550 46 HD11 ILE 5 3HD1 ILE 5 4.338 2.684 -1.634 47 HD12 ILE 5 1HD1 ILE 5 3.694 4.273 -1.219 48 HD13 ILE 5 2HD1 ILE 5 3.259 3.520 -2.753 49 H VAL 6 H VAL 6 -1.496 -0.288 -1.528 50 HA VAL 6 HA VAL 6 -0.562 -3.034 -1.918 51 HB VAL 6 HB VAL 6 -3.384 -1.923 -2.022 52 HG11 VAL 6 1HG1 VAL 6 -4.077 -4.281 -1.814 53 HG12 VAL 6 2HG1 VAL 6 -2.389 -4.780 -1.938 54 HG13 VAL 6 3HG1 VAL 6 -3.176 -3.984 -3.300 55 HG21 VAL 6 3HG2 VAL 6 -3.654 -2.929 0.205 56 HG22 VAL 6 1HG2 VAL 6 -2.409 -1.679 0.204 57 HG23 VAL 6 2HG2 VAL 6 -1.949 -3.383 0.207 58 H VAL 7 H VAL 7 0.288 -3.438 -3.882 59 HA VAL 7 HA VAL 7 -0.800 -2.053 -6.245 60 HB VAL 7 HB VAL 7 1.848 -3.479 -5.881 61 HG11 VAL 7 1HG1 VAL 7 0.828 -1.894 -8.247 62 HG12 VAL 7 2HG1 VAL 7 1.085 -3.638 -8.197 63 HG13 VAL 7 3HG1 VAL 7 2.459 -2.540 -8.065 64 HG21 VAL 7 3HG2 VAL 7 1.213 -0.529 -6.084 65 HG22 VAL 7 1HG2 VAL 7 2.828 -1.233 -5.986 66 HG23 VAL 7 2HG2 VAL 7 1.716 -1.387 -4.626 67 H PHE 8 H PHE 8 -2.258 -3.193 -7.375 68 HA PHE 8 HA PHE 8 -2.247 -6.088 -7.417 69 HB2 PHE 8 2HB PHE 8 -4.030 -4.001 -8.657 70 HB3 PHE 8 3HB PHE 8 -4.194 -5.703 -9.063 71 HD1 PHE 8 HD2 PHE 8 -4.352 -3.283 -6.254 72 HD2 PHE 8 HD1 PHE 8 -5.347 -7.185 -7.648 73 HE1 PHE 8 HE2 PHE 8 -5.785 -3.624 -4.285 74 HE2 PHE 8 HE1 PHE 8 -6.784 -7.524 -5.680 75 HZ PHE 8 HZ PHE 8 -7.002 -5.743 -3.996 76 H SER 9 H SER 9 -0.979 -3.581 -9.390 77 HA SER 9 HA SER 9 -0.690 -5.211 -11.770 78 HB2 SER 9 2HB SER 9 0.476 -2.500 -11.060 79 HB3 SER 9 3HB SER 9 0.696 -3.295 -12.618 80 HG SER 9 HG SER 9 -1.614 -3.268 -12.832 81 H THR 10 H THR 10 0.558 -6.983 -11.383 82 HA THR 10 HA THR 10 2.821 -6.940 -9.630 83 HB THR 10 HB THR 10 3.144 -9.297 -10.285 84 HG1 THR 10 HG1 THR 10 2.008 -10.195 -11.917 85 HG21 THR 10 3HG2 THR 10 0.971 -10.151 -9.489 86 HG22 THR 10 1HG2 THR 10 0.262 -8.556 -9.734 87 HG23 THR 10 2HG2 THR 10 1.528 -8.783 -8.526 88 H ASP 11 H ASP 11 2.646 -5.747 -12.691 89 HA ASP 11 HA ASP 11 5.028 -6.751 -13.878 90 HB2 ASP 11 2HB ASP 11 3.765 -4.044 -14.366 91 HB3 ASP 11 3HB ASP 11 4.818 -4.940 -15.456 92 H GLU 12 H GLU 12 7.026 -6.498 -13.064 93 HA GLU 12 HA GLU 12 7.676 -4.783 -10.952 94 HB2 GLU 12 2HB GLU 12 10.011 -5.405 -11.338 95 HB3 GLU 12 3HB GLU 12 8.954 -6.806 -11.418 96 HG2 GLU 12 2HG GLU 12 9.042 -6.725 -13.869 97 HG3 GLU 12 3HG GLU 12 10.122 -5.334 -13.777 98 H GLU 13 H GLU 13 7.977 -4.260 -14.438 99 HA GLU 13 HA GLU 13 9.578 -1.920 -14.272 100 HB2 GLU 13 2HB GLU 13 8.940 -1.480 -16.574 101 HB3 GLU 13 3HB GLU 13 9.320 -3.183 -16.368 102 HG2 GLU 13 2HG GLU 13 6.954 -3.736 -16.339 103 HG3 GLU 13 3HG GLU 13 6.536 -2.027 -16.455 104 H THR 14 H THR 14 6.065 -2.406 -14.251 105 HA THR 14 HA THR 14 5.360 0.351 -14.151 106 HB THR 14 HB THR 14 3.809 -2.039 -13.105 107 HG1 THR 14 HG1 THR 14 2.738 -1.833 -15.169 108 HG21 THR 14 3HG2 THR 14 1.828 -0.605 -13.353 109 HG22 THR 14 1HG2 THR 14 2.863 0.745 -13.820 110 HG23 THR 14 2HG2 THR 14 2.968 0.076 -12.191 111 H LEU 15 H LEU 15 5.900 -2.113 -11.655 112 HA LEU 15 HA LEU 15 5.433 -0.481 -9.408 113 HB2 LEU 15 2HB LEU 15 5.583 -2.934 -9.313 114 HB3 LEU 15 3HB LEU 15 7.291 -2.849 -9.701 115 HG LEU 15 HG LEU 15 7.695 -1.657 -7.561 116 HD11 LEU 15 1HD1 LEU 15 5.518 -0.628 -7.246 117 HD12 LEU 15 2HD1 LEU 15 5.932 -1.625 -5.851 118 HD13 LEU 15 3HD1 LEU 15 4.773 -2.214 -7.043 119 HD21 LEU 15 3HD2 LEU 15 8.001 -4.065 -7.679 120 HD22 LEU 15 1HD2 LEU 15 6.296 -4.321 -7.305 121 HD23 LEU 15 2HD2 LEU 15 7.366 -3.602 -6.101 122 H ARG 16 H ARG 16 8.225 -0.841 -11.496 123 HA ARG 16 HA ARG 16 10.194 0.383 -9.943 124 HB2 ARG 16 2HB ARG 16 10.638 -0.791 -12.064 125 HB3 ARG 16 3HB ARG 16 9.852 0.507 -12.950 126 HG2 ARG 16 2HG ARG 16 11.579 2.057 -12.359 127 HG3 ARG 16 3HG ARG 16 12.300 0.901 -11.235 128 HD2 ARG 16 2HD ARG 16 13.569 1.002 -13.322 129 HD3 ARG 16 3HD ARG 16 12.842 -0.588 -13.100 130 HE ARG 16 HE ARG 16 11.529 1.410 -14.810 131 HH11 ARG 16 1HH1 ARG 16 13.121 -1.631 -14.485 132 HH12 ARG 16 2HH1 ARG 16 12.594 -2.193 -16.034 133 HH21 ARG 16 1HH2 ARG 16 10.863 0.688 -16.782 134 HH22 ARG 16 2HH2 ARG 16 11.340 -0.880 -17.331 135 H LYS 17 H LYS 17 7.610 1.832 -11.876 136 HA LYS 17 HA LYS 17 8.327 4.530 -11.745 137 HB2 LYS 17 2HB LYS 17 5.650 3.143 -11.733 138 HB3 LYS 17 3HB LYS 17 5.740 4.886 -11.551 139 HG2 LYS 17 2HG LYS 17 5.300 4.423 -13.834 140 HG3 LYS 17 3HG LYS 17 6.967 4.980 -13.725 141 HD2 LYS 17 2HD LYS 17 7.757 2.669 -13.858 142 HD3 LYS 17 3HD LYS 17 6.089 2.097 -13.929 143 HE2 LYS 17 2HE LYS 17 7.077 2.152 -16.157 144 HE3 LYS 17 3HE LYS 17 5.763 3.320 -16.030 145 HZ1 LYS 17 3HZ LYS 17 7.754 4.183 -17.174 146 HZ2 LYS 17 1HZ LYS 17 8.635 4.008 -15.742 147 HZ3 LYS 17 2HZ LYS 17 7.336 5.089 -15.808 148 H PHE 18 H PHE 18 6.251 2.732 -9.485 149 HA PHE 18 HA PHE 18 5.918 4.753 -7.583 150 HB2 PHE 18 2HB PHE 18 5.854 1.745 -7.222 151 HB3 PHE 18 3HB PHE 18 5.252 2.910 -6.045 152 HD1 PHE 18 HD1 PHE 18 4.758 1.649 -9.504 153 HD2 PHE 18 HD2 PHE 18 3.084 3.810 -6.236 154 HE1 PHE 18 HE1 PHE 18 2.575 1.673 -10.638 155 HE2 PHE 18 HE2 PHE 18 0.903 3.834 -7.367 156 HZ PHE 18 HZ PHE 18 0.646 2.768 -9.569 157 H LYS 19 H LYS 19 8.267 2.072 -7.627 158 HA LYS 19 HA LYS 19 9.544 2.665 -5.208 159 HB2 LYS 19 2HB LYS 19 10.692 1.388 -7.702 160 HB3 LYS 19 3HB LYS 19 11.479 1.394 -6.129 161 HG2 LYS 19 2HG LYS 19 9.475 0.185 -5.219 162 HG3 LYS 19 3HG LYS 19 8.898 0.030 -6.879 163 HD2 LYS 19 2HD LYS 19 11.549 -1.008 -5.860 164 HD3 LYS 19 3HD LYS 19 10.098 -1.987 -6.070 165 HE2 LYS 19 2HE LYS 19 10.124 -1.589 -8.456 166 HE3 LYS 19 3HE LYS 19 11.479 -0.470 -8.290 167 HZ1 LYS 19 3HZ LYS 19 12.154 -2.689 -9.048 168 HZ2 LYS 19 1HZ LYS 19 11.583 -3.363 -7.605 169 HZ3 LYS 19 2HZ LYS 19 12.878 -2.271 -7.582 170 H ASP 20 H ASP 20 10.169 3.896 -8.481 171 HA ASP 20 HA ASP 20 12.529 5.317 -7.805 172 HB2 ASP 20 2HB ASP 20 11.824 4.635 -10.123 173 HB3 ASP 20 3HB ASP 20 10.637 5.935 -10.082 174 H ILE 21 H ILE 21 9.122 6.319 -8.052 175 HA ILE 21 HA ILE 21 9.423 9.035 -7.452 176 HB ILE 21 HB ILE 21 7.135 7.179 -6.728 177 HG12 ILE 21 2HG1 ILE 21 7.452 9.096 -9.063 178 HG13 ILE 21 3HG1 ILE 21 7.629 7.347 -9.161 179 HG21 ILE 21 1HG2 ILE 21 7.235 10.200 -6.737 180 HG22 ILE 21 2HG2 ILE 21 7.020 9.153 -5.334 181 HG23 ILE 21 3HG2 ILE 21 5.765 9.240 -6.569 182 HD11 ILE 21 3HD1 ILE 21 5.457 8.080 -9.973 183 HD12 ILE 21 1HD1 ILE 21 5.110 8.820 -8.411 184 HD13 ILE 21 2HD1 ILE 21 5.291 7.070 -8.539 185 H ILE 22 H ILE 22 8.761 6.329 -5.211 186 HA ILE 22 HA ILE 22 8.756 7.746 -2.817 187 HB ILE 22 HB ILE 22 9.649 4.900 -3.329 188 HG12 ILE 22 2HG1 ILE 22 7.001 6.030 -2.364 189 HG13 ILE 22 3HG1 ILE 22 7.317 5.405 -3.979 190 HG21 ILE 22 1HG2 ILE 22 10.548 5.673 -1.193 191 HG22 ILE 22 2HG2 ILE 22 9.260 4.497 -0.938 192 HG23 ILE 22 3HG2 ILE 22 8.943 6.215 -0.701 193 HD11 ILE 22 3HD1 ILE 22 7.404 3.813 -1.424 194 HD12 ILE 22 1HD1 ILE 22 7.711 3.185 -3.045 195 HD13 ILE 22 2HD1 ILE 22 6.111 3.796 -2.623 196 H LYS 23 H LYS 23 11.542 6.271 -4.498 197 HA LYS 23 HA LYS 23 13.502 6.932 -2.585 198 HB2 LYS 23 2HB LYS 23 13.759 6.573 -5.580 199 HB3 LYS 23 3HB LYS 23 15.127 6.713 -4.483 200 HG2 LYS 23 2HG LYS 23 14.374 4.685 -3.312 201 HG3 LYS 23 3HG LYS 23 13.040 4.535 -4.454 202 HD2 LYS 23 2HD LYS 23 15.973 4.486 -5.197 203 HD3 LYS 23 3HD LYS 23 14.965 3.057 -4.986 204 HE2 LYS 23 2HE LYS 23 14.960 3.372 -7.291 205 HE3 LYS 23 3HE LYS 23 13.452 4.130 -6.792 206 HZ1 LYS 23 3HZ LYS 23 14.668 6.288 -6.820 207 HZ2 LYS 23 1HZ LYS 23 14.544 5.555 -8.339 208 HZ3 LYS 23 2HZ LYS 23 15.997 5.488 -7.483 209 H LYS 24 H LYS 24 12.201 8.783 -5.315 210 HA LYS 24 HA LYS 24 13.964 11.008 -5.026 211 HB2 LYS 24 2HB LYS 24 11.258 10.738 -6.351 212 HB3 LYS 24 3HB LYS 24 12.244 12.192 -6.430 213 HG2 LYS 24 2HG LYS 24 14.009 10.977 -7.565 214 HG3 LYS 24 3HG LYS 24 13.098 9.473 -7.417 215 HD2 LYS 24 2HD LYS 24 11.342 10.357 -8.845 216 HD3 LYS 24 3HD LYS 24 12.157 11.920 -8.924 217 HE2 LYS 24 2HE LYS 24 14.036 10.921 -10.086 218 HE3 LYS 24 3HE LYS 24 13.318 9.318 -9.924 219 HZ1 LYS 24 3HZ LYS 24 12.961 10.266 -12.122 220 HZ2 LYS 24 1HZ LYS 24 12.134 11.578 -11.444 221 HZ3 LYS 24 2HZ LYS 24 11.495 10.019 -11.318 222 H ASN 25 H ASN 25 10.837 10.175 -3.640 223 HA ASN 25 HA ASN 25 10.347 12.647 -2.331 224 HB2 ASN 25 2HB ASN 25 9.414 9.843 -1.663 225 HB3 ASN 25 3HB ASN 25 8.803 11.302 -0.892 226 HD21 ASN 25 1HD2 ASN 25 8.751 12.939 -3.230 227 HD22 ASN 25 2HD2 ASN 25 7.474 12.343 -4.230 228 H GLY 26 H GLY 26 12.531 10.070 -1.687 229 HA2 GLY 26 2HA GLY 26 14.431 10.542 -0.274 230 HA3 GLY 26 3HA GLY 26 13.369 11.443 0.793 231 H PHE 27 H PHE 27 11.817 8.623 -0.142 232 HA PHE 27 HA PHE 27 12.476 7.395 2.455 233 HB2 PHE 27 2HB PHE 27 10.047 6.991 0.693 234 HB3 PHE 27 3HB PHE 27 10.302 6.258 2.273 235 HD1 PHE 27 HD1 PHE 27 10.175 7.612 4.309 236 HD2 PHE 27 HD2 PHE 27 9.409 9.302 0.474 237 HE1 PHE 27 HE1 PHE 27 9.127 9.563 5.380 238 HE2 PHE 27 HE2 PHE 27 8.362 11.254 1.542 239 HZ PHE 27 HZ PHE 27 8.221 11.387 3.995 240 H LYS 28 H LYS 28 12.159 4.941 2.486 241 HA LYS 28 HA LYS 28 13.509 3.744 0.149 242 HB2 LYS 28 2HB LYS 28 13.691 2.877 3.048 243 HB3 LYS 28 3HB LYS 28 14.560 2.163 1.693 244 HG2 LYS 28 2HG LYS 28 15.757 4.259 1.332 245 HG3 LYS 28 3HG LYS 28 14.866 5.007 2.657 246 HD2 LYS 28 2HD LYS 28 15.860 3.345 4.211 247 HD3 LYS 28 3HD LYS 28 16.805 2.695 2.867 248 HE2 LYS 28 2HE LYS 28 17.851 4.913 2.566 249 HE3 LYS 28 3HE LYS 28 16.942 5.514 3.951 250 HZ1 LYS 28 3HZ LYS 28 18.991 3.371 3.982 251 HZ2 LYS 28 1HZ LYS 28 18.069 3.838 5.319 252 HZ3 LYS 28 2HZ LYS 28 19.151 4.928 4.617 253 H VAL 29 H VAL 29 12.767 1.768 -0.647 254 HA VAL 29 HA VAL 29 9.948 1.276 0.004 255 HB VAL 29 HB VAL 29 11.524 0.328 -2.400 256 HG11 VAL 29 1HG1 VAL 29 9.535 -1.016 -1.964 257 HG12 VAL 29 2HG1 VAL 29 9.317 -0.037 -3.415 258 HG13 VAL 29 3HG1 VAL 29 8.543 0.443 -1.905 259 HG21 VAL 29 3HG2 VAL 29 11.473 2.767 -2.323 260 HG22 VAL 29 1HG2 VAL 29 9.719 2.738 -2.131 261 HG23 VAL 29 2HG2 VAL 29 10.453 2.161 -3.627 262 H ARG 30 H ARG 30 9.222 -0.563 0.915 263 HA ARG 30 HA ARG 30 10.907 -2.993 0.768 264 HB2 ARG 30 2HB ARG 30 8.951 -2.092 2.885 265 HB3 ARG 30 3HB ARG 30 9.446 -3.771 2.747 266 HG2 ARG 30 2HG ARG 30 11.230 -1.409 3.300 267 HG3 ARG 30 3HG ARG 30 10.756 -2.671 4.440 268 HD2 ARG 30 2HD ARG 30 12.461 -3.008 1.963 269 HD3 ARG 30 3HD ARG 30 13.002 -3.103 3.639 270 HE ARG 30 HE ARG 30 11.229 -5.062 3.631 271 HH11 ARG 30 1HH1 ARG 30 13.562 -4.273 1.219 272 HH12 ARG 30 2HH1 ARG 30 13.761 -5.911 0.711 273 HH21 ARG 30 1HH2 ARG 30 11.479 -7.174 2.952 274 HH22 ARG 30 2HH2 ARG 30 12.598 -7.533 1.685 275 H THR 31 H THR 31 10.163 -3.984 -1.061 276 HA THR 31 HA THR 31 7.336 -4.138 -1.664 277 HB THR 31 HB THR 31 8.044 -5.511 -3.618 278 HG1 THR 31 HG1 THR 31 9.943 -6.425 -2.621 279 HG21 THR 31 3HG2 THR 31 9.200 -3.718 -4.809 280 HG22 THR 31 1HG2 THR 31 9.627 -2.953 -3.276 281 HG23 THR 31 2HG2 THR 31 7.937 -3.049 -3.774 282 H VAL 32 H VAL 32 6.127 -5.451 -0.451 283 HA VAL 32 HA VAL 32 7.100 -7.830 0.804 284 HB VAL 32 HB VAL 32 4.278 -6.778 0.464 285 HG11 VAL 32 1HG1 VAL 32 4.191 -9.185 0.822 286 HG12 VAL 32 2HG1 VAL 32 3.648 -8.335 2.269 287 HG13 VAL 32 3HG1 VAL 32 5.264 -9.036 2.215 288 HG21 VAL 32 3HG2 VAL 32 5.719 -5.318 1.783 289 HG22 VAL 32 1HG2 VAL 32 6.177 -6.675 2.814 290 HG23 VAL 32 2HG2 VAL 32 4.512 -6.090 2.810 291 H ARG 33 H ARG 33 7.073 -9.880 0.120 292 HA ARG 33 HA ARG 33 5.634 -10.551 -2.376 293 HB2 ARG 33 2HB ARG 33 7.291 -12.298 -2.741 294 HB3 ARG 33 3HB ARG 33 8.100 -10.755 -2.502 295 HG2 ARG 33 2HG ARG 33 8.585 -11.380 -0.171 296 HG3 ARG 33 3HG ARG 33 7.796 -12.935 -0.435 297 HD2 ARG 33 2HD ARG 33 9.462 -13.379 -2.252 298 HD3 ARG 33 3HD ARG 33 10.299 -11.903 -1.769 299 HE ARG 33 HE ARG 33 9.924 -13.611 0.458 300 HH11 ARG 33 1HH1 ARG 33 11.845 -13.280 -2.382 301 HH12 ARG 33 2HH1 ARG 33 13.166 -14.173 -1.722 302 HH21 ARG 33 1HH2 ARG 33 11.609 -14.757 1.286 303 HH22 ARG 33 2HH2 ARG 33 13.034 -15.001 0.340 304 H SER 34 H SER 34 5.949 -11.271 0.978 305 HA SER 34 HA SER 34 3.834 -13.268 0.858 306 HB2 SER 34 2HB SER 34 5.090 -14.985 2.038 307 HB3 SER 34 3HB SER 34 5.980 -14.550 0.579 308 HG SER 34 HG SER 34 7.430 -14.602 2.264 309 HA PRO 35 HA PRO 35 2.593 -11.623 4.811 310 HB2 PRO 35 2HB PRO 35 2.306 -13.899 6.378 311 HB3 PRO 35 3HB PRO 35 1.092 -13.284 5.252 312 HG2 PRO 35 2HG PRO 35 3.121 -15.453 4.853 313 HG3 PRO 35 3HG PRO 35 1.419 -15.404 4.353 314 HD2 PRO 35 2HD PRO 35 3.375 -14.957 2.592 315 HD3 PRO 35 3HD PRO 35 1.868 -14.019 2.531 316 H GLN 36 H GLN 36 5.362 -13.711 4.659 317 HA GLN 36 HA GLN 36 6.402 -13.359 7.254 318 HB2 GLN 36 2HB GLN 36 7.289 -15.117 5.935 319 HB3 GLN 36 3HB GLN 36 7.665 -14.042 4.600 320 HG2 GLN 36 2HG GLN 36 9.032 -13.597 7.208 321 HG3 GLN 36 3HG GLN 36 9.537 -14.958 6.211 322 HE21 GLN 36 1HE2 GLN 36 10.934 -12.470 6.963 323 HE22 GLN 36 2HE2 GLN 36 11.405 -11.744 5.470 324 H GLU 37 H GLU 37 7.089 -11.566 4.241 325 HA GLU 37 HA GLU 37 8.872 -9.682 5.261 326 HB2 GLU 37 2HB GLU 37 6.790 -9.348 3.085 327 HB3 GLU 37 3HB GLU 37 8.080 -8.197 3.401 328 HG2 GLU 37 2HG GLU 37 8.524 -11.077 2.630 329 HG3 GLU 37 3HG GLU 37 8.511 -9.730 1.495 330 H LEU 38 H LEU 38 5.313 -9.544 5.162 331 HA LEU 38 HA LEU 38 5.036 -7.010 6.396 332 HB2 LEU 38 2HB LEU 38 3.257 -8.252 5.130 333 HB3 LEU 38 3HB LEU 38 3.101 -9.336 6.500 334 HG LEU 38 HG LEU 38 2.422 -7.398 7.911 335 HD11 LEU 38 1HD1 LEU 38 3.528 -5.616 6.675 336 HD12 LEU 38 2HD1 LEU 38 1.803 -5.288 6.825 337 HD13 LEU 38 3HD1 LEU 38 2.457 -5.884 5.298 338 HD21 LEU 38 3HD2 LEU 38 0.715 -8.808 6.925 339 HD22 LEU 38 1HD2 LEU 38 0.758 -7.867 5.433 340 HD23 LEU 38 2HD2 LEU 38 0.178 -7.129 6.927 341 H LYS 39 H LYS 39 5.076 -10.304 7.691 342 HA LYS 39 HA LYS 39 4.729 -9.877 10.395 343 HB2 LYS 39 2HB LYS 39 4.866 -12.111 9.969 344 HB3 LYS 39 3HB LYS 39 6.033 -11.899 8.681 345 HG2 LYS 39 2HG LYS 39 7.074 -13.208 10.339 346 HG3 LYS 39 3HG LYS 39 7.797 -11.606 10.445 347 HD2 LYS 39 2HD LYS 39 6.509 -11.090 12.410 348 HD3 LYS 39 3HD LYS 39 5.566 -12.574 12.240 349 HE2 LYS 39 2HE LYS 39 7.272 -12.827 13.970 350 HE3 LYS 39 3HE LYS 39 7.585 -13.910 12.617 351 HZ1 LYS 39 3HZ LYS 39 9.024 -11.437 13.355 352 HZ2 LYS 39 1HZ LYS 39 9.153 -12.095 11.799 353 HZ3 LYS 39 2HZ LYS 39 9.644 -12.988 13.148 354 H ASP 40 H ASP 40 7.879 -9.911 8.681 355 HA ASP 40 HA ASP 40 9.335 -9.068 10.969 356 HB2 ASP 40 2HB ASP 40 10.057 -9.240 8.049 357 HB3 ASP 40 3HB ASP 40 11.201 -8.722 9.283 358 H SER 41 H SER 41 7.573 -7.297 8.587 359 HA SER 41 HA SER 41 8.806 -4.766 8.902 360 HB2 SER 41 2HB SER 41 7.186 -5.171 7.107 361 HB3 SER 41 3HB SER 41 5.906 -5.427 8.292 362 HG SER 41 HG SER 41 7.115 -3.062 7.446 363 H ILE 42 H ILE 42 5.996 -6.216 10.562 364 HA ILE 42 HA ILE 42 5.624 -4.164 12.460 365 HB ILE 42 HB ILE 42 4.833 -7.071 12.411 366 HG12 ILE 42 2HG1 ILE 42 2.546 -6.090 12.373 367 HG13 ILE 42 3HG1 ILE 42 3.250 -4.480 12.410 368 HG21 ILE 42 1HG2 ILE 42 4.317 -5.151 14.688 369 HG22 ILE 42 2HG2 ILE 42 5.289 -6.622 14.752 370 HG23 ILE 42 3HG2 ILE 42 3.548 -6.727 14.491 371 HD11 ILE 42 3HD1 ILE 42 4.301 -4.907 10.241 372 HD12 ILE 42 1HD1 ILE 42 2.545 -5.065 10.181 373 HD13 ILE 42 2HD1 ILE 42 3.558 -6.507 10.210 374 H GLU 43 H GLU 43 7.640 -7.077 12.537 375 HA GLU 43 HA GLU 43 8.585 -6.930 15.165 376 HB2 GLU 43 2HB GLU 43 10.184 -7.773 12.736 377 HB3 GLU 43 3HB GLU 43 10.489 -8.236 14.405 378 HG2 GLU 43 2HG GLU 43 7.983 -8.944 12.895 379 HG3 GLU 43 3HG GLU 43 9.401 -9.982 12.990 380 H GLU 44 H GLU 44 9.435 -5.036 12.349 381 HA GLU 44 HA GLU 44 11.667 -3.711 13.632 382 HB2 GLU 44 2HB GLU 44 11.529 -4.036 11.162 383 HB3 GLU 44 3HB GLU 44 10.150 -2.949 11.124 384 HG2 GLU 44 2HG GLU 44 11.940 -1.620 10.472 385 HG3 GLU 44 3HG GLU 44 11.703 -1.209 12.169 386 H LEU 45 H LEU 45 8.264 -3.030 12.957 387 HA LEU 45 HA LEU 45 8.120 -0.356 13.773 388 HB2 LEU 45 2HB LEU 45 6.033 -2.534 13.972 389 HB3 LEU 45 3HB LEU 45 5.703 -0.829 14.208 390 HG LEU 45 HG LEU 45 6.682 -2.081 11.633 391 HD11 LEU 45 1HD1 LEU 45 4.377 -2.704 12.134 392 HD12 LEU 45 2HD1 LEU 45 4.443 -1.576 10.781 393 HD13 LEU 45 3HD1 LEU 45 3.958 -1.009 12.379 394 HD21 LEU 45 3HD2 LEU 45 6.189 0.133 10.659 395 HD22 LEU 45 1HD2 LEU 45 7.491 0.185 11.850 396 HD23 LEU 45 2HD2 LEU 45 5.879 0.756 12.281 397 H VAL 46 H VAL 46 8.142 -3.302 15.684 398 HA VAL 46 HA VAL 46 7.507 -1.894 18.150 399 HB VAL 46 HB VAL 46 6.716 -4.227 17.685 400 HG11 VAL 46 1HG1 VAL 46 9.609 -4.966 18.141 401 HG12 VAL 46 2HG1 VAL 46 8.708 -5.133 16.634 402 HG13 VAL 46 3HG1 VAL 46 8.261 -6.101 18.038 403 HG21 VAL 46 3HG2 VAL 46 8.372 -3.869 20.189 404 HG22 VAL 46 1HG2 VAL 46 7.105 -5.076 19.961 405 HG23 VAL 46 2HG2 VAL 46 6.700 -3.360 19.954 406 H LYS 47 H LYS 47 10.220 -1.909 16.361 407 HA LYS 47 HA LYS 47 12.000 -1.922 18.718 408 HB2 LYS 47 2HB LYS 47 12.664 -2.812 15.904 409 HB3 LYS 47 3HB LYS 47 13.843 -2.630 17.195 410 HG2 LYS 47 2HG LYS 47 11.503 -4.535 17.210 411 HG3 LYS 47 3HG LYS 47 13.184 -4.962 16.884 412 HD2 LYS 47 2HD LYS 47 13.814 -4.259 19.145 413 HD3 LYS 47 3HD LYS 47 12.145 -3.787 19.474 414 HE2 LYS 47 2HE LYS 47 11.432 -6.118 19.161 415 HE3 LYS 47 3HE LYS 47 13.104 -6.583 18.843 416 HZ1 LYS 47 3HZ LYS 47 12.430 -7.045 21.126 417 HZ2 LYS 47 1HZ LYS 47 12.116 -5.405 21.381 418 HZ3 LYS 47 2HZ LYS 47 13.695 -5.926 21.075 419 H LYS 48 H LYS 48 12.679 -0.862 15.355 420 HA LYS 48 HA LYS 48 12.692 1.922 15.917 421 HB2 LYS 48 2HB LYS 48 15.041 2.402 16.138 422 HB3 LYS 48 3HB LYS 48 14.609 1.233 17.374 423 HG2 LYS 48 2HG LYS 48 15.917 0.496 14.753 424 HG3 LYS 48 3HG LYS 48 16.805 0.822 16.241 425 HD2 LYS 48 2HD LYS 48 15.878 -1.068 17.328 426 HD3 LYS 48 3HD LYS 48 14.642 -1.270 16.087 427 HE2 LYS 48 2HE LYS 48 17.608 -1.651 15.679 428 HE3 LYS 48 3HE LYS 48 16.431 -2.945 15.900 429 HZ1 LYS 48 3HZ LYS 48 16.843 -2.689 13.584 430 HZ2 LYS 48 1HZ LYS 48 16.568 -1.022 13.645 431 HZ3 LYS 48 2HZ LYS 48 15.287 -2.099 13.882 432 H TYR 49 H TYR 49 12.987 3.145 14.073 433 HA TYR 49 HA TYR 49 14.589 2.560 11.864 434 HB2 TYR 49 2HB TYR 49 13.183 1.596 10.232 435 HB3 TYR 49 3HB TYR 49 12.829 0.662 11.682 436 HD1 TYR 49 HD2 TYR 49 10.804 1.566 13.129 437 HD2 TYR 49 HD1 TYR 49 11.421 2.476 9.015 438 HE1 TYR 49 HE2 TYR 49 8.433 2.178 12.912 439 HE2 TYR 49 HE1 TYR 49 9.058 3.091 8.792 440 HH TYR 49 HH TYR 49 7.023 3.595 11.436 441 H ASN 50 H ASN 50 13.794 3.872 9.822 442 HA ASN 50 HA ASN 50 11.726 5.816 10.198 443 HB2 ASN 50 2HB ASN 50 13.758 6.694 11.547 444 HB3 ASN 50 3HB ASN 50 14.491 7.015 9.978 445 HD21 ASN 50 1HD2 ASN 50 13.792 8.916 12.000 446 HD22 ASN 50 2HD2 ASN 50 12.638 9.990 11.298 447 H ALA 51 H ALA 51 11.252 6.999 8.292 448 HA ALA 51 HA ALA 51 11.133 7.490 6.082 449 HB1 ALA 51 3HB ALA 51 13.179 7.668 4.793 450 HB2 ALA 51 1HB ALA 51 14.044 6.703 5.991 451 HB3 ALA 51 2HB ALA 51 13.422 8.294 6.423 452 H THR 52 H THR 52 10.995 4.498 7.063 453 HA THR 52 HA THR 52 11.408 3.187 4.462 454 HB THR 52 HB THR 52 10.694 1.900 7.112 455 HG1 THR 52 HG1 THR 52 12.979 1.231 6.959 456 HG21 THR 52 3HG2 THR 52 11.663 0.697 4.508 457 HG22 THR 52 1HG2 THR 52 10.043 0.532 5.191 458 HG23 THR 52 2HG2 THR 52 11.426 -0.184 6.018 459 H ILE 53 H ILE 53 9.751 3.033 3.093 460 HA ILE 53 HA ILE 53 6.979 2.924 4.112 461 HB ILE 53 HB ILE 53 8.025 3.648 1.361 462 HG12 ILE 53 2HG1 ILE 53 6.639 5.285 3.506 463 HG13 ILE 53 3HG1 ILE 53 8.321 5.432 3.003 464 HG21 ILE 53 1HG2 ILE 53 5.694 4.117 0.750 465 HG22 ILE 53 2HG2 ILE 53 5.159 3.495 2.312 466 HG23 ILE 53 3HG2 ILE 53 5.929 2.415 1.150 467 HD11 ILE 53 3HD1 ILE 53 7.569 6.167 0.784 468 HD12 ILE 53 1HD1 ILE 53 6.994 7.219 2.076 469 HD13 ILE 53 2HD1 ILE 53 5.895 6.059 1.333 470 H VAL 54 H VAL 54 5.619 1.220 3.560 471 HA VAL 54 HA VAL 54 6.978 -1.128 2.408 472 HB VAL 54 HB VAL 54 6.232 -1.394 4.731 473 HG11 VAL 54 1HG1 VAL 54 3.855 -1.499 5.299 474 HG12 VAL 54 2HG1 VAL 54 3.437 -0.992 3.662 475 HG13 VAL 54 3HG1 VAL 54 4.312 0.108 4.729 476 HG21 VAL 54 3HG2 VAL 54 6.352 -3.354 3.287 477 HG22 VAL 54 1HG2 VAL 54 4.680 -3.100 2.779 478 HG23 VAL 54 2HG2 VAL 54 5.039 -3.517 4.456 479 H VAL 55 H VAL 55 6.281 -2.011 0.574 480 HA VAL 55 HA VAL 55 3.666 -1.187 -0.535 481 HB VAL 55 HB VAL 55 6.182 -1.864 -2.090 482 HG11 VAL 55 1HG1 VAL 55 4.914 -1.097 -4.057 483 HG12 VAL 55 2HG1 VAL 55 3.482 -0.891 -3.046 484 HG13 VAL 55 3HG1 VAL 55 4.162 -2.500 -3.296 485 HG21 VAL 55 3HG2 VAL 55 4.849 0.813 -1.638 486 HG22 VAL 55 1HG2 VAL 55 6.222 0.515 -2.706 487 HG23 VAL 55 2HG2 VAL 55 6.393 0.291 -0.965 488 H VAL 56 H VAL 56 2.285 -2.864 -0.469 489 HA VAL 56 HA VAL 56 3.321 -5.609 -0.536 490 HB VAL 56 HB VAL 56 0.508 -4.646 0.061 491 HG11 VAL 56 1HG1 VAL 56 0.166 -6.904 0.969 492 HG12 VAL 56 2HG1 VAL 56 1.787 -7.359 0.445 493 HG13 VAL 56 3HG1 VAL 56 0.557 -6.948 -0.750 494 HG21 VAL 56 3HG2 VAL 56 1.049 -5.088 2.413 495 HG22 VAL 56 1HG2 VAL 56 2.094 -3.839 1.735 496 HG23 VAL 56 2HG2 VAL 56 2.709 -5.478 1.960 497 H VAL 57 H VAL 57 3.522 -6.462 -2.525 498 HA VAL 57 HA VAL 57 1.762 -5.679 -4.706 499 HB VAL 57 HB VAL 57 3.983 -7.745 -4.702 500 HG11 VAL 57 1HG1 VAL 57 3.962 -7.441 -7.142 501 HG12 VAL 57 2HG1 VAL 57 2.587 -6.346 -6.992 502 HG13 VAL 57 3HG1 VAL 57 2.414 -8.044 -6.548 503 HG21 VAL 57 3HG2 VAL 57 4.841 -5.536 -4.089 504 HG22 VAL 57 1HG2 VAL 57 4.077 -4.831 -5.514 505 HG23 VAL 57 2HG2 VAL 57 5.388 -5.998 -5.700 506 H VAL 58 H VAL 58 -0.098 -6.704 -5.158 507 HA VAL 58 HA VAL 58 -0.475 -9.464 -4.183 508 HB VAL 58 HB VAL 58 -2.800 -8.946 -3.628 509 HG11 VAL 58 1HG1 VAL 58 -2.397 -7.521 -1.656 510 HG12 VAL 58 2HG1 VAL 58 -0.824 -7.071 -2.315 511 HG13 VAL 58 3HG1 VAL 58 -1.144 -8.745 -1.862 512 HG21 VAL 58 3HG2 VAL 58 -2.116 -6.081 -4.323 513 HG22 VAL 58 1HG2 VAL 58 -3.637 -6.649 -3.632 514 HG23 VAL 58 2HG2 VAL 58 -3.168 -7.142 -5.259 515 H ASP 59 H ASP 59 -1.687 -10.856 -5.421 516 HA ASP 59 HA ASP 59 -2.679 -9.866 -8.023 517 HB2 ASP 59 2HB ASP 59 -2.075 -12.002 -9.011 518 HB3 ASP 59 3HB ASP 59 -0.659 -11.305 -8.230 519 H ASP 60 H ASP 60 -3.110 -12.338 -5.500 520 HA ASP 60 HA ASP 60 -5.794 -12.963 -6.433 521 HB2 ASP 60 2HB ASP 60 -4.305 -14.772 -5.692 522 HB3 ASP 60 3HB ASP 60 -4.207 -14.046 -4.091 523 H LYS 61 H LYS 61 -7.700 -12.565 -5.286 524 HA LYS 61 HA LYS 61 -7.801 -10.136 -3.867 525 HB2 LYS 61 2HB LYS 61 -10.172 -10.559 -3.589 526 HB3 LYS 61 3HB LYS 61 -9.668 -10.980 -5.218 527 HG2 LYS 61 2HG LYS 61 -9.622 -13.368 -4.554 528 HG3 LYS 61 3HG LYS 61 -10.222 -12.908 -2.958 529 HD2 LYS 61 2HD LYS 61 -11.638 -12.520 -5.606 530 HD3 LYS 61 3HD LYS 61 -12.063 -13.678 -4.344 531 HE2 LYS 61 2HE LYS 61 -12.574 -11.840 -2.815 532 HE3 LYS 61 3HE LYS 61 -12.115 -10.670 -4.053 533 HZ1 LYS 61 3HZ LYS 61 -14.479 -10.893 -4.018 534 HZ2 LYS 61 1HZ LYS 61 -14.389 -12.573 -4.168 535 HZ3 LYS 61 2HZ LYS 61 -13.911 -11.583 -5.453 536 H GLU 62 H GLU 62 -7.807 -13.493 -2.679 537 HA GLU 62 HA GLU 62 -8.401 -12.816 0.029 538 HB2 GLU 62 2HB GLU 62 -8.678 -15.109 -0.843 539 HB3 GLU 62 3HB GLU 62 -6.935 -15.243 -1.047 540 HG2 GLU 62 2HG GLU 62 -6.653 -14.967 1.388 541 HG3 GLU 62 3HG GLU 62 -8.405 -14.901 1.564 542 H TRP 63 H TRP 63 -5.369 -13.386 -1.722 543 HA TRP 63 HA TRP 63 -3.567 -12.813 0.350 544 HB2 TRP 63 2HB TRP 63 -2.734 -13.819 -1.650 545 HB3 TRP 63 3HB TRP 63 -3.371 -12.523 -2.653 546 HD1 TRP 63 HD1 TRP 63 -1.363 -11.321 -3.661 547 HE1 TRP 63 HE1 TRP 63 0.869 -10.374 -2.797 548 HE3 TRP 63 HE3 TRP 63 -1.613 -12.941 1.189 549 HZ2 TRP 63 HZ2 TRP 63 2.327 -10.324 -0.386 550 HZ3 TRP 63 HZ3 TRP 63 0.246 -12.397 2.706 551 HH2 TRP 63 HH2 TRP 63 2.174 -11.116 1.934 552 H ALA 64 H ALA 64 -5.238 -10.666 -1.914 553 HA ALA 64 HA ALA 64 -4.006 -8.245 -1.262 554 HB1 ALA 64 3HB ALA 64 -5.542 -8.472 -3.144 555 HB2 ALA 64 1HB ALA 64 -6.053 -7.163 -2.078 556 HB3 ALA 64 2HB ALA 64 -6.891 -8.717 -2.034 557 H GLU 65 H GLU 65 -6.979 -9.661 0.165 558 HA GLU 65 HA GLU 65 -7.212 -7.736 2.234 559 HB2 GLU 65 2HB GLU 65 -9.095 -9.195 1.592 560 HB3 GLU 65 3HB GLU 65 -8.216 -10.595 2.201 561 HG2 GLU 65 2HG GLU 65 -8.185 -9.423 4.457 562 HG3 GLU 65 3HG GLU 65 -9.342 -8.286 3.772 563 H LYS 66 H LYS 66 -5.430 -10.746 1.974 564 HA LYS 66 HA LYS 66 -5.074 -11.437 4.620 565 HB2 LYS 66 2HB LYS 66 -4.397 -12.713 2.522 566 HB3 LYS 66 3HB LYS 66 -2.926 -11.754 2.522 567 HG2 LYS 66 2HG LYS 66 -2.672 -14.004 3.529 568 HG3 LYS 66 3HG LYS 66 -2.241 -12.685 4.621 569 HD2 LYS 66 2HD LYS 66 -4.082 -13.020 5.975 570 HD3 LYS 66 3HD LYS 66 -5.044 -13.727 4.676 571 HE2 LYS 66 2HE LYS 66 -2.690 -15.081 6.001 572 HE3 LYS 66 3HE LYS 66 -4.379 -15.359 6.429 573 HZ1 LYS 66 3HZ LYS 66 -3.739 -17.063 4.938 574 HZ2 LYS 66 1HZ LYS 66 -3.054 -15.968 3.846 575 HZ3 LYS 66 2HZ LYS 66 -4.731 -16.012 4.060 576 H ALA 67 H ALA 67 -3.202 -9.093 2.728 577 HA ALA 67 HA ALA 67 -1.257 -8.465 4.667 578 HB1 ALA 67 3HB ALA 67 -2.488 -6.640 2.593 579 HB2 ALA 67 1HB ALA 67 -1.121 -7.725 2.332 580 HB3 ALA 67 2HB ALA 67 -0.969 -6.367 3.447 581 H ILE 68 H ILE 68 -4.390 -6.899 3.996 582 HA ILE 68 HA ILE 68 -4.277 -5.061 6.174 583 HB ILE 68 HB ILE 68 -6.837 -6.048 4.909 584 HG12 ILE 68 2HG1 ILE 68 -5.361 -5.599 3.037 585 HG13 ILE 68 3HG1 ILE 68 -6.530 -4.291 3.163 586 HG21 ILE 68 1HG2 ILE 68 -7.093 -4.528 6.791 587 HG22 ILE 68 2HG2 ILE 68 -7.577 -3.727 5.296 588 HG23 ILE 68 3HG2 ILE 68 -6.013 -3.363 6.024 589 HD11 ILE 68 3HD1 ILE 68 -4.369 -3.401 2.647 590 HD12 ILE 68 1HD1 ILE 68 -3.650 -4.223 4.030 591 HD13 ILE 68 2HD1 ILE 68 -4.810 -2.920 4.284 592 H ARG 69 H ARG 69 -5.254 -8.339 5.841 593 HA ARG 69 HA ARG 69 -7.006 -8.587 8.057 594 HB2 ARG 69 2HB ARG 69 -6.892 -10.085 6.051 595 HB3 ARG 69 3HB ARG 69 -5.376 -10.723 6.662 596 HG2 ARG 69 2HG ARG 69 -6.478 -11.687 8.565 597 HG3 ARG 69 3HG ARG 69 -8.001 -10.900 8.135 598 HD2 ARG 69 2HD ARG 69 -8.068 -12.181 6.040 599 HD3 ARG 69 3HD ARG 69 -6.550 -12.965 6.470 600 HE ARG 69 HE ARG 69 -7.782 -13.939 8.394 601 HH11 ARG 69 1HH1 ARG 69 -9.530 -12.831 5.635 602 HH12 ARG 69 2HH1 ARG 69 -10.819 -13.961 5.867 603 HH21 ARG 69 1HH2 ARG 69 -9.443 -15.374 8.689 604 HH22 ARG 69 2HH2 ARG 69 -10.776 -15.382 7.587 605 H PHE 70 H PHE 70 -3.527 -9.095 7.613 606 HA PHE 70 HA PHE 70 -3.064 -9.888 10.339 607 HB2 PHE 70 2HB PHE 70 -1.523 -10.542 8.528 608 HB3 PHE 70 3HB PHE 70 -1.124 -8.851 8.251 609 HD1 PHE 70 HD1 PHE 70 -0.985 -11.528 10.838 610 HD2 PHE 70 HD2 PHE 70 0.645 -7.849 9.424 611 HE1 PHE 70 HE1 PHE 70 0.831 -11.696 12.491 612 HE2 PHE 70 HE2 PHE 70 2.460 -8.017 11.078 613 HZ PHE 70 HZ PHE 70 2.555 -9.941 12.614 614 H VAL 71 H VAL 71 -2.737 -6.855 8.505 615 HA VAL 71 HA VAL 71 -1.738 -5.201 10.523 616 HB VAL 71 HB VAL 71 -3.632 -4.498 8.262 617 HG11 VAL 71 1HG1 VAL 71 -2.866 -2.178 8.559 618 HG12 VAL 71 2HG1 VAL 71 -1.969 -2.663 9.997 619 HG13 VAL 71 3HG1 VAL 71 -3.730 -2.770 9.978 620 HG21 VAL 71 3HG2 VAL 71 -1.611 -3.734 7.106 621 HG22 VAL 71 1HG2 VAL 71 -1.504 -5.447 7.511 622 HG23 VAL 71 2HG2 VAL 71 -0.624 -4.256 8.471 623 H LYS 72 H LYS 72 -5.010 -6.331 9.941 624 HA LYS 72 HA LYS 72 -6.552 -4.767 11.596 625 HB2 LYS 72 2HB LYS 72 -7.406 -6.632 10.225 626 HB3 LYS 72 3HB LYS 72 -6.649 -7.783 11.316 627 HG2 LYS 72 2HG LYS 72 -8.109 -6.761 13.146 628 HG3 LYS 72 3HG LYS 72 -9.006 -5.991 11.836 629 HD2 LYS 72 2HD LYS 72 -8.579 -8.961 12.213 630 HD3 LYS 72 3HD LYS 72 -10.078 -8.079 12.504 631 HE2 LYS 72 2HE LYS 72 -10.215 -7.512 10.128 632 HE3 LYS 72 3HE LYS 72 -8.697 -8.359 9.828 633 HZ1 LYS 72 3HZ LYS 72 -11.219 -9.591 10.804 634 HZ2 LYS 72 1HZ LYS 72 -9.759 -10.414 10.575 635 HZ3 LYS 72 2HZ LYS 72 -10.571 -9.746 9.251 636 H SER 73 H SER 73 -4.469 -7.485 12.526 637 HA SER 73 HA SER 73 -5.204 -7.627 15.250 638 HB2 SER 73 2HB SER 73 -4.084 -9.484 14.154 639 HB3 SER 73 3HB SER 73 -2.650 -8.500 13.871 640 HG SER 73 HG SER 73 -2.008 -8.912 15.827 641 H LEU 74 H LEU 74 -3.284 -5.306 13.640 642 HA LEU 74 HA LEU 74 -1.545 -4.625 15.819 643 HB2 LEU 74 2HB LEU 74 -2.327 -3.011 13.385 644 HB3 LEU 74 3HB LEU 74 -1.003 -2.638 14.474 645 HG LEU 74 HG LEU 74 -1.186 -5.100 12.727 646 HD11 LEU 74 1HD1 LEU 74 0.593 -4.074 11.420 647 HD12 LEU 74 2HD1 LEU 74 0.549 -2.643 12.449 648 HD13 LEU 74 3HD1 LEU 74 -0.842 -3.045 11.437 649 HD21 LEU 74 3HD2 LEU 74 1.126 -5.504 13.415 650 HD22 LEU 74 1HD2 LEU 74 0.042 -5.514 14.805 651 HD23 LEU 74 2HD2 LEU 74 1.060 -4.108 14.491 652 H GLY 75 H GLY 75 -4.764 -3.662 14.846 653 HA2 GLY 75 2HA GLY 75 -6.291 -2.199 15.748 654 HA3 GLY 75 3HA GLY 75 -5.436 -2.430 17.263 655 H ALA 76 H ALA 76 -4.349 -0.910 14.232 656 HA ALA 76 HA ALA 76 -4.207 1.699 15.588 657 HB1 ALA 76 3HB ALA 76 -1.892 0.460 14.087 658 HB2 ALA 76 1HB ALA 76 -1.997 0.644 15.838 659 HB3 ALA 76 2HB ALA 76 -1.925 2.071 14.804 660 H GLN 77 H GLN 77 -3.992 3.525 14.100 661 HA GLN 77 HA GLN 77 -5.446 3.064 11.646 662 HB2 GLN 77 2HB GLN 77 -5.425 5.504 11.379 663 HB3 GLN 77 3HB GLN 77 -5.991 5.027 12.970 664 HG2 GLN 77 2HG GLN 77 -3.895 5.657 13.970 665 HG3 GLN 77 3HG GLN 77 -3.190 5.976 12.385 666 HE21 GLN 77 1HE2 GLN 77 -3.839 7.823 11.247 667 HE22 GLN 77 2HE2 GLN 77 -4.648 9.138 12.023 668 H VAL 78 H VAL 78 -4.498 2.447 9.845 669 HA VAL 78 HA VAL 78 -1.876 3.604 9.131 670 HB VAL 78 HB VAL 78 -1.489 1.596 7.716 671 HG11 VAL 78 1HG1 VAL 78 -0.492 1.725 9.935 672 HG12 VAL 78 2HG1 VAL 78 -0.927 0.062 9.547 673 HG13 VAL 78 3HG1 VAL 78 -1.936 1.005 10.647 674 HG21 VAL 78 3HG2 VAL 78 -3.830 0.920 7.411 675 HG22 VAL 78 1HG2 VAL 78 -3.925 0.479 9.116 676 HG23 VAL 78 2HG2 VAL 78 -2.850 -0.407 8.033 677 H LEU 79 H LEU 79 -1.632 4.438 7.079 678 HA LEU 79 HA LEU 79 -4.127 4.973 5.643 679 HB2 LEU 79 2HB LEU 79 -2.707 6.865 6.287 680 HB3 LEU 79 3HB LEU 79 -1.378 6.200 5.359 681 HG LEU 79 HG LEU 79 -2.447 6.686 3.285 682 HD11 LEU 79 1HD1 LEU 79 -4.718 5.985 3.811 683 HD12 LEU 79 2HD1 LEU 79 -4.722 7.616 3.140 684 HD13 LEU 79 3HD1 LEU 79 -4.922 7.377 4.876 685 HD21 LEU 79 3HD2 LEU 79 -2.993 8.991 5.155 686 HD22 LEU 79 1HD2 LEU 79 -2.756 9.085 3.409 687 HD23 LEU 79 2HD2 LEU 79 -1.419 8.600 4.454 688 H ILE 80 H ILE 80 -4.661 3.659 4.042 689 HA ILE 80 HA ILE 80 -2.561 2.038 2.757 690 HB ILE 80 HB ILE 80 -5.544 1.532 2.916 691 HG12 ILE 80 2HG1 ILE 80 -3.309 0.176 4.456 692 HG13 ILE 80 3HG1 ILE 80 -4.310 1.463 5.116 693 HG21 ILE 80 1HG2 ILE 80 -4.505 0.492 0.962 694 HG22 ILE 80 2HG2 ILE 80 -4.983 -0.730 2.139 695 HG23 ILE 80 3HG2 ILE 80 -3.288 -0.261 1.994 696 HD11 ILE 80 3HD1 ILE 80 -6.272 0.093 4.936 697 HD12 ILE 80 1HD1 ILE 80 -5.020 -0.778 5.819 698 HD13 ILE 80 2HD1 ILE 80 -5.352 -1.179 4.134 699 H ILE 81 H ILE 81 -2.004 2.559 0.731 700 HA ILE 81 HA ILE 81 -3.974 3.899 -1.018 701 HB ILE 81 HB ILE 81 -0.974 3.675 -1.395 702 HG12 ILE 81 2HG1 ILE 81 -2.686 5.985 -0.424 703 HG13 ILE 81 3HG1 ILE 81 -1.481 5.107 0.512 704 HG21 ILE 81 1HG2 ILE 81 -2.148 3.855 -3.513 705 HG22 ILE 81 2HG2 ILE 81 -1.318 5.370 -3.163 706 HG23 ILE 81 3HG2 ILE 81 -3.060 5.245 -2.922 707 HD11 ILE 81 3HD1 ILE 81 -0.958 6.878 -1.865 708 HD12 ILE 81 1HD1 ILE 81 0.269 5.943 -1.005 709 HD13 ILE 81 2HD1 ILE 81 -0.601 7.233 -0.176 710 H ILE 82 H ILE 82 -5.023 2.572 -2.366 711 HA ILE 82 HA ILE 82 -3.728 0.058 -3.186 712 HB ILE 82 HB ILE 82 -6.653 0.830 -3.344 713 HG12 ILE 82 2HG1 ILE 82 -5.197 -0.993 -1.400 714 HG13 ILE 82 3HG1 ILE 82 -5.852 0.596 -1.021 715 HG21 ILE 82 1HG2 ILE 82 -6.043 -0.796 -5.052 716 HG22 ILE 82 2HG2 ILE 82 -7.029 -1.560 -3.805 717 HG23 ILE 82 3HG2 ILE 82 -5.284 -1.820 -3.832 718 HD11 ILE 82 3HD1 ILE 82 -7.451 -1.814 -1.848 719 HD12 ILE 82 1HD1 ILE 82 -8.104 -0.227 -1.450 720 HD13 ILE 82 2HD1 ILE 82 -7.291 -1.182 -0.211 721 H TYR 83 H TYR 83 -3.349 -0.447 -5.278 722 HA TYR 83 HA TYR 83 -4.112 1.495 -7.364 723 HB2 TYR 83 2HB TYR 83 -1.846 2.021 -6.858 724 HB3 TYR 83 3HB TYR 83 -1.387 0.325 -6.790 725 HD1 TYR 83 HD2 TYR 83 -2.660 2.904 -9.194 726 HD2 TYR 83 HD1 TYR 83 -0.406 -0.667 -8.647 727 HE1 TYR 83 HE2 TYR 83 -1.935 3.002 -11.543 728 HE2 TYR 83 HE1 TYR 83 0.321 -0.578 -10.989 729 HH TYR 83 HH TYR 83 -0.233 0.376 -13.055 730 H ASP 84 H ASP 84 -5.239 0.533 -8.917 731 HA ASP 84 HA ASP 84 -4.346 -1.993 -10.053 732 HB2 ASP 84 2HB ASP 84 -5.980 -2.661 -8.294 733 HB3 ASP 84 3HB ASP 84 -7.200 -1.662 -9.077 734 H GLN 85 H GLN 85 -5.344 -2.448 -12.130 735 HA GLN 85 HA GLN 85 -5.624 -0.008 -13.654 736 HB2 GLN 85 2HB GLN 85 -5.657 -2.904 -14.521 737 HB3 GLN 85 3HB GLN 85 -5.620 -1.527 -15.617 738 HG2 GLN 85 2HG GLN 85 -3.490 -2.279 -13.618 739 HG3 GLN 85 3HG GLN 85 -3.416 -2.517 -15.362 740 HE21 GLN 85 1HE2 GLN 85 -1.684 -0.984 -13.557 741 HE22 GLN 85 2HE2 GLN 85 -1.674 0.634 -14.172 742 H ASP 86 H ASP 86 -7.799 -2.180 -12.182 743 HA ASP 86 HA ASP 86 -9.988 -1.382 -13.985 744 HB2 ASP 86 2HB ASP 86 -9.548 -3.838 -13.554 745 HB3 ASP 86 3HB ASP 86 -10.048 -3.560 -11.890 746 H GLN 87 H GLN 87 -11.264 0.217 -13.312 747 HA GLN 87 HA GLN 87 -10.983 1.457 -10.791 748 HB2 GLN 87 2HB GLN 87 -13.181 1.793 -12.849 749 HB3 GLN 87 3HB GLN 87 -12.872 2.885 -11.506 750 HG2 GLN 87 2HG GLN 87 -10.660 3.396 -12.434 751 HG3 GLN 87 3HG GLN 87 -10.976 2.306 -13.783 752 HE21 GLN 87 1HE2 GLN 87 -12.464 2.936 -15.376 753 HE22 GLN 87 2HE2 GLN 87 -12.996 4.572 -15.533 754 H ASN 88 H ASN 88 -13.394 -0.831 -12.014 755 HA ASN 88 HA ASN 88 -15.196 -0.609 -9.827 756 HB2 ASN 88 2HB ASN 88 -15.969 -1.538 -11.920 757 HB3 ASN 88 3HB ASN 88 -14.778 -2.831 -11.839 758 HD21 ASN 88 1HD2 ASN 88 -15.151 -4.582 -10.533 759 HD22 ASN 88 2HD2 ASN 88 -16.661 -4.866 -9.742 760 H ARG 89 H ARG 89 -12.578 -2.945 -10.532 761 HA ARG 89 HA ARG 89 -12.810 -4.464 -8.159 762 HB2 ARG 89 2HB ARG 89 -10.274 -3.853 -9.703 763 HB3 ARG 89 3HB ARG 89 -10.498 -5.172 -8.564 764 HG2 ARG 89 2HG ARG 89 -11.958 -4.855 -11.180 765 HG3 ARG 89 3HG ARG 89 -10.572 -5.907 -10.901 766 HD2 ARG 89 2HD ARG 89 -11.904 -7.129 -9.197 767 HD3 ARG 89 3HD ARG 89 -13.296 -6.124 -9.615 768 HE ARG 89 HE ARG 89 -12.138 -7.442 -11.880 769 HH11 ARG 89 1HH1 ARG 89 -14.363 -7.799 -9.274 770 HH12 ARG 89 2HH1 ARG 89 -15.252 -9.050 -10.066 771 HH21 ARG 89 1HH2 ARG 89 -13.286 -9.055 -12.880 772 HH22 ARG 89 2HH2 ARG 89 -14.646 -9.755 -12.079 773 H LEU 90 H LEU 90 -10.761 -1.685 -8.950 774 HA LEU 90 HA LEU 90 -9.333 -1.327 -6.642 775 HB2 LEU 90 2HB LEU 90 -9.091 -0.016 -8.725 776 HB3 LEU 90 3HB LEU 90 -10.579 0.833 -8.355 777 HG LEU 90 HG LEU 90 -9.518 1.806 -6.347 778 HD11 LEU 90 1HD1 LEU 90 -7.102 1.596 -6.022 779 HD12 LEU 90 2HD1 LEU 90 -7.025 0.414 -7.329 780 HD13 LEU 90 3HD1 LEU 90 -7.917 0.041 -5.854 781 HD21 LEU 90 3HD2 LEU 90 -7.994 2.231 -8.921 782 HD22 LEU 90 1HD2 LEU 90 -7.984 3.320 -7.531 783 HD23 LEU 90 2HD2 LEU 90 -9.476 3.052 -8.430 784 H GLU 91 H GLU 91 -12.520 0.171 -7.318 785 HA GLU 91 HA GLU 91 -12.786 1.270 -4.702 786 HB2 GLU 91 2HB GLU 91 -14.844 0.796 -6.865 787 HB3 GLU 91 3HB GLU 91 -15.163 1.673 -5.375 788 HG2 GLU 91 2HG GLU 91 -13.365 3.281 -6.013 789 HG3 GLU 91 3HG GLU 91 -13.248 2.452 -7.566 790 H GLU 92 H GLU 92 -13.927 -1.744 -6.170 791 HA GLU 92 HA GLU 92 -15.798 -2.430 -4.169 792 HB2 GLU 92 2HB GLU 92 -15.715 -3.450 -6.433 793 HB3 GLU 92 3HB GLU 92 -14.248 -4.303 -5.973 794 HG2 GLU 92 2HG GLU 92 -16.159 -5.777 -5.832 795 HG3 GLU 92 3HG GLU 92 -15.488 -5.496 -4.226 796 H PHE 93 H PHE 93 -12.346 -3.275 -4.517 797 HA PHE 93 HA PHE 93 -12.295 -4.846 -2.123 798 HB2 PHE 93 2HB PHE 93 -10.633 -5.202 -3.883 799 HB3 PHE 93 3HB PHE 93 -10.013 -3.569 -3.657 800 HD1 PHE 93 HD1 PHE 93 -10.740 -6.585 -1.565 801 HD2 PHE 93 HD2 PHE 93 -8.064 -3.386 -2.433 802 HE1 PHE 93 HE1 PHE 93 -9.193 -7.413 0.160 803 HE2 PHE 93 HE2 PHE 93 -6.513 -4.213 -0.710 804 HZ PHE 93 HZ PHE 93 -7.078 -6.226 0.589 805 H SER 94 H SER 94 -11.308 -1.503 -2.884 806 HA SER 94 HA SER 94 -10.426 -0.725 -0.347 807 HB2 SER 94 2HB SER 94 -11.843 0.945 -2.447 808 HB3 SER 94 3HB SER 94 -10.989 1.599 -1.049 809 HG SER 94 HG SER 94 -9.991 0.488 -3.394 810 H ARG 95 H ARG 95 -13.668 -1.152 -1.572 811 HA ARG 95 HA ARG 95 -15.203 0.253 0.258 812 HB2 ARG 95 2HB ARG 95 -16.049 -0.994 -1.740 813 HB3 ARG 95 3HB ARG 95 -15.829 -2.495 -0.855 814 HG2 ARG 95 2HG ARG 95 -18.126 -1.964 -0.704 815 HG3 ARG 95 3HG ARG 95 -17.435 -1.581 0.873 816 HD2 ARG 95 2HD ARG 95 -18.957 0.183 0.174 817 HD3 ARG 95 3HD ARG 95 -17.302 0.793 0.219 818 HE ARG 95 HE ARG 95 -18.013 -0.140 -2.376 819 HH11 ARG 95 1HH1 ARG 95 -18.408 2.518 -0.223 820 HH12 ARG 95 2HH1 ARG 95 -18.625 3.660 -1.499 821 HH21 ARG 95 1HH2 ARG 95 -18.289 1.331 -4.001 822 HH22 ARG 95 2HH2 ARG 95 -18.555 2.998 -3.623 823 H GLU 96 H GLU 96 -14.191 -3.173 0.527 824 HA GLU 96 HA GLU 96 -15.206 -3.587 3.120 825 HB2 GLU 96 2HB GLU 96 -12.963 -5.017 1.672 826 HB3 GLU 96 3HB GLU 96 -13.669 -5.564 3.186 827 HG2 GLU 96 2HG GLU 96 -15.876 -5.701 2.027 828 HG3 GLU 96 3HG GLU 96 -15.045 -5.333 0.515 829 H VAL 97 H VAL 97 -11.918 -2.718 2.056 830 HA VAL 97 HA VAL 97 -10.638 -2.716 4.536 831 HB VAL 97 HB VAL 97 -10.104 -0.852 2.206 832 HG11 VAL 97 1HG1 VAL 97 -9.009 -0.077 4.238 833 HG12 VAL 97 2HG1 VAL 97 -7.817 -0.718 3.108 834 HG13 VAL 97 3HG1 VAL 97 -8.317 -1.679 4.501 835 HG21 VAL 97 3HG2 VAL 97 -8.899 -3.554 2.839 836 HG22 VAL 97 1HG2 VAL 97 -8.455 -2.508 1.491 837 HG23 VAL 97 2HG2 VAL 97 -10.066 -3.225 1.557 838 H ARG 98 H ARG 98 -12.259 0.003 2.896 839 HA ARG 98 HA ARG 98 -11.838 1.910 4.948 840 HB2 ARG 98 2HB ARG 98 -12.539 2.207 2.453 841 HB3 ARG 98 3HB ARG 98 -14.178 2.004 3.052 842 HG2 ARG 98 2HG ARG 98 -13.924 3.944 4.489 843 HG3 ARG 98 3HG ARG 98 -12.237 4.112 3.998 844 HD2 ARG 98 2HD ARG 98 -13.115 4.323 1.612 845 HD3 ARG 98 3HD ARG 98 -14.714 4.520 2.330 846 HE ARG 98 HE ARG 98 -13.123 6.354 3.605 847 HH11 ARG 98 1HH1 ARG 98 -14.023 5.712 0.353 848 HH12 ARG 98 2HH1 ARG 98 -13.810 7.347 -0.158 849 HH21 ARG 98 1HH2 ARG 98 -12.838 8.470 2.947 850 HH22 ARG 98 2HH2 ARG 98 -13.158 8.895 1.302 851 H ARG 99 H ARG 99 -14.446 -0.356 4.270 852 HA ARG 99 HA ARG 99 -16.327 0.488 6.177 853 HB2 ARG 99 2HB ARG 99 -16.545 -1.223 4.258 854 HB3 ARG 99 3HB ARG 99 -15.871 -2.392 5.375 855 HG2 ARG 99 2HG ARG 99 -18.371 -0.822 5.968 856 HG3 ARG 99 3HG ARG 99 -18.384 -2.367 5.124 857 HD2 ARG 99 2HD ARG 99 -17.237 -3.379 7.098 858 HD3 ARG 99 3HD ARG 99 -17.423 -1.840 7.938 859 HE ARG 99 HE ARG 99 -19.510 -3.767 7.313 860 HH11 ARG 99 1HH1 ARG 99 -18.701 -0.639 8.507 861 HH12 ARG 99 2HH1 ARG 99 -20.238 -0.399 9.256 862 HH21 ARG 99 1HH2 ARG 99 -21.470 -3.466 8.292 863 HH22 ARG 99 2HH2 ARG 99 -21.799 -1.992 9.131 864 H ARG 100 H ARG 100 -13.448 -1.515 6.480 865 HA ARG 100 HA ARG 100 -14.032 -2.473 9.116 866 HB2 ARG 100 2HB ARG 100 -11.423 -2.392 7.584 867 HB3 ARG 100 3HB ARG 100 -11.668 -3.246 9.105 868 HG2 ARG 100 2HG ARG 100 -13.396 -4.634 8.018 869 HG3 ARG 100 3HG ARG 100 -13.070 -3.805 6.496 870 HD2 ARG 100 2HD ARG 100 -10.789 -4.653 6.491 871 HD3 ARG 100 3HD ARG 100 -11.044 -5.414 8.063 872 HE ARG 100 HE ARG 100 -11.948 -6.376 5.489 873 HH11 ARG 100 1HH1 ARG 100 -12.341 -6.552 8.903 874 HH12 ARG 100 2HH1 ARG 100 -13.123 -8.091 8.848 875 HH21 ARG 100 1HH2 ARG 100 -12.945 -8.366 5.426 876 HH22 ARG 100 2HH2 ARG 100 -13.458 -9.110 6.902 877 H GLY 101 H GLY 101 -13.144 0.587 8.087 878 HA2 GLY 101 2HA GLY 101 -13.053 2.389 9.641 879 HA3 GLY 101 3HA GLY 101 -12.406 1.294 10.849 880 H PHE 102 H PHE 102 -10.896 0.971 7.809 881 HA PHE 102 HA PHE 102 -8.577 2.518 8.747 882 HB2 PHE 102 2HB PHE 102 -8.875 0.391 6.617 883 HB3 PHE 102 3HB PHE 102 -7.408 1.344 6.808 884 HD1 PHE 102 HD1 PHE 102 -6.201 1.257 9.036 885 HD2 PHE 102 HD2 PHE 102 -9.233 -1.528 7.941 886 HE1 PHE 102 HE1 PHE 102 -5.360 -0.315 10.727 887 HE2 PHE 102 HE2 PHE 102 -8.395 -3.105 9.637 888 HZ PHE 102 HZ PHE 102 -6.451 -2.501 11.030 889 H GLU 103 H GLU 103 -7.560 4.093 7.453 890 HA GLU 103 HA GLU 103 -9.301 5.423 5.542 891 HB2 GLU 103 2HB GLU 103 -7.338 7.125 5.512 892 HB3 GLU 103 3HB GLU 103 -8.339 7.005 6.953 893 HG2 GLU 103 2HG GLU 103 -6.608 5.588 8.000 894 HG3 GLU 103 3HG GLU 103 -5.603 5.794 6.565 895 H VAL 104 H VAL 104 -9.335 4.617 3.562 896 HA VAL 104 HA VAL 104 -6.815 3.710 2.315 897 HB VAL 104 HB VAL 104 -8.537 1.962 2.553 898 HG11 VAL 104 1HG1 VAL 104 -10.529 3.362 2.428 899 HG12 VAL 104 2HG1 VAL 104 -10.605 2.053 1.249 900 HG13 VAL 104 3HG1 VAL 104 -10.208 3.690 0.725 901 HG21 VAL 104 3HG2 VAL 104 -6.942 1.834 0.704 902 HG22 VAL 104 1HG2 VAL 104 -8.039 2.763 -0.318 903 HG23 VAL 104 2HG2 VAL 104 -8.503 1.156 0.241 904 H ARG 105 H ARG 105 -6.304 4.332 0.208 905 HA ARG 105 HA ARG 105 -7.919 6.480 -1.009 906 HB2 ARG 105 2HB ARG 105 -4.892 6.420 -0.803 907 HB3 ARG 105 3HB ARG 105 -5.842 7.662 -1.612 908 HG2 ARG 105 2HG ARG 105 -5.904 7.036 1.341 909 HG3 ARG 105 3HG ARG 105 -5.063 8.391 0.589 910 HD2 ARG 105 2HD ARG 105 -7.141 9.364 -0.130 911 HD3 ARG 105 3HD ARG 105 -8.044 7.943 0.393 912 HE ARG 105 HE ARG 105 -6.635 9.073 2.572 913 HH11 ARG 105 1HH1 ARG 105 -9.374 9.650 0.559 914 HH12 ARG 105 2HH1 ARG 105 -10.243 10.484 1.802 915 HH21 ARG 105 1HH2 ARG 105 -7.752 10.149 4.152 916 HH22 ARG 105 2HH2 ARG 105 -9.328 10.776 3.810 917 H THR 106 H THR 106 -8.314 6.226 -3.139 918 HA THR 106 HA THR 106 -7.221 3.841 -4.459 919 HB THR 106 HB THR 106 -9.093 4.108 -6.054 920 HG1 THR 106 HG1 THR 106 -9.241 6.451 -5.794 921 HG21 THR 106 3HG2 THR 106 -9.968 4.205 -3.158 922 HG22 THR 106 1HG2 THR 106 -9.438 2.765 -4.028 923 HG23 THR 106 2HG2 THR 106 -10.924 3.586 -4.504 924 H VAL 107 H VAL 107 -5.619 4.065 -5.929 925 HA VAL 107 HA VAL 107 -5.600 6.502 -7.618 926 HB VAL 107 HB VAL 107 -3.151 6.258 -7.857 927 HG11 VAL 107 1HG1 VAL 107 -4.033 7.805 -6.200 928 HG12 VAL 107 2HG1 VAL 107 -2.541 7.070 -5.615 929 HG13 VAL 107 3HG1 VAL 107 -4.097 6.515 -4.997 930 HG21 VAL 107 3HG2 VAL 107 -3.393 4.138 -5.711 931 HG22 VAL 107 1HG2 VAL 107 -1.887 4.786 -6.364 932 HG23 VAL 107 2HG2 VAL 107 -2.967 3.852 -7.399 933 H THR 108 H THR 108 -5.501 6.237 -9.805 934 HA THR 108 HA THR 108 -5.715 3.471 -10.795 935 HB THR 108 HB THR 108 -6.718 4.499 -12.841 936 HG1 THR 108 HG1 THR 108 -7.357 6.741 -12.622 937 HG21 THR 108 3HG2 THR 108 -8.070 5.254 -10.239 938 HG22 THR 108 1HG2 THR 108 -8.161 3.680 -11.031 939 HG23 THR 108 2HG2 THR 108 -8.861 5.100 -11.808 940 H SER 109 H SER 109 -3.444 5.975 -10.737 941 HA SER 109 HA SER 109 -1.806 4.613 -12.723 942 HB2 SER 109 2HB SER 109 -1.376 6.557 -14.090 943 HB3 SER 109 3HB SER 109 -3.124 6.344 -14.000 944 HG SER 109 HG SER 109 -2.932 8.427 -13.533 945 HA PRO 110 HA PRO 110 1.540 5.902 -10.019 946 HB2 PRO 110 2HB PRO 110 3.553 6.250 -11.868 947 HB3 PRO 110 3HB PRO 110 3.045 4.679 -11.238 948 HG2 PRO 110 2HG PRO 110 2.283 6.026 -13.809 949 HG3 PRO 110 3HG PRO 110 2.714 4.329 -13.521 950 HD2 PRO 110 2HD PRO 110 0.154 5.096 -13.794 951 HD3 PRO 110 3HD PRO 110 0.615 3.812 -12.655 952 H ASP 111 H ASP 111 0.502 7.816 -12.731 953 HA ASP 111 HA ASP 111 1.936 10.204 -12.050 954 HB2 ASP 111 2HB ASP 111 -0.560 9.890 -13.745 955 HB3 ASP 111 3HB ASP 111 0.518 11.284 -13.719 956 H ASP 112 H ASP 112 -1.494 9.232 -11.709 957 HA ASP 112 HA ASP 112 -2.277 11.417 -10.100 958 HB2 ASP 112 2HB ASP 112 -3.854 9.889 -11.274 959 HB3 ASP 112 3HB ASP 112 -3.427 8.611 -10.140 960 H PHE 113 H PHE 113 -0.988 8.227 -9.319 961 HA PHE 113 HA PHE 113 -1.175 8.206 -6.563 962 HB2 PHE 113 2HB PHE 113 -0.399 6.254 -7.732 963 HB3 PHE 113 3HB PHE 113 0.992 7.120 -8.374 964 HD1 PHE 113 HD1 PHE 113 -0.509 5.792 -5.251 965 HD2 PHE 113 HD2 PHE 113 3.016 7.222 -7.176 966 HE1 PHE 113 HE1 PHE 113 0.843 5.052 -3.332 967 HE2 PHE 113 HE2 PHE 113 4.368 6.481 -5.262 968 HZ PHE 113 HZ PHE 113 3.281 5.398 -3.337 969 H LYS 114 H LYS 114 1.356 9.720 -8.561 970 HA LYS 114 HA LYS 114 3.045 10.479 -6.435 971 HB2 LYS 114 2HB LYS 114 3.567 10.401 -8.934 972 HB3 LYS 114 3HB LYS 114 2.786 11.972 -9.049 973 HG2 LYS 114 2HG LYS 114 4.419 12.949 -7.565 974 HG3 LYS 114 3HG LYS 114 5.149 11.369 -7.273 975 HD2 LYS 114 2HD LYS 114 5.636 11.253 -9.745 976 HD3 LYS 114 3HD LYS 114 5.119 12.937 -9.853 977 HE2 LYS 114 2HE LYS 114 7.396 11.873 -8.177 978 HE3 LYS 114 3HE LYS 114 7.550 12.766 -9.689 979 HZ1 LYS 114 3HZ LYS 114 6.486 14.665 -8.608 980 HZ2 LYS 114 1HZ LYS 114 7.903 14.211 -7.807 981 HZ3 LYS 114 2HZ LYS 114 6.400 13.804 -7.157 982 H LYS 115 H LYS 115 0.232 12.057 -7.848 983 HA LYS 115 HA LYS 115 0.517 14.502 -6.363 984 HB2 LYS 115 2HB LYS 115 -1.681 13.265 -8.002 985 HB3 LYS 115 3HB LYS 115 -2.013 14.680 -7.011 986 HG2 LYS 115 2HG LYS 115 0.160 14.564 -9.096 987 HG3 LYS 115 3HG LYS 115 -1.469 15.180 -9.393 988 HD2 LYS 115 2HD LYS 115 -1.164 16.912 -7.726 989 HD3 LYS 115 3HD LYS 115 0.407 16.250 -7.277 990 HE2 LYS 115 2HE LYS 115 -0.284 17.359 -9.998 991 HE3 LYS 115 3HE LYS 115 0.564 18.249 -8.734 992 HZ1 LYS 115 3HZ LYS 115 2.153 17.355 -10.244 993 HZ2 LYS 115 1HZ LYS 115 1.501 15.800 -10.125 994 HZ3 LYS 115 2HZ LYS 115 2.284 16.493 -8.796 995 H SER 116 H SER 116 -1.653 11.690 -6.051 996 HA SER 116 HA SER 116 -2.903 12.399 -3.657 997 HB2 SER 116 2HB SER 116 -2.226 9.607 -4.643 998 HB3 SER 116 3HB SER 116 -3.438 10.002 -3.425 999 HG SER 116 HG SER 116 -3.733 9.922 -6.066 1000 H LEU 117 H LEU 117 0.194 10.830 -4.223 1001 HA LEU 117 HA LEU 117 0.726 9.966 -1.594 1002 HB2 LEU 117 2HB LEU 117 1.919 9.261 -3.700 1003 HB3 LEU 117 3HB LEU 117 2.755 10.800 -3.672 1004 HG LEU 117 HG LEU 117 3.738 10.191 -1.467 1005 HD11 LEU 117 1HD1 LEU 117 3.601 7.877 -0.699 1006 HD12 LEU 117 2HD1 LEU 117 2.467 7.503 -1.998 1007 HD13 LEU 117 3HD1 LEU 117 2.007 8.633 -0.723 1008 HD21 LEU 117 3HD2 LEU 117 5.347 8.581 -2.345 1009 HD22 LEU 117 1HD2 LEU 117 4.977 9.815 -3.548 1010 HD23 LEU 117 2HD2 LEU 117 4.262 8.209 -3.685 1011 H GLU 118 H GLU 118 1.827 12.929 -3.296 1012 HA GLU 118 HA GLU 118 3.060 14.213 -1.155 1013 HB2 GLU 118 2HB GLU 118 1.498 15.357 -3.478 1014 HB3 GLU 118 3HB GLU 118 2.393 16.358 -2.344 1015 HG2 GLU 118 2HG GLU 118 3.613 14.194 -4.051 1016 HG3 GLU 118 3HG GLU 118 3.597 15.908 -4.459 1017 H ARG 119 H ARG 119 -0.356 14.395 -2.155 1018 HA ARG 119 HA ARG 119 -1.362 16.140 -0.262 1019 HB2 ARG 119 2HB ARG 119 -2.617 13.701 -1.533 1020 HB3 ARG 119 3HB ARG 119 -3.525 14.824 -0.533 1021 HG2 ARG 119 2HG ARG 119 -3.248 16.588 -2.085 1022 HG3 ARG 119 3HG ARG 119 -2.019 15.696 -2.987 1023 HD2 ARG 119 2HD ARG 119 -4.255 15.744 -4.096 1024 HD3 ARG 119 3HD ARG 119 -3.646 14.121 -3.780 1025 HE ARG 119 HE ARG 119 -5.304 14.964 -1.648 1026 HH11 ARG 119 1HH1 ARG 119 -5.504 13.976 -4.947 1027 HH12 ARG 119 2HH1 ARG 119 -7.075 13.282 -4.759 1028 HH21 ARG 119 1HH2 ARG 119 -7.343 14.072 -1.429 1029 HH22 ARG 119 2HH2 ARG 119 -8.104 13.350 -2.805 1030 H LEU 120 H LEU 120 -0.691 12.696 0.111 1031 HA LEU 120 HA LEU 120 -1.888 12.588 2.746 1032 HB2 LEU 120 2HB LEU 120 -0.335 10.516 1.195 1033 HB3 LEU 120 3HB LEU 120 -1.207 10.222 2.688 1034 HG LEU 120 HG LEU 120 -2.446 11.053 0.055 1035 HD11 LEU 120 1HD1 LEU 120 -1.653 8.749 0.037 1036 HD12 LEU 120 2HD1 LEU 120 -3.415 8.817 0.044 1037 HD13 LEU 120 3HD1 LEU 120 -2.543 8.421 1.525 1038 HD21 LEU 120 3HD2 LEU 120 -3.751 10.403 2.702 1039 HD22 LEU 120 1HD2 LEU 120 -4.598 10.673 1.178 1040 HD23 LEU 120 2HD2 LEU 120 -3.688 11.986 1.924 1041 H ILE 121 H ILE 121 1.433 12.022 1.492 1042 HA ILE 121 HA ILE 121 2.626 11.549 3.974 1043 HB ILE 121 HB ILE 121 3.877 12.599 1.431 1044 HG12 ILE 121 2HG1 ILE 121 3.732 9.833 2.671 1045 HG13 ILE 121 3HG1 ILE 121 2.932 10.367 1.197 1046 HG21 ILE 121 1HG2 ILE 121 5.303 13.241 3.291 1047 HG22 ILE 121 2HG2 ILE 121 6.051 11.918 2.397 1048 HG23 ILE 121 3HG2 ILE 121 5.250 11.597 3.934 1049 HD11 ILE 121 3HD1 ILE 121 4.865 9.007 0.689 1050 HD12 ILE 121 1HD1 ILE 121 5.905 10.100 1.603 1051 HD13 ILE 121 2HD1 ILE 121 5.112 10.660 0.129 1052 H ARG 122 H ARG 122 2.251 14.649 2.252 1053 HA ARG 122 HA ARG 122 3.937 16.099 4.047 1054 HB2 ARG 122 2HB ARG 122 1.778 17.253 2.268 1055 HB3 ARG 122 3HB ARG 122 3.187 18.088 2.912 1056 HG2 ARG 122 2HG ARG 122 3.167 15.893 0.840 1057 HG3 ARG 122 3HG ARG 122 3.547 17.596 0.586 1058 HD2 ARG 122 2HD ARG 122 5.566 17.406 1.863 1059 HD3 ARG 122 3HD ARG 122 5.143 15.777 2.395 1060 HE ARG 122 HE ARG 122 5.266 15.899 -0.432 1061 HH11 ARG 122 1HH1 ARG 122 7.316 15.859 2.340 1062 HH12 ARG 122 2HH1 ARG 122 8.620 15.104 1.497 1063 HH21 ARG 122 1HH2 ARG 122 6.930 14.904 -1.488 1064 HH22 ARG 122 2HH2 ARG 122 8.413 14.593 -0.651 1065 H GLU 123 H GLU 123 0.672 15.063 4.229 1066 HA GLU 123 HA GLU 123 -0.090 16.945 6.307 1067 HB2 GLU 123 2HB GLU 123 -1.476 14.596 5.015 1068 HB3 GLU 123 3HB GLU 123 -2.170 15.452 6.385 1069 HG2 GLU 123 2HG GLU 123 -1.377 16.850 3.841 1070 HG3 GLU 123 3HG GLU 123 -2.969 16.128 4.073 1071 H VAL 124 H VAL 124 0.281 13.378 6.126 1072 HA VAL 124 HA VAL 124 0.035 13.038 8.950 1073 HB VAL 124 HB VAL 124 -0.578 11.245 7.404 1074 HG11 VAL 124 1HG1 VAL 124 1.112 9.909 6.243 1075 HG12 VAL 124 2HG1 VAL 124 2.374 11.009 6.801 1076 HG13 VAL 124 3HG1 VAL 124 1.130 11.584 5.691 1077 HG21 VAL 124 3HG2 VAL 124 -0.019 10.637 9.688 1078 HG22 VAL 124 1HG2 VAL 124 1.684 10.477 9.255 1079 HG23 VAL 124 2HG2 VAL 124 0.493 9.365 8.578 1080 H GLY 125 H GLY 125 2.830 13.178 6.762 1081 HA2 GLY 125 2HA GLY 125 4.698 12.779 8.975 1082 HA3 GLY 125 3HA GLY 125 5.110 12.954 7.277 1083 H SER 126 H SER 126 3.333 15.008 9.603 1084 HA SER 126 HA SER 126 4.490 17.383 8.468 1085 HB2 SER 126 2HB SER 126 3.181 18.600 10.174 1086 HB3 SER 126 3HB SER 126 2.189 17.429 9.308 1087 HG SER 126 HG SER 126 3.418 16.876 11.806 1088 H LEU 127 H LEU 127 6.754 16.917 8.834 1089 HA LEU 127 HA LEU 127 7.789 17.145 11.521 1090 HB2 LEU 127 2HB LEU 127 10.012 17.437 10.282 1091 HB3 LEU 127 3HB LEU 127 9.184 15.902 10.131 1092 HG LEU 127 HG LEU 127 8.283 16.753 7.899 1093 HD11 LEU 127 1HD1 LEU 127 10.444 18.821 8.297 1094 HD12 LEU 127 2HD1 LEU 127 8.710 19.124 8.178 1095 HD13 LEU 127 3HD1 LEU 127 9.592 18.503 6.785 1096 HD21 LEU 127 3HD2 LEU 127 10.350 16.183 6.707 1097 HD22 LEU 127 1HD2 LEU 127 10.040 15.080 8.046 1098 HD23 LEU 127 2HD2 LEU 127 11.258 16.344 8.211 1099 H GLU 128 H GLU 128 6.791 19.300 9.076 1100 HA GLU 128 HA GLU 128 7.614 21.602 10.726 1101 HB2 GLU 128 2HB GLU 128 7.623 21.314 7.719 1102 HB3 GLU 128 3HB GLU 128 7.516 22.895 8.476 1103 HG2 GLU 128 2HG GLU 128 9.751 20.950 9.022 1104 HG3 GLU 128 3HG GLU 128 9.813 22.179 7.759 1105 H HIS 129 H HIS 129 6.152 23.599 9.933 1106 HA HIS 129 HA HIS 129 3.404 22.799 10.349 1107 HB2 HIS 129 2HB HIS 129 4.691 25.516 9.984 1108 HB3 HIS 129 3HB HIS 129 2.969 25.283 10.266 1109 HD1 HIS 129 HD1 HIS 129 2.318 25.497 12.638 1110 HD2 HIS 129 HD2 HIS 129 6.266 24.252 12.244 1111 HE1 HIS 129 HE1 HIS 129 3.211 25.335 14.977 1112 HE2 HIS 129 HE2 HIS 129 5.617 24.650 14.715 1113 H HIS 130 H HIS 130 1.725 22.884 8.900 1114 HA HIS 130 HA HIS 130 2.282 23.831 6.164 1115 HB2 HIS 130 2HB HIS 130 1.044 21.882 5.239 1116 HB3 HIS 130 3HB HIS 130 2.527 21.418 6.061 1117 HD1 HIS 130 HD1 HIS 130 1.766 19.036 6.583 1118 HD2 HIS 130 HD2 HIS 130 -0.832 21.923 8.053 1119 HE1 HIS 130 HE1 HIS 130 0.205 17.818 8.115 1120 HE2 HIS 130 HE2 HIS 130 -1.492 19.541 8.787 1121 H HIS 131 H HIS 131 0.103 23.887 4.865 1122 HA HIS 131 HA HIS 131 -1.736 25.523 6.307 1123 HB2 HIS 131 2HB HIS 131 -1.394 25.903 3.932 1124 HB3 HIS 131 3HB HIS 131 -1.956 24.279 3.553 1125 HD1 HIS 131 HD1 HIS 131 -4.327 24.181 2.827 1126 HD2 HIS 131 HD2 HIS 131 -3.609 27.451 5.293 1127 HE1 HIS 131 HE1 HIS 131 -6.499 25.428 2.939 1128 HE2 HIS 131 HE2 HIS 131 -6.078 27.327 4.535 1129 H HIS 132 H HIS 132 -3.471 24.962 7.463 1130 HA HIS 132 HA HIS 132 -4.241 22.153 7.623 1131 HB2 HIS 132 2HB HIS 132 -5.037 24.576 9.250 1132 HB3 HIS 132 3HB HIS 132 -5.694 22.966 9.522 1133 HD1 HIS 132 HD1 HIS 132 -4.420 21.506 11.068 1134 HD2 HIS 132 HD2 HIS 132 -2.135 24.693 9.702 1135 HE1 HIS 132 HE1 HIS 132 -2.284 21.407 12.379 1136 HE2 HIS 132 HE2 HIS 132 -1.014 23.462 11.682 1137 H HIS 133 H HIS 133 -6.127 21.296 6.850 1138 HA HIS 133 HA HIS 133 -7.924 22.799 5.219 1139 HB2 HIS 133 2HB HIS 133 -8.592 20.180 6.599 1140 HB3 HIS 133 3HB HIS 133 -9.265 20.807 5.098 1141 HD1 HIS 133 HD1 HIS 133 -7.013 21.262 3.292 1142 HD2 HIS 133 HD2 HIS 133 -6.943 18.146 6.036 1143 HE1 HIS 133 HE1 HIS 133 -5.328 19.625 2.407 1144 HE2 HIS 133 HE2 HIS 133 -5.120 17.900 4.226 1145 H HIS 134 H HIS 134 -8.058 21.562 8.515 1146 HA HIS 134 HA HIS 134 -9.690 23.868 9.299 1147 HB2 HIS 134 2HB HIS 134 -11.294 22.040 9.164 1148 HB3 HIS 134 3HB HIS 134 -10.241 20.997 10.115 1149 HD1 HIS 134 HD1 HIS 134 -9.824 21.865 12.655 1150 HD2 HIS 134 HD2 HIS 134 -13.086 23.474 10.650 1151 HE1 HIS 134 HE1 HIS 134 -11.284 22.857 14.438 1152 HE2 HIS 134 HE2 HIS 134 -13.141 23.989 13.183 Start of MODEL 17 1 H1 MET 1 1H MET 1 1.915 7.617 12.475 2 H2 MET 1 2H MET 1 1.988 5.982 12.061 3 H3 MET 1 3H MET 1 1.203 7.079 11.042 4 HA MET 1 HA MET 1 3.259 8.200 10.564 5 HB2 MET 1 2HB MET 1 5.396 7.290 11.397 6 HB3 MET 1 3HB MET 1 4.362 7.850 12.703 7 HG2 MET 1 2HG MET 1 3.711 5.556 13.198 8 HG3 MET 1 3HG MET 1 4.700 4.976 11.858 9 HE1 MET 1 3HE MET 1 5.535 7.857 14.429 10 HE2 MET 1 1HE MET 1 6.428 6.960 15.658 11 HE3 MET 1 2HE MET 1 4.708 6.653 15.418 12 H ASN 2 H ASN 2 2.326 4.832 10.618 13 HA ASN 2 HA ASN 2 4.130 4.076 8.482 14 HB2 ASN 2 2HB ASN 2 3.588 2.499 10.302 15 HB3 ASN 2 3HB ASN 2 1.899 2.510 9.808 16 HD21 ASN 2 1HD2 ASN 2 1.872 0.312 9.380 17 HD22 ASN 2 2HD2 ASN 2 2.690 -0.379 8.028 18 H ILE 3 H ILE 3 3.463 3.241 6.445 19 HA ILE 3 HA ILE 3 0.747 3.791 5.515 20 HB ILE 3 HB ILE 3 1.781 5.894 5.033 21 HG12 ILE 3 2HG1 ILE 3 1.746 4.232 2.495 22 HG13 ILE 3 3HG1 ILE 3 0.344 4.985 3.247 23 HG21 ILE 3 1HG2 ILE 3 4.020 4.385 3.681 24 HG22 ILE 3 2HG2 ILE 3 4.116 5.200 5.244 25 HG23 ILE 3 3HG2 ILE 3 3.852 6.140 3.774 26 HD11 ILE 3 3HD1 ILE 3 1.114 6.262 1.340 27 HD12 ILE 3 1HD1 ILE 3 2.709 6.430 2.073 28 HD13 ILE 3 2HD1 ILE 3 1.306 7.188 2.829 29 H VAL 4 H VAL 4 0.086 2.398 3.909 30 HA VAL 4 HA VAL 4 2.074 0.423 2.955 31 HB VAL 4 HB VAL 4 -0.808 -0.158 3.696 32 HG11 VAL 4 1HG1 VAL 4 0.030 -1.616 1.932 33 HG12 VAL 4 2HG1 VAL 4 -0.168 -2.513 3.436 34 HG13 VAL 4 3HG1 VAL 4 1.443 -2.020 2.912 35 HG21 VAL 4 3HG2 VAL 4 0.114 -1.388 5.618 36 HG22 VAL 4 1HG2 VAL 4 0.487 0.333 5.700 37 HG23 VAL 4 2HG2 VAL 4 1.729 -0.816 5.205 38 H ILE 5 H ILE 5 1.980 -0.186 0.829 39 HA ILE 5 HA ILE 5 -0.201 0.937 -0.831 40 HB ILE 5 HB ILE 5 2.666 0.435 -1.675 41 HG12 ILE 5 2HG1 ILE 5 1.214 3.059 -1.210 42 HG13 ILE 5 3HG1 ILE 5 2.423 2.367 -0.135 43 HG21 ILE 5 1HG2 ILE 5 1.105 0.109 -3.515 44 HG22 ILE 5 2HG2 ILE 5 2.029 1.591 -3.755 45 HG23 ILE 5 3HG2 ILE 5 0.361 1.676 -3.187 46 HD11 ILE 5 3HD1 ILE 5 4.109 2.583 -1.877 47 HD12 ILE 5 1HD1 ILE 5 3.355 4.134 -1.515 48 HD13 ILE 5 2HD1 ILE 5 2.901 3.252 -2.973 49 H VAL 6 H VAL 6 -1.390 -0.515 -1.951 50 HA VAL 6 HA VAL 6 -0.394 -3.290 -2.151 51 HB VAL 6 HB VAL 6 -3.282 -2.372 -2.124 52 HG11 VAL 6 1HG1 VAL 6 -3.791 -4.764 -1.822 53 HG12 VAL 6 2HG1 VAL 6 -2.077 -5.143 -1.998 54 HG13 VAL 6 3HG1 VAL 6 -2.971 -4.452 -3.353 55 HG21 VAL 6 3HG2 VAL 6 -2.239 -1.981 0.049 56 HG22 VAL 6 1HG2 VAL 6 -1.646 -3.641 0.082 57 HG23 VAL 6 2HG2 VAL 6 -3.380 -3.322 0.143 58 H VAL 7 H VAL 7 0.118 -3.949 -4.144 59 HA VAL 7 HA VAL 7 -1.050 -2.539 -6.467 60 HB VAL 7 HB VAL 7 1.524 -4.128 -6.300 61 HG11 VAL 7 1HG1 VAL 7 0.553 -4.271 -8.532 62 HG12 VAL 7 2HG1 VAL 7 1.991 -3.250 -8.552 63 HG13 VAL 7 3HG1 VAL 7 0.387 -2.515 -8.595 64 HG21 VAL 7 3HG2 VAL 7 1.657 -2.017 -5.080 65 HG22 VAL 7 1HG2 VAL 7 1.075 -1.145 -6.499 66 HG23 VAL 7 2HG2 VAL 7 2.641 -1.957 -6.543 67 H PHE 8 H PHE 8 -2.646 -3.627 -7.460 68 HA PHE 8 HA PHE 8 -2.811 -6.536 -7.258 69 HB2 PHE 8 2HB PHE 8 -4.706 -4.408 -8.230 70 HB3 PHE 8 3HB PHE 8 -5.015 -6.110 -8.546 71 HD1 PHE 8 HD2 PHE 8 -4.615 -3.588 -5.870 72 HD2 PHE 8 HD1 PHE 8 -5.867 -7.540 -6.857 73 HE1 PHE 8 HE2 PHE 8 -5.670 -3.810 -3.658 74 HE2 PHE 8 HE1 PHE 8 -6.924 -7.761 -4.647 75 HZ PHE 8 HZ PHE 8 -6.825 -5.894 -3.045 76 H SER 9 H SER 9 -1.464 -4.379 -9.475 77 HA SER 9 HA SER 9 -2.193 -5.762 -11.899 78 HB2 SER 9 2HB SER 9 -0.751 -4.239 -13.047 79 HB3 SER 9 3HB SER 9 -1.529 -3.315 -11.764 80 HG SER 9 HG SER 9 1.091 -3.798 -12.187 81 H THR 10 H THR 10 0.348 -6.045 -9.556 82 HA THR 10 HA THR 10 1.866 -7.686 -9.150 83 HB THR 10 HB THR 10 0.767 -9.274 -11.480 84 HG1 THR 10 HG1 THR 10 -0.397 -8.784 -8.931 85 HG21 THR 10 3HG2 THR 10 2.727 -10.222 -10.362 86 HG22 THR 10 1HG2 THR 10 1.295 -11.198 -10.036 87 HG23 THR 10 2HG2 THR 10 1.913 -10.099 -8.803 88 H ASP 11 H ASP 11 2.256 -5.589 -11.415 89 HA ASP 11 HA ASP 11 4.315 -6.868 -13.044 90 HB2 ASP 11 2HB ASP 11 3.455 -3.967 -12.928 91 HB3 ASP 11 3HB ASP 11 4.570 -4.658 -14.102 92 H GLU 12 H GLU 12 6.472 -6.774 -12.685 93 HA GLU 12 HA GLU 12 7.592 -5.463 -10.396 94 HB2 GLU 12 2HB GLU 12 8.960 -6.637 -12.834 95 HB3 GLU 12 3HB GLU 12 9.777 -6.137 -11.359 96 HG2 GLU 12 2HG GLU 12 8.661 -7.865 -10.100 97 HG3 GLU 12 3HG GLU 12 7.696 -8.312 -11.506 98 H GLU 13 H GLU 13 7.604 -4.810 -13.891 99 HA GLU 13 HA GLU 13 9.299 -2.552 -13.804 100 HB2 GLU 13 2HB GLU 13 8.460 -2.077 -16.086 101 HB3 GLU 13 3HB GLU 13 8.970 -3.743 -15.871 102 HG2 GLU 13 2HG GLU 13 6.627 -4.427 -15.635 103 HG3 GLU 13 3HG GLU 13 6.123 -2.754 -15.876 104 H THR 14 H THR 14 5.725 -2.754 -13.819 105 HA THR 14 HA THR 14 5.255 0.028 -13.630 106 HB THR 14 HB THR 14 3.534 -2.167 -12.432 107 HG1 THR 14 HG1 THR 14 2.589 -2.334 -14.434 108 HG21 THR 14 3HG2 THR 14 1.692 -0.582 -12.768 109 HG22 THR 14 1HG2 THR 14 2.827 0.619 -13.388 110 HG23 THR 14 2HG2 THR 14 2.918 0.104 -11.703 111 H LEU 15 H LEU 15 5.708 -2.464 -11.161 112 HA LEU 15 HA LEU 15 5.393 -0.903 -8.857 113 HB2 LEU 15 2HB LEU 15 5.475 -3.346 -8.871 114 HB3 LEU 15 3HB LEU 15 7.156 -3.303 -9.358 115 HG LEU 15 HG LEU 15 7.713 -2.212 -7.182 116 HD11 LEU 15 1HD1 LEU 15 5.541 -1.222 -6.692 117 HD12 LEU 15 2HD1 LEU 15 6.063 -2.272 -5.377 118 HD13 LEU 15 3HD1 LEU 15 4.832 -2.829 -6.512 119 HD21 LEU 15 3HD2 LEU 15 8.020 -4.603 -7.478 120 HD22 LEU 15 1HD2 LEU 15 6.333 -4.900 -7.046 121 HD23 LEU 15 2HD2 LEU 15 7.456 -4.267 -5.844 122 H ARG 16 H ARG 16 8.076 -1.177 -11.075 123 HA ARG 16 HA ARG 16 10.163 -0.117 -9.542 124 HB2 ARG 16 2HB ARG 16 10.366 -1.162 -11.811 125 HB3 ARG 16 3HB ARG 16 9.688 0.303 -12.503 126 HG2 ARG 16 2HG ARG 16 12.061 0.360 -12.773 127 HG3 ARG 16 3HG ARG 16 11.612 1.571 -11.571 128 HD2 ARG 16 2HD ARG 16 12.364 0.192 -9.777 129 HD3 ARG 16 3HD ARG 16 12.548 -1.203 -10.843 130 HE ARG 16 HE ARG 16 14.176 1.086 -11.527 131 HH11 ARG 16 1HH1 ARG 16 13.998 -1.839 -9.712 132 HH12 ARG 16 2HH1 ARG 16 15.709 -2.078 -9.731 133 HH21 ARG 16 1HH2 ARG 16 16.355 0.784 -11.526 134 HH22 ARG 16 2HH2 ARG 16 17.035 -0.590 -10.726 135 H LYS 17 H LYS 17 7.637 1.495 -11.431 136 HA LYS 17 HA LYS 17 8.530 4.145 -11.160 137 HB2 LYS 17 2HB LYS 17 5.775 2.972 -11.549 138 HB3 LYS 17 3HB LYS 17 6.015 4.705 -11.396 139 HG2 LYS 17 2HG LYS 17 5.905 4.235 -13.710 140 HG3 LYS 17 3HG LYS 17 7.597 4.569 -13.345 141 HD2 LYS 17 2HD LYS 17 8.031 2.135 -13.272 142 HD3 LYS 17 3HD LYS 17 6.347 1.840 -13.708 143 HE2 LYS 17 2HE LYS 17 8.408 3.291 -15.378 144 HE3 LYS 17 3HE LYS 17 7.779 1.671 -15.669 145 HZ1 LYS 17 3HZ LYS 17 6.710 3.277 -17.104 146 HZ2 LYS 17 1HZ LYS 17 6.210 4.194 -15.772 147 HZ3 LYS 17 2HZ LYS 17 5.578 2.644 -16.019 148 H PHE 18 H PHE 18 6.405 2.205 -9.068 149 HA PHE 18 HA PHE 18 5.775 4.184 -7.194 150 HB2 PHE 18 2HB PHE 18 6.036 1.188 -6.865 151 HB3 PHE 18 3HB PHE 18 5.420 2.248 -5.602 152 HD1 PHE 18 HD1 PHE 18 4.744 0.775 -8.888 153 HD2 PHE 18 HD2 PHE 18 3.243 3.286 -5.791 154 HE1 PHE 18 HE1 PHE 18 2.495 0.654 -9.881 155 HE2 PHE 18 HE2 PHE 18 0.995 3.168 -6.778 156 HZ PHE 18 HZ PHE 18 0.619 1.850 -8.826 157 H LYS 19 H LYS 19 8.502 1.861 -7.173 158 HA LYS 19 HA LYS 19 9.743 2.703 -4.814 159 HB2 LYS 19 2HB LYS 19 11.035 1.735 -7.379 160 HB3 LYS 19 3HB LYS 19 11.883 1.918 -5.851 161 HG2 LYS 19 2HG LYS 19 10.254 0.253 -4.877 162 HG3 LYS 19 3HG LYS 19 9.691 -0.036 -6.527 163 HD2 LYS 19 2HD LYS 19 11.949 -0.696 -7.197 164 HD3 LYS 19 3HD LYS 19 12.545 -0.362 -5.571 165 HE2 LYS 19 2HE LYS 19 12.256 -2.713 -5.714 166 HE3 LYS 19 3HE LYS 19 10.919 -2.108 -4.739 167 HZ1 LYS 19 3HZ LYS 19 10.183 -3.743 -6.346 168 HZ2 LYS 19 1HZ LYS 19 10.790 -2.813 -7.621 169 HZ3 LYS 19 2HZ LYS 19 9.501 -2.234 -6.696 170 H ASP 20 H ASP 20 10.099 3.964 -8.110 171 HA ASP 20 HA ASP 20 12.108 5.864 -7.625 172 HB2 ASP 20 2HB ASP 20 11.327 5.024 -9.858 173 HB3 ASP 20 3HB ASP 20 9.885 6.018 -9.683 174 H ILE 21 H ILE 21 8.564 6.223 -7.604 175 HA ILE 21 HA ILE 21 8.529 9.009 -7.088 176 HB ILE 21 HB ILE 21 6.398 6.934 -6.527 177 HG12 ILE 21 2HG1 ILE 21 6.719 8.796 -8.902 178 HG13 ILE 21 3HG1 ILE 21 7.198 7.102 -8.904 179 HG21 ILE 21 1HG2 ILE 21 5.999 8.986 -5.260 180 HG22 ILE 21 2HG2 ILE 21 4.823 8.824 -6.566 181 HG23 ILE 21 3HG2 ILE 21 6.175 9.944 -6.731 182 HD11 ILE 21 3HD1 ILE 21 5.057 7.415 -9.988 183 HD12 ILE 21 1HD1 ILE 21 4.400 8.143 -8.522 184 HD13 ILE 21 2HD1 ILE 21 4.882 6.446 -8.524 185 H ILE 22 H ILE 22 8.389 6.203 -4.917 186 HA ILE 22 HA ILE 22 8.047 7.630 -2.508 187 HB ILE 22 HB ILE 22 9.390 4.965 -3.021 188 HG12 ILE 22 2HG1 ILE 22 6.611 5.654 -2.011 189 HG13 ILE 22 3HG1 ILE 22 6.994 5.077 -3.629 190 HG21 ILE 22 1HG2 ILE 22 10.196 5.874 -0.913 191 HG22 ILE 22 2HG2 ILE 22 9.098 4.527 -0.616 192 HG23 ILE 22 3HG2 ILE 22 8.540 6.185 -0.390 193 HD11 ILE 22 3HD1 ILE 22 7.386 3.541 -1.069 194 HD12 ILE 22 1HD1 ILE 22 7.763 2.959 -2.691 195 HD13 ILE 22 2HD1 ILE 22 6.093 3.304 -2.243 196 H LYS 23 H LYS 23 10.991 6.670 -4.274 197 HA LYS 23 HA LYS 23 12.850 7.745 -2.421 198 HB2 LYS 23 2HB LYS 23 13.097 7.244 -5.395 199 HB3 LYS 23 3HB LYS 23 14.441 7.720 -4.367 200 HG2 LYS 23 2HG LYS 23 12.822 5.185 -4.127 201 HG3 LYS 23 3HG LYS 23 14.466 5.328 -4.751 202 HD2 LYS 23 2HD LYS 23 15.198 6.163 -2.535 203 HD3 LYS 23 3HD LYS 23 13.559 5.918 -1.926 204 HE2 LYS 23 2HE LYS 23 14.947 4.046 -1.284 205 HE3 LYS 23 3HE LYS 23 13.756 3.510 -2.467 206 HZ1 LYS 23 3HZ LYS 23 15.470 3.672 -4.187 207 HZ2 LYS 23 1HZ LYS 23 15.924 2.598 -2.959 208 HZ3 LYS 23 2HZ LYS 23 16.604 4.143 -3.025 209 H LYS 24 H LYS 24 11.097 9.183 -5.122 210 HA LYS 24 HA LYS 24 12.381 11.627 -5.383 211 HB2 LYS 24 2HB LYS 24 10.606 10.963 -6.885 212 HB3 LYS 24 3HB LYS 24 9.434 10.965 -5.577 213 HG2 LYS 24 2HG LYS 24 9.736 13.418 -5.357 214 HG3 LYS 24 3HG LYS 24 10.824 13.374 -6.748 215 HD2 LYS 24 2HD LYS 24 9.019 12.523 -8.156 216 HD3 LYS 24 3HD LYS 24 7.929 12.491 -6.768 217 HE2 LYS 24 2HE LYS 24 7.481 14.455 -8.109 218 HE3 LYS 24 3HE LYS 24 8.168 14.944 -6.562 219 HZ1 LYS 24 3HZ LYS 24 10.325 15.174 -7.670 220 HZ2 LYS 24 1HZ LYS 24 9.158 16.193 -8.350 221 HZ3 LYS 24 2HZ LYS 24 9.617 14.774 -9.148 222 H ASN 25 H ASN 25 9.933 10.673 -3.003 223 HA ASN 25 HA ASN 25 9.927 13.307 -1.765 224 HB2 ASN 25 2HB ASN 25 8.438 10.762 -1.087 225 HB3 ASN 25 3HB ASN 25 8.234 12.289 -0.232 226 HD21 ASN 25 1HD2 ASN 25 7.650 10.567 -3.201 227 HD22 ASN 25 2HD2 ASN 25 6.520 11.696 -3.852 228 H GLY 26 H GLY 26 11.885 10.610 -1.509 229 HA2 GLY 26 2HA GLY 26 13.748 10.399 -0.127 230 HA3 GLY 26 3HA GLY 26 13.118 11.687 0.882 231 H PHE 27 H PHE 27 11.589 8.576 0.015 232 HA PHE 27 HA PHE 27 11.793 7.765 2.855 233 HB2 PHE 27 2HB PHE 27 9.534 7.241 0.908 234 HB3 PHE 27 3HB PHE 27 9.666 6.484 2.490 235 HD1 PHE 27 HD2 PHE 27 9.103 9.667 0.719 236 HD2 PHE 27 HD1 PHE 27 9.091 7.671 4.483 237 HE1 PHE 27 HE2 PHE 27 7.923 11.576 1.724 238 HE2 PHE 27 HE1 PHE 27 7.905 9.578 5.492 239 HZ PHE 27 HZ PHE 27 7.321 11.534 4.115 240 H LYS 28 H LYS 28 11.438 5.275 3.059 241 HA LYS 28 HA LYS 28 13.105 3.949 1.014 242 HB2 LYS 28 2HB LYS 28 12.606 3.164 3.897 243 HB3 LYS 28 3HB LYS 28 13.628 2.284 2.763 244 HG2 LYS 28 2HG LYS 28 14.979 4.410 2.525 245 HG3 LYS 28 3HG LYS 28 14.071 5.033 3.901 246 HD2 LYS 28 2HD LYS 28 14.895 3.220 5.300 247 HD3 LYS 28 3HD LYS 28 15.741 2.511 3.919 248 HE2 LYS 28 2HE LYS 28 16.301 5.176 5.229 249 HE3 LYS 28 3HE LYS 28 17.327 3.741 5.258 250 HZ1 LYS 28 3HZ LYS 28 16.656 5.381 2.874 251 HZ2 LYS 28 1HZ LYS 28 17.553 3.949 2.830 252 HZ3 LYS 28 2HZ LYS 28 18.154 5.297 3.651 253 H VAL 29 H VAL 29 12.595 1.666 0.509 254 HA VAL 29 HA VAL 29 9.663 1.223 0.520 255 HB VAL 29 HB VAL 29 11.522 0.495 -1.754 256 HG11 VAL 29 1HG1 VAL 29 9.487 -0.836 -1.658 257 HG12 VAL 29 2HG1 VAL 29 9.444 0.257 -3.042 258 HG13 VAL 29 3HG1 VAL 29 8.508 0.631 -1.593 259 HG21 VAL 29 3HG2 VAL 29 9.753 2.931 -1.505 260 HG22 VAL 29 1HG2 VAL 29 10.602 2.428 -2.967 261 HG23 VAL 29 2HG2 VAL 29 11.516 2.913 -1.540 262 H ARG 30 H ARG 30 8.923 -0.809 0.972 263 HA ARG 30 HA ARG 30 10.771 -3.081 0.607 264 HB2 ARG 30 2HB ARG 30 8.885 -2.683 2.940 265 HB3 ARG 30 3HB ARG 30 9.583 -4.241 2.527 266 HG2 ARG 30 2HG ARG 30 11.854 -3.035 2.723 267 HG3 ARG 30 3HG ARG 30 10.948 -1.788 3.579 268 HD2 ARG 30 2HD ARG 30 11.884 -3.323 5.189 269 HD3 ARG 30 3HD ARG 30 10.133 -3.530 5.158 270 HE ARG 30 HE ARG 30 11.198 -5.381 3.385 271 HH11 ARG 30 1HH1 ARG 30 11.350 -4.741 6.773 272 HH12 ARG 30 2HH1 ARG 30 11.624 -6.405 7.175 273 HH21 ARG 30 1HH2 ARG 30 11.569 -7.530 3.949 274 HH22 ARG 30 2HH2 ARG 30 11.748 -7.932 5.623 275 H THR 31 H THR 31 9.947 -3.826 -1.295 276 HA THR 31 HA THR 31 7.067 -4.061 -1.675 277 HB THR 31 HB THR 31 7.656 -4.898 -3.951 278 HG1 THR 31 HG1 THR 31 9.831 -5.665 -3.184 279 HG21 THR 31 3HG2 THR 31 8.522 -2.758 -4.793 280 HG22 THR 31 1HG2 THR 31 8.977 -2.296 -3.151 281 HG23 THR 31 2HG2 THR 31 7.277 -2.506 -3.569 282 H VAL 32 H VAL 32 6.070 -5.725 -0.779 283 HA VAL 32 HA VAL 32 7.517 -8.279 -0.449 284 HB VAL 32 HB VAL 32 5.304 -7.086 1.237 285 HG11 VAL 32 1HG1 VAL 32 5.121 -9.507 1.186 286 HG12 VAL 32 2HG1 VAL 32 5.710 -8.978 2.762 287 HG13 VAL 32 3HG1 VAL 32 6.829 -9.669 1.587 288 HG21 VAL 32 3HG2 VAL 32 7.442 -5.948 1.553 289 HG22 VAL 32 1HG2 VAL 32 8.240 -7.493 1.839 290 HG23 VAL 32 2HG2 VAL 32 7.032 -6.900 2.979 291 H ARG 33 H ARG 33 6.639 -10.159 -1.161 292 HA ARG 33 HA ARG 33 3.747 -10.250 -1.758 293 HB2 ARG 33 2HB ARG 33 5.141 -10.123 -3.857 294 HB3 ARG 33 3HB ARG 33 5.878 -11.652 -3.399 295 HG2 ARG 33 2HG ARG 33 3.654 -12.726 -3.491 296 HG3 ARG 33 3HG ARG 33 2.955 -11.194 -4.016 297 HD2 ARG 33 2HD ARG 33 4.339 -11.232 -6.024 298 HD3 ARG 33 3HD ARG 33 5.107 -12.723 -5.484 299 HE ARG 33 HE ARG 33 2.207 -12.688 -5.928 300 HH11 ARG 33 1HH1 ARG 33 5.344 -13.829 -6.810 301 HH12 ARG 33 2HH1 ARG 33 4.715 -15.042 -7.873 302 HH21 ARG 33 1HH2 ARG 33 1.426 -14.240 -7.280 303 HH22 ARG 33 2HH2 ARG 33 2.525 -15.266 -8.145 304 H SER 34 H SER 34 6.031 -11.303 0.258 305 HA SER 34 HA SER 34 4.874 -14.009 0.582 306 HB2 SER 34 2HB SER 34 7.674 -13.093 1.323 307 HB3 SER 34 3HB SER 34 7.020 -14.711 1.579 308 HG SER 34 HG SER 34 8.328 -14.487 -0.337 309 HA PRO 35 HA PRO 35 3.329 -12.769 4.544 310 HB2 PRO 35 2HB PRO 35 3.722 -15.115 5.971 311 HB3 PRO 35 3HB PRO 35 2.357 -14.802 4.895 312 HG2 PRO 35 2HG PRO 35 4.893 -16.300 4.350 313 HG3 PRO 35 3HG PRO 35 3.232 -16.693 3.870 314 HD2 PRO 35 2HD PRO 35 4.963 -15.624 2.124 315 HD3 PRO 35 3HD PRO 35 3.246 -15.160 2.110 316 H GLN 36 H GLN 36 6.376 -14.639 4.739 317 HA GLN 36 HA GLN 36 7.235 -13.801 7.236 318 HB2 GLN 36 2HB GLN 36 9.559 -14.292 6.399 319 HB3 GLN 36 3HB GLN 36 8.392 -15.587 6.180 320 HG2 GLN 36 2HG GLN 36 8.169 -15.060 3.837 321 HG3 GLN 36 3HG GLN 36 9.207 -13.648 4.019 322 HE21 GLN 36 1HE2 GLN 36 9.106 -17.133 3.940 323 HE22 GLN 36 2HE2 GLN 36 10.800 -17.370 3.699 324 H GLU 37 H GLU 37 7.951 -12.228 4.091 325 HA GLU 37 HA GLU 37 9.520 -10.152 5.234 326 HB2 GLU 37 2HB GLU 37 8.169 -10.451 2.555 327 HB3 GLU 37 3HB GLU 37 9.090 -9.015 2.980 328 HG2 GLU 37 2HG GLU 37 10.188 -11.825 2.960 329 HG3 GLU 37 3HG GLU 37 10.381 -10.646 1.662 330 H LEU 38 H LEU 38 6.074 -10.409 4.504 331 HA LEU 38 HA LEU 38 5.336 -7.730 4.965 332 HB2 LEU 38 2HB LEU 38 3.819 -9.357 3.970 333 HB3 LEU 38 3HB LEU 38 3.809 -10.296 5.450 334 HG LEU 38 HG LEU 38 2.696 -8.388 6.608 335 HD11 LEU 38 1HD1 LEU 38 3.482 -6.574 5.166 336 HD12 LEU 38 2HD1 LEU 38 1.724 -6.581 5.291 337 HD13 LEU 38 3HD1 LEU 38 2.505 -7.203 3.838 338 HD21 LEU 38 3HD2 LEU 38 1.246 -9.418 4.167 339 HD22 LEU 38 1HD2 LEU 38 0.497 -8.740 5.613 340 HD23 LEU 38 2HD2 LEU 38 1.392 -10.257 5.712 341 H LYS 39 H LYS 39 5.201 -10.504 7.195 342 HA LYS 39 HA LYS 39 4.639 -9.118 9.553 343 HB2 LYS 39 2HB LYS 39 4.419 -11.518 9.416 344 HB3 LYS 39 3HB LYS 39 6.133 -11.704 9.077 345 HG2 LYS 39 2HG LYS 39 6.698 -11.002 11.320 346 HG3 LYS 39 3HG LYS 39 5.001 -10.662 11.669 347 HD2 LYS 39 2HD LYS 39 5.722 -12.830 12.604 348 HD3 LYS 39 3HD LYS 39 4.443 -13.018 11.405 349 HE2 LYS 39 2HE LYS 39 6.168 -13.593 9.714 350 HE3 LYS 39 3HE LYS 39 7.397 -13.489 10.974 351 HZ1 LYS 39 3HZ LYS 39 6.274 -15.274 12.156 352 HZ2 LYS 39 1HZ LYS 39 6.711 -15.770 10.600 353 HZ3 LYS 39 2HZ LYS 39 5.103 -15.376 10.940 354 H ASP 40 H ASP 40 7.762 -9.958 8.097 355 HA ASP 40 HA ASP 40 9.467 -9.043 10.101 356 HB2 ASP 40 2HB ASP 40 10.182 -10.405 8.180 357 HB3 ASP 40 3HB ASP 40 9.914 -9.037 7.106 358 H SER 41 H SER 41 8.250 -7.271 7.247 359 HA SER 41 HA SER 41 9.576 -4.846 7.708 360 HB2 SER 41 2HB SER 41 8.413 -5.465 5.585 361 HB3 SER 41 3HB SER 41 6.867 -5.182 6.385 362 HG SER 41 HG SER 41 7.526 -3.005 6.701 363 H ILE 42 H ILE 42 6.641 -6.110 9.106 364 HA ILE 42 HA ILE 42 5.871 -3.590 10.326 365 HB ILE 42 HB ILE 42 4.786 -6.397 10.677 366 HG12 ILE 42 2HG1 ILE 42 3.685 -4.006 9.169 367 HG13 ILE 42 3HG1 ILE 42 4.443 -5.414 8.432 368 HG21 ILE 42 1HG2 ILE 42 3.700 -3.782 11.737 369 HG22 ILE 42 2HG2 ILE 42 4.377 -5.101 12.693 370 HG23 ILE 42 3HG2 ILE 42 2.872 -5.338 11.806 371 HD11 ILE 42 3HD1 ILE 42 2.634 -6.821 9.337 372 HD12 ILE 42 1HD1 ILE 42 2.049 -5.565 8.245 373 HD13 ILE 42 2HD1 ILE 42 1.867 -5.372 9.987 374 H GLU 43 H GLU 43 7.319 -6.670 11.411 375 HA GLU 43 HA GLU 43 7.233 -6.031 14.173 376 HB2 GLU 43 2HB GLU 43 8.570 -7.953 14.570 377 HB3 GLU 43 3HB GLU 43 7.475 -8.352 13.253 378 HG2 GLU 43 2HG GLU 43 9.213 -8.197 11.645 379 HG3 GLU 43 3HG GLU 43 10.316 -7.464 12.808 380 H GLU 44 H GLU 44 9.444 -5.075 11.664 381 HA GLU 44 HA GLU 44 11.629 -4.266 13.260 382 HB2 GLU 44 2HB GLU 44 10.507 -2.934 10.778 383 HB3 GLU 44 3HB GLU 44 12.089 -2.614 11.472 384 HG2 GLU 44 2HG GLU 44 12.749 -4.933 11.018 385 HG3 GLU 44 3HG GLU 44 11.167 -5.233 10.300 386 H LEU 45 H LEU 45 8.564 -2.722 12.498 387 HA LEU 45 HA LEU 45 9.154 -0.131 13.433 388 HB2 LEU 45 2HB LEU 45 6.486 -1.512 13.099 389 HB3 LEU 45 3HB LEU 45 6.703 0.214 13.307 390 HG LEU 45 HG LEU 45 7.740 -1.403 10.970 391 HD11 LEU 45 1HD1 LEU 45 6.024 -0.270 9.657 392 HD12 LEU 45 2HD1 LEU 45 5.419 0.524 11.111 393 HD13 LEU 45 3HD1 LEU 45 5.303 -1.230 10.947 394 HD21 LEU 45 3HD2 LEU 45 8.278 0.756 9.966 395 HD22 LEU 45 1HD2 LEU 45 9.155 0.529 11.480 396 HD23 LEU 45 2HD2 LEU 45 7.741 1.583 11.428 397 H VAL 46 H VAL 46 8.241 -2.993 15.201 398 HA VAL 46 HA VAL 46 7.208 -1.562 17.478 399 HB VAL 46 HB VAL 46 6.550 -3.924 16.947 400 HG11 VAL 46 1HG1 VAL 46 7.990 -5.756 17.665 401 HG12 VAL 46 2HG1 VAL 46 9.269 -4.609 18.059 402 HG13 VAL 46 3HG1 VAL 46 8.753 -4.811 16.387 403 HG21 VAL 46 3HG2 VAL 46 6.440 -4.657 19.279 404 HG22 VAL 46 1HG2 VAL 46 6.098 -2.933 19.139 405 HG23 VAL 46 2HG2 VAL 46 7.674 -3.475 19.717 406 H LYS 47 H LYS 47 10.382 -2.558 16.428 407 HA LYS 47 HA LYS 47 11.557 -1.941 19.043 408 HB2 LYS 47 2HB LYS 47 12.972 -2.758 16.491 409 HB3 LYS 47 3HB LYS 47 13.692 -2.630 18.087 410 HG2 LYS 47 2HG LYS 47 13.325 -4.826 18.263 411 HG3 LYS 47 3HG LYS 47 11.626 -4.410 18.501 412 HD2 LYS 47 2HD LYS 47 11.221 -4.640 16.100 413 HD3 LYS 47 3HD LYS 47 12.926 -5.008 15.835 414 HE2 LYS 47 2HE LYS 47 12.686 -7.022 17.240 415 HE3 LYS 47 3HE LYS 47 10.974 -6.659 17.446 416 HZ1 LYS 47 3HZ LYS 47 12.342 -7.285 14.884 417 HZ2 LYS 47 1HZ LYS 47 10.714 -6.849 15.030 418 HZ3 LYS 47 2HZ LYS 47 11.268 -8.291 15.721 419 H LYS 48 H LYS 48 12.059 -0.913 15.658 420 HA LYS 48 HA LYS 48 12.527 1.842 16.576 421 HB2 LYS 48 2HB LYS 48 14.337 0.317 14.681 422 HB3 LYS 48 3HB LYS 48 14.429 2.049 14.971 423 HG2 LYS 48 2HG LYS 48 14.952 1.612 17.335 424 HG3 LYS 48 3HG LYS 48 14.900 -0.121 17.016 425 HD2 LYS 48 2HD LYS 48 16.791 1.842 15.706 426 HD3 LYS 48 3HD LYS 48 17.206 0.767 17.042 427 HE2 LYS 48 2HE LYS 48 16.804 -1.178 15.656 428 HE3 LYS 48 3HE LYS 48 16.239 -0.159 14.330 429 HZ1 LYS 48 3HZ LYS 48 18.985 -0.132 15.460 430 HZ2 LYS 48 1HZ LYS 48 18.439 0.790 14.155 431 HZ3 LYS 48 2HZ LYS 48 18.533 -0.892 14.021 432 H TYR 49 H TYR 49 11.273 3.218 15.445 433 HA TYR 49 HA TYR 49 10.022 2.268 12.978 434 HB2 TYR 49 2HB TYR 49 8.518 4.236 13.233 435 HB3 TYR 49 3HB TYR 49 8.484 3.144 14.611 436 HD1 TYR 49 HD2 TYR 49 9.456 3.832 16.770 437 HD2 TYR 49 HD1 TYR 49 9.363 6.500 13.448 438 HE1 TYR 49 HE2 TYR 49 9.895 5.723 18.279 439 HE2 TYR 49 HE1 TYR 49 9.799 8.395 14.952 440 HH TYR 49 HH TYR 49 10.839 8.014 18.148 441 H ASN 50 H ASN 50 10.471 3.015 10.999 442 HA ASN 50 HA ASN 50 12.116 5.454 10.715 443 HB2 ASN 50 2HB ASN 50 12.488 2.855 9.195 444 HB3 ASN 50 3HB ASN 50 13.383 4.342 8.907 445 HD21 ASN 50 1HD2 ASN 50 12.900 1.664 11.067 446 HD22 ASN 50 2HD2 ASN 50 14.339 1.905 11.994 447 H ALA 51 H ALA 51 12.109 6.277 8.417 448 HA ALA 51 HA ALA 51 9.446 6.484 7.397 449 HB1 ALA 51 3HB ALA 51 11.042 8.337 7.270 450 HB2 ALA 51 1HB ALA 51 10.439 7.901 5.671 451 HB3 ALA 51 2HB ALA 51 12.053 7.396 6.173 452 H THR 52 H THR 52 9.274 4.038 7.186 453 HA THR 52 HA THR 52 10.368 3.076 4.611 454 HB THR 52 HB THR 52 9.609 1.438 7.047 455 HG1 THR 52 HG1 THR 52 12.187 1.258 6.145 456 HG21 THR 52 3HG2 THR 52 10.777 0.580 4.390 457 HG22 THR 52 1HG2 THR 52 9.170 0.188 5.003 458 HG23 THR 52 2HG2 THR 52 10.603 -0.458 5.806 459 H ILE 53 H ILE 53 8.814 3.224 3.114 460 HA ILE 53 HA ILE 53 6.032 2.641 3.754 461 HB ILE 53 HB ILE 53 7.254 3.373 1.079 462 HG12 ILE 53 2HG1 ILE 53 5.931 5.121 3.180 463 HG13 ILE 53 3HG1 ILE 53 7.621 5.175 2.691 464 HG21 ILE 53 1HG2 ILE 53 4.370 3.422 1.994 465 HG22 ILE 53 2HG2 ILE 53 5.085 2.226 0.913 466 HG23 ILE 53 3HG2 ILE 53 4.967 3.910 0.407 467 HD11 ILE 53 3HD1 ILE 53 5.241 5.908 1.000 468 HD12 ILE 53 1HD1 ILE 53 6.917 5.896 0.446 469 HD13 ILE 53 2HD1 ILE 53 6.416 7.010 1.717 470 H VAL 54 H VAL 54 5.361 0.571 3.749 471 HA VAL 54 HA VAL 54 6.836 -1.413 2.190 472 HB VAL 54 HB VAL 54 6.339 -1.931 4.536 473 HG11 VAL 54 1HG1 VAL 54 3.436 -1.948 3.702 474 HG12 VAL 54 2HG1 VAL 54 4.203 -0.776 4.774 475 HG13 VAL 54 3HG1 VAL 54 4.066 -2.464 5.267 476 HG21 VAL 54 3HG2 VAL 54 6.662 -3.762 2.960 477 HG22 VAL 54 1HG2 VAL 54 4.939 -3.758 2.576 478 HG23 VAL 54 2HG2 VAL 54 5.481 -4.208 4.192 479 H VAL 55 H VAL 55 6.154 -2.245 0.329 480 HA VAL 55 HA VAL 55 3.428 -1.593 -0.597 481 HB VAL 55 HB VAL 55 5.873 -2.147 -2.300 482 HG11 VAL 55 1HG1 VAL 55 3.109 -1.163 -3.029 483 HG12 VAL 55 2HG1 VAL 55 3.810 -2.731 -3.435 484 HG13 VAL 55 3HG1 VAL 55 4.477 -1.256 -4.137 485 HG21 VAL 55 3HG2 VAL 55 4.572 0.490 -1.591 486 HG22 VAL 55 1HG2 VAL 55 5.842 0.275 -2.797 487 HG23 VAL 55 2HG2 VAL 55 6.174 -0.061 -1.098 488 H VAL 56 H VAL 56 2.176 -3.350 -0.312 489 HA VAL 56 HA VAL 56 3.237 -6.037 -0.589 490 HB VAL 56 HB VAL 56 0.378 -5.193 -0.050 491 HG11 VAL 56 1HG1 VAL 56 0.127 -7.463 0.860 492 HG12 VAL 56 2HG1 VAL 56 1.783 -7.836 0.385 493 HG13 VAL 56 3HG1 VAL 56 0.568 -7.493 -0.846 494 HG21 VAL 56 3HG2 VAL 56 0.876 -5.611 2.321 495 HG22 VAL 56 1HG2 VAL 56 1.853 -4.294 1.671 496 HG23 VAL 56 2HG2 VAL 56 2.571 -5.887 1.914 497 H VAL 57 H VAL 57 3.557 -6.724 -2.617 498 HA VAL 57 HA VAL 57 1.770 -6.012 -4.795 499 HB VAL 57 HB VAL 57 4.121 -7.926 -4.818 500 HG11 VAL 57 1HG1 VAL 57 4.103 -7.537 -7.251 501 HG12 VAL 57 2HG1 VAL 57 2.654 -6.545 -7.075 502 HG13 VAL 57 3HG1 VAL 57 2.599 -8.266 -6.691 503 HG21 VAL 57 3HG2 VAL 57 4.806 -5.675 -4.115 504 HG22 VAL 57 1HG2 VAL 57 4.042 -4.993 -5.551 505 HG23 VAL 57 2HG2 VAL 57 5.430 -6.068 -5.717 506 H VAL 58 H VAL 58 -0.064 -7.106 -5.147 507 HA VAL 58 HA VAL 58 -0.237 -9.902 -4.209 508 HB VAL 58 HB VAL 58 -2.579 -9.537 -3.671 509 HG11 VAL 58 1HG1 VAL 58 -2.304 -7.966 -1.775 510 HG12 VAL 58 2HG1 VAL 58 -0.749 -7.468 -2.446 511 HG13 VAL 58 3HG1 VAL 58 -0.985 -9.130 -1.902 512 HG21 VAL 58 3HG2 VAL 58 -2.126 -6.677 -4.547 513 HG22 VAL 58 1HG2 VAL 58 -3.573 -7.281 -3.741 514 HG23 VAL 58 2HG2 VAL 58 -3.151 -7.868 -5.349 515 H ASP 59 H ASP 59 -1.205 -11.411 -5.489 516 HA ASP 59 HA ASP 59 -2.330 -10.522 -8.071 517 HB2 ASP 59 2HB ASP 59 -1.791 -12.867 -8.847 518 HB3 ASP 59 3HB ASP 59 -0.394 -11.858 -8.488 519 H ASP 60 H ASP 60 -3.377 -11.221 -5.165 520 HA ASP 60 HA ASP 60 -5.949 -12.204 -6.080 521 HB2 ASP 60 2HB ASP 60 -4.801 -14.303 -5.587 522 HB3 ASP 60 3HB ASP 60 -4.327 -13.705 -4.001 523 H LYS 61 H LYS 61 -7.654 -11.514 -4.756 524 HA LYS 61 HA LYS 61 -7.039 -9.232 -3.168 525 HB2 LYS 61 2HB LYS 61 -9.447 -8.958 -2.888 526 HB3 LYS 61 3HB LYS 61 -9.037 -9.288 -4.561 527 HG2 LYS 61 2HG LYS 61 -10.935 -10.568 -4.249 528 HG3 LYS 61 3HG LYS 61 -9.647 -11.743 -3.992 529 HD2 LYS 61 2HD LYS 61 -11.402 -11.984 -2.308 530 HD3 LYS 61 3HD LYS 61 -9.886 -11.481 -1.565 531 HE2 LYS 61 2HE LYS 61 -11.659 -10.225 -0.565 532 HE3 LYS 61 3HE LYS 61 -10.735 -9.130 -1.590 533 HZ1 LYS 61 3HZ LYS 61 -13.061 -8.750 -1.911 534 HZ2 LYS 61 1HZ LYS 61 -13.347 -10.383 -2.235 535 HZ3 LYS 61 2HZ LYS 61 -12.447 -9.451 -3.317 536 H GLU 62 H GLU 62 -7.766 -12.573 -2.305 537 HA GLU 62 HA GLU 62 -8.252 -11.951 0.474 538 HB2 GLU 62 2HB GLU 62 -7.742 -14.587 -0.922 539 HB3 GLU 62 3HB GLU 62 -8.074 -14.441 0.800 540 HG2 GLU 62 2HG GLU 62 -10.251 -13.408 0.268 541 HG3 GLU 62 3HG GLU 62 -9.916 -13.639 -1.447 542 H TRP 63 H TRP 63 -5.474 -12.970 -1.457 543 HA TRP 63 HA TRP 63 -3.605 -13.175 0.636 544 HB2 TRP 63 2HB TRP 63 -2.931 -13.885 -1.551 545 HB3 TRP 63 3HB TRP 63 -3.303 -12.313 -2.251 546 HD1 TRP 63 HD1 TRP 63 -1.087 -11.270 -2.974 547 HE1 TRP 63 HE1 TRP 63 1.236 -10.940 -1.924 548 HE3 TRP 63 HE3 TRP 63 -1.775 -13.887 1.371 549 HZ2 TRP 63 HZ2 TRP 63 2.597 -11.685 0.432 550 HZ3 TRP 63 HZ3 TRP 63 0.092 -14.024 2.969 551 HH2 TRP 63 HH2 TRP 63 2.233 -12.946 2.507 552 H ALA 64 H ALA 64 -4.676 -10.364 -1.260 553 HA ALA 64 HA ALA 64 -3.200 -8.391 0.092 554 HB1 ALA 64 3HB ALA 64 -5.922 -8.116 -1.188 555 HB2 ALA 64 1HB ALA 64 -4.377 -7.998 -2.031 556 HB3 ALA 64 2HB ALA 64 -4.810 -6.801 -0.810 557 H GLU 65 H GLU 65 -6.443 -9.723 0.764 558 HA GLU 65 HA GLU 65 -7.031 -8.019 2.938 559 HB2 GLU 65 2HB GLU 65 -8.768 -9.344 1.777 560 HB3 GLU 65 3HB GLU 65 -8.086 -10.819 2.458 561 HG2 GLU 65 2HG GLU 65 -8.531 -9.919 4.731 562 HG3 GLU 65 3HG GLU 65 -9.316 -8.529 3.990 563 H LYS 66 H LYS 66 -5.203 -11.031 2.761 564 HA LYS 66 HA LYS 66 -5.128 -11.659 5.490 565 HB2 LYS 66 2HB LYS 66 -4.278 -13.189 3.784 566 HB3 LYS 66 3HB LYS 66 -2.971 -12.075 3.402 567 HG2 LYS 66 2HG LYS 66 -1.968 -12.411 5.562 568 HG3 LYS 66 3HG LYS 66 -3.347 -13.367 6.104 569 HD2 LYS 66 2HD LYS 66 -1.451 -14.127 3.868 570 HD3 LYS 66 3HD LYS 66 -1.415 -14.777 5.508 571 HE2 LYS 66 2HE LYS 66 -3.729 -15.619 5.171 572 HE3 LYS 66 3HE LYS 66 -3.646 -15.074 3.496 573 HZ1 LYS 66 3HZ LYS 66 -3.149 -17.412 3.670 574 HZ2 LYS 66 1HZ LYS 66 -1.891 -17.111 4.758 575 HZ3 LYS 66 2HZ LYS 66 -1.775 -16.576 3.155 576 H ALA 67 H ALA 67 -3.248 -9.339 3.625 577 HA ALA 67 HA ALA 67 -1.501 -8.564 5.742 578 HB1 ALA 67 3HB ALA 67 -0.926 -6.673 4.314 579 HB2 ALA 67 1HB ALA 67 -2.312 -7.015 3.277 580 HB3 ALA 67 2HB ALA 67 -0.978 -8.165 3.373 581 H ILE 68 H ILE 68 -4.406 -7.022 4.354 582 HA ILE 68 HA ILE 68 -4.518 -4.831 6.112 583 HB ILE 68 HB ILE 68 -6.895 -6.131 4.764 584 HG12 ILE 68 2HG1 ILE 68 -5.177 -5.790 3.079 585 HG13 ILE 68 3HG1 ILE 68 -6.432 -4.574 2.870 586 HG21 ILE 68 1HG2 ILE 68 -6.395 -3.285 5.650 587 HG22 ILE 68 2HG2 ILE 68 -7.516 -4.435 6.382 588 HG23 ILE 68 3HG2 ILE 68 -7.808 -3.839 4.749 589 HD11 ILE 68 3HD1 ILE 68 -5.002 -2.945 4.029 590 HD12 ILE 68 1HD1 ILE 68 -4.258 -3.592 2.568 591 HD13 ILE 68 2HD1 ILE 68 -3.740 -4.170 4.151 592 H ARG 69 H ARG 69 -6.123 -7.992 6.300 593 HA ARG 69 HA ARG 69 -7.665 -7.549 8.607 594 HB2 ARG 69 2HB ARG 69 -7.862 -9.494 6.997 595 HB3 ARG 69 3HB ARG 69 -6.434 -10.184 7.750 596 HG2 ARG 69 2HG ARG 69 -8.197 -11.295 8.784 597 HG3 ARG 69 3HG ARG 69 -7.759 -10.046 9.949 598 HD2 ARG 69 2HD ARG 69 -10.148 -10.109 9.799 599 HD3 ARG 69 3HD ARG 69 -9.600 -8.630 9.010 600 HE ARG 69 HE ARG 69 -9.824 -10.588 7.040 601 HH11 ARG 69 1HH1 ARG 69 -11.930 -8.922 9.220 602 HH12 ARG 69 2HH1 ARG 69 -13.290 -9.051 8.159 603 HH21 ARG 69 1HH2 ARG 69 -11.601 -10.759 5.711 604 HH22 ARG 69 2HH2 ARG 69 -13.107 -10.054 6.207 605 H PHE 70 H PHE 70 -4.304 -8.515 8.175 606 HA PHE 70 HA PHE 70 -3.792 -9.118 10.924 607 HB2 PHE 70 2HB PHE 70 -2.407 -10.027 9.107 608 HB3 PHE 70 3HB PHE 70 -1.867 -8.404 8.692 609 HD1 PHE 70 HD1 PHE 70 -1.863 -10.891 11.462 610 HD2 PHE 70 HD2 PHE 70 0.045 -7.505 9.712 611 HE1 PHE 70 HE1 PHE 70 -0.000 -11.120 13.053 612 HE2 PHE 70 HE2 PHE 70 1.908 -7.733 11.303 613 HZ PHE 70 HZ PHE 70 1.886 -9.540 12.975 614 H VAL 71 H VAL 71 -3.115 -6.264 8.878 615 HA VAL 71 HA VAL 71 -1.867 -4.669 10.799 616 HB VAL 71 HB VAL 71 -3.660 -3.726 8.542 617 HG11 VAL 71 1HG1 VAL 71 -2.410 -1.620 8.690 618 HG12 VAL 71 2HG1 VAL 71 -1.517 -2.243 10.077 619 HG13 VAL 71 3HG1 VAL 71 -3.254 -1.969 10.198 620 HG21 VAL 71 3HG2 VAL 71 -1.571 -3.481 7.264 621 HG22 VAL 71 1HG2 VAL 71 -1.854 -5.157 7.734 622 HG23 VAL 71 2HG2 VAL 71 -0.669 -4.185 8.607 623 H LYS 72 H LYS 72 -5.320 -5.196 10.214 624 HA LYS 72 HA LYS 72 -6.293 -3.217 11.971 625 HB2 LYS 72 2HB LYS 72 -7.686 -4.511 10.310 626 HB3 LYS 72 3HB LYS 72 -7.630 -5.876 11.421 627 HG2 LYS 72 2HG LYS 72 -8.640 -4.382 13.168 628 HG3 LYS 72 3HG LYS 72 -8.861 -3.167 11.910 629 HD2 LYS 72 2HD LYS 72 -10.924 -4.365 12.212 630 HD3 LYS 72 3HD LYS 72 -10.244 -4.800 10.644 631 HE2 LYS 72 2HE LYS 72 -9.559 -6.924 11.417 632 HE3 LYS 72 3HE LYS 72 -9.763 -6.464 13.108 633 HZ1 LYS 72 3HZ LYS 72 -11.540 -7.920 12.207 634 HZ2 LYS 72 1HZ LYS 72 -12.012 -6.660 11.184 635 HZ3 LYS 72 2HZ LYS 72 -12.105 -6.468 12.860 636 H SER 73 H SER 73 -5.441 -6.628 12.537 637 HA SER 73 HA SER 73 -6.147 -6.727 15.268 638 HB2 SER 73 2HB SER 73 -4.045 -8.299 13.750 639 HB3 SER 73 3HB SER 73 -4.567 -8.668 15.394 640 HG SER 73 HG SER 73 -6.702 -8.947 14.550 641 H LEU 74 H LEU 74 -3.278 -5.511 13.655 642 HA LEU 74 HA LEU 74 -1.691 -5.064 15.965 643 HB2 LEU 74 2HB LEU 74 -1.779 -3.470 13.393 644 HB3 LEU 74 3HB LEU 74 -0.493 -3.421 14.585 645 HG LEU 74 HG LEU 74 -1.236 -5.856 12.947 646 HD11 LEU 74 1HD1 LEU 74 1.086 -3.950 12.638 647 HD12 LEU 74 2HD1 LEU 74 -0.297 -4.088 11.550 648 HD13 LEU 74 3HD1 LEU 74 0.831 -5.434 11.719 649 HD21 LEU 74 3HD2 LEU 74 0.872 -6.784 13.792 650 HD22 LEU 74 1HD2 LEU 74 -0.258 -6.442 15.103 651 HD23 LEU 74 2HD2 LEU 74 1.099 -5.355 14.801 652 H GLY 75 H GLY 75 -4.032 -3.018 14.237 653 HA2 GLY 75 2HA GLY 75 -5.437 -1.375 15.058 654 HA3 GLY 75 3HA GLY 75 -4.821 -1.698 16.669 655 H ALA 76 H ALA 76 -3.425 -0.446 13.621 656 HA ALA 76 HA ALA 76 -2.592 1.985 15.063 657 HB1 ALA 76 3HB ALA 76 -0.790 0.369 13.249 658 HB2 ALA 76 1HB ALA 76 -0.663 0.471 15.005 659 HB3 ALA 76 2HB ALA 76 -0.383 1.906 14.015 660 H GLN 77 H GLN 77 -2.764 3.859 13.896 661 HA GLN 77 HA GLN 77 -4.384 3.862 11.585 662 HB2 GLN 77 2HB GLN 77 -4.060 6.287 11.564 663 HB3 GLN 77 3HB GLN 77 -4.384 5.710 13.188 664 HG2 GLN 77 2HG GLN 77 -2.691 7.139 13.668 665 HG3 GLN 77 3HG GLN 77 -1.729 5.707 13.318 666 HE21 GLN 77 1HE2 GLN 77 -3.362 7.642 10.892 667 HE22 GLN 77 2HE2 GLN 77 -1.931 8.270 10.161 668 H VAL 78 H VAL 78 -3.885 3.568 9.508 669 HA VAL 78 HA VAL 78 -1.233 4.325 8.498 670 HB VAL 78 HB VAL 78 -1.025 2.229 7.210 671 HG11 VAL 78 1HG1 VAL 78 -1.299 1.739 10.182 672 HG12 VAL 78 2HG1 VAL 78 0.115 2.409 9.369 673 HG13 VAL 78 3HG1 VAL 78 -0.381 0.748 9.045 674 HG21 VAL 78 3HG2 VAL 78 -3.388 1.623 7.060 675 HG22 VAL 78 1HG2 VAL 78 -3.429 1.300 8.795 676 HG23 VAL 78 2HG2 VAL 78 -2.445 0.292 7.731 677 H LEU 79 H LEU 79 -1.177 4.896 6.322 678 HA LEU 79 HA LEU 79 -3.762 5.247 4.981 679 HB2 LEU 79 2HB LEU 79 -1.000 6.339 4.436 680 HB3 LEU 79 3HB LEU 79 -2.308 6.510 3.284 681 HG LEU 79 HG LEU 79 -2.072 8.554 4.544 682 HD11 LEU 79 1HD1 LEU 79 -4.329 7.921 3.892 683 HD12 LEU 79 2HD1 LEU 79 -4.335 8.810 5.413 684 HD13 LEU 79 3HD1 LEU 79 -4.544 7.058 5.416 685 HD21 LEU 79 3HD2 LEU 79 -2.524 6.897 7.031 686 HD22 LEU 79 1HD2 LEU 79 -2.398 8.656 6.965 687 HD23 LEU 79 2HD2 LEU 79 -1.006 7.657 6.552 688 H ILE 80 H ILE 80 -4.440 3.773 3.552 689 HA ILE 80 HA ILE 80 -2.467 1.906 2.407 690 HB ILE 80 HB ILE 80 -5.464 1.583 2.695 691 HG12 ILE 80 2HG1 ILE 80 -3.205 0.267 4.237 692 HG13 ILE 80 3HG1 ILE 80 -4.212 1.574 4.851 693 HG21 ILE 80 1HG2 ILE 80 -5.065 -0.764 2.063 694 HG22 ILE 80 2HG2 ILE 80 -3.363 -0.392 1.780 695 HG23 ILE 80 3HG2 ILE 80 -4.609 0.350 0.773 696 HD11 ILE 80 3HD1 ILE 80 -6.163 0.150 4.754 697 HD12 ILE 80 1HD1 ILE 80 -4.888 -0.616 5.701 698 HD13 ILE 80 2HD1 ILE 80 -5.204 -1.151 4.050 699 H ILE 81 H ILE 81 -1.799 2.676 0.465 700 HA ILE 81 HA ILE 81 -3.745 3.817 -1.410 701 HB ILE 81 HB ILE 81 -0.738 3.566 -1.687 702 HG12 ILE 81 2HG1 ILE 81 -2.456 5.954 -0.932 703 HG13 ILE 81 3HG1 ILE 81 -1.370 5.081 0.145 704 HG21 ILE 81 1HG2 ILE 81 -2.734 5.113 -3.352 705 HG22 ILE 81 2HG2 ILE 81 -1.878 3.653 -3.850 706 HG23 ILE 81 3HG2 ILE 81 -0.981 5.141 -3.553 707 HD11 ILE 81 3HD1 ILE 81 0.533 5.782 -1.246 708 HD12 ILE 81 1HD1 ILE 81 -0.358 7.145 -0.568 709 HD13 ILE 81 2HD1 ILE 81 -0.578 6.705 -2.260 710 H ILE 82 H ILE 82 -4.651 2.606 -2.970 711 HA ILE 82 HA ILE 82 -3.447 -0.028 -3.584 712 HB ILE 82 HB ILE 82 -6.344 0.816 -3.854 713 HG12 ILE 82 2HG1 ILE 82 -5.007 -0.971 -1.796 714 HG13 ILE 82 3HG1 ILE 82 -5.635 0.646 -1.496 715 HG21 ILE 82 1HG2 ILE 82 -5.716 -0.893 -5.483 716 HG22 ILE 82 2HG2 ILE 82 -6.774 -1.577 -4.249 717 HG23 ILE 82 3HG2 ILE 82 -5.040 -1.892 -4.197 718 HD11 ILE 82 3HD1 ILE 82 -7.265 -1.749 -2.312 719 HD12 ILE 82 1HD1 ILE 82 -7.889 -0.130 -1.985 720 HD13 ILE 82 2HD1 ILE 82 -7.150 -1.070 -0.688 721 H TYR 83 H TYR 83 -3.055 -0.617 -5.687 722 HA TYR 83 HA TYR 83 -3.802 1.305 -7.806 723 HB2 TYR 83 2HB TYR 83 -1.438 1.517 -7.465 724 HB3 TYR 83 3HB TYR 83 -1.218 -0.230 -7.474 725 HD1 TYR 83 HD2 TYR 83 -2.326 2.597 -9.663 726 HD2 TYR 83 HD1 TYR 83 -0.639 -1.316 -9.473 727 HE1 TYR 83 HE2 TYR 83 -1.903 2.660 -12.085 728 HE2 TYR 83 HE1 TYR 83 -0.220 -1.254 -11.892 729 HH TYR 83 HH TYR 83 -0.967 -0.140 -13.864 730 H ASP 84 H ASP 84 -5.136 0.498 -9.237 731 HA ASP 84 HA ASP 84 -4.599 -1.972 -10.600 732 HB2 ASP 84 2HB ASP 84 -5.916 -2.770 -8.634 733 HB3 ASP 84 3HB ASP 84 -7.235 -1.704 -9.113 734 H GLN 85 H GLN 85 -5.984 -2.172 -12.571 735 HA GLN 85 HA GLN 85 -6.770 0.535 -13.456 736 HB2 GLN 85 2HB GLN 85 -5.691 -1.779 -15.074 737 HB3 GLN 85 3HB GLN 85 -6.194 -0.232 -15.747 738 HG2 GLN 85 2HG GLN 85 -3.970 -0.620 -13.745 739 HG3 GLN 85 3HG GLN 85 -3.757 -0.418 -15.481 740 HE21 GLN 85 1HE2 GLN 85 -2.508 1.435 -15.162 741 HE22 GLN 85 2HE2 GLN 85 -3.204 2.940 -14.686 742 H ASP 86 H ASP 86 -8.423 -1.808 -12.281 743 HA ASP 86 HA ASP 86 -10.573 -1.651 -14.308 744 HB2 ASP 86 2HB ASP 86 -9.800 -3.956 -13.746 745 HB3 ASP 86 3HB ASP 86 -10.244 -3.672 -12.069 746 H GLN 87 H GLN 87 -12.116 -0.207 -13.800 747 HA GLN 87 HA GLN 87 -12.062 1.468 -11.627 748 HB2 GLN 87 2HB GLN 87 -14.453 0.686 -13.306 749 HB3 GLN 87 3HB GLN 87 -14.436 2.048 -12.195 750 HG2 GLN 87 2HG GLN 87 -12.678 3.119 -13.486 751 HG3 GLN 87 3HG GLN 87 -12.605 1.732 -14.572 752 HE21 GLN 87 1HE2 GLN 87 -14.465 4.507 -13.595 753 HE22 GLN 87 2HE2 GLN 87 -15.540 4.513 -14.947 754 H ASN 88 H ASN 88 -14.450 -1.191 -11.972 755 HA ASN 88 HA ASN 88 -15.484 -0.820 -9.360 756 HB2 ASN 88 2HB ASN 88 -15.754 -3.074 -11.343 757 HB3 ASN 88 3HB ASN 88 -16.557 -3.092 -9.775 758 HD21 ASN 88 1HD2 ASN 88 -18.599 -3.019 -10.643 759 HD22 ASN 88 2HD2 ASN 88 -19.241 -1.608 -11.406 760 H ARG 89 H ARG 89 -12.918 -2.921 -10.595 761 HA ARG 89 HA ARG 89 -12.654 -4.594 -8.320 762 HB2 ARG 89 2HB ARG 89 -11.391 -4.353 -10.791 763 HB3 ARG 89 3HB ARG 89 -10.114 -3.966 -9.652 764 HG2 ARG 89 2HG ARG 89 -9.984 -6.289 -10.116 765 HG3 ARG 89 3HG ARG 89 -10.625 -6.122 -8.478 766 HD2 ARG 89 2HD ARG 89 -11.792 -7.835 -9.891 767 HD3 ARG 89 3HD ARG 89 -12.846 -6.591 -9.216 768 HE ARG 89 HE ARG 89 -12.742 -5.508 -11.443 769 HH11 ARG 89 1HH1 ARG 89 -12.022 -8.877 -11.209 770 HH12 ARG 89 2HH1 ARG 89 -12.498 -9.186 -12.845 771 HH21 ARG 89 1HH2 ARG 89 -13.320 -5.921 -13.520 772 HH22 ARG 89 2HH2 ARG 89 -13.231 -7.536 -14.132 773 H LEU 90 H LEU 90 -10.747 -1.774 -9.287 774 HA LEU 90 HA LEU 90 -9.115 -1.491 -7.082 775 HB2 LEU 90 2HB LEU 90 -8.882 -0.305 -9.231 776 HB3 LEU 90 3HB LEU 90 -10.285 0.671 -8.843 777 HG LEU 90 HG LEU 90 -9.068 1.672 -6.952 778 HD11 LEU 90 1HD1 LEU 90 -7.581 -0.177 -6.413 779 HD12 LEU 90 2HD1 LEU 90 -6.664 1.300 -6.702 780 HD13 LEU 90 3HD1 LEU 90 -6.726 0.045 -7.941 781 HD21 LEU 90 3HD2 LEU 90 -9.029 2.776 -9.125 782 HD22 LEU 90 1HD2 LEU 90 -7.611 1.837 -9.595 783 HD23 LEU 90 2HD2 LEU 90 -7.497 3.010 -8.283 784 H GLU 91 H GLU 91 -12.280 0.078 -7.630 785 HA GLU 91 HA GLU 91 -12.328 1.361 -5.077 786 HB2 GLU 91 2HB GLU 91 -14.539 0.830 -7.072 787 HB3 GLU 91 3HB GLU 91 -14.712 1.843 -5.645 788 HG2 GLU 91 2HG GLU 91 -12.685 2.375 -7.812 789 HG3 GLU 91 3HG GLU 91 -14.313 3.046 -7.824 790 H GLU 92 H GLU 92 -13.421 -1.773 -6.235 791 HA GLU 92 HA GLU 92 -15.328 -2.506 -4.364 792 HB2 GLU 92 2HB GLU 92 -14.724 -3.886 -6.305 793 HB3 GLU 92 3HB GLU 92 -13.167 -4.250 -5.578 794 HG2 GLU 92 2HG GLU 92 -14.552 -6.146 -5.264 795 HG3 GLU 92 3HG GLU 92 -14.398 -5.358 -3.696 796 H PHE 93 H PHE 93 -11.870 -3.384 -4.138 797 HA PHE 93 HA PHE 93 -12.046 -4.287 -1.461 798 HB2 PHE 93 2HB PHE 93 -10.271 -4.900 -3.169 799 HB3 PHE 93 3HB PHE 93 -9.535 -3.332 -2.859 800 HD1 PHE 93 HD1 PHE 93 -10.643 -6.429 -1.096 801 HD2 PHE 93 HD2 PHE 93 -7.927 -3.147 -1.179 802 HE1 PHE 93 HE1 PHE 93 -9.401 -7.413 0.784 803 HE2 PHE 93 HE2 PHE 93 -6.682 -4.128 0.704 804 HZ PHE 93 HZ PHE 93 -7.419 -6.265 1.686 805 H SER 94 H SER 94 -11.404 -1.151 -2.876 806 HA SER 94 HA SER 94 -10.286 0.187 -0.680 807 HB2 SER 94 2HB SER 94 -10.276 1.230 -2.858 808 HB3 SER 94 3HB SER 94 -12.040 1.246 -2.910 809 HG SER 94 HG SER 94 -10.424 3.106 -1.943 810 H ARG 95 H ARG 95 -13.749 0.082 -1.664 811 HA ARG 95 HA ARG 95 -14.790 1.495 0.511 812 HB2 ARG 95 2HB ARG 95 -15.913 -0.556 -1.347 813 HB3 ARG 95 3HB ARG 95 -16.829 -0.191 0.106 814 HG2 ARG 95 2HG ARG 95 -17.727 1.181 -1.573 815 HG3 ARG 95 3HG ARG 95 -16.735 2.243 -0.576 816 HD2 ARG 95 2HD ARG 95 -15.741 0.999 -3.134 817 HD3 ARG 95 3HD ARG 95 -16.581 2.545 -3.090 818 HE ARG 95 HE ARG 95 -14.142 2.188 -1.496 819 HH11 ARG 95 1HH1 ARG 95 -15.858 3.763 -4.020 820 HH12 ARG 95 2HH1 ARG 95 -14.560 4.847 -4.387 821 HH21 ARG 95 1HH2 ARG 95 -12.490 3.642 -1.928 822 HH22 ARG 95 2HH2 ARG 95 -12.703 4.813 -3.182 823 H GLU 96 H GLU 96 -13.994 -1.944 0.260 824 HA GLU 96 HA GLU 96 -15.002 -2.772 2.745 825 HB2 GLU 96 2HB GLU 96 -12.569 -3.854 1.305 826 HB3 GLU 96 3HB GLU 96 -13.504 -4.686 2.544 827 HG2 GLU 96 2HG GLU 96 -15.480 -4.578 1.023 828 HG3 GLU 96 3HG GLU 96 -14.416 -3.929 -0.224 829 H VAL 97 H VAL 97 -11.719 -1.632 1.888 830 HA VAL 97 HA VAL 97 -10.448 -1.953 4.316 831 HB VAL 97 HB VAL 97 -10.090 0.339 2.365 832 HG11 VAL 97 1HG1 VAL 97 -8.280 -0.620 4.588 833 HG12 VAL 97 2HG1 VAL 97 -9.111 0.935 4.501 834 HG13 VAL 97 3HG1 VAL 97 -7.831 0.553 3.350 835 HG21 VAL 97 3HG2 VAL 97 -9.750 -1.850 1.338 836 HG22 VAL 97 1HG2 VAL 97 -8.626 -2.293 2.624 837 HG23 VAL 97 2HG2 VAL 97 -8.215 -0.997 1.502 838 H ARG 98 H ARG 98 -12.369 0.894 3.303 839 HA ARG 98 HA ARG 98 -12.082 2.288 5.752 840 HB2 ARG 98 2HB ARG 98 -14.032 2.517 3.476 841 HB3 ARG 98 3HB ARG 98 -14.235 3.483 4.933 842 HG2 ARG 98 2HG ARG 98 -11.887 4.313 4.589 843 HG3 ARG 98 3HG ARG 98 -11.912 3.511 3.018 844 HD2 ARG 98 2HD ARG 98 -13.645 4.920 2.221 845 HD3 ARG 98 3HD ARG 98 -14.000 5.522 3.841 846 HE ARG 98 HE ARG 98 -11.327 6.119 3.027 847 HH11 ARG 98 1HH1 ARG 98 -14.598 7.167 2.773 848 HH12 ARG 98 2HH1 ARG 98 -14.159 8.814 2.489 849 HH21 ARG 98 1HH2 ARG 98 -10.773 8.211 2.690 850 HH22 ARG 98 2HH2 ARG 98 -12.007 9.402 2.433 851 H ARG 99 H ARG 99 -14.298 -0.233 4.760 852 HA ARG 99 HA ARG 99 -16.016 0.070 7.062 853 HB2 ARG 99 2HB ARG 99 -15.743 -2.165 5.041 854 HB3 ARG 99 3HB ARG 99 -16.949 -2.135 6.321 855 HG2 ARG 99 2HG ARG 99 -17.879 -0.059 5.379 856 HG3 ARG 99 3HG ARG 99 -16.693 -0.136 4.073 857 HD2 ARG 99 2HD ARG 99 -17.616 -2.241 3.312 858 HD3 ARG 99 3HD ARG 99 -18.739 -2.277 4.671 859 HE ARG 99 HE ARG 99 -18.855 -0.357 2.430 860 HH11 ARG 99 1HH1 ARG 99 -20.353 -2.049 5.025 861 HH12 ARG 99 2HH1 ARG 99 -21.946 -1.568 4.563 862 HH21 ARG 99 1HH2 ARG 99 -20.898 0.265 1.858 863 HH22 ARG 99 2HH2 ARG 99 -22.253 -0.289 2.782 864 H ARG 100 H ARG 100 -13.057 -1.615 6.351 865 HA ARG 100 HA ARG 100 -13.186 -3.358 8.658 866 HB2 ARG 100 2HB ARG 100 -10.764 -2.672 6.971 867 HB3 ARG 100 3HB ARG 100 -10.955 -4.062 8.033 868 HG2 ARG 100 2HG ARG 100 -12.717 -4.940 6.566 869 HG3 ARG 100 3HG ARG 100 -12.525 -3.544 5.509 870 HD2 ARG 100 2HD ARG 100 -10.091 -4.255 5.268 871 HD3 ARG 100 3HD ARG 100 -10.567 -5.771 6.029 872 HE ARG 100 HE ARG 100 -11.424 -4.808 3.389 873 HH11 ARG 100 1HH1 ARG 100 -11.447 -7.311 5.749 874 HH12 ARG 100 2HH1 ARG 100 -11.839 -8.539 4.598 875 HH21 ARG 100 1HH2 ARG 100 -11.951 -6.427 1.911 876 HH22 ARG 100 2HH2 ARG 100 -12.104 -8.057 2.479 877 H GLY 101 H GLY 101 -12.398 -0.104 8.095 878 HA2 GLY 101 2HA GLY 101 -12.284 1.364 9.996 879 HA3 GLY 101 3HA GLY 101 -11.411 0.117 10.864 880 H PHE 102 H PHE 102 -10.578 1.040 7.556 881 HA PHE 102 HA PHE 102 -8.276 2.566 8.597 882 HB2 PHE 102 2HB PHE 102 -8.209 0.302 6.613 883 HB3 PHE 102 3HB PHE 102 -6.934 1.517 6.666 884 HD1 PHE 102 HD1 PHE 102 -6.158 2.019 9.216 885 HD2 PHE 102 HD2 PHE 102 -7.727 -1.656 7.734 886 HE1 PHE 102 HE1 PHE 102 -5.032 0.800 11.037 887 HE2 PHE 102 HE2 PHE 102 -6.604 -2.873 9.551 888 HZ PHE 102 HZ PHE 102 -5.256 -1.643 11.206 889 H GLU 103 H GLU 103 -7.128 3.836 6.927 890 HA GLU 103 HA GLU 103 -9.031 5.104 5.109 891 HB2 GLU 103 2HB GLU 103 -6.883 6.060 6.713 892 HB3 GLU 103 3HB GLU 103 -6.437 6.349 5.038 893 HG2 GLU 103 2HG GLU 103 -8.998 7.242 6.354 894 HG3 GLU 103 3HG GLU 103 -7.595 8.261 6.038 895 H VAL 104 H VAL 104 -8.775 5.194 2.905 896 HA VAL 104 HA VAL 104 -6.560 3.684 1.715 897 HB VAL 104 HB VAL 104 -8.249 1.996 2.032 898 HG11 VAL 104 1HG1 VAL 104 -10.205 3.416 2.281 899 HG12 VAL 104 2HG1 VAL 104 -10.497 2.183 1.055 900 HG13 VAL 104 3HG1 VAL 104 -10.143 3.842 0.570 901 HG21 VAL 104 3HG2 VAL 104 -8.198 2.881 -0.859 902 HG22 VAL 104 1HG2 VAL 104 -8.612 1.268 -0.281 903 HG23 VAL 104 2HG2 VAL 104 -6.978 1.892 -0.057 904 H ARG 105 H ARG 105 -5.883 4.445 -0.202 905 HA ARG 105 HA ARG 105 -7.583 6.358 -1.668 906 HB2 ARG 105 2HB ARG 105 -4.639 6.650 -1.016 907 HB3 ARG 105 3HB ARG 105 -5.482 7.655 -2.189 908 HG2 ARG 105 2HG ARG 105 -6.115 7.451 0.757 909 HG3 ARG 105 3HG ARG 105 -5.291 8.792 -0.043 910 HD2 ARG 105 2HD ARG 105 -7.244 9.425 -1.216 911 HD3 ARG 105 3HD ARG 105 -8.059 7.906 -0.843 912 HE ARG 105 HE ARG 105 -7.464 9.261 1.550 913 HH11 ARG 105 1HH1 ARG 105 -9.583 9.428 -1.168 914 HH12 ARG 105 2HH1 ARG 105 -10.807 10.273 -0.286 915 HH21 ARG 105 1HH2 ARG 105 -9.042 10.303 2.664 916 HH22 ARG 105 2HH2 ARG 105 -10.505 10.767 1.862 917 H THR 106 H THR 106 -7.872 5.804 -3.727 918 HA THR 106 HA THR 106 -6.260 3.611 -4.818 919 HB THR 106 HB THR 106 -8.069 3.373 -6.486 920 HG1 THR 106 HG1 THR 106 -10.069 4.649 -5.783 921 HG21 THR 106 3HG2 THR 106 -9.025 3.458 -3.619 922 HG22 THR 106 1HG2 THR 106 -8.210 2.105 -4.406 923 HG23 THR 106 2HG2 THR 106 -9.820 2.594 -4.935 924 H VAL 107 H VAL 107 -4.987 3.790 -6.588 925 HA VAL 107 HA VAL 107 -4.989 6.360 -8.050 926 HB VAL 107 HB VAL 107 -2.545 6.151 -8.330 927 HG11 VAL 107 1HG1 VAL 107 -3.479 6.144 -5.454 928 HG12 VAL 107 2HG1 VAL 107 -3.409 7.539 -6.532 929 HG13 VAL 107 3HG1 VAL 107 -1.920 6.747 -6.019 930 HG21 VAL 107 3HG2 VAL 107 -2.780 3.829 -6.405 931 HG22 VAL 107 1HG2 VAL 107 -1.272 4.552 -6.970 932 HG23 VAL 107 2HG2 VAL 107 -2.332 3.722 -8.108 933 H THR 108 H THR 108 -4.539 6.317 -10.265 934 HA THR 108 HA THR 108 -4.790 3.644 -11.526 935 HB THR 108 HB THR 108 -5.957 4.850 -13.416 936 HG1 THR 108 HG1 THR 108 -6.573 6.927 -11.631 937 HG21 THR 108 3HG2 THR 108 -7.290 4.952 -10.700 938 HG22 THR 108 1HG2 THR 108 -7.217 3.548 -11.767 939 HG23 THR 108 2HG2 THR 108 -8.122 4.981 -12.255 940 H SER 109 H SER 109 -2.506 5.903 -11.085 941 HA SER 109 HA SER 109 -0.906 4.973 -13.251 942 HB2 SER 109 2HB SER 109 -0.635 6.972 -14.558 943 HB3 SER 109 3HB SER 109 -2.369 6.690 -14.426 944 HG SER 109 HG SER 109 -2.380 8.689 -13.764 945 HA PRO 110 HA PRO 110 2.437 6.302 -10.574 946 HB2 PRO 110 2HB PRO 110 3.765 7.386 -13.016 947 HB3 PRO 110 3HB PRO 110 4.378 6.246 -11.811 948 HG2 PRO 110 2HG PRO 110 3.623 5.396 -14.221 949 HG3 PRO 110 3HG PRO 110 3.275 4.435 -12.771 950 HD2 PRO 110 2HD PRO 110 1.443 6.176 -14.382 951 HD3 PRO 110 3HD PRO 110 1.118 4.611 -13.605 952 H ASP 111 H ASP 111 1.230 8.570 -13.009 953 HA ASP 111 HA ASP 111 2.264 10.909 -11.705 954 HB2 ASP 111 2HB ASP 111 0.121 10.624 -13.825 955 HB3 ASP 111 3HB ASP 111 0.865 12.144 -13.327 956 H ASP 112 H ASP 112 -0.991 9.483 -11.978 957 HA ASP 112 HA ASP 112 -2.334 11.223 -10.239 958 HB2 ASP 112 2HB ASP 112 -3.453 9.616 -11.735 959 HB3 ASP 112 3HB ASP 112 -2.836 8.280 -10.770 960 H PHE 113 H PHE 113 -0.363 8.379 -9.622 961 HA PHE 113 HA PHE 113 -0.868 8.068 -6.871 962 HB2 PHE 113 2HB PHE 113 0.237 6.321 -8.149 963 HB3 PHE 113 3HB PHE 113 1.599 7.383 -8.489 964 HD1 PHE 113 HD1 PHE 113 -0.219 5.726 -5.693 965 HD2 PHE 113 HD2 PHE 113 3.442 7.418 -7.058 966 HE1 PHE 113 HE1 PHE 113 0.916 4.909 -3.668 967 HE2 PHE 113 HE2 PHE 113 4.578 6.604 -5.038 968 HZ PHE 113 HZ PHE 113 3.316 5.348 -3.339 969 H LYS 114 H LYS 114 1.687 9.936 -8.555 970 HA LYS 114 HA LYS 114 3.051 10.890 -6.326 971 HB2 LYS 114 2HB LYS 114 2.540 12.245 -8.982 972 HB3 LYS 114 3HB LYS 114 3.617 12.904 -7.760 973 HG2 LYS 114 2HG LYS 114 4.884 10.708 -7.897 974 HG3 LYS 114 3HG LYS 114 3.937 10.365 -9.345 975 HD2 LYS 114 2HD LYS 114 5.665 12.821 -8.952 976 HD3 LYS 114 3HD LYS 114 6.170 11.374 -9.821 977 HE2 LYS 114 2HE LYS 114 3.749 13.009 -10.580 978 HE3 LYS 114 3HE LYS 114 5.355 13.266 -11.264 979 HZ1 LYS 114 3HZ LYS 114 3.859 10.707 -11.404 980 HZ2 LYS 114 1HZ LYS 114 5.338 11.053 -12.146 981 HZ3 LYS 114 2HZ LYS 114 3.935 11.847 -12.651 982 H LYS 115 H LYS 115 0.293 12.426 -7.988 983 HA LYS 115 HA LYS 115 0.165 14.698 -6.325 984 HB2 LYS 115 2HB LYS 115 -2.069 13.429 -7.918 985 HB3 LYS 115 3HB LYS 115 -2.035 15.079 -7.317 986 HG2 LYS 115 2HG LYS 115 -0.153 13.924 -9.380 987 HG3 LYS 115 3HG LYS 115 -1.550 14.942 -9.718 988 HD2 LYS 115 2HD LYS 115 0.149 16.506 -9.776 989 HD3 LYS 115 3HD LYS 115 -0.345 16.624 -8.087 990 HE2 LYS 115 2HE LYS 115 1.489 15.096 -7.466 991 HE3 LYS 115 3HE LYS 115 1.986 15.022 -9.154 992 HZ1 LYS 115 3HZ LYS 115 3.289 16.586 -7.793 993 HZ2 LYS 115 1HZ LYS 115 1.896 17.512 -7.543 994 HZ3 LYS 115 2HZ LYS 115 2.526 17.337 -9.105 995 H SER 116 H SER 116 -1.053 11.474 -5.856 996 HA SER 116 HA SER 116 -2.778 12.190 -3.641 997 HB2 SER 116 2HB SER 116 -3.338 10.215 -4.959 998 HB3 SER 116 3HB SER 116 -1.771 9.491 -4.595 999 HG SER 116 HG SER 116 -4.029 9.351 -3.189 1000 H LEU 117 H LEU 117 0.298 10.419 -3.972 1001 HA LEU 117 HA LEU 117 0.820 9.980 -1.275 1002 HB2 LEU 117 2HB LEU 117 2.017 8.905 -3.156 1003 HB3 LEU 117 3HB LEU 117 2.829 10.422 -3.493 1004 HG LEU 117 HG LEU 117 3.882 10.305 -1.225 1005 HD11 LEU 117 1HD1 LEU 117 2.224 8.878 -0.139 1006 HD12 LEU 117 2HD1 LEU 117 3.843 8.193 -0.007 1007 HD13 LEU 117 3HD1 LEU 117 2.698 7.528 -1.173 1008 HD21 LEU 117 3HD2 LEU 117 5.522 8.593 -1.815 1009 HD22 LEU 117 1HD2 LEU 117 5.093 9.568 -3.220 1010 HD23 LEU 117 2HD2 LEU 117 4.425 7.946 -3.035 1011 H GLU 118 H GLU 118 1.997 12.672 -3.322 1012 HA GLU 118 HA GLU 118 3.550 13.983 -1.424 1013 HB2 GLU 118 2HB GLU 118 1.981 15.146 -3.736 1014 HB3 GLU 118 3HB GLU 118 3.193 16.031 -2.819 1015 HG2 GLU 118 2HG GLU 118 4.892 14.386 -3.510 1016 HG3 GLU 118 3HG GLU 118 3.673 13.548 -4.468 1017 H ARG 119 H ARG 119 0.094 13.852 -1.651 1018 HA ARG 119 HA ARG 119 -0.336 16.059 0.197 1019 HB2 ARG 119 2HB ARG 119 -2.203 14.060 -1.091 1020 HB3 ARG 119 3HB ARG 119 -2.745 15.247 0.089 1021 HG2 ARG 119 2HG ARG 119 -2.057 17.058 -1.373 1022 HG3 ARG 119 3HG ARG 119 -1.424 15.900 -2.545 1023 HD2 ARG 119 2HD ARG 119 -3.677 16.806 -3.124 1024 HD3 ARG 119 3HD ARG 119 -3.621 15.049 -2.991 1025 HE ARG 119 HE ARG 119 -4.532 15.488 -0.635 1026 HH11 ARG 119 1HH1 ARG 119 -5.223 17.536 -3.316 1027 HH12 ARG 119 2HH1 ARG 119 -6.796 17.951 -2.729 1028 HH21 ARG 119 1HH2 ARG 119 -6.547 16.012 0.100 1029 HH22 ARG 119 2HH2 ARG 119 -7.546 17.081 -0.824 1030 H LEU 120 H LEU 120 -0.948 12.536 0.230 1031 HA LEU 120 HA LEU 120 -1.874 12.302 2.837 1032 HB2 LEU 120 2HB LEU 120 -0.282 10.284 1.245 1033 HB3 LEU 120 3HB LEU 120 -1.198 9.921 2.696 1034 HG LEU 120 HG LEU 120 -2.360 10.888 0.075 1035 HD11 LEU 120 1HD1 LEU 120 -1.561 8.584 -0.028 1036 HD12 LEU 120 2HD1 LEU 120 -3.321 8.654 -0.080 1037 HD13 LEU 120 3HD1 LEU 120 -2.501 8.185 1.410 1038 HD21 LEU 120 3HD2 LEU 120 -4.541 10.443 1.125 1039 HD22 LEU 120 1HD2 LEU 120 -3.656 11.720 1.958 1040 HD23 LEU 120 2HD2 LEU 120 -3.728 10.101 2.654 1041 H ILE 121 H ILE 121 1.477 12.273 1.687 1042 HA ILE 121 HA ILE 121 2.841 11.486 3.960 1043 HB ILE 121 HB ILE 121 3.612 13.598 1.936 1044 HG12 ILE 121 2HG1 ILE 121 4.462 10.701 2.218 1045 HG13 ILE 121 3HG1 ILE 121 3.257 11.288 1.077 1046 HG21 ILE 121 1HG2 ILE 121 4.899 13.974 3.972 1047 HG22 ILE 121 2HG2 ILE 121 5.935 13.307 2.710 1048 HG23 ILE 121 3HG2 ILE 121 5.361 12.271 4.016 1049 HD11 ILE 121 3HD1 ILE 121 4.976 12.655 -0.011 1050 HD12 ILE 121 1HD1 ILE 121 5.379 10.938 -0.022 1051 HD13 ILE 121 2HD1 ILE 121 6.176 12.022 1.116 1052 H ARG 122 H ARG 122 1.595 14.737 3.216 1053 HA ARG 122 HA ARG 122 2.727 15.933 5.565 1054 HB2 ARG 122 2HB ARG 122 0.599 16.936 3.662 1055 HB3 ARG 122 3HB ARG 122 1.335 17.899 4.938 1056 HG2 ARG 122 2HG ARG 122 3.539 17.585 3.876 1057 HG3 ARG 122 3HG ARG 122 2.761 16.689 2.571 1058 HD2 ARG 122 2HD ARG 122 1.470 18.663 1.960 1059 HD3 ARG 122 3HD ARG 122 2.169 19.559 3.311 1060 HE ARG 122 HE ARG 122 4.092 18.484 1.445 1061 HH11 ARG 122 1HH1 ARG 122 2.090 21.179 2.201 1062 HH12 ARG 122 2HH1 ARG 122 3.116 22.306 1.389 1063 HH21 ARG 122 1HH2 ARG 122 5.375 19.925 0.374 1064 HH22 ARG 122 2HH2 ARG 122 4.939 21.598 0.337 1065 H GLU 123 H GLU 123 -0.265 14.299 4.869 1066 HA GLU 123 HA GLU 123 -1.675 15.279 7.177 1067 HB2 GLU 123 2HB GLU 123 -2.230 12.987 5.286 1068 HB3 GLU 123 3HB GLU 123 -3.295 13.424 6.618 1069 HG2 GLU 123 2HG GLU 123 -2.546 15.212 4.307 1070 HG3 GLU 123 3HG GLU 123 -4.068 14.339 4.489 1071 H VAL 124 H VAL 124 0.126 12.315 6.415 1072 HA VAL 124 HA VAL 124 -0.361 11.228 9.073 1073 HB VAL 124 HB VAL 124 -0.329 9.743 7.088 1074 HG11 VAL 124 1HG1 VAL 124 1.785 9.142 6.020 1075 HG12 VAL 124 2HG1 VAL 124 2.631 10.341 7.001 1076 HG13 VAL 124 3HG1 VAL 124 1.436 10.859 5.809 1077 HG21 VAL 124 3HG2 VAL 124 0.106 8.827 9.323 1078 HG22 VAL 124 1HG2 VAL 124 1.833 9.117 9.106 1079 HG23 VAL 124 2HG2 VAL 124 0.999 7.950 8.081 1080 H GLY 125 H GLY 125 2.142 12.991 7.415 1081 HA2 GLY 125 2HA GLY 125 4.290 12.324 9.189 1082 HA3 GLY 125 3HA GLY 125 4.273 13.629 8.021 1083 H SER 126 H SER 126 3.700 12.730 11.322 1084 HA SER 126 HA SER 126 3.288 15.571 12.035 1085 HB2 SER 126 2HB SER 126 2.092 14.766 14.055 1086 HB3 SER 126 3HB SER 126 1.309 14.237 12.567 1087 HG SER 126 HG SER 126 1.579 12.600 14.254 1088 H LEU 127 H LEU 127 5.025 16.456 12.967 1089 HA LEU 127 HA LEU 127 7.191 14.969 14.048 1090 HB2 LEU 127 2HB LEU 127 8.209 17.042 14.571 1091 HB3 LEU 127 3HB LEU 127 7.344 17.278 13.066 1092 HG LEU 127 HG LEU 127 6.367 18.192 15.786 1093 HD11 LEU 127 1HD1 LEU 127 8.345 19.430 15.092 1094 HD12 LEU 127 2HD1 LEU 127 6.908 20.448 15.021 1095 HD13 LEU 127 3HD1 LEU 127 7.594 19.786 13.536 1096 HD21 LEU 127 3HD2 LEU 127 5.280 18.757 13.022 1097 HD22 LEU 127 1HD2 LEU 127 4.702 19.475 14.526 1098 HD23 LEU 127 2HD2 LEU 127 4.524 17.743 14.251 1099 H GLU 128 H GLU 128 4.226 15.975 15.415 1100 HA GLU 128 HA GLU 128 4.988 16.292 18.127 1101 HB2 GLU 128 2HB GLU 128 2.312 15.595 16.894 1102 HB3 GLU 128 3HB GLU 128 2.544 16.009 18.588 1103 HG2 GLU 128 2HG GLU 128 3.229 17.831 16.286 1104 HG3 GLU 128 3HG GLU 128 1.709 17.879 17.176 1105 H HIS 129 H HIS 129 6.159 14.630 19.005 1106 HA HIS 129 HA HIS 129 4.727 12.087 19.366 1107 HB2 HIS 129 2HB HIS 129 7.652 12.365 18.641 1108 HB3 HIS 129 3HB HIS 129 6.896 10.863 19.170 1109 HD1 HIS 129 HD1 HIS 129 4.687 10.226 17.579 1110 HD2 HIS 129 HD2 HIS 129 7.664 12.612 15.936 1111 HE1 HIS 129 HE1 HIS 129 4.371 10.075 15.098 1112 HE2 HIS 129 HE2 HIS 129 5.998 11.742 14.158 1113 H HIS 130 H HIS 130 5.483 10.834 21.240 1114 HA HIS 130 HA HIS 130 5.790 12.678 23.469 1115 HB2 HIS 130 2HB HIS 130 5.223 9.702 23.487 1116 HB3 HIS 130 3HB HIS 130 5.132 10.783 24.875 1117 HD1 HIS 130 HD1 HIS 130 3.255 12.743 24.635 1118 HD2 HIS 130 HD2 HIS 130 2.892 9.469 22.097 1119 HE1 HIS 130 HE1 HIS 130 0.891 12.801 23.795 1120 HE2 HIS 130 HE2 HIS 130 0.653 10.735 22.382 1121 H HIS 131 H HIS 131 7.650 13.076 24.421 1122 HA HIS 131 HA HIS 131 9.895 11.201 24.155 1123 HB2 HIS 131 2HB HIS 131 9.799 14.065 25.143 1124 HB3 HIS 131 3HB HIS 131 11.260 13.085 25.050 1125 HD1 HIS 131 HD1 HIS 131 12.535 13.258 22.922 1126 HD2 HIS 131 HD2 HIS 131 8.580 14.451 22.461 1127 HE1 HIS 131 HE1 HIS 131 12.362 14.124 20.575 1128 HE2 HIS 131 HE2 HIS 131 9.944 14.751 20.287 1129 H HIS 132 H HIS 132 7.846 12.740 26.582 1130 HA HIS 132 HA HIS 132 9.264 11.633 28.828 1131 HB2 HIS 132 2HB HIS 132 7.970 13.725 29.022 1132 HB3 HIS 132 3HB HIS 132 6.486 12.845 28.673 1133 HD1 HIS 132 HD1 HIS 132 9.203 12.982 31.318 1134 HD2 HIS 132 HD2 HIS 132 5.236 11.837 30.888 1135 HE1 HIS 132 HE1 HIS 132 8.418 12.409 33.626 1136 HE2 HIS 132 HE2 HIS 132 5.965 11.944 33.367 1137 H HIS 133 H HIS 133 9.308 9.398 28.046 1138 HA HIS 133 HA HIS 133 6.751 7.958 28.324 1139 HB2 HIS 133 2HB HIS 133 8.214 7.717 26.234 1140 HB3 HIS 133 3HB HIS 133 9.335 6.816 27.247 1141 HD1 HIS 133 HD1 HIS 133 5.948 6.616 25.678 1142 HD2 HIS 133 HD2 HIS 133 8.513 4.205 27.886 1143 HE1 HIS 133 HE1 HIS 133 4.982 4.303 25.538 1144 HE2 HIS 133 HE2 HIS 133 6.661 2.840 26.699 1145 H HIS 134 H HIS 134 9.229 8.832 30.263 1146 HA HIS 134 HA HIS 134 9.675 6.292 31.599 1147 HB2 HIS 134 2HB HIS 134 11.513 7.929 31.374 1148 HB3 HIS 134 3HB HIS 134 10.609 9.070 32.366 1149 HD1 HIS 134 HD1 HIS 134 10.434 8.548 34.911 1150 HD2 HIS 134 HD2 HIS 134 12.802 5.882 32.777 1151 HE1 HIS 134 HE1 HIS 134 11.708 7.248 36.638 1152 HE2 HIS 134 HE2 HIS 134 13.224 5.737 35.323 Start of MODEL 18 1 H1 MET 1 1H MET 1 2.796 8.906 12.709 2 H2 MET 1 2H MET 1 3.451 7.377 13.033 3 H3 MET 1 3H MET 1 1.906 7.507 12.366 4 HA MET 1 HA MET 1 2.771 8.398 10.332 5 HB2 MET 1 2HB MET 1 5.459 8.120 11.701 6 HB3 MET 1 3HB MET 1 5.252 8.445 9.986 7 HG2 MET 1 2HG MET 1 4.124 10.549 10.521 8 HG3 MET 1 3HG MET 1 4.339 10.220 12.241 9 HE1 MET 1 3HE MET 1 6.891 13.129 11.650 10 HE2 MET 1 1HE MET 1 5.530 12.562 12.616 11 HE3 MET 1 2HE MET 1 5.301 12.944 10.910 12 H ASN 2 H ASN 2 2.068 6.630 9.236 13 HA ASN 2 HA ASN 2 3.952 4.642 8.510 14 HB2 ASN 2 2HB ASN 2 3.310 3.668 10.690 15 HB3 ASN 2 3HB ASN 2 1.622 3.648 10.183 16 HD21 ASN 2 1HD2 ASN 2 1.581 1.386 10.473 17 HD22 ASN 2 2HD2 ASN 2 2.310 0.321 9.331 18 H ILE 3 H ILE 3 3.337 3.537 6.628 19 HA ILE 3 HA ILE 3 0.638 3.873 5.593 20 HB ILE 3 HB ILE 3 1.592 5.968 4.909 21 HG12 ILE 3 2HG1 ILE 3 1.570 4.084 2.532 22 HG13 ILE 3 3HG1 ILE 3 0.140 4.781 3.282 23 HG21 ILE 3 1HG2 ILE 3 3.847 4.394 3.659 24 HG22 ILE 3 2HG2 ILE 3 3.956 5.412 5.096 25 HG23 ILE 3 3HG2 ILE 3 3.607 6.138 3.527 26 HD11 ILE 3 3HD1 ILE 3 2.335 6.317 1.906 27 HD12 ILE 3 1HD1 ILE 3 0.901 7.016 2.659 28 HD13 ILE 3 2HD1 ILE 3 0.735 5.964 1.252 29 H VAL 4 H VAL 4 0.026 2.180 4.426 30 HA VAL 4 HA VAL 4 2.070 0.327 3.366 31 HB VAL 4 HB VAL 4 -0.756 -0.340 4.243 32 HG11 VAL 4 1HG1 VAL 4 0.053 -1.822 2.490 33 HG12 VAL 4 2HG1 VAL 4 -0.030 -2.680 4.028 34 HG13 VAL 4 3HG1 VAL 4 1.528 -2.135 3.407 35 HG21 VAL 4 3HG2 VAL 4 0.283 -1.472 6.162 36 HG22 VAL 4 1HG2 VAL 4 0.612 0.262 6.173 37 HG23 VAL 4 2HG2 VAL 4 1.861 -0.872 5.660 38 H ILE 5 H ILE 5 2.131 0.175 1.187 39 HA ILE 5 HA ILE 5 -0.214 1.090 -0.356 40 HB ILE 5 HB ILE 5 2.651 0.755 -1.281 41 HG12 ILE 5 2HG1 ILE 5 1.054 3.253 -0.617 42 HG13 ILE 5 3HG1 ILE 5 2.403 2.607 0.314 43 HG21 ILE 5 1HG2 ILE 5 0.274 1.967 -2.710 44 HG22 ILE 5 2HG2 ILE 5 1.027 0.418 -3.091 45 HG23 ILE 5 3HG2 ILE 5 1.930 1.916 -3.314 46 HD11 ILE 5 3HD1 ILE 5 3.097 4.502 -1.018 47 HD12 ILE 5 1HD1 ILE 5 2.548 3.698 -2.488 48 HD13 ILE 5 2HD1 ILE 5 3.899 3.032 -1.571 49 H VAL 6 H VAL 6 -1.510 -0.513 -0.962 50 HA VAL 6 HA VAL 6 -0.504 -3.177 -1.577 51 HB VAL 6 HB VAL 6 -3.343 -2.116 -1.655 52 HG11 VAL 6 1HG1 VAL 6 -3.999 -4.489 -1.610 53 HG12 VAL 6 2HG1 VAL 6 -2.300 -4.953 -1.719 54 HG13 VAL 6 3HG1 VAL 6 -3.066 -4.091 -3.054 55 HG21 VAL 6 3HG2 VAL 6 -2.410 -1.981 0.595 56 HG22 VAL 6 1HG2 VAL 6 -1.914 -3.671 0.509 57 HG23 VAL 6 2HG2 VAL 6 -3.628 -3.254 0.505 58 H VAL 7 H VAL 7 0.225 -3.609 -3.575 59 HA VAL 7 HA VAL 7 -0.928 -2.127 -5.871 60 HB VAL 7 HB VAL 7 1.834 -3.361 -5.652 61 HG11 VAL 7 1HG1 VAL 7 0.606 -1.653 -7.825 62 HG12 VAL 7 2HG1 VAL 7 1.021 -3.363 -7.948 63 HG13 VAL 7 3HG1 VAL 7 2.294 -2.158 -7.755 64 HG21 VAL 7 3HG2 VAL 7 1.000 -0.456 -5.571 65 HG22 VAL 7 1HG2 VAL 7 2.659 -1.058 -5.566 66 HG23 VAL 7 2HG2 VAL 7 1.592 -1.405 -4.205 67 H PHE 8 H PHE 8 -2.188 -3.331 -7.175 68 HA PHE 8 HA PHE 8 -2.070 -6.218 -7.154 69 HB2 PHE 8 2HB PHE 8 -3.750 -4.247 -8.711 70 HB3 PHE 8 3HB PHE 8 -3.854 -5.986 -8.962 71 HD1 PHE 8 HD2 PHE 8 -4.139 -3.395 -6.294 72 HD2 PHE 8 HD1 PHE 8 -5.297 -7.264 -7.656 73 HE1 PHE 8 HE2 PHE 8 -5.745 -3.567 -4.442 74 HE2 PHE 8 HE1 PHE 8 -6.907 -7.440 -5.802 75 HZ PHE 8 HZ PHE 8 -7.132 -5.587 -4.191 76 H SER 9 H SER 9 -0.500 -3.784 -8.924 77 HA SER 9 HA SER 9 -0.054 -5.250 -11.351 78 HB2 SER 9 2HB SER 9 0.125 -2.810 -11.366 79 HB3 SER 9 3HB SER 9 1.450 -2.878 -10.206 80 HG SER 9 HG SER 9 1.426 -3.766 -12.899 81 H THR 10 H THR 10 0.850 -7.211 -11.051 82 HA THR 10 HA THR 10 3.065 -7.632 -9.226 83 HB THR 10 HB THR 10 2.968 -9.994 -10.004 84 HG1 THR 10 HG1 THR 10 1.098 -8.874 -11.823 85 HG21 THR 10 3HG2 THR 10 0.796 -10.526 -9.043 86 HG22 THR 10 1HG2 THR 10 0.257 -8.862 -9.279 87 HG23 THR 10 2HG2 THR 10 1.550 -9.216 -8.133 88 H ASP 11 H ASP 11 3.715 -5.788 -11.287 89 HA ASP 11 HA ASP 11 5.801 -7.289 -12.739 90 HB2 ASP 11 2HB ASP 11 4.157 -4.934 -13.681 91 HB3 ASP 11 3HB ASP 11 5.626 -5.467 -14.493 92 H GLU 12 H GLU 12 7.827 -6.687 -12.347 93 HA GLU 12 HA GLU 12 8.492 -4.930 -10.279 94 HB2 GLU 12 2HB GLU 12 9.992 -6.697 -10.765 95 HB3 GLU 12 3HB GLU 12 10.140 -6.219 -12.448 96 HG2 GLU 12 2HG GLU 12 12.168 -5.691 -11.249 97 HG3 GLU 12 3HG GLU 12 11.375 -4.209 -11.771 98 H GLU 13 H GLU 13 8.830 -4.429 -13.811 99 HA GLU 13 HA GLU 13 10.123 -1.955 -13.658 100 HB2 GLU 13 2HB GLU 13 8.274 -2.927 -15.845 101 HB3 GLU 13 3HB GLU 13 9.419 -1.598 -15.985 102 HG2 GLU 13 2HG GLU 13 11.229 -3.287 -15.413 103 HG3 GLU 13 3HG GLU 13 10.004 -4.529 -15.667 104 H THR 14 H THR 14 6.614 -2.594 -13.971 105 HA THR 14 HA THR 14 5.785 0.099 -13.896 106 HB THR 14 HB THR 14 4.304 -2.371 -12.947 107 HG1 THR 14 HG1 THR 14 4.325 -2.659 -15.059 108 HG21 THR 14 3HG2 THR 14 2.254 -1.023 -13.198 109 HG22 THR 14 1HG2 THR 14 3.237 0.404 -13.533 110 HG23 THR 14 2HG2 THR 14 3.312 -0.368 -11.948 111 H LEU 15 H LEU 15 6.057 -2.266 -11.217 112 HA LEU 15 HA LEU 15 5.391 -0.507 -9.128 113 HB2 LEU 15 2HB LEU 15 5.492 -2.950 -8.874 114 HB3 LEU 15 3HB LEU 15 7.233 -2.903 -9.077 115 HG LEU 15 HG LEU 15 7.426 -1.589 -6.983 116 HD11 LEU 15 1HD1 LEU 15 5.257 -0.509 -6.970 117 HD12 LEU 15 2HD1 LEU 15 5.486 -1.427 -5.483 118 HD13 LEU 15 3HD1 LEU 15 4.453 -2.065 -6.763 119 HD21 LEU 15 3HD2 LEU 15 7.706 -3.996 -6.897 120 HD22 LEU 15 1HD2 LEU 15 5.963 -4.218 -6.727 121 HD23 LEU 15 2HD2 LEU 15 6.882 -3.432 -5.444 122 H ARG 16 H ARG 16 8.381 -1.036 -10.826 123 HA ARG 16 HA ARG 16 10.186 0.213 -9.066 124 HB2 ARG 16 2HB ARG 16 10.741 -1.286 -11.009 125 HB3 ARG 16 3HB ARG 16 10.370 0.054 -12.085 126 HG2 ARG 16 2HG ARG 16 12.191 1.354 -11.115 127 HG3 ARG 16 3HG ARG 16 12.540 0.037 -9.990 128 HD2 ARG 16 2HD ARG 16 12.938 -1.447 -11.961 129 HD3 ARG 16 3HD ARG 16 12.757 -0.036 -13.003 130 HE ARG 16 HE ARG 16 14.741 0.355 -10.987 131 HH11 ARG 16 1HH1 ARG 16 14.161 -1.094 -14.062 132 HH12 ARG 16 2HH1 ARG 16 15.831 -1.060 -14.505 133 HH21 ARG 16 1HH2 ARG 16 16.872 0.380 -11.569 134 HH22 ARG 16 2HH2 ARG 16 17.345 -0.220 -13.121 135 H LYS 17 H LYS 17 8.170 1.470 -11.687 136 HA LYS 17 HA LYS 17 9.161 4.105 -11.724 137 HB2 LYS 17 2HB LYS 17 6.347 3.149 -12.330 138 HB3 LYS 17 3HB LYS 17 7.022 4.704 -12.797 139 HG2 LYS 17 2HG LYS 17 8.028 2.018 -13.737 140 HG3 LYS 17 3HG LYS 17 6.980 3.096 -14.656 141 HD2 LYS 17 2HD LYS 17 9.664 4.004 -13.638 142 HD3 LYS 17 3HD LYS 17 9.512 3.124 -15.155 143 HE2 LYS 17 2HE LYS 17 9.568 5.504 -15.587 144 HE3 LYS 17 3HE LYS 17 7.977 4.866 -15.991 145 HZ1 LYS 17 3HZ LYS 17 7.961 7.010 -14.775 146 HZ2 LYS 17 1HZ LYS 17 8.607 6.226 -13.426 147 HZ3 LYS 17 2HZ LYS 17 7.076 5.793 -14.009 148 H PHE 18 H PHE 18 6.704 2.560 -9.697 149 HA PHE 18 HA PHE 18 5.916 4.940 -8.317 150 HB2 PHE 18 2HB PHE 18 5.709 2.052 -7.415 151 HB3 PHE 18 3HB PHE 18 4.866 3.416 -6.690 152 HD1 PHE 18 HD2 PHE 18 3.742 4.903 -8.839 153 HD2 PHE 18 HD1 PHE 18 4.220 0.680 -8.521 154 HE1 PHE 18 HE2 PHE 18 1.872 4.571 -10.401 155 HE2 PHE 18 HE1 PHE 18 2.351 0.352 -10.086 156 HZ PHE 18 HZ PHE 18 1.175 2.298 -11.027 157 H LYS 19 H LYS 19 8.160 2.290 -7.537 158 HA LYS 19 HA LYS 19 9.028 3.257 -5.046 159 HB2 LYS 19 2HB LYS 19 10.449 1.487 -7.056 160 HB3 LYS 19 3HB LYS 19 11.030 1.783 -5.420 161 HG2 LYS 19 2HG LYS 19 8.941 0.821 -4.526 162 HG3 LYS 19 3HG LYS 19 8.414 0.472 -6.170 163 HD2 LYS 19 2HD LYS 19 10.941 -0.624 -4.923 164 HD3 LYS 19 3HD LYS 19 9.403 -1.485 -4.961 165 HE2 LYS 19 2HE LYS 19 9.441 -1.368 -7.436 166 HE3 LYS 19 3HE LYS 19 11.023 -0.593 -7.351 167 HZ1 LYS 19 3HZ LYS 19 10.411 -3.293 -6.277 168 HZ2 LYS 19 1HZ LYS 19 11.927 -2.555 -6.336 169 HZ3 LYS 19 2HZ LYS 19 11.149 -2.999 -7.767 170 H ASP 20 H ASP 20 10.034 4.080 -8.313 171 HA ASP 20 HA ASP 20 12.325 5.599 -7.688 172 HB2 ASP 20 2HB ASP 20 11.852 4.980 -9.977 173 HB3 ASP 20 3HB ASP 20 10.329 5.863 -9.951 174 H ILE 21 H ILE 21 8.893 6.501 -7.864 175 HA ILE 21 HA ILE 21 9.196 9.249 -7.311 176 HB ILE 21 HB ILE 21 6.855 7.429 -6.681 177 HG12 ILE 21 2HG1 ILE 21 7.361 9.222 -9.079 178 HG13 ILE 21 3HG1 ILE 21 7.509 7.469 -9.078 179 HG21 ILE 21 1HG2 ILE 21 6.693 9.471 -5.388 180 HG22 ILE 21 2HG2 ILE 21 5.510 9.512 -6.697 181 HG23 ILE 21 3HG2 ILE 21 7.002 10.445 -6.826 182 HD11 ILE 21 3HD1 ILE 21 4.982 9.041 -8.624 183 HD12 ILE 21 1HD1 ILE 21 5.114 7.282 -8.576 184 HD13 ILE 21 2HD1 ILE 21 5.421 8.150 -10.081 185 H ILE 22 H ILE 22 8.460 6.522 -5.130 186 HA ILE 22 HA ILE 22 8.294 7.880 -2.721 187 HB ILE 22 HB ILE 22 9.420 5.110 -3.187 188 HG12 ILE 22 2HG1 ILE 22 6.604 6.015 -2.499 189 HG13 ILE 22 3HG1 ILE 22 7.134 5.425 -4.074 190 HG21 ILE 22 1HG2 ILE 22 10.046 5.904 -0.983 191 HG22 ILE 22 2HG2 ILE 22 8.791 4.675 -0.838 192 HG23 ILE 22 3HG2 ILE 22 8.381 6.380 -0.649 193 HD11 ILE 22 3HD1 ILE 22 5.944 3.705 -2.852 194 HD12 ILE 22 1HD1 ILE 22 7.083 3.838 -1.513 195 HD13 ILE 22 2HD1 ILE 22 7.631 3.244 -3.082 196 H LYS 23 H LYS 23 11.241 6.328 -4.064 197 HA LYS 23 HA LYS 23 12.976 7.234 -2.029 198 HB2 LYS 23 2HB LYS 23 14.803 6.617 -3.510 199 HB3 LYS 23 3HB LYS 23 13.549 5.388 -3.554 200 HG2 LYS 23 2HG LYS 23 12.746 6.265 -5.685 201 HG3 LYS 23 3HG LYS 23 13.973 7.530 -5.634 202 HD2 LYS 23 2HD LYS 23 14.731 5.775 -7.095 203 HD3 LYS 23 3HD LYS 23 15.724 5.764 -5.637 204 HE2 LYS 23 2HE LYS 23 14.412 3.891 -4.756 205 HE3 LYS 23 3HE LYS 23 13.400 3.914 -6.202 206 HZ1 LYS 23 3HZ LYS 23 15.340 3.377 -7.530 207 HZ2 LYS 23 1HZ LYS 23 15.113 2.209 -6.329 208 HZ3 LYS 23 2HZ LYS 23 16.323 3.379 -6.155 209 H LYS 24 H LYS 24 11.881 8.708 -4.995 210 HA LYS 24 HA LYS 24 13.738 10.868 -5.059 211 HB2 LYS 24 2HB LYS 24 12.309 9.943 -6.955 212 HB3 LYS 24 3HB LYS 24 10.972 10.845 -6.261 213 HG2 LYS 24 2HG LYS 24 12.114 12.933 -6.644 214 HG3 LYS 24 3HG LYS 24 13.559 12.084 -7.196 215 HD2 LYS 24 2HD LYS 24 10.845 12.077 -8.535 216 HD3 LYS 24 3HD LYS 24 12.299 12.897 -9.110 217 HE2 LYS 24 2HE LYS 24 13.414 10.764 -9.434 218 HE3 LYS 24 3HE LYS 24 12.034 9.903 -8.756 219 HZ1 LYS 24 3HZ LYS 24 12.159 11.389 -11.313 220 HZ2 LYS 24 1HZ LYS 24 10.705 10.867 -10.620 221 HZ3 LYS 24 2HZ LYS 24 11.877 9.736 -11.079 222 H ASN 25 H ASN 25 10.715 10.330 -3.387 223 HA ASN 25 HA ASN 25 10.342 13.067 -2.578 224 HB2 ASN 25 2HB ASN 25 9.185 10.503 -1.458 225 HB3 ASN 25 3HB ASN 25 8.671 12.122 -1.000 226 HD21 ASN 25 1HD2 ASN 25 8.924 13.157 -3.737 227 HD22 ASN 25 2HD2 ASN 25 7.580 12.507 -4.598 228 H GLY 26 H GLY 26 12.468 10.609 -1.614 229 HA2 GLY 26 2HA GLY 26 14.278 11.176 -0.109 230 HA3 GLY 26 3HA GLY 26 13.135 12.097 0.856 231 H PHE 27 H PHE 27 11.462 9.409 0.091 232 HA PHE 27 HA PHE 27 12.090 8.161 2.666 233 HB2 PHE 27 2HB PHE 27 9.777 7.723 0.758 234 HB3 PHE 27 3HB PHE 27 9.971 6.906 2.305 235 HD1 PHE 27 HD2 PHE 27 9.315 10.150 0.684 236 HD2 PHE 27 HD1 PHE 27 9.452 8.001 4.363 237 HE1 PHE 27 HE2 PHE 27 8.152 12.003 1.805 238 HE2 PHE 27 HE1 PHE 27 8.289 9.856 5.492 239 HZ PHE 27 HZ PHE 27 7.637 11.859 4.213 240 H LYS 28 H LYS 28 12.244 5.815 2.845 241 HA LYS 28 HA LYS 28 13.543 4.585 0.514 242 HB2 LYS 28 2HB LYS 28 13.420 3.594 3.376 243 HB3 LYS 28 3HB LYS 28 14.409 2.926 2.082 244 HG2 LYS 28 2HG LYS 28 15.664 5.032 1.955 245 HG3 LYS 28 3HG LYS 28 14.680 5.689 3.264 246 HD2 LYS 28 2HD LYS 28 15.502 3.868 4.739 247 HD3 LYS 28 3HD LYS 28 16.543 3.311 3.425 248 HE2 LYS 28 2HE LYS 28 16.663 6.012 4.779 249 HE3 LYS 28 3HE LYS 28 17.798 4.682 5.007 250 HZ1 LYS 28 3HZ LYS 28 17.330 6.142 2.463 251 HZ2 LYS 28 1HZ LYS 28 18.414 4.862 2.673 252 HZ3 LYS 28 2HZ LYS 28 18.664 6.332 3.475 253 H VAL 29 H VAL 29 13.062 2.138 0.259 254 HA VAL 29 HA VAL 29 10.126 1.777 0.433 255 HB VAL 29 HB VAL 29 11.941 0.730 -1.755 256 HG11 VAL 29 1HG1 VAL 29 9.982 -0.677 -1.381 257 HG12 VAL 29 2HG1 VAL 29 9.849 0.177 -2.916 258 HG13 VAL 29 3HG1 VAL 29 8.925 0.727 -1.519 259 HG21 VAL 29 3HG2 VAL 29 11.753 3.180 -1.851 260 HG22 VAL 29 1HG2 VAL 29 9.995 3.045 -1.852 261 HG23 VAL 29 2HG2 VAL 29 10.929 2.412 -3.209 262 H ARG 30 H ARG 30 9.313 -0.178 1.079 263 HA ARG 30 HA ARG 30 11.136 -2.472 1.380 264 HB2 ARG 30 2HB ARG 30 10.714 -1.113 3.573 265 HB3 ARG 30 3HB ARG 30 9.116 -1.839 3.527 266 HG2 ARG 30 2HG ARG 30 10.185 -4.080 3.517 267 HG3 ARG 30 3HG ARG 30 11.752 -3.293 3.698 268 HD2 ARG 30 2HD ARG 30 10.726 -2.171 5.773 269 HD3 ARG 30 3HD ARG 30 9.460 -3.388 5.645 270 HE ARG 30 HE ARG 30 12.131 -3.758 6.597 271 HH11 ARG 30 1HH1 ARG 30 9.525 -5.408 5.045 272 HH12 ARG 30 2HH1 ARG 30 9.994 -6.945 5.674 273 HH21 ARG 30 1HH2 ARG 30 12.686 -5.716 7.426 274 HH22 ARG 30 2HH2 ARG 30 11.749 -7.116 7.035 275 H THR 31 H THR 31 10.199 -3.730 -0.220 276 HA THR 31 HA THR 31 7.297 -3.774 -0.487 277 HB THR 31 HB THR 31 7.774 -5.247 -2.499 278 HG1 THR 31 HG1 THR 31 10.046 -5.663 -1.585 279 HG21 THR 31 3HG2 THR 31 8.513 -3.371 -3.889 280 HG22 THR 31 1HG2 THR 31 9.034 -2.498 -2.449 281 HG23 THR 31 2HG2 THR 31 7.322 -2.845 -2.699 282 H VAL 32 H VAL 32 5.976 -5.520 -0.294 283 HA VAL 32 HA VAL 32 7.078 -7.915 1.045 284 HB VAL 32 HB VAL 32 4.364 -6.599 1.361 285 HG11 VAL 32 1HG1 VAL 32 4.125 -9.035 1.412 286 HG12 VAL 32 2HG1 VAL 32 3.857 -8.335 3.009 287 HG13 VAL 32 3HG1 VAL 32 5.383 -9.138 2.644 288 HG21 VAL 32 3HG2 VAL 32 6.125 -5.449 2.574 289 HG22 VAL 32 1HG2 VAL 32 6.651 -6.967 3.302 290 HG23 VAL 32 2HG2 VAL 32 5.071 -6.296 3.708 291 H ARG 33 H ARG 33 6.694 -9.866 0.112 292 HA ARG 33 HA ARG 33 4.691 -10.007 -2.065 293 HB2 ARG 33 2HB ARG 33 6.119 -11.635 -3.189 294 HB3 ARG 33 3HB ARG 33 6.983 -10.126 -2.924 295 HG2 ARG 33 2HG ARG 33 8.150 -11.113 -1.018 296 HG3 ARG 33 3HG ARG 33 7.262 -12.622 -1.245 297 HD2 ARG 33 2HD ARG 33 9.181 -11.364 -3.214 298 HD3 ARG 33 3HD ARG 33 9.504 -12.772 -2.203 299 HE ARG 33 HE ARG 33 7.380 -13.623 -3.532 300 HH11 ARG 33 1HH1 ARG 33 10.156 -11.940 -4.713 301 HH12 ARG 33 2HH1 ARG 33 10.057 -12.673 -6.278 302 HH21 ARG 33 1HH2 ARG 33 7.265 -14.542 -5.525 303 HH22 ARG 33 2HH2 ARG 33 8.433 -14.140 -6.736 304 H SER 34 H SER 34 5.456 -11.198 0.986 305 HA SER 34 HA SER 34 3.503 -13.335 0.793 306 HB2 SER 34 2HB SER 34 6.402 -13.948 1.458 307 HB3 SER 34 3HB SER 34 5.066 -15.074 1.691 308 HG SER 34 HG SER 34 4.864 -14.258 -0.787 309 HA PRO 35 HA PRO 35 2.481 -12.372 4.966 310 HB2 PRO 35 2HB PRO 35 2.645 -14.862 6.247 311 HB3 PRO 35 3HB PRO 35 1.237 -14.210 5.407 312 HG2 PRO 35 2HG PRO 35 3.303 -16.134 4.437 313 HG3 PRO 35 3HG PRO 35 1.561 -16.096 4.110 314 HD2 PRO 35 2HD PRO 35 3.334 -15.283 2.276 315 HD3 PRO 35 3HD PRO 35 1.777 -14.452 2.478 316 H GLN 36 H GLN 36 5.199 -14.720 4.973 317 HA GLN 36 HA GLN 36 6.296 -13.954 7.436 318 HB2 GLN 36 2HB GLN 36 8.317 -15.108 6.781 319 HB3 GLN 36 3HB GLN 36 6.927 -16.033 6.238 320 HG2 GLN 36 2HG GLN 36 8.243 -14.134 4.343 321 HG3 GLN 36 3HG GLN 36 9.012 -15.679 4.690 322 HE21 GLN 36 1HE2 GLN 36 8.734 -16.338 2.553 323 HE22 GLN 36 2HE2 GLN 36 7.195 -16.829 1.943 324 H GLU 37 H GLU 37 6.550 -12.457 4.307 325 HA GLU 37 HA GLU 37 8.806 -10.790 4.875 326 HB2 GLU 37 2HB GLU 37 6.593 -10.413 2.841 327 HB3 GLU 37 3HB GLU 37 8.142 -9.581 2.843 328 HG2 GLU 37 2HG GLU 37 7.759 -12.555 2.503 329 HG3 GLU 37 3HG GLU 37 8.025 -11.403 1.196 330 H LEU 38 H LEU 38 5.284 -10.317 4.951 331 HA LEU 38 HA LEU 38 5.340 -7.604 5.789 332 HB2 LEU 38 2HB LEU 38 3.390 -8.708 4.725 333 HB3 LEU 38 3HB LEU 38 3.167 -9.675 6.170 334 HG LEU 38 HG LEU 38 2.661 -7.645 7.467 335 HD11 LEU 38 1HD1 LEU 38 4.012 -6.037 6.244 336 HD12 LEU 38 2HD1 LEU 38 2.335 -5.501 6.314 337 HD13 LEU 38 3HD1 LEU 38 2.972 -6.206 4.829 338 HD21 LEU 38 3HD2 LEU 38 1.013 -7.888 4.944 339 HD22 LEU 38 1HD2 LEU 38 0.491 -7.147 6.458 340 HD23 LEU 38 2HD2 LEU 38 0.834 -8.876 6.394 341 H LYS 39 H LYS 39 4.955 -10.654 7.569 342 HA LYS 39 HA LYS 39 4.654 -9.659 10.153 343 HB2 LYS 39 2HB LYS 39 4.326 -12.015 9.557 344 HB3 LYS 39 3HB LYS 39 6.045 -12.192 9.237 345 HG2 LYS 39 2HG LYS 39 6.547 -11.805 11.587 346 HG3 LYS 39 3HG LYS 39 4.834 -11.553 11.925 347 HD2 LYS 39 2HD LYS 39 5.527 -13.814 12.561 348 HD3 LYS 39 3HD LYS 39 4.356 -13.863 11.243 349 HE2 LYS 39 2HE LYS 39 6.165 -14.203 9.633 350 HE3 LYS 39 3HE LYS 39 7.354 -14.105 10.931 351 HZ1 LYS 39 3HZ LYS 39 6.384 -16.086 11.917 352 HZ2 LYS 39 1HZ LYS 39 6.880 -16.396 10.330 353 HZ3 LYS 39 2HZ LYS 39 5.240 -16.177 10.677 354 H ASP 40 H ASP 40 7.584 -10.154 8.257 355 HA ASP 40 HA ASP 40 9.434 -9.722 10.367 356 HB2 ASP 40 2HB ASP 40 9.984 -10.888 8.245 357 HB3 ASP 40 3HB ASP 40 9.847 -9.354 7.389 358 H SER 41 H SER 41 7.913 -7.530 8.020 359 HA SER 41 HA SER 41 9.502 -5.256 8.502 360 HB2 SER 41 2HB SER 41 7.800 -3.960 7.434 361 HB3 SER 41 3HB SER 41 7.789 -5.531 6.638 362 HG SER 41 HG SER 41 5.912 -6.036 7.633 363 H ILE 42 H ILE 42 6.636 -6.466 10.159 364 HA ILE 42 HA ILE 42 6.120 -4.331 11.881 365 HB ILE 42 HB ILE 42 5.791 -7.283 12.478 366 HG12 ILE 42 2HG1 ILE 42 3.837 -5.309 11.248 367 HG13 ILE 42 3HG1 ILE 42 4.680 -6.584 10.373 368 HG21 ILE 42 1HG2 ILE 42 4.450 -4.863 13.703 369 HG22 ILE 42 2HG2 ILE 42 5.614 -5.924 14.495 370 HG23 ILE 42 3HG2 ILE 42 4.027 -6.541 14.040 371 HD11 ILE 42 3HD1 ILE 42 2.386 -7.204 10.867 372 HD12 ILE 42 1HD1 ILE 42 2.685 -6.986 12.590 373 HD13 ILE 42 2HD1 ILE 42 3.518 -8.264 11.706 374 H GLU 43 H GLU 43 8.456 -6.973 12.175 375 HA GLU 43 HA GLU 43 9.258 -6.645 14.823 376 HB2 GLU 43 2HB GLU 43 10.845 -7.511 12.399 377 HB3 GLU 43 3HB GLU 43 11.462 -7.606 14.041 378 HG2 GLU 43 2HG GLU 43 8.981 -9.012 13.059 379 HG3 GLU 43 3HG GLU 43 10.577 -9.752 13.190 380 H GLU 44 H GLU 44 10.126 -4.775 11.977 381 HA GLU 44 HA GLU 44 12.149 -3.216 13.331 382 HB2 GLU 44 2HB GLU 44 10.755 -2.807 10.672 383 HB3 GLU 44 3HB GLU 44 12.098 -1.832 11.251 384 HG2 GLU 44 2HG GLU 44 12.222 -4.801 10.743 385 HG3 GLU 44 3HG GLU 44 12.761 -3.562 9.612 386 H LEU 45 H LEU 45 8.830 -2.663 12.200 387 HA LEU 45 HA LEU 45 8.662 0.065 12.851 388 HB2 LEU 45 2HB LEU 45 6.440 -1.972 12.632 389 HB3 LEU 45 3HB LEU 45 6.224 -0.230 12.608 390 HG LEU 45 HG LEU 45 7.726 -1.844 10.534 391 HD11 LEU 45 1HD1 LEU 45 5.873 -1.274 9.044 392 HD12 LEU 45 2HD1 LEU 45 5.035 -0.486 10.382 393 HD13 LEU 45 3HD1 LEU 45 5.324 -2.226 10.422 394 HD21 LEU 45 3HD2 LEU 45 7.821 0.253 9.271 395 HD22 LEU 45 1HD2 LEU 45 8.666 0.394 10.811 396 HD23 LEU 45 2HD2 LEU 45 7.064 1.104 10.616 397 H VAL 46 H VAL 46 7.805 -2.802 14.756 398 HA VAL 46 HA VAL 46 6.501 -1.436 16.864 399 HB VAL 46 HB VAL 46 6.254 -3.863 16.455 400 HG11 VAL 46 1HG1 VAL 46 7.972 -5.430 17.204 401 HG12 VAL 46 2HG1 VAL 46 9.044 -4.084 17.591 402 HG13 VAL 46 3HG1 VAL 46 8.578 -4.387 15.917 403 HG21 VAL 46 3HG2 VAL 46 6.281 -4.583 18.815 404 HG22 VAL 46 1HG2 VAL 46 5.593 -2.971 18.619 405 HG23 VAL 46 2HG2 VAL 46 7.237 -3.160 19.228 406 H LYS 47 H LYS 47 9.888 -1.998 16.200 407 HA LYS 47 HA LYS 47 10.683 -1.204 18.902 408 HB2 LYS 47 2HB LYS 47 12.421 -1.937 16.534 409 HB3 LYS 47 3HB LYS 47 12.962 -1.725 18.192 410 HG2 LYS 47 2HG LYS 47 11.084 -3.866 17.204 411 HG3 LYS 47 3HG LYS 47 12.788 -4.080 17.599 412 HD2 LYS 47 2HD LYS 47 10.647 -3.218 19.554 413 HD3 LYS 47 3HD LYS 47 11.271 -4.860 19.396 414 HE2 LYS 47 2HE LYS 47 13.516 -4.050 19.988 415 HE3 LYS 47 3HE LYS 47 12.873 -2.417 20.172 416 HZ1 LYS 47 3HZ LYS 47 12.062 -4.782 21.771 417 HZ2 LYS 47 1HZ LYS 47 11.453 -3.215 21.952 418 HZ3 LYS 47 2HZ LYS 47 13.073 -3.536 22.301 419 H LYS 48 H LYS 48 11.840 -0.225 15.663 420 HA LYS 48 HA LYS 48 11.556 2.592 16.422 421 HB2 LYS 48 2HB LYS 48 14.147 1.329 15.506 422 HB3 LYS 48 3HB LYS 48 13.859 3.063 15.495 423 HG2 LYS 48 2HG LYS 48 13.533 3.020 17.925 424 HG3 LYS 48 3HG LYS 48 13.841 1.282 17.933 425 HD2 LYS 48 2HD LYS 48 15.792 3.406 17.019 426 HD3 LYS 48 3HD LYS 48 15.829 2.591 18.583 427 HE2 LYS 48 2HE LYS 48 16.197 0.446 17.473 428 HE3 LYS 48 3HE LYS 48 16.104 1.231 15.897 429 HZ1 LYS 48 3HZ LYS 48 18.130 1.886 17.960 430 HZ2 LYS 48 1HZ LYS 48 18.082 2.453 16.368 431 HZ3 LYS 48 2HZ LYS 48 18.397 0.818 16.681 432 H TYR 49 H TYR 49 10.129 3.195 14.902 433 HA TYR 49 HA TYR 49 10.115 2.198 12.237 434 HB2 TYR 49 2HB TYR 49 8.375 3.828 11.789 435 HB3 TYR 49 3HB TYR 49 8.081 3.072 13.349 436 HD1 TYR 49 HD2 TYR 49 8.954 4.391 15.436 437 HD2 TYR 49 HD1 TYR 49 8.317 6.153 11.611 438 HE1 TYR 49 HE2 TYR 49 8.808 6.604 16.484 439 HE2 TYR 49 HE1 TYR 49 8.171 8.374 12.655 440 HH TYR 49 HH TYR 49 9.272 9.108 15.573 441 H ASN 50 H ASN 50 10.395 3.510 10.280 442 HA ASN 50 HA ASN 50 12.427 5.618 10.479 443 HB2 ASN 50 2HB ASN 50 13.601 3.413 10.331 444 HB3 ASN 50 3HB ASN 50 12.777 3.107 8.808 445 HD21 ASN 50 1HD2 ASN 50 14.643 2.994 7.619 446 HD22 ASN 50 2HD2 ASN 50 15.652 4.359 7.311 447 H ALA 51 H ALA 51 12.743 6.772 8.392 448 HA ALA 51 HA ALA 51 10.340 7.217 6.956 449 HB1 ALA 51 3HB ALA 51 12.033 8.950 7.165 450 HB2 ALA 51 1HB ALA 51 11.707 8.615 5.465 451 HB3 ALA 51 2HB ALA 51 13.168 7.981 6.223 452 H THR 52 H THR 52 9.843 4.966 6.422 453 HA THR 52 HA THR 52 10.873 4.201 3.792 454 HB THR 52 HB THR 52 10.883 2.279 6.146 455 HG1 THR 52 HG1 THR 52 12.762 3.961 5.265 456 HG21 THR 52 3HG2 THR 52 11.627 1.822 3.249 457 HG22 THR 52 1HG2 THR 52 10.227 1.147 4.082 458 HG23 THR 52 2HG2 THR 52 11.856 0.663 4.559 459 H ILE 53 H ILE 53 9.116 3.887 2.555 460 HA ILE 53 HA ILE 53 6.539 3.279 3.754 461 HB ILE 53 HB ILE 53 7.286 3.764 0.858 462 HG12 ILE 53 2HG1 ILE 53 6.001 5.567 2.935 463 HG13 ILE 53 3HG1 ILE 53 7.617 5.745 2.261 464 HG21 ILE 53 1HG2 ILE 53 4.879 4.003 0.462 465 HG22 ILE 53 2HG2 ILE 53 4.555 3.570 2.141 466 HG23 ILE 53 3HG2 ILE 53 5.275 2.386 1.048 467 HD11 ILE 53 3HD1 ILE 53 6.082 7.336 1.276 468 HD12 ILE 53 1HD1 ILE 53 5.022 6.026 0.754 469 HD13 ILE 53 2HD1 ILE 53 6.637 6.186 0.060 470 H VAL 54 H VAL 54 5.653 1.297 3.877 471 HA VAL 54 HA VAL 54 7.016 -0.941 2.596 472 HB VAL 54 HB VAL 54 6.502 -1.195 4.954 473 HG11 VAL 54 1HG1 VAL 54 4.544 0.240 5.121 474 HG12 VAL 54 2HG1 VAL 54 4.201 -1.359 5.780 475 HG13 VAL 54 3HG1 VAL 54 3.596 -0.914 4.184 476 HG21 VAL 54 3HG2 VAL 54 6.519 -3.199 3.554 477 HG22 VAL 54 1HG2 VAL 54 4.787 -3.021 3.263 478 HG23 VAL 54 2HG2 VAL 54 5.380 -3.363 4.890 479 H VAL 55 H VAL 55 6.351 -1.820 0.763 480 HA VAL 55 HA VAL 55 3.634 -1.193 -0.223 481 HB VAL 55 HB VAL 55 6.127 -1.780 -1.842 482 HG11 VAL 55 1HG1 VAL 55 4.775 -1.093 -3.783 483 HG12 VAL 55 2HG1 VAL 55 3.360 -0.956 -2.740 484 HG13 VAL 55 3HG1 VAL 55 4.120 -2.529 -2.995 485 HG21 VAL 55 3HG2 VAL 55 4.681 0.838 -1.390 486 HG22 VAL 55 1HG2 VAL 55 6.043 0.590 -2.484 487 HG23 VAL 55 2HG2 VAL 55 6.261 0.396 -0.745 488 H VAL 56 H VAL 56 2.337 -2.914 0.006 489 HA VAL 56 HA VAL 56 3.416 -5.628 -0.170 490 HB VAL 56 HB VAL 56 0.611 -4.716 0.536 491 HG11 VAL 56 1HG1 VAL 56 0.307 -7.003 1.383 492 HG12 VAL 56 2HG1 VAL 56 1.913 -7.436 0.796 493 HG13 VAL 56 3HG1 VAL 56 0.644 -6.994 -0.348 494 HG21 VAL 56 3HG2 VAL 56 1.244 -5.261 2.856 495 HG22 VAL 56 1HG2 VAL 56 2.217 -3.949 2.194 496 HG23 VAL 56 2HG2 VAL 56 2.896 -5.570 2.324 497 H VAL 57 H VAL 57 3.486 -6.575 -2.118 498 HA VAL 57 HA VAL 57 1.678 -5.739 -4.247 499 HB VAL 57 HB VAL 57 3.825 -7.874 -4.379 500 HG11 VAL 57 1HG1 VAL 57 3.756 -7.401 -6.804 501 HG12 VAL 57 2HG1 VAL 57 2.422 -6.279 -6.535 502 HG13 VAL 57 3HG1 VAL 57 2.213 -7.998 -6.195 503 HG21 VAL 57 3HG2 VAL 57 4.829 -5.760 -3.672 504 HG22 VAL 57 1HG2 VAL 57 4.059 -4.926 -5.024 505 HG23 VAL 57 2HG2 VAL 57 5.295 -6.148 -5.328 506 H VAL 58 H VAL 58 -0.050 -6.886 -4.968 507 HA VAL 58 HA VAL 58 -0.532 -9.545 -3.781 508 HB VAL 58 HB VAL 58 -2.932 -9.000 -3.598 509 HG11 VAL 58 1HG1 VAL 58 -1.518 -8.742 -1.637 510 HG12 VAL 58 2HG1 VAL 58 -2.760 -7.490 -1.653 511 HG13 VAL 58 3HG1 VAL 58 -1.104 -7.096 -2.121 512 HG21 VAL 58 3HG2 VAL 58 -3.113 -7.289 -5.314 513 HG22 VAL 58 1HG2 VAL 58 -2.069 -6.213 -4.385 514 HG23 VAL 58 2HG2 VAL 58 -3.664 -6.644 -3.767 515 H ASP 59 H ASP 59 -1.553 -11.069 -5.027 516 HA ASP 59 HA ASP 59 -1.628 -10.522 -7.909 517 HB2 ASP 59 2HB ASP 59 -1.609 -13.002 -8.120 518 HB3 ASP 59 3HB ASP 59 -0.232 -12.378 -7.218 519 H ASP 60 H ASP 60 -3.735 -11.225 -5.254 520 HA ASP 60 HA ASP 60 -6.073 -11.113 -6.972 521 HB2 ASP 60 2HB ASP 60 -5.460 -13.494 -7.014 522 HB3 ASP 60 3HB ASP 60 -5.489 -13.541 -5.255 523 H LYS 61 H LYS 61 -8.058 -10.765 -5.798 524 HA LYS 61 HA LYS 61 -7.842 -8.973 -3.689 525 HB2 LYS 61 2HB LYS 61 -10.238 -9.015 -3.508 526 HB3 LYS 61 3HB LYS 61 -9.806 -9.143 -5.207 527 HG2 LYS 61 2HG LYS 61 -10.393 -11.600 -3.585 528 HG3 LYS 61 3HG LYS 61 -11.696 -10.631 -4.267 529 HD2 LYS 61 2HD LYS 61 -10.921 -11.016 -6.497 530 HD3 LYS 61 3HD LYS 61 -9.428 -11.754 -5.912 531 HE2 LYS 61 2HE LYS 61 -11.064 -13.424 -6.710 532 HE3 LYS 61 3HE LYS 61 -10.656 -13.632 -5.009 533 HZ1 LYS 61 3HZ LYS 61 -13.128 -12.399 -6.097 534 HZ2 LYS 61 1HZ LYS 61 -12.728 -12.453 -4.454 535 HZ3 LYS 61 2HZ LYS 61 -12.999 -13.885 -5.306 536 H GLU 62 H GLU 62 -8.308 -12.481 -3.518 537 HA GLU 62 HA GLU 62 -9.101 -12.578 -0.800 538 HB2 GLU 62 2HB GLU 62 -7.763 -14.671 -2.523 539 HB3 GLU 62 3HB GLU 62 -8.412 -14.981 -0.916 540 HG2 GLU 62 2HG GLU 62 -10.644 -14.307 -1.705 541 HG3 GLU 62 3HG GLU 62 -9.984 -14.058 -3.320 542 H TRP 63 H TRP 63 -5.890 -12.932 -2.313 543 HA TRP 63 HA TRP 63 -4.426 -13.162 0.095 544 HB2 TRP 63 2HB TRP 63 -3.294 -13.802 -1.880 545 HB3 TRP 63 3HB TRP 63 -3.689 -12.298 -2.700 546 HD1 TRP 63 HD1 TRP 63 -1.514 -11.046 -3.114 547 HE1 TRP 63 HE1 TRP 63 0.596 -10.474 -1.764 548 HE3 TRP 63 HE3 TRP 63 -2.578 -13.626 1.181 549 HZ2 TRP 63 HZ2 TRP 63 1.669 -11.040 0.785 550 HZ3 TRP 63 HZ3 TRP 63 -0.956 -13.549 3.027 551 HH2 TRP 63 HH2 TRP 63 1.123 -12.283 2.832 552 H ALA 64 H ALA 64 -5.352 -10.338 -1.848 553 HA ALA 64 HA ALA 64 -4.050 -8.338 -0.385 554 HB1 ALA 64 3HB ALA 64 -5.708 -6.800 -1.340 555 HB2 ALA 64 1HB ALA 64 -6.698 -8.176 -1.833 556 HB3 ALA 64 2HB ALA 64 -5.106 -7.932 -2.551 557 H GLU 65 H GLU 65 -7.318 -9.679 0.042 558 HA GLU 65 HA GLU 65 -8.063 -8.162 2.295 559 HB2 GLU 65 2HB GLU 65 -9.576 -9.556 0.816 560 HB3 GLU 65 3HB GLU 65 -8.963 -10.984 1.633 561 HG2 GLU 65 2HG GLU 65 -10.342 -8.727 3.079 562 HG3 GLU 65 3HG GLU 65 -11.207 -10.100 2.400 563 H LYS 66 H LYS 66 -6.552 -11.370 2.022 564 HA LYS 66 HA LYS 66 -6.377 -12.019 4.731 565 HB2 LYS 66 2HB LYS 66 -5.901 -13.541 2.797 566 HB3 LYS 66 3HB LYS 66 -4.367 -12.715 2.573 567 HG2 LYS 66 2HG LYS 66 -4.101 -14.840 3.756 568 HG3 LYS 66 3HG LYS 66 -3.606 -13.473 4.754 569 HD2 LYS 66 2HD LYS 66 -5.632 -13.579 6.033 570 HD3 LYS 66 3HD LYS 66 -6.336 -14.756 4.925 571 HE2 LYS 66 2HE LYS 66 -5.528 -15.755 7.049 572 HE3 LYS 66 3HE LYS 66 -4.755 -16.437 5.619 573 HZ1 LYS 66 3HZ LYS 66 -3.550 -14.308 7.295 574 HZ2 LYS 66 1HZ LYS 66 -2.804 -15.154 6.040 575 HZ3 LYS 66 2HZ LYS 66 -3.212 -15.948 7.475 576 H ALA 67 H ALA 67 -4.176 -10.106 2.713 577 HA ALA 67 HA ALA 67 -2.186 -9.637 4.672 578 HB1 ALA 67 3HB ALA 67 -1.820 -9.249 2.273 579 HB2 ALA 67 1HB ALA 67 -1.438 -7.817 3.226 580 HB3 ALA 67 2HB ALA 67 -2.950 -7.896 2.321 581 H ILE 68 H ILE 68 -4.937 -7.594 3.629 582 HA ILE 68 HA ILE 68 -4.607 -5.535 5.504 583 HB ILE 68 HB ILE 68 -7.176 -6.550 4.261 584 HG12 ILE 68 2HG1 ILE 68 -5.523 -5.838 2.598 585 HG13 ILE 68 3HG1 ILE 68 -6.860 -4.694 2.661 586 HG21 ILE 68 1HG2 ILE 68 -6.628 -3.925 5.652 587 HG22 ILE 68 2HG2 ILE 68 -7.678 -5.219 6.230 588 HG23 ILE 68 3HG2 ILE 68 -8.102 -4.327 4.769 589 HD11 ILE 68 3HD1 ILE 68 -4.735 -3.552 2.452 590 HD12 ILE 68 1HD1 ILE 68 -4.149 -4.327 3.923 591 HD13 ILE 68 2HD1 ILE 68 -5.485 -3.177 4.003 592 H ARG 69 H ARG 69 -6.237 -8.647 5.808 593 HA ARG 69 HA ARG 69 -7.407 -8.221 8.346 594 HB2 ARG 69 2HB ARG 69 -7.932 -10.082 6.706 595 HB3 ARG 69 3HB ARG 69 -6.449 -10.868 7.224 596 HG2 ARG 69 2HG ARG 69 -8.554 -10.125 9.228 597 HG3 ARG 69 3HG ARG 69 -8.714 -11.588 8.256 598 HD2 ARG 69 2HD ARG 69 -6.650 -12.463 9.132 599 HD3 ARG 69 3HD ARG 69 -6.308 -10.950 9.968 600 HE ARG 69 HE ARG 69 -8.435 -11.486 11.255 601 HH11 ARG 69 1HH1 ARG 69 -6.457 -13.956 9.907 602 HH12 ARG 69 2HH1 ARG 69 -6.782 -15.074 11.183 603 HH21 ARG 69 1HH2 ARG 69 -8.874 -12.926 12.878 604 HH22 ARG 69 2HH2 ARG 69 -8.123 -14.483 12.870 605 H PHE 70 H PHE 70 -4.240 -9.478 7.353 606 HA PHE 70 HA PHE 70 -3.243 -10.123 9.910 607 HB2 PHE 70 2HB PHE 70 -2.216 -10.753 7.683 608 HB3 PHE 70 3HB PHE 70 -1.612 -9.106 7.566 609 HD1 PHE 70 HD1 PHE 70 -1.408 -12.234 9.529 610 HD2 PHE 70 HD2 PHE 70 0.358 -8.442 8.719 611 HE1 PHE 70 HE1 PHE 70 0.596 -12.897 10.790 612 HE2 PHE 70 HE2 PHE 70 2.359 -9.103 9.985 613 HZ PHE 70 HZ PHE 70 2.481 -11.332 11.020 614 H VAL 71 H VAL 71 -3.196 -7.099 8.062 615 HA VAL 71 HA VAL 71 -1.730 -5.567 9.956 616 HB VAL 71 HB VAL 71 -3.749 -4.584 7.920 617 HG11 VAL 71 1HG1 VAL 71 -2.524 -2.455 8.053 618 HG12 VAL 71 2HG1 VAL 71 -1.512 -3.119 9.337 619 HG13 VAL 71 3HG1 VAL 71 -3.241 -2.894 9.604 620 HG21 VAL 71 3HG2 VAL 71 -1.829 -4.221 6.444 621 HG22 VAL 71 1HG2 VAL 71 -1.985 -5.925 6.875 622 HG23 VAL 71 2HG2 VAL 71 -0.755 -4.928 7.653 623 H LYS 72 H LYS 72 -5.219 -6.094 9.470 624 HA LYS 72 HA LYS 72 -6.118 -4.375 11.522 625 HB2 LYS 72 2HB LYS 72 -7.629 -5.290 9.799 626 HB3 LYS 72 3HB LYS 72 -7.429 -6.903 10.479 627 HG2 LYS 72 2HG LYS 72 -8.420 -6.099 12.597 628 HG3 LYS 72 3HG LYS 72 -8.684 -4.526 11.849 629 HD2 LYS 72 2HD LYS 72 -10.180 -5.539 10.206 630 HD3 LYS 72 3HD LYS 72 -9.880 -7.137 10.899 631 HE2 LYS 72 2HE LYS 72 -10.841 -6.386 13.032 632 HE3 LYS 72 3HE LYS 72 -11.147 -4.796 12.332 633 HZ1 LYS 72 3HZ LYS 72 -12.608 -5.881 10.709 634 HZ2 LYS 72 1HZ LYS 72 -13.138 -6.096 12.300 635 HZ3 LYS 72 2HZ LYS 72 -12.370 -7.363 11.486 636 H SER 73 H SER 73 -4.870 -7.650 11.593 637 HA SER 73 HA SER 73 -5.604 -8.429 14.177 638 HB2 SER 73 2HB SER 73 -4.474 -9.941 12.568 639 HB3 SER 73 3HB SER 73 -2.980 -9.026 12.767 640 HG SER 73 HG SER 73 -2.702 -10.565 14.228 641 H LEU 74 H LEU 74 -3.180 -6.173 13.090 642 HA LEU 74 HA LEU 74 -1.882 -5.818 15.624 643 HB2 LEU 74 2HB LEU 74 -1.997 -3.912 13.278 644 HB3 LEU 74 3HB LEU 74 -0.820 -3.902 14.578 645 HG LEU 74 HG LEU 74 -1.104 -6.120 12.538 646 HD11 LEU 74 1HD1 LEU 74 0.959 -5.232 11.562 647 HD12 LEU 74 2HD1 LEU 74 0.910 -3.877 12.689 648 HD13 LEU 74 3HD1 LEU 74 -0.359 -4.063 11.478 649 HD21 LEU 74 3HD2 LEU 74 1.022 -5.598 14.622 650 HD22 LEU 74 1HD2 LEU 74 1.045 -6.888 13.418 651 HD23 LEU 74 2HD2 LEU 74 -0.190 -6.879 14.674 652 H GLY 75 H GLY 75 -4.294 -3.920 13.786 653 HA2 GLY 75 2HA GLY 75 -5.995 -2.546 14.553 654 HA3 GLY 75 3HA GLY 75 -5.574 -2.998 16.197 655 H ALA 76 H ALA 76 -4.662 -0.875 13.500 656 HA ALA 76 HA ALA 76 -3.890 1.213 15.371 657 HB1 ALA 76 3HB ALA 76 -1.641 1.513 14.461 658 HB2 ALA 76 1HB ALA 76 -1.865 0.107 13.419 659 HB3 ALA 76 2HB ALA 76 -1.827 -0.091 15.171 660 H GLN 77 H GLN 77 -3.602 3.287 14.383 661 HA GLN 77 HA GLN 77 -5.159 3.645 11.965 662 HB2 GLN 77 2HB GLN 77 -3.767 5.712 13.689 663 HB3 GLN 77 3HB GLN 77 -4.940 6.043 12.420 664 HG2 GLN 77 2HG GLN 77 -6.634 4.780 13.729 665 HG3 GLN 77 3HG GLN 77 -5.451 4.614 15.025 666 HE21 GLN 77 1HE2 GLN 77 -6.729 5.769 16.478 667 HE22 GLN 77 2HE2 GLN 77 -6.954 7.474 16.349 668 H VAL 78 H VAL 78 -4.167 3.307 10.066 669 HA VAL 78 HA VAL 78 -1.563 4.596 9.573 670 HB VAL 78 HB VAL 78 -0.769 2.674 8.293 671 HG11 VAL 78 1HG1 VAL 78 -1.636 1.880 11.078 672 HG12 VAL 78 2HG1 VAL 78 -0.175 2.777 10.659 673 HG13 VAL 78 3HG1 VAL 78 -0.363 1.103 10.133 674 HG21 VAL 78 3HG2 VAL 78 -3.331 1.320 9.160 675 HG22 VAL 78 1HG2 VAL 78 -1.977 0.511 8.368 676 HG23 VAL 78 2HG2 VAL 78 -2.876 1.763 7.515 677 H LEU 79 H LEU 79 -1.091 4.961 7.301 678 HA LEU 79 HA LEU 79 -3.479 5.589 5.733 679 HB2 LEU 79 2HB LEU 79 -1.258 7.019 6.135 680 HB3 LEU 79 3HB LEU 79 -0.690 6.100 4.760 681 HG LEU 79 HG LEU 79 -1.490 8.222 3.983 682 HD11 LEU 79 1HD1 LEU 79 -1.975 6.336 2.513 683 HD12 LEU 79 2HD1 LEU 79 -3.205 7.592 2.379 684 HD13 LEU 79 3HD1 LEU 79 -3.543 6.123 3.295 685 HD21 LEU 79 3HD2 LEU 79 -3.768 9.007 4.339 686 HD22 LEU 79 1HD2 LEU 79 -2.920 8.792 5.869 687 HD23 LEU 79 2HD2 LEU 79 -4.108 7.596 5.343 688 H ILE 80 H ILE 80 -4.081 4.446 3.886 689 HA ILE 80 HA ILE 80 -2.183 2.421 2.869 690 HB ILE 80 HB ILE 80 -5.164 2.048 3.264 691 HG12 ILE 80 2HG1 ILE 80 -2.748 0.700 4.511 692 HG13 ILE 80 3HG1 ILE 80 -3.904 1.749 5.324 693 HG21 ILE 80 1HG2 ILE 80 -4.472 1.036 1.153 694 HG22 ILE 80 2HG2 ILE 80 -4.848 -0.210 2.343 695 HG23 ILE 80 3HG2 ILE 80 -3.167 0.178 1.972 696 HD11 ILE 80 3HD1 ILE 80 -4.320 -0.553 5.893 697 HD12 ILE 80 1HD1 ILE 80 -4.460 -0.984 4.188 698 HD13 ILE 80 2HD1 ILE 80 -5.660 0.072 4.932 699 H ILE 81 H ILE 81 -1.964 2.256 0.692 700 HA ILE 81 HA ILE 81 -3.847 3.772 -1.024 701 HB ILE 81 HB ILE 81 -0.892 3.317 -1.537 702 HG12 ILE 81 2HG1 ILE 81 -2.425 5.815 -0.755 703 HG13 ILE 81 3HG1 ILE 81 -1.174 5.004 0.180 704 HG21 ILE 81 1HG2 ILE 81 -2.949 4.827 -3.159 705 HG22 ILE 81 2HG2 ILE 81 -2.171 3.310 -3.607 706 HG23 ILE 81 3HG2 ILE 81 -1.216 4.787 -3.489 707 HD11 ILE 81 3HD1 ILE 81 -0.814 6.471 -2.422 708 HD12 ILE 81 1HD1 ILE 81 0.457 5.572 -1.590 709 HD13 ILE 81 2HD1 ILE 81 -0.273 6.982 -0.824 710 H ILE 82 H ILE 82 -4.733 2.680 -2.733 711 HA ILE 82 HA ILE 82 -3.737 -0.055 -3.265 712 HB ILE 82 HB ILE 82 -6.586 0.958 -3.487 713 HG12 ILE 82 2HG1 ILE 82 -5.336 -1.047 -1.580 714 HG13 ILE 82 3HG1 ILE 82 -5.850 0.582 -1.158 715 HG21 ILE 82 1HG2 ILE 82 -6.065 -0.679 -5.231 716 HG22 ILE 82 2HG2 ILE 82 -7.173 -1.358 -4.040 717 HG23 ILE 82 3HG2 ILE 82 -5.467 -1.803 -4.010 718 HD11 ILE 82 3HD1 ILE 82 -7.469 -1.066 -0.427 719 HD12 ILE 82 1HD1 ILE 82 -7.641 -1.654 -2.080 720 HD13 ILE 82 2HD1 ILE 82 -8.163 -0.021 -1.666 721 H TYR 83 H TYR 83 -2.894 -0.330 -5.242 722 HA TYR 83 HA TYR 83 -3.802 1.443 -7.424 723 HB2 TYR 83 2HB TYR 83 -1.428 1.685 -7.069 724 HB3 TYR 83 3HB TYR 83 -1.189 -0.060 -7.115 725 HD1 TYR 83 HD2 TYR 83 -2.282 2.826 -9.216 726 HD2 TYR 83 HD1 TYR 83 -0.730 -1.142 -9.169 727 HE1 TYR 83 HE2 TYR 83 -1.933 2.936 -11.647 728 HE2 TYR 83 HE1 TYR 83 -0.384 -1.039 -11.599 729 HH TYR 83 HH TYR 83 -0.486 1.820 -13.362 730 H ASP 84 H ASP 84 -5.281 0.535 -8.650 731 HA ASP 84 HA ASP 84 -4.658 -1.873 -10.099 732 HB2 ASP 84 2HB ASP 84 -5.776 -2.803 -8.088 733 HB3 ASP 84 3HB ASP 84 -7.187 -1.800 -8.419 734 H GLN 85 H GLN 85 -6.044 -2.114 -12.006 735 HA GLN 85 HA GLN 85 -7.138 0.514 -12.778 736 HB2 GLN 85 2HB GLN 85 -5.943 -1.674 -14.488 737 HB3 GLN 85 3HB GLN 85 -6.675 -0.204 -15.125 738 HG2 GLN 85 2HG GLN 85 -5.004 1.133 -13.889 739 HG3 GLN 85 3HG GLN 85 -4.246 -0.361 -13.342 740 HE21 GLN 85 1HE2 GLN 85 -2.298 0.196 -14.358 741 HE22 GLN 85 2HE2 GLN 85 -2.110 0.104 -16.072 742 H ASP 86 H ASP 86 -8.327 -2.450 -11.874 743 HA ASP 86 HA ASP 86 -10.540 -2.475 -13.786 744 HB2 ASP 86 2HB ASP 86 -9.508 -4.607 -12.920 745 HB3 ASP 86 3HB ASP 86 -10.166 -4.220 -11.333 746 H GLN 87 H GLN 87 -12.016 -0.922 -13.481 747 HA GLN 87 HA GLN 87 -12.270 0.618 -11.160 748 HB2 GLN 87 2HB GLN 87 -14.358 0.284 -13.321 749 HB3 GLN 87 3HB GLN 87 -14.172 1.657 -12.238 750 HG2 GLN 87 2HG GLN 87 -12.221 0.797 -14.371 751 HG3 GLN 87 3HG GLN 87 -13.318 2.173 -14.456 752 HE21 GLN 87 1HE2 GLN 87 -10.385 2.009 -14.598 753 HE22 GLN 87 2HE2 GLN 87 -9.810 3.094 -13.387 754 H ASN 88 H ASN 88 -13.759 -2.412 -11.925 755 HA ASN 88 HA ASN 88 -15.962 -2.080 -10.060 756 HB2 ASN 88 2HB ASN 88 -16.196 -3.400 -12.161 757 HB3 ASN 88 3HB ASN 88 -15.047 -4.573 -11.523 758 HD21 ASN 88 1HD2 ASN 88 -18.264 -3.331 -11.330 759 HD22 ASN 88 2HD2 ASN 88 -18.899 -4.572 -10.311 760 H ARG 89 H ARG 89 -12.923 -3.920 -10.210 761 HA ARG 89 HA ARG 89 -13.328 -5.156 -7.628 762 HB2 ARG 89 2HB ARG 89 -10.897 -5.087 -9.441 763 HB3 ARG 89 3HB ARG 89 -11.031 -6.056 -7.977 764 HG2 ARG 89 2HG ARG 89 -12.834 -6.313 -10.384 765 HG3 ARG 89 3HG ARG 89 -11.450 -7.349 -10.038 766 HD2 ARG 89 2HD ARG 89 -12.480 -8.234 -8.088 767 HD3 ARG 89 3HD ARG 89 -13.742 -7.002 -8.112 768 HE ARG 89 HE ARG 89 -14.311 -8.164 -10.366 769 HH11 ARG 89 1HH1 ARG 89 -13.190 -9.756 -7.530 770 HH12 ARG 89 2HH1 ARG 89 -14.111 -11.184 -7.834 771 HH21 ARG 89 1HH2 ARG 89 -15.509 -9.971 -10.737 772 HH22 ARG 89 2HH2 ARG 89 -15.413 -11.309 -9.646 773 H LEU 90 H LEU 90 -11.254 -2.572 -8.898 774 HA LEU 90 HA LEU 90 -9.729 -1.937 -6.696 775 HB2 LEU 90 2HB LEU 90 -9.469 -0.880 -8.882 776 HB3 LEU 90 3HB LEU 90 -11.007 -0.060 -8.693 777 HG LEU 90 HG LEU 90 -10.040 1.202 -6.762 778 HD11 LEU 90 1HD1 LEU 90 -8.289 -0.348 -6.106 779 HD12 LEU 90 2HD1 LEU 90 -7.597 1.229 -6.488 780 HD13 LEU 90 3HD1 LEU 90 -7.463 -0.097 -7.644 781 HD21 LEU 90 3HD2 LEU 90 -8.706 2.727 -8.123 782 HD22 LEU 90 1HD2 LEU 90 -10.132 2.181 -9.006 783 HD23 LEU 90 2HD2 LEU 90 -8.549 1.493 -9.374 784 H GLU 91 H GLU 91 -12.847 -0.389 -7.509 785 HA GLU 91 HA GLU 91 -13.105 1.016 -5.078 786 HB2 GLU 91 2HB GLU 91 -15.190 0.188 -7.108 787 HB3 GLU 91 3HB GLU 91 -15.495 1.301 -5.779 788 HG2 GLU 91 2HG GLU 91 -13.386 1.771 -7.880 789 HG3 GLU 91 3HG GLU 91 -15.041 2.357 -8.017 790 H GLU 92 H GLU 92 -14.417 -2.132 -6.107 791 HA GLU 92 HA GLU 92 -16.043 -2.756 -3.963 792 HB2 GLU 92 2HB GLU 92 -15.899 -4.240 -5.861 793 HB3 GLU 92 3HB GLU 92 -14.200 -4.564 -5.540 794 HG2 GLU 92 2HG GLU 92 -14.831 -5.666 -3.424 795 HG3 GLU 92 3HG GLU 92 -16.529 -5.385 -3.803 796 H PHE 93 H PHE 93 -12.593 -3.624 -4.245 797 HA PHE 93 HA PHE 93 -12.340 -4.593 -1.599 798 HB2 PHE 93 2HB PHE 93 -10.834 -5.211 -3.475 799 HB3 PHE 93 3HB PHE 93 -10.175 -3.581 -3.466 800 HD1 PHE 93 HD1 PHE 93 -10.814 -6.321 -1.000 801 HD2 PHE 93 HD2 PHE 93 -8.128 -3.349 -2.449 802 HE1 PHE 93 HE1 PHE 93 -9.137 -7.033 0.650 803 HE2 PHE 93 HE2 PHE 93 -6.452 -4.058 -0.797 804 HZ PHE 93 HZ PHE 93 -6.955 -5.901 0.752 805 H SER 94 H SER 94 -11.672 -1.435 -3.056 806 HA SER 94 HA SER 94 -10.344 -0.165 -0.970 807 HB2 SER 94 2HB SER 94 -10.565 0.880 -3.148 808 HB3 SER 94 3HB SER 94 -12.314 0.994 -2.959 809 HG SER 94 HG SER 94 -11.370 2.973 -2.468 810 H ARG 95 H ARG 95 -13.876 -0.062 -1.582 811 HA ARG 95 HA ARG 95 -14.591 1.469 0.630 812 HB2 ARG 95 2HB ARG 95 -16.208 -0.743 -0.660 813 HB3 ARG 95 3HB ARG 95 -16.852 0.522 0.377 814 HG2 ARG 95 2HG ARG 95 -15.607 0.882 -2.345 815 HG3 ARG 95 3HG ARG 95 -17.317 1.024 -1.934 816 HD2 ARG 95 2HD ARG 95 -16.739 2.920 -0.428 817 HD3 ARG 95 3HD ARG 95 -15.071 2.817 -0.999 818 HE ARG 95 HE ARG 95 -17.368 3.423 -2.754 819 HH11 ARG 95 1HH1 ARG 95 -14.082 3.928 -1.830 820 HH12 ARG 95 2HH1 ARG 95 -13.801 5.093 -3.073 821 HH21 ARG 95 1HH2 ARG 95 -17.006 4.936 -4.301 822 HH22 ARG 95 2HH2 ARG 95 -15.443 5.661 -4.456 823 H GLU 96 H GLU 96 -14.369 -2.074 0.377 824 HA GLU 96 HA GLU 96 -15.249 -2.665 2.977 825 HB2 GLU 96 2HB GLU 96 -13.445 -4.211 1.108 826 HB3 GLU 96 3HB GLU 96 -14.054 -4.857 2.627 827 HG2 GLU 96 2HG GLU 96 -16.370 -4.483 1.792 828 HG3 GLU 96 3HG GLU 96 -15.684 -3.999 0.242 829 H VAL 97 H VAL 97 -11.877 -2.369 1.763 830 HA VAL 97 HA VAL 97 -10.541 -2.803 4.163 831 HB VAL 97 HB VAL 97 -9.764 -0.892 1.945 832 HG11 VAL 97 1HG1 VAL 97 -8.075 -2.041 4.177 833 HG12 VAL 97 2HG1 VAL 97 -8.547 -0.351 3.992 834 HG13 VAL 97 3HG1 VAL 97 -7.469 -1.099 2.814 835 HG21 VAL 97 3HG2 VAL 97 -10.043 -3.217 1.209 836 HG22 VAL 97 1HG2 VAL 97 -8.931 -3.750 2.470 837 HG23 VAL 97 2HG2 VAL 97 -8.351 -2.724 1.158 838 H ARG 98 H ARG 98 -11.880 0.240 2.905 839 HA ARG 98 HA ARG 98 -10.999 1.902 5.007 840 HB2 ARG 98 2HB ARG 98 -12.007 2.520 2.696 841 HB3 ARG 98 3HB ARG 98 -13.563 2.379 3.502 842 HG2 ARG 98 2HG ARG 98 -12.832 4.079 5.143 843 HG3 ARG 98 3HG ARG 98 -11.321 4.253 4.249 844 HD2 ARG 98 2HD ARG 98 -12.741 4.816 2.223 845 HD3 ARG 98 3HD ARG 98 -14.112 4.928 3.327 846 HE ARG 98 HE ARG 98 -12.004 6.831 2.984 847 HH11 ARG 98 1HH1 ARG 98 -14.350 5.644 5.215 848 HH12 ARG 98 2HH1 ARG 98 -14.349 7.101 6.139 849 HH21 ARG 98 1HH2 ARG 98 -12.032 8.689 4.170 850 HH22 ARG 98 2HH2 ARG 98 -13.065 8.811 5.551 851 H ARG 99 H ARG 99 -13.934 -0.022 4.592 852 HA ARG 99 HA ARG 99 -15.394 0.905 6.809 853 HB2 ARG 99 2HB ARG 99 -16.388 -0.426 5.006 854 HB3 ARG 99 3HB ARG 99 -15.418 -1.816 5.477 855 HG2 ARG 99 2HG ARG 99 -17.659 -2.109 6.292 856 HG3 ARG 99 3HG ARG 99 -16.582 -1.844 7.664 857 HD2 ARG 99 2HD ARG 99 -17.254 0.589 7.573 858 HD3 ARG 99 3HD ARG 99 -18.494 0.121 6.408 859 HE ARG 99 HE ARG 99 -18.385 -1.051 9.107 860 HH11 ARG 99 1HH1 ARG 99 -20.145 0.459 6.560 861 HH12 ARG 99 2HH1 ARG 99 -21.618 0.499 7.464 862 HH21 ARG 99 1HH2 ARG 99 -20.273 -1.029 10.237 863 HH22 ARG 99 2HH2 ARG 99 -21.698 -0.354 9.519 864 H ARG 100 H ARG 100 -12.766 -1.379 6.584 865 HA ARG 100 HA ARG 100 -13.203 -2.702 9.081 866 HB2 ARG 100 2HB ARG 100 -10.620 -2.519 7.514 867 HB3 ARG 100 3HB ARG 100 -11.065 -3.756 8.688 868 HG2 ARG 100 2HG ARG 100 -12.772 -4.611 7.240 869 HG3 ARG 100 3HG ARG 100 -12.556 -3.266 6.123 870 HD2 ARG 100 2HD ARG 100 -11.486 -5.149 5.154 871 HD3 ARG 100 3HD ARG 100 -10.216 -4.077 5.735 872 HE ARG 100 HE ARG 100 -10.115 -5.628 7.715 873 HH11 ARG 100 1HH1 ARG 100 -11.285 -6.725 4.661 874 HH12 ARG 100 2HH1 ARG 100 -10.718 -8.338 4.906 875 HH21 ARG 100 1HH2 ARG 100 -9.400 -7.745 7.998 876 HH22 ARG 100 2HH2 ARG 100 -9.668 -8.902 6.737 877 H GLY 101 H GLY 101 -11.944 0.363 8.307 878 HA2 GLY 101 2HA GLY 101 -11.601 1.919 10.150 879 HA3 GLY 101 3HA GLY 101 -10.820 0.621 11.038 880 H PHE 102 H PHE 102 -10.227 1.393 7.640 881 HA PHE 102 HA PHE 102 -7.567 2.449 8.377 882 HB2 PHE 102 2HB PHE 102 -8.232 0.486 6.173 883 HB3 PHE 102 3HB PHE 102 -6.687 1.322 6.299 884 HD1 PHE 102 HD1 PHE 102 -5.284 0.954 8.375 885 HD2 PHE 102 HD2 PHE 102 -8.632 -1.491 7.386 886 HE1 PHE 102 HE1 PHE 102 -4.436 -0.807 9.865 887 HE2 PHE 102 HE2 PHE 102 -7.788 -3.252 8.884 888 HZ PHE 102 HZ PHE 102 -5.685 -2.912 10.124 889 H GLU 103 H GLU 103 -6.888 4.262 7.332 890 HA GLU 103 HA GLU 103 -8.715 5.642 5.568 891 HB2 GLU 103 2HB GLU 103 -5.922 6.360 6.507 892 HB3 GLU 103 3HB GLU 103 -6.944 7.412 5.535 893 HG2 GLU 103 2HG GLU 103 -7.612 6.411 8.301 894 HG3 GLU 103 3HG GLU 103 -6.950 8.000 7.925 895 H VAL 104 H VAL 104 -8.855 4.566 3.624 896 HA VAL 104 HA VAL 104 -6.346 3.932 2.220 897 HB VAL 104 HB VAL 104 -7.846 2.023 2.616 898 HG11 VAL 104 1HG1 VAL 104 -9.796 3.477 0.826 899 HG12 VAL 104 2HG1 VAL 104 -9.993 3.189 2.555 900 HG13 VAL 104 3HG1 VAL 104 -9.974 1.829 1.432 901 HG21 VAL 104 3HG2 VAL 104 -6.351 1.999 0.688 902 HG22 VAL 104 1HG2 VAL 104 -7.588 2.780 -0.298 903 HG23 VAL 104 2HG2 VAL 104 -7.855 1.151 0.325 904 H ARG 105 H ARG 105 -5.871 4.719 0.265 905 HA ARG 105 HA ARG 105 -7.870 6.343 -1.180 906 HB2 ARG 105 2HB ARG 105 -4.999 6.920 -0.535 907 HB3 ARG 105 3HB ARG 105 -5.656 7.528 -2.048 908 HG2 ARG 105 2HG ARG 105 -7.405 8.724 -0.818 909 HG3 ARG 105 3HG ARG 105 -6.767 8.099 0.705 910 HD2 ARG 105 2HD ARG 105 -4.726 9.318 0.434 911 HD3 ARG 105 3HD ARG 105 -5.147 9.767 -1.218 912 HE ARG 105 HE ARG 105 -6.602 11.386 -0.398 913 HH11 ARG 105 1HH1 ARG 105 -5.306 9.563 2.226 914 HH12 ARG 105 2HH1 ARG 105 -5.709 10.770 3.397 915 HH21 ARG 105 1HH2 ARG 105 -7.122 12.904 1.129 916 HH22 ARG 105 2HH2 ARG 105 -6.724 12.616 2.791 917 H THR 106 H THR 106 -7.975 6.063 -3.401 918 HA THR 106 HA THR 106 -6.442 3.756 -4.439 919 HB THR 106 HB THR 106 -8.294 3.388 -6.037 920 HG1 THR 106 HG1 THR 106 -10.267 4.540 -5.697 921 HG21 THR 106 3HG2 THR 106 -9.929 2.531 -4.419 922 HG22 THR 106 1HG2 THR 106 -9.173 3.490 -3.142 923 HG23 THR 106 2HG2 THR 106 -8.279 2.177 -3.910 924 H VAL 107 H VAL 107 -5.338 3.893 -6.316 925 HA VAL 107 HA VAL 107 -5.524 6.400 -7.872 926 HB VAL 107 HB VAL 107 -3.068 6.269 -8.271 927 HG11 VAL 107 1HG1 VAL 107 -3.853 6.478 -5.357 928 HG12 VAL 107 2HG1 VAL 107 -3.960 7.769 -6.554 929 HG13 VAL 107 3HG1 VAL 107 -2.384 7.134 -6.081 930 HG21 VAL 107 3HG2 VAL 107 -2.696 3.904 -7.841 931 HG22 VAL 107 1HG2 VAL 107 -3.149 4.113 -6.147 932 HG23 VAL 107 2HG2 VAL 107 -1.684 4.872 -6.772 933 H THR 108 H THR 108 -5.607 6.185 -10.050 934 HA THR 108 HA THR 108 -5.729 3.448 -11.120 935 HB THR 108 HB THR 108 -6.873 4.461 -13.070 936 HG1 THR 108 HG1 THR 108 -6.726 6.549 -13.362 937 HG21 THR 108 3HG2 THR 108 -8.065 5.270 -10.410 938 HG22 THR 108 1HG2 THR 108 -8.204 3.679 -11.161 939 HG23 THR 108 2HG2 THR 108 -8.948 5.084 -11.925 940 H SER 109 H SER 109 -3.765 6.295 -11.318 941 HA SER 109 HA SER 109 -2.138 5.046 -13.428 942 HB2 SER 109 2HB SER 109 -3.044 7.943 -13.481 943 HB3 SER 109 3HB SER 109 -1.917 7.203 -14.617 944 HG SER 109 HG SER 109 -4.534 7.294 -14.793 945 HA PRO 110 HA PRO 110 1.476 6.134 -11.096 946 HB2 PRO 110 2HB PRO 110 2.549 7.380 -13.591 947 HB3 PRO 110 3HB PRO 110 3.279 6.162 -12.536 948 HG2 PRO 110 2HG PRO 110 2.248 5.449 -14.875 949 HG3 PRO 110 3HG PRO 110 2.005 4.429 -13.442 950 HD2 PRO 110 2HD PRO 110 0.096 6.322 -14.769 951 HD3 PRO 110 3HD PRO 110 -0.212 4.723 -14.058 952 H ASP 111 H ASP 111 0.491 8.742 -13.347 953 HA ASP 111 HA ASP 111 1.643 10.886 -11.976 954 HB2 ASP 111 2HB ASP 111 -0.881 10.820 -13.645 955 HB3 ASP 111 3HB ASP 111 -0.042 12.290 -13.149 956 H ASP 112 H ASP 112 -1.689 9.623 -11.712 957 HA ASP 112 HA ASP 112 -2.626 11.269 -9.672 958 HB2 ASP 112 2HB ASP 112 -3.305 8.360 -10.202 959 HB3 ASP 112 3HB ASP 112 -4.258 9.462 -9.209 960 H PHE 113 H PHE 113 -0.902 8.162 -9.432 961 HA PHE 113 HA PHE 113 -0.859 7.916 -6.648 962 HB2 PHE 113 2HB PHE 113 -0.150 6.077 -8.060 963 HB3 PHE 113 3HB PHE 113 1.191 7.025 -8.695 964 HD1 PHE 113 HD1 PHE 113 -0.127 5.380 -5.647 965 HD2 PHE 113 HD2 PHE 113 3.265 7.117 -7.558 966 HE1 PHE 113 HE1 PHE 113 1.323 4.526 -3.853 967 HE2 PHE 113 HE2 PHE 113 4.715 6.261 -5.766 968 HZ PHE 113 HZ PHE 113 3.745 4.968 -3.910 969 H LYS 114 H LYS 114 1.500 9.514 -8.791 970 HA LYS 114 HA LYS 114 3.306 10.368 -6.844 971 HB2 LYS 114 2HB LYS 114 3.714 10.481 -9.284 972 HB3 LYS 114 3HB LYS 114 2.554 11.796 -9.409 973 HG2 LYS 114 2HG LYS 114 3.964 13.197 -7.996 974 HG3 LYS 114 3HG LYS 114 5.118 11.877 -7.820 975 HD2 LYS 114 2HD LYS 114 5.984 13.374 -9.466 976 HD3 LYS 114 3HD LYS 114 5.437 11.927 -10.308 977 HE2 LYS 114 2HE LYS 114 3.755 14.421 -10.059 978 HE3 LYS 114 3HE LYS 114 4.865 14.143 -11.398 979 HZ1 LYS 114 3HZ LYS 114 2.531 12.456 -10.680 980 HZ2 LYS 114 1HZ LYS 114 3.622 12.120 -11.925 981 HZ3 LYS 114 2HZ LYS 114 2.645 13.497 -12.003 982 H LYS 115 H LYS 115 0.530 12.155 -8.212 983 HA LYS 115 HA LYS 115 0.789 14.478 -6.658 984 HB2 LYS 115 2HB LYS 115 -1.534 13.217 -8.097 985 HB3 LYS 115 3HB LYS 115 -1.741 14.700 -7.178 986 HG2 LYS 115 2HG LYS 115 0.497 14.696 -9.112 987 HG3 LYS 115 3HG LYS 115 -1.123 14.622 -9.805 988 HD2 LYS 115 2HD LYS 115 -0.393 16.936 -9.613 989 HD3 LYS 115 3HD LYS 115 -1.755 16.634 -8.537 990 HE2 LYS 115 2HE LYS 115 -0.185 17.961 -7.331 991 HE3 LYS 115 3HE LYS 115 -0.090 16.330 -6.671 992 HZ1 LYS 115 3HZ LYS 115 1.787 17.513 -8.644 993 HZ2 LYS 115 1HZ LYS 115 1.892 15.951 -8.005 994 HZ3 LYS 115 2HZ LYS 115 2.097 17.290 -6.999 995 H SER 116 H SER 116 -1.198 11.573 -6.065 996 HA SER 116 HA SER 116 -2.423 12.520 -3.701 997 HB2 SER 116 2HB SER 116 -2.994 10.151 -3.260 998 HB3 SER 116 3HB SER 116 -3.337 10.613 -4.925 999 HG SER 116 HG SER 116 -1.765 9.358 -5.629 1000 H LEU 117 H LEU 117 0.485 10.525 -4.184 1001 HA LEU 117 HA LEU 117 1.121 10.118 -1.484 1002 HB2 LEU 117 2HB LEU 117 2.146 8.918 -3.402 1003 HB3 LEU 117 3HB LEU 117 3.037 10.371 -3.810 1004 HG LEU 117 HG LEU 117 4.230 10.245 -1.650 1005 HD11 LEU 117 1HD1 LEU 117 2.511 9.099 -0.338 1006 HD12 LEU 117 2HD1 LEU 117 4.053 8.248 -0.257 1007 HD13 LEU 117 3HD1 LEU 117 2.759 7.630 -1.284 1008 HD21 LEU 117 3HD2 LEU 117 5.637 8.335 -2.198 1009 HD22 LEU 117 1HD2 LEU 117 5.187 9.213 -3.660 1010 HD23 LEU 117 2HD2 LEU 117 4.384 7.693 -3.262 1011 H GLU 118 H GLU 118 2.203 12.708 -3.704 1012 HA GLU 118 HA GLU 118 3.804 14.221 -2.048 1013 HB2 GLU 118 2HB GLU 118 1.758 15.154 -4.077 1014 HB3 GLU 118 3HB GLU 118 2.916 16.233 -3.313 1015 HG2 GLU 118 2HG GLU 118 4.760 15.051 -4.322 1016 HG3 GLU 118 3HG GLU 118 3.667 13.833 -4.977 1017 H ARG 119 H ARG 119 0.262 14.330 -2.266 1018 HA ARG 119 HA ARG 119 -0.105 16.306 -0.251 1019 HB2 ARG 119 2HB ARG 119 -2.010 14.244 -1.388 1020 HB3 ARG 119 3HB ARG 119 -2.492 15.546 -0.308 1021 HG2 ARG 119 2HG ARG 119 -1.245 15.926 -3.033 1022 HG3 ARG 119 3HG ARG 119 -2.970 16.047 -2.670 1023 HD2 ARG 119 2HD ARG 119 -2.541 17.912 -1.166 1024 HD3 ARG 119 3HD ARG 119 -0.807 17.765 -1.444 1025 HE ARG 119 HE ARG 119 -1.507 18.240 -3.886 1026 HH11 ARG 119 1HH1 ARG 119 -3.037 19.580 -1.103 1027 HH12 ARG 119 2HH1 ARG 119 -3.426 21.066 -1.904 1028 HH21 ARG 119 1HH2 ARG 119 -2.008 20.145 -4.891 1029 HH22 ARG 119 2HH2 ARG 119 -2.843 21.378 -4.016 1030 H LEU 120 H LEU 120 -0.116 12.765 -0.196 1031 HA LEU 120 HA LEU 120 -1.128 12.442 2.414 1032 HB2 LEU 120 2HB LEU 120 0.548 10.657 0.662 1033 HB3 LEU 120 3HB LEU 120 -0.012 10.156 2.250 1034 HG LEU 120 HG LEU 120 -1.788 10.944 -0.068 1035 HD11 LEU 120 1HD1 LEU 120 -0.708 8.794 -0.437 1036 HD12 LEU 120 2HD1 LEU 120 -2.426 8.583 -0.105 1037 HD13 LEU 120 3HD1 LEU 120 -1.237 8.239 1.152 1038 HD21 LEU 120 3HD2 LEU 120 -2.479 9.919 2.688 1039 HD22 LEU 120 1HD2 LEU 120 -3.621 10.171 1.368 1040 HD23 LEU 120 2HD2 LEU 120 -2.774 11.546 2.074 1041 H ILE 121 H ILE 121 2.207 12.766 1.248 1042 HA ILE 121 HA ILE 121 3.618 12.181 3.556 1043 HB ILE 121 HB ILE 121 4.202 14.387 1.553 1044 HG12 ILE 121 2HG1 ILE 121 5.256 11.546 1.723 1045 HG13 ILE 121 3HG1 ILE 121 4.029 12.101 0.590 1046 HG21 ILE 121 1HG2 ILE 121 5.456 14.755 3.624 1047 HG22 ILE 121 2HG2 ILE 121 6.533 14.250 2.324 1048 HG23 ILE 121 3HG2 ILE 121 6.055 13.097 3.568 1049 HD11 ILE 121 3HD1 ILE 121 6.186 11.937 -0.486 1050 HD12 ILE 121 1HD1 ILE 121 6.891 13.028 0.706 1051 HD13 ILE 121 2HD1 ILE 121 5.667 13.620 -0.417 1052 H ARG 122 H ARG 122 1.921 15.191 2.741 1053 HA ARG 122 HA ARG 122 2.764 16.493 5.192 1054 HB2 ARG 122 2HB ARG 122 0.644 17.410 3.239 1055 HB3 ARG 122 3HB ARG 122 1.487 18.392 4.431 1056 HG2 ARG 122 2HG ARG 122 2.682 17.122 1.968 1057 HG3 ARG 122 3HG ARG 122 2.354 18.835 2.221 1058 HD2 ARG 122 2HD ARG 122 4.316 17.162 3.797 1059 HD3 ARG 122 3HD ARG 122 4.732 18.298 2.516 1060 HE ARG 122 HE ARG 122 3.589 19.043 5.135 1061 HH11 ARG 122 1HH1 ARG 122 5.485 19.784 2.341 1062 HH12 ARG 122 2HH1 ARG 122 5.962 21.331 2.946 1063 HH21 ARG 122 1HH2 ARG 122 4.255 21.024 5.907 1064 HH22 ARG 122 2HH2 ARG 122 5.287 22.011 4.935 1065 H GLU 123 H GLU 123 0.147 14.489 4.193 1066 HA GLU 123 HA GLU 123 -1.732 15.293 6.226 1067 HB2 GLU 123 2HB GLU 123 -1.604 12.910 4.368 1068 HB3 GLU 123 3HB GLU 123 -2.900 13.135 5.532 1069 HG2 GLU 123 2HG GLU 123 -2.227 15.168 3.418 1070 HG3 GLU 123 3HG GLU 123 -3.371 13.853 3.160 1071 H VAL 124 H VAL 124 0.650 12.685 5.894 1072 HA VAL 124 HA VAL 124 -0.122 11.669 8.556 1073 HB VAL 124 HB VAL 124 -0.378 10.020 6.789 1074 HG11 VAL 124 1HG1 VAL 124 1.557 9.157 5.536 1075 HG12 VAL 124 2HG1 VAL 124 2.559 10.432 6.234 1076 HG13 VAL 124 3HG1 VAL 124 1.215 10.847 5.170 1077 HG21 VAL 124 3HG2 VAL 124 0.298 9.212 8.994 1078 HG22 VAL 124 1HG2 VAL 124 1.998 9.384 8.547 1079 HG23 VAL 124 2HG2 VAL 124 0.981 8.204 7.718 1080 H GLY 125 H GLY 125 2.527 13.151 6.851 1081 HA2 GLY 125 2HA GLY 125 4.307 12.529 9.139 1082 HA3 GLY 125 3HA GLY 125 4.885 12.546 7.483 1083 H SER 126 H SER 126 6.293 14.005 9.131 1084 HA SER 126 HA SER 126 5.598 16.782 8.432 1085 HB2 SER 126 2HB SER 126 6.554 17.569 10.555 1086 HB3 SER 126 3HB SER 126 5.232 16.446 10.864 1087 HG SER 126 HG SER 126 6.787 15.704 12.165 1088 H LEU 127 H LEU 127 7.839 18.114 9.042 1089 HA LEU 127 HA LEU 127 9.942 16.714 7.513 1090 HB2 LEU 127 2HB LEU 127 10.484 18.714 6.329 1091 HB3 LEU 127 3HB LEU 127 8.766 18.424 6.158 1092 HG LEU 127 HG LEU 127 9.931 20.431 8.104 1093 HD11 LEU 127 1HD1 LEU 127 9.264 22.147 6.465 1094 HD12 LEU 127 2HD1 LEU 127 8.881 20.873 5.308 1095 HD13 LEU 127 3HD1 LEU 127 10.541 21.094 5.860 1096 HD21 LEU 127 3HD2 LEU 127 7.126 19.897 7.125 1097 HD22 LEU 127 1HD2 LEU 127 7.602 21.380 7.956 1098 HD23 LEU 127 2HD2 LEU 127 7.733 19.832 8.780 1099 H GLU 128 H GLU 128 9.432 17.499 10.518 1100 HA GLU 128 HA GLU 128 11.773 19.151 11.050 1101 HB2 GLU 128 2HB GLU 128 9.751 17.920 12.939 1102 HB3 GLU 128 3HB GLU 128 11.039 19.018 13.415 1103 HG2 GLU 128 2HG GLU 128 10.052 20.758 11.958 1104 HG3 GLU 128 3HG GLU 128 8.725 19.656 11.591 1105 H HIS 129 H HIS 129 13.740 18.342 11.388 1106 HA HIS 129 HA HIS 129 14.027 15.517 12.231 1107 HB2 HIS 129 2HB HIS 129 15.861 17.232 10.534 1108 HB3 HIS 129 3HB HIS 129 16.249 15.604 11.084 1109 HD1 HIS 129 HD1 HIS 129 15.416 13.701 9.679 1110 HD2 HIS 129 HD2 HIS 129 13.640 17.317 8.672 1111 HE1 HIS 129 HE1 HIS 129 14.080 13.239 7.608 1112 HE2 HIS 129 HE2 HIS 129 12.952 15.418 7.062 1113 H HIS 130 H HIS 130 13.744 17.727 14.086 1114 HA HIS 130 HA HIS 130 16.422 18.039 15.219 1115 HB2 HIS 130 2HB HIS 130 15.263 19.520 16.897 1116 HB3 HIS 130 3HB HIS 130 15.175 20.068 15.228 1117 HD1 HIS 130 HD1 HIS 130 13.011 18.327 17.817 1118 HD2 HIS 130 HD2 HIS 130 12.644 20.536 14.324 1119 HE1 HIS 130 HE1 HIS 130 10.558 18.749 17.546 1120 HE2 HIS 130 HE2 HIS 130 10.384 20.246 15.536 1121 H HIS 131 H HIS 131 16.995 16.091 16.097 1122 HA HIS 131 HA HIS 131 15.192 14.677 17.898 1123 HB2 HIS 131 2HB HIS 131 17.059 13.024 18.055 1124 HB3 HIS 131 3HB HIS 131 16.520 13.317 16.407 1125 HD1 HIS 131 HD1 HIS 131 18.221 14.213 14.761 1126 HD2 HIS 131 HD2 HIS 131 19.647 14.111 18.662 1127 HE1 HIS 131 HE1 HIS 131 20.674 14.693 14.590 1128 HE2 HIS 131 HE2 HIS 131 21.543 14.437 16.931 1129 H HIS 132 H HIS 132 16.063 17.321 18.688 1130 HA HIS 132 HA HIS 132 18.224 17.283 20.498 1131 HB2 HIS 132 2HB HIS 132 17.312 19.333 19.442 1132 HB3 HIS 132 3HB HIS 132 15.858 19.176 20.421 1133 HD1 HIS 132 HD1 HIS 132 19.400 20.279 20.555 1134 HD2 HIS 132 HD2 HIS 132 16.188 19.846 23.154 1135 HE1 HIS 132 HE1 HIS 132 20.046 21.537 22.630 1136 HE2 HIS 132 HE2 HIS 132 18.009 21.420 24.103 1137 H HIS 133 H HIS 133 18.137 15.730 22.064 1138 HA HIS 133 HA HIS 133 15.933 15.937 24.025 1139 HB2 HIS 133 2HB HIS 133 17.673 13.539 23.381 1140 HB3 HIS 133 3HB HIS 133 16.470 13.595 24.663 1141 HD1 HIS 133 HD1 HIS 133 16.879 12.830 21.124 1142 HD2 HIS 133 HD2 HIS 133 13.741 13.883 23.636 1143 HE1 HIS 133 HE1 HIS 133 14.788 12.185 19.895 1144 HE2 HIS 133 HE2 HIS 133 12.917 12.662 21.510 1145 H HIS 134 H HIS 134 16.474 16.070 26.214 1146 HA HIS 134 HA HIS 134 19.334 16.255 26.894 1147 HB2 HIS 134 2HB HIS 134 18.438 18.541 26.416 1148 HB3 HIS 134 3HB HIS 134 17.281 18.327 27.725 1149 HD1 HIS 134 HD1 HIS 134 18.450 17.899 30.161 1150 HD2 HIS 134 HD2 HIS 134 20.821 19.604 27.201 1151 HE1 HIS 134 HE1 HIS 134 20.391 18.940 31.366 1152 HE2 HIS 134 HE2 HIS 134 21.871 19.853 29.551 Start of MODEL 19 1 H1 MET 1 1H MET 1 0.172 8.500 12.299 2 H2 MET 1 2H MET 1 0.076 7.489 10.949 3 H3 MET 1 3H MET 1 1.159 8.791 10.959 4 HA MET 1 HA MET 1 2.450 7.802 12.695 5 HB2 MET 1 2HB MET 1 0.561 6.686 13.831 6 HB3 MET 1 3HB MET 1 0.465 5.518 12.522 7 HG2 MET 1 2HG MET 1 2.675 4.671 13.078 8 HG3 MET 1 3HG MET 1 2.837 5.884 14.346 9 HE1 MET 1 3HE MET 1 0.862 2.670 13.173 10 HE2 MET 1 1HE MET 1 -0.406 3.874 13.397 11 HE3 MET 1 2HE MET 1 -0.299 2.496 14.489 12 H ASN 2 H ASN 2 0.945 5.556 10.316 13 HA ASN 2 HA ASN 2 3.470 5.402 8.856 14 HB2 ASN 2 2HB ASN 2 3.388 3.639 10.747 15 HB3 ASN 2 3HB ASN 2 2.154 2.840 9.782 16 HD21 ASN 2 1HD2 ASN 2 4.797 1.914 10.558 17 HD22 ASN 2 2HD2 ASN 2 5.627 1.565 9.090 18 H ILE 3 H ILE 3 3.193 4.140 6.773 19 HA ILE 3 HA ILE 3 0.407 4.190 5.812 20 HB ILE 3 HB ILE 3 1.394 6.276 5.102 21 HG12 ILE 3 2HG1 ILE 3 1.282 4.350 2.759 22 HG13 ILE 3 3HG1 ILE 3 -0.115 5.108 3.517 23 HG21 ILE 3 1HG2 ILE 3 3.591 4.637 3.838 24 HG22 ILE 3 2HG2 ILE 3 3.748 5.671 5.258 25 HG23 ILE 3 3HG2 ILE 3 3.390 6.383 3.684 26 HD11 ILE 3 3HD1 ILE 3 0.720 7.305 2.848 27 HD12 ILE 3 1HD1 ILE 3 0.482 6.241 1.463 28 HD13 ILE 3 2HD1 ILE 3 2.109 6.540 2.075 29 H VAL 4 H VAL 4 -0.190 2.488 4.610 30 HA VAL 4 HA VAL 4 1.875 0.593 3.660 31 HB VAL 4 HB VAL 4 -1.008 -0.029 4.360 32 HG11 VAL 4 1HG1 VAL 4 -0.266 -2.382 4.270 33 HG12 VAL 4 2HG1 VAL 4 1.320 -1.844 3.719 34 HG13 VAL 4 3HG1 VAL 4 -0.103 -1.564 2.715 35 HG21 VAL 4 3HG2 VAL 4 0.217 0.616 6.371 36 HG22 VAL 4 1HG2 VAL 4 1.483 -0.554 5.988 37 HG23 VAL 4 2HG2 VAL 4 -0.145 -1.111 6.382 38 H ILE 5 H ILE 5 1.861 -0.005 1.510 39 HA ILE 5 HA ILE 5 -0.334 1.069 -0.168 40 HB ILE 5 HB ILE 5 2.567 0.703 -0.963 41 HG12 ILE 5 2HG1 ILE 5 0.991 3.252 -0.461 42 HG13 ILE 5 3HG1 ILE 5 2.208 2.583 0.623 43 HG21 ILE 5 1HG2 ILE 5 1.036 0.363 -2.839 44 HG22 ILE 5 2HG2 ILE 5 1.935 1.869 -3.030 45 HG23 ILE 5 3HG2 ILE 5 0.252 1.907 -2.496 46 HD11 ILE 5 3HD1 ILE 5 2.693 3.569 -2.181 47 HD12 ILE 5 1HD1 ILE 5 3.915 2.915 -1.088 48 HD13 ILE 5 2HD1 ILE 5 3.091 4.423 -0.690 49 H VAL 6 H VAL 6 -1.568 -0.482 -1.030 50 HA VAL 6 HA VAL 6 -0.472 -3.180 -1.469 51 HB VAL 6 HB VAL 6 -3.363 -2.262 -1.520 52 HG11 VAL 6 1HG1 VAL 6 -3.907 -4.657 -1.433 53 HG12 VAL 6 2HG1 VAL 6 -2.191 -5.050 -1.532 54 HG13 VAL 6 3HG1 VAL 6 -2.994 -4.254 -2.887 55 HG21 VAL 6 3HG2 VAL 6 -2.394 -2.046 0.717 56 HG22 VAL 6 1HG2 VAL 6 -1.844 -3.720 0.655 57 HG23 VAL 6 2HG2 VAL 6 -3.571 -3.358 0.667 58 H VAL 7 H VAL 7 0.113 -3.752 -3.492 59 HA VAL 7 HA VAL 7 -0.984 -2.194 -5.762 60 HB VAL 7 HB VAL 7 1.795 -3.383 -5.555 61 HG11 VAL 7 1HG1 VAL 7 0.565 -1.538 -7.610 62 HG12 VAL 7 2HG1 VAL 7 1.028 -3.222 -7.849 63 HG13 VAL 7 3HG1 VAL 7 2.265 -2.008 -7.542 64 HG21 VAL 7 3HG2 VAL 7 0.903 -0.513 -5.244 65 HG22 VAL 7 1HG2 VAL 7 2.577 -1.073 -5.293 66 HG23 VAL 7 2HG2 VAL 7 1.522 -1.556 -3.963 67 H PHE 8 H PHE 8 -2.321 -3.432 -6.953 68 HA PHE 8 HA PHE 8 -2.007 -6.320 -7.142 69 HB2 PHE 8 2HB PHE 8 -4.013 -4.385 -8.326 70 HB3 PHE 8 3HB PHE 8 -4.046 -6.114 -8.645 71 HD1 PHE 8 HD2 PHE 8 -4.284 -3.588 -5.931 72 HD2 PHE 8 HD1 PHE 8 -5.088 -7.591 -7.149 73 HE1 PHE 8 HE2 PHE 8 -5.647 -3.930 -3.912 74 HE2 PHE 8 HE1 PHE 8 -6.453 -7.937 -5.130 75 HZ PHE 8 HZ PHE 8 -6.733 -6.102 -3.510 76 H SER 9 H SER 9 0.121 -4.654 -8.370 77 HA SER 9 HA SER 9 -0.320 -4.735 -11.239 78 HB2 SER 9 2HB SER 9 0.928 -2.857 -10.256 79 HB3 SER 9 3HB SER 9 2.168 -3.973 -9.689 80 HG SER 9 HG SER 9 2.563 -4.503 -11.914 81 H THR 10 H THR 10 0.996 -6.839 -8.897 82 HA THR 10 HA THR 10 2.030 -8.845 -8.940 83 HB THR 10 HB THR 10 1.930 -10.308 -10.821 84 HG1 THR 10 HG1 THR 10 1.075 -8.240 -12.562 85 HG21 THR 10 3HG2 THR 10 -0.426 -10.156 -11.496 86 HG22 THR 10 1HG2 THR 10 -0.500 -8.509 -10.867 87 HG23 THR 10 2HG2 THR 10 -0.226 -9.863 -9.770 88 H ASP 11 H ASP 11 3.183 -7.194 -11.930 89 HA ASP 11 HA ASP 11 5.879 -8.119 -11.487 90 HB2 ASP 11 2HB ASP 11 6.432 -6.930 -13.532 91 HB3 ASP 11 3HB ASP 11 4.941 -7.836 -13.764 92 H GLU 12 H GLU 12 7.738 -6.801 -11.122 93 HA GLU 12 HA GLU 12 7.190 -4.571 -9.337 94 HB2 GLU 12 2HB GLU 12 8.838 -6.275 -8.670 95 HB3 GLU 12 3HB GLU 12 9.834 -5.854 -10.060 96 HG2 GLU 12 2HG GLU 12 10.157 -3.604 -9.164 97 HG3 GLU 12 3HG GLU 12 9.136 -3.997 -7.783 98 H GLU 13 H GLU 13 8.089 -4.951 -12.642 99 HA GLU 13 HA GLU 13 9.605 -2.640 -13.095 100 HB2 GLU 13 2HB GLU 13 9.317 -4.316 -14.835 101 HB3 GLU 13 3HB GLU 13 7.592 -3.980 -14.918 102 HG2 GLU 13 2HG GLU 13 8.105 -1.682 -15.672 103 HG3 GLU 13 3HG GLU 13 9.820 -2.086 -15.659 104 H THR 14 H THR 14 6.063 -3.028 -13.439 105 HA THR 14 HA THR 14 5.474 -0.293 -13.787 106 HB THR 14 HB THR 14 3.675 -2.379 -12.514 107 HG1 THR 14 HG1 THR 14 3.902 -3.277 -14.432 108 HG21 THR 14 3HG2 THR 14 1.846 -0.999 -13.392 109 HG22 THR 14 1HG2 THR 14 3.016 0.170 -14.009 110 HG23 THR 14 2HG2 THR 14 2.847 -0.079 -12.269 111 H LEU 15 H LEU 15 5.822 -2.291 -10.896 112 HA LEU 15 HA LEU 15 5.056 -0.356 -8.980 113 HB2 LEU 15 2HB LEU 15 5.208 -2.720 -8.431 114 HB3 LEU 15 3HB LEU 15 6.934 -2.712 -8.741 115 HG LEU 15 HG LEU 15 7.219 -1.118 -6.834 116 HD11 LEU 15 1HD1 LEU 15 4.313 -1.739 -6.306 117 HD12 LEU 15 2HD1 LEU 15 4.961 -0.183 -6.830 118 HD13 LEU 15 3HD1 LEU 15 5.394 -0.830 -5.249 119 HD21 LEU 15 3HD2 LEU 15 7.637 -3.485 -6.522 120 HD22 LEU 15 1HD2 LEU 15 5.927 -3.771 -6.198 121 HD23 LEU 15 2HD2 LEU 15 6.888 -2.807 -5.077 122 H ARG 16 H ARG 16 8.052 -0.873 -10.722 123 HA ARG 16 HA ARG 16 9.829 0.519 -9.063 124 HB2 ARG 16 2HB ARG 16 10.524 -0.886 -10.973 125 HB3 ARG 16 3HB ARG 16 9.892 0.322 -12.083 126 HG2 ARG 16 2HG ARG 16 11.552 1.908 -11.434 127 HG3 ARG 16 3HG ARG 16 12.073 0.900 -10.083 128 HD2 ARG 16 2HD ARG 16 13.641 0.762 -11.956 129 HD3 ARG 16 3HD ARG 16 12.881 -0.797 -11.640 130 HE ARG 16 HE ARG 16 12.035 0.994 -13.827 131 HH11 ARG 16 1HH1 ARG 16 12.756 -2.145 -12.608 132 HH12 ARG 16 2HH1 ARG 16 12.428 -2.926 -14.115 133 HH21 ARG 16 1HH2 ARG 16 11.616 -0.014 -15.753 134 HH22 ARG 16 2HH2 ARG 16 11.793 -1.729 -15.878 135 H LYS 17 H LYS 17 7.477 1.639 -11.375 136 HA LYS 17 HA LYS 17 8.206 4.356 -11.554 137 HB2 LYS 17 2HB LYS 17 5.417 3.167 -11.645 138 HB3 LYS 17 3HB LYS 17 5.909 4.719 -12.307 139 HG2 LYS 17 2HG LYS 17 6.960 2.054 -13.252 140 HG3 LYS 17 3HG LYS 17 5.634 2.935 -14.011 141 HD2 LYS 17 2HD LYS 17 8.447 3.997 -13.673 142 HD3 LYS 17 3HD LYS 17 7.813 3.274 -15.153 143 HE2 LYS 17 2HE LYS 17 6.067 5.034 -15.221 144 HE3 LYS 17 3HE LYS 17 6.799 5.777 -13.799 145 HZ1 LYS 17 3HZ LYS 17 7.489 6.818 -15.893 146 HZ2 LYS 17 1HZ LYS 17 8.188 5.360 -16.386 147 HZ3 LYS 17 2HZ LYS 17 8.798 6.177 -15.038 148 H PHE 18 H PHE 18 6.366 2.553 -9.166 149 HA PHE 18 HA PHE 18 5.409 4.846 -7.720 150 HB2 PHE 18 2HB PHE 18 5.516 1.913 -6.958 151 HB3 PHE 18 3HB PHE 18 4.697 3.158 -6.022 152 HD1 PHE 18 HD1 PHE 18 4.769 1.767 -9.494 153 HD2 PHE 18 HD2 PHE 18 2.435 3.468 -6.364 154 HE1 PHE 18 HE1 PHE 18 2.731 1.416 -10.823 155 HE2 PHE 18 HE2 PHE 18 0.397 3.123 -7.693 156 HZ PHE 18 HZ PHE 18 0.544 2.096 -9.926 157 H LYS 19 H LYS 19 7.858 2.328 -6.998 158 HA LYS 19 HA LYS 19 8.727 3.475 -4.571 159 HB2 LYS 19 2HB LYS 19 10.639 1.980 -4.694 160 HB3 LYS 19 3HB LYS 19 9.185 1.128 -5.194 161 HG2 LYS 19 2HG LYS 19 9.814 1.309 -7.507 162 HG3 LYS 19 3HG LYS 19 11.198 2.312 -7.085 163 HD2 LYS 19 2HD LYS 19 11.974 0.081 -7.524 164 HD3 LYS 19 3HD LYS 19 12.143 0.408 -5.800 165 HE2 LYS 19 2HE LYS 19 10.076 -0.852 -5.371 166 HE3 LYS 19 3HE LYS 19 9.912 -1.169 -7.098 167 HZ1 LYS 19 3HZ LYS 19 10.909 -3.059 -6.011 168 HZ2 LYS 19 1HZ LYS 19 12.129 -2.087 -5.349 169 HZ3 LYS 19 2HZ LYS 19 12.061 -2.326 -7.016 170 H ASP 20 H ASP 20 9.650 4.117 -7.893 171 HA ASP 20 HA ASP 20 11.938 5.677 -7.514 172 HB2 ASP 20 2HB ASP 20 11.245 5.021 -9.725 173 HB3 ASP 20 3HB ASP 20 9.715 5.874 -9.562 174 H ILE 21 H ILE 21 8.514 6.538 -7.268 175 HA ILE 21 HA ILE 21 8.918 9.323 -6.783 176 HB ILE 21 HB ILE 21 6.547 7.534 -6.190 177 HG12 ILE 21 2HG1 ILE 21 7.033 9.477 -8.470 178 HG13 ILE 21 3HG1 ILE 21 7.203 7.730 -8.589 179 HG21 ILE 21 1HG2 ILE 21 6.727 10.551 -6.155 180 HG22 ILE 21 2HG2 ILE 21 6.437 9.498 -4.771 181 HG23 ILE 21 3HG2 ILE 21 5.232 9.622 -6.053 182 HD11 ILE 21 3HD1 ILE 21 5.098 8.530 -9.523 183 HD12 ILE 21 1HD1 ILE 21 4.647 9.189 -7.952 184 HD13 ILE 21 2HD1 ILE 21 4.840 7.447 -8.158 185 H ILE 22 H ILE 22 8.333 6.527 -4.663 186 HA ILE 22 HA ILE 22 8.269 7.843 -2.198 187 HB ILE 22 HB ILE 22 9.371 5.082 -2.798 188 HG12 ILE 22 2HG1 ILE 22 6.589 5.955 -1.952 189 HG13 ILE 22 3HG1 ILE 22 7.042 5.408 -3.564 190 HG21 ILE 22 1HG2 ILE 22 10.084 5.866 -0.600 191 HG22 ILE 22 2HG2 ILE 22 8.892 4.579 -0.446 192 HG23 ILE 22 3HG2 ILE 22 8.415 6.255 -0.181 193 HD11 ILE 22 3HD1 ILE 22 7.107 3.760 -1.041 194 HD12 ILE 22 1HD1 ILE 22 7.600 3.204 -2.643 195 HD13 ILE 22 2HD1 ILE 22 5.920 3.649 -2.341 196 H LYS 23 H LYS 23 11.106 6.298 -3.764 197 HA LYS 23 HA LYS 23 13.005 7.252 -1.893 198 HB2 LYS 23 2HB LYS 23 13.377 6.380 -4.766 199 HB3 LYS 23 3HB LYS 23 14.694 6.691 -3.643 200 HG2 LYS 23 2HG LYS 23 13.810 4.887 -2.178 201 HG3 LYS 23 3HG LYS 23 12.595 4.536 -3.410 202 HD2 LYS 23 2HD LYS 23 14.350 4.015 -5.024 203 HD3 LYS 23 3HD LYS 23 15.589 4.440 -3.843 204 HE2 LYS 23 2HE LYS 23 14.765 2.604 -2.388 205 HE3 LYS 23 3HE LYS 23 13.623 2.153 -3.653 206 HZ1 LYS 23 3HZ LYS 23 15.472 1.692 -5.128 207 HZ2 LYS 23 1HZ LYS 23 15.639 0.797 -3.703 208 HZ3 LYS 23 2HZ LYS 23 16.579 2.180 -3.951 209 H LYS 24 H LYS 24 11.645 8.663 -4.805 210 HA LYS 24 HA LYS 24 13.422 10.776 -5.226 211 HB2 LYS 24 2HB LYS 24 11.444 10.059 -6.660 212 HB3 LYS 24 3HB LYS 24 10.422 10.963 -5.554 213 HG2 LYS 24 2HG LYS 24 11.689 13.013 -6.109 214 HG3 LYS 24 3HG LYS 24 12.638 12.083 -7.272 215 HD2 LYS 24 2HD LYS 24 9.681 12.688 -7.353 216 HD3 LYS 24 3HD LYS 24 10.921 13.198 -8.500 217 HE2 LYS 24 2HE LYS 24 9.945 10.375 -8.035 218 HE3 LYS 24 3HE LYS 24 9.601 11.386 -9.436 219 HZ1 LYS 24 3HZ LYS 24 12.323 10.503 -8.650 220 HZ2 LYS 24 1HZ LYS 24 11.891 11.311 -10.068 221 HZ3 LYS 24 2HZ LYS 24 11.369 9.727 -9.804 222 H ASN 25 H ASN 25 10.591 10.569 -3.092 223 HA ASN 25 HA ASN 25 10.955 13.220 -2.035 224 HB2 ASN 25 2HB ASN 25 9.175 10.926 -1.185 225 HB3 ASN 25 3HB ASN 25 9.150 12.523 -0.437 226 HD21 ASN 25 1HD2 ASN 25 7.098 11.068 -2.009 227 HD22 ASN 25 2HD2 ASN 25 6.665 12.155 -3.279 228 H GLY 26 H GLY 26 11.998 9.997 -1.098 229 HA2 GLY 26 2HA GLY 26 14.238 10.345 0.127 230 HA3 GLY 26 3HA GLY 26 13.241 11.136 1.334 231 H PHE 27 H PHE 27 11.049 9.190 1.069 232 HA PHE 27 HA PHE 27 11.818 7.539 3.205 233 HB2 PHE 27 2HB PHE 27 9.435 7.351 1.351 234 HB3 PHE 27 3HB PHE 27 9.615 6.404 2.822 235 HD1 PHE 27 HD2 PHE 27 9.182 9.826 1.495 236 HD2 PHE 27 HD1 PHE 27 9.170 7.347 4.961 237 HE1 PHE 27 HE2 PHE 27 8.169 11.652 2.796 238 HE2 PHE 27 HE1 PHE 27 8.158 9.170 6.263 239 HZ PHE 27 HZ PHE 27 7.656 11.325 5.184 240 H LYS 28 H LYS 28 12.023 5.271 3.384 241 HA LYS 28 HA LYS 28 13.349 3.977 1.159 242 HB2 LYS 28 2HB LYS 28 12.731 3.122 3.986 243 HB3 LYS 28 3HB LYS 28 13.472 2.034 2.823 244 HG2 LYS 28 2HG LYS 28 14.653 4.697 3.601 245 HG3 LYS 28 3HG LYS 28 15.058 3.172 4.395 246 HD2 LYS 28 2HD LYS 28 15.753 2.278 2.159 247 HD3 LYS 28 3HD LYS 28 15.500 3.891 1.490 248 HE2 LYS 28 2HE LYS 28 17.412 3.237 3.738 249 HE3 LYS 28 3HE LYS 28 17.872 3.414 2.046 250 HZ1 LYS 28 3HZ LYS 28 17.168 5.697 2.095 251 HZ2 LYS 28 1HZ LYS 28 18.256 5.431 3.358 252 HZ3 LYS 28 2HZ LYS 28 16.605 5.547 3.682 253 H VAL 29 H VAL 29 12.726 1.848 0.345 254 HA VAL 29 HA VAL 29 9.788 1.521 0.245 255 HB VAL 29 HB VAL 29 11.798 0.789 -1.904 256 HG11 VAL 29 1HG1 VAL 29 8.775 0.796 -1.946 257 HG12 VAL 29 2HG1 VAL 29 9.826 -0.622 -1.986 258 HG13 VAL 29 3HG1 VAL 29 9.818 0.509 -3.343 259 HG21 VAL 29 3HG2 VAL 29 11.647 3.215 -1.616 260 HG22 VAL 29 1HG2 VAL 29 9.895 3.133 -1.791 261 HG23 VAL 29 2HG2 VAL 29 10.937 2.709 -3.148 262 H ARG 30 H ARG 30 9.168 -0.216 1.400 263 HA ARG 30 HA ARG 30 10.906 -2.600 1.501 264 HB2 ARG 30 2HB ARG 30 10.099 -1.467 3.636 265 HB3 ARG 30 3HB ARG 30 8.484 -2.013 3.222 266 HG2 ARG 30 2HG ARG 30 9.517 -3.477 4.864 267 HG3 ARG 30 3HG ARG 30 9.226 -4.340 3.353 268 HD2 ARG 30 2HD ARG 30 11.488 -4.423 2.816 269 HD3 ARG 30 3HD ARG 30 11.890 -3.055 3.852 270 HE ARG 30 HE ARG 30 11.407 -4.634 5.756 271 HH11 ARG 30 1HH1 ARG 30 12.369 -5.880 2.687 272 HH12 ARG 30 2HH1 ARG 30 13.256 -7.187 3.379 273 HH21 ARG 30 1HH2 ARG 30 12.523 -6.311 6.630 274 HH22 ARG 30 2HH2 ARG 30 13.314 -7.453 5.594 275 H THR 31 H THR 31 10.400 -3.746 -0.339 276 HA THR 31 HA THR 31 7.669 -3.974 -1.273 277 HB THR 31 HB THR 31 8.597 -5.371 -3.086 278 HG1 THR 31 HG1 THR 31 10.310 -6.386 -2.002 279 HG21 THR 31 3HG2 THR 31 9.999 -3.646 -4.138 280 HG22 THR 31 1HG2 THR 31 10.162 -2.833 -2.581 281 HG23 THR 31 2HG2 THR 31 8.582 -2.941 -3.359 282 H VAL 32 H VAL 32 6.362 -5.244 -0.068 283 HA VAL 32 HA VAL 32 7.234 -7.827 0.929 284 HB VAL 32 HB VAL 32 4.507 -6.502 0.945 285 HG11 VAL 32 1HG1 VAL 32 5.377 -9.039 2.343 286 HG12 VAL 32 2HG1 VAL 32 4.276 -8.943 0.969 287 HG13 VAL 32 3HG1 VAL 32 3.813 -8.241 2.517 288 HG21 VAL 32 3HG2 VAL 32 6.171 -5.373 2.340 289 HG22 VAL 32 1HG2 VAL 32 6.526 -6.896 3.159 290 HG23 VAL 32 2HG2 VAL 32 4.935 -6.153 3.327 291 H ARG 33 H ARG 33 6.923 -9.755 -0.036 292 HA ARG 33 HA ARG 33 5.066 -9.999 -2.302 293 HB2 ARG 33 2HB ARG 33 6.866 -11.260 -3.561 294 HB3 ARG 33 3HB ARG 33 7.119 -9.526 -3.414 295 HG2 ARG 33 2HG ARG 33 8.684 -9.926 -1.552 296 HG3 ARG 33 3HG ARG 33 8.454 -11.664 -1.750 297 HD2 ARG 33 2HD ARG 33 10.523 -10.818 -2.827 298 HD3 ARG 33 3HD ARG 33 9.415 -11.590 -3.960 299 HE ARG 33 HE ARG 33 8.839 -9.424 -4.799 300 HH11 ARG 33 1HH1 ARG 33 11.474 -9.387 -2.572 301 HH12 ARG 33 2HH1 ARG 33 12.129 -7.923 -3.219 302 HH21 ARG 33 1HH2 ARG 33 9.652 -7.540 -5.582 303 HH22 ARG 33 2HH2 ARG 33 11.080 -6.858 -4.883 304 H SER 34 H SER 34 6.085 -11.194 0.582 305 HA SER 34 HA SER 34 4.856 -13.801 0.127 306 HB2 SER 34 2HB SER 34 7.625 -13.554 1.356 307 HB3 SER 34 3HB SER 34 6.710 -15.043 1.140 308 HG SER 34 HG SER 34 8.434 -14.223 -0.492 309 HA PRO 35 HA PRO 35 3.017 -13.189 4.123 310 HB2 PRO 35 2HB PRO 35 3.565 -15.693 5.293 311 HB3 PRO 35 3HB PRO 35 2.138 -15.268 4.346 312 HG2 PRO 35 2HG PRO 35 4.627 -16.679 3.498 313 HG3 PRO 35 3HG PRO 35 2.952 -16.935 2.974 314 HD2 PRO 35 2HD PRO 35 4.718 -15.664 1.410 315 HD3 PRO 35 3HD PRO 35 3.018 -15.148 1.476 316 H GLN 36 H GLN 36 6.285 -14.627 4.117 317 HA GLN 36 HA GLN 36 6.891 -13.947 6.806 318 HB2 GLN 36 2HB GLN 36 9.173 -14.479 6.303 319 HB3 GLN 36 3HB GLN 36 8.156 -15.629 5.448 320 HG2 GLN 36 2HG GLN 36 8.487 -14.405 3.367 321 HG3 GLN 36 3HG GLN 36 9.462 -13.207 4.214 322 HE21 GLN 36 1HE2 GLN 36 11.314 -13.584 3.024 323 HE22 GLN 36 2HE2 GLN 36 12.227 -15.047 3.146 324 H GLU 37 H GLU 37 7.425 -12.244 3.736 325 HA GLU 37 HA GLU 37 8.986 -10.115 4.667 326 HB2 GLU 37 2HB GLU 37 6.897 -10.003 2.471 327 HB3 GLU 37 3HB GLU 37 8.247 -8.899 2.678 328 HG2 GLU 37 2HG GLU 37 8.446 -11.831 2.010 329 HG3 GLU 37 3HG GLU 37 8.643 -10.492 0.882 330 H LEU 38 H LEU 38 5.452 -10.439 4.477 331 HA LEU 38 HA LEU 38 4.813 -7.840 5.376 332 HB2 LEU 38 2HB LEU 38 3.211 -9.348 4.260 333 HB3 LEU 38 3HB LEU 38 3.223 -10.399 5.664 334 HG LEU 38 HG LEU 38 2.293 -8.499 7.014 335 HD11 LEU 38 1HD1 LEU 38 1.290 -6.608 5.830 336 HD12 LEU 38 2HD1 LEU 38 1.973 -7.192 4.311 337 HD13 LEU 38 3HD1 LEU 38 3.038 -6.654 5.611 338 HD21 LEU 38 3HD2 LEU 38 0.846 -10.269 6.167 339 HD22 LEU 38 1HD2 LEU 38 0.645 -9.396 4.646 340 HD23 LEU 38 2HD2 LEU 38 0.011 -8.716 6.145 341 H LYS 39 H LYS 39 4.936 -10.930 7.170 342 HA LYS 39 HA LYS 39 4.289 -10.004 9.707 343 HB2 LYS 39 2HB LYS 39 4.474 -12.386 9.132 344 HB3 LYS 39 3HB LYS 39 6.216 -12.219 8.961 345 HG2 LYS 39 2HG LYS 39 6.362 -11.630 11.362 346 HG3 LYS 39 3HG LYS 39 4.628 -11.911 11.509 347 HD2 LYS 39 2HD LYS 39 6.584 -14.005 10.549 348 HD3 LYS 39 3HD LYS 39 6.111 -13.822 12.236 349 HE2 LYS 39 2HE LYS 39 4.787 -15.569 11.272 350 HE3 LYS 39 3HE LYS 39 3.739 -14.182 11.548 351 HZ1 LYS 39 3HZ LYS 39 4.939 -14.925 8.933 352 HZ2 LYS 39 1HZ LYS 39 3.869 -13.648 9.209 353 HZ3 LYS 39 2HZ LYS 39 3.346 -15.236 9.399 354 H ASP 40 H ASP 40 7.532 -10.334 8.265 355 HA ASP 40 HA ASP 40 8.922 -9.301 10.514 356 HB2 ASP 40 2HB ASP 40 9.765 -9.651 7.630 357 HB3 ASP 40 3HB ASP 40 10.862 -9.168 8.920 358 H SER 41 H SER 41 8.038 -7.793 7.399 359 HA SER 41 HA SER 41 9.328 -5.359 7.667 360 HB2 SER 41 2HB SER 41 7.710 -4.454 6.069 361 HB3 SER 41 3HB SER 41 8.142 -6.102 5.613 362 HG SER 41 HG SER 41 6.200 -6.821 6.320 363 H ILE 42 H ILE 42 6.028 -6.152 8.734 364 HA ILE 42 HA ILE 42 5.321 -3.634 9.715 365 HB ILE 42 HB ILE 42 4.376 -6.366 10.607 366 HG12 ILE 42 2HG1 ILE 42 3.183 -4.349 8.678 367 HG13 ILE 42 3HG1 ILE 42 4.003 -5.836 8.217 368 HG21 ILE 42 1HG2 ILE 42 3.144 -3.654 11.136 369 HG22 ILE 42 2HG2 ILE 42 3.905 -4.699 12.335 370 HG23 ILE 42 3HG2 ILE 42 2.419 -5.211 11.538 371 HD11 ILE 42 3HD1 ILE 42 2.257 -7.135 9.320 372 HD12 ILE 42 1HD1 ILE 42 1.605 -6.076 8.071 373 HD13 ILE 42 2HD1 ILE 42 1.436 -5.639 9.769 374 H GLU 43 H GLU 43 6.878 -6.359 11.442 375 HA GLU 43 HA GLU 43 6.877 -4.942 13.940 376 HB2 GLU 43 2HB GLU 43 8.193 -6.796 14.819 377 HB3 GLU 43 3HB GLU 43 6.800 -7.378 13.919 378 HG2 GLU 43 2HG GLU 43 8.230 -7.883 12.011 379 HG3 GLU 43 3HG GLU 43 9.632 -7.279 12.895 380 H GLU 44 H GLU 44 9.107 -5.140 11.244 381 HA GLU 44 HA GLU 44 11.351 -3.974 12.525 382 HB2 GLU 44 2HB GLU 44 10.433 -3.689 9.649 383 HB3 GLU 44 3HB GLU 44 12.000 -3.174 10.254 384 HG2 GLU 44 2HG GLU 44 12.491 -5.530 10.851 385 HG3 GLU 44 3HG GLU 44 10.960 -5.998 10.113 386 H LEU 45 H LEU 45 8.626 -2.530 10.768 387 HA LEU 45 HA LEU 45 9.417 0.140 10.837 388 HB2 LEU 45 2HB LEU 45 6.613 -0.990 10.824 389 HB3 LEU 45 3HB LEU 45 7.037 0.665 10.419 390 HG LEU 45 HG LEU 45 7.935 -1.788 8.889 391 HD11 LEU 45 1HD1 LEU 45 6.418 -1.016 7.143 392 HD12 LEU 45 2HD1 LEU 45 5.874 0.300 8.184 393 HD13 LEU 45 3HD1 LEU 45 5.547 -1.374 8.634 394 HD21 LEU 45 3HD2 LEU 45 8.745 -0.176 7.223 395 HD22 LEU 45 1HD2 LEU 45 9.574 0.006 8.768 396 HD23 LEU 45 2HD2 LEU 45 8.317 1.151 8.303 397 H VAL 46 H VAL 46 7.722 -1.716 13.326 398 HA VAL 46 HA VAL 46 7.072 0.600 14.904 399 HB VAL 46 HB VAL 46 5.738 -1.484 15.028 400 HG11 VAL 46 1HG1 VAL 46 8.110 -2.629 16.507 401 HG12 VAL 46 2HG1 VAL 46 7.571 -3.105 14.896 402 HG13 VAL 46 3HG1 VAL 46 6.537 -3.403 16.295 403 HG21 VAL 46 3HG2 VAL 46 5.432 -1.489 17.462 404 HG22 VAL 46 1HG2 VAL 46 5.609 0.149 16.835 405 HG23 VAL 46 2HG2 VAL 46 6.960 -0.631 17.657 406 H LYS 47 H LYS 47 9.800 -1.573 14.708 407 HA LYS 47 HA LYS 47 11.006 -0.675 17.193 408 HB2 LYS 47 2HB LYS 47 12.199 -2.301 14.929 409 HB3 LYS 47 3HB LYS 47 12.917 -2.068 16.515 410 HG2 LYS 47 2HG LYS 47 10.281 -3.446 16.027 411 HG3 LYS 47 3HG LYS 47 11.828 -4.277 16.200 412 HD2 LYS 47 2HD LYS 47 12.067 -3.333 18.462 413 HD3 LYS 47 3HD LYS 47 10.505 -2.527 18.284 414 HE2 LYS 47 2HE LYS 47 10.329 -4.617 19.572 415 HE3 LYS 47 3HE LYS 47 9.386 -4.670 18.084 416 HZ1 LYS 47 3HZ LYS 47 10.575 -6.730 18.426 417 HZ2 LYS 47 1HZ LYS 47 12.056 -5.919 18.500 418 HZ3 LYS 47 2HZ LYS 47 11.178 -5.954 17.053 419 H LYS 48 H LYS 48 11.901 -0.487 13.761 420 HA LYS 48 HA LYS 48 13.058 2.181 14.113 421 HB2 LYS 48 2HB LYS 48 14.578 -0.110 12.820 422 HB3 LYS 48 3HB LYS 48 15.141 1.546 13.000 423 HG2 LYS 48 2HG LYS 48 15.256 1.285 15.404 424 HG3 LYS 48 3HG LYS 48 14.580 -0.342 15.285 425 HD2 LYS 48 2HD LYS 48 16.543 -1.046 13.970 426 HD3 LYS 48 3HD LYS 48 17.215 0.578 14.120 427 HE2 LYS 48 2HE LYS 48 16.641 -1.324 16.396 428 HE3 LYS 48 3HE LYS 48 18.230 -0.955 15.730 429 HZ1 LYS 48 3HZ LYS 48 16.424 0.897 17.187 430 HZ2 LYS 48 1HZ LYS 48 17.829 1.399 16.384 431 HZ3 LYS 48 2HZ LYS 48 17.936 0.328 17.689 432 H TYR 49 H TYR 49 14.079 2.621 11.652 433 HA TYR 49 HA TYR 49 13.681 2.955 9.434 434 HB2 TYR 49 2HB TYR 49 12.203 0.318 9.469 435 HB3 TYR 49 3HB TYR 49 13.037 1.064 8.111 436 HD1 TYR 49 HD2 TYR 49 15.649 1.503 8.566 437 HD2 TYR 49 HD1 TYR 49 13.272 -1.414 10.571 438 HE1 TYR 49 HE2 TYR 49 17.681 0.250 9.150 439 HE2 TYR 49 HE1 TYR 49 15.304 -2.667 11.158 440 HH TYR 49 HH TYR 49 17.623 -2.918 10.308 441 H ASN 50 H ASN 50 11.575 3.852 11.378 442 HA ASN 50 HA ASN 50 8.985 3.414 10.432 443 HB2 ASN 50 2HB ASN 50 9.645 4.538 12.603 444 HB3 ASN 50 3HB ASN 50 9.946 6.005 11.674 445 HD21 ASN 50 1HD2 ASN 50 8.166 7.090 10.733 446 HD22 ASN 50 2HD2 ASN 50 6.552 6.795 11.268 447 H ALA 51 H ALA 51 11.509 5.342 9.082 448 HA ALA 51 HA ALA 51 9.777 6.880 7.331 449 HB1 ALA 51 3HB ALA 51 11.883 7.823 8.183 450 HB2 ALA 51 1HB ALA 51 11.843 7.786 6.420 451 HB3 ALA 51 2HB ALA 51 12.784 6.586 7.307 452 H THR 52 H THR 52 10.062 3.785 7.273 453 HA THR 52 HA THR 52 10.709 3.473 4.406 454 HB THR 52 HB THR 52 10.475 1.316 6.531 455 HG1 THR 52 HG1 THR 52 12.351 2.356 6.960 456 HG21 THR 52 3HG2 THR 52 11.473 1.167 3.677 457 HG22 THR 52 1HG2 THR 52 9.955 0.497 4.274 458 HG23 THR 52 2HG2 THR 52 11.491 -0.153 4.847 459 H ILE 53 H ILE 53 8.956 3.494 3.115 460 HA ILE 53 HA ILE 53 6.318 2.907 4.132 461 HB ILE 53 HB ILE 53 7.208 3.464 1.288 462 HG12 ILE 53 2HG1 ILE 53 6.035 5.276 3.425 463 HG13 ILE 53 3HG1 ILE 53 7.658 5.364 2.751 464 HG21 ILE 53 1HG2 ILE 53 5.084 2.240 1.384 465 HG22 ILE 53 2HG2 ILE 53 4.843 3.897 0.832 466 HG23 ILE 53 3HG2 ILE 53 4.432 3.452 2.489 467 HD11 ILE 53 3HD1 ILE 53 6.208 7.099 1.860 468 HD12 ILE 53 1HD1 ILE 53 5.103 5.873 1.241 469 HD13 ILE 53 2HD1 ILE 53 6.740 5.997 0.592 470 H VAL 54 H VAL 54 5.378 0.966 4.191 471 HA VAL 54 HA VAL 54 6.677 -1.308 2.940 472 HB VAL 54 HB VAL 54 5.947 -1.593 5.218 473 HG11 VAL 54 1HG1 VAL 54 3.142 -1.019 4.249 474 HG12 VAL 54 2HG1 VAL 54 4.126 0.023 5.279 475 HG13 VAL 54 3HG1 VAL 54 3.585 -1.547 5.876 476 HG21 VAL 54 3HG2 VAL 54 5.885 -3.569 3.794 477 HG22 VAL 54 1HG2 VAL 54 4.219 -3.212 3.338 478 HG23 VAL 54 2HG2 VAL 54 4.605 -3.639 5.005 479 H VAL 55 H VAL 55 6.223 -1.891 0.936 480 HA VAL 55 HA VAL 55 3.558 -1.316 -0.195 481 HB VAL 55 HB VAL 55 6.146 -1.877 -1.667 482 HG11 VAL 55 1HG1 VAL 55 4.919 -1.119 -3.658 483 HG12 VAL 55 2HG1 VAL 55 3.452 -0.960 -2.692 484 HG13 VAL 55 3HG1 VAL 55 4.176 -2.549 -2.942 485 HG21 VAL 55 3HG2 VAL 55 6.114 0.521 -2.239 486 HG22 VAL 55 1HG2 VAL 55 6.265 0.259 -0.501 487 HG23 VAL 55 2HG2 VAL 55 4.714 0.745 -1.189 488 H VAL 56 H VAL 56 2.280 -3.057 -0.016 489 HA VAL 56 HA VAL 56 3.357 -5.758 -0.169 490 HB VAL 56 HB VAL 56 0.484 -4.890 0.235 491 HG11 VAL 56 1HG1 VAL 56 0.193 -7.158 1.172 492 HG12 VAL 56 2HG1 VAL 56 1.856 -7.542 0.719 493 HG13 VAL 56 3HG1 VAL 56 0.661 -7.191 -0.530 494 HG21 VAL 56 3HG2 VAL 56 2.585 -5.597 2.294 495 HG22 VAL 56 1HG2 VAL 56 0.880 -5.288 2.631 496 HG23 VAL 56 2HG2 VAL 56 1.905 -3.994 2.010 497 H VAL 57 H VAL 57 3.786 -6.441 -2.199 498 HA VAL 57 HA VAL 57 2.094 -5.707 -4.439 499 HB VAL 57 HB VAL 57 4.422 -7.644 -4.426 500 HG11 VAL 57 1HG1 VAL 57 4.530 -7.143 -6.831 501 HG12 VAL 57 2HG1 VAL 57 3.104 -6.115 -6.678 502 HG13 VAL 57 3HG1 VAL 57 2.975 -7.850 -6.383 503 HG21 VAL 57 3HG2 VAL 57 5.149 -5.474 -3.584 504 HG22 VAL 57 1HG2 VAL 57 4.416 -4.670 -4.973 505 HG23 VAL 57 2HG2 VAL 57 5.792 -5.752 -5.204 506 H VAL 58 H VAL 58 0.289 -6.770 -4.900 507 HA VAL 58 HA VAL 58 0.045 -9.595 -4.075 508 HB VAL 58 HB VAL 58 -2.348 -9.202 -3.692 509 HG11 VAL 58 1HG1 VAL 58 -2.137 -7.859 -1.639 510 HG12 VAL 58 2HG1 VAL 58 -0.549 -7.308 -2.173 511 HG13 VAL 58 3HG1 VAL 58 -0.813 -9.013 -1.810 512 HG21 VAL 58 3HG2 VAL 58 -3.248 -6.917 -3.644 513 HG22 VAL 58 1HG2 VAL 58 -2.697 -7.357 -5.260 514 HG23 VAL 58 2HG2 VAL 58 -1.712 -6.296 -4.251 515 H ASP 59 H ASP 59 -1.768 -10.742 -5.214 516 HA ASP 59 HA ASP 59 -2.395 -9.860 -7.908 517 HB2 ASP 59 2HB ASP 59 -1.567 -11.952 -8.952 518 HB3 ASP 59 3HB ASP 59 -0.263 -10.997 -8.254 519 H ASP 60 H ASP 60 -2.627 -12.435 -5.486 520 HA ASP 60 HA ASP 60 -5.257 -13.246 -6.421 521 HB2 ASP 60 2HB ASP 60 -3.729 -14.982 -5.682 522 HB3 ASP 60 3HB ASP 60 -3.517 -14.187 -4.127 523 H LYS 61 H LYS 61 -7.196 -12.944 -5.271 524 HA LYS 61 HA LYS 61 -7.395 -10.480 -3.884 525 HB2 LYS 61 2HB LYS 61 -9.174 -11.621 -5.326 526 HB3 LYS 61 3HB LYS 61 -9.539 -12.605 -3.916 527 HG2 LYS 61 2HG LYS 61 -10.147 -10.637 -2.642 528 HG3 LYS 61 3HG LYS 61 -9.656 -9.589 -3.974 529 HD2 LYS 61 2HD LYS 61 -11.996 -9.708 -4.157 530 HD3 LYS 61 3HD LYS 61 -11.405 -10.837 -5.374 531 HE2 LYS 61 2HE LYS 61 -13.213 -11.909 -4.249 532 HE3 LYS 61 3HE LYS 61 -11.729 -12.675 -3.679 533 HZ1 LYS 61 3HZ LYS 61 -13.308 -10.608 -2.246 534 HZ2 LYS 61 1HZ LYS 61 -11.832 -11.235 -1.710 535 HZ3 LYS 61 2HZ LYS 61 -13.179 -12.243 -1.835 536 H GLU 62 H GLU 62 -7.618 -13.857 -2.718 537 HA GLU 62 HA GLU 62 -8.099 -13.256 -0.002 538 HB2 GLU 62 2HB GLU 62 -7.004 -15.625 -1.468 539 HB3 GLU 62 3HB GLU 62 -6.819 -15.571 0.278 540 HG2 GLU 62 2HG GLU 62 -9.468 -15.277 -1.123 541 HG3 GLU 62 3HG GLU 62 -8.825 -16.816 -0.551 542 H TRP 63 H TRP 63 -5.053 -13.740 -1.770 543 HA TRP 63 HA TRP 63 -3.267 -13.358 0.347 544 HB2 TRP 63 2HB TRP 63 -2.411 -14.169 -1.723 545 HB3 TRP 63 3HB TRP 63 -3.035 -12.785 -2.612 546 HD1 TRP 63 HD1 TRP 63 -1.090 -11.343 -3.404 547 HE1 TRP 63 HE1 TRP 63 1.148 -10.533 -2.427 548 HE3 TRP 63 HE3 TRP 63 -1.240 -13.770 1.103 549 HZ2 TRP 63 HZ2 TRP 63 2.651 -10.878 -0.073 550 HZ3 TRP 63 HZ3 TRP 63 0.644 -13.473 2.660 551 HH2 TRP 63 HH2 TRP 63 2.549 -12.054 2.081 552 H ALA 64 H ALA 64 -4.755 -10.950 -1.813 553 HA ALA 64 HA ALA 64 -3.513 -8.659 -0.753 554 HB1 ALA 64 3HB ALA 64 -6.260 -8.876 -1.991 555 HB2 ALA 64 1HB ALA 64 -4.746 -8.678 -2.876 556 HB3 ALA 64 2HB ALA 64 -5.312 -7.400 -1.802 557 H GLU 65 H GLU 65 -6.692 -10.080 0.024 558 HA GLU 65 HA GLU 65 -7.284 -8.267 2.123 559 HB2 GLU 65 2HB GLU 65 -8.402 -11.024 1.571 560 HB3 GLU 65 3HB GLU 65 -9.071 -9.878 2.727 561 HG2 GLU 65 2HG GLU 65 -9.383 -8.276 0.820 562 HG3 GLU 65 3HG GLU 65 -8.932 -9.587 -0.268 563 H LYS 66 H LYS 66 -5.373 -11.163 2.013 564 HA LYS 66 HA LYS 66 -5.429 -11.890 4.734 565 HB2 LYS 66 2HB LYS 66 -4.447 -13.233 2.831 566 HB3 LYS 66 3HB LYS 66 -3.057 -12.156 2.869 567 HG2 LYS 66 2HG LYS 66 -2.671 -12.834 5.238 568 HG3 LYS 66 3HG LYS 66 -3.979 -14.006 5.068 569 HD2 LYS 66 2HD LYS 66 -1.379 -13.943 3.525 570 HD3 LYS 66 3HD LYS 66 -1.859 -15.123 4.745 571 HE2 LYS 66 2HE LYS 66 -3.164 -14.702 2.051 572 HE3 LYS 66 3HE LYS 66 -2.112 -16.043 2.503 573 HZ1 LYS 66 3HZ LYS 66 -4.457 -16.639 2.585 574 HZ2 LYS 66 1HZ LYS 66 -4.742 -15.447 3.746 575 HZ3 LYS 66 2HZ LYS 66 -3.743 -16.765 4.108 576 H ALA 67 H ALA 67 -3.354 -9.629 2.952 577 HA ALA 67 HA ALA 67 -1.696 -8.810 5.053 578 HB1 ALA 67 3HB ALA 67 -2.710 -7.193 2.710 579 HB2 ALA 67 1HB ALA 67 -1.272 -8.215 2.727 580 HB3 ALA 67 2HB ALA 67 -1.336 -6.769 3.735 581 H ILE 68 H ILE 68 -4.710 -7.276 3.883 582 HA ILE 68 HA ILE 68 -4.949 -5.332 5.885 583 HB ILE 68 HB ILE 68 -7.224 -6.725 4.445 584 HG12 ILE 68 2HG1 ILE 68 -5.573 -5.851 2.849 585 HG13 ILE 68 3HG1 ILE 68 -7.055 -4.905 2.787 586 HG21 ILE 68 1HG2 ILE 68 -8.001 -5.414 6.334 587 HG22 ILE 68 2HG2 ILE 68 -8.443 -4.614 4.827 588 HG23 ILE 68 3HG2 ILE 68 -7.083 -4.016 5.776 589 HD11 ILE 68 3HD1 ILE 68 -4.495 -4.115 4.167 590 HD12 ILE 68 1HD1 ILE 68 -5.984 -3.168 4.154 591 HD13 ILE 68 2HD1 ILE 68 -5.116 -3.469 2.648 592 H ARG 69 H ARG 69 -6.016 -8.687 5.820 593 HA ARG 69 HA ARG 69 -7.577 -8.776 8.145 594 HB2 ARG 69 2HB ARG 69 -7.376 -10.573 6.405 595 HB3 ARG 69 3HB ARG 69 -5.793 -10.970 7.052 596 HG2 ARG 69 2HG ARG 69 -6.873 -11.510 9.228 597 HG3 ARG 69 3HG ARG 69 -8.444 -11.233 8.465 598 HD2 ARG 69 2HD ARG 69 -7.816 -12.972 6.760 599 HD3 ARG 69 3HD ARG 69 -6.392 -13.328 7.736 600 HE ARG 69 HE ARG 69 -9.102 -13.585 8.864 601 HH11 ARG 69 1HH1 ARG 69 -6.010 -14.937 8.152 602 HH12 ARG 69 2HH1 ARG 69 -6.382 -16.453 8.895 603 HH21 ARG 69 1HH2 ARG 69 -9.568 -15.537 9.803 604 HH22 ARG 69 2HH2 ARG 69 -8.373 -16.793 9.810 605 H PHE 70 H PHE 70 -4.094 -9.428 7.717 606 HA PHE 70 HA PHE 70 -3.551 -9.890 10.465 607 HB2 PHE 70 2HB PHE 70 -2.096 -10.653 8.588 608 HB3 PHE 70 3HB PHE 70 -1.628 -8.980 8.306 609 HD1 PHE 70 HD1 PHE 70 -1.510 -11.728 10.796 610 HD2 PHE 70 HD2 PHE 70 0.105 -7.981 9.567 611 HE1 PHE 70 HE1 PHE 70 0.303 -11.968 12.443 612 HE2 PHE 70 HE2 PHE 70 1.919 -8.221 11.210 613 HZ PHE 70 HZ PHE 70 2.020 -10.215 12.649 614 H VAL 71 H VAL 71 -3.259 -6.983 8.421 615 HA VAL 71 HA VAL 71 -2.169 -5.256 10.346 616 HB VAL 71 HB VAL 71 -4.048 -4.559 8.070 617 HG11 VAL 71 1HG1 VAL 71 -3.139 -2.291 8.234 618 HG12 VAL 71 2HG1 VAL 71 -2.181 -2.764 9.637 619 HG13 VAL 71 3HG1 VAL 71 -3.941 -2.758 9.734 620 HG21 VAL 71 3HG2 VAL 71 -2.006 -4.010 6.832 621 HG22 VAL 71 1HG2 VAL 71 -2.016 -5.704 7.323 622 HG23 VAL 71 2HG2 VAL 71 -1.025 -4.538 8.200 623 H LYS 72 H LYS 72 -5.548 -6.112 9.677 624 HA LYS 72 HA LYS 72 -6.808 -4.435 11.539 625 HB2 LYS 72 2HB LYS 72 -7.895 -5.923 9.780 626 HB3 LYS 72 3HB LYS 72 -7.653 -7.272 10.876 627 HG2 LYS 72 2HG LYS 72 -9.219 -4.821 11.664 628 HG3 LYS 72 3HG LYS 72 -9.960 -6.183 10.831 629 HD2 LYS 72 2HD LYS 72 -8.560 -6.293 13.510 630 HD3 LYS 72 3HD LYS 72 -10.304 -6.316 13.253 631 HE2 LYS 72 2HE LYS 72 -10.052 -8.425 11.976 632 HE3 LYS 72 3HE LYS 72 -8.325 -8.410 12.336 633 HZ1 LYS 72 3HZ LYS 72 -8.905 -8.493 14.717 634 HZ2 LYS 72 1HZ LYS 72 -9.462 -9.845 13.865 635 HZ3 LYS 72 2HZ LYS 72 -10.542 -8.621 14.301 636 H SER 73 H SER 73 -5.402 -7.672 11.919 637 HA SER 73 HA SER 73 -6.027 -8.105 14.623 638 HB2 SER 73 2HB SER 73 -5.214 -9.915 13.217 639 HB3 SER 73 3HB SER 73 -3.665 -9.105 13.004 640 HG SER 73 HG SER 73 -4.626 -9.822 15.574 641 H LEU 74 H LEU 74 -3.492 -6.170 13.162 642 HA LEU 74 HA LEU 74 -1.866 -5.813 15.454 643 HB2 LEU 74 2HB LEU 74 -2.353 -3.882 13.177 644 HB3 LEU 74 3HB LEU 74 -1.032 -3.793 14.330 645 HG LEU 74 HG LEU 74 -1.454 -6.023 12.333 646 HD11 LEU 74 1HD1 LEU 74 0.512 -5.080 11.209 647 HD12 LEU 74 2HD1 LEU 74 0.520 -3.739 12.353 648 HD13 LEU 74 3HD1 LEU 74 -0.833 -3.941 11.239 649 HD21 LEU 74 3HD2 LEU 74 0.850 -5.495 14.222 650 HD22 LEU 74 1HD2 LEU 74 0.778 -6.769 13.006 651 HD23 LEU 74 2HD2 LEU 74 -0.332 -6.794 14.374 652 H GLY 75 H GLY 75 -4.718 -4.089 14.269 653 HA2 GLY 75 2HA GLY 75 -6.253 -2.804 15.430 654 HA3 GLY 75 3HA GLY 75 -5.347 -3.108 16.901 655 H ALA 76 H ALA 76 -3.459 -1.862 14.347 656 HA ALA 76 HA ALA 76 -3.270 0.708 15.749 657 HB1 ALA 76 3HB ALA 76 -1.439 -0.465 13.655 658 HB2 ALA 76 1HB ALA 76 -1.189 -0.536 15.401 659 HB3 ALA 76 2HB ALA 76 -1.169 1.021 14.569 660 H GLN 77 H GLN 77 -3.132 2.679 14.573 661 HA GLN 77 HA GLN 77 -4.997 2.753 12.323 662 HB2 GLN 77 2HB GLN 77 -4.942 5.273 12.798 663 HB3 GLN 77 3HB GLN 77 -5.696 4.240 14.002 664 HG2 GLN 77 2HG GLN 77 -2.829 5.119 14.247 665 HG3 GLN 77 3HG GLN 77 -4.161 6.111 14.824 666 HE21 GLN 77 1HE2 GLN 77 -2.008 4.857 16.336 667 HE22 GLN 77 2HE2 GLN 77 -2.770 3.821 17.488 668 H VAL 78 H VAL 78 -4.002 2.509 10.401 669 HA VAL 78 HA VAL 78 -1.730 4.294 9.781 670 HB VAL 78 HB VAL 78 -0.769 2.572 8.308 671 HG11 VAL 78 1HG1 VAL 78 0.104 1.078 10.058 672 HG12 VAL 78 2HG1 VAL 78 -1.159 1.641 11.156 673 HG13 VAL 78 3HG1 VAL 78 0.077 2.764 10.582 674 HG21 VAL 78 3HG2 VAL 78 -2.778 1.308 7.767 675 HG22 VAL 78 1HG2 VAL 78 -2.908 0.756 9.439 676 HG23 VAL 78 2HG2 VAL 78 -1.548 0.238 8.441 677 H LEU 79 H LEU 79 -1.542 4.957 7.579 678 HA LEU 79 HA LEU 79 -4.113 5.131 6.187 679 HB2 LEU 79 2HB LEU 79 -2.857 7.196 6.595 680 HB3 LEU 79 3HB LEU 79 -1.480 6.549 5.727 681 HG LEU 79 HG LEU 79 -2.787 6.563 3.635 682 HD11 LEU 79 1HD1 LEU 79 -4.954 7.843 5.304 683 HD12 LEU 79 2HD1 LEU 79 -5.018 6.248 4.557 684 HD13 LEU 79 3HD1 LEU 79 -4.959 7.690 3.548 685 HD21 LEU 79 3HD2 LEU 79 -2.798 9.220 5.072 686 HD22 LEU 79 1HD2 LEU 79 -2.844 8.979 3.325 687 HD23 LEU 79 2HD2 LEU 79 -1.416 8.504 4.242 688 H ILE 80 H ILE 80 -4.486 4.245 4.147 689 HA ILE 80 HA ILE 80 -2.318 2.539 3.078 690 HB ILE 80 HB ILE 80 -5.269 1.868 3.209 691 HG12 ILE 80 2HG1 ILE 80 -2.904 0.668 4.687 692 HG13 ILE 80 3HG1 ILE 80 -4.135 1.705 5.397 693 HG21 ILE 80 1HG2 ILE 80 -4.598 -0.345 2.343 694 HG22 ILE 80 2HG2 ILE 80 -2.954 0.253 2.126 695 HG23 ILE 80 3HG2 ILE 80 -4.277 0.949 1.192 696 HD11 ILE 80 3HD1 ILE 80 -5.825 0.010 4.981 697 HD12 ILE 80 1HD1 ILE 80 -4.494 -0.643 5.934 698 HD13 ILE 80 2HD1 ILE 80 -4.617 -1.024 4.217 699 H ILE 81 H ILE 81 -1.956 2.555 0.920 700 HA ILE 81 HA ILE 81 -3.906 3.919 -0.844 701 HB ILE 81 HB ILE 81 -0.909 3.694 -1.243 702 HG12 ILE 81 2HG1 ILE 81 -2.623 6.102 -0.555 703 HG13 ILE 81 3HG1 ILE 81 -1.453 5.321 0.505 704 HG21 ILE 81 1HG2 ILE 81 -1.276 5.186 -3.178 705 HG22 ILE 81 2HG2 ILE 81 -3.017 5.065 -2.921 706 HG23 ILE 81 3HG2 ILE 81 -2.089 3.631 -3.362 707 HD11 ILE 81 3HD1 ILE 81 -0.507 7.338 -0.398 708 HD12 ILE 81 1HD1 ILE 81 -0.853 6.809 -2.045 709 HD13 ILE 81 2HD1 ILE 81 0.340 5.948 -1.074 710 H ILE 82 H ILE 82 -4.796 2.653 -2.402 711 HA ILE 82 HA ILE 82 -3.508 0.044 -2.944 712 HB ILE 82 HB ILE 82 -6.470 0.654 -3.104 713 HG12 ILE 82 2HG1 ILE 82 -4.936 -0.875 -0.974 714 HG13 ILE 82 3HG1 ILE 82 -5.615 0.737 -0.773 715 HG21 ILE 82 1HG2 ILE 82 -5.759 -1.128 -4.613 716 HG22 ILE 82 2HG2 ILE 82 -6.705 -1.793 -3.281 717 HG23 ILE 82 3HG2 ILE 82 -4.947 -1.955 -3.281 718 HD11 ILE 82 3HD1 ILE 82 -7.026 -0.947 0.251 719 HD12 ILE 82 1HD1 ILE 82 -7.184 -1.778 -1.295 720 HD13 ILE 82 2HD1 ILE 82 -7.858 -0.162 -1.090 721 H TYR 83 H TYR 83 -3.126 -0.543 -5.010 722 HA TYR 83 HA TYR 83 -4.023 1.277 -7.160 723 HB2 TYR 83 2HB TYR 83 -1.653 1.558 -6.852 724 HB3 TYR 83 3HB TYR 83 -1.386 -0.181 -6.853 725 HD1 TYR 83 HD2 TYR 83 -2.526 2.631 -9.028 726 HD2 TYR 83 HD1 TYR 83 -0.894 -1.303 -8.873 727 HE1 TYR 83 HE2 TYR 83 -2.151 2.693 -11.455 728 HE2 TYR 83 HE1 TYR 83 -0.519 -1.246 -11.302 729 HH TYR 83 HH TYR 83 -1.351 -0.093 -13.267 730 H ASP 84 H ASP 84 -5.249 0.405 -8.678 731 HA ASP 84 HA ASP 84 -4.626 -2.210 -9.767 732 HB2 ASP 84 2HB ASP 84 -6.284 -2.712 -7.971 733 HB3 ASP 84 3HB ASP 84 -7.431 -1.634 -8.765 734 H GLN 85 H GLN 85 -5.705 -2.601 -11.809 735 HA GLN 85 HA GLN 85 -5.566 -0.300 -13.464 736 HB2 GLN 85 2HB GLN 85 -6.495 -3.112 -14.054 737 HB3 GLN 85 3HB GLN 85 -6.155 -1.895 -15.280 738 HG2 GLN 85 2HG GLN 85 -4.174 -3.069 -13.330 739 HG3 GLN 85 3HG GLN 85 -4.315 -3.472 -15.039 740 HE21 GLN 85 1HE2 GLN 85 -4.794 -0.689 -15.838 741 HE22 GLN 85 2HE2 GLN 85 -3.266 0.103 -15.705 742 H ASP 86 H ASP 86 -8.305 -2.266 -12.324 743 HA ASP 86 HA ASP 86 -10.178 -0.666 -13.909 744 HB2 ASP 86 2HB ASP 86 -10.614 -3.115 -12.185 745 HB3 ASP 86 3HB ASP 86 -11.871 -2.311 -13.118 746 H GLN 87 H GLN 87 -11.362 0.957 -13.091 747 HA GLN 87 HA GLN 87 -10.849 1.958 -10.500 748 HB2 GLN 87 2HB GLN 87 -13.042 2.695 -12.451 749 HB3 GLN 87 3HB GLN 87 -12.633 3.613 -11.006 750 HG2 GLN 87 2HG GLN 87 -10.357 3.956 -11.916 751 HG3 GLN 87 3HG GLN 87 -10.853 3.131 -13.391 752 HE21 GLN 87 1HE2 GLN 87 -12.285 4.165 -14.788 753 HE22 GLN 87 2HE2 GLN 87 -12.611 5.856 -14.681 754 H ASN 88 H ASN 88 -13.675 0.209 -11.799 755 HA ASN 88 HA ASN 88 -15.212 0.401 -9.410 756 HB2 ASN 88 2HB ASN 88 -16.145 -0.112 -11.677 757 HB3 ASN 88 3HB ASN 88 -15.424 -1.716 -11.567 758 HD21 ASN 88 1HD2 ASN 88 -17.364 -2.795 -11.620 759 HD22 ASN 88 2HD2 ASN 88 -18.501 -2.750 -10.324 760 H ARG 89 H ARG 89 -13.075 -2.139 -10.683 761 HA ARG 89 HA ARG 89 -13.293 -4.012 -8.610 762 HB2 ARG 89 2HB ARG 89 -12.154 -4.544 -10.685 763 HB3 ARG 89 3HB ARG 89 -10.953 -3.297 -10.394 764 HG2 ARG 89 2HG ARG 89 -9.944 -5.403 -9.951 765 HG3 ARG 89 3HG ARG 89 -10.180 -4.591 -8.406 766 HD2 ARG 89 2HD ARG 89 -12.100 -5.963 -7.916 767 HD3 ARG 89 3HD ARG 89 -12.058 -6.673 -9.531 768 HE ARG 89 HE ARG 89 -9.621 -7.087 -8.100 769 HH11 ARG 89 1HH1 ARG 89 -12.829 -8.272 -8.495 770 HH12 ARG 89 2HH1 ARG 89 -12.421 -9.871 -7.981 771 HH21 ARG 89 1HH2 ARG 89 -9.112 -9.158 -7.436 772 HH22 ARG 89 2HH2 ARG 89 -10.353 -10.364 -7.398 773 H LEU 90 H LEU 90 -11.069 -1.277 -8.995 774 HA LEU 90 HA LEU 90 -9.644 -1.569 -6.596 775 HB2 LEU 90 2HB LEU 90 -8.959 -0.169 -8.522 776 HB3 LEU 90 3HB LEU 90 -10.247 0.957 -8.145 777 HG LEU 90 HG LEU 90 -9.169 1.508 -6.012 778 HD11 LEU 90 1HD1 LEU 90 -6.916 0.668 -5.516 779 HD12 LEU 90 2HD1 LEU 90 -7.023 -0.420 -6.902 780 HD13 LEU 90 3HD1 LEU 90 -8.115 -0.624 -5.530 781 HD21 LEU 90 3HD2 LEU 90 -7.257 2.709 -6.899 782 HD22 LEU 90 1HD2 LEU 90 -8.599 2.784 -8.040 783 HD23 LEU 90 2HD2 LEU 90 -7.249 1.688 -8.337 784 H GLU 91 H GLU 91 -12.480 0.470 -7.343 785 HA GLU 91 HA GLU 91 -12.914 1.579 -4.827 786 HB2 GLU 91 2HB GLU 91 -14.748 0.899 -7.111 787 HB3 GLU 91 3HB GLU 91 -15.416 1.511 -5.606 788 HG2 GLU 91 2HG GLU 91 -13.306 2.937 -7.219 789 HG3 GLU 91 3HG GLU 91 -15.039 3.246 -7.346 790 H GLU 92 H GLU 92 -14.172 -1.492 -6.134 791 HA GLU 92 HA GLU 92 -15.768 -2.333 -4.054 792 HB2 GLU 92 2HB GLU 92 -15.560 -3.563 -6.154 793 HB3 GLU 92 3HB GLU 92 -13.904 -4.002 -5.766 794 HG2 GLU 92 2HG GLU 92 -15.279 -5.901 -5.367 795 HG3 GLU 92 3HG GLU 92 -14.770 -5.275 -3.802 796 H PHE 93 H PHE 93 -12.279 -3.069 -4.396 797 HA PHE 93 HA PHE 93 -12.072 -4.299 -1.836 798 HB2 PHE 93 2HB PHE 93 -10.542 -4.782 -3.731 799 HB3 PHE 93 3HB PHE 93 -9.867 -3.166 -3.582 800 HD1 PHE 93 HD1 PHE 93 -10.630 -5.970 -1.212 801 HD2 PHE 93 HD2 PHE 93 -7.766 -3.156 -2.643 802 HE1 PHE 93 HE1 PHE 93 -8.980 -6.823 0.404 803 HE2 PHE 93 HE2 PHE 93 -6.120 -4.005 -1.025 804 HZ PHE 93 HZ PHE 93 -6.725 -5.841 0.500 805 H SER 94 H SER 94 -11.492 -1.006 -2.988 806 HA SER 94 HA SER 94 -10.159 0.008 -0.717 807 HB2 SER 94 2HB SER 94 -10.193 1.211 -2.854 808 HB3 SER 94 3HB SER 94 -11.928 1.478 -2.695 809 HG SER 94 HG SER 94 -9.802 2.639 -1.265 810 H ARG 95 H ARG 95 -13.630 0.060 -1.553 811 HA ARG 95 HA ARG 95 -14.503 1.486 0.712 812 HB2 ARG 95 2HB ARG 95 -16.029 -0.545 -0.938 813 HB3 ARG 95 3HB ARG 95 -16.750 0.604 0.182 814 HG2 ARG 95 2HG ARG 95 -15.224 1.293 -2.326 815 HG3 ARG 95 3HG ARG 95 -16.974 1.357 -2.120 816 HD2 ARG 95 2HD ARG 95 -16.739 3.098 -0.436 817 HD3 ARG 95 3HD ARG 95 -14.981 2.993 -0.541 818 HE ARG 95 HE ARG 95 -15.623 3.574 -3.064 819 HH11 ARG 95 1HH1 ARG 95 -16.610 5.005 -0.088 820 HH12 ARG 95 2HH1 ARG 95 -16.916 6.544 -0.814 821 HH21 ARG 95 1HH2 ARG 95 -15.969 5.545 -3.962 822 HH22 ARG 95 2HH2 ARG 95 -16.540 6.855 -2.982 823 H GLU 96 H GLU 96 -14.110 -2.003 0.169 824 HA GLU 96 HA GLU 96 -15.107 -2.908 2.623 825 HB2 GLU 96 2HB GLU 96 -12.879 -4.037 0.909 826 HB3 GLU 96 3HB GLU 96 -13.590 -4.881 2.279 827 HG2 GLU 96 2HG GLU 96 -14.998 -4.063 -0.260 828 HG3 GLU 96 3HG GLU 96 -14.542 -5.698 0.219 829 H VAL 97 H VAL 97 -11.688 -2.203 1.774 830 HA VAL 97 HA VAL 97 -10.551 -2.569 4.281 831 HB VAL 97 HB VAL 97 -9.761 -0.508 2.200 832 HG11 VAL 97 1HG1 VAL 97 -7.528 -0.594 3.245 833 HG12 VAL 97 2HG1 VAL 97 -8.175 -1.629 4.518 834 HG13 VAL 97 3HG1 VAL 97 -8.755 0.028 4.351 835 HG21 VAL 97 3HG2 VAL 97 -9.800 -2.809 1.340 836 HG22 VAL 97 1HG2 VAL 97 -8.739 -3.321 2.652 837 HG23 VAL 97 2HG2 VAL 97 -8.154 -2.183 1.437 838 H ARG 98 H ARG 98 -11.993 0.413 2.959 839 HA ARG 98 HA ARG 98 -11.566 2.100 5.145 840 HB2 ARG 98 2HB ARG 98 -12.388 2.879 2.957 841 HB3 ARG 98 3HB ARG 98 -13.917 2.060 3.234 842 HG2 ARG 98 2HG ARG 98 -14.190 4.410 3.653 843 HG3 ARG 98 3HG ARG 98 -14.322 3.537 5.181 844 HD2 ARG 98 2HD ARG 98 -11.976 4.109 5.685 845 HD3 ARG 98 3HD ARG 98 -11.883 5.016 4.175 846 HE ARG 98 HE ARG 98 -13.548 5.734 6.500 847 HH11 ARG 98 1HH1 ARG 98 -12.007 6.588 3.549 848 HH12 ARG 98 2HH1 ARG 98 -12.225 8.285 3.789 849 HH21 ARG 98 1HH2 ARG 98 -13.847 7.915 6.805 850 HH22 ARG 98 2HH2 ARG 98 -13.268 9.033 5.619 851 H ARG 99 H ARG 99 -14.383 0.022 4.439 852 HA ARG 99 HA ARG 99 -15.830 0.639 6.778 853 HB2 ARG 99 2HB ARG 99 -16.963 -0.345 4.907 854 HB3 ARG 99 3HB ARG 99 -15.922 -1.760 4.939 855 HG2 ARG 99 2HG ARG 99 -17.005 -2.685 6.764 856 HG3 ARG 99 3HG ARG 99 -17.620 -1.129 7.322 857 HD2 ARG 99 2HD ARG 99 -19.363 -2.632 6.371 858 HD3 ARG 99 3HD ARG 99 -19.249 -1.065 5.576 859 HE ARG 99 HE ARG 99 -17.718 -3.106 4.261 860 HH11 ARG 99 1HH1 ARG 99 -20.860 -1.736 4.595 861 HH12 ARG 99 2HH1 ARG 99 -21.369 -2.238 3.023 862 HH21 ARG 99 1HH2 ARG 99 -18.400 -3.730 2.212 863 HH22 ARG 99 2HH2 ARG 99 -20.007 -3.339 1.708 864 H ARG 100 H ARG 100 -13.187 -1.597 6.235 865 HA ARG 100 HA ARG 100 -13.552 -3.094 8.649 866 HB2 ARG 100 2HB ARG 100 -11.029 -2.731 7.006 867 HB3 ARG 100 3HB ARG 100 -11.287 -3.955 8.247 868 HG2 ARG 100 2HG ARG 100 -13.151 -4.874 6.895 869 HG3 ARG 100 3HG ARG 100 -12.771 -3.703 5.637 870 HD2 ARG 100 2HD ARG 100 -11.744 -5.725 4.978 871 HD3 ARG 100 3HD ARG 100 -10.444 -4.695 5.579 872 HE ARG 100 HE ARG 100 -11.030 -6.093 7.765 873 HH11 ARG 100 1HH1 ARG 100 -10.626 -7.172 4.509 874 HH12 ARG 100 2HH1 ARG 100 -10.054 -8.732 4.994 875 HH21 ARG 100 1HH2 ARG 100 -10.326 -8.115 8.358 876 HH22 ARG 100 2HH2 ARG 100 -9.895 -9.258 7.131 877 H GLY 101 H GLY 101 -12.322 0.053 8.022 878 HA2 GLY 101 2HA GLY 101 -12.417 1.373 10.165 879 HA3 GLY 101 3HA GLY 101 -11.302 0.181 10.806 880 H PHE 102 H PHE 102 -10.124 0.445 7.826 881 HA PHE 102 HA PHE 102 -8.116 2.366 8.770 882 HB2 PHE 102 2HB PHE 102 -7.991 0.336 6.525 883 HB3 PHE 102 3HB PHE 102 -6.661 1.373 7.032 884 HD1 PHE 102 HD1 PHE 102 -5.618 1.063 9.256 885 HD2 PHE 102 HD2 PHE 102 -8.560 -1.633 7.755 886 HE1 PHE 102 HE1 PHE 102 -4.956 -0.599 10.944 887 HE2 PHE 102 HE2 PHE 102 -7.893 -3.301 9.436 888 HZ PHE 102 HZ PHE 102 -6.091 -2.783 11.036 889 H GLU 103 H GLU 103 -7.469 4.166 7.664 890 HA GLU 103 HA GLU 103 -9.203 5.286 5.662 891 HB2 GLU 103 2HB GLU 103 -6.498 6.255 6.637 892 HB3 GLU 103 3HB GLU 103 -7.633 7.186 5.666 893 HG2 GLU 103 2HG GLU 103 -9.262 7.074 7.520 894 HG3 GLU 103 3HG GLU 103 -8.066 6.220 8.492 895 H VAL 104 H VAL 104 -8.936 5.286 3.454 896 HA VAL 104 HA VAL 104 -6.448 4.200 2.344 897 HB VAL 104 HB VAL 104 -7.873 2.258 2.667 898 HG11 VAL 104 1HG1 VAL 104 -10.049 3.358 2.689 899 HG12 VAL 104 2HG1 VAL 104 -10.032 2.027 1.532 900 HG13 VAL 104 3HG1 VAL 104 -9.913 3.692 0.962 901 HG21 VAL 104 3HG2 VAL 104 -6.436 2.272 0.701 902 HG22 VAL 104 1HG2 VAL 104 -7.704 3.052 -0.244 903 HG23 VAL 104 2HG2 VAL 104 -7.937 1.412 0.361 904 H ARG 105 H ARG 105 -5.928 4.862 0.292 905 HA ARG 105 HA ARG 105 -7.868 6.562 -1.154 906 HB2 ARG 105 2HB ARG 105 -4.876 6.790 -0.898 907 HB3 ARG 105 3HB ARG 105 -5.703 7.470 -2.294 908 HG2 ARG 105 2HG ARG 105 -7.137 8.772 -0.688 909 HG3 ARG 105 3HG ARG 105 -6.068 8.215 0.603 910 HD2 ARG 105 2HD ARG 105 -5.488 10.473 -0.253 911 HD3 ARG 105 3HD ARG 105 -4.179 9.304 -0.416 912 HE ARG 105 HE ARG 105 -4.510 9.286 -2.749 913 HH11 ARG 105 1HH1 ARG 105 -6.576 11.546 -1.161 914 HH12 ARG 105 2HH1 ARG 105 -6.954 12.383 -2.627 915 HH21 ARG 105 1HH2 ARG 105 -5.016 10.389 -4.623 916 HH22 ARG 105 2HH2 ARG 105 -6.094 11.738 -4.541 917 H THR 106 H THR 106 -7.661 6.544 -3.525 918 HA THR 106 HA THR 106 -6.980 3.840 -4.527 919 HB THR 106 HB THR 106 -8.835 4.066 -6.126 920 HG1 THR 106 HG1 THR 106 -8.762 6.456 -6.109 921 HG21 THR 106 3HG2 THR 106 -9.726 4.608 -3.287 922 HG22 THR 106 1HG2 THR 106 -9.302 3.027 -3.946 923 HG23 THR 106 2HG2 THR 106 -10.710 3.892 -4.564 924 H VAL 107 H VAL 107 -5.591 3.737 -6.213 925 HA VAL 107 HA VAL 107 -5.433 6.021 -8.071 926 HB VAL 107 HB VAL 107 -2.964 5.712 -8.261 927 HG11 VAL 107 1HG1 VAL 107 -3.865 7.518 -6.895 928 HG12 VAL 107 2HG1 VAL 107 -2.383 6.884 -6.180 929 HG13 VAL 107 3HG1 VAL 107 -3.950 6.445 -5.497 930 HG21 VAL 107 3HG2 VAL 107 -3.306 3.951 -5.823 931 HG22 VAL 107 1HG2 VAL 107 -1.764 4.515 -6.471 932 HG23 VAL 107 2HG2 VAL 107 -2.777 3.430 -7.423 933 H THR 108 H THR 108 -5.408 5.470 -10.205 934 HA THR 108 HA THR 108 -5.178 2.590 -10.860 935 HB THR 108 HB THR 108 -6.644 3.028 -12.813 936 HG1 THR 108 HG1 THR 108 -7.713 5.020 -12.962 937 HG21 THR 108 3HG2 THR 108 -7.869 3.864 -10.179 938 HG22 THR 108 1HG2 THR 108 -7.595 2.199 -10.697 939 HG23 THR 108 2HG2 THR 108 -8.733 3.220 -11.574 940 H SER 109 H SER 109 -3.527 5.432 -11.204 941 HA SER 109 HA SER 109 -1.931 4.322 -13.389 942 HB2 SER 109 2HB SER 109 -3.106 7.119 -13.454 943 HB3 SER 109 3HB SER 109 -1.787 6.590 -14.493 944 HG SER 109 HG SER 109 -4.492 5.790 -14.486 945 HA PRO 110 HA PRO 110 1.580 5.502 -10.987 946 HB2 PRO 110 2HB PRO 110 3.203 6.691 -12.922 947 HB3 PRO 110 3HB PRO 110 3.101 4.960 -12.593 948 HG2 PRO 110 2HG PRO 110 1.725 6.576 -14.703 949 HG3 PRO 110 3HG PRO 110 2.441 4.956 -14.821 950 HD2 PRO 110 2HD PRO 110 -0.205 5.273 -14.634 951 HD3 PRO 110 3HD PRO 110 0.609 3.942 -13.785 952 H ASP 111 H ASP 111 0.599 8.087 -13.268 953 HA ASP 111 HA ASP 111 1.735 10.224 -11.819 954 HB2 ASP 111 2HB ASP 111 0.108 11.645 -13.141 955 HB3 ASP 111 3HB ASP 111 1.159 10.602 -14.095 956 H ASP 112 H ASP 112 -1.488 8.748 -11.642 957 HA ASP 112 HA ASP 112 -2.643 10.496 -9.772 958 HB2 ASP 112 2HB ASP 112 -3.104 7.556 -10.297 959 HB3 ASP 112 3HB ASP 112 -4.063 8.481 -9.144 960 H PHE 113 H PHE 113 -0.520 7.701 -9.308 961 HA PHE 113 HA PHE 113 -0.688 7.562 -6.499 962 HB2 PHE 113 2HB PHE 113 0.320 5.760 -7.812 963 HB3 PHE 113 3HB PHE 113 1.638 6.824 -8.297 964 HD1 PHE 113 HD1 PHE 113 0.037 5.301 -5.298 965 HD2 PHE 113 HD2 PHE 113 3.575 6.951 -6.998 966 HE1 PHE 113 HE1 PHE 113 1.315 4.617 -3.310 967 HE2 PHE 113 HE2 PHE 113 4.857 6.266 -5.015 968 HZ PHE 113 HZ PHE 113 3.727 5.096 -3.169 969 H LYS 114 H LYS 114 1.644 9.294 -8.581 970 HA LYS 114 HA LYS 114 3.116 10.594 -6.597 971 HB2 LYS 114 2HB LYS 114 3.786 10.697 -8.929 972 HB3 LYS 114 3HB LYS 114 2.316 11.564 -9.356 973 HG2 LYS 114 2HG LYS 114 3.086 13.448 -7.903 974 HG3 LYS 114 3HG LYS 114 4.608 12.587 -7.675 975 HD2 LYS 114 2HD LYS 114 3.500 13.410 -10.364 976 HD3 LYS 114 3HD LYS 114 4.676 14.348 -9.446 977 HE2 LYS 114 2HE LYS 114 5.114 11.500 -10.343 978 HE3 LYS 114 3HE LYS 114 5.666 12.915 -11.236 979 HZ1 LYS 114 3HZ LYS 114 6.985 13.552 -9.298 980 HZ2 LYS 114 1HZ LYS 114 7.434 12.032 -9.889 981 HZ3 LYS 114 2HZ LYS 114 6.493 12.156 -8.486 982 H LYS 115 H LYS 115 0.330 11.903 -8.396 983 HA LYS 115 HA LYS 115 -0.021 14.268 -7.006 984 HB2 LYS 115 2HB LYS 115 -2.058 12.513 -8.378 985 HB3 LYS 115 3HB LYS 115 -2.383 14.159 -7.838 986 HG2 LYS 115 2HG LYS 115 -0.803 15.071 -9.361 987 HG3 LYS 115 3HG LYS 115 -0.153 13.477 -9.745 988 HD2 LYS 115 2HD LYS 115 -1.569 14.261 -11.545 989 HD3 LYS 115 3HD LYS 115 -2.295 12.862 -10.759 990 HE2 LYS 115 2HE LYS 115 -3.972 14.572 -11.252 991 HE3 LYS 115 3HE LYS 115 -3.802 14.323 -9.516 992 HZ1 LYS 115 3HZ LYS 115 -2.512 16.525 -11.028 993 HZ2 LYS 115 1HZ LYS 115 -2.511 16.317 -9.352 994 HZ3 LYS 115 2HZ LYS 115 -3.952 16.671 -10.160 995 H SER 116 H SER 116 -0.892 11.047 -6.030 996 HA SER 116 HA SER 116 -2.565 11.863 -3.811 997 HB2 SER 116 2HB SER 116 -2.984 9.708 -4.866 998 HB3 SER 116 3HB SER 116 -1.336 9.183 -4.528 999 HG SER 116 HG SER 116 -1.859 8.797 -2.502 1000 H LEU 117 H LEU 117 0.647 10.321 -4.073 1001 HA LEU 117 HA LEU 117 1.129 10.199 -1.304 1002 HB2 LEU 117 2HB LEU 117 2.241 8.807 -3.052 1003 HB3 LEU 117 3HB LEU 117 3.169 10.214 -3.535 1004 HG LEU 117 HG LEU 117 4.172 10.282 -1.247 1005 HD11 LEU 117 1HD1 LEU 117 2.750 7.640 -0.902 1006 HD12 LEU 117 2HD1 LEU 117 2.414 9.131 -0.019 1007 HD13 LEU 117 3HD1 LEU 117 3.960 8.312 0.193 1008 HD21 LEU 117 3HD2 LEU 117 5.678 8.382 -1.588 1009 HD22 LEU 117 1HD2 LEU 117 5.364 9.233 -3.099 1010 HD23 LEU 117 2HD2 LEU 117 4.558 7.700 -2.768 1011 H GLU 118 H GLU 118 2.145 12.595 -3.731 1012 HA GLU 118 HA GLU 118 3.905 14.140 -2.261 1013 HB2 GLU 118 2HB GLU 118 1.835 15.099 -4.253 1014 HB3 GLU 118 3HB GLU 118 3.211 16.043 -3.704 1015 HG2 GLU 118 2HG GLU 118 3.340 13.457 -5.250 1016 HG3 GLU 118 3HG GLU 118 3.595 15.072 -5.906 1017 H ARG 119 H ARG 119 0.387 14.146 -2.138 1018 HA ARG 119 HA ARG 119 0.197 16.479 -0.458 1019 HB2 ARG 119 2HB ARG 119 -1.903 14.361 -0.966 1020 HB3 ARG 119 3HB ARG 119 -2.170 16.000 -0.384 1021 HG2 ARG 119 2HG ARG 119 -1.425 16.893 -2.530 1022 HG3 ARG 119 3HG ARG 119 -1.118 15.255 -3.110 1023 HD2 ARG 119 2HD ARG 119 -3.523 14.737 -2.777 1024 HD3 ARG 119 3HD ARG 119 -3.792 16.422 -2.328 1025 HE ARG 119 HE ARG 119 -2.912 15.501 -4.984 1026 HH11 ARG 119 1HH1 ARG 119 -4.506 17.794 -2.964 1027 HH12 ARG 119 2HH1 ARG 119 -4.982 18.789 -4.295 1028 HH21 ARG 119 1HH2 ARG 119 -3.561 16.777 -6.684 1029 HH22 ARG 119 2HH2 ARG 119 -4.458 18.220 -6.368 1030 H LEU 120 H LEU 120 -0.320 12.994 0.033 1031 HA LEU 120 HA LEU 120 -1.091 13.041 2.694 1032 HB2 LEU 120 2HB LEU 120 0.488 10.881 1.291 1033 HB3 LEU 120 3HB LEU 120 -0.432 10.679 2.772 1034 HG LEU 120 HG LEU 120 -1.577 11.339 0.052 1035 HD11 LEU 120 1HD1 LEU 120 -0.803 9.044 0.216 1036 HD12 LEU 120 2HD1 LEU 120 -2.562 9.106 0.180 1037 HD13 LEU 120 3HD1 LEU 120 -1.721 8.818 1.704 1038 HD21 LEU 120 3HD2 LEU 120 -3.769 11.040 1.128 1039 HD22 LEU 120 1HD2 LEU 120 -2.880 12.400 1.811 1040 HD23 LEU 120 2HD2 LEU 120 -2.975 10.876 2.695 1041 H ILE 121 H ILE 121 2.223 12.682 1.403 1042 HA ILE 121 HA ILE 121 3.582 12.326 3.811 1043 HB ILE 121 HB ILE 121 4.513 13.775 1.320 1044 HG12 ILE 121 2HG1 ILE 121 4.919 10.919 2.260 1045 HG13 ILE 121 3HG1 ILE 121 3.863 11.430 0.948 1046 HG21 ILE 121 1HG2 ILE 121 6.180 12.709 3.607 1047 HG22 ILE 121 2HG2 ILE 121 5.889 14.411 3.250 1048 HG23 ILE 121 3HG2 ILE 121 6.797 13.416 2.113 1049 HD11 ILE 121 3HD1 ILE 121 5.819 12.216 -0.300 1050 HD12 ILE 121 1HD1 ILE 121 5.920 10.499 0.088 1051 HD13 ILE 121 2HD1 ILE 121 6.864 11.666 1.011 1052 H ARG 122 H ARG 122 2.410 15.308 2.329 1053 HA ARG 122 HA ARG 122 3.746 17.062 4.172 1054 HB2 ARG 122 2HB ARG 122 1.354 17.650 2.405 1055 HB3 ARG 122 3HB ARG 122 2.412 18.834 3.161 1056 HG2 ARG 122 2HG ARG 122 3.182 16.876 0.999 1057 HG3 ARG 122 3HG ARG 122 2.921 18.610 0.801 1058 HD2 ARG 122 2HD ARG 122 5.076 17.293 2.458 1059 HD3 ARG 122 3HD ARG 122 5.300 18.104 0.910 1060 HE ARG 122 HE ARG 122 4.123 19.842 2.831 1061 HH11 ARG 122 1HH1 ARG 122 7.125 18.490 1.815 1062 HH12 ARG 122 2HH1 ARG 122 8.065 19.735 2.561 1063 HH21 ARG 122 1HH2 ARG 122 5.318 21.448 3.755 1064 HH22 ARG 122 2HH2 ARG 122 7.043 21.418 3.631 1065 H GLU 123 H GLU 123 0.553 15.570 3.988 1066 HA GLU 123 HA GLU 123 -0.602 17.153 6.081 1067 HB2 GLU 123 2HB GLU 123 -1.566 14.548 4.876 1068 HB3 GLU 123 3HB GLU 123 -2.516 15.619 5.899 1069 HG2 GLU 123 2HG GLU 123 -2.267 17.395 4.177 1070 HG3 GLU 123 3HG GLU 123 -1.447 16.227 3.145 1071 H VAL 124 H VAL 124 0.552 13.768 5.939 1072 HA VAL 124 HA VAL 124 -0.076 13.330 8.728 1073 HB VAL 124 HB VAL 124 -0.317 11.531 7.028 1074 HG11 VAL 124 1HG1 VAL 124 1.650 10.327 6.229 1075 HG12 VAL 124 2HG1 VAL 124 2.703 11.495 7.026 1076 HG13 VAL 124 3HG1 VAL 124 1.675 12.005 5.689 1077 HG21 VAL 124 3HG2 VAL 124 -0.163 10.969 9.396 1078 HG22 VAL 124 1HG2 VAL 124 1.595 10.899 9.282 1079 HG23 VAL 124 2HG2 VAL 124 0.607 9.726 8.411 1080 H GLY 125 H GLY 125 2.788 14.183 6.898 1081 HA2 GLY 125 2HA GLY 125 4.623 13.411 9.017 1082 HA3 GLY 125 3HA GLY 125 5.046 14.167 7.491 1083 H SER 126 H SER 126 2.566 15.793 9.215 1084 HA SER 126 HA SER 126 4.291 18.074 9.622 1085 HB2 SER 126 2HB SER 126 2.222 19.202 10.418 1086 HB3 SER 126 3HB SER 126 2.008 18.438 8.841 1087 HG SER 126 HG SER 126 0.293 17.682 9.870 1088 H LEU 127 H LEU 127 5.706 17.888 11.291 1089 HA LEU 127 HA LEU 127 4.864 16.804 13.856 1090 HB2 LEU 127 2HB LEU 127 7.227 17.282 14.541 1091 HB3 LEU 127 3HB LEU 127 7.045 16.173 13.200 1092 HG LEU 127 HG LEU 127 7.514 18.210 11.685 1093 HD11 LEU 127 1HD1 LEU 127 7.256 19.965 13.347 1094 HD12 LEU 127 2HD1 LEU 127 8.885 19.973 12.678 1095 HD13 LEU 127 3HD1 LEU 127 8.594 19.300 14.283 1096 HD21 LEU 127 3HD2 LEU 127 9.926 17.889 11.884 1097 HD22 LEU 127 1HD2 LEU 127 9.063 16.355 11.987 1098 HD23 LEU 127 2HD2 LEU 127 9.699 17.109 13.451 1099 H GLU 128 H GLU 128 5.100 19.861 12.354 1100 HA GLU 128 HA GLU 128 4.481 21.216 14.912 1101 HB2 GLU 128 2HB GLU 128 6.640 21.963 14.031 1102 HB3 GLU 128 3HB GLU 128 5.907 22.320 12.474 1103 HG2 GLU 128 2HG GLU 128 4.481 24.023 13.615 1104 HG3 GLU 128 3HG GLU 128 5.401 23.731 15.091 1105 H HIS 129 H HIS 129 2.812 22.800 14.856 1106 HA HIS 129 HA HIS 129 0.728 23.531 14.307 1107 HB2 HIS 129 2HB HIS 129 1.948 23.425 11.542 1108 HB3 HIS 129 3HB HIS 129 0.344 24.080 11.852 1109 HD1 HIS 129 HD1 HIS 129 3.901 24.967 11.904 1110 HD2 HIS 129 HD2 HIS 129 0.367 26.458 13.494 1111 HE1 HIS 129 HE1 HIS 129 4.428 27.304 12.627 1112 HE2 HIS 129 HE2 HIS 129 2.211 28.257 13.331 1113 H HIS 130 H HIS 130 1.265 20.621 14.463 1114 HA HIS 130 HA HIS 130 -0.336 19.283 12.513 1115 HB2 HIS 130 2HB HIS 130 1.493 18.230 13.918 1116 HB3 HIS 130 3HB HIS 130 0.376 18.270 15.278 1117 HD1 HIS 130 HD1 HIS 130 1.002 16.542 12.018 1118 HD2 HIS 130 HD2 HIS 130 -1.639 16.321 15.220 1119 HE1 HIS 130 HE1 HIS 130 -0.262 14.397 11.703 1120 HE2 HIS 130 HE2 HIS 130 -1.750 14.219 13.718 1121 H HIS 131 H HIS 131 -0.988 20.841 15.562 1122 HA HIS 131 HA HIS 131 -3.676 19.840 15.843 1123 HB2 HIS 131 2HB HIS 131 -2.417 22.301 17.095 1124 HB3 HIS 131 3HB HIS 131 -3.918 21.532 17.596 1125 HD1 HIS 131 HD1 HIS 131 -3.615 19.017 18.582 1126 HD2 HIS 131 HD2 HIS 131 -0.183 21.351 18.347 1127 HE1 HIS 131 HE1 HIS 131 -1.945 17.922 20.101 1128 HE2 HIS 131 HE2 HIS 131 0.109 19.364 19.970 1129 H HIS 132 H HIS 132 -5.125 20.329 14.289 1130 HA HIS 132 HA HIS 132 -4.989 22.455 12.486 1131 HB2 HIS 132 2HB HIS 132 -7.226 21.861 11.817 1132 HB3 HIS 132 3HB HIS 132 -6.372 20.376 12.226 1133 HD1 HIS 132 HD1 HIS 132 -9.307 22.417 13.157 1134 HD2 HIS 132 HD2 HIS 132 -7.212 19.176 14.697 1135 HE1 HIS 132 HE1 HIS 132 -10.782 21.449 14.944 1136 HE2 HIS 132 HE2 HIS 132 -9.562 19.406 15.745 1137 H HIS 133 H HIS 133 -6.656 24.214 12.232 1138 HA HIS 133 HA HIS 133 -6.922 25.695 14.728 1139 HB2 HIS 133 2HB HIS 133 -6.091 26.827 12.703 1140 HB3 HIS 133 3HB HIS 133 -7.607 26.484 11.881 1141 HD1 HIS 133 HD1 HIS 133 -9.620 27.980 12.448 1142 HD2 HIS 133 HD2 HIS 133 -6.200 28.887 14.625 1143 HE1 HIS 133 HE1 HIS 133 -10.084 30.192 13.533 1144 HE2 HIS 133 HE2 HIS 133 -7.915 30.822 14.630 1145 H HIS 134 H HIS 134 -8.929 26.583 15.480 1146 HA HIS 134 HA HIS 134 -11.229 24.874 15.002 1147 HB2 HIS 134 2HB HIS 134 -10.647 25.550 17.297 1148 HB3 HIS 134 3HB HIS 134 -10.888 27.242 16.871 1149 HD1 HIS 134 HD1 HIS 134 -13.416 27.921 16.272 1150 HD2 HIS 134 HD2 HIS 134 -12.904 24.217 18.084 1151 HE1 HIS 134 HE1 HIS 134 -15.685 27.263 17.114 1152 HE2 HIS 134 HE2 HIS 134 -15.317 25.104 18.342 Start of MODEL 20 1 H1 MET 1 1H MET 1 5.157 6.880 11.326 2 H2 MET 1 2H MET 1 3.692 7.717 11.218 3 H3 MET 1 3H MET 1 5.144 8.571 11.308 4 HA MET 1 HA MET 1 4.249 8.558 9.055 5 HB2 MET 1 2HB MET 1 6.802 6.960 9.400 6 HB3 MET 1 3HB MET 1 6.321 7.809 7.937 7 HG2 MET 1 2HG MET 1 6.437 9.940 9.132 8 HG3 MET 1 3HG MET 1 6.916 9.091 10.600 9 HE1 MET 1 3HE MET 1 10.216 10.921 9.535 10 HE2 MET 1 1HE MET 1 9.040 10.675 10.824 11 HE3 MET 1 2HE MET 1 8.570 11.528 9.353 12 H ASN 2 H ASN 2 2.849 6.290 10.339 13 HA ASN 2 HA ASN 2 3.414 3.888 8.911 14 HB2 ASN 2 2HB ASN 2 0.957 4.661 10.502 15 HB3 ASN 2 3HB ASN 2 1.364 3.032 9.969 16 HD21 ASN 2 1HD2 ASN 2 1.410 2.277 12.085 17 HD22 ASN 2 2HD2 ASN 2 2.705 2.653 13.162 18 H ILE 3 H ILE 3 3.199 3.958 6.719 19 HA ILE 3 HA ILE 3 0.463 4.217 5.700 20 HB ILE 3 HB ILE 3 1.470 6.373 5.204 21 HG12 ILE 3 2HG1 ILE 3 1.320 4.709 2.670 22 HG13 ILE 3 3HG1 ILE 3 -0.079 5.321 3.546 23 HG21 ILE 3 1HG2 ILE 3 3.618 4.856 3.717 24 HG22 ILE 3 2HG2 ILE 3 3.825 5.719 5.241 25 HG23 ILE 3 3HG2 ILE 3 3.432 6.611 3.770 26 HD11 ILE 3 3HD1 ILE 3 2.060 7.010 2.261 27 HD12 ILE 3 1HD1 ILE 3 0.630 7.607 3.107 28 HD13 ILE 3 2HD1 ILE 3 0.452 6.695 1.607 29 H VAL 4 H VAL 4 -0.090 2.703 4.215 30 HA VAL 4 HA VAL 4 2.009 0.818 3.325 31 HB VAL 4 HB VAL 4 -0.883 0.136 3.933 32 HG11 VAL 4 1HG1 VAL 4 1.500 -1.617 3.302 33 HG12 VAL 4 2HG1 VAL 4 0.091 -1.342 2.276 34 HG13 VAL 4 3HG1 VAL 4 -0.088 -2.203 3.804 35 HG21 VAL 4 3HG2 VAL 4 -0.038 -0.997 5.945 36 HG22 VAL 4 1HG2 VAL 4 0.274 0.737 5.996 37 HG23 VAL 4 2HG2 VAL 4 1.581 -0.382 5.613 38 H ILE 5 H ILE 5 2.019 0.192 1.193 39 HA ILE 5 HA ILE 5 -0.121 1.246 -0.562 40 HB ILE 5 HB ILE 5 2.774 0.726 -1.294 41 HG12 ILE 5 2HG1 ILE 5 1.324 3.371 -0.956 42 HG13 ILE 5 3HG1 ILE 5 2.456 2.690 0.210 43 HG21 ILE 5 1HG2 ILE 5 1.247 0.375 -3.172 44 HG22 ILE 5 2HG2 ILE 5 2.214 1.827 -3.417 45 HG23 ILE 5 3HG2 ILE 5 0.532 1.964 -2.906 46 HD11 ILE 5 3HD1 ILE 5 4.249 2.840 -1.410 47 HD12 ILE 5 1HD1 ILE 5 3.480 4.411 -1.183 48 HD13 ILE 5 2HD1 ILE 5 3.126 3.455 -2.623 49 H VAL 6 H VAL 6 -1.113 -0.167 -1.966 50 HA VAL 6 HA VAL 6 -0.128 -2.954 -2.039 51 HB VAL 6 HB VAL 6 -3.030 -2.078 -2.062 52 HG11 VAL 6 1HG1 VAL 6 -3.527 -4.483 -1.851 53 HG12 VAL 6 2HG1 VAL 6 -1.809 -4.842 -2.017 54 HG13 VAL 6 3HG1 VAL 6 -2.688 -4.106 -3.357 55 HG21 VAL 6 3HG2 VAL 6 -2.068 -1.749 0.148 56 HG22 VAL 6 1HG2 VAL 6 -1.422 -3.393 0.138 57 HG23 VAL 6 2HG2 VAL 6 -3.167 -3.130 0.167 58 H VAL 7 H VAL 7 0.205 -3.796 -4.025 59 HA VAL 7 HA VAL 7 -0.733 -2.236 -6.361 60 HB VAL 7 HB VAL 7 1.690 -4.050 -6.184 61 HG11 VAL 7 1HG1 VAL 7 0.768 -2.192 -8.385 62 HG12 VAL 7 2HG1 VAL 7 0.774 -3.956 -8.440 63 HG13 VAL 7 3HG1 VAL 7 2.300 -3.071 -8.362 64 HG21 VAL 7 3HG2 VAL 7 1.536 -1.028 -6.198 65 HG22 VAL 7 1HG2 VAL 7 3.017 -1.983 -6.259 66 HG23 VAL 7 2HG2 VAL 7 1.990 -2.039 -4.825 67 H PHE 8 H PHE 8 -2.510 -3.216 -7.201 68 HA PHE 8 HA PHE 8 -2.795 -6.103 -7.213 69 HB2 PHE 8 2HB PHE 8 -4.531 -3.811 -8.085 70 HB3 PHE 8 3HB PHE 8 -4.915 -5.449 -8.601 71 HD1 PHE 8 HD2 PHE 8 -4.258 -3.419 -5.545 72 HD2 PHE 8 HD1 PHE 8 -6.158 -6.843 -7.221 73 HE1 PHE 8 HE2 PHE 8 -5.405 -3.829 -3.406 74 HE2 PHE 8 HE1 PHE 8 -7.309 -7.255 -5.087 75 HZ PHE 8 HZ PHE 8 -6.932 -5.747 -3.175 76 H SER 9 H SER 9 -1.206 -3.956 -9.213 77 HA SER 9 HA SER 9 -1.810 -4.993 -11.782 78 HB2 SER 9 2HB SER 9 -0.737 -2.825 -11.559 79 HB3 SER 9 3HB SER 9 0.675 -3.564 -10.802 80 HG SER 9 HG SER 9 -0.059 -4.539 -13.310 81 H THR 10 H THR 10 0.255 -6.134 -9.247 82 HA THR 10 HA THR 10 1.215 -8.166 -8.913 83 HB THR 10 HB THR 10 0.272 -8.900 -11.699 84 HG1 THR 10 HG1 THR 10 -0.909 -9.220 -9.117 85 HG21 THR 10 3HG2 THR 10 0.552 -11.217 -10.982 86 HG22 THR 10 1HG2 THR 10 1.151 -10.679 -9.413 87 HG23 THR 10 2HG2 THR 10 2.088 -10.357 -10.871 88 H ASP 11 H ASP 11 1.908 -6.878 -12.181 89 HA ASP 11 HA ASP 11 4.382 -8.181 -12.499 90 HB2 ASP 11 2HB ASP 11 3.275 -5.683 -13.781 91 HB3 ASP 11 3HB ASP 11 4.793 -6.433 -14.271 92 H GLU 12 H GLU 12 6.507 -7.356 -12.496 93 HA GLU 12 HA GLU 12 7.112 -5.925 -10.081 94 HB2 GLU 12 2HB GLU 12 9.041 -6.878 -12.215 95 HB3 GLU 12 3HB GLU 12 9.441 -6.416 -10.568 96 HG2 GLU 12 2HG GLU 12 9.498 -8.771 -10.632 97 HG3 GLU 12 3HG GLU 12 8.009 -8.340 -9.790 98 H GLU 13 H GLU 13 7.381 -5.218 -13.560 99 HA GLU 13 HA GLU 13 8.941 -2.902 -13.380 100 HB2 GLU 13 2HB GLU 13 8.203 -2.318 -15.575 101 HB3 GLU 13 3HB GLU 13 8.328 -4.069 -15.516 102 HG2 GLU 13 2HG GLU 13 5.957 -4.318 -15.404 103 HG3 GLU 13 3HG GLU 13 5.728 -2.586 -15.164 104 H THR 14 H THR 14 5.467 -3.330 -12.972 105 HA THR 14 HA THR 14 4.687 -0.641 -12.880 106 HB THR 14 HB THR 14 3.488 -2.933 -11.300 107 HG1 THR 14 HG1 THR 14 2.114 -3.119 -13.150 108 HG21 THR 14 3HG2 THR 14 1.416 -1.600 -11.415 109 HG22 THR 14 1HG2 THR 14 2.302 -0.297 -12.203 110 HG23 THR 14 2HG2 THR 14 2.686 -0.747 -10.540 111 H LEU 15 H LEU 15 5.855 -2.783 -10.304 112 HA LEU 15 HA LEU 15 5.633 -0.943 -8.177 113 HB2 LEU 15 2HB LEU 15 5.916 -3.338 -7.830 114 HB3 LEU 15 3HB LEU 15 7.503 -3.282 -8.570 115 HG LEU 15 HG LEU 15 8.341 -1.915 -6.704 116 HD11 LEU 15 1HD1 LEU 15 6.254 -0.762 -6.135 117 HD12 LEU 15 2HD1 LEU 15 6.981 -1.526 -4.724 118 HD13 LEU 15 3HD1 LEU 15 5.589 -2.272 -5.508 119 HD21 LEU 15 3HD2 LEU 15 8.549 -4.331 -6.557 120 HD22 LEU 15 1HD2 LEU 15 6.940 -4.452 -5.842 121 HD23 LEU 15 2HD2 LEU 15 8.239 -3.648 -4.961 122 H ARG 16 H ARG 16 7.978 -1.280 -10.725 123 HA ARG 16 HA ARG 16 10.122 0.146 -9.546 124 HB2 ARG 16 2HB ARG 16 10.187 -1.323 -11.624 125 HB3 ARG 16 3HB ARG 16 9.498 0.036 -12.499 126 HG2 ARG 16 2HG ARG 16 11.446 1.402 -11.916 127 HG3 ARG 16 3HG ARG 16 12.134 0.040 -11.028 128 HD2 ARG 16 2HD ARG 16 12.060 -1.272 -13.166 129 HD3 ARG 16 3HD ARG 16 11.596 0.215 -13.992 130 HE ARG 16 HE ARG 16 14.117 0.038 -12.484 131 HH11 ARG 16 1HH1 ARG 16 12.403 0.764 -15.384 132 HH12 ARG 16 2HH1 ARG 16 13.840 1.190 -16.248 133 HH21 ARG 16 1HH2 ARG 16 15.931 0.632 -13.588 134 HH22 ARG 16 2HH2 ARG 16 15.809 1.150 -15.230 135 H LYS 17 H LYS 17 7.183 1.190 -11.160 136 HA LYS 17 HA LYS 17 7.853 3.921 -11.515 137 HB2 LYS 17 2HB LYS 17 5.177 2.573 -11.066 138 HB3 LYS 17 3HB LYS 17 5.334 4.299 -11.344 139 HG2 LYS 17 2HG LYS 17 4.721 3.277 -13.401 140 HG3 LYS 17 3HG LYS 17 6.405 3.785 -13.539 141 HD2 LYS 17 2HD LYS 17 7.161 1.521 -13.177 142 HD3 LYS 17 3HD LYS 17 5.513 0.981 -12.865 143 HE2 LYS 17 2HE LYS 17 6.520 2.106 -15.482 144 HE3 LYS 17 3HE LYS 17 6.285 0.396 -15.133 145 HZ1 LYS 17 3HZ LYS 17 4.415 1.266 -16.349 146 HZ2 LYS 17 1HZ LYS 17 4.164 2.478 -15.196 147 HZ3 LYS 17 2HZ LYS 17 3.912 0.859 -14.785 148 H PHE 18 H PHE 18 6.385 2.154 -8.819 149 HA PHE 18 HA PHE 18 5.952 4.337 -7.100 150 HB2 PHE 18 2HB PHE 18 6.473 1.422 -6.458 151 HB3 PHE 18 3HB PHE 18 5.925 2.612 -5.282 152 HD1 PHE 18 HD1 PHE 18 4.998 0.826 -8.385 153 HD2 PHE 18 HD2 PHE 18 3.641 3.232 -5.144 154 HE1 PHE 18 HE1 PHE 18 2.670 0.381 -9.033 155 HE2 PHE 18 HE2 PHE 18 1.311 2.786 -5.789 156 HZ PHE 18 HZ PHE 18 0.828 1.361 -7.735 157 H LYS 19 H LYS 19 8.751 2.177 -7.460 158 HA LYS 19 HA LYS 19 10.249 3.023 -5.278 159 HB2 LYS 19 2HB LYS 19 11.206 2.066 -7.981 160 HB3 LYS 19 3HB LYS 19 12.248 2.261 -6.576 161 HG2 LYS 19 2HG LYS 19 10.859 0.620 -5.353 162 HG3 LYS 19 3HG LYS 19 9.898 0.384 -6.815 163 HD2 LYS 19 2HD LYS 19 11.887 -0.402 -8.007 164 HD3 LYS 19 3HD LYS 19 12.868 -0.132 -6.565 165 HE2 LYS 19 2HE LYS 19 11.540 -1.797 -5.350 166 HE3 LYS 19 3HE LYS 19 10.554 -2.065 -6.787 167 HZ1 LYS 19 3HZ LYS 19 12.511 -2.858 -7.946 168 HZ2 LYS 19 1HZ LYS 19 12.270 -3.753 -6.534 169 HZ3 LYS 19 2HZ LYS 19 13.475 -2.569 -6.594 170 H ASP 20 H ASP 20 10.119 4.457 -8.532 171 HA ASP 20 HA ASP 20 12.119 6.408 -8.126 172 HB2 ASP 20 2HB ASP 20 11.278 5.841 -10.358 173 HB3 ASP 20 3HB ASP 20 9.689 6.473 -9.942 174 H ILE 21 H ILE 21 8.638 6.440 -7.514 175 HA ILE 21 HA ILE 21 8.505 9.220 -6.845 176 HB ILE 21 HB ILE 21 6.520 7.042 -6.150 177 HG12 ILE 21 2HG1 ILE 21 6.619 8.791 -8.629 178 HG13 ILE 21 3HG1 ILE 21 7.126 7.108 -8.579 179 HG21 ILE 21 1HG2 ILE 21 6.138 9.145 -4.957 180 HG22 ILE 21 2HG2 ILE 21 4.874 8.868 -6.156 181 HG23 ILE 21 3HG2 ILE 21 6.159 10.029 -6.484 182 HD11 ILE 21 3HD1 ILE 21 4.342 8.119 -8.049 183 HD12 ILE 21 1HD1 ILE 21 4.857 6.432 -8.023 184 HD13 ILE 21 2HD1 ILE 21 4.909 7.348 -9.529 185 H ILE 22 H ILE 22 8.528 6.233 -4.898 186 HA ILE 22 HA ILE 22 8.280 7.435 -2.366 187 HB ILE 22 HB ILE 22 9.575 4.808 -3.130 188 HG12 ILE 22 2HG1 ILE 22 6.792 5.430 -2.092 189 HG13 ILE 22 3HG1 ILE 22 7.191 5.007 -3.753 190 HG21 ILE 22 1HG2 ILE 22 10.367 5.501 -0.941 191 HG22 ILE 22 2HG2 ILE 22 9.246 4.149 -0.779 192 HG23 ILE 22 3HG2 ILE 22 8.710 5.788 -0.405 193 HD11 ILE 22 3HD1 ILE 22 7.483 3.240 -1.335 194 HD12 ILE 22 1HD1 ILE 22 7.976 2.807 -2.973 195 HD13 ILE 22 2HD1 ILE 22 6.276 3.101 -2.611 196 H LYS 23 H LYS 23 11.223 6.343 -4.099 197 HA LYS 23 HA LYS 23 13.094 7.265 -2.199 198 HB2 LYS 23 2HB LYS 23 13.404 6.942 -5.197 199 HB3 LYS 23 3HB LYS 23 14.734 7.178 -4.073 200 HG2 LYS 23 2HG LYS 23 12.824 4.850 -3.952 201 HG3 LYS 23 3HG LYS 23 14.377 4.815 -4.790 202 HD2 LYS 23 2HD LYS 23 14.054 5.445 -1.852 203 HD3 LYS 23 3HD LYS 23 14.395 3.832 -2.480 204 HE2 LYS 23 2HE LYS 23 16.128 6.281 -2.838 205 HE3 LYS 23 3HE LYS 23 16.445 4.939 -1.740 206 HZ1 LYS 23 3HZ LYS 23 16.428 4.875 -4.708 207 HZ2 LYS 23 1HZ LYS 23 16.476 3.484 -3.749 208 HZ3 LYS 23 2HZ LYS 23 17.740 4.601 -3.678 209 H LYS 24 H LYS 24 11.416 8.901 -4.803 210 HA LYS 24 HA LYS 24 12.963 11.278 -4.850 211 HB2 LYS 24 2HB LYS 24 11.364 10.423 -6.614 212 HB3 LYS 24 3HB LYS 24 10.049 11.000 -5.603 213 HG2 LYS 24 2HG LYS 24 10.720 13.265 -5.877 214 HG3 LYS 24 3HG LYS 24 12.251 12.794 -6.616 215 HD2 LYS 24 2HD LYS 24 9.488 12.406 -7.787 216 HD3 LYS 24 3HD LYS 24 10.712 13.555 -8.334 217 HE2 LYS 24 2HE LYS 24 12.195 11.681 -8.917 218 HE3 LYS 24 3HE LYS 24 10.963 10.541 -8.382 219 HZ1 LYS 24 3HZ LYS 24 9.488 11.616 -10.109 220 HZ2 LYS 24 1HZ LYS 24 10.760 10.666 -10.693 221 HZ3 LYS 24 2HZ LYS 24 10.881 12.353 -10.719 222 H ASN 25 H ASN 25 10.376 10.187 -2.778 223 HA ASN 25 HA ASN 25 10.116 12.802 -1.497 224 HB2 ASN 25 2HB ASN 25 8.726 10.151 -1.101 225 HB3 ASN 25 3HB ASN 25 8.545 11.467 0.057 226 HD21 ASN 25 1HD2 ASN 25 7.828 10.377 -3.162 227 HD22 ASN 25 2HD2 ASN 25 6.664 11.600 -3.517 228 H GLY 26 H GLY 26 12.373 10.440 -1.361 229 HA2 GLY 26 2HA GLY 26 14.224 10.494 0.092 230 HA3 GLY 26 3HA GLY 26 13.243 11.315 1.292 231 H PHE 27 H PHE 27 11.357 8.821 0.347 232 HA PHE 27 HA PHE 27 12.054 7.316 2.745 233 HB2 PHE 27 2HB PHE 27 9.685 7.159 0.871 234 HB3 PHE 27 3HB PHE 27 9.900 6.097 2.257 235 HD1 PHE 27 HD2 PHE 27 9.591 9.682 1.310 236 HD2 PHE 27 HD1 PHE 27 9.156 6.748 4.369 237 HE1 PHE 27 HE2 PHE 27 8.506 11.351 2.755 238 HE2 PHE 27 HE1 PHE 27 8.068 8.413 5.816 239 HZ PHE 27 HZ PHE 27 7.742 10.719 5.010 240 H LYS 28 H LYS 28 12.167 4.984 2.760 241 HA LYS 28 HA LYS 28 13.408 3.848 0.353 242 HB2 LYS 28 2HB LYS 28 13.270 2.805 3.196 243 HB3 LYS 28 3HB LYS 28 14.097 1.998 1.871 244 HG2 LYS 28 2HG LYS 28 14.790 4.750 2.896 245 HG3 LYS 28 3HG LYS 28 15.610 3.263 3.375 246 HD2 LYS 28 2HD LYS 28 15.424 4.272 0.528 247 HD3 LYS 28 3HD LYS 28 16.801 4.546 1.596 248 HE2 LYS 28 2HE LYS 28 15.761 1.831 0.766 249 HE3 LYS 28 3HE LYS 28 17.143 2.649 0.039 250 HZ1 LYS 28 3HZ LYS 28 18.259 2.591 2.178 251 HZ2 LYS 28 1HZ LYS 28 17.836 1.029 1.693 252 HZ3 LYS 28 2HZ LYS 28 16.936 1.821 2.884 253 H VAL 29 H VAL 29 12.765 1.760 -0.449 254 HA VAL 29 HA VAL 29 9.876 1.315 -0.186 255 HB VAL 29 HB VAL 29 11.779 0.150 -2.240 256 HG11 VAL 29 1HG1 VAL 29 9.750 -1.170 -1.973 257 HG12 VAL 29 2HG1 VAL 29 9.720 -0.320 -3.518 258 HG13 VAL 29 3HG1 VAL 29 8.755 0.274 -2.164 259 HG21 VAL 29 3HG2 VAL 29 11.713 2.597 -2.389 260 HG22 VAL 29 1HG2 VAL 29 9.951 2.550 -2.484 261 HG23 VAL 29 2HG2 VAL 29 10.925 1.850 -3.779 262 H ARG 30 H ARG 30 9.252 -0.206 1.241 263 HA ARG 30 HA ARG 30 10.959 -2.574 1.680 264 HB2 ARG 30 2HB ARG 30 10.168 -1.151 3.630 265 HB3 ARG 30 3HB ARG 30 8.540 -1.710 3.284 266 HG2 ARG 30 2HG ARG 30 9.426 -3.010 5.081 267 HG3 ARG 30 3HG ARG 30 9.321 -4.044 3.655 268 HD2 ARG 30 2HD ARG 30 11.425 -4.382 4.880 269 HD3 ARG 30 3HD ARG 30 11.707 -3.770 3.251 270 HE ARG 30 HE ARG 30 12.014 -1.543 4.329 271 HH11 ARG 30 1HH1 ARG 30 12.493 -4.409 6.195 272 HH12 ARG 30 2HH1 ARG 30 13.612 -3.642 7.263 273 HH21 ARG 30 1HH2 ARG 30 13.465 -0.592 5.710 274 HH22 ARG 30 2HH2 ARG 30 14.158 -1.522 6.992 275 H THR 31 H THR 31 10.455 -4.039 0.095 276 HA THR 31 HA THR 31 7.778 -4.235 -0.981 277 HB THR 31 HB THR 31 8.749 -5.991 -2.471 278 HG1 THR 31 HG1 THR 31 10.407 -6.719 -1.022 279 HG21 THR 31 3HG2 THR 31 10.293 -3.392 -2.331 280 HG22 THR 31 1HG2 THR 31 8.755 -3.646 -3.160 281 HG23 THR 31 2HG2 THR 31 10.211 -4.464 -3.729 282 H VAL 32 H VAL 32 6.255 -5.703 -0.577 283 HA VAL 32 HA VAL 32 6.931 -8.102 1.013 284 HB VAL 32 HB VAL 32 4.484 -6.334 1.296 285 HG11 VAL 32 1HG1 VAL 32 3.860 -8.694 1.481 286 HG12 VAL 32 2HG1 VAL 32 3.727 -7.870 3.034 287 HG13 VAL 32 3HG1 VAL 32 5.098 -8.929 2.714 288 HG21 VAL 32 3HG2 VAL 32 6.478 -5.456 2.415 289 HG22 VAL 32 1HG2 VAL 32 6.689 -6.989 3.261 290 HG23 VAL 32 2HG2 VAL 32 5.275 -5.987 3.590 291 H ARG 33 H ARG 33 6.166 -10.007 0.256 292 HA ARG 33 HA ARG 33 4.016 -10.001 -1.771 293 HB2 ARG 33 2HB ARG 33 5.205 -11.857 -2.937 294 HB3 ARG 33 3HB ARG 33 6.071 -10.326 -2.980 295 HG2 ARG 33 2HG ARG 33 7.553 -11.083 -1.203 296 HG3 ARG 33 3HG ARG 33 6.665 -12.604 -1.089 297 HD2 ARG 33 2HD ARG 33 8.762 -12.810 -2.380 298 HD3 ARG 33 3HD ARG 33 7.331 -13.215 -3.327 299 HE ARG 33 HE ARG 33 7.623 -11.251 -4.580 300 HH11 ARG 33 1HH1 ARG 33 10.051 -11.548 -2.145 301 HH12 ARG 33 2HH1 ARG 33 11.104 -10.413 -2.913 302 HH21 ARG 33 1HH2 ARG 33 8.985 -9.829 -5.564 303 HH22 ARG 33 2HH2 ARG 33 10.532 -9.487 -4.859 304 H SER 34 H SER 34 5.199 -11.264 1.138 305 HA SER 34 HA SER 34 3.057 -13.253 1.262 306 HB2 SER 34 2HB SER 34 5.971 -13.897 1.828 307 HB3 SER 34 3HB SER 34 4.620 -14.950 2.248 308 HG SER 34 HG SER 34 5.732 -15.382 0.189 309 HA PRO 35 HA PRO 35 2.251 -11.846 5.365 310 HB2 PRO 35 2HB PRO 35 2.426 -14.278 6.801 311 HB3 PRO 35 3HB PRO 35 0.975 -13.570 6.090 312 HG2 PRO 35 2HG PRO 35 2.770 -15.692 5.021 313 HG3 PRO 35 3HG PRO 35 1.019 -15.498 4.831 314 HD2 PRO 35 2HD PRO 35 2.705 -14.943 2.826 315 HD3 PRO 35 3HD PRO 35 1.254 -13.955 3.103 316 H GLN 36 H GLN 36 4.896 -14.282 5.358 317 HA GLN 36 HA GLN 36 6.151 -13.415 7.718 318 HB2 GLN 36 2HB GLN 36 8.105 -14.634 6.987 319 HB3 GLN 36 3HB GLN 36 6.669 -15.554 6.557 320 HG2 GLN 36 2HG GLN 36 6.857 -14.876 4.257 321 HG3 GLN 36 3HG GLN 36 8.182 -13.781 4.646 322 HE21 GLN 36 1HE2 GLN 36 9.612 -14.759 3.261 323 HE22 GLN 36 2HE2 GLN 36 10.276 -16.330 3.553 324 H GLU 37 H GLU 37 6.424 -12.237 4.414 325 HA GLU 37 HA GLU 37 8.723 -10.607 4.754 326 HB2 GLU 37 2HB GLU 37 6.472 -10.040 2.817 327 HB3 GLU 37 3HB GLU 37 8.175 -9.656 2.633 328 HG2 GLU 37 2HG GLU 37 7.098 -12.468 2.697 329 HG3 GLU 37 3HG GLU 37 7.306 -11.540 1.217 330 H LEU 38 H LEU 38 5.241 -9.951 4.947 331 HA LEU 38 HA LEU 38 5.413 -7.199 5.581 332 HB2 LEU 38 2HB LEU 38 3.392 -8.594 4.792 333 HB3 LEU 38 3HB LEU 38 3.192 -9.045 6.471 334 HG LEU 38 HG LEU 38 3.194 -6.156 5.581 335 HD11 LEU 38 1HD1 LEU 38 0.815 -8.000 5.838 336 HD12 LEU 38 2HD1 LEU 38 1.443 -7.310 4.339 337 HD13 LEU 38 3HD1 LEU 38 0.747 -6.256 5.571 338 HD21 LEU 38 3HD2 LEU 38 1.955 -5.805 7.664 339 HD22 LEU 38 1HD2 LEU 38 3.530 -6.538 7.974 340 HD23 LEU 38 2HD2 LEU 38 2.069 -7.528 8.029 341 H LYS 39 H LYS 39 5.187 -10.105 7.617 342 HA LYS 39 HA LYS 39 5.136 -8.903 10.134 343 HB2 LYS 39 2HB LYS 39 4.792 -11.317 9.742 344 HB3 LYS 39 3HB LYS 39 6.496 -11.490 9.340 345 HG2 LYS 39 2HG LYS 39 6.999 -10.640 11.680 346 HG3 LYS 39 3HG LYS 39 5.278 -10.837 12.019 347 HD2 LYS 39 2HD LYS 39 7.186 -13.007 11.129 348 HD3 LYS 39 3HD LYS 39 6.548 -12.788 12.759 349 HE2 LYS 39 2HE LYS 39 4.318 -13.290 12.020 350 HE3 LYS 39 3HE LYS 39 4.821 -13.292 10.331 351 HZ1 LYS 39 3HZ LYS 39 4.591 -15.529 11.163 352 HZ2 LYS 39 1HZ LYS 39 5.701 -15.224 12.405 353 HZ3 LYS 39 2HZ LYS 39 6.213 -15.215 10.793 354 H ASP 40 H ASP 40 7.972 -10.020 8.271 355 HA ASP 40 HA ASP 40 9.958 -9.285 10.084 356 HB2 ASP 40 2HB ASP 40 10.339 -10.719 8.107 357 HB3 ASP 40 3HB ASP 40 10.138 -9.317 7.057 358 H SER 41 H SER 41 8.384 -7.371 7.564 359 HA SER 41 HA SER 41 9.893 -5.030 7.711 360 HB2 SER 41 2HB SER 41 8.145 -5.360 6.023 361 HB3 SER 41 3HB SER 41 6.902 -5.300 7.271 362 HG SER 41 HG SER 41 6.904 -3.249 6.750 363 H ILE 42 H ILE 42 7.011 -5.924 9.625 364 HA ILE 42 HA ILE 42 7.010 -3.601 11.256 365 HB ILE 42 HB ILE 42 5.828 -6.333 11.816 366 HG12 ILE 42 2HG1 ILE 42 4.582 -3.821 10.650 367 HG13 ILE 42 3HG1 ILE 42 4.960 -5.291 9.759 368 HG21 ILE 42 1HG2 ILE 42 5.295 -3.672 13.152 369 HG22 ILE 42 2HG2 ILE 42 6.061 -5.083 13.882 370 HG23 ILE 42 3HG2 ILE 42 4.362 -5.147 13.417 371 HD11 ILE 42 3HD1 ILE 42 2.599 -5.148 10.257 372 HD12 ILE 42 1HD1 ILE 42 2.948 -5.038 11.981 373 HD13 ILE 42 2HD1 ILE 42 3.329 -6.515 11.097 374 H GLU 43 H GLU 43 8.321 -6.874 11.792 375 HA GLU 43 HA GLU 43 9.321 -6.559 14.374 376 HB2 GLU 43 2HB GLU 43 10.517 -8.158 12.093 377 HB3 GLU 43 3HB GLU 43 10.932 -8.354 13.790 378 HG2 GLU 43 2HG GLU 43 8.209 -8.834 12.584 379 HG3 GLU 43 3HG GLU 43 9.382 -10.081 13.000 380 H GLU 44 H GLU 44 10.560 -5.355 11.335 381 HA GLU 44 HA GLU 44 13.032 -4.382 12.479 382 HB2 GLU 44 2HB GLU 44 11.700 -4.160 9.802 383 HB3 GLU 44 3HB GLU 44 12.971 -3.017 10.215 384 HG2 GLU 44 2HG GLU 44 13.327 -6.004 10.364 385 HG3 GLU 44 3HG GLU 44 13.694 -5.052 8.926 386 H LEU 45 H LEU 45 10.023 -2.836 11.309 387 HA LEU 45 HA LEU 45 10.749 -0.193 11.806 388 HB2 LEU 45 2HB LEU 45 8.001 -1.443 11.824 389 HB3 LEU 45 3HB LEU 45 8.301 0.285 11.818 390 HG LEU 45 HG LEU 45 9.101 -1.646 9.629 391 HD11 LEU 45 1HD1 LEU 45 7.394 -0.512 8.296 392 HD12 LEU 45 2HD1 LEU 45 6.933 0.451 9.701 393 HD13 LEU 45 3HD1 LEU 45 6.694 -1.297 9.713 394 HD21 LEU 45 3HD2 LEU 45 9.705 0.359 8.358 395 HD22 LEU 45 1HD2 LEU 45 10.683 0.203 9.816 396 HD23 LEU 45 2HD2 LEU 45 9.353 1.361 9.766 397 H VAL 46 H VAL 46 9.539 -2.581 14.092 398 HA VAL 46 HA VAL 46 8.757 -0.875 16.175 399 HB VAL 46 HB VAL 46 8.345 -3.308 16.189 400 HG11 VAL 46 1HG1 VAL 46 10.089 -4.877 16.846 401 HG12 VAL 46 2HG1 VAL 46 11.274 -3.572 16.877 402 HG13 VAL 46 3HG1 VAL 46 10.526 -4.046 15.353 403 HG21 VAL 46 3HG2 VAL 46 8.737 -3.688 18.585 404 HG22 VAL 46 1HG2 VAL 46 8.137 -2.057 18.278 405 HG23 VAL 46 2HG2 VAL 46 9.849 -2.317 18.622 406 H LYS 47 H LYS 47 11.951 -1.794 15.092 407 HA LYS 47 HA LYS 47 13.160 -0.124 17.218 408 HB2 LYS 47 2HB LYS 47 14.476 -2.241 15.490 409 HB3 LYS 47 3HB LYS 47 15.270 -1.304 16.750 410 HG2 LYS 47 2HG LYS 47 13.780 -2.331 18.424 411 HG3 LYS 47 3HG LYS 47 13.040 -3.299 17.148 412 HD2 LYS 47 2HD LYS 47 15.184 -4.375 16.693 413 HD3 LYS 47 3HD LYS 47 15.966 -3.368 17.915 414 HE2 LYS 47 2HE LYS 47 13.792 -5.410 18.404 415 HE3 LYS 47 3HE LYS 47 15.501 -5.595 18.794 416 HZ1 LYS 47 3HZ LYS 47 13.601 -3.660 19.999 417 HZ2 LYS 47 1HZ LYS 47 15.265 -3.664 20.302 418 HZ3 LYS 47 2HZ LYS 47 14.317 -4.987 20.758 419 H LYS 48 H LYS 48 13.654 -1.037 13.816 420 HA LYS 48 HA LYS 48 15.134 1.299 13.103 421 HB2 LYS 48 2HB LYS 48 13.613 -0.492 11.208 422 HB3 LYS 48 3HB LYS 48 15.034 0.480 10.862 423 HG2 LYS 48 2HG LYS 48 14.973 -1.974 12.615 424 HG3 LYS 48 3HG LYS 48 15.530 -1.916 10.945 425 HD2 LYS 48 2HD LYS 48 17.202 -0.149 11.758 426 HD3 LYS 48 3HD LYS 48 16.786 -0.685 13.389 427 HE2 LYS 48 2HE LYS 48 17.957 -2.353 11.157 428 HE3 LYS 48 3HE LYS 48 18.758 -1.862 12.647 429 HZ1 LYS 48 3HZ LYS 48 18.033 -4.141 12.794 430 HZ2 LYS 48 1HZ LYS 48 16.437 -3.708 12.431 431 HZ3 LYS 48 2HZ LYS 48 17.148 -3.204 13.885 432 H TYR 49 H TYR 49 13.618 3.044 13.841 433 HA TYR 49 HA TYR 49 11.292 3.287 12.063 434 HB2 TYR 49 2HB TYR 49 11.180 3.625 14.664 435 HB3 TYR 49 3HB TYR 49 11.769 5.244 14.281 436 HD1 TYR 49 HD1 TYR 49 9.331 2.909 12.677 437 HD2 TYR 49 HD2 TYR 49 10.014 6.801 14.285 438 HE1 TYR 49 HE1 TYR 49 7.037 3.567 12.059 439 HE2 TYR 49 HE2 TYR 49 7.725 7.463 13.663 440 HH TYR 49 HH TYR 49 5.334 5.286 12.853 441 H ASN 50 H ASN 50 12.175 3.921 10.187 442 HA ASN 50 HA ASN 50 13.283 6.638 10.062 443 HB2 ASN 50 2HB ASN 50 15.173 5.003 10.053 444 HB3 ASN 50 3HB ASN 50 14.481 4.245 8.624 445 HD21 ASN 50 1HD2 ASN 50 16.130 7.038 9.868 446 HD22 ASN 50 2HD2 ASN 50 16.567 7.701 8.336 447 H ALA 51 H ALA 51 13.348 7.367 7.657 448 HA ALA 51 HA ALA 51 10.762 7.295 6.604 449 HB1 ALA 51 3HB ALA 51 12.363 9.098 6.163 450 HB2 ALA 51 1HB ALA 51 11.680 8.455 4.669 451 HB3 ALA 51 2HB ALA 51 13.314 8.005 5.158 452 H THR 52 H THR 52 10.037 5.179 6.309 453 HA THR 52 HA THR 52 10.926 3.893 3.833 454 HB THR 52 HB THR 52 10.827 2.420 6.483 455 HG1 THR 52 HG1 THR 52 12.790 3.644 5.820 456 HG21 THR 52 3HG2 THR 52 11.447 0.412 5.178 457 HG22 THR 52 1HG2 THR 52 11.238 1.330 3.688 458 HG23 THR 52 2HG2 THR 52 9.851 1.019 4.734 459 H ILE 53 H ILE 53 9.193 3.389 2.643 460 HA ILE 53 HA ILE 53 6.576 3.067 3.962 461 HB ILE 53 HB ILE 53 7.194 3.611 1.045 462 HG12 ILE 53 2HG1 ILE 53 6.144 5.457 3.214 463 HG13 ILE 53 3HG1 ILE 53 7.746 5.526 2.488 464 HG21 ILE 53 1HG2 ILE 53 5.105 2.367 1.343 465 HG22 ILE 53 2HG2 ILE 53 4.789 4.016 0.806 466 HG23 ILE 53 3HG2 ILE 53 4.541 3.578 2.495 467 HD11 ILE 53 3HD1 ILE 53 6.292 7.247 1.585 468 HD12 ILE 53 1HD1 ILE 53 5.137 6.021 1.062 469 HD13 ILE 53 2HD1 ILE 53 6.741 6.091 0.332 470 H VAL 54 H VAL 54 5.505 1.155 3.891 471 HA VAL 54 HA VAL 54 6.849 -1.125 2.658 472 HB VAL 54 HB VAL 54 6.160 -1.411 4.962 473 HG11 VAL 54 1HG1 VAL 54 3.333 -0.914 4.018 474 HG12 VAL 54 2HG1 VAL 54 4.295 0.159 5.035 475 HG13 VAL 54 3HG1 VAL 54 3.803 -1.424 5.638 476 HG21 VAL 54 3HG2 VAL 54 6.120 -3.389 3.529 477 HG22 VAL 54 1HG2 VAL 54 4.437 -3.069 3.113 478 HG23 VAL 54 2HG2 VAL 54 4.873 -3.487 4.772 479 H VAL 55 H VAL 55 6.212 -2.081 0.823 480 HA VAL 55 HA VAL 55 3.560 -1.391 -0.286 481 HB VAL 55 HB VAL 55 6.066 -1.952 -1.892 482 HG11 VAL 55 1HG1 VAL 55 4.722 -1.095 -3.787 483 HG12 VAL 55 2HG1 VAL 55 3.317 -1.002 -2.724 484 HG13 VAL 55 3HG1 VAL 55 4.049 -2.565 -3.085 485 HG21 VAL 55 3HG2 VAL 55 6.069 0.451 -2.425 486 HG22 VAL 55 1HG2 VAL 55 6.295 0.166 -0.699 487 HG23 VAL 55 2HG2 VAL 55 4.729 0.697 -1.306 488 H VAL 56 H VAL 56 2.278 -3.109 -0.212 489 HA VAL 56 HA VAL 56 3.335 -5.821 -0.403 490 HB VAL 56 HB VAL 56 0.502 -4.867 0.094 491 HG11 VAL 56 1HG1 VAL 56 0.063 -7.157 0.832 492 HG12 VAL 56 2HG1 VAL 56 1.712 -7.618 0.413 493 HG13 VAL 56 3HG1 VAL 56 0.586 -7.125 -0.851 494 HG21 VAL 56 3HG2 VAL 56 0.917 -5.445 2.445 495 HG22 VAL 56 1HG2 VAL 56 2.015 -4.180 1.891 496 HG23 VAL 56 2HG2 VAL 56 2.592 -5.840 2.055 497 H VAL 57 H VAL 57 3.651 -6.566 -2.429 498 HA VAL 57 HA VAL 57 1.877 -5.841 -4.623 499 HB VAL 57 HB VAL 57 4.194 -7.797 -4.619 500 HG11 VAL 57 1HG1 VAL 57 4.161 -7.485 -7.059 501 HG12 VAL 57 2HG1 VAL 57 2.737 -6.457 -6.904 502 HG13 VAL 57 3HG1 VAL 57 2.644 -8.162 -6.466 503 HG21 VAL 57 3HG2 VAL 57 5.521 -5.982 -5.607 504 HG22 VAL 57 1HG2 VAL 57 4.952 -5.553 -3.993 505 HG23 VAL 57 2HG2 VAL 57 4.158 -4.879 -5.418 506 H VAL 58 H VAL 58 0.017 -6.939 -4.977 507 HA VAL 58 HA VAL 58 -0.278 -9.544 -3.645 508 HB VAL 58 HB VAL 58 -2.701 -9.188 -3.736 509 HG11 VAL 58 1HG1 VAL 58 -1.462 -8.434 -1.783 510 HG12 VAL 58 2HG1 VAL 58 -2.808 -7.343 -2.113 511 HG13 VAL 58 3HG1 VAL 58 -1.163 -6.874 -2.549 512 HG21 VAL 58 3HG2 VAL 58 -2.858 -7.851 -5.769 513 HG22 VAL 58 1HG2 VAL 58 -2.017 -6.517 -4.977 514 HG23 VAL 58 2HG2 VAL 58 -3.616 -7.009 -4.418 515 H ASP 59 H ASP 59 -0.699 -11.370 -4.672 516 HA ASP 59 HA ASP 59 -1.042 -11.342 -7.590 517 HB2 ASP 59 2HB ASP 59 -0.482 -13.802 -7.359 518 HB3 ASP 59 3HB ASP 59 0.797 -12.689 -6.882 519 H ASP 60 H ASP 60 -2.730 -12.153 -4.653 520 HA ASP 60 HA ASP 60 -5.085 -12.894 -6.247 521 HB2 ASP 60 2HB ASP 60 -3.978 -14.973 -5.429 522 HB3 ASP 60 3HB ASP 60 -4.193 -14.407 -3.776 523 H LYS 61 H LYS 61 -7.109 -12.539 -5.216 524 HA LYS 61 HA LYS 61 -7.377 -10.177 -3.774 525 HB2 LYS 61 2HB LYS 61 -9.726 -10.811 -3.462 526 HB3 LYS 61 3HB LYS 61 -9.192 -11.169 -5.100 527 HG2 LYS 61 2HG LYS 61 -8.911 -13.531 -4.479 528 HG3 LYS 61 3HG LYS 61 -9.483 -13.159 -2.852 529 HD2 LYS 61 2HD LYS 61 -11.634 -12.395 -3.825 530 HD3 LYS 61 3HD LYS 61 -11.056 -12.883 -5.421 531 HE2 LYS 61 2HE LYS 61 -10.793 -15.197 -4.572 532 HE3 LYS 61 3HE LYS 61 -11.473 -14.680 -3.030 533 HZ1 LYS 61 3HZ LYS 61 -13.521 -14.105 -4.157 534 HZ2 LYS 61 1HZ LYS 61 -13.126 -15.727 -4.441 535 HZ3 LYS 61 2HZ LYS 61 -12.864 -14.574 -5.647 536 H GLU 62 H GLU 62 -7.293 -13.521 -2.569 537 HA GLU 62 HA GLU 62 -8.043 -12.982 0.088 538 HB2 GLU 62 2HB GLU 62 -8.029 -15.247 -0.830 539 HB3 GLU 62 3HB GLU 62 -6.279 -15.193 -0.993 540 HG2 GLU 62 2HG GLU 62 -6.035 -15.061 1.426 541 HG3 GLU 62 3HG GLU 62 -7.788 -15.050 1.616 542 H TRP 63 H TRP 63 -4.783 -13.263 -1.353 543 HA TRP 63 HA TRP 63 -3.299 -12.681 0.936 544 HB2 TRP 63 2HB TRP 63 -2.151 -13.495 -0.995 545 HB3 TRP 63 3HB TRP 63 -2.732 -12.167 -1.989 546 HD1 TRP 63 HD1 TRP 63 -0.532 -11.033 -2.684 547 HE1 TRP 63 HE1 TRP 63 1.420 -9.920 -1.442 548 HE3 TRP 63 HE3 TRP 63 -1.698 -12.431 2.106 549 HZ2 TRP 63 HZ2 TRP 63 2.345 -9.663 1.206 550 HZ3 TRP 63 HZ3 TRP 63 -0.221 -11.702 3.934 551 HH2 TRP 63 HH2 TRP 63 1.760 -10.347 3.490 552 H ALA 64 H ALA 64 -4.728 -10.452 -1.447 553 HA ALA 64 HA ALA 64 -3.821 -8.028 -0.412 554 HB1 ALA 64 3HB ALA 64 -6.521 -8.606 -1.643 555 HB2 ALA 64 1HB ALA 64 -5.042 -8.227 -2.526 556 HB3 ALA 64 2HB ALA 64 -5.776 -7.016 -1.479 557 H GLU 65 H GLU 65 -6.754 -9.856 0.466 558 HA GLU 65 HA GLU 65 -7.587 -8.107 2.535 559 HB2 GLU 65 2HB GLU 65 -8.179 -11.052 2.153 560 HB3 GLU 65 3HB GLU 65 -9.023 -9.984 3.267 561 HG2 GLU 65 2HG GLU 65 -9.734 -8.611 1.309 562 HG3 GLU 65 3HG GLU 65 -9.014 -9.832 0.258 563 H LYS 66 H LYS 66 -5.433 -10.912 2.514 564 HA LYS 66 HA LYS 66 -5.295 -11.295 5.309 565 HB2 LYS 66 2HB LYS 66 -3.349 -12.018 3.115 566 HB3 LYS 66 3HB LYS 66 -3.114 -12.472 4.797 567 HG2 LYS 66 2HG LYS 66 -5.325 -13.647 4.706 568 HG3 LYS 66 3HG LYS 66 -5.354 -13.324 2.972 569 HD2 LYS 66 2HD LYS 66 -4.522 -15.576 3.419 570 HD3 LYS 66 3HD LYS 66 -3.256 -14.575 2.704 571 HE2 LYS 66 2HE LYS 66 -2.399 -15.946 4.551 572 HE3 LYS 66 3HE LYS 66 -2.263 -14.224 4.901 573 HZ1 LYS 66 3HZ LYS 66 -4.369 -16.048 5.931 574 HZ2 LYS 66 1HZ LYS 66 -4.271 -14.391 6.256 575 HZ3 LYS 66 2HZ LYS 66 -3.067 -15.437 6.815 576 H ALA 67 H ALA 67 -3.263 -9.362 3.118 577 HA ALA 67 HA ALA 67 -1.410 -8.448 5.025 578 HB1 ALA 67 3HB ALA 67 -1.126 -8.174 2.596 579 HB2 ALA 67 1HB ALA 67 -0.927 -6.648 3.459 580 HB3 ALA 67 2HB ALA 67 -2.425 -6.980 2.586 581 H ILE 68 H ILE 68 -4.426 -6.915 3.882 582 HA ILE 68 HA ILE 68 -4.432 -4.738 5.670 583 HB ILE 68 HB ILE 68 -6.859 -6.148 4.519 584 HG12 ILE 68 2HG1 ILE 68 -5.327 -5.542 2.718 585 HG13 ILE 68 3HG1 ILE 68 -6.726 -4.475 2.691 586 HG21 ILE 68 1HG2 ILE 68 -6.512 -3.328 5.552 587 HG22 ILE 68 2HG2 ILE 68 -7.453 -4.615 6.304 588 HG23 ILE 68 3HG2 ILE 68 -7.957 -3.948 4.751 589 HD11 ILE 68 3HD1 ILE 68 -3.999 -3.810 3.773 590 HD12 ILE 68 1HD1 ILE 68 -5.399 -2.736 3.798 591 HD13 ILE 68 2HD1 ILE 68 -4.701 -3.240 2.260 592 H ARG 69 H ARG 69 -5.681 -8.025 5.987 593 HA ARG 69 HA ARG 69 -7.062 -7.665 8.439 594 HB2 ARG 69 2HB ARG 69 -7.490 -9.535 6.872 595 HB3 ARG 69 3HB ARG 69 -5.914 -10.211 7.260 596 HG2 ARG 69 2HG ARG 69 -6.614 -10.537 9.577 597 HG3 ARG 69 3HG ARG 69 -8.186 -9.826 9.207 598 HD2 ARG 69 2HD ARG 69 -8.607 -11.636 7.589 599 HD3 ARG 69 3HD ARG 69 -7.048 -12.355 8.002 600 HE ARG 69 HE ARG 69 -8.387 -12.119 10.385 601 HH11 ARG 69 1HH1 ARG 69 -9.007 -13.688 7.375 602 HH12 ARG 69 2HH1 ARG 69 -9.917 -14.964 8.111 603 HH21 ARG 69 1HH2 ARG 69 -9.573 -13.741 11.298 604 HH22 ARG 69 2HH2 ARG 69 -10.259 -14.973 10.290 605 H PHE 70 H PHE 70 -3.729 -8.531 7.671 606 HA PHE 70 HA PHE 70 -2.922 -9.274 10.282 607 HB2 PHE 70 2HB PHE 70 -1.644 -9.641 8.098 608 HB3 PHE 70 3HB PHE 70 -1.152 -7.955 8.202 609 HD1 PHE 70 HD2 PHE 70 0.306 -7.209 10.087 610 HD2 PHE 70 HD1 PHE 70 -0.612 -11.319 9.428 611 HE1 PHE 70 HE2 PHE 70 2.193 -7.862 11.525 612 HE2 PHE 70 HE1 PHE 70 1.277 -11.972 10.863 613 HZ PHE 70 HZ PHE 70 2.682 -10.245 11.914 614 H VAL 71 H VAL 71 -2.765 -6.173 8.537 615 HA VAL 71 HA VAL 71 -1.804 -4.606 10.688 616 HB VAL 71 HB VAL 71 -3.531 -3.704 8.363 617 HG11 VAL 71 1HG1 VAL 71 -2.505 -1.502 8.737 618 HG12 VAL 71 2HG1 VAL 71 -1.658 -2.138 10.148 619 HG13 VAL 71 3HG1 VAL 71 -3.419 -2.042 10.146 620 HG21 VAL 71 3HG2 VAL 71 -1.404 -3.140 7.249 621 HG22 VAL 71 1HG2 VAL 71 -1.549 -4.870 7.555 622 HG23 VAL 71 2HG2 VAL 71 -0.519 -3.877 8.585 623 H LYS 72 H LYS 72 -5.043 -5.556 9.693 624 HA LYS 72 HA LYS 72 -6.574 -3.933 11.379 625 HB2 LYS 72 2HB LYS 72 -7.453 -5.346 9.525 626 HB3 LYS 72 3HB LYS 72 -7.170 -6.773 10.507 627 HG2 LYS 72 2HG LYS 72 -9.522 -6.088 10.510 628 HG3 LYS 72 3HG LYS 72 -8.815 -6.028 12.127 629 HD2 LYS 72 2HD LYS 72 -8.679 -3.665 12.088 630 HD3 LYS 72 3HD LYS 72 -8.978 -3.597 10.351 631 HE2 LYS 72 2HE LYS 72 -10.927 -2.917 11.734 632 HE3 LYS 72 3HE LYS 72 -11.261 -4.268 10.654 633 HZ1 LYS 72 3HZ LYS 72 -10.605 -4.554 13.536 634 HZ2 LYS 72 1HZ LYS 72 -11.102 -5.778 12.480 635 HZ3 LYS 72 2HZ LYS 72 -12.176 -4.547 12.912 636 H SER 73 H SER 73 -4.962 -7.020 12.009 637 HA SER 73 HA SER 73 -6.005 -7.468 14.605 638 HB2 SER 73 2HB SER 73 -4.874 -9.246 13.348 639 HB3 SER 73 3HB SER 73 -3.352 -8.363 13.437 640 HG SER 73 HG SER 73 -3.671 -10.071 15.044 641 H LEU 74 H LEU 74 -3.355 -5.485 13.442 642 HA LEU 74 HA LEU 74 -2.055 -4.997 15.893 643 HB2 LEU 74 2HB LEU 74 -2.321 -3.137 13.522 644 HB3 LEU 74 3HB LEU 74 -1.138 -2.992 14.809 645 HG LEU 74 HG LEU 74 -1.290 -5.277 12.831 646 HD11 LEU 74 1HD1 LEU 74 0.735 -4.328 11.866 647 HD12 LEU 74 2HD1 LEU 74 0.658 -2.978 13.002 648 HD13 LEU 74 3HD1 LEU 74 -0.603 -3.181 11.783 649 HD21 LEU 74 3HD2 LEU 74 -0.394 -5.977 14.994 650 HD22 LEU 74 1HD2 LEU 74 0.769 -4.653 14.953 651 HD23 LEU 74 2HD2 LEU 74 0.869 -5.952 13.763 652 H GLY 75 H GLY 75 -4.805 -3.397 14.345 653 HA2 GLY 75 2HA GLY 75 -6.517 -2.160 15.285 654 HA3 GLY 75 3HA GLY 75 -5.813 -2.455 16.865 655 H ALA 76 H ALA 76 -4.662 -0.741 13.945 656 HA ALA 76 HA ALA 76 -4.537 1.756 15.489 657 HB1 ALA 76 3HB ALA 76 -2.261 2.215 14.747 658 HB2 ALA 76 1HB ALA 76 -2.201 0.657 13.922 659 HB3 ALA 76 2HB ALA 76 -2.322 0.719 15.679 660 H GLN 77 H GLN 77 -4.355 3.682 14.161 661 HA GLN 77 HA GLN 77 -5.731 3.386 11.620 662 HB2 GLN 77 2HB GLN 77 -5.896 5.836 11.638 663 HB3 GLN 77 3HB GLN 77 -6.476 5.137 13.141 664 HG2 GLN 77 2HG GLN 77 -4.308 5.706 14.199 665 HG3 GLN 77 3HG GLN 77 -3.823 6.495 12.699 666 HE21 GLN 77 1HE2 GLN 77 -4.130 7.643 15.343 667 HE22 GLN 77 2HE2 GLN 77 -5.300 8.901 15.192 668 H VAL 78 H VAL 78 -4.739 3.235 9.721 669 HA VAL 78 HA VAL 78 -2.168 4.603 9.301 670 HB VAL 78 HB VAL 78 -1.251 2.698 8.066 671 HG11 VAL 78 1HG1 VAL 78 -2.122 1.924 10.856 672 HG12 VAL 78 2HG1 VAL 78 -0.701 2.878 10.434 673 HG13 VAL 78 3HG1 VAL 78 -0.801 1.188 9.946 674 HG21 VAL 78 3HG2 VAL 78 -3.720 1.192 8.946 675 HG22 VAL 78 1HG2 VAL 78 -2.327 0.493 8.118 676 HG23 VAL 78 2HG2 VAL 78 -3.337 1.682 7.297 677 H LEU 79 H LEU 79 -1.708 5.154 7.112 678 HA LEU 79 HA LEU 79 -4.083 5.515 5.459 679 HB2 LEU 79 2HB LEU 79 -2.143 7.218 5.952 680 HB3 LEU 79 3HB LEU 79 -1.296 6.353 4.690 681 HG LEU 79 HG LEU 79 -2.303 8.359 3.785 682 HD11 LEU 79 1HD1 LEU 79 -2.225 6.408 2.309 683 HD12 LEU 79 2HD1 LEU 79 -3.606 7.445 1.952 684 HD13 LEU 79 3HD1 LEU 79 -3.842 5.940 2.840 685 HD21 LEU 79 3HD2 LEU 79 -4.726 8.699 3.763 686 HD22 LEU 79 1HD2 LEU 79 -4.082 8.668 5.407 687 HD23 LEU 79 2HD2 LEU 79 -4.938 7.263 4.766 688 H ILE 80 H ILE 80 -4.615 4.106 3.846 689 HA ILE 80 HA ILE 80 -2.483 2.328 2.811 690 HB ILE 80 HB ILE 80 -5.417 1.669 3.170 691 HG12 ILE 80 2HG1 ILE 80 -2.946 0.630 4.596 692 HG13 ILE 80 3HG1 ILE 80 -4.162 1.698 5.289 693 HG21 ILE 80 1HG2 ILE 80 -4.545 0.585 1.178 694 HG22 ILE 80 2HG2 ILE 80 -4.767 -0.613 2.453 695 HG23 ILE 80 3HG2 ILE 80 -3.151 -0.013 2.079 696 HD11 ILE 80 3HD1 ILE 80 -4.466 -0.570 6.058 697 HD12 ILE 80 1HD1 ILE 80 -4.593 -1.143 4.396 698 HD13 ILE 80 2HD1 ILE 80 -5.833 -0.077 5.057 699 H ILE 81 H ILE 81 -2.000 2.685 0.749 700 HA ILE 81 HA ILE 81 -4.029 3.834 -1.059 701 HB ILE 81 HB ILE 81 -1.031 3.648 -1.457 702 HG12 ILE 81 2HG1 ILE 81 -2.739 6.023 -0.645 703 HG13 ILE 81 3HG1 ILE 81 -1.613 5.162 0.399 704 HG21 ILE 81 1HG2 ILE 81 -3.148 5.122 -3.035 705 HG22 ILE 81 2HG2 ILE 81 -2.251 3.698 -3.562 706 HG23 ILE 81 3HG2 ILE 81 -1.409 5.224 -3.308 707 HD11 ILE 81 3HD1 ILE 81 -0.912 6.777 -2.042 708 HD12 ILE 81 1HD1 ILE 81 0.236 5.861 -1.065 709 HD13 ILE 81 2HD1 ILE 81 -0.635 7.221 -0.357 710 H ILE 82 H ILE 82 -4.756 2.700 -2.804 711 HA ILE 82 HA ILE 82 -3.472 0.111 -3.414 712 HB ILE 82 HB ILE 82 -6.418 0.794 -3.553 713 HG12 ILE 82 2HG1 ILE 82 -4.875 -1.133 -1.786 714 HG13 ILE 82 3HG1 ILE 82 -5.622 0.375 -1.268 715 HG21 ILE 82 1HG2 ILE 82 -5.790 -0.657 -5.408 716 HG22 ILE 82 2HG2 ILE 82 -6.748 -1.549 -4.227 717 HG23 ILE 82 3HG2 ILE 82 -5.000 -1.770 -4.293 718 HD11 ILE 82 3HD1 ILE 82 -6.954 -1.551 -0.621 719 HD12 ILE 82 1HD1 ILE 82 -7.083 -2.048 -2.309 720 HD13 ILE 82 2HD1 ILE 82 -7.826 -0.542 -1.773 721 H TYR 83 H TYR 83 -2.832 -0.214 -5.453 722 HA TYR 83 HA TYR 83 -3.637 1.740 -7.519 723 HB2 TYR 83 2HB TYR 83 -1.270 1.882 -6.954 724 HB3 TYR 83 3HB TYR 83 -1.067 0.159 -7.236 725 HD1 TYR 83 HD1 TYR 83 -1.151 -0.734 -9.566 726 HD2 TYR 83 HD2 TYR 83 -1.254 3.452 -8.780 727 HE1 TYR 83 HE1 TYR 83 -0.549 -0.284 -11.904 728 HE2 TYR 83 HE2 TYR 83 -0.660 3.908 -11.122 729 HH TYR 83 HH TYR 83 -0.829 1.609 -13.547 730 H ASP 84 H ASP 84 -4.821 0.993 -9.147 731 HA ASP 84 HA ASP 84 -4.223 -1.573 -10.359 732 HB2 ASP 84 2HB ASP 84 -5.923 -2.142 -8.642 733 HB3 ASP 84 3HB ASP 84 -7.032 -0.987 -9.377 734 H GLN 85 H GLN 85 -5.510 -1.854 -12.438 735 HA GLN 85 HA GLN 85 -5.543 0.763 -13.778 736 HB2 GLN 85 2HB GLN 85 -5.221 -2.031 -14.888 737 HB3 GLN 85 3HB GLN 85 -5.238 -0.567 -15.863 738 HG2 GLN 85 2HG GLN 85 -3.243 -1.117 -13.667 739 HG3 GLN 85 3HG GLN 85 -2.962 -1.443 -15.380 740 HE21 GLN 85 1HE2 GLN 85 -3.460 1.073 -12.994 741 HE22 GLN 85 2HE2 GLN 85 -2.823 2.366 -13.945 742 H ASP 86 H ASP 86 -7.809 -1.203 -12.464 743 HA ASP 86 HA ASP 86 -9.819 -0.488 -14.511 744 HB2 ASP 86 2HB ASP 86 -9.666 -2.902 -14.169 745 HB3 ASP 86 3HB ASP 86 -9.883 -2.694 -12.434 746 H GLN 87 H GLN 87 -12.003 0.066 -13.627 747 HA GLN 87 HA GLN 87 -11.732 1.778 -11.257 748 HB2 GLN 87 2HB GLN 87 -14.002 1.600 -13.255 749 HB3 GLN 87 3HB GLN 87 -13.855 2.781 -11.960 750 HG2 GLN 87 2HG GLN 87 -11.729 3.560 -13.056 751 HG3 GLN 87 3HG GLN 87 -12.145 2.522 -14.421 752 HE21 GLN 87 1HE2 GLN 87 -13.951 3.051 -15.685 753 HE22 GLN 87 2HE2 GLN 87 -14.645 4.632 -15.661 754 H ASN 88 H ASN 88 -13.901 -0.740 -12.545 755 HA ASN 88 HA ASN 88 -15.734 -0.719 -10.421 756 HB2 ASN 88 2HB ASN 88 -16.065 -1.730 -12.716 757 HB3 ASN 88 3HB ASN 88 -15.098 -3.099 -12.180 758 HD21 ASN 88 1HD2 ASN 88 -16.807 -4.538 -12.402 759 HD22 ASN 88 2HD2 ASN 88 -18.152 -4.544 -11.319 760 H ARG 89 H ARG 89 -13.204 -3.168 -11.075 761 HA ARG 89 HA ARG 89 -13.523 -4.581 -8.664 762 HB2 ARG 89 2HB ARG 89 -12.370 -5.444 -10.693 763 HB3 ARG 89 3HB ARG 89 -11.028 -4.358 -10.366 764 HG2 ARG 89 2HG ARG 89 -10.513 -6.615 -9.638 765 HG3 ARG 89 3HG ARG 89 -10.594 -5.522 -8.257 766 HD2 ARG 89 2HD ARG 89 -12.821 -6.324 -7.712 767 HD3 ARG 89 3HD ARG 89 -12.833 -7.345 -9.149 768 HE ARG 89 HE ARG 89 -10.734 -8.349 -7.936 769 HH11 ARG 89 1HH1 ARG 89 -13.739 -7.392 -6.520 770 HH12 ARG 89 2HH1 ARG 89 -13.614 -8.545 -5.243 771 HH21 ARG 89 1HH2 ARG 89 -10.607 -9.821 -6.297 772 HH22 ARG 89 2HH2 ARG 89 -11.874 -9.897 -5.115 773 H LEU 90 H LEU 90 -11.237 -2.017 -9.548 774 HA LEU 90 HA LEU 90 -9.712 -1.902 -7.226 775 HB2 LEU 90 2HB LEU 90 -9.096 -0.713 -9.230 776 HB3 LEU 90 3HB LEU 90 -10.534 0.283 -9.138 777 HG LEU 90 HG LEU 90 -9.654 1.360 -7.094 778 HD11 LEU 90 1HD1 LEU 90 -8.297 -0.442 -6.215 779 HD12 LEU 90 2HD1 LEU 90 -7.316 1.005 -6.438 780 HD13 LEU 90 3HD1 LEU 90 -7.201 -0.324 -7.591 781 HD21 LEU 90 3HD2 LEU 90 -7.848 2.629 -8.184 782 HD22 LEU 90 1HD2 LEU 90 -9.238 2.396 -9.247 783 HD23 LEU 90 2HD2 LEU 90 -7.787 1.418 -9.464 784 H GLU 91 H GLU 91 -12.646 0.018 -7.989 785 HA GLU 91 HA GLU 91 -12.671 1.303 -5.442 786 HB2 GLU 91 2HB GLU 91 -14.779 1.116 -7.600 787 HB3 GLU 91 3HB GLU 91 -14.974 2.066 -6.132 788 HG2 GLU 91 2HG GLU 91 -12.872 3.297 -6.770 789 HG3 GLU 91 3HG GLU 91 -12.947 2.466 -8.323 790 H GLU 92 H GLU 92 -14.296 -1.574 -6.708 791 HA GLU 92 HA GLU 92 -16.215 -2.015 -4.754 792 HB2 GLU 92 2HB GLU 92 -15.956 -3.443 -6.751 793 HB3 GLU 92 3HB GLU 92 -14.470 -4.106 -6.084 794 HG2 GLU 92 2HG GLU 92 -15.899 -4.855 -4.097 795 HG3 GLU 92 3HG GLU 92 -17.290 -4.493 -5.117 796 H PHE 93 H PHE 93 -12.894 -3.337 -4.737 797 HA PHE 93 HA PHE 93 -12.999 -4.378 -2.118 798 HB2 PHE 93 2HB PHE 93 -11.337 -5.020 -3.873 799 HB3 PHE 93 3HB PHE 93 -10.545 -3.465 -3.648 800 HD1 PHE 93 HD1 PHE 93 -11.785 -6.220 -1.435 801 HD2 PHE 93 HD2 PHE 93 -8.593 -3.579 -2.433 802 HE1 PHE 93 HE1 PHE 93 -10.411 -7.208 0.352 803 HE2 PHE 93 HE2 PHE 93 -7.218 -4.559 -0.643 804 HZ PHE 93 HZ PHE 93 -8.127 -6.378 0.751 805 H SER 94 H SER 94 -12.131 -1.208 -3.357 806 HA SER 94 HA SER 94 -10.978 -0.092 -1.052 807 HB2 SER 94 2HB SER 94 -10.869 1.023 -3.220 808 HB3 SER 94 3HB SER 94 -12.617 1.263 -3.212 809 HG SER 94 HG SER 94 -10.620 2.623 -1.849 810 H ARG 95 H ARG 95 -14.392 -0.311 -2.024 811 HA ARG 95 HA ARG 95 -15.560 1.368 -0.135 812 HB2 ARG 95 2HB ARG 95 -16.717 -1.257 -1.105 813 HB3 ARG 95 3HB ARG 95 -17.617 0.097 -0.440 814 HG2 ARG 95 2HG ARG 95 -16.123 0.048 -3.055 815 HG3 ARG 95 3HG ARG 95 -17.870 0.000 -2.840 816 HD2 ARG 95 2HD ARG 95 -17.733 2.247 -1.761 817 HD3 ARG 95 3HD ARG 95 -16.016 2.287 -2.168 818 HE ARG 95 HE ARG 95 -18.179 2.137 -4.171 819 HH11 ARG 95 1HH1 ARG 95 -15.085 3.265 -3.169 820 HH12 ARG 95 2HH1 ARG 95 -14.834 4.186 -4.606 821 HH21 ARG 95 1HH2 ARG 95 -17.867 3.332 -5.986 822 HH22 ARG 95 2HH2 ARG 95 -16.391 4.215 -6.198 823 H GLU 96 H GLU 96 -14.746 -2.074 0.173 824 HA GLU 96 HA GLU 96 -15.817 -2.239 2.838 825 HB2 GLU 96 2HB GLU 96 -14.922 -4.559 2.803 826 HB3 GLU 96 3HB GLU 96 -16.004 -4.183 1.468 827 HG2 GLU 96 2HG GLU 96 -14.056 -3.857 0.005 828 HG3 GLU 96 3HG GLU 96 -12.996 -4.293 1.347 829 H VAL 97 H VAL 97 -12.497 -2.183 1.474 830 HA VAL 97 HA VAL 97 -11.056 -2.532 3.827 831 HB VAL 97 HB VAL 97 -10.382 -0.698 1.508 832 HG11 VAL 97 1HG1 VAL 97 -8.054 -0.821 2.290 833 HG12 VAL 97 2HG1 VAL 97 -8.579 -1.732 3.708 834 HG13 VAL 97 3HG1 VAL 97 -9.096 -0.059 3.494 835 HG21 VAL 97 3HG2 VAL 97 -8.987 -2.545 0.738 836 HG22 VAL 97 1HG2 VAL 97 -10.666 -3.059 0.896 837 HG23 VAL 97 2HG2 VAL 97 -9.485 -3.519 2.123 838 H ARG 98 H ARG 98 -12.454 0.456 2.516 839 HA ARG 98 HA ARG 98 -11.722 2.207 4.582 840 HB2 ARG 98 2HB ARG 98 -12.918 2.622 2.278 841 HB3 ARG 98 3HB ARG 98 -14.394 2.402 3.203 842 HG2 ARG 98 2HG ARG 98 -12.273 4.471 3.789 843 HG3 ARG 98 3HG ARG 98 -13.761 4.766 2.893 844 HD2 ARG 98 2HD ARG 98 -13.497 3.984 5.796 845 HD3 ARG 98 3HD ARG 98 -14.046 5.529 5.153 846 HE ARG 98 HE ARG 98 -15.612 3.190 5.551 847 HH11 ARG 98 1HH1 ARG 98 -15.292 5.936 3.475 848 HH12 ARG 98 2HH1 ARG 98 -16.960 5.916 3.025 849 HH21 ARG 98 1HH2 ARG 98 -17.747 3.214 4.991 850 HH22 ARG 98 2HH2 ARG 98 -18.337 4.403 3.882 851 H ARG 99 H ARG 99 -14.625 0.190 4.186 852 HA ARG 99 HA ARG 99 -15.921 0.942 6.570 853 HB2 ARG 99 2HB ARG 99 -17.005 -0.193 4.635 854 HB3 ARG 99 3HB ARG 99 -16.178 -1.680 5.079 855 HG2 ARG 99 2HG ARG 99 -18.471 -1.720 5.861 856 HG3 ARG 99 3HG ARG 99 -17.361 -1.689 7.232 857 HD2 ARG 99 2HD ARG 99 -17.726 0.739 7.447 858 HD3 ARG 99 3HD ARG 99 -18.861 0.678 6.099 859 HE ARG 99 HE ARG 99 -19.543 -1.098 8.248 860 HH11 ARG 99 1HH1 ARG 99 -19.787 2.136 7.095 861 HH12 ARG 99 2HH1 ARG 99 -21.226 2.465 7.991 862 HH21 ARG 99 1HH2 ARG 99 -21.378 -0.651 9.422 863 HH22 ARG 99 2HH2 ARG 99 -22.109 0.910 9.299 864 H ARG 100 H ARG 100 -13.304 -1.302 6.034 865 HA ARG 100 HA ARG 100 -13.617 -2.789 8.458 866 HB2 ARG 100 2HB ARG 100 -11.103 -2.361 6.816 867 HB3 ARG 100 3HB ARG 100 -11.330 -3.590 8.054 868 HG2 ARG 100 2HG ARG 100 -13.166 -4.559 6.665 869 HG3 ARG 100 3HG ARG 100 -12.757 -3.396 5.405 870 HD2 ARG 100 2HD ARG 100 -10.438 -4.342 5.393 871 HD3 ARG 100 3HD ARG 100 -10.997 -5.590 6.505 872 HE ARG 100 HE ARG 100 -12.379 -5.296 3.941 873 HH11 ARG 100 1HH1 ARG 100 -10.315 -7.154 5.985 874 HH12 ARG 100 2HH1 ARG 100 -10.366 -8.538 4.958 875 HH21 ARG 100 1HH2 ARG 100 -12.421 -7.077 2.615 876 HH22 ARG 100 2HH2 ARG 100 -11.545 -8.501 3.058 877 H GLY 101 H GLY 101 -12.349 0.334 7.724 878 HA2 GLY 101 2HA GLY 101 -12.159 1.875 9.617 879 HA3 GLY 101 3HA GLY 101 -11.374 0.586 10.513 880 H PHE 102 H PHE 102 -10.596 1.234 7.155 881 HA PHE 102 HA PHE 102 -8.139 2.655 7.974 882 HB2 PHE 102 2HB PHE 102 -8.322 0.388 5.973 883 HB3 PHE 102 3HB PHE 102 -6.901 1.400 6.198 884 HD1 PHE 102 HD1 PHE 102 -5.983 1.515 8.651 885 HD2 PHE 102 HD2 PHE 102 -8.463 -1.608 7.147 886 HE1 PHE 102 HE1 PHE 102 -5.168 0.015 10.419 887 HE2 PHE 102 HE2 PHE 102 -7.648 -3.109 8.919 888 HZ PHE 102 HZ PHE 102 -5.994 -2.296 10.556 889 H GLU 103 H GLU 103 -7.560 4.380 6.715 890 HA GLU 103 HA GLU 103 -9.420 5.324 4.743 891 HB2 GLU 103 2HB GLU 103 -6.727 6.390 5.614 892 HB3 GLU 103 3HB GLU 103 -7.760 7.190 4.436 893 HG2 GLU 103 2HG GLU 103 -9.545 7.260 6.206 894 HG3 GLU 103 3HG GLU 103 -8.324 6.710 7.352 895 H VAL 104 H VAL 104 -9.485 4.031 2.971 896 HA VAL 104 HA VAL 104 -7.020 3.269 1.616 897 HB VAL 104 HB VAL 104 -8.683 1.536 1.849 898 HG11 VAL 104 1HG1 VAL 104 -10.557 3.313 0.275 899 HG12 VAL 104 2HG1 VAL 104 -10.681 2.947 1.997 900 HG13 VAL 104 3HG1 VAL 104 -10.887 1.663 0.805 901 HG21 VAL 104 3HG2 VAL 104 -8.529 2.451 -1.030 902 HG22 VAL 104 1HG2 VAL 104 -8.901 0.817 -0.476 903 HG23 VAL 104 2HG2 VAL 104 -7.305 1.505 -0.181 904 H ARG 105 H ARG 105 -6.197 4.318 -0.060 905 HA ARG 105 HA ARG 105 -7.859 6.280 -1.522 906 HB2 ARG 105 2HB ARG 105 -4.845 6.258 -1.189 907 HB3 ARG 105 3HB ARG 105 -5.804 7.526 -1.942 908 HG2 ARG 105 2HG ARG 105 -5.999 6.726 0.960 909 HG3 ARG 105 3HG ARG 105 -5.043 8.076 0.350 910 HD2 ARG 105 2HD ARG 105 -7.011 9.212 -0.411 911 HD3 ARG 105 3HD ARG 105 -8.017 7.805 -0.070 912 HE ARG 105 HE ARG 105 -7.114 8.300 2.351 913 HH11 ARG 105 1HH1 ARG 105 -8.102 10.614 -0.003 914 HH12 ARG 105 2HH1 ARG 105 -8.813 11.659 1.177 915 HH21 ARG 105 1HH2 ARG 105 -7.994 9.690 3.859 916 HH22 ARG 105 2HH2 ARG 105 -8.732 11.159 3.318 917 H THR 106 H THR 106 -8.252 5.820 -3.617 918 HA THR 106 HA THR 106 -6.788 3.584 -4.851 919 HB THR 106 HB THR 106 -8.607 3.445 -6.472 920 HG1 THR 106 HG1 THR 106 -9.811 5.626 -5.065 921 HG21 THR 106 3HG2 THR 106 -9.667 3.693 -3.649 922 HG22 THR 106 1HG2 THR 106 -8.871 2.272 -4.327 923 HG23 THR 106 2HG2 THR 106 -10.427 2.800 -4.968 924 H VAL 107 H VAL 107 -5.338 3.902 -6.419 925 HA VAL 107 HA VAL 107 -5.407 6.443 -7.935 926 HB VAL 107 HB VAL 107 -2.925 6.322 -8.085 927 HG11 VAL 107 1HG1 VAL 107 -4.034 6.442 -5.274 928 HG12 VAL 107 2HG1 VAL 107 -3.989 7.767 -6.434 929 HG13 VAL 107 3HG1 VAL 107 -2.485 7.104 -5.799 930 HG21 VAL 107 3HG2 VAL 107 -3.207 4.119 -6.029 931 HG22 VAL 107 1HG2 VAL 107 -1.693 4.863 -6.540 932 HG23 VAL 107 2HG2 VAL 107 -2.642 3.920 -7.688 933 H THR 108 H THR 108 -5.213 6.333 -10.110 934 HA THR 108 HA THR 108 -5.224 3.661 -11.328 935 HB THR 108 HB THR 108 -6.047 4.827 -13.369 936 HG1 THR 108 HG1 THR 108 -6.494 7.154 -11.834 937 HG21 THR 108 3HG2 THR 108 -7.632 5.410 -10.855 938 HG22 THR 108 1HG2 THR 108 -7.646 3.896 -11.760 939 HG23 THR 108 2HG2 THR 108 -8.279 5.367 -12.497 940 H SER 109 H SER 109 -3.705 6.852 -11.940 941 HA SER 109 HA SER 109 -1.632 5.500 -13.547 942 HB2 SER 109 2HB SER 109 -1.170 7.655 -14.562 943 HB3 SER 109 3HB SER 109 -2.906 7.358 -14.634 944 HG SER 109 HG SER 109 -3.077 9.214 -13.673 945 HA PRO 110 HA PRO 110 1.532 6.181 -10.467 946 HB2 PRO 110 2HB PRO 110 3.322 6.788 -12.768 947 HB3 PRO 110 3HB PRO 110 3.499 5.580 -11.490 948 HG2 PRO 110 2HG PRO 110 2.820 4.848 -13.960 949 HG3 PRO 110 3HG PRO 110 2.089 4.062 -12.546 950 HD2 PRO 110 2HD PRO 110 0.937 6.162 -14.355 951 HD3 PRO 110 3HD PRO 110 0.156 4.728 -13.650 952 H ASP 111 H ASP 111 0.867 8.557 -12.959 953 HA ASP 111 HA ASP 111 2.293 10.722 -11.733 954 HB2 ASP 111 2HB ASP 111 -0.012 10.778 -13.706 955 HB3 ASP 111 3HB ASP 111 1.032 12.141 -13.308 956 H ASP 112 H ASP 112 -1.130 9.715 -11.767 957 HA ASP 112 HA ASP 112 -2.119 11.675 -10.003 958 HB2 ASP 112 2HB ASP 112 -3.592 10.304 -11.382 959 HB3 ASP 112 3HB ASP 112 -3.079 8.849 -10.537 960 H PHE 113 H PHE 113 -0.797 8.440 -9.417 961 HA PHE 113 HA PHE 113 -1.179 8.236 -6.679 962 HB2 PHE 113 2HB PHE 113 -0.382 6.338 -7.915 963 HB3 PHE 113 3HB PHE 113 1.077 7.194 -8.405 964 HD1 PHE 113 HD1 PHE 113 -0.696 5.871 -5.408 965 HD2 PHE 113 HD2 PHE 113 3.023 7.041 -7.120 966 HE1 PHE 113 HE1 PHE 113 0.486 5.006 -3.434 967 HE2 PHE 113 HE2 PHE 113 4.207 6.180 -5.145 968 HZ PHE 113 HZ PHE 113 2.938 5.165 -3.303 969 H LYS 114 H LYS 114 1.344 10.005 -8.424 970 HA LYS 114 HA LYS 114 3.039 10.562 -6.258 971 HB2 LYS 114 2HB LYS 114 2.463 12.206 -8.730 972 HB3 LYS 114 3HB LYS 114 3.764 12.553 -7.603 973 HG2 LYS 114 2HG LYS 114 4.740 10.346 -8.081 974 HG3 LYS 114 3HG LYS 114 3.456 10.052 -9.254 975 HD2 LYS 114 2HD LYS 114 4.208 11.970 -10.574 976 HD3 LYS 114 3HD LYS 114 5.477 12.300 -9.390 977 HE2 LYS 114 2HE LYS 114 6.413 11.112 -11.287 978 HE3 LYS 114 3HE LYS 114 6.458 10.083 -9.858 979 HZ1 LYS 114 3HZ LYS 114 4.397 9.022 -10.682 980 HZ2 LYS 114 1HZ LYS 114 5.720 8.803 -11.714 981 HZ3 LYS 114 2HZ LYS 114 4.524 9.929 -12.103 982 H LYS 115 H LYS 115 0.511 12.696 -7.633 983 HA LYS 115 HA LYS 115 0.740 14.652 -5.606 984 HB2 LYS 115 2HB LYS 115 -1.588 14.122 -7.467 985 HB3 LYS 115 3HB LYS 115 -1.330 15.598 -6.538 986 HG2 LYS 115 2HG LYS 115 0.370 14.528 -8.786 987 HG3 LYS 115 3HG LYS 115 -0.604 16.001 -8.780 988 HD2 LYS 115 2HD LYS 115 0.854 17.077 -7.247 989 HD3 LYS 115 3HD LYS 115 1.665 15.568 -6.837 990 HE2 LYS 115 2HE LYS 115 2.489 15.484 -9.215 991 HE3 LYS 115 3HE LYS 115 1.864 17.124 -9.409 992 HZ1 LYS 115 3HZ LYS 115 3.315 17.865 -7.642 993 HZ2 LYS 115 1HZ LYS 115 4.227 17.086 -8.835 994 HZ3 LYS 115 2HZ LYS 115 3.875 16.288 -7.385 995 H SER 116 H SER 116 -0.929 11.644 -5.666 996 HA SER 116 HA SER 116 -2.607 12.210 -3.397 997 HB2 SER 116 2HB SER 116 -3.140 10.393 -5.013 998 HB3 SER 116 3HB SER 116 -1.703 9.521 -4.482 999 HG SER 116 HG SER 116 -3.373 10.277 -2.431 1000 H LEU 117 H LEU 117 0.400 10.334 -3.843 1001 HA LEU 117 HA LEU 117 0.802 9.632 -1.158 1002 HB2 LEU 117 2HB LEU 117 1.908 8.543 -3.078 1003 HB3 LEU 117 3HB LEU 117 2.863 9.989 -3.343 1004 HG LEU 117 HG LEU 117 3.889 9.660 -1.079 1005 HD11 LEU 117 1HD1 LEU 117 2.462 7.000 -1.185 1006 HD12 LEU 117 2HD1 LEU 117 2.106 8.323 -0.072 1007 HD13 LEU 117 3HD1 LEU 117 3.659 7.491 0.015 1008 HD21 LEU 117 3HD2 LEU 117 4.220 7.387 -3.044 1009 HD22 LEU 117 1HD2 LEU 117 5.355 7.812 -1.761 1010 HD23 LEU 117 2HD2 LEU 117 5.061 8.938 -3.085 1011 H GLU 118 H GLU 118 2.268 12.301 -3.027 1012 HA GLU 118 HA GLU 118 4.045 13.379 -1.261 1013 HB2 GLU 118 2HB GLU 118 2.153 14.859 -3.105 1014 HB3 GLU 118 3HB GLU 118 3.521 15.612 -2.302 1015 HG2 GLU 118 2HG GLU 118 5.063 14.183 -3.514 1016 HG3 GLU 118 3HG GLU 118 3.715 13.327 -4.262 1017 H ARG 119 H ARG 119 0.547 13.866 -1.225 1018 HA ARG 119 HA ARG 119 0.732 15.790 0.963 1019 HB2 ARG 119 2HB ARG 119 -1.717 14.776 -0.501 1020 HB3 ARG 119 3HB ARG 119 -1.642 16.165 0.579 1021 HG2 ARG 119 2HG ARG 119 -0.209 17.353 -0.962 1022 HG3 ARG 119 3HG ARG 119 -0.110 15.940 -2.014 1023 HD2 ARG 119 2HD ARG 119 -2.599 16.101 -2.299 1024 HD3 ARG 119 3HD ARG 119 -2.535 17.638 -1.435 1025 HE ARG 119 HE ARG 119 -0.785 18.109 -3.361 1026 HH11 ARG 119 1HH1 ARG 119 -3.831 16.532 -3.562 1027 HH12 ARG 119 2HH1 ARG 119 -4.144 17.081 -5.171 1028 HH21 ARG 119 1HH2 ARG 119 -1.182 18.807 -5.438 1029 HH22 ARG 119 2HH2 ARG 119 -2.655 18.355 -6.221 1030 H LEU 120 H LEU 120 -0.599 12.547 0.363 1031 HA LEU 120 HA LEU 120 -1.954 12.175 2.771 1032 HB2 LEU 120 2HB LEU 120 -0.540 10.183 1.003 1033 HB3 LEU 120 3HB LEU 120 -1.537 9.718 2.370 1034 HG LEU 120 HG LEU 120 -2.527 11.284 -0.024 1035 HD11 LEU 120 1HD1 LEU 120 -2.894 8.371 0.667 1036 HD12 LEU 120 2HD1 LEU 120 -1.937 9.019 -0.665 1037 HD13 LEU 120 3HD1 LEU 120 -3.689 9.225 -0.657 1038 HD21 LEU 120 3HD2 LEU 120 -4.041 10.043 2.280 1039 HD22 LEU 120 1HD2 LEU 120 -4.758 10.845 0.881 1040 HD23 LEU 120 2HD2 LEU 120 -3.779 11.769 2.022 1041 H ILE 121 H ILE 121 1.480 11.605 2.038 1042 HA ILE 121 HA ILE 121 2.267 10.414 4.435 1043 HB ILE 121 HB ILE 121 3.828 12.330 2.681 1044 HG12 ILE 121 2HG1 ILE 121 3.788 9.297 2.794 1045 HG13 ILE 121 3HG1 ILE 121 3.051 10.284 1.537 1046 HG21 ILE 121 1HG2 ILE 121 4.837 12.226 4.895 1047 HG22 ILE 121 2HG2 ILE 121 5.848 11.388 3.720 1048 HG23 ILE 121 3HG2 ILE 121 4.838 10.464 4.832 1049 HD11 ILE 121 3HD1 ILE 121 5.160 9.341 0.799 1050 HD12 ILE 121 1HD1 ILE 121 5.997 10.115 2.144 1051 HD13 ILE 121 2HD1 ILE 121 5.256 11.100 0.880 1052 H ARG 122 H ARG 122 1.719 13.826 3.695 1053 HA ARG 122 HA ARG 122 2.719 14.793 6.214 1054 HB2 ARG 122 2HB ARG 122 0.878 16.206 4.268 1055 HB3 ARG 122 3HB ARG 122 1.853 16.953 5.528 1056 HG2 ARG 122 2HG ARG 122 3.893 16.184 4.344 1057 HG3 ARG 122 3HG ARG 122 2.867 15.562 3.051 1058 HD2 ARG 122 2HD ARG 122 3.678 17.711 2.373 1059 HD3 ARG 122 3HD ARG 122 1.964 17.879 2.756 1060 HE ARG 122 HE ARG 122 3.650 18.491 4.984 1061 HH11 ARG 122 1HH1 ARG 122 2.218 19.777 2.125 1062 HH12 ARG 122 2HH1 ARG 122 2.418 21.415 2.633 1063 HH21 ARG 122 1HH2 ARG 122 3.890 20.590 5.634 1064 HH22 ARG 122 2HH2 ARG 122 3.373 21.873 4.595 1065 H GLU 123 H GLU 123 -0.447 13.996 4.883 1066 HA GLU 123 HA GLU 123 -2.060 15.017 6.957 1067 HB2 GLU 123 2HB GLU 123 -2.611 12.710 5.075 1068 HB3 GLU 123 3HB GLU 123 -3.821 13.554 6.031 1069 HG2 GLU 123 2HG GLU 123 -2.124 14.828 3.890 1070 HG3 GLU 123 3HG GLU 123 -3.767 14.239 3.658 1071 H VAL 124 H VAL 124 -0.555 11.827 6.535 1072 HA VAL 124 HA VAL 124 -1.729 10.909 9.069 1073 HB VAL 124 HB VAL 124 -1.821 9.406 7.095 1074 HG11 VAL 124 1HG1 VAL 124 0.210 8.251 6.338 1075 HG12 VAL 124 2HG1 VAL 124 1.184 9.296 7.373 1076 HG13 VAL 124 3HG1 VAL 124 0.279 9.986 6.027 1077 HG21 VAL 124 3HG2 VAL 124 -1.094 7.365 8.246 1078 HG22 VAL 124 1HG2 VAL 124 -1.929 8.463 9.346 1079 HG23 VAL 124 2HG2 VAL 124 -0.169 8.340 9.391 1080 H GLY 125 H GLY 125 1.315 12.013 7.779 1081 HA2 GLY 125 2HA GLY 125 2.795 10.908 10.076 1082 HA3 GLY 125 3HA GLY 125 3.504 11.511 8.592 1083 H SER 126 H SER 126 3.382 13.895 8.238 1084 HA SER 126 HA SER 126 4.399 15.127 10.654 1085 HB2 SER 126 2HB SER 126 5.122 16.956 9.136 1086 HB3 SER 126 3HB SER 126 5.665 15.371 8.589 1087 HG SER 126 HG SER 126 4.839 16.522 6.843 1088 H LEU 127 H LEU 127 1.562 14.740 10.725 1089 HA LEU 127 HA LEU 127 0.184 17.166 10.164 1090 HB2 LEU 127 2HB LEU 127 -1.575 16.145 11.729 1091 HB3 LEU 127 3HB LEU 127 -1.199 15.308 10.238 1092 HG LEU 127 HG LEU 127 0.289 13.765 11.572 1093 HD11 LEU 127 1HD1 LEU 127 -0.116 13.618 13.998 1094 HD12 LEU 127 2HD1 LEU 127 -1.027 15.127 13.918 1095 HD13 LEU 127 3HD1 LEU 127 0.694 15.113 13.529 1096 HD21 LEU 127 3HD2 LEU 127 -1.957 13.117 10.860 1097 HD22 LEU 127 1HD2 LEU 127 -2.633 13.819 12.330 1098 HD23 LEU 127 2HD2 LEU 127 -1.557 12.423 12.432 1099 H GLU 128 H GLU 128 2.153 16.173 12.809 1100 HA GLU 128 HA GLU 128 2.935 17.219 14.658 1101 HB2 GLU 128 2HB GLU 128 1.528 19.623 13.491 1102 HB3 GLU 128 3HB GLU 128 2.529 19.686 14.935 1103 HG2 GLU 128 2HG GLU 128 4.453 18.901 13.617 1104 HG3 GLU 128 3HG GLU 128 3.439 18.896 12.175 1105 H HIS 129 H HIS 129 -0.372 18.546 14.244 1106 HA HIS 129 HA HIS 129 -1.068 18.816 16.891 1107 HB2 HIS 129 2HB HIS 129 -2.409 19.588 14.931 1108 HB3 HIS 129 3HB HIS 129 -2.923 17.926 14.666 1109 HD1 HIS 129 HD1 HIS 129 -3.540 20.904 16.810 1110 HD2 HIS 129 HD2 HIS 129 -4.827 16.960 16.539 1111 HE1 HIS 129 HE1 HIS 129 -5.575 20.757 18.268 1112 HE2 HIS 129 HE2 HIS 129 -6.404 18.401 18.002 1113 H HIS 130 H HIS 130 -1.217 17.423 18.531 1114 HA HIS 130 HA HIS 130 -1.615 14.555 17.930 1115 HB2 HIS 130 2HB HIS 130 -0.277 14.119 20.009 1116 HB3 HIS 130 3HB HIS 130 0.633 14.880 18.709 1117 HD1 HIS 130 HD1 HIS 130 -0.647 15.480 22.157 1118 HD2 HIS 130 HD2 HIS 130 1.478 17.530 19.238 1119 HE1 HIS 130 HE1 HIS 130 0.286 17.500 23.309 1120 HE2 HIS 130 HE2 HIS 130 1.667 18.658 21.562 1121 H HIS 131 H HIS 131 -3.603 13.937 18.487 1122 HA HIS 131 HA HIS 131 -5.284 15.412 20.217 1123 HB2 HIS 131 2HB HIS 131 -6.173 14.110 18.368 1124 HB3 HIS 131 3HB HIS 131 -5.606 12.617 19.110 1125 HD1 HIS 131 HD1 HIS 131 -7.667 15.482 20.542 1126 HD2 HIS 131 HD2 HIS 131 -7.819 11.360 20.032 1127 HE1 HIS 131 HE1 HIS 131 -9.775 14.742 21.679 1128 HE2 HIS 131 HE2 HIS 131 -9.941 12.282 21.189 1129 H HIS 132 H HIS 132 -2.779 13.481 21.162 1130 HA HIS 132 HA HIS 132 -4.053 12.993 23.777 1131 HB2 HIS 132 2HB HIS 132 -2.614 10.997 24.056 1132 HB3 HIS 132 3HB HIS 132 -3.719 10.839 22.696 1133 HD1 HIS 132 HD1 HIS 132 -0.104 10.972 23.555 1134 HD2 HIS 132 HD2 HIS 132 -2.483 10.874 20.146 1135 HE1 HIS 132 HE1 HIS 132 1.456 10.459 21.656 1136 HE2 HIS 132 HE2 HIS 132 -0.012 10.325 19.619 1137 H HIS 133 H HIS 133 -2.965 13.689 25.554 1138 HA HIS 133 HA HIS 133 -0.191 14.663 25.201 1139 HB2 HIS 133 2HB HIS 133 -0.673 16.482 26.798 1140 HB3 HIS 133 3HB HIS 133 -1.690 16.590 25.366 1141 HD1 HIS 133 HD1 HIS 133 -1.853 15.836 29.051 1142 HD2 HIS 133 HD2 HIS 133 -4.419 16.310 25.815 1143 HE1 HIS 133 HE1 HIS 133 -4.160 15.949 30.029 1144 HE2 HIS 133 HE2 HIS 133 -5.683 16.305 28.066 1145 H HIS 134 H HIS 134 1.245 14.286 26.884 1146 HA HIS 134 HA HIS 134 2.188 13.166 28.622 1147 HB2 HIS 134 2HB HIS 134 0.644 14.554 29.965 1148 HB3 HIS 134 3HB HIS 134 -0.590 13.310 29.831 1149 HD1 HIS 134 HD1 HIS 134 2.688 14.041 31.522 1150 HD2 HIS 134 HD2 HIS 134 -0.333 11.190 31.616 1151 HE1 HIS 134 HE1 HIS 134 3.138 12.652 33.561 1152 HE2 HIS 134 HE2 HIS 134 1.197 11.061 33.694
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