NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
587431 | 2msg | 25123 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1H MET 1 49.221 -4.859 4.772 2 H2 MET 1 2H MET 1 49.185 -3.170 4.952 3 H3 MET 1 3H MET 1 48.404 -4.165 6.086 4 HA MET 1 HA MET 1 50.769 -3.137 6.553 5 HB2 MET 1 1HB MET 1 50.312 -6.025 7.284 6 HB3 MET 1 2HB MET 1 50.958 -4.719 8.280 7 HG2 MET 1 1HG MET 1 48.096 -5.219 7.467 8 HG3 MET 1 2HG MET 1 48.756 -5.014 9.090 9 HE1 MET 1 3HE MET 1 46.711 -3.874 9.260 10 HE2 MET 1 1HE MET 1 46.298 -2.256 8.679 11 HE3 MET 1 2HE MET 1 47.386 -2.453 10.051 12 H GLN 2 H GLN 2 50.262 -5.849 4.414 13 HA GLN 2 HA GLN 2 53.017 -6.644 4.276 14 HB2 GLN 2 1HB GLN 2 50.471 -7.358 2.913 15 HB3 GLN 2 2HB GLN 2 51.960 -7.683 2.024 16 HG2 GLN 2 1HG GLN 2 51.780 -8.501 4.911 17 HG3 GLN 2 2HG GLN 2 50.986 -9.494 3.691 18 HE21 GLN 2 2HE2 GLN 2 53.670 -9.677 5.394 19 HE22 GLN 2 1HE2 GLN 2 54.789 -10.200 4.229 20 H ILE 3 H ILE 3 54.237 -6.600 2.241 21 HA ILE 3 HA ILE 3 53.638 -4.376 0.456 22 HB ILE 3 HB ILE 3 56.085 -4.512 2.200 23 HG12 ILE 3 1HG1 ILE 3 53.802 -2.680 1.645 24 HG13 ILE 3 2HG1 ILE 3 54.701 -2.932 3.131 25 HG21 ILE 3 1HG2 ILE 3 56.855 -4.431 -0.178 26 HG22 ILE 3 2HG2 ILE 3 57.196 -2.930 0.671 27 HG23 ILE 3 3HG2 ILE 3 55.830 -3.020 -0.441 28 HD11 ILE 3 3HD1 ILE 3 55.473 -1.227 0.759 29 HD12 ILE 3 1HD1 ILE 3 56.618 -1.656 2.032 30 HD13 ILE 3 2HD1 ILE 3 55.179 -0.715 2.415 31 H PHE 4 H PHE 4 54.195 -4.728 -1.537 32 HA PHE 4 HA PHE 4 55.383 -7.357 -2.159 33 HB2 PHE 4 1HB PHE 4 53.365 -5.550 -3.448 34 HB3 PHE 4 2HB PHE 4 54.224 -6.733 -4.422 35 HD1 PHE 4 HD2 PHE 4 53.741 -7.839 -1.003 36 HD2 PHE 4 HD1 PHE 4 51.838 -7.528 -4.845 37 HE1 PHE 4 HE2 PHE 4 52.114 -9.573 -0.337 38 HE2 PHE 4 HE1 PHE 4 50.203 -9.263 -4.167 39 HZ PHE 4 HZ PHE 4 50.343 -10.287 -1.916 40 H VAL 5 H VAL 5 57.168 -7.516 -3.388 41 HA VAL 5 HA VAL 5 58.213 -5.088 -4.714 42 HB VAL 5 HB VAL 5 59.981 -7.088 -3.306 43 HG11 VAL 5 1HG1 VAL 5 61.660 -5.399 -3.559 44 HG12 VAL 5 2HG1 VAL 5 60.466 -4.190 -4.031 45 HG13 VAL 5 3HG1 VAL 5 60.853 -5.521 -5.122 46 HG21 VAL 5 3HG2 VAL 5 58.674 -6.193 -1.529 47 HG22 VAL 5 1HG2 VAL 5 58.642 -4.587 -2.258 48 HG23 VAL 5 2HG2 VAL 5 60.136 -5.206 -1.553 49 H LYS 6 H LYS 6 58.897 -5.411 -6.767 50 HA LYS 6 HA LYS 6 58.873 -8.191 -7.772 51 HB2 LYS 6 1HB LYS 6 57.277 -6.501 -8.768 52 HB3 LYS 6 2HB LYS 6 58.688 -5.658 -9.410 53 HG2 LYS 6 1HG LYS 6 59.383 -7.744 -10.568 54 HG3 LYS 6 2HG LYS 6 57.926 -8.539 -9.973 55 HD2 LYS 6 1HD LYS 6 56.573 -6.748 -11.119 56 HD3 LYS 6 2HD LYS 6 58.071 -6.162 -11.845 57 HE2 LYS 6 1HE LYS 6 57.039 -8.998 -12.125 58 HE3 LYS 6 2HE LYS 6 56.809 -7.733 -13.333 59 HZ1 LYS 6 3HZ LYS 6 59.371 -7.500 -13.098 60 HZ2 LYS 6 1HZ LYS 6 58.719 -8.726 -14.072 61 HZ3 LYS 6 2HZ LYS 6 59.280 -9.091 -12.510 62 H THR 7 H THR 7 60.635 -9.083 -8.644 63 HA THR 7 HA THR 7 63.039 -7.382 -8.986 64 HB THR 7 HB THR 7 64.319 -9.502 -8.523 65 HG1 THR 7 HG1 THR 7 63.142 -11.223 -8.508 66 HG21 THR 7 3HG2 THR 7 64.184 -7.934 -6.742 67 HG22 THR 7 1HG2 THR 7 63.724 -9.480 -6.031 68 HG23 THR 7 2HG2 THR 7 62.483 -8.297 -6.450 69 H LEU 8 H LEU 8 64.405 -7.853 -10.758 70 HA LEU 8 HA LEU 8 63.071 -8.586 -13.145 71 HB2 LEU 8 1HB LEU 8 66.055 -8.440 -12.671 72 HB3 LEU 8 2HB LEU 8 65.227 -8.334 -14.224 73 HG LEU 8 HG LEU 8 64.960 -6.375 -11.923 74 HD11 LEU 8 1HD1 LEU 8 65.966 -4.812 -13.649 75 HD12 LEU 8 2HD1 LEU 8 66.312 -6.238 -14.629 76 HD13 LEU 8 3HD1 LEU 8 67.062 -6.054 -13.044 77 HD21 LEU 8 3HD2 LEU 8 63.751 -5.085 -13.881 78 HD22 LEU 8 1HD2 LEU 8 62.858 -6.289 -12.952 79 HD23 LEU 8 2HD2 LEU 8 63.505 -6.702 -14.539 80 H THR 9 H THR 9 64.118 -10.530 -10.680 81 HA THR 9 HA THR 9 64.996 -12.753 -12.368 82 HB THR 9 HB THR 9 64.610 -12.669 -9.368 83 HG1 THR 9 HG1 THR 9 66.144 -11.149 -10.065 84 HG21 THR 9 3HG2 THR 9 65.956 -14.575 -11.287 85 HG22 THR 9 1HG2 THR 9 64.704 -14.931 -10.094 86 HG23 THR 9 2HG2 THR 9 66.342 -14.547 -9.567 87 H GLY 10 H GLY 10 62.103 -11.474 -11.248 88 HA2 GLY 10 1HA GLY 10 59.942 -12.252 -11.576 89 HA3 GLY 10 2HA GLY 10 60.612 -13.774 -12.147 90 H LYS 11 H LYS 11 62.119 -13.188 -9.286 91 HA LYS 11 HA LYS 11 60.556 -15.181 -7.911 92 HB2 LYS 11 1HB LYS 11 63.010 -15.082 -7.682 93 HB3 LYS 11 2HB LYS 11 62.869 -13.496 -6.922 94 HG2 LYS 11 1HG LYS 11 61.694 -14.398 -5.041 95 HG3 LYS 11 2HG LYS 11 61.465 -15.950 -5.846 96 HD2 LYS 11 1HD LYS 11 63.981 -16.204 -5.880 97 HD3 LYS 11 2HD LYS 11 64.074 -14.767 -4.860 98 HE2 LYS 11 1HE LYS 11 62.467 -17.235 -4.148 99 HE3 LYS 11 2HE LYS 11 64.105 -16.930 -3.571 100 HZ1 LYS 11 3HZ LYS 11 63.365 -15.482 -2.078 101 HZ2 LYS 11 1HZ LYS 11 61.804 -16.060 -2.403 102 HZ3 LYS 11 2HZ LYS 11 62.382 -14.680 -3.208 103 H THR 12 H THR 12 58.866 -14.833 -6.635 104 HA THR 12 HA THR 12 58.060 -12.127 -5.968 105 HB THR 12 HB THR 12 56.816 -14.837 -5.450 106 HG1 THR 12 HG1 THR 12 56.069 -14.448 -7.353 107 HG21 THR 12 3HG2 THR 12 56.077 -13.520 -3.624 108 HG22 THR 12 1HG2 THR 12 54.794 -13.369 -4.826 109 HG23 THR 12 2HG2 THR 12 55.963 -12.065 -4.615 110 H ILE 13 H ILE 13 58.677 -11.108 -4.179 111 HA ILE 13 HA ILE 13 59.449 -12.720 -1.814 112 HB ILE 13 HB ILE 13 61.320 -11.509 -3.017 113 HG12 ILE 13 1HG1 ILE 13 60.790 -10.516 -0.202 114 HG13 ILE 13 2HG1 ILE 13 61.323 -12.157 -0.565 115 HG21 ILE 13 1HG2 ILE 13 59.788 -9.492 -3.475 116 HG22 ILE 13 2HG2 ILE 13 61.433 -9.139 -2.947 117 HG23 ILE 13 3HG2 ILE 13 60.097 -9.028 -1.802 118 HD11 ILE 13 3HD1 ILE 13 62.953 -10.131 -1.917 119 HD12 ILE 13 1HD1 ILE 13 63.456 -11.494 -0.916 120 HD13 ILE 13 2HD1 ILE 13 62.986 -9.972 -0.162 121 H THR 14 H THR 14 58.360 -12.337 0.008 122 HA THR 14 HA THR 14 56.673 -9.904 0.163 123 HB THR 14 HB THR 14 54.993 -11.136 1.223 124 HG1 THR 14 HG1 THR 14 55.614 -12.484 2.686 125 HG21 THR 14 3HG2 THR 14 56.264 -13.179 -0.618 126 HG22 THR 14 1HG2 THR 14 55.340 -11.786 -1.181 127 HG23 THR 14 2HG2 THR 14 54.554 -13.033 -0.212 128 H LEU 15 H LEU 15 56.799 -8.657 1.950 129 HA LEU 15 HA LEU 15 58.666 -9.520 4.084 130 HB2 LEU 15 1HB LEU 15 58.145 -6.641 3.964 131 HB3 LEU 15 2HB LEU 15 59.681 -7.499 4.033 132 HG LEU 15 HG LEU 15 58.049 -7.331 1.492 133 HD11 LEU 15 1HD1 LEU 15 58.569 -5.044 2.248 134 HD12 LEU 15 2HD1 LEU 15 59.533 -5.472 0.835 135 HD13 LEU 15 3HD1 LEU 15 60.265 -5.490 2.440 136 HD21 LEU 15 3HD2 LEU 15 60.970 -7.891 2.107 137 HD22 LEU 15 1HD2 LEU 15 60.288 -7.780 0.485 138 HD23 LEU 15 2HD2 LEU 15 59.779 -9.073 1.570 139 H GLU 16 H GLU 16 58.086 -9.114 6.232 140 HA GLU 16 HA GLU 16 55.196 -8.655 6.608 141 HB2 GLU 16 1HB GLU 16 57.281 -9.530 8.636 142 HB3 GLU 16 2HB GLU 16 55.533 -9.534 8.857 143 HG2 GLU 16 1HG GLU 16 56.657 -11.060 6.537 144 HG3 GLU 16 2HG GLU 16 56.842 -11.749 8.147 145 H VAL 17 H VAL 17 54.758 -6.567 6.752 146 HA VAL 17 HA VAL 17 56.278 -4.913 8.629 147 HB VAL 17 HB VAL 17 57.406 -4.652 6.455 148 HG11 VAL 17 1HG1 VAL 17 55.327 -5.211 5.117 149 HG12 VAL 17 2HG1 VAL 17 56.245 -3.829 4.522 150 HG13 VAL 17 3HG1 VAL 17 54.767 -3.573 5.447 151 HG21 VAL 17 3HG2 VAL 17 55.802 -2.143 6.818 152 HG22 VAL 17 1HG2 VAL 17 57.527 -2.334 6.547 153 HG23 VAL 17 2HG2 VAL 17 56.841 -2.692 8.127 154 H GLU 18 H GLU 18 55.328 -2.656 8.627 155 HA GLU 18 HA GLU 18 52.383 -2.818 8.686 156 HB2 GLU 18 1HB GLU 18 52.922 -0.512 9.970 157 HB3 GLU 18 2HB GLU 18 52.954 -2.061 10.807 158 HG2 GLU 18 1HG GLU 18 55.415 -0.954 9.457 159 HG3 GLU 18 2HG GLU 18 54.992 -0.502 11.108 160 HA PRO 19 HA PRO 19 52.417 0.029 5.353 161 HB2 PRO 19 1HB PRO 19 50.617 2.045 6.357 162 HB3 PRO 19 2HB PRO 19 50.276 0.720 5.230 163 HG2 PRO 19 1HG PRO 19 49.295 0.891 7.784 164 HG3 PRO 19 2HG PRO 19 49.455 -0.612 6.858 165 HD2 PRO 19 1HD PRO 19 51.225 0.480 9.005 166 HD3 PRO 19 2HD PRO 19 50.771 -1.205 8.661 167 H SER 20 H SER 20 53.598 1.101 8.369 168 HA SER 20 HA SER 20 54.238 3.762 7.425 169 HB2 SER 20 1HB SER 20 56.034 3.189 9.464 170 HB3 SER 20 2HB SER 20 54.464 3.957 9.683 171 HG SER 20 HG SER 20 53.689 2.151 10.463 172 H ASP 21 H ASP 21 55.489 0.543 7.346 173 HA ASP 21 HA ASP 21 57.542 -0.191 6.451 174 HB2 ASP 21 1HB ASP 21 55.585 0.884 4.583 175 HB3 ASP 21 2HB ASP 21 57.207 0.753 3.906 176 H THR 22 H THR 22 58.904 1.587 7.839 177 HA THR 22 HA THR 22 59.600 3.762 6.029 178 HB THR 22 HB THR 22 60.399 4.793 7.881 179 HG1 THR 22 HG1 THR 22 62.266 3.323 7.602 180 HG21 THR 22 3HG2 THR 22 59.477 2.289 9.319 181 HG22 THR 22 1HG2 THR 22 58.427 3.616 8.823 182 HG23 THR 22 2HG2 THR 22 59.682 3.889 10.031 183 H ILE 23 H ILE 23 61.246 3.871 4.789 184 HA ILE 23 HA ILE 23 62.309 1.629 3.681 185 HB ILE 23 HB ILE 23 64.023 4.015 3.418 186 HG12 ILE 23 1HG1 ILE 23 61.787 5.018 4.030 187 HG13 ILE 23 2HG1 ILE 23 62.262 5.383 2.387 188 HG21 ILE 23 1HG2 ILE 23 62.620 2.028 1.663 189 HG22 ILE 23 2HG2 ILE 23 64.304 2.550 1.655 190 HG23 ILE 23 3HG2 ILE 23 63.057 3.593 0.980 191 HD11 ILE 23 3HD1 ILE 23 60.497 3.041 3.071 192 HD12 ILE 23 1HD1 ILE 23 60.778 3.768 1.491 193 HD13 ILE 23 2HD1 ILE 23 59.881 4.651 2.720 194 H GLU 24 H GLU 24 63.809 3.623 6.227 195 HA GLU 24 HA GLU 24 66.210 2.098 6.238 196 HB2 GLU 24 1HB GLU 24 66.677 3.077 8.362 197 HB3 GLU 24 2HB GLU 24 65.806 4.318 7.469 198 HG2 GLU 24 1HG GLU 24 64.508 4.421 9.342 199 HG3 GLU 24 2HG GLU 24 63.730 3.002 8.657 200 H ASN 25 H ASN 25 62.968 1.733 7.384 201 HA ASN 25 HA ASN 25 63.412 -0.616 9.006 202 HB2 ASN 25 1HB ASN 25 61.502 1.234 9.070 203 HB3 ASN 25 2HB ASN 25 60.699 0.098 7.991 204 HD21 ASN 25 2HD2 ASN 25 59.281 -1.113 9.243 205 HD22 ASN 25 1HD2 ASN 25 59.660 -1.804 10.747 206 H VAL 26 H VAL 26 61.983 0.024 5.790 207 HA VAL 26 HA VAL 26 61.395 -2.729 5.270 208 HB VAL 26 HB VAL 26 61.742 -0.546 3.209 209 HG11 VAL 26 1HG1 VAL 26 61.418 -3.109 2.694 210 HG12 VAL 26 2HG1 VAL 26 60.479 -1.913 1.803 211 HG13 VAL 26 3HG1 VAL 26 59.743 -2.790 3.144 212 HG21 VAL 26 3HG2 VAL 26 60.196 0.438 4.680 213 HG22 VAL 26 1HG2 VAL 26 59.498 -1.114 5.138 214 HG23 VAL 26 2HG2 VAL 26 59.155 -0.425 3.552 215 H LYS 27 H LYS 27 63.955 -0.502 4.263 216 HA LYS 27 HA LYS 27 65.385 -2.151 2.536 217 HB2 LYS 27 1HB LYS 27 66.401 -0.125 4.526 218 HB3 LYS 27 2HB LYS 27 67.339 -0.765 3.180 219 HG2 LYS 27 1HG LYS 27 64.645 0.366 2.554 220 HG3 LYS 27 2HG LYS 27 65.911 1.512 2.983 221 HD2 LYS 27 1HD LYS 27 66.849 1.311 0.942 222 HD3 LYS 27 2HD LYS 27 66.987 -0.435 1.140 223 HE2 LYS 27 1HE LYS 27 64.323 0.758 0.450 224 HE3 LYS 27 2HE LYS 27 65.536 0.533 -0.809 225 HZ1 LYS 27 3HZ LYS 27 64.567 -1.582 1.033 226 HZ2 LYS 27 1HZ LYS 27 65.698 -1.788 -0.213 227 HZ3 LYS 27 2HZ LYS 27 64.088 -1.397 -0.584 228 H ALA 28 H ALA 28 65.835 -1.678 6.029 229 HA ALA 28 HA ALA 28 67.880 -3.549 6.382 230 HB1 ALA 28 3HB ALA 28 67.008 -3.626 8.770 231 HB2 ALA 28 1HB ALA 28 65.734 -2.527 8.242 232 HB3 ALA 28 2HB ALA 28 67.423 -2.027 8.152 233 H LYS 29 H LYS 29 64.375 -3.912 6.240 234 HA LYS 29 HA LYS 29 64.288 -6.635 7.055 235 HB2 LYS 29 1HB LYS 29 62.418 -4.709 5.803 236 HB3 LYS 29 2HB LYS 29 62.135 -6.391 5.358 237 HG2 LYS 29 1HG LYS 29 61.960 -7.041 7.686 238 HG3 LYS 29 2HG LYS 29 62.446 -5.432 8.218 239 HD2 LYS 29 1HD LYS 29 60.394 -4.566 6.939 240 HD3 LYS 29 2HD LYS 29 59.872 -6.249 6.866 241 HE2 LYS 29 1HE LYS 29 60.548 -4.768 9.423 242 HE3 LYS 29 2HE LYS 29 58.912 -5.039 8.822 243 HZ1 LYS 29 3HZ LYS 29 58.996 -6.940 9.937 244 HZ2 LYS 29 1HZ LYS 29 60.670 -6.841 10.179 245 HZ3 LYS 29 2HZ LYS 29 60.060 -7.504 8.738 246 H ILE 30 H ILE 30 64.825 -4.965 4.008 247 HA ILE 30 HA ILE 30 64.854 -7.361 2.413 248 HB ILE 30 HB ILE 30 65.907 -4.598 1.767 249 HG12 ILE 30 1HG1 ILE 30 63.263 -5.909 1.065 250 HG13 ILE 30 2HG1 ILE 30 63.466 -4.707 2.332 251 HG21 ILE 30 1HG2 ILE 30 65.918 -5.307 -0.514 252 HG22 ILE 30 2HG2 ILE 30 65.036 -6.784 -0.134 253 HG23 ILE 30 3HG2 ILE 30 66.712 -6.607 0.373 254 HD11 ILE 30 3HD1 ILE 30 63.190 -4.306 -0.516 255 HD12 ILE 30 1HD1 ILE 30 64.707 -3.609 0.049 256 HD13 ILE 30 2HD1 ILE 30 63.181 -3.106 0.775 257 H GLN 31 H GLN 31 67.218 -5.513 4.239 258 HA GLN 31 HA GLN 31 69.591 -6.410 3.044 259 HB2 GLN 31 1HB GLN 31 69.505 -4.659 4.796 260 HB3 GLN 31 2HB GLN 31 69.096 -5.894 5.986 261 HG2 GLN 31 1HG GLN 31 71.291 -6.358 6.265 262 HG3 GLN 31 2HG GLN 31 71.413 -6.803 4.565 263 HE21 GLN 31 2HE2 GLN 31 71.018 -4.313 3.312 264 HE22 GLN 31 1HE2 GLN 31 72.274 -3.259 3.753 265 H ASP 32 H ASP 32 67.414 -7.946 5.346 266 HA ASP 32 HA ASP 32 69.084 -10.173 5.972 267 HB2 ASP 32 1HB ASP 32 66.172 -9.531 6.295 268 HB3 ASP 32 2HB ASP 32 66.725 -11.183 6.557 269 H LYS 33 H LYS 33 66.449 -9.672 3.630 270 HA LYS 33 HA LYS 33 66.396 -12.296 2.577 271 HB2 LYS 33 1HB LYS 33 65.868 -9.750 1.023 272 HB3 LYS 33 2HB LYS 33 65.197 -11.348 0.715 273 HG2 LYS 33 1HG LYS 33 64.707 -9.993 3.365 274 HG3 LYS 33 2HG LYS 33 63.732 -9.567 1.962 275 HD2 LYS 33 1HD LYS 33 63.343 -12.106 1.685 276 HD3 LYS 33 2HD LYS 33 63.973 -12.252 3.325 277 HE2 LYS 33 1HE LYS 33 61.755 -10.305 2.698 278 HE3 LYS 33 2HE LYS 33 61.404 -12.002 3.016 279 HZ1 LYS 33 3HZ LYS 33 62.102 -11.844 5.171 280 HZ2 LYS 33 1HZ LYS 33 61.481 -10.281 4.951 281 HZ3 LYS 33 2HZ LYS 33 63.157 -10.548 4.866 282 H GLU 34 H GLU 34 68.002 -9.359 1.498 283 HA GLU 34 HA GLU 34 70.295 -10.858 0.489 284 HB2 GLU 34 1HB GLU 34 68.424 -9.227 -1.215 285 HB3 GLU 34 2HB GLU 34 70.146 -9.243 -1.592 286 HG2 GLU 34 1HG GLU 34 70.161 -11.587 -1.959 287 HG3 GLU 34 2HG GLU 34 68.595 -11.800 -1.179 288 H GLY 35 H GLY 35 72.185 -9.401 0.321 289 HA2 GLY 35 1HA GLY 35 72.010 -7.323 2.308 290 HA3 GLY 35 2HA GLY 35 73.446 -7.763 1.391 291 H ILE 36 H ILE 36 71.268 -5.425 1.958 292 HA ILE 36 HA ILE 36 72.168 -3.882 -0.324 293 HB ILE 36 HB ILE 36 69.874 -3.095 -0.847 294 HG12 ILE 36 1HG1 ILE 36 68.123 -4.960 -0.030 295 HG13 ILE 36 2HG1 ILE 36 69.238 -5.060 1.323 296 HG21 ILE 36 1HG2 ILE 36 70.047 -6.101 -1.112 297 HG22 ILE 36 2HG2 ILE 36 71.070 -5.010 -2.046 298 HG23 ILE 36 3HG2 ILE 36 69.318 -4.951 -2.232 299 HD11 ILE 36 3HD1 ILE 36 67.237 -3.048 0.761 300 HD12 ILE 36 1HD1 ILE 36 68.826 -2.292 0.879 301 HD13 ILE 36 2HD1 ILE 36 68.207 -3.264 2.213 302 HA PRO 37 HA PRO 37 72.238 -1.346 3.345 303 HB2 PRO 37 1HB PRO 37 73.620 0.696 1.860 304 HB3 PRO 37 2HB PRO 37 74.272 -0.416 3.070 305 HG2 PRO 37 1HG PRO 37 74.831 -0.447 0.349 306 HG3 PRO 37 2HG PRO 37 75.159 -1.752 1.498 307 HD2 PRO 37 1HD PRO 37 73.000 -1.533 -0.525 308 HD3 PRO 37 2HD PRO 37 73.736 -2.977 0.207 309 HA PRO 38 HA PRO 38 68.626 1.111 2.318 310 HB2 PRO 38 1HB PRO 38 68.919 2.680 4.713 311 HB3 PRO 38 2HB PRO 38 67.752 1.404 4.381 312 HG2 PRO 38 1HG PRO 38 70.003 1.312 6.094 313 HG3 PRO 38 2HG PRO 38 68.854 0.020 5.733 314 HD2 PRO 38 1HD PRO 38 71.597 0.234 4.887 315 HD3 PRO 38 2HD PRO 38 70.442 -1.070 4.546 316 H ASP 39 H ASP 39 71.428 2.721 3.774 317 HA ASP 39 HA ASP 39 70.909 5.320 2.856 318 HB2 ASP 39 1HB ASP 39 73.537 5.437 3.046 319 HB3 ASP 39 2HB ASP 39 72.549 5.240 4.493 320 H GLN 40 H GLN 40 71.890 2.517 1.166 321 HA GLN 40 HA GLN 40 72.842 4.135 -1.116 322 HB2 GLN 40 1HB GLN 40 73.314 1.221 -0.471 323 HB3 GLN 40 2HB GLN 40 73.906 2.055 -1.907 324 HG2 GLN 40 1HG GLN 40 74.511 3.070 0.871 325 HG3 GLN 40 2HG GLN 40 75.527 1.861 0.088 326 HE21 GLN 40 2HE2 GLN 40 77.142 2.662 -1.272 327 HE22 GLN 40 1HE2 GLN 40 77.188 4.244 -1.886 328 H GLN 41 H GLN 41 70.224 2.138 -0.065 329 HA GLN 41 HA GLN 41 69.415 1.765 -2.886 330 HB2 GLN 41 1HB GLN 41 69.684 -0.295 -1.444 331 HB3 GLN 41 2HB GLN 41 68.265 0.259 -0.554 332 HG2 GLN 41 1HG GLN 41 66.983 0.353 -2.677 333 HG3 GLN 41 2HG GLN 41 68.393 -0.261 -3.539 334 HE21 GLN 41 2HE2 GLN 41 66.441 -1.949 -3.961 335 HE22 GLN 41 1HE2 GLN 41 66.441 -3.282 -2.911 336 H ARG 42 H ARG 42 67.565 2.462 -3.662 337 HA ARG 42 HA ARG 42 65.650 3.841 -1.879 338 HB2 ARG 42 1HB ARG 42 66.300 4.805 -4.663 339 HB3 ARG 42 2HB ARG 42 65.456 5.661 -3.374 340 HG2 ARG 42 1HG ARG 42 67.509 5.809 -2.067 341 HG3 ARG 42 2HG ARG 42 68.373 4.838 -3.260 342 HD2 ARG 42 1HD ARG 42 68.887 7.177 -3.653 343 HD3 ARG 42 2HD ARG 42 67.884 6.586 -4.975 344 HE ARG 42 HE ARG 42 66.834 8.206 -2.719 345 HH11 ARG 42 1HH1 ARG 42 64.811 6.892 -4.515 346 HH12 ARG 42 2HH1 ARG 42 64.485 8.134 -5.677 347 HH21 ARG 42 1HH2 ARG 42 67.317 9.976 -4.899 348 HH22 ARG 42 2HH2 ARG 42 65.903 9.878 -5.896 349 H LEU 43 H LEU 43 63.457 3.603 -2.454 350 HA LEU 43 HA LEU 43 62.934 1.650 -4.630 351 HB2 LEU 43 1HB LEU 43 61.188 2.107 -2.208 352 HB3 LEU 43 2HB LEU 43 61.100 0.787 -3.369 353 HG LEU 43 HG LEU 43 63.514 1.289 -1.616 354 HD11 LEU 43 1HD1 LEU 43 62.594 -0.656 -0.283 355 HD12 LEU 43 2HD1 LEU 43 61.087 -0.472 -1.176 356 HD13 LEU 43 3HD1 LEU 43 61.661 0.832 -0.138 357 HD21 LEU 43 3HD2 LEU 43 62.573 -0.977 -3.394 358 HD22 LEU 43 1HD2 LEU 43 63.834 -1.192 -2.182 359 HD23 LEU 43 2HD2 LEU 43 64.075 -0.060 -3.510 360 H ILE 44 H ILE 44 60.532 1.768 -5.314 361 HA ILE 44 HA ILE 44 59.633 4.574 -5.527 362 HB ILE 44 HB ILE 44 60.945 3.798 -7.566 363 HG12 ILE 44 1HG1 ILE 44 58.024 4.454 -8.060 364 HG13 ILE 44 2HG1 ILE 44 59.224 5.643 -7.557 365 HG21 ILE 44 1HG2 ILE 44 58.457 2.180 -8.142 366 HG22 ILE 44 2HG2 ILE 44 59.897 1.458 -7.424 367 HG23 ILE 44 3HG2 ILE 44 59.981 2.188 -9.028 368 HD11 ILE 44 3HD1 ILE 44 60.090 5.802 -9.637 369 HD12 ILE 44 1HD1 ILE 44 58.648 4.949 -10.181 370 HD13 ILE 44 2HD1 ILE 44 60.126 4.051 -9.844 371 H PHE 45 H PHE 45 57.452 4.854 -5.419 372 HA PHE 45 HA PHE 45 55.741 2.437 -5.407 373 HB2 PHE 45 1HB PHE 45 55.763 2.922 -3.137 374 HB3 PHE 45 2HB PHE 45 55.959 4.655 -3.404 375 HD1 PHE 45 HD2 PHE 45 53.498 1.944 -4.274 376 HD2 PHE 45 HD1 PHE 45 54.102 5.991 -2.962 377 HE1 PHE 45 HE2 PHE 45 51.045 2.252 -4.091 378 HE2 PHE 45 HE1 PHE 45 51.648 6.297 -2.781 379 HZ PHE 45 HZ PHE 45 50.120 4.430 -3.345 380 H ALA 46 H ALA 46 54.323 2.542 -7.006 381 HA ALA 46 HA ALA 46 52.975 3.390 -8.673 382 HB1 ALA 46 3HB ALA 46 51.354 5.124 -7.838 383 HB2 ALA 46 1HB ALA 46 52.262 5.159 -6.326 384 HB3 ALA 46 2HB ALA 46 51.453 3.677 -6.835 385 H GLY 47 H GLY 47 55.564 4.320 -8.943 386 HA2 GLY 47 1HA GLY 47 56.548 5.852 -10.409 387 HA3 GLY 47 2HA GLY 47 55.090 6.833 -10.330 388 H LYS 48 H LYS 48 55.266 6.533 -7.284 389 HA LYS 48 HA LYS 48 56.762 8.964 -6.850 390 HB2 LYS 48 1HB LYS 48 54.581 8.230 -5.672 391 HB3 LYS 48 2HB LYS 48 55.625 7.221 -4.670 392 HG2 LYS 48 1HG LYS 48 56.941 9.186 -4.019 393 HG3 LYS 48 2HG LYS 48 55.956 10.211 -5.059 394 HD2 LYS 48 1HD LYS 48 54.696 8.540 -2.884 395 HD3 LYS 48 2HD LYS 48 55.375 10.129 -2.530 396 HE2 LYS 48 1HE LYS 48 53.130 9.475 -4.455 397 HE3 LYS 48 2HE LYS 48 53.042 10.464 -3.000 398 HZ1 LYS 48 3HZ LYS 48 54.355 11.089 -5.570 399 HZ2 LYS 48 1HZ LYS 48 54.780 11.905 -4.145 400 HZ3 LYS 48 2HZ LYS 48 53.186 11.991 -4.727 401 H GLN 49 H GLN 49 58.755 9.185 -5.971 402 HA GLN 49 HA GLN 49 60.389 6.797 -5.720 403 HB2 GLN 49 1HB GLN 49 61.288 9.618 -5.163 404 HB3 GLN 49 2HB GLN 49 62.247 8.248 -5.722 405 HG2 GLN 49 1HG GLN 49 61.196 8.292 -7.886 406 HG3 GLN 49 2HG GLN 49 59.998 9.466 -7.344 407 HE21 GLN 49 2HE2 GLN 49 60.981 10.676 -9.322 408 HE22 GLN 49 1HE2 GLN 49 62.326 11.664 -9.009 409 H LEU 50 H LEU 50 60.601 5.714 -3.867 410 HA LEU 50 HA LEU 50 59.863 6.954 -1.353 411 HB2 LEU 50 1HB LEU 50 60.513 4.193 -2.279 412 HB3 LEU 50 2HB LEU 50 60.744 4.554 -0.569 413 HG LEU 50 HG LEU 50 58.193 5.160 -2.091 414 HD11 LEU 50 1HD1 LEU 50 58.222 2.825 -2.083 415 HD12 LEU 50 2HD1 LEU 50 57.338 3.200 -0.606 416 HD13 LEU 50 3HD1 LEU 50 59.039 2.735 -0.524 417 HD21 LEU 50 3HD2 LEU 50 59.072 5.397 0.773 418 HD22 LEU 50 1HD2 LEU 50 57.373 5.115 0.400 419 HD23 LEU 50 2HD2 LEU 50 58.180 6.545 -0.211 420 H GLU 51 H GLU 51 61.257 7.368 0.373 421 HA GLU 51 HA GLU 51 63.954 8.042 -0.501 422 HB2 GLU 51 1HB GLU 51 62.507 8.840 2.016 423 HB3 GLU 51 2HB GLU 51 63.988 9.551 1.376 424 HG2 GLU 51 1HG GLU 51 62.247 9.688 -0.788 425 HG3 GLU 51 2HG GLU 51 61.198 10.030 0.586 426 H ASP 52 H ASP 52 65.335 8.434 1.508 427 HA ASP 52 HA ASP 52 66.786 6.183 2.163 428 HB2 ASP 52 1HB ASP 52 67.852 7.694 3.879 429 HB3 ASP 52 2HB ASP 52 67.836 8.298 2.223 430 H GLY 53 H GLY 53 63.784 6.496 3.304 431 HA2 GLY 53 1HA GLY 53 63.241 4.810 5.136 432 HA3 GLY 53 2HA GLY 53 64.509 5.600 6.031 433 H ARG 54 H ARG 54 62.074 6.999 3.963 434 HA ARG 54 HA ARG 54 61.064 8.740 6.100 435 HB2 ARG 54 1HB ARG 54 60.481 8.426 3.133 436 HB3 ARG 54 2HB ARG 54 59.383 9.322 4.181 437 HG2 ARG 54 1HG ARG 54 62.329 9.963 4.193 438 HG3 ARG 54 2HG ARG 54 61.294 10.612 2.922 439 HD2 ARG 54 1HD ARG 54 59.760 11.443 4.803 440 HD3 ARG 54 2HD ARG 54 61.084 11.070 5.903 441 HE ARG 54 HE ARG 54 60.964 13.269 4.017 442 HH11 ARG 54 1HH1 ARG 54 63.545 11.378 4.001 443 HH12 ARG 54 2HH1 ARG 54 64.622 12.389 4.905 444 HH21 ARG 54 1HH2 ARG 54 62.119 14.520 6.009 445 HH22 ARG 54 2HH2 ARG 54 63.815 14.169 6.041 446 H THR 55 H THR 55 58.511 8.447 6.444 447 HA THR 55 HA THR 55 58.160 5.551 6.644 448 HB THR 55 HB THR 55 56.436 7.857 7.540 449 HG1 THR 55 HG1 THR 55 57.452 7.624 9.393 450 HG21 THR 55 3HG2 THR 55 56.192 4.884 7.963 451 HG22 THR 55 1HG2 THR 55 55.023 5.941 7.180 452 HG23 THR 55 2HG2 THR 55 55.315 6.076 8.913 453 H LEU 56 H LEU 56 56.689 4.348 5.611 454 HA LEU 56 HA LEU 56 55.665 5.317 3.125 455 HB2 LEU 56 1HB LEU 56 56.198 2.767 4.333 456 HB3 LEU 56 2HB LEU 56 54.642 2.757 3.512 457 HG LEU 56 HG LEU 56 55.812 3.802 1.510 458 HD11 LEU 56 1HD1 LEU 56 58.189 3.242 3.269 459 HD12 LEU 56 2HD1 LEU 56 57.733 4.764 2.522 460 HD13 LEU 56 3HD1 LEU 56 58.330 3.431 1.530 461 HD21 LEU 56 3HD2 LEU 56 56.097 1.718 0.665 462 HD22 LEU 56 1HD2 LEU 56 55.693 1.127 2.271 463 HD23 LEU 56 2HD2 LEU 56 57.378 1.341 1.813 464 H SER 57 H SER 57 54.282 4.597 6.270 465 HA SER 57 HA SER 57 51.578 4.483 5.527 466 HB2 SER 57 1HB SER 57 52.920 5.445 8.057 467 HB3 SER 57 2HB SER 57 51.171 5.486 7.863 468 HG SER 57 HG SER 57 51.505 3.516 8.672 469 H ASP 58 H ASP 58 53.791 7.128 6.068 470 HA ASP 58 HA ASP 58 51.872 9.236 5.845 471 HB2 ASP 58 1HB ASP 58 53.791 10.102 6.768 472 HB3 ASP 58 2HB ASP 58 54.834 8.976 5.904 473 H TYR 59 H TYR 59 53.553 7.144 3.683 474 HA TYR 59 HA TYR 59 53.090 8.760 1.314 475 HB2 TYR 59 1HB TYR 59 54.470 6.211 1.947 476 HB3 TYR 59 2HB TYR 59 53.783 6.332 0.332 477 HD1 TYR 59 HD2 TYR 59 55.314 8.825 2.641 478 HD2 TYR 59 HD1 TYR 59 55.455 6.890 -1.183 479 HE1 TYR 59 HE2 TYR 59 57.175 10.321 1.960 480 HE2 TYR 59 HE1 TYR 59 57.312 8.386 -1.874 481 HH TYR 59 HH TYR 59 59.006 9.774 -0.923 482 H ASN 60 H ASN 60 51.076 7.240 3.268 483 HA ASN 60 HA ASN 60 48.996 6.298 3.076 484 HB2 ASN 60 1HB ASN 60 48.992 8.418 1.467 485 HB3 ASN 60 2HB ASN 60 48.807 7.181 0.226 486 HD21 ASN 60 2HD2 ASN 60 47.305 8.475 3.202 487 HD22 ASN 60 1HD2 ASN 60 45.761 7.848 2.881 488 H ILE 61 H ILE 61 51.118 4.543 2.617 489 HA ILE 61 HA ILE 61 50.828 3.100 0.198 490 HB ILE 61 HB ILE 61 52.038 2.304 2.838 491 HG12 ILE 61 1HG1 ILE 61 53.277 4.011 1.626 492 HG13 ILE 61 2HG1 ILE 61 54.111 2.477 1.486 493 HG21 ILE 61 1HG2 ILE 61 53.058 0.433 1.403 494 HG22 ILE 61 2HG2 ILE 61 51.777 0.778 0.240 495 HG23 ILE 61 3HG2 ILE 61 51.368 0.234 1.867 496 HD11 ILE 61 3HD1 ILE 61 54.188 3.144 -0.717 497 HD12 ILE 61 1HD1 ILE 61 52.661 4.015 -0.612 498 HD13 ILE 61 2HD1 ILE 61 52.668 2.254 -0.730 499 H GLN 62 H GLN 62 49.777 1.395 -0.359 500 HA GLN 62 HA GLN 62 47.301 0.834 1.051 501 HB2 GLN 62 1HB GLN 62 47.311 1.498 -1.323 502 HB3 GLN 62 2HB GLN 62 48.260 0.067 -1.714 503 HG2 GLN 62 1HG GLN 62 46.477 -1.379 -1.366 504 HG3 GLN 62 2HG GLN 62 45.677 -0.287 -0.232 505 HE21 GLN 62 2HE2 GLN 62 43.685 0.156 -1.232 506 HE22 GLN 62 1HE2 GLN 62 43.525 0.720 -2.825 507 H LYS 63 H LYS 63 46.490 -1.407 0.356 508 HA LYS 63 HA LYS 63 47.197 -3.345 2.047 509 HB2 LYS 63 1HB LYS 63 45.410 -3.077 -0.053 510 HB3 LYS 63 2HB LYS 63 46.345 -4.502 -0.491 511 HG2 LYS 63 1HG LYS 63 45.123 -4.116 2.256 512 HG3 LYS 63 2HG LYS 63 44.296 -4.949 0.940 513 HD2 LYS 63 1HD LYS 63 46.230 -6.512 0.755 514 HD3 LYS 63 2HD LYS 63 46.966 -5.724 2.151 515 HE2 LYS 63 1HE LYS 63 44.205 -6.969 2.202 516 HE3 LYS 63 2HE LYS 63 45.666 -7.821 2.704 517 HZ1 LYS 63 3HZ LYS 63 46.059 -5.886 4.240 518 HZ2 LYS 63 1HZ LYS 63 44.752 -6.890 4.641 519 HZ3 LYS 63 2HZ LYS 63 44.472 -5.388 3.898 520 H GLU 64 H GLU 64 49.708 -2.397 0.598 521 HA GLU 64 HA GLU 64 51.748 -3.521 0.402 522 HB2 GLU 64 1HB GLU 64 51.944 -5.829 0.466 523 HB3 GLU 64 2HB GLU 64 50.440 -5.580 1.345 524 HG2 GLU 64 1HG GLU 64 49.485 -5.817 -1.206 525 HG3 GLU 64 2HG GLU 64 50.918 -6.825 -1.312 526 H SER 65 H SER 65 50.898 -1.975 -1.478 527 HA SER 65 HA SER 65 50.502 -2.997 -4.060 528 HB2 SER 65 1HB SER 65 52.153 -0.553 -3.575 529 HB3 SER 65 2HB SER 65 50.890 -0.830 -4.769 530 HG SER 65 HG SER 65 50.563 0.446 -2.608 531 H THR 66 H THR 66 51.994 -3.297 -5.781 532 HA THR 66 HA THR 66 54.530 -4.442 -4.942 533 HB THR 66 HB THR 66 53.338 -4.258 -7.709 534 HG1 THR 66 HG1 THR 66 53.139 -6.224 -5.678 535 HG21 THR 66 3HG2 THR 66 55.719 -4.756 -7.720 536 HG22 THR 66 1HG2 THR 66 54.822 -6.227 -8.096 537 HG23 THR 66 2HG2 THR 66 55.497 -5.994 -6.483 538 H LEU 67 H LEU 67 56.359 -3.319 -4.856 539 HA LEU 67 HA LEU 67 56.648 -0.870 -6.478 540 HB2 LEU 67 1HB LEU 67 58.258 -1.924 -4.128 541 HB3 LEU 67 2HB LEU 67 58.648 -0.455 -5.019 542 HG LEU 67 HG LEU 67 56.451 0.496 -4.419 543 HD11 LEU 67 1HD1 LEU 67 54.936 -1.242 -4.124 544 HD12 LEU 67 2HD1 LEU 67 55.316 -0.865 -2.446 545 HD13 LEU 67 3HD1 LEU 67 56.090 -2.237 -3.237 546 HD21 LEU 67 3HD2 LEU 67 58.499 0.721 -2.937 547 HD22 LEU 67 1HD2 LEU 67 57.836 -0.582 -1.953 548 HD23 LEU 67 2HD2 LEU 67 56.956 0.938 -2.108 549 H HIS 68 H HIS 68 58.018 -0.839 -8.200 550 HA HIS 68 HA HIS 68 59.813 -3.172 -8.550 551 HB2 HIS 68 1HB HIS 68 59.261 -3.341 -10.788 552 HB3 HIS 68 2HB HIS 68 57.716 -2.833 -10.108 553 HD1 HIS 68 HD1 HIS 68 60.249 -1.876 -12.559 554 HD2 HIS 68 HD2 HIS 68 57.301 0.106 -10.378 555 HE1 HIS 68 HE1 HIS 68 59.902 0.361 -13.696 556 H LEU 69 H LEU 69 61.876 -2.829 -9.125 557 HA LEU 69 HA LEU 69 62.725 -0.029 -9.575 558 HB2 LEU 69 1HB LEU 69 64.950 -1.358 -8.542 559 HB3 LEU 69 2HB LEU 69 63.926 -0.219 -7.676 560 HG LEU 69 HG LEU 69 62.425 -2.197 -7.092 561 HD11 LEU 69 1HD1 LEU 69 63.309 -3.711 -8.859 562 HD12 LEU 69 2HD1 LEU 69 63.435 -4.424 -7.252 563 HD13 LEU 69 3HD1 LEU 69 64.864 -3.741 -8.028 564 HD21 LEU 69 3HD2 LEU 69 64.071 -1.171 -5.530 565 HD22 LEU 69 1HD2 LEU 69 65.293 -2.302 -6.111 566 HD23 LEU 69 2HD2 LEU 69 63.873 -2.901 -5.253 567 H VAL 70 H VAL 70 63.901 0.345 -11.345 568 HA VAL 70 HA VAL 70 65.225 -1.915 -12.704 569 HB VAL 70 HB VAL 70 63.111 -1.668 -13.856 570 HG11 VAL 70 1HG1 VAL 70 62.508 0.572 -13.108 571 HG12 VAL 70 2HG1 VAL 70 62.501 0.534 -14.871 572 HG13 VAL 70 3HG1 VAL 70 63.854 1.268 -14.011 573 HG21 VAL 70 3HG2 VAL 70 65.152 -0.165 -15.507 574 HG22 VAL 70 1HG2 VAL 70 63.919 -1.293 -16.069 575 HG23 VAL 70 2HG2 VAL 70 65.309 -1.888 -15.162 576 H LEU 71 H LEU 71 67.004 -1.299 -14.034 577 HA LEU 71 HA LEU 71 67.846 1.521 -13.854 578 HB2 LEU 71 1HB LEU 71 69.544 -0.862 -13.082 579 HB3 LEU 71 2HB LEU 71 70.145 0.783 -13.269 580 HG LEU 71 HG LEU 71 68.056 1.239 -11.584 581 HD11 LEU 71 1HD1 LEU 71 69.199 -1.414 -10.679 582 HD12 LEU 71 2HD1 LEU 71 67.652 -1.272 -11.514 583 HD13 LEU 71 3HD1 LEU 71 67.880 -0.503 -9.943 584 HD21 LEU 71 3HD2 LEU 71 70.862 0.367 -10.818 585 HD22 LEU 71 1HD2 LEU 71 69.757 1.249 -9.764 586 HD23 LEU 71 2HD2 LEU 71 70.360 2.005 -11.238 587 H ARG 72 H ARG 72 66.907 -0.519 -15.972 588 HA ARG 72 HA ARG 72 68.989 0.199 -17.917 589 HB2 ARG 72 1HB ARG 72 68.751 -2.403 -16.884 590 HB3 ARG 72 2HB ARG 72 67.957 -2.475 -18.454 591 HG2 ARG 72 1HG ARG 72 70.154 -2.885 -19.084 592 HG3 ARG 72 2HG ARG 72 70.117 -1.130 -19.241 593 HD2 ARG 72 1HD ARG 72 70.879 -1.095 -16.765 594 HD3 ARG 72 2HD ARG 72 71.281 -2.792 -17.008 595 HE ARG 72 HE ARG 72 72.399 -1.111 -19.052 596 HH11 ARG 72 1HH1 ARG 72 72.734 -1.297 -15.671 597 HH12 ARG 72 2HH1 ARG 72 74.454 -1.502 -15.686 598 HH21 ARG 72 1HH2 ARG 72 74.654 -1.805 -19.134 599 HH22 ARG 72 2HH2 ARG 72 75.540 -1.788 -17.646 Start of MODEL 2 1 H1 MET 1 1H MET 1 47.311 -4.836 7.171 2 H2 MET 1 2H MET 1 48.756 -4.439 7.971 3 H3 MET 1 3H MET 1 48.588 -5.951 7.215 4 HA MET 1 HA MET 1 48.328 -4.762 5.059 5 HB2 MET 1 1HB MET 1 48.907 -2.504 6.947 6 HB3 MET 1 2HB MET 1 49.511 -2.404 5.292 7 HG2 MET 1 1HG MET 1 47.301 -1.359 5.413 8 HG3 MET 1 2HG MET 1 47.201 -2.839 4.460 9 HE1 MET 1 3HE MET 1 46.635 -0.986 7.614 10 HE2 MET 1 1HE MET 1 45.222 -1.748 8.358 11 HE3 MET 1 2HE MET 1 45.074 -0.942 6.799 12 H GLN 2 H GLN 2 49.999 -5.405 3.889 13 HA GLN 2 HA GLN 2 52.691 -5.491 5.113 14 HB2 GLN 2 1HB GLN 2 51.146 -7.630 3.673 15 HB3 GLN 2 2HB GLN 2 52.909 -7.617 3.600 16 HG2 GLN 2 1HG GLN 2 52.345 -9.000 5.460 17 HG3 GLN 2 2HG GLN 2 52.885 -7.470 6.145 18 HE21 GLN 2 2HE2 GLN 2 51.585 -7.709 8.088 19 HE22 GLN 2 1HE2 GLN 2 49.893 -7.584 8.045 20 H ILE 3 H ILE 3 54.425 -5.775 3.382 21 HA ILE 3 HA ILE 3 53.690 -4.168 1.003 22 HB ILE 3 HB ILE 3 56.137 -4.107 2.746 23 HG12 ILE 3 1HG1 ILE 3 53.952 -2.283 1.913 24 HG13 ILE 3 2HG1 ILE 3 54.915 -2.272 3.382 25 HG21 ILE 3 1HG2 ILE 3 55.957 -3.176 -0.142 26 HG22 ILE 3 2HG2 ILE 3 56.970 -4.488 0.458 27 HG23 ILE 3 3HG2 ILE 3 57.297 -2.834 0.950 28 HD11 ILE 3 3HD1 ILE 3 56.831 -1.347 1.996 29 HD12 ILE 3 1HD1 ILE 3 55.458 -0.263 2.182 30 HD13 ILE 3 2HD1 ILE 3 55.678 -1.145 0.676 31 H PHE 4 H PHE 4 54.679 -4.645 -0.944 32 HA PHE 4 HA PHE 4 56.118 -7.206 -1.144 33 HB2 PHE 4 1HB PHE 4 54.011 -8.023 -1.632 34 HB3 PHE 4 2HB PHE 4 53.456 -6.482 -2.272 35 HD1 PHE 4 HD1 PHE 4 56.507 -8.449 -3.136 36 HD2 PHE 4 HD2 PHE 4 52.706 -6.943 -4.448 37 HE1 PHE 4 HE1 PHE 4 56.991 -9.237 -5.439 38 HE2 PHE 4 HE2 PHE 4 53.185 -7.739 -6.749 39 HZ PHE 4 HZ PHE 4 55.328 -8.880 -7.243 40 H VAL 5 H VAL 5 57.761 -7.133 -2.563 41 HA VAL 5 HA VAL 5 57.882 -4.859 -4.461 42 HB VAL 5 HB VAL 5 60.161 -6.232 -3.013 43 HG11 VAL 5 1HG1 VAL 5 60.930 -5.585 -5.182 44 HG12 VAL 5 2HG1 VAL 5 61.455 -4.309 -4.083 45 HG13 VAL 5 3HG1 VAL 5 60.047 -4.060 -5.115 46 HG21 VAL 5 3HG2 VAL 5 59.232 -3.356 -2.814 47 HG22 VAL 5 1HG2 VAL 5 60.394 -4.187 -1.780 48 HG23 VAL 5 2HG2 VAL 5 58.683 -4.609 -1.702 49 H LYS 6 H LYS 6 58.171 -5.364 -6.563 50 HA LYS 6 HA LYS 6 58.546 -8.210 -7.243 51 HB2 LYS 6 1HB LYS 6 56.549 -6.834 -8.082 52 HB3 LYS 6 2HB LYS 6 57.704 -6.020 -9.134 53 HG2 LYS 6 1HG LYS 6 58.338 -8.138 -10.156 54 HG3 LYS 6 2HG LYS 6 57.306 -9.024 -9.031 55 HD2 LYS 6 1HD LYS 6 55.319 -7.937 -9.941 56 HD3 LYS 6 2HD LYS 6 56.317 -6.951 -11.009 57 HE2 LYS 6 1HE LYS 6 56.330 -9.977 -11.071 58 HE3 LYS 6 2HE LYS 6 55.282 -8.998 -12.097 59 HZ1 LYS 6 3HZ LYS 6 58.096 -8.269 -12.053 60 HZ2 LYS 6 1HZ LYS 6 57.001 -8.300 -13.349 61 HZ3 LYS 6 2HZ LYS 6 57.718 -9.742 -12.811 62 H THR 7 H THR 7 60.462 -8.864 -7.946 63 HA THR 7 HA THR 7 62.474 -6.906 -8.767 64 HB THR 7 HB THR 7 63.872 -9.109 -8.911 65 HG1 THR 7 HG1 THR 7 62.918 -10.680 -7.461 66 HG21 THR 7 3HG2 THR 7 64.358 -7.615 -7.150 67 HG22 THR 7 1HG2 THR 7 63.972 -9.125 -6.326 68 HG23 THR 7 2HG2 THR 7 62.773 -7.834 -6.409 69 H LEU 8 H LEU 8 63.778 -7.312 -10.710 70 HA LEU 8 HA LEU 8 62.115 -7.688 -13.006 71 HB2 LEU 8 1HB LEU 8 64.503 -6.392 -12.499 72 HB3 LEU 8 2HB LEU 8 65.019 -7.769 -13.470 73 HG LEU 8 HG LEU 8 63.044 -7.118 -15.040 74 HD11 LEU 8 1HD1 LEU 8 62.204 -5.442 -13.258 75 HD12 LEU 8 2HD1 LEU 8 62.247 -4.890 -14.932 76 HD13 LEU 8 3HD1 LEU 8 63.515 -4.400 -13.808 77 HD21 LEU 8 3HD2 LEU 8 64.505 -5.430 -16.182 78 HD22 LEU 8 1HD2 LEU 8 65.378 -6.884 -15.698 79 HD23 LEU 8 2HD2 LEU 8 65.534 -5.406 -14.748 80 H THR 9 H THR 9 63.525 -9.885 -10.964 81 HA THR 9 HA THR 9 64.117 -11.875 -13.044 82 HB THR 9 HB THR 9 64.318 -12.373 -10.083 83 HG1 THR 9 HG1 THR 9 66.650 -11.604 -10.959 84 HG21 THR 9 3HG2 THR 9 65.948 -13.279 -12.475 85 HG22 THR 9 1HG2 THR 9 64.685 -14.225 -11.691 86 HG23 THR 9 2HG2 THR 9 66.160 -13.825 -10.812 87 H GLY 10 H GLY 10 61.443 -10.763 -11.556 88 HA2 GLY 10 1HA GLY 10 59.288 -11.626 -11.548 89 HA3 GLY 10 2HA GLY 10 59.935 -13.165 -12.106 90 H LYS 11 H LYS 11 61.847 -12.424 -9.598 91 HA LYS 11 HA LYS 11 60.614 -14.322 -7.842 92 HB2 LYS 11 1HB LYS 11 63.170 -13.479 -8.198 93 HB3 LYS 11 2HB LYS 11 62.735 -12.539 -6.773 94 HG2 LYS 11 1HG LYS 11 62.350 -15.540 -7.010 95 HG3 LYS 11 2HG LYS 11 63.732 -14.775 -6.227 96 HD2 LYS 11 1HD LYS 11 62.122 -13.572 -4.714 97 HD3 LYS 11 2HD LYS 11 60.824 -14.536 -5.418 98 HE2 LYS 11 1HE LYS 11 61.696 -16.559 -4.554 99 HE3 LYS 11 2HE LYS 11 63.274 -15.841 -4.232 100 HZ1 LYS 11 3HZ LYS 11 62.296 -14.483 -2.518 101 HZ2 LYS 11 1HZ LYS 11 61.947 -16.114 -2.214 102 HZ3 LYS 11 2HZ LYS 11 60.749 -15.096 -2.857 103 H THR 12 H THR 12 59.073 -13.948 -6.396 104 HA THR 12 HA THR 12 58.352 -11.192 -5.732 105 HB THR 12 HB THR 12 56.262 -12.008 -5.149 106 HG1 THR 12 HG1 THR 12 57.254 -13.532 -3.631 107 HG21 THR 12 3HG2 THR 12 57.175 -14.245 -6.961 108 HG22 THR 12 1HG2 THR 12 56.946 -12.595 -7.542 109 HG23 THR 12 2HG2 THR 12 55.582 -13.496 -6.880 110 H ILE 13 H ILE 13 58.949 -10.239 -3.914 111 HA ILE 13 HA ILE 13 59.796 -11.915 -1.620 112 HB ILE 13 HB ILE 13 61.598 -10.559 -2.839 113 HG12 ILE 13 1HG1 ILE 13 62.210 -9.475 -0.408 114 HG13 ILE 13 2HG1 ILE 13 60.983 -10.648 0.069 115 HG21 ILE 13 1HG2 ILE 13 60.440 -8.218 -1.337 116 HG22 ILE 13 2HG2 ILE 13 59.959 -8.553 -3.000 117 HG23 ILE 13 3HG2 ILE 13 61.648 -8.221 -2.621 118 HD11 ILE 13 3HD1 ILE 13 63.545 -11.181 -1.451 119 HD12 ILE 13 1HD1 ILE 13 62.254 -12.373 -1.286 120 HD13 ILE 13 2HD1 ILE 13 63.097 -11.782 0.144 121 H THR 14 H THR 14 58.492 -11.734 0.087 122 HA THR 14 HA THR 14 56.817 -9.306 0.342 123 HB THR 14 HB THR 14 55.156 -10.619 1.378 124 HG1 THR 14 HG1 THR 14 56.699 -12.934 1.425 125 HG21 THR 14 3HG2 THR 14 54.722 -12.402 -0.214 126 HG22 THR 14 1HG2 THR 14 56.423 -12.449 -0.679 127 HG23 THR 14 2HG2 THR 14 55.438 -11.039 -1.073 128 H LEU 15 H LEU 15 56.987 -8.060 2.102 129 HA LEU 15 HA LEU 15 58.696 -9.010 4.327 130 HB2 LEU 15 1HB LEU 15 58.584 -6.203 4.460 131 HB3 LEU 15 2HB LEU 15 59.955 -7.179 3.945 132 HG LEU 15 HG LEU 15 57.758 -6.484 1.997 133 HD11 LEU 15 1HD1 LEU 15 58.508 -4.354 2.957 134 HD12 LEU 15 2HD1 LEU 15 59.119 -4.525 1.313 135 HD13 LEU 15 3HD1 LEU 15 60.190 -4.809 2.684 136 HD21 LEU 15 3HD2 LEU 15 59.677 -8.216 1.624 137 HD22 LEU 15 1HD2 LEU 15 60.715 -6.801 1.478 138 HD23 LEU 15 2HD2 LEU 15 59.371 -7.027 0.359 139 H GLU 16 H GLU 16 58.005 -8.603 6.446 140 HA GLU 16 HA GLU 16 55.126 -8.005 6.628 141 HB2 GLU 16 1HB GLU 16 56.906 -8.918 8.893 142 HB3 GLU 16 2HB GLU 16 55.153 -9.061 8.748 143 HG2 GLU 16 1HG GLU 16 55.964 -11.233 8.268 144 HG3 GLU 16 2HG GLU 16 55.615 -10.533 6.689 145 H VAL 17 H VAL 17 54.721 -5.948 6.821 146 HA VAL 17 HA VAL 17 56.101 -4.390 8.875 147 HB VAL 17 HB VAL 17 57.414 -4.032 6.843 148 HG11 VAL 17 1HG1 VAL 17 55.532 -4.633 5.284 149 HG12 VAL 17 2HG1 VAL 17 56.397 -3.168 4.824 150 HG13 VAL 17 3HG1 VAL 17 54.823 -3.051 5.611 151 HG21 VAL 17 3HG2 VAL 17 57.609 -1.856 7.379 152 HG22 VAL 17 1HG2 VAL 17 56.172 -2.017 8.379 153 HG23 VAL 17 2HG2 VAL 17 56.022 -1.486 6.707 154 H GLU 18 H GLU 18 54.966 -2.610 9.584 155 HA GLU 18 HA GLU 18 52.109 -2.628 9.197 156 HB2 GLU 18 1HB GLU 18 52.498 -0.313 10.466 157 HB3 GLU 18 2HB GLU 18 52.669 -1.836 11.331 158 HG2 GLU 18 1HG GLU 18 55.044 -0.644 9.919 159 HG3 GLU 18 2HG GLU 18 54.569 -0.033 11.502 160 HA PRO 19 HA PRO 19 52.162 0.160 5.800 161 HB2 PRO 19 1HB PRO 19 50.416 2.247 6.750 162 HB3 PRO 19 2HB PRO 19 50.040 0.902 5.657 163 HG2 PRO 19 1HG PRO 19 49.076 1.169 8.212 164 HG3 PRO 19 2HG PRO 19 49.181 -0.354 7.320 165 HD2 PRO 19 1HD PRO 19 50.982 0.716 9.445 166 HD3 PRO 19 2HD PRO 19 50.490 -0.964 9.124 167 H SER 20 H SER 20 53.404 1.359 8.770 168 HA SER 20 HA SER 20 54.005 3.969 7.672 169 HB2 SER 20 1HB SER 20 55.312 4.334 9.663 170 HB3 SER 20 2HB SER 20 53.836 3.503 10.152 171 HG SER 20 HG SER 20 56.284 2.750 10.611 172 H ASP 21 H ASP 21 55.404 0.776 7.760 173 HA ASP 21 HA ASP 21 57.525 0.123 6.978 174 HB2 ASP 21 1HB ASP 21 56.943 1.168 4.350 175 HB3 ASP 21 2HB ASP 21 56.997 -0.487 4.912 176 H THR 22 H THR 22 58.857 1.913 8.259 177 HA THR 22 HA THR 22 59.408 4.135 6.468 178 HB THR 22 HB THR 22 61.370 4.411 8.253 179 HG1 THR 22 HG1 THR 22 60.205 3.480 10.250 180 HG21 THR 22 3HG2 THR 22 59.627 5.434 9.823 181 HG22 THR 22 1HG2 THR 22 58.416 4.829 8.696 182 HG23 THR 22 2HG2 THR 22 59.608 6.013 8.156 183 H ILE 23 H ILE 23 60.889 4.260 5.061 184 HA ILE 23 HA ILE 23 61.973 2.048 3.888 185 HB ILE 23 HB ILE 23 63.390 4.612 3.407 186 HG12 ILE 23 1HG1 ILE 23 60.381 4.220 3.173 187 HG13 ILE 23 2HG1 ILE 23 61.204 5.453 4.112 188 HG21 ILE 23 1HG2 ILE 23 63.274 3.920 1.199 189 HG22 ILE 23 2HG2 ILE 23 61.707 3.142 1.417 190 HG23 ILE 23 3HG2 ILE 23 63.169 2.352 1.989 191 HD11 ILE 23 3HD1 ILE 23 61.816 5.407 1.208 192 HD12 ILE 23 1HD1 ILE 23 61.607 6.773 2.299 193 HD13 ILE 23 2HD1 ILE 23 60.200 5.927 1.668 194 H GLU 24 H GLU 24 63.437 4.106 6.342 195 HA GLU 24 HA GLU 24 66.020 2.895 6.167 196 HB2 GLU 24 1HB GLU 24 65.944 4.873 7.489 197 HB3 GLU 24 2HB GLU 24 64.516 4.331 8.369 198 HG2 GLU 24 1HG GLU 24 65.744 2.787 9.659 199 HG3 GLU 24 2HG GLU 24 67.100 2.785 8.532 200 H ASN 25 H ASN 25 62.923 2.195 7.560 201 HA ASN 25 HA ASN 25 63.708 -0.150 9.041 202 HB2 ASN 25 1HB ASN 25 61.796 1.328 9.669 203 HB3 ASN 25 2HB ASN 25 60.931 0.746 8.252 204 HD21 ASN 25 2HD2 ASN 25 60.397 -1.601 8.186 205 HD22 ASN 25 1HD2 ASN 25 60.295 -2.479 9.634 206 H VAL 26 H VAL 26 61.939 0.439 5.992 207 HA VAL 26 HA VAL 26 61.505 -2.333 5.471 208 HB VAL 26 HB VAL 26 61.453 -0.075 3.465 209 HG11 VAL 26 1HG1 VAL 26 59.848 -1.540 2.320 210 HG12 VAL 26 2HG1 VAL 26 60.007 -2.731 3.611 211 HG13 VAL 26 3HG1 VAL 26 61.381 -2.381 2.562 212 HG21 VAL 26 3HG2 VAL 26 59.056 0.113 4.028 213 HG22 VAL 26 1HG2 VAL 26 60.054 0.469 5.435 214 HG23 VAL 26 2HG2 VAL 26 59.258 -1.095 5.297 215 H LYS 27 H LYS 27 63.954 0.004 4.462 216 HA LYS 27 HA LYS 27 65.184 -1.435 2.424 217 HB2 LYS 27 1HB LYS 27 66.405 0.356 4.529 218 HB3 LYS 27 2HB LYS 27 67.267 -0.248 3.120 219 HG2 LYS 27 1HG LYS 27 64.651 1.008 2.563 220 HG3 LYS 27 2HG LYS 27 65.902 2.103 3.145 221 HD2 LYS 27 1HD LYS 27 66.929 2.073 1.136 222 HD3 LYS 27 2HD LYS 27 67.015 0.315 1.159 223 HE2 LYS 27 1HE LYS 27 64.653 1.977 0.263 224 HE3 LYS 27 2HE LYS 27 65.720 1.031 -0.770 225 HZ1 LYS 27 3HZ LYS 27 63.817 -0.272 -0.382 226 HZ2 LYS 27 1HZ LYS 27 63.847 0.024 1.287 227 HZ3 LYS 27 2HZ LYS 27 65.049 -0.943 0.575 228 H ALA 28 H ALA 28 65.925 -1.454 5.895 229 HA ALA 28 HA ALA 28 67.941 -3.380 5.807 230 HB1 ALA 28 3HB ALA 28 65.942 -2.770 7.989 231 HB2 ALA 28 1HB ALA 28 67.538 -2.047 7.792 232 HB3 ALA 28 2HB ALA 28 67.389 -3.756 8.199 233 H LYS 29 H LYS 29 64.422 -3.681 5.866 234 HA LYS 29 HA LYS 29 64.331 -6.487 6.305 235 HB2 LYS 29 1HB LYS 29 62.411 -4.439 5.277 236 HB3 LYS 29 2HB LYS 29 62.075 -6.122 4.883 237 HG2 LYS 29 1HG LYS 29 61.904 -6.744 7.154 238 HG3 LYS 29 2HG LYS 29 62.743 -5.292 7.705 239 HD2 LYS 29 1HD LYS 29 60.859 -3.897 7.085 240 HD3 LYS 29 2HD LYS 29 60.036 -5.272 6.343 241 HE2 LYS 29 1HE LYS 29 60.765 -5.059 9.280 242 HE3 LYS 29 2HE LYS 29 59.153 -4.790 8.612 243 HZ1 LYS 29 3HZ LYS 29 59.735 -7.159 7.560 244 HZ2 LYS 29 1HZ LYS 29 58.936 -6.973 9.044 245 HZ3 LYS 29 2HZ LYS 29 60.609 -7.271 9.013 246 H ILE 30 H ILE 30 64.687 -4.446 3.452 247 HA ILE 30 HA ILE 30 64.563 -6.586 1.551 248 HB ILE 30 HB ILE 30 65.915 -3.892 1.242 249 HG12 ILE 30 1HG1 ILE 30 63.664 -3.373 1.806 250 HG13 ILE 30 2HG1 ILE 30 63.698 -3.346 0.048 251 HG21 ILE 30 1HG2 ILE 30 65.430 -4.310 -1.170 252 HG22 ILE 30 2HG2 ILE 30 64.844 -5.917 -0.741 253 HG23 ILE 30 3HG2 ILE 30 66.536 -5.497 -0.478 254 HD11 ILE 30 3HD1 ILE 30 62.597 -5.500 1.858 255 HD12 ILE 30 1HD1 ILE 30 62.958 -5.807 0.158 256 HD13 ILE 30 2HD1 ILE 30 61.756 -4.596 0.601 257 H GLN 31 H GLN 31 67.158 -4.880 3.231 258 HA GLN 31 HA GLN 31 69.296 -6.276 1.966 259 HB2 GLN 31 1HB GLN 31 69.600 -4.096 3.071 260 HB3 GLN 31 2HB GLN 31 69.244 -4.837 4.628 261 HG2 GLN 31 1HG GLN 31 71.413 -6.010 2.910 262 HG3 GLN 31 2HG GLN 31 71.748 -4.554 3.842 263 HE21 GLN 31 2HE2 GLN 31 69.429 -6.197 5.597 264 HE22 GLN 31 1HE2 GLN 31 70.450 -7.085 6.622 265 H ASP 32 H ASP 32 67.305 -6.883 4.789 266 HA ASP 32 HA ASP 32 68.886 -8.786 6.090 267 HB2 ASP 32 1HB ASP 32 66.883 -7.797 7.094 268 HB3 ASP 32 2HB ASP 32 65.870 -8.650 5.929 269 H LYS 33 H LYS 33 66.625 -9.194 3.378 270 HA LYS 33 HA LYS 33 66.562 -12.016 3.380 271 HB2 LYS 33 1HB LYS 33 66.346 -10.157 0.999 272 HB3 LYS 33 2HB LYS 33 65.788 -11.828 1.072 273 HG2 LYS 33 1HG LYS 33 64.801 -9.728 3.009 274 HG3 LYS 33 2HG LYS 33 64.021 -10.001 1.453 275 HD2 LYS 33 1HD LYS 33 63.893 -12.481 2.142 276 HD3 LYS 33 2HD LYS 33 64.295 -11.928 3.767 277 HE2 LYS 33 1HE LYS 33 62.324 -10.604 3.918 278 HE3 LYS 33 2HE LYS 33 62.011 -10.733 2.187 279 HZ1 LYS 33 3HZ LYS 33 60.570 -12.220 3.351 280 HZ2 LYS 33 1HZ LYS 33 61.869 -12.918 4.187 281 HZ3 LYS 33 2HZ LYS 33 61.721 -13.146 2.510 282 H GLU 34 H GLU 34 68.536 -9.795 1.432 283 HA GLU 34 HA GLU 34 70.703 -11.783 1.376 284 HB2 GLU 34 1HB GLU 34 69.365 -10.543 -1.033 285 HB3 GLU 34 2HB GLU 34 71.024 -11.140 -1.096 286 HG2 GLU 34 1HG GLU 34 70.216 -13.357 -0.279 287 HG3 GLU 34 2HG GLU 34 68.564 -12.747 -0.351 288 H GLY 35 H GLY 35 72.711 -10.556 0.227 289 HA2 GLY 35 1HA GLY 35 73.030 -8.182 1.840 290 HA3 GLY 35 2HA GLY 35 74.230 -8.862 0.744 291 H ILE 36 H ILE 36 72.200 -6.380 1.306 292 HA ILE 36 HA ILE 36 72.721 -5.193 -1.272 293 HB ILE 36 HB ILE 36 70.186 -6.391 -0.734 294 HG12 ILE 36 1HG1 ILE 36 71.300 -6.199 -2.929 295 HG13 ILE 36 2HG1 ILE 36 69.658 -5.564 -2.986 296 HG21 ILE 36 1HG2 ILE 36 69.502 -4.412 0.501 297 HG22 ILE 36 2HG2 ILE 36 68.696 -4.422 -1.063 298 HG23 ILE 36 3HG2 ILE 36 70.079 -3.363 -0.795 299 HD11 ILE 36 3HD1 ILE 36 71.235 -3.362 -2.250 300 HD12 ILE 36 1HD1 ILE 36 70.530 -3.666 -3.836 301 HD13 ILE 36 2HD1 ILE 36 72.175 -4.194 -3.487 302 HA PRO 37 HA PRO 37 73.248 -2.314 2.073 303 HB2 PRO 37 1HB PRO 37 74.245 -0.310 0.255 304 HB3 PRO 37 2HB PRO 37 75.147 -1.291 1.420 305 HG2 PRO 37 1HG PRO 37 75.291 -1.505 -1.340 306 HG3 PRO 37 2HG PRO 37 75.844 -2.714 -0.171 307 HD2 PRO 37 1HD PRO 37 73.391 -2.712 -1.848 308 HD3 PRO 37 2HD PRO 37 74.304 -4.077 -1.167 309 HA PRO 38 HA PRO 38 69.342 -0.194 1.604 310 HB2 PRO 38 1HB PRO 38 69.952 1.588 3.786 311 HB3 PRO 38 2HB PRO 38 68.868 0.200 3.783 312 HG2 PRO 38 1HG PRO 38 71.434 0.431 4.978 313 HG3 PRO 38 2HG PRO 38 70.321 -0.941 5.010 314 HD2 PRO 38 1HD PRO 38 72.797 -0.747 3.604 315 HD3 PRO 38 2HD PRO 38 71.631 -2.085 3.564 316 H ASP 39 H ASP 39 72.388 1.542 2.024 317 HA ASP 39 HA ASP 39 71.478 4.090 1.169 318 HB2 ASP 39 1HB ASP 39 74.297 3.115 0.777 319 HB3 ASP 39 2HB ASP 39 73.733 4.738 1.169 320 H GLN 40 H GLN 40 72.445 1.217 -0.547 321 HA GLN 40 HA GLN 40 72.451 2.697 -3.101 322 HB2 GLN 40 1HB GLN 40 74.352 1.067 -2.349 323 HB3 GLN 40 2HB GLN 40 73.219 -0.195 -2.830 324 HG2 GLN 40 1HG GLN 40 72.992 0.975 -5.058 325 HG3 GLN 40 2HG GLN 40 74.305 2.041 -4.563 326 HE21 GLN 40 2HE2 GLN 40 74.830 0.545 -6.801 327 HE22 GLN 40 1HE2 GLN 40 75.884 -0.738 -6.441 328 H GLN 41 H GLN 41 70.287 1.127 -1.187 329 HA GLN 41 HA GLN 41 68.879 -0.135 -3.457 330 HB2 GLN 41 1HB GLN 41 69.368 -1.179 -0.996 331 HB3 GLN 41 2HB GLN 41 67.791 -0.453 -0.720 332 HG2 GLN 41 1HG GLN 41 68.545 -2.587 -2.711 333 HG3 GLN 41 2HG GLN 41 67.289 -2.633 -1.478 334 HE21 GLN 41 2HE2 GLN 41 65.695 -0.512 -1.873 335 HE22 GLN 41 1HE2 GLN 41 65.128 -0.415 -3.470 336 H ARG 42 H ARG 42 67.156 0.829 -4.313 337 HA ARG 42 HA ARG 42 65.677 2.828 -2.710 338 HB2 ARG 42 1HB ARG 42 65.380 3.940 -5.101 339 HB3 ARG 42 2HB ARG 42 66.796 4.289 -4.110 340 HG2 ARG 42 1HG ARG 42 68.100 2.608 -5.301 341 HG3 ARG 42 2HG ARG 42 66.683 2.133 -6.238 342 HD2 ARG 42 1HD ARG 42 66.706 4.077 -7.516 343 HD3 ARG 42 2HD ARG 42 67.541 5.008 -6.275 344 HE ARG 42 HE ARG 42 68.952 2.864 -7.752 345 HH11 ARG 42 1HH1 ARG 42 68.544 5.808 -8.843 346 HH12 ARG 42 2HH1 ARG 42 70.112 6.459 -8.500 347 HH21 ARG 42 1HH2 ARG 42 71.027 3.858 -6.398 348 HH22 ARG 42 2HH2 ARG 42 71.518 5.356 -7.117 349 H LEU 43 H LEU 43 63.455 2.846 -2.978 350 HA LEU 43 HA LEU 43 62.329 0.766 -4.777 351 HB2 LEU 43 1HB LEU 43 60.913 1.725 -2.307 352 HB3 LEU 43 2HB LEU 43 60.699 0.218 -3.188 353 HG LEU 43 HG LEU 43 63.262 0.884 -1.722 354 HD11 LEU 43 1HD1 LEU 43 61.696 0.882 0.036 355 HD12 LEU 43 2HD1 LEU 43 62.223 -0.800 -0.019 356 HD13 LEU 43 3HD1 LEU 43 60.685 -0.335 -0.742 357 HD21 LEU 43 3HD2 LEU 43 62.016 -1.759 -2.541 358 HD22 LEU 43 1HD2 LEU 43 63.633 -1.513 -1.884 359 HD23 LEU 43 2HD2 LEU 43 63.236 -0.914 -3.492 360 H ILE 44 H ILE 44 60.090 1.221 -5.513 361 HA ILE 44 HA ILE 44 59.442 4.097 -5.610 362 HB ILE 44 HB ILE 44 59.561 2.248 -8.001 363 HG12 ILE 44 1HG1 ILE 44 61.083 4.812 -7.466 364 HG13 ILE 44 2HG1 ILE 44 61.737 3.219 -7.088 365 HG21 ILE 44 1HG2 ILE 44 57.676 3.710 -8.271 366 HG22 ILE 44 2HG2 ILE 44 58.989 4.405 -9.221 367 HG23 ILE 44 3HG2 ILE 44 58.580 5.090 -7.648 368 HD11 ILE 44 3HD1 ILE 44 60.722 3.960 -9.839 369 HD12 ILE 44 1HD1 ILE 44 61.675 2.547 -9.386 370 HD13 ILE 44 2HD1 ILE 44 62.405 4.152 -9.354 371 H PHE 45 H PHE 45 57.302 4.590 -5.571 372 HA PHE 45 HA PHE 45 55.347 2.388 -5.807 373 HB2 PHE 45 1HB PHE 45 55.678 2.632 -3.430 374 HB3 PHE 45 2HB PHE 45 55.549 4.386 -3.541 375 HD1 PHE 45 HD1 PHE 45 53.640 1.233 -4.170 376 HD2 PHE 45 HD2 PHE 45 53.453 5.449 -3.372 377 HE1 PHE 45 HE1 PHE 45 51.181 1.072 -3.895 378 HE2 PHE 45 HE2 PHE 45 50.994 5.289 -3.096 379 HZ PHE 45 HZ PHE 45 49.857 3.099 -3.356 380 H ALA 46 H ALA 46 53.901 2.923 -7.312 381 HA ALA 46 HA ALA 46 52.606 4.171 -8.746 382 HB1 ALA 46 3HB ALA 46 52.413 6.112 -6.435 383 HB2 ALA 46 1HB ALA 46 51.488 4.613 -6.523 384 HB3 ALA 46 2HB ALA 46 51.246 5.871 -7.736 385 H GLY 47 H GLY 47 55.442 4.610 -8.835 386 HA2 GLY 47 1HA GLY 47 56.735 5.967 -10.234 387 HA3 GLY 47 2HA GLY 47 55.446 7.166 -10.228 388 H LYS 48 H LYS 48 55.426 6.829 -7.163 389 HA LYS 48 HA LYS 48 57.307 8.980 -6.666 390 HB2 LYS 48 1HB LYS 48 54.863 8.285 -5.590 391 HB3 LYS 48 2HB LYS 48 55.984 7.786 -4.325 392 HG2 LYS 48 1HG LYS 48 57.017 10.028 -4.347 393 HG3 LYS 48 2HG LYS 48 55.905 10.531 -5.620 394 HD2 LYS 48 1HD LYS 48 54.805 9.402 -3.055 395 HD3 LYS 48 2HD LYS 48 55.334 11.083 -3.110 396 HE2 LYS 48 1HE LYS 48 53.840 11.485 -5.042 397 HE3 LYS 48 2HE LYS 48 53.291 9.811 -4.960 398 HZ1 LYS 48 3HZ LYS 48 53.100 11.640 -2.642 399 HZ2 LYS 48 1HZ LYS 48 52.290 10.172 -2.893 400 HZ3 LYS 48 2HZ LYS 48 51.872 11.538 -3.811 401 H GLN 49 H GLN 49 59.370 8.615 -6.226 402 HA GLN 49 HA GLN 49 60.370 6.035 -5.518 403 HB2 GLN 49 1HB GLN 49 62.544 7.130 -5.389 404 HB3 GLN 49 2HB GLN 49 61.686 7.676 -6.829 405 HG2 GLN 49 1HG GLN 49 60.849 9.631 -5.393 406 HG3 GLN 49 2HG GLN 49 62.079 9.150 -4.224 407 HE21 GLN 49 2HE2 GLN 49 62.883 11.455 -4.861 408 HE22 GLN 49 1HE2 GLN 49 63.942 11.545 -6.184 409 H LEU 50 H LEU 50 60.604 5.149 -3.554 410 HA LEU 50 HA LEU 50 59.802 6.640 -1.214 411 HB2 LEU 50 1HB LEU 50 60.872 3.821 -1.535 412 HB3 LEU 50 2HB LEU 50 60.253 4.485 -0.030 413 HG LEU 50 HG LEU 50 58.708 4.051 -2.604 414 HD11 LEU 50 1HD1 LEU 50 57.374 2.538 -1.242 415 HD12 LEU 50 2HD1 LEU 50 58.287 2.980 0.198 416 HD13 LEU 50 3HD1 LEU 50 59.071 2.090 -1.100 417 HD21 LEU 50 3HD2 LEU 50 56.768 4.852 -1.028 418 HD22 LEU 50 1HD2 LEU 50 57.766 6.054 -1.838 419 HD23 LEU 50 2HD2 LEU 50 58.060 5.663 -0.143 420 H GLU 51 H GLU 51 61.040 7.731 0.089 421 HA GLU 51 HA GLU 51 63.790 8.154 -0.564 422 HB2 GLU 51 1HB GLU 51 61.681 9.535 0.849 423 HB3 GLU 51 2HB GLU 51 63.206 9.652 1.723 424 HG2 GLU 51 1HG GLU 51 63.013 11.494 0.114 425 HG3 GLU 51 2HG GLU 51 64.324 10.414 -0.359 426 H ASP 52 H ASP 52 64.948 8.997 1.527 427 HA ASP 52 HA ASP 52 66.538 7.047 2.550 428 HB2 ASP 52 1HB ASP 52 65.888 9.810 3.508 429 HB3 ASP 52 2HB ASP 52 67.059 8.800 4.354 430 H GLY 53 H GLY 53 63.383 6.998 3.383 431 HA2 GLY 53 1HA GLY 53 62.858 5.312 5.178 432 HA3 GLY 53 2HA GLY 53 64.017 6.170 6.157 433 H ARG 54 H ARG 54 61.556 7.414 3.999 434 HA ARG 54 HA ARG 54 60.386 9.090 6.096 435 HB2 ARG 54 1HB ARG 54 59.741 8.635 3.151 436 HB3 ARG 54 2HB ARG 54 58.723 9.612 4.209 437 HG2 ARG 54 1HG ARG 54 60.977 10.850 4.770 438 HG3 ARG 54 2HG ARG 54 61.518 10.153 3.244 439 HD2 ARG 54 1HD ARG 54 60.591 12.361 2.817 440 HD3 ARG 54 2HD ARG 54 59.516 11.147 2.130 441 HE ARG 54 HE ARG 54 58.714 11.773 4.784 442 HH11 ARG 54 1HH2 ARG 54 56.734 11.557 2.601 443 HH12 ARG 54 2HH2 ARG 54 56.240 13.197 2.347 444 HH21 ARG 54 1HH1 ARG 54 58.958 14.555 4.014 445 HH22 ARG 54 2HH1 ARG 54 57.497 14.892 3.146 446 H THR 55 H THR 55 57.977 8.625 6.623 447 HA THR 55 HA THR 55 57.740 5.747 6.819 448 HB THR 55 HB THR 55 56.513 8.089 8.032 449 HG1 THR 55 HG1 THR 55 56.633 6.796 9.735 450 HG21 THR 55 3HG2 THR 55 54.487 7.510 6.895 451 HG22 THR 55 1HG2 THR 55 54.345 6.885 8.537 452 HG23 THR 55 2HG2 THR 55 54.733 5.798 7.211 453 H LEU 56 H LEU 56 56.403 4.420 5.770 454 HA LEU 56 HA LEU 56 55.479 5.194 3.193 455 HB2 LEU 56 1HB LEU 56 55.797 2.722 4.703 456 HB3 LEU 56 2HB LEU 56 54.452 2.692 3.579 457 HG LEU 56 HG LEU 56 56.428 1.868 2.412 458 HD11 LEU 56 1HD1 LEU 56 56.577 4.534 1.220 459 HD12 LEU 56 2HD1 LEU 56 54.933 3.991 1.474 460 HD13 LEU 56 3HD1 LEU 56 56.029 3.016 0.520 461 HD21 LEU 56 3HD2 LEU 56 58.205 3.994 2.233 462 HD22 LEU 56 1HD2 LEU 56 58.417 2.544 3.206 463 HD23 LEU 56 2HD2 LEU 56 57.724 4.001 3.924 464 H SER 57 H SER 57 53.939 4.650 6.296 465 HA SER 57 HA SER 57 51.305 4.298 5.471 466 HB2 SER 57 1HB SER 57 51.692 4.082 7.801 467 HB3 SER 57 2HB SER 57 52.486 5.650 7.898 468 HG SER 57 HG SER 57 49.759 5.018 7.667 469 H ASP 58 H ASP 58 53.353 7.101 5.582 470 HA ASP 58 HA ASP 58 51.289 9.036 5.072 471 HB2 ASP 58 1HB ASP 58 53.642 9.469 6.041 472 HB3 ASP 58 2HB ASP 58 54.210 9.353 4.377 473 H TYR 59 H TYR 59 53.305 6.878 3.247 474 HA TYR 59 HA TYR 59 52.753 8.046 0.651 475 HB2 TYR 59 1HB TYR 59 54.167 5.630 1.683 476 HB3 TYR 59 2HB TYR 59 53.689 5.657 -0.007 477 HD1 TYR 59 HD2 TYR 59 55.548 7.495 2.605 478 HD2 TYR 59 HD1 TYR 59 54.883 6.928 -1.585 479 HE1 TYR 59 HE2 TYR 59 57.505 8.939 2.111 480 HE2 TYR 59 HE1 TYR 59 56.838 8.371 -2.096 481 HH TYR 59 HH TYR 59 58.463 9.628 -1.261 482 H ASN 60 H ASN 60 51.044 6.292 2.885 483 HA ASN 60 HA ASN 60 49.022 5.222 2.838 484 HB2 ASN 60 1HB ASN 60 48.700 7.148 1.059 485 HB3 ASN 60 2HB ASN 60 48.704 5.807 -0.084 486 HD21 ASN 60 2HD2 ASN 60 47.263 3.824 1.018 487 HD22 ASN 60 1HD2 ASN 60 45.721 4.339 1.503 488 H ILE 61 H ILE 61 51.288 3.595 2.505 489 HA ILE 61 HA ILE 61 51.077 1.951 0.210 490 HB ILE 61 HB ILE 61 52.287 1.359 2.908 491 HG12 ILE 61 1HG1 ILE 61 53.330 3.127 1.548 492 HG13 ILE 61 2HG1 ILE 61 54.371 1.717 1.700 493 HG21 ILE 61 1HG2 ILE 61 52.137 -0.818 2.217 494 HG22 ILE 61 2HG2 ILE 61 53.451 -0.372 1.130 495 HG23 ILE 61 3HG2 ILE 61 51.795 -0.365 0.548 496 HD11 ILE 61 3HD1 ILE 61 54.534 1.693 -0.540 497 HD12 ILE 61 1HD1 ILE 61 53.294 2.932 -0.698 498 HD13 ILE 61 2HD1 ILE 61 52.839 1.231 -0.607 499 H GLN 62 H GLN 62 50.015 0.218 -0.240 500 HA GLN 62 HA GLN 62 47.724 -0.454 1.445 501 HB2 GLN 62 1HB GLN 62 46.800 -1.414 -0.655 502 HB3 GLN 62 2HB GLN 62 47.168 0.307 -0.763 503 HG2 GLN 62 1HG GLN 62 49.137 -0.079 -2.022 504 HG3 GLN 62 2HG GLN 62 49.161 -1.794 -1.615 505 HE21 GLN 62 2HE2 GLN 62 47.998 -3.222 -2.979 506 HE22 GLN 62 1HE2 GLN 62 47.051 -2.705 -4.289 507 H LYS 63 H LYS 63 46.868 -2.607 0.615 508 HA LYS 63 HA LYS 63 47.778 -4.680 2.040 509 HB2 LYS 63 1HB LYS 63 46.187 -4.629 -0.499 510 HB3 LYS 63 2HB LYS 63 46.466 -6.117 0.406 511 HG2 LYS 63 1HG LYS 63 45.277 -5.371 2.275 512 HG3 LYS 63 2HG LYS 63 45.484 -3.672 1.856 513 HD2 LYS 63 1HD LYS 63 44.026 -4.233 -0.225 514 HD3 LYS 63 2HD LYS 63 43.571 -5.680 0.677 515 HE2 LYS 63 1HE LYS 63 42.991 -4.138 2.620 516 HE3 LYS 63 2HE LYS 63 43.175 -2.793 1.491 517 HZ1 LYS 63 3HZ LYS 63 40.895 -3.427 1.537 518 HZ2 LYS 63 1HZ LYS 63 41.273 -5.060 1.281 519 HZ3 LYS 63 2HZ LYS 63 41.534 -3.923 0.045 520 H GLU 64 H GLU 64 50.142 -3.672 0.535 521 HA GLU 64 HA GLU 64 52.114 -4.842 0.005 522 HB2 GLU 64 1HB GLU 64 50.366 -7.144 -0.857 523 HB3 GLU 64 2HB GLU 64 52.109 -7.150 -0.672 524 HG2 GLU 64 1HG GLU 64 52.028 -7.256 1.606 525 HG3 GLU 64 2HG GLU 64 50.536 -6.333 1.721 526 H SER 65 H SER 65 51.172 -2.970 -1.510 527 HA SER 65 HA SER 65 50.638 -3.573 -4.229 528 HB2 SER 65 1HB SER 65 51.837 -1.180 -4.382 529 HB3 SER 65 2HB SER 65 50.190 -1.363 -3.789 530 HG SER 65 HG SER 65 52.008 -1.812 -1.835 531 H THR 66 H THR 66 52.116 -3.464 -6.021 532 HA THR 66 HA THR 66 54.744 -4.554 -5.391 533 HB THR 66 HB THR 66 53.483 -5.578 -7.204 534 HG1 THR 66 HG1 THR 66 55.645 -4.030 -8.182 535 HG21 THR 66 3HG2 THR 66 52.769 -4.394 -9.138 536 HG22 THR 66 1HG2 THR 66 53.707 -2.966 -8.702 537 HG23 THR 66 2HG2 THR 66 52.274 -3.398 -7.771 538 H LEU 67 H LEU 67 56.568 -3.404 -5.309 539 HA LEU 67 HA LEU 67 56.529 -0.601 -6.228 540 HB2 LEU 67 1HB LEU 67 58.680 -1.938 -4.574 541 HB3 LEU 67 2HB LEU 67 58.370 -0.213 -4.757 542 HG LEU 67 HG LEU 67 56.641 -2.248 -3.327 543 HD11 LEU 67 1HD1 LEU 67 57.775 0.358 -2.299 544 HD12 LEU 67 2HD1 LEU 67 58.676 -1.154 -2.204 545 HD13 LEU 67 3HD1 LEU 67 57.132 -0.994 -1.368 546 HD21 LEU 67 3HD2 LEU 67 55.262 -0.092 -2.835 547 HD22 LEU 67 1HD2 LEU 67 55.045 -0.881 -4.396 548 HD23 LEU 67 2HD2 LEU 67 56.055 0.558 -4.271 549 H HIS 68 H HIS 68 57.897 0.142 -7.799 550 HA HIS 68 HA HIS 68 59.185 -1.887 -9.455 551 HB2 HIS 68 1HB HIS 68 58.952 1.092 -9.926 552 HB3 HIS 68 2HB HIS 68 59.388 -0.139 -11.112 553 HD1 HIS 68 HD1 HIS 68 57.503 -1.491 -12.171 554 HD2 HIS 68 HD2 HIS 68 56.174 0.994 -9.097 555 HE1 HIS 68 HE1 HIS 68 54.972 -1.554 -12.242 556 H LEU 69 H LEU 69 61.327 -2.124 -9.780 557 HA LEU 69 HA LEU 69 63.135 -0.412 -8.179 558 HB2 LEU 69 1HB LEU 69 63.034 -3.339 -8.709 559 HB3 LEU 69 2HB LEU 69 64.636 -2.604 -8.645 560 HG LEU 69 HG LEU 69 62.626 -1.974 -6.494 561 HD11 LEU 69 1HD1 LEU 69 63.683 -3.889 -5.195 562 HD12 LEU 69 2HD1 LEU 69 64.328 -4.468 -6.733 563 HD13 LEU 69 3HD1 LEU 69 62.583 -4.374 -6.486 564 HD21 LEU 69 3HD2 LEU 69 64.821 -0.758 -6.708 565 HD22 LEU 69 1HD2 LEU 69 65.644 -2.296 -6.458 566 HD23 LEU 69 2HD2 LEU 69 64.641 -1.613 -5.179 567 H VAL 70 H VAL 70 65.244 0.020 -9.088 568 HA VAL 70 HA VAL 70 65.508 -0.372 -11.986 569 HB VAL 70 HB VAL 70 66.088 2.037 -12.277 570 HG11 VAL 70 1HG1 VAL 70 63.804 1.135 -12.763 571 HG12 VAL 70 2HG1 VAL 70 63.780 2.829 -12.271 572 HG13 VAL 70 3HG1 VAL 70 63.321 1.571 -11.123 573 HG21 VAL 70 3HG2 VAL 70 64.973 2.256 -9.460 574 HG22 VAL 70 1HG2 VAL 70 65.430 3.610 -10.494 575 HG23 VAL 70 2HG2 VAL 70 66.662 2.491 -9.909 576 H LEU 71 H LEU 71 67.639 -0.248 -12.741 577 HA LEU 71 HA LEU 71 69.775 0.242 -10.801 578 HB2 LEU 71 1HB LEU 71 70.818 -1.990 -11.780 579 HB3 LEU 71 2HB LEU 71 69.738 -2.030 -10.389 580 HG LEU 71 HG LEU 71 68.385 -2.145 -13.035 581 HD11 LEU 71 1HD1 LEU 71 68.883 -4.665 -13.106 582 HD12 LEU 71 2HD1 LEU 71 70.252 -4.308 -12.054 583 HD13 LEU 71 3HD1 LEU 71 70.165 -3.587 -13.662 584 HD21 LEU 71 3HD2 LEU 71 67.113 -3.934 -11.817 585 HD22 LEU 71 1HD2 LEU 71 67.120 -2.394 -10.959 586 HD23 LEU 71 2HD2 LEU 71 68.179 -3.701 -10.433 587 H ARG 72 H ARG 72 68.979 -0.777 -14.122 588 HA ARG 72 HA ARG 72 71.441 0.436 -15.128 589 HB2 ARG 72 1HB ARG 72 70.472 -1.775 -15.980 590 HB3 ARG 72 2HB ARG 72 69.236 -0.798 -16.774 591 HG2 ARG 72 1HG ARG 72 71.228 0.563 -17.739 592 HG3 ARG 72 2HG ARG 72 72.215 -0.815 -17.262 593 HD2 ARG 72 1HD ARG 72 69.728 -1.362 -18.836 594 HD3 ARG 72 2HD ARG 72 71.105 -0.672 -19.684 595 HE ARG 72 HE ARG 72 72.314 -2.655 -19.285 596 HH11 ARG 72 1HH2 ARG 72 68.985 -2.884 -18.525 597 HH12 ARG 72 2HH2 ARG 72 69.086 -4.480 -17.863 598 HH21 ARG 72 1HH1 ARG 72 72.541 -4.649 -18.101 599 HH22 ARG 72 2HH1 ARG 72 71.098 -5.478 -17.621 Start of MODEL 3 1 H1 MET 1 1H MET 1 49.163 -3.654 7.713 2 H2 MET 1 2H MET 1 49.468 -2.765 6.297 3 H3 MET 1 3H MET 1 50.749 -3.504 7.131 4 HA MET 1 HA MET 1 49.040 -5.568 6.626 5 HB2 MET 1 1HB MET 1 49.309 -3.782 4.185 6 HB3 MET 1 2HB MET 1 48.605 -5.400 4.210 7 HG2 MET 1 1HG MET 1 46.701 -4.061 4.375 8 HG3 MET 1 2HG MET 1 47.045 -4.388 6.073 9 HE1 MET 1 3HE MET 1 47.388 -0.508 3.729 10 HE2 MET 1 1HE MET 1 46.592 -2.029 3.304 11 HE3 MET 1 2HE MET 1 48.346 -1.894 3.216 12 H GLN 2 H GLN 2 50.348 -5.544 3.749 13 HA GLN 2 HA GLN 2 53.101 -6.176 4.641 14 HB2 GLN 2 1HB GLN 2 51.209 -7.767 2.921 15 HB3 GLN 2 2HB GLN 2 52.955 -7.955 2.753 16 HG2 GLN 2 1HG GLN 2 53.204 -8.728 4.971 17 HG3 GLN 2 2HG GLN 2 51.623 -8.116 5.454 18 HE21 GLN 2 2HE2 GLN 2 52.008 -10.738 6.075 19 HE22 GLN 2 1HE2 GLN 2 51.183 -11.758 4.998 20 H ILE 3 H ILE 3 54.678 -6.154 2.835 21 HA ILE 3 HA ILE 3 53.889 -4.244 0.728 22 HB ILE 3 HB ILE 3 56.334 -4.276 2.455 23 HG12 ILE 3 1HG1 ILE 3 54.151 -2.411 1.630 24 HG13 ILE 3 2HG1 ILE 3 54.962 -2.567 3.181 25 HG21 ILE 3 1HG2 ILE 3 57.516 -2.888 0.783 26 HG22 ILE 3 2HG2 ILE 3 56.178 -3.098 -0.347 27 HG23 ILE 3 3HG2 ILE 3 57.167 -4.480 0.119 28 HD11 ILE 3 3HD1 ILE 3 55.911 -1.109 0.717 29 HD12 ILE 3 1HD1 ILE 3 57.009 -1.532 2.030 30 HD13 ILE 3 2HD1 ILE 3 55.641 -0.467 2.334 31 H PHE 4 H PHE 4 54.983 -4.441 -1.266 32 HA PHE 4 HA PHE 4 56.204 -7.082 -1.742 33 HB2 PHE 4 1HB PHE 4 53.883 -7.326 -2.248 34 HB3 PHE 4 2HB PHE 4 53.858 -5.806 -3.127 35 HD1 PHE 4 HD2 PHE 4 56.701 -8.116 -3.527 36 HD2 PHE 4 HD1 PHE 4 52.898 -6.871 -5.087 37 HE1 PHE 4 HE2 PHE 4 57.176 -9.317 -5.634 38 HE2 PHE 4 HE1 PHE 4 53.369 -8.088 -7.195 39 HZ PHE 4 HZ PHE 4 55.508 -9.311 -7.469 40 H VAL 5 H VAL 5 57.922 -7.022 -3.053 41 HA VAL 5 HA VAL 5 58.408 -4.617 -4.706 42 HB VAL 5 HB VAL 5 60.622 -6.129 -3.332 43 HG11 VAL 5 1HG1 VAL 5 60.468 -3.211 -4.095 44 HG12 VAL 5 2HG1 VAL 5 60.941 -4.444 -5.265 45 HG13 VAL 5 3HG1 VAL 5 61.903 -4.194 -3.809 46 HG21 VAL 5 3HG2 VAL 5 60.510 -4.240 -1.620 47 HG22 VAL 5 1HG2 VAL 5 59.237 -5.455 -1.497 48 HG23 VAL 5 2HG2 VAL 5 58.897 -3.892 -2.242 49 H LYS 6 H LYS 6 59.473 -4.962 -6.677 50 HA LYS 6 HA LYS 6 59.442 -7.761 -7.604 51 HB2 LYS 6 1HB LYS 6 58.168 -6.244 -8.990 52 HB3 LYS 6 2HB LYS 6 59.514 -5.111 -9.073 53 HG2 LYS 6 1HG LYS 6 59.507 -6.315 -11.145 54 HG3 LYS 6 2HG LYS 6 60.853 -6.957 -10.209 55 HD2 LYS 6 1HD LYS 6 59.624 -8.920 -9.612 56 HD3 LYS 6 2HD LYS 6 58.107 -8.226 -10.188 57 HE2 LYS 6 1HE LYS 6 59.180 -9.901 -11.765 58 HE3 LYS 6 2HE LYS 6 58.835 -8.325 -12.476 59 HZ1 LYS 6 3HZ LYS 6 61.197 -7.741 -11.799 60 HZ2 LYS 6 1HZ LYS 6 61.010 -8.794 -13.114 61 HZ3 LYS 6 2HZ LYS 6 61.437 -9.409 -11.588 62 H THR 7 H THR 7 61.311 -8.826 -7.663 63 HA THR 7 HA THR 7 63.828 -7.390 -7.387 64 HB THR 7 HB THR 7 64.805 -9.640 -7.135 65 HG1 THR 7 HG1 THR 7 62.733 -10.369 -8.491 66 HG21 THR 7 3HG2 THR 7 63.657 -8.383 -5.240 67 HG22 THR 7 1HG2 THR 7 63.804 -10.127 -5.019 68 HG23 THR 7 2HG2 THR 7 62.262 -9.427 -5.513 69 H LEU 8 H LEU 8 65.686 -7.951 -8.704 70 HA LEU 8 HA LEU 8 65.123 -7.667 -11.491 71 HB2 LEU 8 1HB LEU 8 67.740 -8.236 -10.077 72 HB3 LEU 8 2HB LEU 8 67.567 -7.722 -11.753 73 HG LEU 8 HG LEU 8 66.118 -5.775 -10.542 74 HD11 LEU 8 1HD1 LEU 8 66.877 -6.941 -8.305 75 HD12 LEU 8 2HD1 LEU 8 66.904 -5.183 -8.423 76 HD13 LEU 8 3HD1 LEU 8 68.397 -6.103 -8.607 77 HD21 LEU 8 3HD2 LEU 8 67.900 -5.299 -12.090 78 HD22 LEU 8 1HD2 LEU 8 69.115 -5.913 -10.971 79 HD23 LEU 8 2HD2 LEU 8 68.259 -4.414 -10.608 80 H THR 9 H THR 9 65.306 -10.353 -9.444 81 HA THR 9 HA THR 9 66.196 -12.193 -11.547 82 HB THR 9 HB THR 9 65.296 -12.970 -8.778 83 HG1 THR 9 HG1 THR 9 66.836 -11.380 -8.496 84 HG21 THR 9 3HG2 THR 9 65.700 -14.747 -10.452 85 HG22 THR 9 1HG2 THR 9 66.886 -14.807 -9.149 86 HG23 THR 9 2HG2 THR 9 67.328 -14.120 -10.712 87 H GLY 10 H GLY 10 63.334 -10.829 -10.401 88 HA2 GLY 10 1HA GLY 10 61.201 -11.160 -11.327 89 HA3 GLY 10 2HA GLY 10 61.740 -12.706 -11.972 90 H LYS 11 H LYS 11 62.774 -12.564 -8.840 91 HA LYS 11 HA LYS 11 60.752 -14.435 -7.952 92 HB2 LYS 11 1HB LYS 11 63.185 -13.259 -6.593 93 HB3 LYS 11 2HB LYS 11 62.129 -14.464 -5.855 94 HG2 LYS 11 1HG LYS 11 62.560 -15.915 -7.909 95 HG3 LYS 11 2HG LYS 11 63.833 -14.770 -8.337 96 HD2 LYS 11 1HD LYS 11 63.653 -16.438 -5.813 97 HD3 LYS 11 2HD LYS 11 64.858 -16.575 -7.094 98 HE2 LYS 11 1HE LYS 11 65.375 -14.076 -6.548 99 HE3 LYS 11 2HE LYS 11 64.536 -14.403 -5.033 100 HZ1 LYS 11 3HZ LYS 11 66.614 -15.018 -4.433 101 HZ2 LYS 11 1HZ LYS 11 67.085 -15.433 -6.009 102 HZ3 LYS 11 2HZ LYS 11 66.120 -16.498 -5.103 103 H THR 12 H THR 12 59.033 -14.004 -6.686 104 HA THR 12 HA THR 12 58.415 -11.264 -6.032 105 HB THR 12 HB THR 12 56.527 -12.537 -6.634 106 HG1 THR 12 HG1 THR 12 56.085 -12.971 -3.976 107 HG21 THR 12 3HG2 THR 12 57.322 -14.768 -6.530 108 HG22 THR 12 1HG2 THR 12 56.016 -14.705 -5.347 109 HG23 THR 12 2HG2 THR 12 57.695 -14.642 -4.812 110 H ILE 13 H ILE 13 59.049 -10.243 -4.252 111 HA ILE 13 HA ILE 13 59.835 -11.850 -1.889 112 HB ILE 13 HB ILE 13 61.659 -10.574 -3.045 113 HG12 ILE 13 1HG1 ILE 13 60.925 -9.661 -0.244 114 HG13 ILE 13 2HG1 ILE 13 61.789 -11.145 -0.647 115 HG21 ILE 13 1HG2 ILE 13 61.591 -8.274 -3.289 116 HG22 ILE 13 2HG2 ILE 13 60.529 -8.050 -1.898 117 HG23 ILE 13 3HG2 ILE 13 59.869 -8.624 -3.426 118 HD11 ILE 13 3HD1 ILE 13 62.777 -8.377 -1.393 119 HD12 ILE 13 1HD1 ILE 13 63.657 -9.899 -1.541 120 HD13 ILE 13 2HD1 ILE 13 63.287 -9.242 0.051 121 H THR 14 H THR 14 58.564 -11.654 -0.178 122 HA THR 14 HA THR 14 56.929 -9.202 0.117 123 HB THR 14 HB THR 14 56.353 -11.880 1.385 124 HG1 THR 14 HG1 THR 14 55.571 -10.815 -1.116 125 HG21 THR 14 3HG2 THR 14 54.079 -10.927 1.542 126 HG22 THR 14 1HG2 THR 14 54.655 -9.441 0.784 127 HG23 THR 14 2HG2 THR 14 55.257 -9.912 2.373 128 H LEU 15 H LEU 15 57.059 -8.057 1.977 129 HA LEU 15 HA LEU 15 58.949 -9.033 4.041 130 HB2 LEU 15 1HB LEU 15 58.456 -6.170 4.158 131 HB3 LEU 15 2HB LEU 15 59.985 -7.029 4.004 132 HG LEU 15 HG LEU 15 58.119 -6.599 1.660 133 HD11 LEU 15 1HD1 LEU 15 58.697 -4.395 2.392 134 HD12 LEU 15 2HD1 LEU 15 59.791 -4.772 1.061 135 HD13 LEU 15 3HD1 LEU 15 60.363 -4.871 2.726 136 HD21 LEU 15 3HD2 LEU 15 61.111 -6.991 1.619 137 HD22 LEU 15 1HD2 LEU 15 59.938 -7.314 0.343 138 HD23 LEU 15 2HD2 LEU 15 60.034 -8.382 1.743 139 H GLU 16 H GLU 16 58.410 -8.728 6.226 140 HA GLU 16 HA GLU 16 55.518 -8.362 6.656 141 HB2 GLU 16 1HB GLU 16 56.364 -10.343 7.721 142 HB3 GLU 16 2HB GLU 16 57.743 -9.471 8.393 143 HG2 GLU 16 1HG GLU 16 56.387 -8.286 9.935 144 HG3 GLU 16 2HG GLU 16 54.906 -8.692 9.070 145 H VAL 17 H VAL 17 55.004 -6.324 6.891 146 HA VAL 17 HA VAL 17 56.441 -4.671 8.837 147 HB VAL 17 HB VAL 17 57.531 -4.269 6.655 148 HG11 VAL 17 1HG1 VAL 17 55.441 -4.879 5.346 149 HG12 VAL 17 2HG1 VAL 17 56.286 -3.441 4.777 150 HG13 VAL 17 3HG1 VAL 17 54.819 -3.277 5.742 151 HG21 VAL 17 3HG2 VAL 17 56.895 -2.411 8.418 152 HG22 VAL 17 1HG2 VAL 17 55.810 -1.858 7.150 153 HG23 VAL 17 2HG2 VAL 17 57.537 -1.951 6.848 154 H GLU 18 H GLU 18 55.351 -2.489 8.972 155 HA GLU 18 HA GLU 18 52.427 -2.850 8.937 156 HB2 GLU 18 1HB GLU 18 53.792 -0.498 10.225 157 HB3 GLU 18 2HB GLU 18 52.290 -1.300 10.679 158 HG2 GLU 18 1HG GLU 18 53.571 -2.222 12.325 159 HG3 GLU 18 2HG GLU 18 54.057 -3.341 11.052 160 HA PRO 19 HA PRO 19 52.240 0.113 5.736 161 HB2 PRO 19 1HB PRO 19 50.409 2.018 6.884 162 HB3 PRO 19 2HB PRO 19 50.073 0.730 5.714 163 HG2 PRO 19 1HG PRO 19 49.198 0.776 8.323 164 HG3 PRO 19 2HG PRO 19 49.316 -0.668 7.306 165 HD2 PRO 19 1HD PRO 19 51.142 0.270 9.466 166 HD3 PRO 19 2HD PRO 19 50.734 -1.384 8.960 167 H SER 20 H SER 20 53.444 1.153 8.782 168 HA SER 20 HA SER 20 53.920 3.863 7.878 169 HB2 SER 20 1HB SER 20 54.392 4.163 10.069 170 HB3 SER 20 2HB SER 20 54.204 2.434 10.337 171 HG SER 20 HG SER 20 56.405 3.826 10.489 172 H ASP 21 H ASP 21 55.434 0.727 7.740 173 HA ASP 21 HA ASP 21 57.535 0.187 6.824 174 HB2 ASP 21 1HB ASP 21 55.565 1.228 4.938 175 HB3 ASP 21 2HB ASP 21 57.213 1.145 4.321 176 H THR 22 H THR 22 58.840 1.948 8.248 177 HA THR 22 HA THR 22 59.306 4.307 6.617 178 HB THR 22 HB THR 22 61.364 4.128 8.542 179 HG1 THR 22 HG1 THR 22 59.886 2.323 9.262 180 HG21 THR 22 3HG2 THR 22 60.244 5.945 9.600 181 HG22 THR 22 1HG2 THR 22 58.674 5.427 8.992 182 HG23 THR 22 2HG2 THR 22 59.875 6.093 7.883 183 H ILE 23 H ILE 23 60.786 4.569 5.211 184 HA ILE 23 HA ILE 23 61.915 2.455 3.896 185 HB ILE 23 HB ILE 23 63.164 5.152 3.604 186 HG12 ILE 23 1HG1 ILE 23 60.249 4.436 3.128 187 HG13 ILE 23 2HG1 ILE 23 60.849 5.688 4.200 188 HG21 ILE 23 1HG2 ILE 23 62.311 2.867 1.861 189 HG22 ILE 23 2HG2 ILE 23 63.823 3.774 1.865 190 HG23 ILE 23 3HG2 ILE 23 62.376 4.484 1.166 191 HD11 ILE 23 3HD1 ILE 23 61.576 5.855 1.311 192 HD12 ILE 23 1HD1 ILE 23 61.311 7.146 2.480 193 HD13 ILE 23 2HD1 ILE 23 59.939 6.286 1.791 194 H GLU 24 H GLU 24 63.516 4.581 6.274 195 HA GLU 24 HA GLU 24 66.037 3.291 6.007 196 HB2 GLU 24 1HB GLU 24 66.412 4.048 8.384 197 HB3 GLU 24 2HB GLU 24 65.924 5.349 7.301 198 HG2 GLU 24 1HG GLU 24 64.429 5.778 8.987 199 HG3 GLU 24 2HG GLU 24 63.484 4.560 8.138 200 H ASN 25 H ASN 25 62.978 2.588 7.458 201 HA ASN 25 HA ASN 25 63.817 0.307 9.003 202 HB2 ASN 25 1HB ASN 25 61.651 1.936 9.122 203 HB3 ASN 25 2HB ASN 25 60.958 0.555 8.274 204 HD21 ASN 25 2HD2 ASN 25 62.858 -1.360 9.630 205 HD22 ASN 25 1HD2 ASN 25 62.276 -1.510 11.218 206 H VAL 26 H VAL 26 62.121 0.767 5.906 207 HA VAL 26 HA VAL 26 61.766 -2.025 5.448 208 HB VAL 26 HB VAL 26 61.772 0.138 3.345 209 HG11 VAL 26 1HG1 VAL 26 60.267 -2.486 3.602 210 HG12 VAL 26 2HG1 VAL 26 61.697 -2.238 2.600 211 HG13 VAL 26 3HG1 VAL 26 60.203 -1.379 2.230 212 HG21 VAL 26 3HG2 VAL 26 59.786 -0.540 5.497 213 HG22 VAL 26 1HG2 VAL 26 59.189 -0.039 3.916 214 HG23 VAL 26 2HG2 VAL 26 60.228 1.038 4.846 215 H LYS 27 H LYS 27 64.181 0.350 4.404 216 HA LYS 27 HA LYS 27 65.503 -1.186 2.504 217 HB2 LYS 27 1HB LYS 27 65.941 1.285 3.755 218 HB3 LYS 27 2HB LYS 27 67.381 0.352 4.116 219 HG2 LYS 27 1HG LYS 27 68.064 1.046 2.051 220 HG3 LYS 27 2HG LYS 27 67.035 -0.252 1.464 221 HD2 LYS 27 1HD LYS 27 66.345 2.681 1.730 222 HD3 LYS 27 2HD LYS 27 66.450 1.738 0.248 223 HE2 LYS 27 1HE LYS 27 64.572 0.285 1.325 224 HE3 LYS 27 2HE LYS 27 64.317 1.677 2.370 225 HZ1 LYS 27 3HZ LYS 27 62.913 1.914 0.495 226 HZ2 LYS 27 1HZ LYS 27 64.174 1.584 -0.588 227 HZ3 LYS 27 2HZ LYS 27 64.178 3.032 0.299 228 H ALA 28 H ALA 28 65.917 -1.158 6.021 229 HA ALA 28 HA ALA 28 68.080 -3.018 6.010 230 HB1 ALA 28 3HB ALA 28 66.613 -3.288 8.430 231 HB2 ALA 28 1HB ALA 28 66.535 -1.588 7.970 232 HB3 ALA 28 2HB ALA 28 68.099 -2.376 8.166 233 H LYS 29 H LYS 29 64.580 -3.244 6.022 234 HA LYS 29 HA LYS 29 64.413 -6.045 6.518 235 HB2 LYS 29 1HB LYS 29 62.583 -3.946 6.244 236 HB3 LYS 29 2HB LYS 29 62.234 -4.991 4.872 237 HG2 LYS 29 1HG LYS 29 61.915 -6.901 6.316 238 HG3 LYS 29 2HG LYS 29 62.494 -6.007 7.719 239 HD2 LYS 29 1HD LYS 29 60.004 -5.323 6.125 240 HD3 LYS 29 2HD LYS 29 60.018 -6.154 7.680 241 HE2 LYS 29 1HE LYS 29 60.539 -3.281 7.062 242 HE3 LYS 29 2HE LYS 29 59.720 -4.000 8.446 243 HZ1 LYS 29 3HZ LYS 29 61.952 -2.987 8.902 244 HZ2 LYS 29 1HZ LYS 29 62.638 -4.248 8.000 245 HZ3 LYS 29 2HZ LYS 29 61.766 -4.596 9.415 246 H ILE 30 H ILE 30 64.778 -4.040 3.636 247 HA ILE 30 HA ILE 30 64.342 -6.051 1.699 248 HB ILE 30 HB ILE 30 66.164 -3.633 1.524 249 HG12 ILE 30 1HG1 ILE 30 63.975 -2.816 2.024 250 HG13 ILE 30 2HG1 ILE 30 64.147 -2.668 0.284 251 HG21 ILE 30 1HG2 ILE 30 66.720 -4.970 -0.311 252 HG22 ILE 30 2HG2 ILE 30 65.454 -3.939 -0.972 253 HG23 ILE 30 3HG2 ILE 30 65.080 -5.592 -0.487 254 HD11 ILE 30 3HD1 ILE 30 62.547 -4.688 1.846 255 HD12 ILE 30 1HD1 ILE 30 63.043 -5.014 0.184 256 HD13 ILE 30 2HD1 ILE 30 62.015 -3.628 0.542 257 H GLN 31 H GLN 31 67.231 -5.038 3.453 258 HA GLN 31 HA GLN 31 69.073 -6.732 2.084 259 HB2 GLN 31 1HB GLN 31 69.653 -4.698 3.458 260 HB3 GLN 31 2HB GLN 31 69.306 -5.654 4.898 261 HG2 GLN 31 1HG GLN 31 70.977 -7.377 3.763 262 HG3 GLN 31 2HG GLN 31 71.554 -5.936 2.932 263 HE21 GLN 31 2HE2 GLN 31 71.210 -4.013 5.014 264 HE22 GLN 31 1HE2 GLN 31 72.266 -4.403 6.285 265 H ASP 32 H ASP 32 66.960 -7.161 4.851 266 HA ASP 32 HA ASP 32 68.123 -9.387 6.050 267 HB2 ASP 32 1HB ASP 32 66.327 -8.103 7.076 268 HB3 ASP 32 2HB ASP 32 65.198 -8.671 5.847 269 H LYS 33 H LYS 33 65.686 -9.353 3.417 270 HA LYS 33 HA LYS 33 65.305 -12.150 3.335 271 HB2 LYS 33 1HB LYS 33 64.963 -9.950 1.311 272 HB3 LYS 33 2HB LYS 33 64.716 -11.633 0.849 273 HG2 LYS 33 1HG LYS 33 62.560 -11.055 1.513 274 HG3 LYS 33 2HG LYS 33 63.201 -11.683 3.027 275 HD2 LYS 33 1HD LYS 33 63.974 -9.151 3.343 276 HD3 LYS 33 2HD LYS 33 62.641 -8.851 2.231 277 HE2 LYS 33 1HE LYS 33 62.577 -9.961 5.012 278 HE3 LYS 33 2HE LYS 33 61.508 -8.779 4.254 279 HZ1 LYS 33 3HZ LYS 33 61.330 -11.650 4.300 280 HZ2 LYS 33 1HZ LYS 33 61.121 -10.987 2.753 281 HZ3 LYS 33 2HZ LYS 33 60.120 -10.489 4.032 282 H GLU 34 H GLU 34 67.392 -10.080 1.351 283 HA GLU 34 HA GLU 34 69.291 -12.316 1.052 284 HB2 GLU 34 1HB GLU 34 67.873 -10.815 -1.105 285 HB3 GLU 34 2HB GLU 34 69.586 -11.147 -1.356 286 HG2 GLU 34 1HG GLU 34 69.271 -13.488 -1.236 287 HG3 GLU 34 2HG GLU 34 67.680 -13.322 -0.493 288 H GLY 35 H GLY 35 71.525 -11.513 0.658 289 HA2 GLY 35 1HA GLY 35 71.916 -9.034 2.086 290 HA3 GLY 35 2HA GLY 35 73.184 -10.055 1.409 291 H ILE 36 H ILE 36 71.584 -7.243 1.198 292 HA ILE 36 HA ILE 36 72.986 -6.450 -1.183 293 HB ILE 36 HB ILE 36 70.834 -5.338 -2.062 294 HG12 ILE 36 1HG1 ILE 36 69.690 -7.412 -0.168 295 HG13 ILE 36 2HG1 ILE 36 69.355 -5.683 -0.194 296 HG21 ILE 36 1HG2 ILE 36 70.858 -8.361 -2.206 297 HG22 ILE 36 2HG2 ILE 36 72.051 -7.364 -3.038 298 HG23 ILE 36 3HG2 ILE 36 70.344 -7.222 -3.450 299 HD11 ILE 36 3HD1 ILE 36 68.387 -5.980 -2.500 300 HD12 ILE 36 1HD1 ILE 36 67.489 -6.818 -1.236 301 HD13 ILE 36 2HD1 ILE 36 68.570 -7.722 -2.293 302 HA PRO 37 HA PRO 37 73.295 -3.432 2.035 303 HB2 PRO 37 1HB PRO 37 74.404 -1.498 0.225 304 HB3 PRO 37 2HB PRO 37 75.229 -2.431 1.477 305 HG2 PRO 37 1HG PRO 37 75.335 -2.771 -1.356 306 HG3 PRO 37 2HG PRO 37 76.201 -3.670 -0.104 307 HD2 PRO 37 1HD PRO 37 74.050 -4.601 -1.732 308 HD3 PRO 37 2HD PRO 37 74.851 -5.462 -0.399 309 HA PRO 38 HA PRO 38 69.437 -1.412 1.082 310 HB2 PRO 38 1HB PRO 38 69.723 0.375 3.326 311 HB3 PRO 38 2HB PRO 38 68.675 -1.043 3.169 312 HG2 PRO 38 1HG PRO 38 71.025 -0.764 4.728 313 HG3 PRO 38 2HG PRO 38 70.004 -2.192 4.535 314 HD2 PRO 38 1HD PRO 38 72.649 -1.741 3.477 315 HD3 PRO 38 2HD PRO 38 71.636 -3.194 3.339 316 H ASP 39 H ASP 39 72.349 0.455 1.846 317 HA ASP 39 HA ASP 39 71.477 2.970 0.945 318 HB2 ASP 39 1HB ASP 39 73.790 3.583 0.843 319 HB3 ASP 39 2HB ASP 39 73.618 2.472 2.201 320 H GLN 40 H GLN 40 71.807 0.117 -0.760 321 HA GLN 40 HA GLN 40 72.243 1.516 -3.333 322 HB2 GLN 40 1HB GLN 40 72.622 -1.373 -2.524 323 HB3 GLN 40 2HB GLN 40 72.654 -0.828 -4.200 324 HG2 GLN 40 1HG GLN 40 74.460 0.796 -3.576 325 HG3 GLN 40 2HG GLN 40 74.496 0.068 -1.970 326 HE21 GLN 40 2HE2 GLN 40 76.865 -0.331 -2.876 327 HE22 GLN 40 1HE2 GLN 40 77.096 -1.811 -3.677 328 H GLN 41 H GLN 41 69.902 0.035 -1.368 329 HA GLN 41 HA GLN 41 68.221 -0.898 -3.538 330 HB2 GLN 41 1HB GLN 41 67.822 -0.692 -0.557 331 HB3 GLN 41 2HB GLN 41 66.576 -1.281 -1.660 332 HG2 GLN 41 1HG GLN 41 69.372 -2.436 -1.526 333 HG3 GLN 41 2HG GLN 41 68.007 -3.093 -0.628 334 HE21 GLN 41 2HE2 GLN 41 65.929 -2.968 -2.469 335 HE22 GLN 41 1HE2 GLN 41 66.300 -3.910 -3.833 336 H ARG 42 H ARG 42 66.808 0.263 -4.621 337 HA ARG 42 HA ARG 42 65.735 2.752 -3.436 338 HB2 ARG 42 1HB ARG 42 66.478 2.395 -6.348 339 HB3 ARG 42 2HB ARG 42 65.950 3.879 -5.553 340 HG2 ARG 42 1HG ARG 42 67.962 3.962 -4.213 341 HG3 ARG 42 2HG ARG 42 68.461 2.367 -4.775 342 HD2 ARG 42 1HD ARG 42 68.095 3.795 -7.140 343 HD3 ARG 42 2HD ARG 42 68.815 4.978 -6.052 344 HE ARG 42 HE ARG 42 70.359 2.742 -5.708 345 HH11 ARG 42 1HH1 ARG 42 69.925 5.270 -7.934 346 HH12 ARG 42 2HH1 ARG 42 71.061 4.669 -9.096 347 HH21 ARG 42 1HH2 ARG 42 71.577 1.668 -7.431 348 HH22 ARG 42 2HH2 ARG 42 71.997 2.628 -8.810 349 H LEU 43 H LEU 43 63.541 2.824 -3.460 350 HA LEU 43 HA LEU 43 62.124 1.142 -5.437 351 HB2 LEU 43 1HB LEU 43 60.457 1.100 -3.232 352 HB3 LEU 43 2HB LEU 43 61.516 -0.213 -3.735 353 HG LEU 43 HG LEU 43 62.467 2.031 -1.943 354 HD11 LEU 43 1HD1 LEU 43 61.122 -0.584 -1.234 355 HD12 LEU 43 2HD1 LEU 43 60.677 1.043 -0.716 356 HD13 LEU 43 3HD1 LEU 43 62.147 0.293 -0.097 357 HD21 LEU 43 3HD2 LEU 43 63.683 -0.294 -3.186 358 HD22 LEU 43 1HD2 LEU 43 63.772 -0.433 -1.430 359 HD23 LEU 43 2HD2 LEU 43 64.445 0.980 -2.239 360 H ILE 44 H ILE 44 60.100 1.845 -6.096 361 HA ILE 44 HA ILE 44 59.286 4.570 -5.281 362 HB ILE 44 HB ILE 44 59.494 3.467 -8.095 363 HG12 ILE 44 1HG1 ILE 44 60.721 5.997 -6.990 364 HG13 ILE 44 2HG1 ILE 44 61.549 4.446 -6.856 365 HG21 ILE 44 1HG2 ILE 44 57.467 4.719 -8.025 366 HG22 ILE 44 2HG2 ILE 44 58.679 5.821 -8.679 367 HG23 ILE 44 3HG2 ILE 44 58.182 5.957 -6.992 368 HD11 ILE 44 3HD1 ILE 44 62.271 5.636 -8.886 369 HD12 ILE 44 1HD1 ILE 44 60.598 5.725 -9.436 370 HD13 ILE 44 2HD1 ILE 44 61.402 4.161 -9.308 371 H PHE 45 H PHE 45 57.049 4.893 -5.178 372 HA PHE 45 HA PHE 45 55.382 2.494 -5.707 373 HB2 PHE 45 1HB PHE 45 55.448 2.722 -3.353 374 HB3 PHE 45 2HB PHE 45 55.314 4.475 -3.435 375 HD1 PHE 45 HD1 PHE 45 53.466 1.304 -4.108 376 HD2 PHE 45 HD2 PHE 45 53.195 5.542 -3.468 377 HE1 PHE 45 HE1 PHE 45 50.994 1.127 -3.968 378 HE2 PHE 45 HE2 PHE 45 50.724 5.365 -3.330 379 HZ PHE 45 HZ PHE 45 49.626 3.157 -3.579 380 H ALA 46 H ALA 46 54.061 2.825 -7.374 381 HA ALA 46 HA ALA 46 52.744 3.903 -8.934 382 HB1 ALA 46 3HB ALA 46 50.978 5.350 -7.865 383 HB2 ALA 46 1HB ALA 46 51.818 5.125 -6.331 384 HB3 ALA 46 2HB ALA 46 51.131 3.736 -7.173 385 H GLY 47 H GLY 47 55.322 5.077 -8.713 386 HA2 GLY 47 1HA GLY 47 56.231 6.911 -9.873 387 HA3 GLY 47 2HA GLY 47 54.692 7.752 -9.713 388 H LYS 48 H LYS 48 54.748 6.941 -6.744 389 HA LYS 48 HA LYS 48 56.079 9.348 -5.833 390 HB2 LYS 48 1HB LYS 48 54.399 7.227 -4.531 391 HB3 LYS 48 2HB LYS 48 55.370 8.299 -3.531 392 HG2 LYS 48 1HG LYS 48 54.275 10.248 -4.408 393 HG3 LYS 48 2HG LYS 48 53.460 9.299 -5.651 394 HD2 LYS 48 1HD LYS 48 51.909 8.434 -4.178 395 HD3 LYS 48 2HD LYS 48 53.023 8.479 -2.812 396 HE2 LYS 48 1HE LYS 48 52.036 11.044 -4.043 397 HE3 LYS 48 2HE LYS 48 51.043 10.179 -2.869 398 HZ1 LYS 48 3HZ LYS 48 53.663 11.457 -2.502 399 HZ2 LYS 48 1HZ LYS 48 53.239 10.142 -1.519 400 HZ3 LYS 48 2HZ LYS 48 52.276 11.541 -1.525 401 H GLN 49 H GLN 49 58.178 9.419 -5.435 402 HA GLN 49 HA GLN 49 59.751 7.028 -5.193 403 HB2 GLN 49 1HB GLN 49 61.650 8.492 -5.133 404 HB3 GLN 49 2HB GLN 49 60.517 9.154 -6.310 405 HG2 GLN 49 1HG GLN 49 59.604 10.539 -4.289 406 HG3 GLN 49 2HG GLN 49 61.149 10.143 -3.538 407 HE21 GLN 49 2HE2 GLN 49 63.030 11.243 -4.291 408 HE22 GLN 49 1HE2 GLN 49 62.985 12.421 -5.513 409 H LEU 50 H LEU 50 60.108 5.911 -3.386 410 HA LEU 50 HA LEU 50 59.387 7.009 -0.807 411 HB2 LEU 50 1HB LEU 50 60.677 4.361 -1.557 412 HB3 LEU 50 2HB LEU 50 60.105 4.784 0.055 413 HG LEU 50 HG LEU 50 58.314 4.841 -2.389 414 HD11 LEU 50 1HD1 LEU 50 58.479 2.636 -0.320 415 HD12 LEU 50 2HD1 LEU 50 59.265 2.548 -1.896 416 HD13 LEU 50 3HD1 LEU 50 57.508 2.656 -1.791 417 HD21 LEU 50 3HD2 LEU 50 57.988 5.762 0.282 418 HD22 LEU 50 1HD2 LEU 50 57.012 4.303 0.126 419 HD23 LEU 50 2HD2 LEU 50 56.765 5.646 -0.979 420 H GLU 51 H GLU 51 60.688 8.074 0.501 421 HA GLU 51 HA GLU 51 63.387 8.658 -0.362 422 HB2 GLU 51 1HB GLU 51 61.890 9.853 1.955 423 HB3 GLU 51 2HB GLU 51 63.265 10.534 1.087 424 HG2 GLU 51 1HG GLU 51 61.897 10.589 -0.989 425 HG3 GLU 51 2HG GLU 51 60.516 9.993 -0.070 426 H ASP 52 H ASP 52 64.597 9.552 1.685 427 HA ASP 52 HA ASP 52 66.270 7.655 2.663 428 HB2 ASP 52 1HB ASP 52 66.459 10.207 2.655 429 HB3 ASP 52 2HB ASP 52 65.647 10.144 4.218 430 H GLY 53 H GLY 53 63.133 7.527 3.545 431 HA2 GLY 53 1HA GLY 53 62.635 5.801 5.286 432 HA3 GLY 53 2HA GLY 53 63.820 6.611 6.280 433 H ARG 54 H ARG 54 61.288 7.928 4.240 434 HA ARG 54 HA ARG 54 60.174 9.505 6.443 435 HB2 ARG 54 1HB ARG 54 59.927 9.437 3.488 436 HB3 ARG 54 2HB ARG 54 58.374 9.590 4.307 437 HG2 ARG 54 1HG ARG 54 59.318 11.810 3.845 438 HG3 ARG 54 2HG ARG 54 59.241 11.524 5.583 439 HD2 ARG 54 1HD ARG 54 61.538 11.330 5.792 440 HD3 ARG 54 2HD ARG 54 61.746 10.754 4.140 441 HE ARG 54 HE ARG 54 60.827 13.474 4.226 442 HH11 ARG 54 1HH1 ARG 54 62.993 12.015 2.480 443 HH12 ARG 54 2HH1 ARG 54 64.391 12.951 2.893 444 HH21 ARG 54 1HH2 ARG 54 62.899 14.451 5.643 445 HH22 ARG 54 2HH2 ARG 54 64.337 14.330 4.684 446 H THR 55 H THR 55 57.748 8.953 7.007 447 HA THR 55 HA THR 55 57.638 6.056 7.105 448 HB THR 55 HB THR 55 55.739 8.205 8.034 449 HG1 THR 55 HG1 THR 55 57.417 8.105 9.383 450 HG21 THR 55 3HG2 THR 55 54.590 6.336 9.236 451 HG22 THR 55 1HG2 THR 55 55.560 5.204 8.303 452 HG23 THR 55 2HG2 THR 55 54.406 6.254 7.485 453 H LEU 56 H LEU 56 56.376 4.720 6.022 454 HA LEU 56 HA LEU 56 55.283 5.613 3.543 455 HB2 LEU 56 1HB LEU 56 56.172 3.131 4.658 456 HB3 LEU 56 2HB LEU 56 54.645 2.920 3.807 457 HG LEU 56 HG LEU 56 55.586 4.044 1.827 458 HD11 LEU 56 1HD1 LEU 56 58.258 4.266 2.054 459 HD12 LEU 56 2HD1 LEU 56 57.821 4.577 3.734 460 HD13 LEU 56 3HD1 LEU 56 57.173 5.596 2.450 461 HD21 LEU 56 3HD2 LEU 56 56.195 1.501 2.631 462 HD22 LEU 56 1HD2 LEU 56 57.805 2.158 2.358 463 HD23 LEU 56 2HD2 LEU 56 56.615 2.161 1.060 464 H SER 57 H SER 57 53.912 4.727 6.641 465 HA SER 57 HA SER 57 51.296 4.163 5.811 466 HB2 SER 57 1HB SER 57 51.667 3.870 8.130 467 HB3 SER 57 2HB SER 57 52.380 5.472 8.307 468 HG SER 57 HG SER 57 50.433 6.047 8.838 469 H ASP 58 H ASP 58 53.134 7.082 6.048 470 HA ASP 58 HA ASP 58 50.964 8.914 5.595 471 HB2 ASP 58 1HB ASP 58 53.170 9.552 6.636 472 HB3 ASP 58 2HB ASP 58 53.920 9.320 5.057 473 H TYR 59 H TYR 59 53.083 6.910 3.725 474 HA TYR 59 HA TYR 59 52.528 8.152 1.170 475 HB2 TYR 59 1HB TYR 59 54.052 5.763 2.119 476 HB3 TYR 59 2HB TYR 59 53.549 5.812 0.437 477 HD1 TYR 59 HD1 TYR 59 55.136 7.947 3.041 478 HD2 TYR 59 HD2 TYR 59 54.850 6.941 -1.111 479 HE1 TYR 59 HE1 TYR 59 56.991 9.518 2.539 480 HE2 TYR 59 HE2 TYR 59 56.704 8.506 -1.624 481 HH TYR 59 HH TYR 59 58.827 9.506 0.241 482 H ASN 60 H ASN 60 50.812 6.290 3.290 483 HA ASN 60 HA ASN 60 48.861 5.107 3.151 484 HB2 ASN 60 1HB ASN 60 48.521 7.179 1.495 485 HB3 ASN 60 2HB ASN 60 48.442 5.884 0.302 486 HD21 ASN 60 2HD2 ASN 60 46.958 3.928 1.196 487 HD22 ASN 60 1HD2 ASN 60 45.481 4.426 1.868 488 H ILE 61 H ILE 61 51.165 3.613 2.694 489 HA ILE 61 HA ILE 61 51.053 2.155 0.268 490 HB ILE 61 HB ILE 61 52.211 1.321 2.930 491 HG12 ILE 61 1HG1 ILE 61 53.282 3.323 2.046 492 HG13 ILE 61 2HG1 ILE 61 54.346 1.946 1.802 493 HG21 ILE 61 1HG2 ILE 61 52.373 0.138 0.152 494 HG22 ILE 61 2HG2 ILE 61 51.868 -0.661 1.641 495 HG23 ILE 61 3HG2 ILE 61 53.558 -0.220 1.405 496 HD11 ILE 61 3HD1 ILE 61 52.788 3.504 -0.222 497 HD12 ILE 61 1HD1 ILE 61 53.138 1.803 -0.542 498 HD13 ILE 61 2HD1 ILE 61 54.457 2.943 -0.287 499 H GLN 62 H GLN 62 50.057 0.461 -0.342 500 HA GLN 62 HA GLN 62 47.723 -0.400 1.164 501 HB2 GLN 62 1HB GLN 62 47.043 -1.353 -1.065 502 HB3 GLN 62 2HB GLN 62 47.239 0.398 -1.012 503 HG2 GLN 62 1HG GLN 62 49.579 0.089 -1.887 504 HG3 GLN 62 2HG GLN 62 49.215 -1.622 -2.105 505 HE21 GLN 62 2HE2 GLN 62 46.664 -1.629 -3.160 506 HE22 GLN 62 1HE2 GLN 62 46.619 -0.756 -4.617 507 H LYS 63 H LYS 63 47.000 -2.571 0.178 508 HA LYS 63 HA LYS 63 47.858 -4.642 1.630 509 HB2 LYS 63 1HB LYS 63 46.779 -6.116 -0.058 510 HB3 LYS 63 2HB LYS 63 45.799 -4.736 0.434 511 HG2 LYS 63 1HG LYS 63 46.000 -3.680 -1.609 512 HG3 LYS 63 2HG LYS 63 47.591 -4.370 -1.931 513 HD2 LYS 63 1HD LYS 63 46.705 -6.423 -2.651 514 HD3 LYS 63 2HD LYS 63 45.163 -6.151 -1.837 515 HE2 LYS 63 1HE LYS 63 45.781 -4.099 -3.857 516 HE3 LYS 63 2HE LYS 63 45.630 -5.723 -4.529 517 HZ1 LYS 63 3HZ LYS 63 43.451 -5.568 -4.320 518 HZ2 LYS 63 1HZ LYS 63 43.594 -4.011 -3.662 519 HZ3 LYS 63 2HZ LYS 63 43.603 -5.369 -2.640 520 H GLU 64 H GLU 64 50.293 -3.432 0.267 521 HA GLU 64 HA GLU 64 52.363 -4.417 -0.111 522 HB2 GLU 64 1HB GLU 64 52.701 -6.693 -0.177 523 HB3 GLU 64 2HB GLU 64 51.165 -6.616 0.676 524 HG2 GLU 64 1HG GLU 64 50.281 -6.722 -1.918 525 HG3 GLU 64 2HG GLU 64 51.768 -7.651 -2.043 526 H SER 65 H SER 65 51.438 -2.748 -1.708 527 HA SER 65 HA SER 65 51.034 -3.368 -4.426 528 HB2 SER 65 1HB SER 65 51.418 -1.047 -2.772 529 HB3 SER 65 2HB SER 65 52.376 -0.900 -4.242 530 HG SER 65 HG SER 65 49.716 -1.813 -4.347 531 H THR 66 H THR 66 52.493 -3.048 -6.200 532 HA THR 66 HA THR 66 55.163 -4.110 -5.715 533 HB THR 66 HB THR 66 55.241 -3.769 -8.313 534 HG1 THR 66 HG1 THR 66 53.192 -2.457 -7.993 535 HG21 THR 66 3HG2 THR 66 54.020 -5.878 -8.634 536 HG22 THR 66 1HG2 THR 66 53.290 -5.702 -7.039 537 HG23 THR 66 2HG2 THR 66 55.032 -5.946 -7.192 538 H LEU 67 H LEU 67 57.005 -2.913 -5.669 539 HA LEU 67 HA LEU 67 56.745 -0.013 -6.074 540 HB2 LEU 67 1HB LEU 67 59.136 -1.467 -4.937 541 HB3 LEU 67 2HB LEU 67 58.704 0.233 -4.747 542 HG LEU 67 HG LEU 67 57.110 -2.114 -3.669 543 HD11 LEU 67 1HD1 LEU 67 57.936 -1.544 -1.518 544 HD12 LEU 67 2HD1 LEU 67 58.591 -0.008 -2.089 545 HD13 LEU 67 3HD1 LEU 67 59.357 -1.524 -2.563 546 HD21 LEU 67 3HD2 LEU 67 56.716 0.878 -3.642 547 HD22 LEU 67 1HD2 LEU 67 55.992 -0.149 -2.405 548 HD23 LEU 67 2HD2 LEU 67 55.562 -0.375 -4.100 549 H HIS 68 H HIS 68 57.981 1.134 -7.526 550 HA HIS 68 HA HIS 68 59.070 -0.398 -9.749 551 HB2 HIS 68 1HB HIS 68 57.924 2.249 -9.353 552 HB3 HIS 68 2HB HIS 68 59.419 2.332 -10.283 553 HD1 HIS 68 HD1 HIS 68 56.704 -0.353 -10.327 554 HD2 HIS 68 HD2 HIS 68 58.525 2.373 -12.903 555 HE1 HIS 68 HE1 HIS 68 55.754 -0.799 -12.631 556 H LEU 69 H LEU 69 61.150 -0.581 -10.302 557 HA LEU 69 HA LEU 69 63.168 0.930 -8.743 558 HB2 LEU 69 1HB LEU 69 63.345 -1.922 -9.750 559 HB3 LEU 69 2HB LEU 69 64.646 -1.036 -8.958 560 HG LEU 69 HG LEU 69 62.532 -0.694 -7.192 561 HD11 LEU 69 1HD1 LEU 69 61.431 -2.791 -6.899 562 HD12 LEU 69 2HD1 LEU 69 62.506 -3.594 -8.042 563 HD13 LEU 69 3HD1 LEU 69 61.315 -2.431 -8.622 564 HD21 LEU 69 3HD2 LEU 69 64.909 -1.268 -6.674 565 HD22 LEU 69 1HD2 LEU 69 64.587 -2.931 -7.167 566 HD23 LEU 69 2HD2 LEU 69 63.765 -2.251 -5.762 567 H VAL 70 H VAL 70 65.319 1.001 -9.919 568 HA VAL 70 HA VAL 70 64.865 1.334 -12.831 569 HB VAL 70 HB VAL 70 66.972 2.981 -12.336 570 HG11 VAL 70 1HG1 VAL 70 63.999 3.515 -12.214 571 HG12 VAL 70 2HG1 VAL 70 65.086 3.726 -13.587 572 HG13 VAL 70 3HG1 VAL 70 65.190 4.816 -12.204 573 HG21 VAL 70 3HG2 VAL 70 66.579 4.203 -10.272 574 HG22 VAL 70 1HG2 VAL 70 66.769 2.495 -9.876 575 HG23 VAL 70 2HG2 VAL 70 65.161 3.218 -9.912 576 H LEU 71 H LEU 71 66.914 1.218 -14.106 577 HA LEU 71 HA LEU 71 68.895 0.200 -14.711 578 HB2 LEU 71 1HB LEU 71 69.512 0.718 -12.228 579 HB3 LEU 71 2HB LEU 71 69.179 -0.993 -11.964 580 HG LEU 71 HG LEU 71 70.748 -1.444 -13.946 581 HD11 LEU 71 1HD1 LEU 71 70.729 1.381 -14.067 582 HD12 LEU 71 2HD1 LEU 71 71.752 0.283 -14.991 583 HD13 LEU 71 3HD1 LEU 71 72.325 0.944 -13.461 584 HD21 LEU 71 3HD2 LEU 71 71.436 -1.972 -11.695 585 HD22 LEU 71 1HD2 LEU 71 71.734 -0.273 -11.330 586 HD23 LEU 71 2HD2 LEU 71 72.781 -1.127 -12.463 587 H ARG 72 H ARG 72 68.745 -1.498 -16.002 588 HA ARG 72 HA ARG 72 66.822 -3.532 -15.722 589 HB2 ARG 72 1HB ARG 72 69.307 -3.276 -17.410 590 HB3 ARG 72 2HB ARG 72 68.264 -4.694 -17.499 591 HG2 ARG 72 1HG ARG 72 66.883 -2.062 -17.641 592 HG3 ARG 72 2HG ARG 72 67.892 -2.475 -19.027 593 HD2 ARG 72 1HD ARG 72 65.623 -3.282 -19.407 594 HD3 ARG 72 2HD ARG 72 66.707 -4.654 -19.207 595 HE ARG 72 HE ARG 72 65.403 -3.789 -16.764 596 HH11 ARG 72 1HH2 ARG 72 66.296 -6.624 -17.597 597 HH12 ARG 72 2HH2 ARG 72 64.761 -7.408 -17.778 598 HH21 ARG 72 1HH1 ARG 72 62.960 -4.449 -17.855 599 HH22 ARG 72 2HH1 ARG 72 62.876 -6.178 -17.923 Start of MODEL 4 1 H1 MET 1 1H MET 1 48.392 -2.549 4.728 2 H2 MET 1 2H MET 1 49.885 -2.743 3.942 3 H3 MET 1 3H MET 1 49.726 -1.613 5.201 4 HA MET 1 HA MET 1 49.943 -3.133 6.811 5 HB2 MET 1 1HB MET 1 47.734 -4.153 5.815 6 HB3 MET 1 2HB MET 1 48.813 -5.367 5.134 7 HG2 MET 1 1HG MET 1 48.439 -6.387 7.157 8 HG3 MET 1 2HG MET 1 49.749 -5.327 7.671 9 HE1 MET 1 3HE MET 1 49.518 -3.227 9.090 10 HE2 MET 1 1HE MET 1 49.450 -4.761 9.970 11 HE3 MET 1 2HE MET 1 48.387 -3.432 10.425 12 H GLN 2 H GLN 2 50.158 -5.383 4.080 13 HA GLN 2 HA GLN 2 52.972 -5.887 4.712 14 HB2 GLN 2 1HB GLN 2 50.795 -7.321 3.279 15 HB3 GLN 2 2HB GLN 2 52.432 -7.587 2.677 16 HG2 GLN 2 1HG GLN 2 51.866 -9.249 4.395 17 HG3 GLN 2 2HG GLN 2 53.156 -8.193 4.969 18 HE21 GLN 2 2HE2 GLN 2 52.672 -6.723 6.719 19 HE22 GLN 2 1HE2 GLN 2 51.213 -6.802 7.583 20 H ILE 3 H ILE 3 54.498 -6.103 2.831 21 HA ILE 3 HA ILE 3 53.862 -4.177 0.691 22 HB ILE 3 HB ILE 3 56.298 -4.218 2.452 23 HG12 ILE 3 1HG1 ILE 3 54.033 -2.391 1.790 24 HG13 ILE 3 2HG1 ILE 3 54.909 -2.588 3.300 25 HG21 ILE 3 1HG2 ILE 3 57.039 -4.283 0.062 26 HG22 ILE 3 2HG2 ILE 3 57.414 -2.748 0.831 27 HG23 ILE 3 3HG2 ILE 3 56.034 -2.870 -0.262 28 HD11 ILE 3 3HD1 ILE 3 55.731 -1.003 0.863 29 HD12 ILE 3 1HD1 ILE 3 56.867 -1.416 2.148 30 HD13 ILE 3 2HD1 ILE 3 55.458 -0.421 2.501 31 H PHE 4 H PHE 4 54.410 -4.705 -1.254 32 HA PHE 4 HA PHE 4 55.746 -7.307 -1.672 33 HB2 PHE 4 1HB PHE 4 53.548 -5.810 -3.047 34 HB3 PHE 4 2HB PHE 4 54.536 -6.916 -3.988 35 HD1 PHE 4 HD2 PHE 4 54.009 -7.698 -0.432 36 HD2 PHE 4 HD1 PHE 4 52.519 -8.268 -4.419 37 HE1 PHE 4 HE2 PHE 4 52.658 -9.612 0.352 38 HE2 PHE 4 HE1 PHE 4 51.162 -10.186 -3.630 39 HZ PHE 4 HZ PHE 4 51.233 -10.858 -1.245 40 H VAL 5 H VAL 5 57.417 -7.469 -3.109 41 HA VAL 5 HA VAL 5 58.297 -5.015 -4.492 42 HB VAL 5 HB VAL 5 60.450 -6.806 -3.525 43 HG11 VAL 5 1HG1 VAL 5 60.691 -4.583 -4.741 44 HG12 VAL 5 2HG1 VAL 5 61.601 -4.724 -3.236 45 HG13 VAL 5 3HG1 VAL 5 60.093 -3.811 -3.272 46 HG21 VAL 5 3HG2 VAL 5 60.379 -5.795 -1.241 47 HG22 VAL 5 1HG2 VAL 5 59.003 -6.849 -1.556 48 HG23 VAL 5 2HG2 VAL 5 58.805 -5.099 -1.630 49 H LYS 6 H LYS 6 58.925 -5.327 -6.572 50 HA LYS 6 HA LYS 6 58.753 -8.085 -7.593 51 HB2 LYS 6 1HB LYS 6 57.358 -6.082 -8.509 52 HB3 LYS 6 2HB LYS 6 58.855 -5.631 -9.325 53 HG2 LYS 6 1HG LYS 6 58.967 -7.931 -10.296 54 HG3 LYS 6 2HG LYS 6 57.397 -8.278 -9.570 55 HD2 LYS 6 1HD LYS 6 56.627 -6.105 -10.813 56 HD3 LYS 6 2HD LYS 6 58.066 -6.369 -11.798 57 HE2 LYS 6 1HE LYS 6 55.632 -8.115 -11.512 58 HE3 LYS 6 2HE LYS 6 56.419 -7.545 -12.982 59 HZ1 LYS 6 3HZ LYS 6 56.851 -9.941 -11.618 60 HZ2 LYS 6 1HZ LYS 6 58.272 -9.025 -11.489 61 HZ3 LYS 6 2HZ LYS 6 57.626 -9.378 -13.020 62 H THR 7 H THR 7 60.544 -9.133 -8.108 63 HA THR 7 HA THR 7 63.062 -7.639 -8.388 64 HB THR 7 HB THR 7 64.148 -9.804 -8.062 65 HG1 THR 7 HG1 THR 7 63.070 -11.530 -8.497 66 HG21 THR 7 3HG2 THR 7 61.904 -9.189 -6.125 67 HG22 THR 7 1HG2 THR 7 63.570 -8.619 -6.040 68 HG23 THR 7 2HG2 THR 7 63.208 -10.325 -5.781 69 H LEU 8 H LEU 8 64.480 -8.018 -10.136 70 HA LEU 8 HA LEU 8 63.185 -8.317 -12.667 71 HB2 LEU 8 1HB LEU 8 65.566 -8.211 -13.542 72 HB3 LEU 8 2HB LEU 8 65.042 -6.826 -12.585 73 HG LEU 8 HG LEU 8 66.238 -9.014 -10.992 74 HD11 LEU 8 1HD1 LEU 8 67.840 -7.514 -13.076 75 HD12 LEU 8 2HD1 LEU 8 67.742 -9.259 -12.838 76 HD13 LEU 8 3HD1 LEU 8 68.576 -8.254 -11.654 77 HD21 LEU 8 3HD2 LEU 8 67.275 -7.158 -9.841 78 HD22 LEU 8 1HD2 LEU 8 65.608 -6.698 -10.185 79 HD23 LEU 8 2HD2 LEU 8 66.919 -6.064 -11.178 80 H THR 9 H THR 9 64.361 -10.540 -10.429 81 HA THR 9 HA THR 9 65.081 -12.566 -12.415 82 HB THR 9 HB THR 9 64.939 -13.441 -9.621 83 HG1 THR 9 HG1 THR 9 66.731 -12.094 -9.032 84 HG21 THR 9 3HG2 THR 9 66.175 -14.559 -11.497 85 HG22 THR 9 1HG2 THR 9 67.192 -14.197 -10.102 86 HG23 THR 9 2HG2 THR 9 67.271 -13.179 -11.539 87 H GLY 10 H GLY 10 62.266 -11.389 -11.283 88 HA2 GLY 10 1HA GLY 10 60.106 -12.199 -11.436 89 HA3 GLY 10 2HA GLY 10 60.769 -13.706 -12.063 90 H LYS 11 H LYS 11 62.168 -12.676 -9.133 91 HA LYS 11 HA LYS 11 60.829 -14.850 -7.689 92 HB2 LYS 11 1HB LYS 11 63.351 -14.574 -7.709 93 HB3 LYS 11 2HB LYS 11 63.121 -13.121 -6.737 94 HG2 LYS 11 1HG LYS 11 61.722 -14.636 -5.168 95 HG3 LYS 11 2HG LYS 11 62.486 -15.981 -6.017 96 HD2 LYS 11 1HD LYS 11 64.720 -14.787 -5.513 97 HD3 LYS 11 2HD LYS 11 63.798 -13.832 -4.353 98 HE2 LYS 11 1HE LYS 11 64.286 -16.809 -4.354 99 HE3 LYS 11 2HE LYS 11 64.621 -15.644 -3.074 100 HZ1 LYS 11 3HZ LYS 11 61.853 -15.943 -3.979 101 HZ2 LYS 11 1HZ LYS 11 62.454 -15.575 -2.436 102 HZ3 LYS 11 2HZ LYS 11 62.508 -17.173 -3.008 103 H THR 12 H THR 12 59.278 -14.495 -6.226 104 HA THR 12 HA THR 12 58.517 -11.755 -5.598 105 HB THR 12 HB THR 12 57.259 -14.433 -4.979 106 HG1 THR 12 HG1 THR 12 55.998 -13.939 -6.616 107 HG21 THR 12 3HG2 THR 12 56.518 -11.640 -4.108 108 HG22 THR 12 1HG2 THR 12 56.657 -13.095 -3.121 109 HG23 THR 12 2HG2 THR 12 55.308 -12.917 -4.245 110 H ILE 13 H ILE 13 59.403 -10.735 -3.954 111 HA ILE 13 HA ILE 13 60.252 -12.277 -1.573 112 HB ILE 13 HB ILE 13 62.027 -11.059 -2.889 113 HG12 ILE 13 1HG1 ILE 13 61.580 -9.990 -0.085 114 HG13 ILE 13 2HG1 ILE 13 62.188 -11.609 -0.434 115 HG21 ILE 13 1HG2 ILE 13 60.947 -8.521 -1.698 116 HG22 ILE 13 2HG2 ILE 13 60.322 -9.085 -3.249 117 HG23 ILE 13 3HG2 ILE 13 62.041 -8.735 -3.065 118 HD11 ILE 13 3HD1 ILE 13 63.724 -9.763 -1.984 119 HD12 ILE 13 1HD1 ILE 13 64.265 -10.776 -0.645 120 HD13 ILE 13 2HD1 ILE 13 63.654 -9.151 -0.333 121 H THR 14 H THR 14 58.934 -12.046 0.110 122 HA THR 14 HA THR 14 57.286 -9.603 0.314 123 HB THR 14 HB THR 14 56.757 -12.037 1.970 124 HG1 THR 14 HG1 THR 14 56.712 -13.152 0.193 125 HG21 THR 14 3HG2 THR 14 54.838 -10.295 0.429 126 HG22 THR 14 1HG2 THR 14 55.468 -9.801 2.001 127 HG23 THR 14 2HG2 THR 14 54.518 -11.281 1.854 128 H LEU 15 H LEU 15 57.343 -8.324 2.082 129 HA LEU 15 HA LEU 15 59.235 -9.051 4.245 130 HB2 LEU 15 1HB LEU 15 58.742 -6.236 4.243 131 HB3 LEU 15 2HB LEU 15 60.257 -7.071 3.904 132 HG LEU 15 HG LEU 15 58.089 -6.665 1.828 133 HD11 LEU 15 1HD1 LEU 15 58.765 -4.460 2.318 134 HD12 LEU 15 2HD1 LEU 15 59.813 -4.919 0.977 135 HD13 LEU 15 3HD1 LEU 15 60.433 -4.942 2.629 136 HD21 LEU 15 3HD2 LEU 15 59.437 -7.884 0.479 137 HD22 LEU 15 1HD2 LEU 15 60.382 -8.303 1.906 138 HD23 LEU 15 2HD2 LEU 15 60.846 -6.920 0.915 139 H GLU 16 H GLU 16 58.583 -8.686 6.365 140 HA GLU 16 HA GLU 16 55.674 -8.325 6.664 141 HB2 GLU 16 1HB GLU 16 56.141 -9.070 9.034 142 HB3 GLU 16 2HB GLU 16 56.522 -10.278 7.808 143 HG2 GLU 16 1HG GLU 16 58.648 -10.364 8.561 144 HG3 GLU 16 2HG GLU 16 58.856 -8.664 8.151 145 H VAL 17 H VAL 17 55.142 -6.269 6.827 146 HA VAL 17 HA VAL 17 56.536 -4.596 8.784 147 HB VAL 17 HB VAL 17 57.692 -4.219 6.641 148 HG11 VAL 17 1HG1 VAL 17 55.644 -4.838 5.263 149 HG12 VAL 17 2HG1 VAL 17 56.516 -3.408 4.711 150 HG13 VAL 17 3HG1 VAL 17 55.015 -3.231 5.622 151 HG21 VAL 17 3HG2 VAL 17 57.003 -2.345 8.363 152 HG22 VAL 17 1HG2 VAL 17 55.952 -1.808 7.058 153 HG23 VAL 17 2HG2 VAL 17 57.688 -1.897 6.807 154 H GLU 18 H GLU 18 55.499 -2.449 8.916 155 HA GLU 18 HA GLU 18 52.573 -2.705 8.923 156 HB2 GLU 18 1HB GLU 18 53.197 -0.292 10.119 157 HB3 GLU 18 2HB GLU 18 52.993 -1.811 10.994 158 HG2 GLU 18 1HG GLU 18 55.350 -2.255 10.954 159 HG3 GLU 18 2HG GLU 18 55.640 -0.957 9.800 160 HA PRO 19 HA PRO 19 52.413 0.132 5.587 161 HB2 PRO 19 1HB PRO 19 50.454 1.979 6.621 162 HB3 PRO 19 2HB PRO 19 50.218 0.643 5.481 163 HG2 PRO 19 1HG PRO 19 49.237 0.699 8.040 164 HG3 PRO 19 2HG PRO 19 49.528 -0.775 7.101 165 HD2 PRO 19 1HD PRO 19 51.215 0.460 9.244 166 HD3 PRO 19 2HD PRO 19 50.896 -1.257 8.903 167 H SER 20 H SER 20 53.477 1.307 8.633 168 HA SER 20 HA SER 20 53.897 4.005 7.660 169 HB2 SER 20 1HB SER 20 55.520 2.846 9.898 170 HB3 SER 20 2HB SER 20 54.857 4.469 9.728 171 HG SER 20 HG SER 20 53.542 3.510 11.169 172 H ASP 21 H ASP 21 55.428 0.897 7.663 173 HA ASP 21 HA ASP 21 57.538 0.309 6.821 174 HB2 ASP 21 1HB ASP 21 55.621 1.291 4.860 175 HB3 ASP 21 2HB ASP 21 57.285 1.254 4.278 176 H THR 22 H THR 22 58.848 2.067 8.239 177 HA THR 22 HA THR 22 59.344 4.411 6.602 178 HB THR 22 HB THR 22 61.406 4.013 8.590 179 HG1 THR 22 HG1 THR 22 59.872 3.965 10.380 180 HG21 THR 22 3HG2 THR 22 59.019 5.832 8.856 181 HG22 THR 22 1HG2 THR 22 60.284 6.155 7.670 182 HG23 THR 22 2HG2 THR 22 60.678 6.104 9.386 183 H ILE 23 H ILE 23 60.799 4.637 5.174 184 HA ILE 23 HA ILE 23 61.903 2.484 3.906 185 HB ILE 23 HB ILE 23 63.205 5.126 3.484 186 HG12 ILE 23 1HG1 ILE 23 60.222 4.556 3.239 187 HG13 ILE 23 2HG1 ILE 23 60.968 5.834 4.185 188 HG21 ILE 23 1HG2 ILE 23 61.642 3.699 1.400 189 HG22 ILE 23 2HG2 ILE 23 63.020 2.817 2.042 190 HG23 ILE 23 3HG2 ILE 23 63.256 4.396 1.306 191 HD11 ILE 23 3HD1 ILE 23 61.565 5.839 1.274 192 HD12 ILE 23 1HD1 ILE 23 61.281 7.185 2.375 193 HD13 ILE 23 2HD1 ILE 23 59.924 6.257 1.748 194 H GLU 24 H GLU 24 63.461 4.612 6.287 195 HA GLU 24 HA GLU 24 66.015 3.378 6.036 196 HB2 GLU 24 1HB GLU 24 66.399 4.160 8.363 197 HB3 GLU 24 2HB GLU 24 65.735 5.449 7.360 198 HG2 GLU 24 1HG GLU 24 63.503 5.051 8.257 199 HG3 GLU 24 2HG GLU 24 64.088 3.670 9.183 200 H ASN 25 H ASN 25 62.951 2.615 7.449 201 HA ASN 25 HA ASN 25 63.816 0.332 8.976 202 HB2 ASN 25 1HB ASN 25 61.709 1.872 9.301 203 HB3 ASN 25 2HB ASN 25 60.960 0.748 8.172 204 HD21 ASN 25 2HD2 ASN 25 62.870 -1.427 9.270 205 HD22 ASN 25 1HD2 ASN 25 62.132 -1.903 10.722 206 H VAL 26 H VAL 26 62.123 0.802 5.875 207 HA VAL 26 HA VAL 26 61.803 -1.994 5.405 208 HB VAL 26 HB VAL 26 61.791 0.157 3.291 209 HG11 VAL 26 1HG1 VAL 26 60.133 -1.389 2.262 210 HG12 VAL 26 2HG1 VAL 26 60.383 -2.514 3.597 211 HG13 VAL 26 3HG1 VAL 26 61.706 -2.156 2.488 212 HG21 VAL 26 3HG2 VAL 26 60.287 1.038 4.885 213 HG22 VAL 26 1HG2 VAL 26 59.737 -0.562 5.383 214 HG23 VAL 26 2HG2 VAL 26 59.247 0.095 3.822 215 H LYS 27 H LYS 27 64.264 0.384 4.495 216 HA LYS 27 HA LYS 27 65.580 -1.061 2.518 217 HB2 LYS 27 1HB LYS 27 66.058 1.323 3.808 218 HB3 LYS 27 2HB LYS 27 67.383 0.333 4.391 219 HG2 LYS 27 1HG LYS 27 68.393 1.006 2.461 220 HG3 LYS 27 2HG LYS 27 67.461 -0.302 1.744 221 HD2 LYS 27 1HD LYS 27 66.831 2.651 1.786 222 HD3 LYS 27 2HD LYS 27 67.086 1.621 0.383 223 HE2 LYS 27 1HE LYS 27 65.017 0.366 0.981 224 HE3 LYS 27 2HE LYS 27 64.738 1.507 2.293 225 HZ1 LYS 27 3HZ LYS 27 64.846 2.093 -0.608 226 HZ2 LYS 27 1HZ LYS 27 64.825 3.296 0.587 227 HZ3 LYS 27 2HZ LYS 27 63.506 2.237 0.424 228 H ALA 28 H ALA 28 66.239 -1.115 6.035 229 HA ALA 28 HA ALA 28 68.247 -3.080 5.912 230 HB1 ALA 28 3HB ALA 28 66.291 -2.407 8.119 231 HB2 ALA 28 1HB ALA 28 67.939 -1.803 7.934 232 HB3 ALA 28 2HB ALA 28 67.658 -3.504 8.311 233 H LYS 29 H LYS 29 64.730 -3.300 6.052 234 HA LYS 29 HA LYS 29 64.573 -6.104 6.454 235 HB2 LYS 29 1HB LYS 29 62.630 -4.145 5.203 236 HB3 LYS 29 2HB LYS 29 62.261 -5.850 5.441 237 HG2 LYS 29 1HG LYS 29 62.679 -5.596 7.870 238 HG3 LYS 29 2HG LYS 29 63.016 -3.882 7.625 239 HD2 LYS 29 1HD LYS 29 60.668 -3.803 6.511 240 HD3 LYS 29 2HD LYS 29 60.398 -5.349 7.313 241 HE2 LYS 29 1HE LYS 29 59.735 -4.096 9.095 242 HE3 LYS 29 2HE LYS 29 61.455 -3.806 9.354 243 HZ1 LYS 29 3HZ LYS 29 60.136 -1.752 9.243 244 HZ2 LYS 29 1HZ LYS 29 59.696 -2.129 7.648 245 HZ3 LYS 29 2HZ LYS 29 61.324 -1.827 8.031 246 H ILE 30 H ILE 30 64.887 -4.059 3.588 247 HA ILE 30 HA ILE 30 64.412 -6.057 1.651 248 HB ILE 30 HB ILE 30 66.160 -3.598 1.417 249 HG12 ILE 30 1HG1 ILE 30 63.999 -2.791 1.968 250 HG13 ILE 30 2HG1 ILE 30 64.044 -2.732 0.216 251 HG21 ILE 30 1HG2 ILE 30 65.330 -3.943 -1.054 252 HG22 ILE 30 2HG2 ILE 30 65.088 -5.611 -0.538 253 HG23 ILE 30 3HG2 ILE 30 66.691 -4.884 -0.449 254 HD11 ILE 30 3HD1 ILE 30 62.962 -5.049 0.247 255 HD12 ILE 30 1HD1 ILE 30 61.943 -3.705 0.763 256 HD13 ILE 30 2HD1 ILE 30 62.663 -4.773 1.965 257 H GLN 31 H GLN 31 67.469 -4.946 3.114 258 HA GLN 31 HA GLN 31 69.075 -6.715 1.564 259 HB2 GLN 31 1HB GLN 31 70.809 -5.610 2.482 260 HB3 GLN 31 2HB GLN 31 69.589 -4.543 3.164 261 HG2 GLN 31 1HG GLN 31 70.921 -5.151 5.006 262 HG3 GLN 31 2HG GLN 31 69.525 -6.213 5.141 263 HE21 GLN 31 2HE2 GLN 31 71.688 -7.197 6.428 264 HE22 GLN 31 1HE2 GLN 31 72.456 -8.419 5.536 265 H ASP 32 H ASP 32 67.468 -7.049 4.673 266 HA ASP 32 HA ASP 32 68.852 -9.264 5.671 267 HB2 ASP 32 1HB ASP 32 66.010 -8.339 6.040 268 HB3 ASP 32 2HB ASP 32 66.667 -9.735 6.892 269 H LYS 33 H LYS 33 65.964 -9.232 3.545 270 HA LYS 33 HA LYS 33 65.676 -12.070 3.532 271 HB2 LYS 33 1HB LYS 33 64.746 -10.047 1.485 272 HB3 LYS 33 2HB LYS 33 64.164 -11.705 1.642 273 HG2 LYS 33 1HG LYS 33 63.961 -10.481 4.222 274 HG3 LYS 33 2HG LYS 33 63.272 -9.356 3.054 275 HD2 LYS 33 1HD LYS 33 61.458 -10.748 3.683 276 HD3 LYS 33 2HD LYS 33 61.978 -11.385 2.123 277 HE2 LYS 33 1HE LYS 33 63.215 -13.169 3.192 278 HE3 LYS 33 2HE LYS 33 62.934 -12.472 4.788 279 HZ1 LYS 33 3HZ LYS 33 60.670 -13.200 3.048 280 HZ2 LYS 33 1HZ LYS 33 60.708 -13.036 4.735 281 HZ3 LYS 33 2HZ LYS 33 61.439 -14.380 3.998 282 H GLU 34 H GLU 34 66.958 -9.833 1.082 283 HA GLU 34 HA GLU 34 68.652 -12.034 0.045 284 HB2 GLU 34 1HB GLU 34 67.027 -9.967 -1.434 285 HB3 GLU 34 2HB GLU 34 68.473 -10.661 -2.166 286 HG2 GLU 34 1HG GLU 34 66.359 -12.449 -0.978 287 HG3 GLU 34 2HG GLU 34 66.176 -11.812 -2.610 288 H GLY 35 H GLY 35 70.805 -11.321 -0.648 289 HA2 GLY 35 1HA GLY 35 71.689 -9.093 0.960 290 HA3 GLY 35 2HA GLY 35 72.701 -10.092 -0.078 291 H ILE 36 H ILE 36 71.310 -7.186 0.383 292 HA ILE 36 HA ILE 36 72.367 -6.123 -2.067 293 HB ILE 36 HB ILE 36 70.190 -6.515 -2.956 294 HG12 ILE 36 1HG1 ILE 36 69.775 -3.758 -1.822 295 HG13 ILE 36 2HG1 ILE 36 71.135 -4.054 -2.902 296 HG21 ILE 36 1HG2 ILE 36 69.188 -7.081 -0.705 297 HG22 ILE 36 2HG2 ILE 36 68.137 -6.145 -1.763 298 HG23 ILE 36 3HG2 ILE 36 68.983 -5.351 -0.435 299 HD11 ILE 36 3HD1 ILE 36 68.864 -3.296 -3.938 300 HD12 ILE 36 1HD1 ILE 36 68.371 -4.968 -3.668 301 HD13 ILE 36 2HD1 ILE 36 69.749 -4.612 -4.711 302 HA PRO 37 HA PRO 37 73.248 -3.629 1.496 303 HB2 PRO 37 1HB PRO 37 74.446 -1.590 -0.137 304 HB3 PRO 37 2HB PRO 37 75.238 -2.763 0.921 305 HG2 PRO 37 1HG PRO 37 75.171 -2.726 -1.918 306 HG3 PRO 37 2HG PRO 37 75.934 -3.916 -0.857 307 HD2 PRO 37 1HD PRO 37 73.557 -4.231 -2.451 308 HD3 PRO 37 2HD PRO 37 74.349 -5.430 -1.408 309 HA PRO 38 HA PRO 38 69.583 -1.111 1.216 310 HB2 PRO 38 1HB PRO 38 70.336 0.412 3.542 311 HB3 PRO 38 2HB PRO 38 69.124 -0.869 3.415 312 HG2 PRO 38 1HG PRO 38 71.693 -0.978 4.632 313 HG3 PRO 38 2HG PRO 38 70.461 -2.240 4.537 314 HD2 PRO 38 1HD PRO 38 72.960 -2.139 3.151 315 HD3 PRO 38 2HD PRO 38 71.684 -3.364 3.001 316 H ASP 39 H ASP 39 72.811 0.216 1.530 317 HA ASP 39 HA ASP 39 72.185 2.938 1.074 318 HB2 ASP 39 1HB ASP 39 74.751 1.678 0.150 319 HB3 ASP 39 2HB ASP 39 74.486 3.279 0.840 320 H GLN 40 H GLN 40 72.497 0.202 -1.072 321 HA GLN 40 HA GLN 40 72.303 1.994 -3.418 322 HB2 GLN 40 1HB GLN 40 73.054 -0.936 -3.279 323 HB3 GLN 40 2HB GLN 40 73.019 0.053 -4.739 324 HG2 GLN 40 1HG GLN 40 74.683 0.818 -2.339 325 HG3 GLN 40 2HG GLN 40 75.301 -0.252 -3.597 326 HE21 GLN 40 2HE2 GLN 40 76.817 1.861 -3.623 327 HE22 GLN 40 1HE2 GLN 40 76.363 3.033 -4.764 328 H GLN 41 H GLN 41 70.242 0.578 -1.398 329 HA GLN 41 HA GLN 41 68.538 -0.739 -3.369 330 HB2 GLN 41 1HB GLN 41 68.712 -1.739 -1.149 331 HB3 GLN 41 2HB GLN 41 68.143 -0.242 -0.414 332 HG2 GLN 41 1HG GLN 41 66.319 -1.906 -0.640 333 HG3 GLN 41 2HG GLN 41 65.995 -0.452 -1.580 334 HE21 GLN 41 2HE2 GLN 41 65.791 -0.683 -3.862 335 HE22 GLN 41 1HE2 GLN 41 65.983 -2.164 -4.671 336 H ARG 42 H ARG 42 66.960 0.224 -4.444 337 HA ARG 42 HA ARG 42 65.841 2.763 -3.415 338 HB2 ARG 42 1HB ARG 42 66.425 2.129 -6.320 339 HB3 ARG 42 2HB ARG 42 65.785 3.643 -5.678 340 HG2 ARG 42 1HG ARG 42 67.837 4.039 -4.428 341 HG3 ARG 42 2HG ARG 42 68.474 2.468 -4.915 342 HD2 ARG 42 1HD ARG 42 69.477 4.101 -6.360 343 HD3 ARG 42 2HD ARG 42 68.276 3.238 -7.317 344 HE ARG 42 HE ARG 42 67.536 5.794 -6.041 345 HH11 ARG 42 1HH2 ARG 42 66.094 4.047 -8.238 346 HH12 ARG 42 2HH2 ARG 42 66.288 5.089 -9.608 347 HH21 ARG 42 1HH1 ARG 42 68.683 7.081 -8.091 348 HH22 ARG 42 2HH1 ARG 42 67.753 6.805 -9.526 349 H LEU 43 H LEU 43 63.656 2.846 -3.370 350 HA LEU 43 HA LEU 43 62.152 0.723 -4.797 351 HB2 LEU 43 1HB LEU 43 61.114 1.905 -2.249 352 HB3 LEU 43 2HB LEU 43 60.821 0.313 -2.941 353 HG LEU 43 HG LEU 43 63.504 1.185 -1.823 354 HD11 LEU 43 1HD1 LEU 43 62.915 -0.140 0.161 355 HD12 LEU 43 2HD1 LEU 43 61.322 -0.467 -0.521 356 HD13 LEU 43 3HD1 LEU 43 61.767 1.179 -0.066 357 HD21 LEU 43 3HD2 LEU 43 63.557 -1.468 -1.663 358 HD22 LEU 43 1HD2 LEU 43 63.965 -0.657 -3.171 359 HD23 LEU 43 2HD2 LEU 43 62.362 -1.355 -2.952 360 H ILE 44 H ILE 44 60.066 1.278 -5.558 361 HA ILE 44 HA ILE 44 59.358 4.145 -5.497 362 HB ILE 44 HB ILE 44 59.421 2.422 -7.988 363 HG12 ILE 44 1HG1 ILE 44 60.998 4.920 -7.297 364 HG13 ILE 44 2HG1 ILE 44 61.641 3.286 -7.146 365 HG21 ILE 44 1HG2 ILE 44 58.439 5.224 -7.418 366 HG22 ILE 44 2HG2 ILE 44 57.549 3.894 -8.157 367 HG23 ILE 44 3HG2 ILE 44 58.849 4.686 -9.046 368 HD11 ILE 44 3HD1 ILE 44 62.357 4.079 -9.284 369 HD12 ILE 44 1HD1 ILE 44 60.749 4.690 -9.670 370 HD13 ILE 44 2HD1 ILE 44 61.039 2.952 -9.600 371 H PHE 45 H PHE 45 57.195 4.569 -5.389 372 HA PHE 45 HA PHE 45 55.351 2.246 -5.423 373 HB2 PHE 45 1HB PHE 45 55.598 2.948 -3.140 374 HB3 PHE 45 2HB PHE 45 55.412 4.644 -3.580 375 HD1 PHE 45 HD1 PHE 45 53.616 1.365 -3.586 376 HD2 PHE 45 HD2 PHE 45 53.273 5.646 -3.654 377 HE1 PHE 45 HE1 PHE 45 51.161 1.172 -3.304 378 HE2 PHE 45 HE2 PHE 45 50.817 5.454 -3.370 379 HZ PHE 45 HZ PHE 45 49.760 3.216 -3.195 380 H ALA 46 H ALA 46 53.991 2.386 -7.088 381 HA ALA 46 HA ALA 46 52.724 3.273 -8.801 382 HB1 ALA 46 3HB ALA 46 52.020 5.390 -6.762 383 HB2 ALA 46 1HB ALA 46 51.361 3.756 -6.718 384 HB3 ALA 46 2HB ALA 46 51.028 4.803 -8.097 385 H GLY 47 H GLY 47 55.474 4.175 -8.659 386 HA2 GLY 47 1HA GLY 47 56.608 5.569 -10.196 387 HA3 GLY 47 2HA GLY 47 55.197 6.621 -10.257 388 H LYS 48 H LYS 48 55.130 6.389 -7.196 389 HA LYS 48 HA LYS 48 56.701 8.757 -6.689 390 HB2 LYS 48 1HB LYS 48 55.227 7.038 -4.686 391 HB3 LYS 48 2HB LYS 48 55.721 8.720 -4.493 392 HG2 LYS 48 1HG LYS 48 54.247 9.294 -6.456 393 HG3 LYS 48 2HG LYS 48 53.646 7.635 -6.412 394 HD2 LYS 48 1HD LYS 48 52.834 7.936 -4.139 395 HD3 LYS 48 2HD LYS 48 53.544 9.549 -4.064 396 HE2 LYS 48 1HE LYS 48 51.399 8.702 -6.032 397 HE3 LYS 48 2HE LYS 48 51.098 9.607 -4.549 398 HZ1 LYS 48 3HZ LYS 48 51.477 11.412 -5.762 399 HZ2 LYS 48 1HZ LYS 48 52.103 10.521 -7.062 400 HZ3 LYS 48 2HZ LYS 48 53.117 10.968 -5.774 401 H GLN 49 H GLN 49 58.770 8.749 -6.159 402 HA GLN 49 HA GLN 49 60.168 6.328 -5.501 403 HB2 GLN 49 1HB GLN 49 61.169 9.176 -5.318 404 HB3 GLN 49 2HB GLN 49 62.143 7.712 -5.451 405 HG2 GLN 49 1HG GLN 49 61.601 7.387 -7.694 406 HG3 GLN 49 2HG GLN 49 60.098 8.299 -7.573 407 HE21 GLN 49 2HE2 GLN 49 60.976 10.711 -6.440 408 HE22 GLN 49 1HE2 GLN 49 62.063 11.470 -7.500 409 H LEU 50 H LEU 50 60.398 5.462 -3.527 410 HA LEU 50 HA LEU 50 59.499 6.909 -1.197 411 HB2 LEU 50 1HB LEU 50 60.668 4.145 -1.584 412 HB3 LEU 50 2HB LEU 50 60.203 4.781 -0.008 413 HG LEU 50 HG LEU 50 58.344 4.590 -2.401 414 HD11 LEU 50 1HD1 LEU 50 58.860 2.358 -1.593 415 HD12 LEU 50 2HD1 LEU 50 57.233 2.787 -1.072 416 HD13 LEU 50 3HD1 LEU 50 58.572 2.851 0.074 417 HD21 LEU 50 3HD2 LEU 50 58.131 5.772 0.321 418 HD22 LEU 50 1HD2 LEU 50 56.736 4.842 -0.230 419 HD23 LEU 50 2HD2 LEU 50 57.306 6.218 -1.169 420 H GLU 51 H GLU 51 60.679 7.973 0.227 421 HA GLU 51 HA GLU 51 63.384 8.636 -0.492 422 HB2 GLU 51 1HB GLU 51 61.915 9.761 1.858 423 HB3 GLU 51 2HB GLU 51 63.110 10.533 0.815 424 HG2 GLU 51 1HG GLU 51 61.468 10.277 -1.096 425 HG3 GLU 51 2HG GLU 51 60.270 9.769 0.094 426 H ASP 52 H ASP 52 64.511 9.549 1.563 427 HA ASP 52 HA ASP 52 66.214 7.696 2.592 428 HB2 ASP 52 1HB ASP 52 66.927 9.425 4.155 429 HB3 ASP 52 2HB ASP 52 66.643 10.090 2.548 430 H GLY 53 H GLY 53 63.074 7.522 3.448 431 HA2 GLY 53 1HA GLY 53 62.607 5.833 5.243 432 HA3 GLY 53 2HA GLY 53 63.759 6.710 6.216 433 H ARG 54 H ARG 54 61.235 7.919 4.099 434 HA ARG 54 HA ARG 54 60.078 9.548 6.240 435 HB2 ARG 54 1HB ARG 54 60.034 9.596 3.341 436 HB3 ARG 54 2HB ARG 54 58.382 9.393 3.915 437 HG2 ARG 54 1HG ARG 54 58.698 11.738 3.815 438 HG3 ARG 54 2HG ARG 54 58.878 11.341 5.522 439 HD2 ARG 54 1HD ARG 54 61.316 11.333 5.288 440 HD3 ARG 54 2HD ARG 54 61.167 11.643 3.561 441 HE ARG 54 HE ARG 54 60.689 13.874 4.043 442 HH11 ARG 54 1HH2 ARG 54 58.689 13.066 6.301 443 HH12 ARG 54 2HH2 ARG 54 59.397 13.891 7.650 444 HH21 ARG 54 1HH1 ARG 54 62.425 14.459 6.052 445 HH22 ARG 54 2HH1 ARG 54 61.514 14.680 7.509 446 H THR 55 H THR 55 57.665 8.997 6.818 447 HA THR 55 HA THR 55 57.554 6.105 6.947 448 HB THR 55 HB THR 55 56.269 8.316 8.277 449 HG1 THR 55 HG1 THR 55 57.111 5.787 8.690 450 HG21 THR 55 3HG2 THR 55 54.455 6.088 7.323 451 HG22 THR 55 1HG2 THR 55 54.295 7.800 6.947 452 HG23 THR 55 2HG2 THR 55 54.053 7.235 8.597 453 H LEU 56 H LEU 56 56.303 4.769 5.852 454 HA LEU 56 HA LEU 56 55.312 5.631 3.327 455 HB2 LEU 56 1HB LEU 56 56.139 3.175 4.522 456 HB3 LEU 56 2HB LEU 56 54.636 2.948 3.631 457 HG LEU 56 HG LEU 56 55.660 4.080 1.667 458 HD11 LEU 56 1HD1 LEU 56 57.288 5.549 2.426 459 HD12 LEU 56 2HD1 LEU 56 58.309 4.202 1.934 460 HD13 LEU 56 3HD1 LEU 56 57.899 4.420 3.632 461 HD21 LEU 56 3HD2 LEU 56 57.772 2.095 2.179 462 HD22 LEU 56 1HD2 LEU 56 56.520 2.111 0.939 463 HD23 LEU 56 2HD2 LEU 56 56.155 1.499 2.542 464 H SER 57 H SER 57 53.798 4.776 6.366 465 HA SER 57 HA SER 57 51.231 4.220 5.409 466 HB2 SER 57 1HB SER 57 50.412 5.146 7.594 467 HB3 SER 57 2HB SER 57 51.700 3.962 7.779 468 HG SER 57 HG SER 57 51.800 6.779 7.983 469 H ASP 58 H ASP 58 53.044 7.154 5.721 470 HA ASP 58 HA ASP 58 50.884 8.978 5.201 471 HB2 ASP 58 1HB ASP 58 53.085 9.588 6.302 472 HB3 ASP 58 2HB ASP 58 53.840 9.418 4.718 473 H TYR 59 H TYR 59 53.017 6.970 3.366 474 HA TYR 59 HA TYR 59 52.585 8.263 0.814 475 HB2 TYR 59 1HB TYR 59 54.070 5.900 1.828 476 HB3 TYR 59 2HB TYR 59 53.524 5.808 0.161 477 HD1 TYR 59 HD2 TYR 59 55.572 7.710 2.565 478 HD2 TYR 59 HD1 TYR 59 54.413 7.216 -1.530 479 HE1 TYR 59 HE2 TYR 59 57.429 9.202 1.866 480 HE2 TYR 59 HE1 TYR 59 56.265 8.710 -2.239 481 HH TYR 59 HH TYR 59 57.906 10.714 -0.154 482 H ASN 60 H ASN 60 50.574 6.680 2.778 483 HA ASN 60 HA ASN 60 48.583 5.576 2.511 484 HB2 ASN 60 1HB ASN 60 48.787 6.265 -0.420 485 HB3 ASN 60 2HB ASN 60 47.331 6.002 0.534 486 HD21 ASN 60 2HD2 ASN 60 46.552 7.757 1.845 487 HD22 ASN 60 1HD2 ASN 60 47.234 9.312 1.778 488 H ILE 61 H ILE 61 50.961 3.997 2.406 489 HA ILE 61 HA ILE 61 50.913 2.245 0.171 490 HB ILE 61 HB ILE 61 52.019 1.868 2.958 491 HG12 ILE 61 1HG1 ILE 61 53.213 3.534 1.633 492 HG13 ILE 61 2HG1 ILE 61 54.184 2.072 1.730 493 HG21 ILE 61 1HG2 ILE 61 52.129 0.058 0.535 494 HG22 ILE 61 2HG2 ILE 61 51.533 -0.338 2.146 495 HG23 ILE 61 3HG2 ILE 61 53.255 -0.070 1.886 496 HD11 ILE 61 3HD1 ILE 61 52.725 3.205 -0.621 497 HD12 ILE 61 1HD1 ILE 61 52.945 1.456 -0.525 498 HD13 ILE 61 2HD1 ILE 61 54.347 2.525 -0.535 499 H GLN 62 H GLN 62 49.767 0.610 -0.300 500 HA GLN 62 HA GLN 62 47.419 0.004 1.305 501 HB2 GLN 62 1HB GLN 62 46.546 -0.989 -0.756 502 HB3 GLN 62 2HB GLN 62 47.095 0.666 -1.012 503 HG2 GLN 62 1HG GLN 62 49.002 -0.004 -2.194 504 HG3 GLN 62 2HG GLN 62 48.985 -1.625 -1.502 505 HE21 GLN 62 2HE2 GLN 62 48.124 -3.223 -2.838 506 HE22 GLN 62 1HE2 GLN 62 47.095 -2.934 -4.157 507 H LYS 63 H LYS 63 46.578 -2.199 0.481 508 HA LYS 63 HA LYS 63 47.301 -4.201 2.095 509 HB2 LYS 63 1HB LYS 63 45.997 -4.182 -0.597 510 HB3 LYS 63 2HB LYS 63 46.292 -5.714 0.220 511 HG2 LYS 63 1HG LYS 63 45.005 -3.485 1.765 512 HG3 LYS 63 2HG LYS 63 44.028 -4.399 0.616 513 HD2 LYS 63 1HD LYS 63 44.596 -6.495 1.726 514 HD3 LYS 63 2HD LYS 63 45.693 -5.654 2.821 515 HE2 LYS 63 1HE LYS 63 43.194 -4.313 3.004 516 HE3 LYS 63 2HE LYS 63 42.851 -6.041 3.089 517 HZ1 LYS 63 3HZ LYS 63 44.384 -6.289 4.867 518 HZ2 LYS 63 1HZ LYS 63 43.370 -4.988 5.260 519 HZ3 LYS 63 2HZ LYS 63 44.947 -4.695 4.700 520 H GLU 64 H GLU 64 49.806 -3.189 0.695 521 HA GLU 64 HA GLU 64 51.846 -4.286 0.430 522 HB2 GLU 64 1HB GLU 64 52.071 -6.585 0.436 523 HB3 GLU 64 2HB GLU 64 50.550 -6.386 1.294 524 HG2 GLU 64 1HG GLU 64 49.623 -6.536 -1.269 525 HG3 GLU 64 2HG GLU 64 51.059 -7.528 -1.405 526 H SER 65 H SER 65 50.938 -2.668 -1.327 527 HA SER 65 HA SER 65 50.635 -3.554 -3.991 528 HB2 SER 65 1HB SER 65 51.090 -1.065 -2.549 529 HB3 SER 65 2HB SER 65 51.959 -1.107 -4.081 530 HG SER 65 HG SER 65 49.982 -0.444 -4.652 531 H THR 66 H THR 66 52.227 -3.620 -5.681 532 HA THR 66 HA THR 66 54.837 -4.538 -4.767 533 HB THR 66 HB THR 66 55.103 -5.482 -6.868 534 HG1 THR 66 HG1 THR 66 53.215 -4.151 -8.291 535 HG21 THR 66 3HG2 THR 66 52.949 -6.223 -5.701 536 HG22 THR 66 1HG2 THR 66 53.059 -6.561 -7.430 537 HG23 THR 66 2HG2 THR 66 52.096 -5.199 -6.857 538 H LEU 67 H LEU 67 56.648 -3.349 -4.767 539 HA LEU 67 HA LEU 67 56.549 -0.633 -5.902 540 HB2 LEU 67 1HB LEU 67 58.717 -1.768 -4.133 541 HB3 LEU 67 2HB LEU 67 58.308 -0.075 -4.411 542 HG LEU 67 HG LEU 67 56.554 -2.110 -3.005 543 HD11 LEU 67 1HD1 LEU 67 58.328 -1.514 -1.529 544 HD12 LEU 67 2HD1 LEU 67 56.975 -0.481 -1.066 545 HD13 LEU 67 3HD1 LEU 67 58.290 0.171 -2.043 546 HD21 LEU 67 3HD2 LEU 67 55.289 0.081 -2.438 547 HD22 LEU 67 1HD2 LEU 67 55.087 -0.576 -4.061 548 HD23 LEU 67 2HD2 LEU 67 56.177 0.784 -3.790 549 H HIS 68 H HIS 68 57.752 -0.049 -7.614 550 HA HIS 68 HA HIS 68 59.317 -2.110 -8.959 551 HB2 HIS 68 1HB HIS 68 57.623 -0.301 -9.967 552 HB3 HIS 68 2HB HIS 68 59.098 0.660 -10.052 553 HD1 HIS 68 HD1 HIS 68 57.315 -2.097 -11.719 554 HD2 HIS 68 HD2 HIS 68 61.220 -0.642 -11.628 555 HE1 HIS 68 HE1 HIS 68 58.509 -3.125 -13.700 556 H LEU 69 H LEU 69 61.503 -2.027 -9.344 557 HA LEU 69 HA LEU 69 63.007 0.140 -7.992 558 HB2 LEU 69 1HB LEU 69 64.141 -2.617 -8.341 559 HB3 LEU 69 2HB LEU 69 64.545 -1.385 -7.146 560 HG LEU 69 HG LEU 69 62.012 -1.744 -6.411 561 HD11 LEU 69 1HD1 LEU 69 61.048 -3.779 -6.942 562 HD12 LEU 69 2HD1 LEU 69 62.603 -4.575 -7.185 563 HD13 LEU 69 3HD1 LEU 69 61.957 -3.506 -8.428 564 HD21 LEU 69 3HD2 LEU 69 62.827 -3.480 -4.804 565 HD22 LEU 69 1HD2 LEU 69 63.938 -2.119 -4.955 566 HD23 LEU 69 2HD2 LEU 69 64.295 -3.640 -5.769 567 H VAL 70 H VAL 70 65.183 0.503 -8.870 568 HA VAL 70 HA VAL 70 65.618 -0.373 -11.632 569 HB VAL 70 HB VAL 70 66.053 1.997 -12.331 570 HG11 VAL 70 1HG1 VAL 70 63.917 0.754 -12.808 571 HG12 VAL 70 2HG1 VAL 70 63.717 2.504 -12.724 572 HG13 VAL 70 3HG1 VAL 70 63.223 1.492 -11.366 573 HG21 VAL 70 3HG2 VAL 70 66.283 2.832 -9.955 574 HG22 VAL 70 1HG2 VAL 70 64.534 2.675 -9.796 575 HG23 VAL 70 2HG2 VAL 70 65.216 3.806 -10.965 576 H LEU 71 H LEU 71 67.789 0.280 -12.414 577 HA LEU 71 HA LEU 71 69.715 0.281 -10.173 578 HB2 LEU 71 1HB LEU 71 69.850 -0.756 -13.004 579 HB3 LEU 71 2HB LEU 71 71.306 -0.500 -12.044 580 HG LEU 71 HG LEU 71 70.008 -1.912 -10.226 581 HD11 LEU 71 1HD1 LEU 71 68.416 -3.465 -11.075 582 HD12 LEU 71 2HD1 LEU 71 68.790 -3.054 -12.747 583 HD13 LEU 71 3HD1 LEU 71 67.923 -1.907 -11.730 584 HD21 LEU 71 3HD2 LEU 71 70.986 -3.976 -11.202 585 HD22 LEU 71 1HD2 LEU 71 72.098 -2.612 -11.316 586 HD23 LEU 71 2HD2 LEU 71 71.196 -3.136 -12.738 587 H ARG 72 H ARG 72 69.391 1.534 -13.503 588 HA ARG 72 HA ARG 72 71.343 3.623 -12.945 589 HB2 ARG 72 1HB ARG 72 70.248 2.336 -15.302 590 HB3 ARG 72 2HB ARG 72 70.151 4.088 -15.460 591 HG2 ARG 72 1HG ARG 72 72.685 2.705 -14.553 592 HG3 ARG 72 2HG ARG 72 72.327 2.980 -16.258 593 HD2 ARG 72 1HD ARG 72 72.089 5.287 -14.360 594 HD3 ARG 72 2HD ARG 72 73.696 4.772 -14.866 595 HE ARG 72 HE ARG 72 71.567 5.759 -16.667 596 HH11 ARG 72 1HH2 ARG 72 74.108 3.840 -17.296 597 HH12 ARG 72 2HH2 ARG 72 75.056 4.980 -18.191 598 HH21 ARG 72 1HH1 ARG 72 73.128 7.709 -17.270 599 HH22 ARG 72 2HH1 ARG 72 74.503 7.169 -18.177 Start of MODEL 5 1 H1 MET 1 1H MET 1 47.811 -5.286 5.601 2 H2 MET 1 2H MET 1 48.193 -4.195 4.356 3 H3 MET 1 3H MET 1 47.123 -3.734 5.590 4 HA MET 1 HA MET 1 49.226 -2.708 6.009 5 HB2 MET 1 1HB MET 1 49.270 -5.007 7.927 6 HB3 MET 1 2HB MET 1 49.353 -3.276 8.250 7 HG2 MET 1 1HG MET 1 46.878 -3.305 7.295 8 HG3 MET 1 2HG MET 1 46.950 -5.002 7.765 9 HE1 MET 1 3HE MET 1 48.661 -1.757 9.800 10 HE2 MET 1 1HE MET 1 47.029 -1.222 10.213 11 HE3 MET 1 2HE MET 1 47.472 -1.481 8.530 12 H GLN 2 H GLN 2 49.701 -4.653 3.867 13 HA GLN 2 HA GLN 2 52.402 -5.583 4.659 14 HB2 GLN 2 1HB GLN 2 50.304 -6.955 2.976 15 HB3 GLN 2 2HB GLN 2 52.001 -7.433 2.954 16 HG2 GLN 2 1HG GLN 2 51.954 -8.194 5.161 17 HG3 GLN 2 2HG GLN 2 50.588 -7.165 5.592 18 HE21 GLN 2 2HE2 GLN 2 48.690 -7.804 3.658 19 HE22 GLN 2 1HE2 GLN 2 48.298 -9.453 3.750 20 H ILE 3 H ILE 3 53.875 -5.858 2.777 21 HA ILE 3 HA ILE 3 53.277 -3.915 0.628 22 HB ILE 3 HB ILE 3 55.648 -4.135 2.381 23 HG12 ILE 3 1HG1 ILE 3 54.130 -2.060 0.828 24 HG13 ILE 3 2HG1 ILE 3 54.647 -2.041 2.511 25 HG21 ILE 3 1HG2 ILE 3 56.503 -5.100 0.222 26 HG22 ILE 3 2HG2 ILE 3 57.259 -3.569 0.632 27 HG23 ILE 3 3HG2 ILE 3 55.997 -3.622 -0.597 28 HD11 ILE 3 3HD1 ILE 3 55.970 -0.433 1.313 29 HD12 ILE 3 1HD1 ILE 3 56.368 -1.592 0.059 30 HD13 ILE 3 2HD1 ILE 3 57.020 -1.789 1.687 31 H PHE 4 H PHE 4 54.379 -4.354 -1.393 32 HA PHE 4 HA PHE 4 55.196 -7.149 -1.736 33 HB2 PHE 4 1HB PHE 4 52.885 -7.248 -2.249 34 HB3 PHE 4 2HB PHE 4 52.949 -5.747 -3.164 35 HD1 PHE 4 HD2 PHE 4 55.430 -8.514 -3.302 36 HD2 PHE 4 HD1 PHE 4 52.204 -6.502 -5.300 37 HE1 PHE 4 HE2 PHE 4 55.915 -9.792 -5.358 38 HE2 PHE 4 HE1 PHE 4 52.690 -7.790 -7.364 39 HZ PHE 4 HZ PHE 4 54.546 -9.434 -7.394 40 H VAL 5 H VAL 5 56.838 -7.405 -3.146 41 HA VAL 5 HA VAL 5 57.511 -5.159 -4.952 42 HB VAL 5 HB VAL 5 59.389 -6.703 -3.149 43 HG11 VAL 5 1HG1 VAL 5 59.901 -4.921 -5.534 44 HG12 VAL 5 2HG1 VAL 5 60.550 -6.529 -5.212 45 HG13 VAL 5 3HG1 VAL 5 61.110 -5.147 -4.270 46 HG21 VAL 5 3HG2 VAL 5 58.007 -4.555 -2.442 47 HG22 VAL 5 1HG2 VAL 5 59.224 -3.713 -3.401 48 HG23 VAL 5 2HG2 VAL 5 59.713 -4.690 -2.016 49 H LYS 6 H LYS 6 58.259 -5.734 -6.962 50 HA LYS 6 HA LYS 6 58.107 -8.608 -7.616 51 HB2 LYS 6 1HB LYS 6 57.465 -8.016 -9.779 52 HB3 LYS 6 2HB LYS 6 56.717 -6.740 -8.818 53 HG2 LYS 6 1HG LYS 6 58.841 -5.373 -9.231 54 HG3 LYS 6 2HG LYS 6 59.268 -6.585 -10.440 55 HD2 LYS 6 1HD LYS 6 57.009 -6.179 -11.508 56 HD3 LYS 6 2HD LYS 6 56.812 -4.814 -10.409 57 HE2 LYS 6 1HE LYS 6 58.031 -3.517 -11.797 58 HE3 LYS 6 2HE LYS 6 59.404 -4.607 -11.626 59 HZ1 LYS 6 3HZ LYS 6 57.155 -5.220 -13.442 60 HZ2 LYS 6 1HZ LYS 6 58.726 -5.861 -13.451 61 HZ3 LYS 6 2HZ LYS 6 58.460 -4.254 -13.940 62 H THR 7 H THR 7 59.809 -9.685 -8.549 63 HA THR 7 HA THR 7 62.379 -8.225 -8.594 64 HB THR 7 HB THR 7 62.074 -11.223 -8.589 65 HG1 THR 7 HG1 THR 7 61.107 -9.713 -6.761 66 HG21 THR 7 3HG2 THR 7 64.301 -11.090 -7.541 67 HG22 THR 7 1HG2 THR 7 64.222 -9.328 -7.589 68 HG23 THR 7 2HG2 THR 7 64.289 -10.250 -9.091 69 H LEU 8 H LEU 8 63.810 -8.487 -10.313 70 HA LEU 8 HA LEU 8 62.594 -8.761 -12.891 71 HB2 LEU 8 1HB LEU 8 65.497 -8.474 -12.084 72 HB3 LEU 8 2HB LEU 8 64.885 -8.340 -13.733 73 HG LEU 8 HG LEU 8 63.575 -6.655 -11.634 74 HD11 LEU 8 1HD1 LEU 8 66.336 -6.159 -12.769 75 HD12 LEU 8 2HD1 LEU 8 65.865 -6.226 -11.070 76 HD13 LEU 8 3HD1 LEU 8 65.334 -4.881 -12.079 77 HD21 LEU 8 3HD2 LEU 8 64.461 -5.938 -14.437 78 HD22 LEU 8 1HD2 LEU 8 63.198 -5.181 -13.466 79 HD23 LEU 8 2HD2 LEU 8 62.955 -6.800 -14.124 80 H THR 9 H THR 9 63.887 -11.002 -10.708 81 HA THR 9 HA THR 9 64.763 -12.886 -12.771 82 HB THR 9 HB THR 9 65.378 -14.320 -10.851 83 HG1 THR 9 HG1 THR 9 65.230 -12.802 -8.822 84 HG21 THR 9 3HG2 THR 9 67.024 -12.737 -11.674 85 HG22 THR 9 1HG2 THR 9 67.110 -12.772 -9.913 86 HG23 THR 9 2HG2 THR 9 66.299 -11.437 -10.730 87 H GLY 10 H GLY 10 61.895 -12.060 -11.188 88 HA2 GLY 10 1HA GLY 10 59.796 -13.025 -11.699 89 HA3 GLY 10 2HA GLY 10 60.614 -14.513 -12.164 90 H LYS 11 H LYS 11 62.107 -13.711 -9.406 91 HA LYS 11 HA LYS 11 60.625 -15.650 -7.860 92 HB2 LYS 11 1HB LYS 11 63.126 -15.436 -7.811 93 HB3 LYS 11 2HB LYS 11 62.930 -13.896 -6.978 94 HG2 LYS 11 1HG LYS 11 62.449 -14.904 -4.996 95 HG3 LYS 11 2HG LYS 11 61.372 -16.077 -5.752 96 HD2 LYS 11 1HD LYS 11 63.304 -17.408 -6.482 97 HD3 LYS 11 2HD LYS 11 64.403 -16.222 -5.777 98 HE2 LYS 11 1HE LYS 11 62.282 -17.619 -4.137 99 HE3 LYS 11 2HE LYS 11 63.898 -18.293 -4.349 100 HZ1 LYS 11 3HZ LYS 11 64.799 -16.766 -3.009 101 HZ2 LYS 11 1HZ LYS 11 63.220 -16.546 -2.431 102 HZ3 LYS 11 2HZ LYS 11 63.841 -15.500 -3.617 103 H THR 12 H THR 12 59.060 -15.250 -6.434 104 HA THR 12 HA THR 12 58.102 -12.565 -6.051 105 HB THR 12 HB THR 12 57.243 -15.248 -4.956 106 HG1 THR 12 HG1 THR 12 56.081 -15.224 -6.680 107 HG21 THR 12 3HG2 THR 12 55.144 -13.743 -4.363 108 HG22 THR 12 1HG2 THR 12 56.360 -12.468 -4.268 109 HG23 THR 12 2HG2 THR 12 56.490 -13.891 -3.233 110 H ILE 13 H ILE 13 58.960 -11.191 -4.636 111 HA ILE 13 HA ILE 13 60.072 -12.267 -2.110 112 HB ILE 13 HB ILE 13 61.614 -11.079 -3.848 113 HG12 ILE 13 1HG1 ILE 13 61.525 -10.197 -0.946 114 HG13 ILE 13 2HG1 ILE 13 62.279 -11.672 -1.548 115 HG21 ILE 13 1HG2 ILE 13 60.552 -8.620 -2.456 116 HG22 ILE 13 2HG2 ILE 13 59.940 -9.133 -4.029 117 HG23 ILE 13 3HG2 ILE 13 61.640 -8.713 -3.839 118 HD11 ILE 13 3HD1 ILE 13 63.436 -9.759 -3.154 119 HD12 ILE 13 1HD1 ILE 13 64.163 -10.411 -1.688 120 HD13 ILE 13 2HD1 ILE 13 63.263 -8.897 -1.627 121 H THR 14 H THR 14 58.728 -11.924 -0.479 122 HA THR 14 HA THR 14 57.166 -9.401 -0.407 123 HB THR 14 HB THR 14 55.572 -10.702 1.048 124 HG1 THR 14 HG1 THR 14 56.376 -12.519 1.702 125 HG21 THR 14 3HG2 THR 14 55.974 -11.920 -1.693 126 HG22 THR 14 1HG2 THR 14 55.255 -10.332 -1.429 127 HG23 THR 14 2HG2 THR 14 54.461 -11.776 -0.802 128 H LEU 15 H LEU 15 57.245 -8.174 1.443 129 HA LEU 15 HA LEU 15 59.017 -9.167 3.604 130 HB2 LEU 15 1HB LEU 15 58.816 -6.373 3.868 131 HB3 LEU 15 2HB LEU 15 60.213 -7.280 3.301 132 HG LEU 15 HG LEU 15 57.962 -6.490 1.439 133 HD11 LEU 15 1HD1 LEU 15 59.354 -4.544 0.806 134 HD12 LEU 15 2HD1 LEU 15 60.494 -4.949 2.087 135 HD13 LEU 15 3HD1 LEU 15 58.852 -4.451 2.494 136 HD21 LEU 15 3HD2 LEU 15 60.126 -6.544 -0.107 137 HD22 LEU 15 1HD2 LEU 15 59.292 -8.040 0.305 138 HD23 LEU 15 2HD2 LEU 15 60.754 -7.579 1.172 139 H GLU 16 H GLU 16 58.339 -8.924 5.731 140 HA GLU 16 HA GLU 16 55.454 -8.403 5.998 141 HB2 GLU 16 1HB GLU 16 57.463 -9.630 7.914 142 HB3 GLU 16 2HB GLU 16 55.757 -9.378 8.276 143 HG2 GLU 16 1HG GLU 16 55.683 -11.567 7.516 144 HG3 GLU 16 2HG GLU 16 55.415 -10.709 6.001 145 H VAL 17 H VAL 17 54.995 -6.391 6.332 146 HA VAL 17 HA VAL 17 56.396 -4.899 8.425 147 HB VAL 17 HB VAL 17 57.583 -4.409 6.316 148 HG11 VAL 17 1HG1 VAL 17 54.918 -3.322 5.363 149 HG12 VAL 17 2HG1 VAL 17 55.543 -4.903 4.895 150 HG13 VAL 17 3HG1 VAL 17 56.418 -3.443 4.442 151 HG21 VAL 17 3HG2 VAL 17 55.925 -1.967 6.809 152 HG22 VAL 17 1HG2 VAL 17 57.670 -2.129 6.688 153 HG23 VAL 17 2HG2 VAL 17 56.846 -2.622 8.159 154 H GLU 18 H GLU 18 55.378 -2.690 8.600 155 HA GLU 18 HA GLU 18 52.447 -2.941 8.485 156 HB2 GLU 18 1HB GLU 18 53.873 -0.712 9.909 157 HB3 GLU 18 2HB GLU 18 52.344 -1.496 10.310 158 HG2 GLU 18 1HG GLU 18 53.792 -2.342 11.948 159 HG3 GLU 18 2HG GLU 18 53.804 -3.614 10.727 160 HA PRO 19 HA PRO 19 52.434 0.185 5.439 161 HB2 PRO 19 1HB PRO 19 50.654 2.107 6.643 162 HB3 PRO 19 2HB PRO 19 50.295 0.886 5.409 163 HG2 PRO 19 1HG PRO 19 49.362 0.832 7.993 164 HG3 PRO 19 2HG PRO 19 49.486 -0.576 6.924 165 HD2 PRO 19 1HD PRO 19 51.298 0.271 9.142 166 HD3 PRO 19 2HD PRO 19 50.838 -1.362 8.613 167 H SER 20 H SER 20 53.687 1.102 8.531 168 HA SER 20 HA SER 20 54.230 3.825 7.680 169 HB2 SER 20 1HB SER 20 54.470 3.914 9.951 170 HB3 SER 20 2HB SER 20 54.793 2.188 10.068 171 HG SER 20 HG SER 20 56.911 2.733 9.151 172 H ASP 21 H ASP 21 55.651 0.654 7.488 173 HA ASP 21 HA ASP 21 57.722 0.059 6.545 174 HB2 ASP 21 1HB ASP 21 55.692 1.075 4.744 175 HB3 ASP 21 2HB ASP 21 57.308 1.093 4.044 176 H THR 22 H THR 22 59.107 1.799 7.940 177 HA THR 22 HA THR 22 59.630 4.134 6.280 178 HB THR 22 HB THR 22 61.695 3.911 8.200 179 HG1 THR 22 HG1 THR 22 59.624 3.619 9.842 180 HG21 THR 22 3HG2 THR 22 59.053 5.299 8.668 181 HG22 THR 22 1HG2 THR 22 60.240 5.909 7.513 182 HG23 THR 22 2HG2 THR 22 60.653 5.788 9.223 183 H ILE 23 H ILE 23 61.189 4.358 4.876 184 HA ILE 23 HA ILE 23 62.213 2.177 3.581 185 HB ILE 23 HB ILE 23 63.784 4.675 3.293 186 HG12 ILE 23 1HG1 ILE 23 61.614 5.637 3.924 187 HG13 ILE 23 2HG1 ILE 23 61.790 5.781 2.188 188 HG21 ILE 23 1HG2 ILE 23 62.101 3.353 1.184 189 HG22 ILE 23 2HG2 ILE 23 63.553 2.536 1.747 190 HG23 ILE 23 3HG2 ILE 23 63.672 4.136 1.028 191 HD11 ILE 23 3HD1 ILE 23 59.837 4.279 3.734 192 HD12 ILE 23 1HD1 ILE 23 60.606 3.300 2.483 193 HD13 ILE 23 2HD1 ILE 23 59.797 4.802 2.054 194 H GLU 24 H GLU 24 63.910 4.171 6.008 195 HA GLU 24 HA GLU 24 66.336 2.720 5.789 196 HB2 GLU 24 1HB GLU 24 65.654 4.869 7.258 197 HB3 GLU 24 2HB GLU 24 65.390 3.629 8.486 198 HG2 GLU 24 1HG GLU 24 67.793 2.807 7.537 199 HG3 GLU 24 2HG GLU 24 67.932 4.536 7.219 200 H ASN 25 H ASN 25 63.215 2.202 7.178 201 HA ASN 25 HA ASN 25 63.853 -0.165 8.697 202 HB2 ASN 25 1HB ASN 25 61.812 1.653 8.753 203 HB3 ASN 25 2HB ASN 25 61.038 0.294 7.945 204 HD21 ASN 25 2HD2 ASN 25 60.745 1.393 10.794 205 HD22 ASN 25 1HD2 ASN 25 60.994 0.040 11.788 206 H VAL 26 H VAL 26 62.228 0.505 5.593 207 HA VAL 26 HA VAL 26 61.678 -2.247 5.041 208 HB VAL 26 HB VAL 26 61.826 -0.002 3.023 209 HG11 VAL 26 1HG1 VAL 26 60.099 -1.399 1.890 210 HG12 VAL 26 2HG1 VAL 26 60.296 -2.617 3.150 211 HG13 VAL 26 3HG1 VAL 26 61.639 -2.241 2.069 212 HG21 VAL 26 3HG2 VAL 26 60.322 0.892 4.578 213 HG22 VAL 26 1HG2 VAL 26 59.748 -0.695 5.089 214 HG23 VAL 26 2HG2 VAL 26 59.246 -0.031 3.535 215 H LYS 27 H LYS 27 64.221 0.017 4.122 216 HA LYS 27 HA LYS 27 65.536 -1.459 2.166 217 HB2 LYS 27 1HB LYS 27 66.679 0.317 4.329 218 HB3 LYS 27 2HB LYS 27 67.586 -0.274 2.937 219 HG2 LYS 27 1HG LYS 27 64.974 1.107 2.467 220 HG3 LYS 27 2HG LYS 27 66.381 2.089 2.860 221 HD2 LYS 27 1HD LYS 27 67.299 1.769 0.816 222 HD3 LYS 27 2HD LYS 27 66.978 0.038 0.857 223 HE2 LYS 27 1HE LYS 27 65.072 2.238 0.040 224 HE3 LYS 27 2HE LYS 27 65.694 0.926 -0.959 225 HZ1 LYS 27 3HZ LYS 27 63.906 -0.210 -0.361 226 HZ2 LYS 27 1HZ LYS 27 63.467 0.939 0.808 227 HZ3 LYS 27 2HZ LYS 27 64.553 -0.306 1.207 228 H ALA 28 H ALA 28 66.116 -1.431 5.668 229 HA ALA 28 HA ALA 28 68.097 -3.395 5.701 230 HB1 ALA 28 3HB ALA 28 66.142 -3.248 7.951 231 HB2 ALA 28 1HB ALA 28 67.094 -1.812 7.580 232 HB3 ALA 28 2HB ALA 28 67.904 -3.324 7.994 233 H LYS 29 H LYS 29 64.581 -3.620 5.592 234 HA LYS 29 HA LYS 29 64.403 -6.422 6.070 235 HB2 LYS 29 1HB LYS 29 62.585 -4.287 5.347 236 HB3 LYS 29 2HB LYS 29 62.299 -5.676 4.304 237 HG2 LYS 29 1HG LYS 29 61.851 -7.107 6.144 238 HG3 LYS 29 2HG LYS 29 62.557 -5.981 7.302 239 HD2 LYS 29 1HD LYS 29 60.260 -4.964 5.688 240 HD3 LYS 29 2HD LYS 29 59.891 -6.177 6.913 241 HE2 LYS 29 1HE LYS 29 61.626 -3.825 7.622 242 HE3 LYS 29 2HE LYS 29 59.873 -3.646 7.585 243 HZ1 LYS 29 3HZ LYS 29 60.432 -6.015 8.929 244 HZ2 LYS 29 1HZ LYS 29 59.797 -4.581 9.576 245 HZ3 LYS 29 2HZ LYS 29 61.476 -4.837 9.568 246 H ILE 30 H ILE 30 64.928 -4.411 3.211 247 HA ILE 30 HA ILE 30 64.833 -6.543 1.309 248 HB ILE 30 HB ILE 30 66.433 -3.986 1.030 249 HG12 ILE 30 1HG1 ILE 30 64.224 -3.285 1.683 250 HG13 ILE 30 2HG1 ILE 30 64.327 -3.097 -0.064 251 HG21 ILE 30 1HG2 ILE 30 66.371 -6.093 -0.637 252 HG22 ILE 30 2HG2 ILE 30 66.449 -4.437 -1.234 253 HG23 ILE 30 3HG2 ILE 30 64.907 -5.286 -1.187 254 HD11 ILE 30 3HD1 ILE 30 62.256 -4.177 0.246 255 HD12 ILE 30 1HD1 ILE 30 62.891 -5.226 1.514 256 HD13 ILE 30 2HD1 ILE 30 63.347 -5.498 -0.168 257 H GLN 31 H GLN 31 67.350 -5.018 3.243 258 HA GLN 31 HA GLN 31 69.608 -6.319 2.164 259 HB2 GLN 31 1HB GLN 31 69.786 -4.368 3.639 260 HB3 GLN 31 2HB GLN 31 69.108 -5.301 4.972 261 HG2 GLN 31 1HG GLN 31 71.004 -6.768 5.027 262 HG3 GLN 31 2HG GLN 31 71.627 -6.110 3.515 263 HE21 GLN 31 2HE2 GLN 31 71.840 -3.491 3.721 264 HE22 GLN 31 1HE2 GLN 31 72.649 -2.988 5.126 265 H ASP 32 H ASP 32 67.266 -7.280 4.599 266 HA ASP 32 HA ASP 32 68.630 -9.426 5.757 267 HB2 ASP 32 1HB ASP 32 65.676 -8.974 5.338 268 HB3 ASP 32 2HB ASP 32 66.338 -10.272 6.326 269 H LYS 33 H LYS 33 66.776 -9.300 2.743 270 HA LYS 33 HA LYS 33 66.505 -12.075 2.332 271 HB2 LYS 33 1HB LYS 33 66.994 -10.162 0.057 272 HB3 LYS 33 2HB LYS 33 65.938 -11.571 0.105 273 HG2 LYS 33 1HG LYS 33 65.436 -9.164 1.866 274 HG3 LYS 33 2HG LYS 33 64.818 -9.249 0.222 275 HD2 LYS 33 1HD LYS 33 63.469 -11.138 0.703 276 HD3 LYS 33 2HD LYS 33 64.322 -11.467 2.211 277 HE2 LYS 33 1HE LYS 33 63.315 -9.659 3.324 278 HE3 LYS 33 2HE LYS 33 62.865 -8.861 1.817 279 HZ1 LYS 33 3HZ LYS 33 61.228 -10.513 1.398 280 HZ2 LYS 33 1HZ LYS 33 60.995 -9.964 2.986 281 HZ3 LYS 33 2HZ LYS 33 61.749 -11.460 2.708 282 H GLU 34 H GLU 34 69.159 -9.890 1.863 283 HA GLU 34 HA GLU 34 71.060 -12.048 1.658 284 HB2 GLU 34 1HB GLU 34 72.024 -11.029 -0.508 285 HB3 GLU 34 2HB GLU 34 70.589 -12.042 -0.666 286 HG2 GLU 34 1HG GLU 34 69.166 -10.206 -0.996 287 HG3 GLU 34 2HG GLU 34 70.305 -9.073 -0.268 288 H GLY 35 H GLY 35 72.277 -9.362 0.070 289 HA2 GLY 35 1HA GLY 35 72.714 -7.781 2.487 290 HA3 GLY 35 2HA GLY 35 74.151 -8.491 1.760 291 H ILE 36 H ILE 36 72.120 -5.921 1.827 292 HA ILE 36 HA ILE 36 73.550 -4.597 -0.282 293 HB ILE 36 HB ILE 36 70.990 -3.755 -0.901 294 HG12 ILE 36 1HG1 ILE 36 70.390 -6.451 -1.553 295 HG13 ILE 36 2HG1 ILE 36 70.765 -6.448 0.166 296 HG21 ILE 36 1HG2 ILE 36 71.394 -5.137 -3.008 297 HG22 ILE 36 2HG2 ILE 36 72.855 -5.728 -2.216 298 HG23 ILE 36 3HG2 ILE 36 72.672 -4.008 -2.557 299 HD11 ILE 36 3HD1 ILE 36 68.708 -4.767 -1.269 300 HD12 ILE 36 1HD1 ILE 36 69.200 -4.470 0.399 301 HD13 ILE 36 2HD1 ILE 36 68.432 -5.992 -0.035 302 HA PRO 37 HA PRO 37 72.875 -1.895 3.169 303 HB2 PRO 37 1HB PRO 37 74.502 0.133 1.926 304 HB3 PRO 37 2HB PRO 37 74.912 -0.936 3.276 305 HG2 PRO 37 1HG PRO 37 75.993 -1.033 0.716 306 HG3 PRO 37 2HG PRO 37 76.112 -2.292 1.953 307 HD2 PRO 37 1HD PRO 37 74.401 -2.200 -0.464 308 HD3 PRO 37 2HD PRO 37 74.981 -3.598 0.471 309 HA PRO 38 HA PRO 38 69.423 0.529 1.787 310 HB2 PRO 38 1HB PRO 38 69.899 2.619 3.711 311 HB3 PRO 38 2HB PRO 38 68.686 1.340 3.774 312 HG2 PRO 38 1HG PRO 38 71.172 1.565 5.210 313 HG3 PRO 38 2HG PRO 38 69.847 0.421 5.442 314 HD2 PRO 38 1HD PRO 38 72.372 -0.206 4.428 315 HD3 PRO 38 2HD PRO 38 70.921 -1.219 4.276 316 H ASP 39 H ASP 39 72.586 1.944 2.248 317 HA ASP 39 HA ASP 39 72.178 4.487 1.166 318 HB2 ASP 39 1HB ASP 39 74.226 3.771 2.356 319 HB3 ASP 39 2HB ASP 39 74.668 2.781 0.967 320 H GLN 40 H GLN 40 72.635 1.387 -0.450 321 HA GLN 40 HA GLN 40 72.601 2.796 -3.053 322 HB2 GLN 40 1HB GLN 40 73.413 -0.070 -2.569 323 HB3 GLN 40 2HB GLN 40 73.687 0.906 -4.012 324 HG2 GLN 40 1HG GLN 40 74.842 2.442 -2.006 325 HG3 GLN 40 2HG GLN 40 75.234 0.797 -1.512 326 HE21 GLN 40 2HE2 GLN 40 76.043 3.326 -3.733 327 HE22 GLN 40 1HE2 GLN 40 77.156 2.442 -4.662 328 H GLN 41 H GLN 41 70.354 1.549 -1.089 329 HA GLN 41 HA GLN 41 68.919 0.165 -3.282 330 HB2 GLN 41 1HB GLN 41 68.945 -0.230 -0.325 331 HB3 GLN 41 2HB GLN 41 67.448 -0.557 -1.197 332 HG2 GLN 41 1HG GLN 41 69.062 -2.523 -0.921 333 HG3 GLN 41 2HG GLN 41 68.468 -2.214 -2.550 334 HE21 GLN 41 2HE2 GLN 41 70.050 -2.015 -4.139 335 HE22 GLN 41 1HE2 GLN 41 71.691 -1.702 -3.839 336 H ARG 42 H ARG 42 67.222 1.127 -4.157 337 HA ARG 42 HA ARG 42 65.737 3.157 -2.596 338 HB2 ARG 42 1HB ARG 42 66.394 3.387 -5.543 339 HB3 ARG 42 2HB ARG 42 65.572 4.583 -4.539 340 HG2 ARG 42 1HG ARG 42 67.677 4.594 -3.084 341 HG3 ARG 42 2HG ARG 42 68.458 3.701 -4.386 342 HD2 ARG 42 1HD ARG 42 67.991 5.504 -5.960 343 HD3 ARG 42 2HD ARG 42 67.078 6.376 -4.733 344 HE ARG 42 HE ARG 42 69.089 7.156 -3.899 345 HH11 ARG 42 1HH1 ARG 42 70.038 4.138 -3.725 346 HH12 ARG 42 2HH1 ARG 42 71.571 4.281 -4.517 347 HH21 ARG 42 1HH2 ARG 42 70.906 7.419 -5.822 348 HH22 ARG 42 2HH2 ARG 42 72.060 6.133 -5.706 349 H LEU 43 H LEU 43 63.506 3.134 -2.853 350 HA LEU 43 HA LEU 43 62.414 1.056 -4.672 351 HB2 LEU 43 1HB LEU 43 61.075 1.911 -2.110 352 HB3 LEU 43 2HB LEU 43 60.765 0.478 -3.084 353 HG LEU 43 HG LEU 43 63.354 1.017 -1.604 354 HD11 LEU 43 1HD1 LEU 43 62.400 -1.043 -0.269 355 HD12 LEU 43 2HD1 LEU 43 60.844 -0.478 -0.877 356 HD13 LEU 43 3HD1 LEU 43 61.835 0.581 0.126 357 HD21 LEU 43 3HD2 LEU 43 63.552 -1.526 -2.065 358 HD22 LEU 43 1HD2 LEU 43 63.830 -0.431 -3.417 359 HD23 LEU 43 2HD2 LEU 43 62.287 -1.268 -3.266 360 H ILE 44 H ILE 44 60.150 1.446 -5.348 361 HA ILE 44 HA ILE 44 59.404 4.301 -5.405 362 HB ILE 44 HB ILE 44 59.175 2.574 -7.861 363 HG12 ILE 44 1HG1 ILE 44 61.503 4.350 -7.056 364 HG13 ILE 44 2HG1 ILE 44 61.554 2.596 -7.232 365 HG21 ILE 44 1HG2 ILE 44 59.493 5.570 -7.603 366 HG22 ILE 44 2HG2 ILE 44 57.915 4.783 -7.535 367 HG23 ILE 44 3HG2 ILE 44 58.904 4.654 -8.991 368 HD11 ILE 44 3HD1 ILE 44 62.249 3.072 -9.350 369 HD12 ILE 44 1HD1 ILE 44 61.571 4.699 -9.311 370 HD13 ILE 44 2HD1 ILE 44 60.531 3.319 -9.660 371 H PHE 45 H PHE 45 57.208 4.711 -5.423 372 HA PHE 45 HA PHE 45 55.358 2.428 -5.605 373 HB2 PHE 45 1HB PHE 45 55.540 2.440 -3.286 374 HB3 PHE 45 2HB PHE 45 55.808 4.181 -3.212 375 HD1 PHE 45 HD2 PHE 45 53.249 1.551 -3.802 376 HD2 PHE 45 HD1 PHE 45 53.977 5.718 -3.053 377 HE1 PHE 45 HE2 PHE 45 50.825 1.906 -3.408 378 HE2 PHE 45 HE1 PHE 45 51.554 6.072 -2.658 379 HZ PHE 45 HZ PHE 45 49.977 4.164 -2.836 380 H ALA 46 H ALA 46 53.696 2.926 -6.880 381 HA ALA 46 HA ALA 46 52.309 4.167 -8.243 382 HB1 ALA 46 3HB ALA 46 50.912 5.742 -7.062 383 HB2 ALA 46 1HB ALA 46 52.118 5.926 -5.788 384 HB3 ALA 46 2HB ALA 46 51.259 4.396 -5.975 385 H GLY 47 H GLY 47 54.942 4.765 -8.784 386 HA2 GLY 47 1HA GLY 47 56.099 6.332 -10.042 387 HA3 GLY 47 2HA GLY 47 54.701 7.396 -9.915 388 H LYS 48 H LYS 48 54.863 6.895 -6.896 389 HA LYS 48 HA LYS 48 56.514 9.203 -6.323 390 HB2 LYS 48 1HB LYS 48 54.205 8.292 -5.249 391 HB3 LYS 48 2HB LYS 48 55.351 7.595 -4.107 392 HG2 LYS 48 1HG LYS 48 56.244 9.735 -3.545 393 HG3 LYS 48 2HG LYS 48 55.443 10.514 -4.908 394 HD2 LYS 48 1HD LYS 48 53.925 9.149 -2.676 395 HD3 LYS 48 2HD LYS 48 54.338 10.861 -2.635 396 HE2 LYS 48 1HE LYS 48 52.403 9.415 -4.408 397 HE3 LYS 48 2HE LYS 48 52.227 10.965 -3.592 398 HZ1 LYS 48 3HZ LYS 48 53.796 10.364 -6.028 399 HZ2 LYS 48 1HZ LYS 48 53.984 11.804 -5.151 400 HZ3 LYS 48 2HZ LYS 48 52.487 11.435 -5.863 401 H GLN 49 H GLN 49 58.633 9.019 -6.031 402 HA GLN 49 HA GLN 49 59.911 6.515 -5.522 403 HB2 GLN 49 1HB GLN 49 61.963 8.034 -5.232 404 HB3 GLN 49 2HB GLN 49 61.176 8.030 -6.809 405 HG2 GLN 49 1HG GLN 49 60.298 10.024 -4.737 406 HG3 GLN 49 2HG GLN 49 61.778 10.319 -5.644 407 HE21 GLN 49 2HE2 GLN 49 61.249 9.591 -8.208 408 HE22 GLN 49 1HE2 GLN 49 59.891 10.406 -8.818 409 H LEU 50 H LEU 50 60.289 5.557 -3.633 410 HA LEU 50 HA LEU 50 59.632 6.910 -1.168 411 HB2 LEU 50 1HB LEU 50 60.668 4.126 -1.778 412 HB3 LEU 50 2HB LEU 50 60.301 4.687 -0.148 413 HG LEU 50 HG LEU 50 58.362 4.485 -2.479 414 HD11 LEU 50 1HD1 LEU 50 57.206 2.862 -1.041 415 HD12 LEU 50 2HD1 LEU 50 58.430 3.084 0.208 416 HD13 LEU 50 3HD1 LEU 50 58.870 2.357 -1.335 417 HD21 LEU 50 3HD2 LEU 50 57.443 6.316 -1.431 418 HD22 LEU 50 1HD2 LEU 50 58.204 5.951 0.116 419 HD23 LEU 50 2HD2 LEU 50 56.764 5.068 -0.390 420 H GLU 51 H GLU 51 61.009 7.732 0.319 421 HA GLU 51 HA GLU 51 63.700 8.288 -0.634 422 HB2 GLU 51 1HB GLU 51 61.792 9.545 1.269 423 HB3 GLU 51 2HB GLU 51 63.504 9.890 1.481 424 HG2 GLU 51 1HG GLU 51 62.772 11.583 0.016 425 HG3 GLU 51 2HG GLU 51 63.516 10.404 -1.060 426 H ASP 52 H ASP 52 65.037 9.073 1.350 427 HA ASP 52 HA ASP 52 66.623 7.072 2.277 428 HB2 ASP 52 1HB ASP 52 66.875 9.676 2.275 429 HB3 ASP 52 2HB ASP 52 66.318 9.532 3.940 430 H GLY 53 H GLY 53 63.541 7.102 3.267 431 HA2 GLY 53 1HA GLY 53 63.065 5.419 5.087 432 HA3 GLY 53 2HA GLY 53 64.263 6.278 6.018 433 H ARG 54 H ARG 54 61.757 7.538 3.932 434 HA ARG 54 HA ARG 54 60.649 9.199 6.076 435 HB2 ARG 54 1HB ARG 54 60.296 8.973 3.097 436 HB3 ARG 54 2HB ARG 54 58.897 9.500 4.032 437 HG2 ARG 54 1HG ARG 54 60.274 11.417 3.249 438 HG3 ARG 54 2HG ARG 54 60.199 11.329 5.009 439 HD2 ARG 54 1HD ARG 54 62.427 10.909 5.194 440 HD3 ARG 54 2HD ARG 54 62.423 9.792 3.832 441 HE ARG 54 HE ARG 54 62.106 12.358 2.777 442 HH11 ARG 54 1HH2 ARG 54 64.272 11.481 5.216 443 HH12 ARG 54 2HH2 ARG 54 65.704 11.924 4.350 444 HH21 ARG 54 1HH1 ARG 54 64.031 12.527 1.370 445 HH22 ARG 54 2HH1 ARG 54 65.568 12.518 2.167 446 H THR 55 H THR 55 58.192 8.752 6.539 447 HA THR 55 HA THR 55 57.980 5.853 6.703 448 HB THR 55 HB THR 55 56.198 8.071 7.692 449 HG1 THR 55 HG1 THR 55 57.620 8.071 9.207 450 HG21 THR 55 3HG2 THR 55 54.837 6.110 7.349 451 HG22 THR 55 1HG2 THR 55 55.182 6.237 9.071 452 HG23 THR 55 2HG2 THR 55 56.065 5.082 8.082 453 H LEU 56 H LEU 56 56.527 4.566 5.770 454 HA LEU 56 HA LEU 56 55.362 5.422 3.313 455 HB2 LEU 56 1HB LEU 56 56.088 2.936 4.529 456 HB3 LEU 56 2HB LEU 56 54.508 2.819 3.758 457 HG LEU 56 HG LEU 56 55.525 3.891 1.706 458 HD11 LEU 56 1HD1 LEU 56 57.598 4.473 3.481 459 HD12 LEU 56 2HD1 LEU 56 57.618 4.695 1.736 460 HD13 LEU 56 3HD1 LEU 56 58.256 3.213 2.439 461 HD21 LEU 56 3HD2 LEU 56 55.945 1.828 0.890 462 HD22 LEU 56 1HD2 LEU 56 55.704 1.223 2.527 463 HD23 LEU 56 2HD2 LEU 56 57.328 1.604 1.958 464 H SER 57 H SER 57 54.121 4.718 6.503 465 HA SER 57 HA SER 57 51.419 4.391 5.852 466 HB2 SER 57 1HB SER 57 51.943 4.027 8.130 467 HB3 SER 57 2HB SER 57 52.800 5.559 8.271 468 HG SER 57 HG SER 57 50.925 6.158 9.057 469 H ASP 58 H ASP 58 53.498 7.156 6.083 470 HA ASP 58 HA ASP 58 51.454 9.144 5.732 471 HB2 ASP 58 1HB ASP 58 54.464 9.129 5.574 472 HB3 ASP 58 2HB ASP 58 53.544 10.536 5.044 473 H TYR 59 H TYR 59 53.370 7.045 3.732 474 HA TYR 59 HA TYR 59 52.884 8.465 1.265 475 HB2 TYR 59 1HB TYR 59 54.221 5.903 2.025 476 HB3 TYR 59 2HB TYR 59 53.683 6.089 0.365 477 HD1 TYR 59 HD1 TYR 59 54.150 8.588 -0.561 478 HD2 TYR 59 HD2 TYR 59 56.443 6.537 2.421 479 HE1 TYR 59 HE1 TYR 59 56.103 10.025 -1.076 480 HE2 TYR 59 HE2 TYR 59 58.397 7.966 1.913 481 HH TYR 59 HH TYR 59 59.256 9.431 0.394 482 H ASN 60 H ASN 60 50.877 6.851 3.242 483 HA ASN 60 HA ASN 60 48.819 5.861 2.990 484 HB2 ASN 60 1HB ASN 60 48.869 6.856 0.144 485 HB3 ASN 60 2HB ASN 60 47.474 6.623 1.196 486 HD21 ASN 60 2HD2 ASN 60 49.866 8.905 0.182 487 HD22 ASN 60 1HD2 ASN 60 49.464 10.134 1.281 488 H ILE 61 H ILE 61 50.968 4.117 2.649 489 HA ILE 61 HA ILE 61 50.832 2.678 0.215 490 HB ILE 61 HB ILE 61 51.777 1.751 2.923 491 HG12 ILE 61 1HG1 ILE 61 53.086 3.612 2.081 492 HG13 ILE 61 2HG1 ILE 61 53.990 2.128 1.862 493 HG21 ILE 61 1HG2 ILE 61 51.408 -0.246 1.754 494 HG22 ILE 61 2HG2 ILE 61 53.077 0.128 1.326 495 HG23 ILE 61 3HG2 ILE 61 51.774 0.485 0.191 496 HD11 ILE 61 3HD1 ILE 61 54.287 3.100 -0.221 497 HD12 ILE 61 1HD1 ILE 61 52.693 3.849 -0.206 498 HD13 ILE 61 2HD1 ILE 61 52.855 2.120 -0.521 499 H GLN 62 H GLN 62 49.772 1.008 -0.432 500 HA GLN 62 HA GLN 62 47.228 0.463 0.859 501 HB2 GLN 62 1HB GLN 62 47.365 1.192 -1.491 502 HB3 GLN 62 2HB GLN 62 48.282 -0.256 -1.884 503 HG2 GLN 62 1HG GLN 62 46.437 -1.672 -1.522 504 HG3 GLN 62 2HG GLN 62 45.576 -0.462 -0.570 505 HE21 GLN 62 2HE2 GLN 62 46.213 1.697 -2.614 506 HE22 GLN 62 1HE2 GLN 62 45.175 1.374 -3.916 507 H LYS 63 H LYS 63 46.369 -1.691 0.159 508 HA LYS 63 HA LYS 63 47.016 -3.703 1.801 509 HB2 LYS 63 1HB LYS 63 45.745 -3.891 -0.922 510 HB3 LYS 63 2HB LYS 63 45.725 -5.176 0.283 511 HG2 LYS 63 1HG LYS 63 44.784 -3.308 1.874 512 HG3 LYS 63 2HG LYS 63 44.386 -2.481 0.369 513 HD2 LYS 63 1HD LYS 63 42.922 -4.207 -0.327 514 HD3 LYS 63 2HD LYS 63 43.583 -5.356 0.838 515 HE2 LYS 63 1HE LYS 63 41.358 -4.445 1.530 516 HE3 LYS 63 2HE LYS 63 42.639 -4.094 2.691 517 HZ1 LYS 63 3HZ LYS 63 42.434 -2.084 0.675 518 HZ2 LYS 63 1HZ LYS 63 42.413 -1.923 2.362 519 HZ3 LYS 63 2HZ LYS 63 40.976 -2.270 1.526 520 H GLU 64 H GLU 64 49.560 -2.924 0.363 521 HA GLU 64 HA GLU 64 51.480 -4.231 0.054 522 HB2 GLU 64 1HB GLU 64 51.469 -6.541 -0.056 523 HB3 GLU 64 2HB GLU 64 50.022 -6.213 0.882 524 HG2 GLU 64 1HG GLU 64 48.900 -7.486 -0.617 525 HG3 GLU 64 2HG GLU 64 49.108 -6.179 -1.773 526 H SER 65 H SER 65 50.770 -2.456 -1.577 527 HA SER 65 HA SER 65 50.286 -3.087 -4.279 528 HB2 SER 65 1HB SER 65 50.939 -0.872 -4.714 529 HB3 SER 65 2HB SER 65 50.257 -0.818 -3.090 530 HG SER 65 HG SER 65 53.006 -1.283 -3.532 531 H THR 66 H THR 66 51.767 -3.134 -6.035 532 HA THR 66 HA THR 66 54.282 -4.469 -5.420 533 HB THR 66 HB THR 66 53.193 -5.512 -7.200 534 HG1 THR 66 HG1 THR 66 55.407 -4.461 -7.649 535 HG21 THR 66 3HG2 THR 66 51.411 -3.939 -7.579 536 HG22 THR 66 1HG2 THR 66 52.232 -4.182 -9.119 537 HG23 THR 66 2HG2 THR 66 52.542 -2.725 -8.177 538 H LEU 67 H LEU 67 56.089 -3.289 -5.071 539 HA LEU 67 HA LEU 67 56.342 -0.640 -6.352 540 HB2 LEU 67 1HB LEU 67 57.883 -1.937 -4.083 541 HB3 LEU 67 2HB LEU 67 58.352 -0.410 -4.822 542 HG LEU 67 HG LEU 67 55.937 0.362 -4.324 543 HD11 LEU 67 1HD1 LEU 67 56.139 -2.164 -2.675 544 HD12 LEU 67 2HD1 LEU 67 54.843 -1.672 -3.766 545 HD13 LEU 67 3HD1 LEU 67 55.060 -0.845 -2.225 546 HD21 LEU 67 3HD2 LEU 67 56.580 0.787 -1.881 547 HD22 LEU 67 1HD2 LEU 67 57.742 1.324 -3.095 548 HD23 LEU 67 2HD2 LEU 67 58.026 -0.172 -2.201 549 H HIS 68 H HIS 68 57.895 -0.223 -7.859 550 HA HIS 68 HA HIS 68 59.144 -2.518 -9.113 551 HB2 HIS 68 1HB HIS 68 59.348 0.412 -9.831 552 HB3 HIS 68 2HB HIS 68 59.798 -0.957 -10.849 553 HD1 HIS 68 HD1 HIS 68 57.256 -2.713 -10.025 554 HD2 HIS 68 HD2 HIS 68 57.165 1.201 -11.454 555 HE1 HIS 68 HE1 HIS 68 54.955 -2.370 -11.024 556 H LEU 69 H LEU 69 61.284 -2.966 -9.285 557 HA LEU 69 HA LEU 69 63.141 -1.352 -7.639 558 HB2 LEU 69 1HB LEU 69 62.413 -3.806 -6.931 559 HB3 LEU 69 2HB LEU 69 63.608 -4.270 -8.137 560 HG LEU 69 HG LEU 69 64.709 -4.150 -5.984 561 HD11 LEU 69 1HD1 LEU 69 65.833 -3.207 -8.073 562 HD12 LEU 69 2HD1 LEU 69 66.499 -2.670 -6.530 563 HD13 LEU 69 3HD1 LEU 69 65.435 -1.606 -7.449 564 HD21 LEU 69 3HD2 LEU 69 64.397 -2.488 -4.427 565 HD22 LEU 69 1HD2 LEU 69 62.868 -2.289 -5.280 566 HD23 LEU 69 2HD2 LEU 69 64.226 -1.225 -5.645 567 H VAL 70 H VAL 70 64.555 -0.329 -8.910 568 HA VAL 70 HA VAL 70 65.776 -1.799 -11.147 569 HB VAL 70 HB VAL 70 65.533 0.818 -12.111 570 HG11 VAL 70 1HG1 VAL 70 63.960 -1.704 -12.696 571 HG12 VAL 70 2HG1 VAL 70 65.412 -1.135 -13.519 572 HG13 VAL 70 3HG1 VAL 70 63.895 -0.256 -13.700 573 HG21 VAL 70 3HG2 VAL 70 63.185 1.366 -11.944 574 HG22 VAL 70 1HG2 VAL 70 63.806 1.154 -10.307 575 HG23 VAL 70 2HG2 VAL 70 62.851 -0.123 -11.060 576 H LEU 71 H LEU 71 67.834 -1.044 -11.756 577 HA LEU 71 HA LEU 71 69.192 0.513 -9.649 578 HB2 LEU 71 1HB LEU 71 70.154 -1.523 -11.658 579 HB3 LEU 71 2HB LEU 71 71.272 -0.486 -10.772 580 HG LEU 71 HG LEU 71 69.178 -1.955 -9.208 581 HD11 LEU 71 1HD1 LEU 71 71.702 -3.208 -10.331 582 HD12 LEU 71 2HD1 LEU 71 70.044 -3.710 -10.661 583 HD13 LEU 71 3HD1 LEU 71 70.721 -3.914 -9.046 584 HD21 LEU 71 3HD2 LEU 71 70.913 -1.929 -7.508 585 HD22 LEU 71 1HD2 LEU 71 70.802 -0.311 -8.202 586 HD23 LEU 71 2HD2 LEU 71 72.113 -1.389 -8.682 587 H ARG 72 H ARG 72 68.710 0.274 -13.136 588 HA ARG 72 HA ARG 72 70.460 2.442 -13.804 589 HB2 ARG 72 1HB ARG 72 68.153 1.373 -15.442 590 HB3 ARG 72 2HB ARG 72 69.579 2.230 -16.028 591 HG2 ARG 72 1HG ARG 72 71.021 0.384 -15.332 592 HG3 ARG 72 2HG ARG 72 69.641 -0.462 -14.630 593 HD2 ARG 72 1HD ARG 72 69.746 0.331 -17.545 594 HD3 ARG 72 2HD ARG 72 70.353 -1.218 -16.965 595 HE ARG 72 HE ARG 72 67.608 -0.552 -16.213 596 HH11 ARG 72 1HH2 ARG 72 68.783 -3.356 -16.386 597 HH12 ARG 72 2HH2 ARG 72 68.039 -3.958 -17.829 598 HH21 ARG 72 1HH1 ARG 72 67.060 -0.826 -18.949 599 HH22 ARG 72 2HH1 ARG 72 67.068 -2.526 -19.282 Start of MODEL 6 1 H1 MET 1 1H MET 1 49.915 -1.342 4.315 2 H2 MET 1 2H MET 1 48.282 -1.810 4.346 3 H3 MET 1 3H MET 1 49.388 -2.640 3.359 4 HA MET 1 HA MET 1 49.545 -2.550 6.316 5 HB2 MET 1 1HB MET 1 47.600 -3.834 4.868 6 HB3 MET 1 2HB MET 1 48.841 -5.081 4.951 7 HG2 MET 1 1HG MET 1 47.594 -5.456 6.903 8 HG3 MET 1 2HG MET 1 48.944 -4.480 7.488 9 HE1 MET 1 3HE MET 1 48.368 -2.719 9.260 10 HE2 MET 1 1HE MET 1 47.497 -4.236 9.526 11 HE3 MET 1 2HE MET 1 46.679 -2.694 9.764 12 H GLN 2 H GLN 2 50.201 -4.847 3.695 13 HA GLN 2 HA GLN 2 52.937 -5.223 4.714 14 HB2 GLN 2 1HB GLN 2 51.079 -6.895 3.037 15 HB3 GLN 2 2HB GLN 2 52.810 -7.220 3.059 16 HG2 GLN 2 1HG GLN 2 51.981 -8.610 4.764 17 HG3 GLN 2 2HG GLN 2 52.557 -7.201 5.648 18 HE21 GLN 2 2HE2 GLN 2 49.519 -7.633 3.756 19 HE22 GLN 2 1HE2 GLN 2 48.488 -7.295 5.062 20 H ILE 3 H ILE 3 54.621 -5.651 2.988 21 HA ILE 3 HA ILE 3 54.209 -3.819 0.690 22 HB ILE 3 HB ILE 3 56.608 -4.226 2.463 23 HG12 ILE 3 1HG1 ILE 3 54.659 -2.139 1.911 24 HG13 ILE 3 2HG1 ILE 3 55.858 -2.214 3.182 25 HG21 ILE 3 1HG2 ILE 3 57.410 -4.612 0.172 26 HG22 ILE 3 2HG2 ILE 3 57.966 -3.044 0.741 27 HG23 ILE 3 3HG2 ILE 3 56.604 -3.142 -0.375 28 HD11 ILE 3 3HD1 ILE 3 57.265 -0.801 2.096 29 HD12 ILE 3 1HD1 ILE 3 55.844 -0.381 1.147 30 HD13 ILE 3 2HD1 ILE 3 56.986 -1.561 0.534 31 H PHE 4 H PHE 4 55.206 -4.368 -1.247 32 HA PHE 4 HA PHE 4 56.145 -7.151 -1.517 33 HB2 PHE 4 1HB PHE 4 53.725 -7.042 -1.978 34 HB3 PHE 4 2HB PHE 4 54.023 -5.825 -3.206 35 HD1 PHE 4 HD1 PHE 4 55.249 -9.211 -2.218 36 HD2 PHE 4 HD2 PHE 4 54.206 -6.540 -5.403 37 HE1 PHE 4 HE1 PHE 4 55.689 -11.010 -3.867 38 HE2 PHE 4 HE2 PHE 4 54.650 -8.329 -7.059 39 HZ PHE 4 HZ PHE 4 55.392 -10.569 -6.289 40 H VAL 5 H VAL 5 57.853 -7.336 -2.848 41 HA VAL 5 HA VAL 5 58.440 -5.134 -4.736 42 HB VAL 5 HB VAL 5 60.367 -6.544 -2.879 43 HG11 VAL 5 1HG1 VAL 5 61.593 -6.263 -4.870 44 HG12 VAL 5 2HG1 VAL 5 61.961 -4.801 -3.953 45 HG13 VAL 5 3HG1 VAL 5 60.779 -4.747 -5.262 46 HG21 VAL 5 3HG2 VAL 5 59.825 -3.584 -3.129 47 HG22 VAL 5 1HG2 VAL 5 60.607 -4.445 -1.805 48 HG23 VAL 5 2HG2 VAL 5 58.869 -4.607 -2.056 49 H LYS 6 H LYS 6 59.206 -5.747 -6.721 50 HA LYS 6 HA LYS 6 59.683 -8.636 -7.158 51 HB2 LYS 6 1HB LYS 6 57.407 -7.502 -7.989 52 HB3 LYS 6 2HB LYS 6 58.433 -7.020 -9.337 53 HG2 LYS 6 1HG LYS 6 59.175 -9.580 -9.235 54 HG3 LYS 6 2HG LYS 6 57.596 -9.764 -8.471 55 HD2 LYS 6 1HD LYS 6 56.694 -8.375 -10.472 56 HD3 LYS 6 2HD LYS 6 58.234 -8.752 -11.243 57 HE2 LYS 6 1HE LYS 6 57.346 -11.213 -10.216 58 HE3 LYS 6 2HE LYS 6 55.899 -10.458 -10.883 59 HZ1 LYS 6 3HZ LYS 6 57.151 -11.768 -12.524 60 HZ2 LYS 6 1HZ LYS 6 58.476 -10.726 -12.332 61 HZ3 LYS 6 2HZ LYS 6 57.014 -10.132 -12.962 62 H THR 7 H THR 7 61.272 -9.167 -8.618 63 HA THR 7 HA THR 7 62.906 -6.917 -9.647 64 HB THR 7 HB THR 7 64.794 -8.628 -9.562 65 HG1 THR 7 HG1 THR 7 64.431 -10.483 -8.572 66 HG21 THR 7 3HG2 THR 7 64.779 -6.903 -7.916 67 HG22 THR 7 1HG2 THR 7 64.990 -8.409 -7.024 68 HG23 THR 7 2HG2 THR 7 63.411 -7.625 -7.069 69 H LEU 8 H LEU 8 64.340 -7.710 -11.541 70 HA LEU 8 HA LEU 8 62.654 -8.404 -13.690 71 HB2 LEU 8 1HB LEU 8 65.650 -8.279 -13.377 72 HB3 LEU 8 2HB LEU 8 64.905 -8.787 -14.893 73 HG LEU 8 HG LEU 8 63.930 -6.258 -13.597 74 HD11 LEU 8 1HD1 LEU 8 65.689 -4.976 -14.774 75 HD12 LEU 8 2HD1 LEU 8 66.463 -6.485 -15.254 76 HD13 LEU 8 3HD1 LEU 8 66.384 -6.039 -13.551 77 HD21 LEU 8 3HD2 LEU 8 63.412 -5.651 -15.856 78 HD22 LEU 8 1HD2 LEU 8 62.944 -7.345 -15.698 79 HD23 LEU 8 2HD2 LEU 8 64.451 -6.918 -16.509 80 H THR 9 H THR 9 63.901 -10.341 -11.264 81 HA THR 9 HA THR 9 64.137 -12.745 -12.924 82 HB THR 9 HB THR 9 64.989 -13.830 -10.976 83 HG1 THR 9 HG1 THR 9 64.894 -11.906 -9.155 84 HG21 THR 9 3HG2 THR 9 66.405 -12.025 -12.126 85 HG22 THR 9 1HG2 THR 9 66.902 -12.507 -10.502 86 HG23 THR 9 2HG2 THR 9 66.016 -11.001 -10.742 87 H GLY 10 H GLY 10 61.765 -11.055 -11.230 88 HA2 GLY 10 1HA GLY 10 59.520 -11.541 -10.954 89 HA3 GLY 10 2HA GLY 10 59.813 -13.126 -11.664 90 H LYS 11 H LYS 11 62.028 -12.580 -9.223 91 HA LYS 11 HA LYS 11 61.039 -14.626 -7.559 92 HB2 LYS 11 1HB LYS 11 63.431 -13.719 -7.721 93 HB3 LYS 11 2HB LYS 11 62.894 -12.433 -6.639 94 HG2 LYS 11 1HG LYS 11 63.686 -14.013 -5.115 95 HG3 LYS 11 2HG LYS 11 61.971 -14.416 -5.181 96 HD2 LYS 11 1HD LYS 11 62.878 -15.949 -7.234 97 HD3 LYS 11 2HD LYS 11 64.315 -15.933 -6.213 98 HE2 LYS 11 1HE LYS 11 61.524 -16.745 -5.350 99 HE3 LYS 11 2HE LYS 11 62.890 -17.830 -5.609 100 HZ1 LYS 11 3HZ LYS 11 63.993 -16.158 -3.910 101 HZ2 LYS 11 1HZ LYS 11 63.104 -17.507 -3.394 102 HZ3 LYS 11 2HZ LYS 11 62.378 -15.970 -3.420 103 H THR 12 H THR 12 59.644 -14.651 -5.904 104 HA THR 12 HA THR 12 58.225 -12.182 -5.243 105 HB THR 12 HB THR 12 56.912 -14.201 -5.697 106 HG1 THR 12 HG1 THR 12 56.924 -13.423 -2.970 107 HG21 THR 12 3HG2 THR 12 58.856 -15.663 -4.662 108 HG22 THR 12 1HG2 THR 12 57.185 -16.218 -4.572 109 HG23 THR 12 2HG2 THR 12 57.936 -15.455 -3.172 110 H ILE 13 H ILE 13 58.964 -10.949 -3.657 111 HA ILE 13 HA ILE 13 60.184 -12.239 -1.289 112 HB ILE 13 HB ILE 13 61.629 -10.816 -2.950 113 HG12 ILE 13 1HG1 ILE 13 61.808 -10.033 -0.039 114 HG13 ILE 13 2HG1 ILE 13 62.197 -11.667 -0.577 115 HG21 ILE 13 1HG2 ILE 13 60.524 -8.593 -1.228 116 HG22 ILE 13 2HG2 ILE 13 59.939 -8.914 -2.861 117 HG23 ILE 13 3HG2 ILE 13 61.623 -8.463 -2.603 118 HD11 ILE 13 3HD1 ILE 13 63.445 -9.582 -2.234 119 HD12 ILE 13 1HD1 ILE 13 64.162 -11.013 -1.496 120 HD13 ILE 13 2HD1 ILE 13 63.964 -9.540 -0.552 121 H THR 14 H THR 14 59.009 -11.988 0.498 122 HA THR 14 HA THR 14 57.208 -9.641 0.692 123 HB THR 14 HB THR 14 55.908 -11.172 2.284 124 HG1 THR 14 HG1 THR 14 57.287 -12.820 2.614 125 HG21 THR 14 3HG2 THR 14 54.750 -12.267 0.405 126 HG22 THR 14 1HG2 THR 14 56.120 -11.910 -0.647 127 HG23 THR 14 2HG2 THR 14 55.148 -10.594 0.012 128 H LEU 15 H LEU 15 57.336 -8.361 2.446 129 HA LEU 15 HA LEU 15 59.201 -9.158 4.610 130 HB2 LEU 15 1HB LEU 15 58.871 -6.341 4.663 131 HB3 LEU 15 2HB LEU 15 60.313 -7.240 4.195 132 HG LEU 15 HG LEU 15 58.034 -6.631 2.294 133 HD11 LEU 15 1HD1 LEU 15 59.849 -5.001 1.361 134 HD12 LEU 15 2HD1 LEU 15 60.535 -5.101 2.982 135 HD13 LEU 15 3HD1 LEU 15 58.896 -4.497 2.756 136 HD21 LEU 15 3HD2 LEU 15 60.179 -8.446 2.142 137 HD22 LEU 15 1HD2 LEU 15 60.700 -7.064 1.180 138 HD23 LEU 15 2HD2 LEU 15 59.187 -7.883 0.799 139 H GLU 16 H GLU 16 58.585 -8.739 6.744 140 HA GLU 16 HA GLU 16 55.687 -8.316 7.061 141 HB2 GLU 16 1HB GLU 16 57.813 -9.284 8.997 142 HB3 GLU 16 2HB GLU 16 56.117 -9.046 9.417 143 HG2 GLU 16 1HG GLU 16 55.453 -10.682 7.700 144 HG3 GLU 16 2HG GLU 16 57.145 -10.920 7.269 145 H VAL 17 H VAL 17 55.170 -6.266 7.220 146 HA VAL 17 HA VAL 17 56.648 -4.558 9.090 147 HB VAL 17 HB VAL 17 57.677 -4.252 6.862 148 HG11 VAL 17 1HG1 VAL 17 56.383 -3.440 5.004 149 HG12 VAL 17 2HG1 VAL 17 54.949 -3.240 6.011 150 HG13 VAL 17 3HG1 VAL 17 55.538 -4.856 5.628 151 HG21 VAL 17 3HG2 VAL 17 57.078 -2.351 8.624 152 HG22 VAL 17 1HG2 VAL 17 56.026 -1.797 7.327 153 HG23 VAL 17 2HG2 VAL 17 57.757 -1.943 7.055 154 H GLU 18 H GLU 18 55.608 -2.389 9.229 155 HA GLU 18 HA GLU 18 52.666 -2.640 9.167 156 HB2 GLU 18 1HB GLU 18 52.830 -0.637 10.769 157 HB3 GLU 18 2HB GLU 18 53.374 -2.186 11.409 158 HG2 GLU 18 1HG GLU 18 55.367 -0.410 10.038 159 HG3 GLU 18 2HG GLU 18 54.869 -0.015 11.680 160 HA PRO 19 HA PRO 19 52.476 0.243 5.900 161 HB2 PRO 19 1HB PRO 19 50.710 2.142 7.124 162 HB3 PRO 19 2HB PRO 19 50.328 0.896 5.927 163 HG2 PRO 19 1HG PRO 19 49.832 0.921 8.769 164 HG3 PRO 19 2HG PRO 19 49.213 -0.177 7.530 165 HD2 PRO 19 1HD PRO 19 51.083 -0.833 9.481 166 HD3 PRO 19 2HD PRO 19 50.780 -1.752 8.000 167 H SER 20 H SER 20 53.711 1.220 9.014 168 HA SER 20 HA SER 20 54.128 3.939 8.095 169 HB2 SER 20 1HB SER 20 54.119 3.117 10.566 170 HB3 SER 20 2HB SER 20 55.770 2.597 10.243 171 HG SER 20 HG SER 20 56.391 4.617 10.192 172 H ASP 21 H ASP 21 55.666 0.822 7.982 173 HA ASP 21 HA ASP 21 57.753 0.264 7.026 174 HB2 ASP 21 1HB ASP 21 55.690 1.185 5.175 175 HB3 ASP 21 2HB ASP 21 57.311 1.124 4.491 176 H THR 22 H THR 22 59.033 2.164 8.340 177 HA THR 22 HA THR 22 59.392 4.407 6.525 178 HB THR 22 HB THR 22 60.201 5.459 8.355 179 HG1 THR 22 HG1 THR 22 62.019 3.352 8.210 180 HG21 THR 22 3HG2 THR 22 59.940 4.362 10.533 181 HG22 THR 22 1HG2 THR 22 59.830 2.790 9.742 182 HG23 THR 22 2HG2 THR 22 58.568 3.992 9.489 183 H ILE 23 H ILE 23 60.818 4.610 5.093 184 HA ILE 23 HA ILE 23 62.014 2.454 3.926 185 HB ILE 23 HB ILE 23 63.165 5.164 3.428 186 HG12 ILE 23 1HG1 ILE 23 60.272 4.324 2.979 187 HG13 ILE 23 2HG1 ILE 23 60.809 5.615 4.040 188 HG21 ILE 23 1HG2 ILE 23 63.181 2.758 2.076 189 HG22 ILE 23 2HG2 ILE 23 63.469 4.327 1.334 190 HG23 ILE 23 3HG2 ILE 23 61.857 3.612 1.292 191 HD11 ILE 23 3HD1 ILE 23 59.946 6.123 1.587 192 HD12 ILE 23 1HD1 ILE 23 61.614 5.754 1.174 193 HD13 ILE 23 2HD1 ILE 23 61.255 7.056 2.304 194 H GLU 24 H GLU 24 63.464 4.751 6.189 195 HA GLU 24 HA GLU 24 66.076 3.630 5.975 196 HB2 GLU 24 1HB GLU 24 65.277 5.813 7.218 197 HB3 GLU 24 2HB GLU 24 64.969 4.716 8.564 198 HG2 GLU 24 1HG GLU 24 67.285 3.956 8.529 199 HG3 GLU 24 2HG GLU 24 67.614 4.935 7.100 200 H ASN 25 H ASN 25 63.062 2.840 7.495 201 HA ASN 25 HA ASN 25 64.047 0.713 9.176 202 HB2 ASN 25 1HB ASN 25 61.953 2.154 9.554 203 HB3 ASN 25 2HB ASN 25 61.170 1.096 8.385 204 HD21 ASN 25 2HD2 ASN 25 63.607 0.269 10.902 205 HD22 ASN 25 1HD2 ASN 25 62.614 -0.854 11.697 206 H VAL 26 H VAL 26 62.272 0.896 6.105 207 HA VAL 26 HA VAL 26 62.035 -1.931 5.810 208 HB VAL 26 HB VAL 26 61.895 0.052 3.546 209 HG11 VAL 26 1HG1 VAL 26 60.411 -1.553 2.578 210 HG12 VAL 26 2HG1 VAL 26 60.256 -2.429 4.101 211 HG13 VAL 26 3HG1 VAL 26 61.775 -2.480 3.207 212 HG21 VAL 26 3HG2 VAL 26 59.357 -0.017 4.256 213 HG22 VAL 26 1HG2 VAL 26 60.452 1.105 5.052 214 HG23 VAL 26 2HG2 VAL 26 60.010 -0.403 5.848 215 H LYS 27 H LYS 27 64.403 0.456 4.802 216 HA LYS 27 HA LYS 27 65.731 -0.872 2.783 217 HB2 LYS 27 1HB LYS 27 66.347 1.251 4.676 218 HB3 LYS 27 2HB LYS 27 67.775 0.287 4.326 219 HG2 LYS 27 1HG LYS 27 67.618 2.088 2.694 220 HG3 LYS 27 2HG LYS 27 67.307 0.552 1.887 221 HD2 LYS 27 1HD LYS 27 64.770 1.167 2.586 222 HD3 LYS 27 2HD LYS 27 65.433 2.795 2.486 223 HE2 LYS 27 1HE LYS 27 65.763 0.753 0.277 224 HE3 LYS 27 2HE LYS 27 64.435 1.912 0.330 225 HZ1 LYS 27 3HZ LYS 27 65.967 3.715 0.283 226 HZ2 LYS 27 1HZ LYS 27 66.377 2.663 -0.983 227 HZ3 LYS 27 2HZ LYS 27 67.300 2.673 0.444 228 H ALA 28 H ALA 28 66.294 -1.218 6.286 229 HA ALA 28 HA ALA 28 68.296 -3.215 5.953 230 HB1 ALA 28 3HB ALA 28 68.364 -3.303 8.253 231 HB2 ALA 28 1HB ALA 28 66.619 -3.111 8.421 232 HB3 ALA 28 2HB ALA 28 67.627 -1.717 8.031 233 H LYS 29 H LYS 29 64.785 -3.250 6.245 234 HA LYS 29 HA LYS 29 64.496 -6.061 6.604 235 HB2 LYS 29 1HB LYS 29 62.555 -4.059 5.412 236 HB3 LYS 29 2HB LYS 29 62.155 -5.720 5.842 237 HG2 LYS 29 1HG LYS 29 62.815 -5.256 8.189 238 HG3 LYS 29 2HG LYS 29 63.141 -3.579 7.750 239 HD2 LYS 29 1HD LYS 29 60.699 -3.573 6.847 240 HD3 LYS 29 2HD LYS 29 60.495 -5.021 7.834 241 HE2 LYS 29 1HE LYS 29 61.631 -3.500 9.695 242 HE3 LYS 29 2HE LYS 29 60.991 -2.197 8.692 243 HZ1 LYS 29 3HZ LYS 29 58.830 -3.527 8.764 244 HZ2 LYS 29 1HZ LYS 29 59.277 -2.674 10.161 245 HZ3 LYS 29 2HZ LYS 29 59.526 -4.353 10.077 246 H ILE 30 H ILE 30 64.807 -3.941 3.805 247 HA ILE 30 HA ILE 30 64.145 -5.835 1.815 248 HB ILE 30 HB ILE 30 66.095 -3.516 1.644 249 HG12 ILE 30 1HG1 ILE 30 63.997 -2.553 2.205 250 HG13 ILE 30 2HG1 ILE 30 64.067 -2.445 0.454 251 HG21 ILE 30 1HG2 ILE 30 66.551 -4.687 -0.288 252 HG22 ILE 30 2HG2 ILE 30 65.161 -3.758 -0.846 253 HG23 ILE 30 3HG2 ILE 30 64.956 -5.436 -0.345 254 HD11 ILE 30 3HD1 ILE 30 62.526 -4.437 2.123 255 HD12 ILE 30 1HD1 ILE 30 62.803 -4.659 0.395 256 HD13 ILE 30 2HD1 ILE 30 61.886 -3.267 0.971 257 H GLN 31 H GLN 31 67.235 -4.969 3.315 258 HA GLN 31 HA GLN 31 68.796 -6.847 1.835 259 HB2 GLN 31 1HB GLN 31 69.700 -4.805 2.933 260 HB3 GLN 31 2HB GLN 31 69.427 -5.569 4.498 261 HG2 GLN 31 1HG GLN 31 70.821 -7.459 2.872 262 HG3 GLN 31 2HG GLN 31 71.653 -5.915 2.702 263 HE21 GLN 31 2HE2 GLN 31 72.297 -4.820 4.808 264 HE22 GLN 31 1HE2 GLN 31 72.644 -5.798 6.151 265 H ASP 32 H ASP 32 67.055 -7.006 4.894 266 HA ASP 32 HA ASP 32 68.274 -9.257 6.004 267 HB2 ASP 32 1HB ASP 32 65.415 -8.302 6.216 268 HB3 ASP 32 2HB ASP 32 66.115 -9.571 7.221 269 H LYS 33 H LYS 33 65.487 -9.135 3.758 270 HA LYS 33 HA LYS 33 64.975 -11.915 3.771 271 HB2 LYS 33 1HB LYS 33 64.504 -9.909 1.555 272 HB3 LYS 33 2HB LYS 33 63.755 -11.501 1.673 273 HG2 LYS 33 1HG LYS 33 63.509 -9.532 3.941 274 HG3 LYS 33 2HG LYS 33 62.437 -9.415 2.545 275 HD2 LYS 33 1HD LYS 33 61.326 -11.365 3.055 276 HD3 LYS 33 2HD LYS 33 62.754 -12.124 3.755 277 HE2 LYS 33 1HE LYS 33 62.484 -11.029 5.817 278 HE3 LYS 33 2HE LYS 33 61.444 -9.783 5.124 279 HZ1 LYS 33 3HZ LYS 33 60.715 -12.653 5.322 280 HZ2 LYS 33 1HZ LYS 33 59.711 -11.381 4.823 281 HZ3 LYS 33 2HZ LYS 33 60.235 -11.465 6.438 282 H GLU 34 H GLU 34 66.768 -9.940 1.421 283 HA GLU 34 HA GLU 34 68.448 -12.288 0.776 284 HB2 GLU 34 1HB GLU 34 67.010 -10.431 -1.123 285 HB3 GLU 34 2HB GLU 34 68.481 -11.269 -1.611 286 HG2 GLU 34 1HG GLU 34 67.376 -13.433 -0.913 287 HG3 GLU 34 2HG GLU 34 65.881 -12.524 -0.696 288 H GLY 35 H GLY 35 70.636 -11.618 -0.017 289 HA2 GLY 35 1HA GLY 35 71.469 -9.245 1.414 290 HA3 GLY 35 2HA GLY 35 72.512 -10.319 0.489 291 H ILE 36 H ILE 36 71.101 -7.400 0.657 292 HA ILE 36 HA ILE 36 72.130 -6.558 -1.894 293 HB ILE 36 HB ILE 36 69.872 -5.265 -2.254 294 HG12 ILE 36 1HG1 ILE 36 68.996 -7.655 -0.599 295 HG13 ILE 36 2HG1 ILE 36 68.791 -5.954 -0.182 296 HG21 ILE 36 1HG2 ILE 36 69.976 -8.242 -2.830 297 HG22 ILE 36 2HG2 ILE 36 70.853 -7.024 -3.755 298 HG23 ILE 36 3HG2 ILE 36 69.092 -7.019 -3.743 299 HD11 ILE 36 3HD1 ILE 36 66.696 -6.815 -1.082 300 HD12 ILE 36 1HD1 ILE 36 67.522 -7.395 -2.528 301 HD13 ILE 36 2HD1 ILE 36 67.389 -5.663 -2.225 302 HA PRO 37 HA PRO 37 72.996 -3.739 1.405 303 HB2 PRO 37 1HB PRO 37 74.145 -1.822 -0.404 304 HB3 PRO 37 2HB PRO 37 74.967 -2.893 0.737 305 HG2 PRO 37 1HG PRO 37 74.921 -3.080 -2.080 306 HG3 PRO 37 2HG PRO 37 75.638 -4.217 -0.931 307 HD2 PRO 37 1HD PRO 37 73.223 -4.532 -2.513 308 HD3 PRO 37 2HD PRO 37 74.046 -5.723 -1.486 309 HA PRO 38 HA PRO 38 69.280 -1.317 0.858 310 HB2 PRO 38 1HB PRO 38 69.809 0.182 3.256 311 HB3 PRO 38 2HB PRO 38 68.648 -1.130 3.006 312 HG2 PRO 38 1HG PRO 38 71.051 -1.213 4.485 313 HG3 PRO 38 2HG PRO 38 69.941 -2.542 4.140 314 HD2 PRO 38 1HD PRO 38 72.577 -2.053 3.021 315 HD3 PRO 38 2HD PRO 38 71.528 -3.469 2.824 316 H ASP 39 H ASP 39 72.271 0.308 1.887 317 HA ASP 39 HA ASP 39 71.581 2.925 1.150 318 HB2 ASP 39 1HB ASP 39 74.208 3.038 0.799 319 HB3 ASP 39 2HB ASP 39 73.514 2.862 2.410 320 H GLN 40 H GLN 40 72.249 0.180 -0.781 321 HA GLN 40 HA GLN 40 72.680 1.872 -3.170 322 HB2 GLN 40 1HB GLN 40 73.192 -1.097 -2.897 323 HB3 GLN 40 2HB GLN 40 73.682 -0.042 -4.224 324 HG2 GLN 40 1HG GLN 40 74.610 0.297 -1.359 325 HG3 GLN 40 2HG GLN 40 75.535 -0.543 -2.603 326 HE21 GLN 40 2HE2 GLN 40 76.588 0.745 -4.239 327 HE22 GLN 40 1HE2 GLN 40 76.629 2.441 -4.169 328 H GLN 41 H GLN 41 70.198 0.617 -1.565 329 HA GLN 41 HA GLN 41 68.797 -0.281 -4.013 330 HB2 GLN 41 1HB GLN 41 69.043 -2.023 -2.233 331 HB3 GLN 41 2HB GLN 41 68.080 -1.000 -1.167 332 HG2 GLN 41 1HG GLN 41 66.452 -2.399 -2.099 333 HG3 GLN 41 2HG GLN 41 66.362 -0.989 -3.146 334 HE21 GLN 41 2HE2 GLN 41 65.965 -4.069 -3.583 335 HE22 GLN 41 1HE2 GLN 41 66.867 -4.369 -4.989 336 H ARG 42 H ARG 42 67.159 0.877 -4.709 337 HA ARG 42 HA ARG 42 65.849 2.800 -2.875 338 HB2 ARG 42 1HB ARG 42 66.026 3.452 -5.782 339 HB3 ARG 42 2HB ARG 42 66.042 4.526 -4.385 340 HG2 ARG 42 1HG ARG 42 68.347 3.751 -3.847 341 HG3 ARG 42 2HG ARG 42 68.328 2.756 -5.306 342 HD2 ARG 42 1HD ARG 42 69.401 4.729 -6.011 343 HD3 ARG 42 2HD ARG 42 67.738 4.954 -6.549 344 HE ARG 42 HE ARG 42 69.057 6.353 -4.329 345 HH11 ARG 42 1HH2 ARG 42 67.385 7.323 -6.846 346 HH12 ARG 42 2HH2 ARG 42 66.026 8.018 -6.028 347 HH21 ARG 42 1HH1 ARG 42 66.782 6.565 -2.972 348 HH22 ARG 42 2HH1 ARG 42 65.682 7.589 -3.835 349 H LEU 43 H LEU 43 63.627 2.928 -3.024 350 HA LEU 43 HA LEU 43 62.326 1.165 -5.022 351 HB2 LEU 43 1HB LEU 43 60.688 1.444 -2.675 352 HB3 LEU 43 2HB LEU 43 61.354 -0.026 -3.381 353 HG LEU 43 HG LEU 43 63.065 1.774 -1.661 354 HD11 LEU 43 1HD1 LEU 43 61.121 -0.371 -0.779 355 HD12 LEU 43 2HD1 LEU 43 61.172 1.311 -0.256 356 HD13 LEU 43 3HD1 LEU 43 62.453 0.199 0.228 357 HD21 LEU 43 3HD2 LEU 43 63.166 -1.231 -1.879 358 HD22 LEU 43 1HD2 LEU 43 64.468 -0.104 -1.491 359 HD23 LEU 43 2HD2 LEU 43 63.878 -0.236 -3.147 360 H ILE 44 H ILE 44 60.318 1.812 -5.834 361 HA ILE 44 HA ILE 44 59.341 4.484 -5.066 362 HB ILE 44 HB ILE 44 59.220 5.276 -7.284 363 HG12 ILE 44 1HG1 ILE 44 59.783 2.409 -8.090 364 HG13 ILE 44 2HG1 ILE 44 58.341 3.362 -8.442 365 HG21 ILE 44 1HG2 ILE 44 61.557 5.067 -6.226 366 HG22 ILE 44 2HG2 ILE 44 61.493 5.329 -7.968 367 HG23 ILE 44 3HG2 ILE 44 61.807 3.716 -7.330 368 HD11 ILE 44 3HD1 ILE 44 59.543 3.473 -10.459 369 HD12 ILE 44 1HD1 ILE 44 61.096 3.611 -9.634 370 HD13 ILE 44 2HD1 ILE 44 59.984 4.979 -9.656 371 H PHE 45 H PHE 45 57.123 4.714 -5.136 372 HA PHE 45 HA PHE 45 55.585 2.334 -6.013 373 HB2 PHE 45 1HB PHE 45 55.492 2.278 -3.656 374 HB3 PHE 45 2HB PHE 45 55.314 4.025 -3.533 375 HD1 PHE 45 HD2 PHE 45 53.604 0.963 -4.831 376 HD2 PHE 45 HD1 PHE 45 53.169 4.997 -3.420 377 HE1 PHE 45 HE2 PHE 45 51.136 0.703 -4.844 378 HE2 PHE 45 HE1 PHE 45 50.702 4.736 -3.431 379 HZ PHE 45 HZ PHE 45 49.687 2.589 -4.143 380 H ALA 46 H ALA 46 53.952 2.687 -7.372 381 HA ALA 46 HA ALA 46 52.632 3.824 -8.879 382 HB1 ALA 46 3HB ALA 46 51.429 4.023 -6.644 383 HB2 ALA 46 1HB ALA 46 50.992 5.215 -7.867 384 HB3 ALA 46 2HB ALA 46 52.077 5.659 -6.550 385 H GLY 47 H GLY 47 55.286 4.599 -9.121 386 HA2 GLY 47 1HA GLY 47 56.391 6.209 -10.382 387 HA3 GLY 47 2HA GLY 47 54.966 7.235 -10.271 388 H LYS 48 H LYS 48 55.061 6.747 -7.230 389 HA LYS 48 HA LYS 48 56.680 9.076 -6.652 390 HB2 LYS 48 1HB LYS 48 55.126 7.251 -4.802 391 HB3 LYS 48 2HB LYS 48 55.910 8.756 -4.332 392 HG2 LYS 48 1HG LYS 48 54.518 9.924 -6.096 393 HG3 LYS 48 2HG LYS 48 53.615 8.419 -6.272 394 HD2 LYS 48 1HD LYS 48 52.314 9.503 -4.678 395 HD3 LYS 48 2HD LYS 48 53.411 8.599 -3.636 396 HE2 LYS 48 1HE LYS 48 54.917 10.760 -3.844 397 HE3 LYS 48 2HE LYS 48 53.391 11.534 -4.272 398 HZ1 LYS 48 3HZ LYS 48 52.436 10.604 -2.219 399 HZ2 LYS 48 1HZ LYS 48 53.716 11.675 -1.918 400 HZ3 LYS 48 2HZ LYS 48 53.965 9.999 -1.796 401 H GLN 49 H GLN 49 58.614 9.148 -5.637 402 HA GLN 49 HA GLN 49 60.064 6.621 -5.419 403 HB2 GLN 49 1HB GLN 49 60.997 9.492 -5.226 404 HB3 GLN 49 2HB GLN 49 62.050 8.080 -5.154 405 HG2 GLN 49 1HG GLN 49 62.017 7.827 -7.402 406 HG3 GLN 49 2HG GLN 49 60.262 7.956 -7.458 407 HE21 GLN 49 2HE2 GLN 49 59.335 10.030 -7.948 408 HE22 GLN 49 1HE2 GLN 49 60.282 11.359 -8.415 409 H LEU 50 H LEU 50 60.262 5.597 -3.544 410 HA LEU 50 HA LEU 50 59.469 6.856 -1.070 411 HB2 LEU 50 1HB LEU 50 60.585 4.123 -1.751 412 HB3 LEU 50 2HB LEU 50 60.189 4.609 -0.106 413 HG LEU 50 HG LEU 50 58.251 4.573 -2.444 414 HD11 LEU 50 1HD1 LEU 50 58.783 2.695 -0.149 415 HD12 LEU 50 2HD1 LEU 50 58.565 2.323 -1.859 416 HD13 LEU 50 3HD1 LEU 50 57.178 2.790 -0.875 417 HD21 LEU 50 3HD2 LEU 50 57.275 6.175 -1.114 418 HD22 LEU 50 1HD2 LEU 50 58.105 5.632 0.341 419 HD23 LEU 50 2HD2 LEU 50 56.692 4.757 -0.246 420 H GLU 51 H GLU 51 60.730 8.340 -0.335 421 HA GLU 51 HA GLU 51 63.472 8.650 -0.827 422 HB2 GLU 51 1HB GLU 51 61.797 10.035 1.256 423 HB3 GLU 51 2HB GLU 51 63.311 10.608 0.557 424 HG2 GLU 51 1HG GLU 51 61.879 10.144 -1.715 425 HG3 GLU 51 2HG GLU 51 60.581 10.592 -0.610 426 H ASP 52 H ASP 52 64.569 9.682 1.225 427 HA ASP 52 HA ASP 52 66.188 7.864 2.388 428 HB2 ASP 52 1HB ASP 52 66.390 10.392 2.272 429 HB3 ASP 52 2HB ASP 52 65.466 10.423 3.775 430 H GLY 53 H GLY 53 63.022 7.705 3.144 431 HA2 GLY 53 1HA GLY 53 62.517 6.065 4.963 432 HA3 GLY 53 2HA GLY 53 63.641 6.962 5.948 433 H ARG 54 H ARG 54 61.110 8.064 3.772 434 HA ARG 54 HA ARG 54 59.905 9.732 5.855 435 HB2 ARG 54 1HB ARG 54 59.377 9.209 2.916 436 HB3 ARG 54 2HB ARG 54 58.117 9.930 3.915 437 HG2 ARG 54 1HG ARG 54 60.878 11.098 4.047 438 HG3 ARG 54 2HG ARG 54 59.894 11.452 2.630 439 HD2 ARG 54 1HD ARG 54 58.602 12.904 3.792 440 HD3 ARG 54 2HD ARG 54 58.362 11.754 5.103 441 HE ARG 54 HE ARG 54 60.977 13.010 5.082 442 HH11 ARG 54 1HH2 ARG 54 58.058 14.514 5.402 443 HH12 ARG 54 2HH2 ARG 54 58.216 14.943 7.072 444 HH21 ARG 54 1HH1 ARG 54 61.035 12.989 7.581 445 HH22 ARG 54 2HH1 ARG 54 59.902 14.082 8.305 446 H THR 55 H THR 55 57.585 9.072 6.557 447 HA THR 55 HA THR 55 57.627 6.194 6.805 448 HB THR 55 HB THR 55 55.877 8.396 7.811 449 HG1 THR 55 HG1 THR 55 56.461 6.490 9.544 450 HG21 THR 55 3HG2 THR 55 55.123 5.509 7.526 451 HG22 THR 55 1HG2 THR 55 54.129 6.936 7.261 452 HG23 THR 55 2HG2 THR 55 54.541 6.437 8.902 453 H LEU 56 H LEU 56 56.398 4.717 5.876 454 HA LEU 56 HA LEU 56 55.209 5.333 3.364 455 HB2 LEU 56 1HB LEU 56 56.214 3.013 4.685 456 HB3 LEU 56 2HB LEU 56 54.667 2.659 3.919 457 HG LEU 56 HG LEU 56 55.523 3.676 1.804 458 HD11 LEU 56 1HD1 LEU 56 58.143 3.897 1.821 459 HD12 LEU 56 2HD1 LEU 56 57.923 4.131 3.554 460 HD13 LEU 56 3HD1 LEU 56 57.155 5.231 2.412 461 HD21 LEU 56 3HD2 LEU 56 56.458 1.718 1.125 462 HD22 LEU 56 1HD2 LEU 56 56.082 1.161 2.753 463 HD23 LEU 56 2HD2 LEU 56 57.698 1.753 2.374 464 H SER 57 H SER 57 53.958 4.706 6.561 465 HA SER 57 HA SER 57 51.355 3.949 5.893 466 HB2 SER 57 1HB SER 57 51.857 3.909 8.209 467 HB3 SER 57 2HB SER 57 52.465 5.564 8.191 468 HG SER 57 HG SER 57 50.188 5.016 8.985 469 H ASP 58 H ASP 58 53.017 6.990 5.834 470 HA ASP 58 HA ASP 58 50.726 8.627 5.262 471 HB2 ASP 58 1HB ASP 58 52.744 9.625 6.227 472 HB3 ASP 58 2HB ASP 58 53.687 9.113 4.827 473 H TYR 59 H TYR 59 52.919 6.606 3.492 474 HA TYR 59 HA TYR 59 52.326 7.716 0.889 475 HB2 TYR 59 1HB TYR 59 53.989 5.498 1.961 476 HB3 TYR 59 2HB TYR 59 53.427 5.329 0.304 477 HD1 TYR 59 HD2 TYR 59 55.440 7.369 2.613 478 HD2 TYR 59 HD1 TYR 59 54.116 6.835 -1.424 479 HE1 TYR 59 HE2 TYR 59 57.152 8.992 1.849 480 HE2 TYR 59 HE1 TYR 59 55.818 8.463 -2.195 481 HH TYR 59 HH TYR 59 58.204 9.837 0.031 482 H ASN 60 H ASN 60 50.424 6.151 2.960 483 HA ASN 60 HA ASN 60 48.553 4.831 2.790 484 HB2 ASN 60 1HB ASN 60 48.302 5.428 -0.119 485 HB3 ASN 60 2HB ASN 60 47.089 5.515 1.155 486 HD21 ASN 60 2HD2 ASN 60 48.287 7.550 -0.946 487 HD22 ASN 60 1HD2 ASN 60 48.552 8.934 -0.001 488 H ILE 61 H ILE 61 50.909 3.363 2.551 489 HA ILE 61 HA ILE 61 50.975 1.746 0.222 490 HB ILE 61 HB ILE 61 51.944 1.087 3.009 491 HG12 ILE 61 1HG1 ILE 61 53.043 3.083 2.182 492 HG13 ILE 61 2HG1 ILE 61 54.155 1.733 2.015 493 HG21 ILE 61 1HG2 ILE 61 52.274 -0.217 0.312 494 HG22 ILE 61 2HG2 ILE 61 51.868 -0.964 1.857 495 HG23 ILE 61 3HG2 ILE 61 53.509 -0.395 1.555 496 HD11 ILE 61 3HD1 ILE 61 54.343 2.799 -0.061 497 HD12 ILE 61 1HD1 ILE 61 52.621 3.166 -0.132 498 HD13 ILE 61 2HD1 ILE 61 53.183 1.514 -0.390 499 H GLN 62 H GLN 62 50.012 -0.043 -0.314 500 HA GLN 62 HA GLN 62 47.675 -0.840 1.249 501 HB2 GLN 62 1HB GLN 62 46.724 -1.611 -0.776 502 HB3 GLN 62 2HB GLN 62 47.472 -0.054 -1.135 503 HG2 GLN 62 1HG GLN 62 49.550 -1.419 -1.815 504 HG3 GLN 62 2HG GLN 62 48.472 -2.814 -1.829 505 HE21 GLN 62 2HE2 GLN 62 48.737 0.507 -3.210 506 HE22 GLN 62 1HE2 GLN 62 47.925 0.125 -4.651 507 H LYS 63 H LYS 63 46.981 -3.053 0.368 508 HA LYS 63 HA LYS 63 47.926 -5.046 1.876 509 HB2 LYS 63 1HB LYS 63 45.857 -4.862 0.298 510 HB3 LYS 63 2HB LYS 63 46.879 -5.741 -0.838 511 HG2 LYS 63 1HG LYS 63 47.090 -7.605 0.615 512 HG3 LYS 63 2HG LYS 63 46.524 -6.694 2.011 513 HD2 LYS 63 1HD LYS 63 44.577 -7.834 1.529 514 HD3 LYS 63 2HD LYS 63 44.329 -6.435 0.490 515 HE2 LYS 63 1HE LYS 63 45.740 -8.907 -0.526 516 HE3 LYS 63 2HE LYS 63 43.983 -8.777 -0.549 517 HZ1 LYS 63 3HZ LYS 63 44.343 -6.587 -1.715 518 HZ2 LYS 63 1HZ LYS 63 44.699 -7.981 -2.612 519 HZ3 LYS 63 2HZ LYS 63 45.959 -7.067 -1.933 520 H GLU 64 H GLU 64 50.316 -3.867 0.478 521 HA GLU 64 HA GLU 64 52.399 -4.860 0.084 522 HB2 GLU 64 1HB GLU 64 52.714 -7.130 -0.012 523 HB3 GLU 64 2HB GLU 64 51.170 -7.070 0.818 524 HG2 GLU 64 1HG GLU 64 50.311 -7.120 -1.777 525 HG3 GLU 64 2HG GLU 64 51.804 -8.038 -1.917 526 H SER 65 H SER 65 51.447 -3.140 -1.495 527 HA SER 65 HA SER 65 50.998 -3.739 -4.211 528 HB2 SER 65 1HB SER 65 52.186 -1.330 -4.319 529 HB3 SER 65 2HB SER 65 50.523 -1.548 -3.791 530 HG SER 65 HG SER 65 51.246 -0.622 -2.036 531 H THR 66 H THR 66 52.423 -3.564 -5.997 532 HA THR 66 HA THR 66 55.100 -4.584 -5.481 533 HB THR 66 HB THR 66 53.872 -3.899 -8.152 534 HG1 THR 66 HG1 THR 66 53.426 -6.272 -8.035 535 HG21 THR 66 3HG2 THR 66 56.014 -5.843 -7.261 536 HG22 THR 66 1HG2 THR 66 56.269 -4.352 -8.166 537 HG23 THR 66 2HG2 THR 66 55.407 -5.699 -8.910 538 H LEU 67 H LEU 67 56.842 -3.348 -5.322 539 HA LEU 67 HA LEU 67 56.715 -0.543 -6.217 540 HB2 LEU 67 1HB LEU 67 58.455 -2.034 -4.256 541 HB3 LEU 67 2HB LEU 67 58.964 -0.476 -4.907 542 HG LEU 67 HG LEU 67 57.019 0.621 -4.026 543 HD11 LEU 67 1HD1 LEU 67 55.255 -0.916 -4.414 544 HD12 LEU 67 2HD1 LEU 67 55.366 -0.813 -2.658 545 HD13 LEU 67 3HD1 LEU 67 56.061 -2.195 -3.506 546 HD21 LEU 67 3HD2 LEU 67 58.853 0.124 -2.412 547 HD22 LEU 67 1HD2 LEU 67 58.008 -1.347 -1.942 548 HD23 LEU 67 2HD2 LEU 67 57.279 0.227 -1.626 549 H HIS 68 H HIS 68 57.999 0.218 -7.828 550 HA HIS 68 HA HIS 68 59.324 -1.740 -9.506 551 HB2 HIS 68 1HB HIS 68 59.465 1.195 -10.054 552 HB3 HIS 68 2HB HIS 68 59.249 -0.147 -11.178 553 HD1 HIS 68 HD1 HIS 68 57.362 2.486 -10.735 554 HD2 HIS 68 HD2 HIS 68 56.555 -1.434 -9.574 555 HE1 HIS 68 HE1 HIS 68 54.847 2.315 -10.498 556 H LEU 69 H LEU 69 61.457 -2.044 -9.758 557 HA LEU 69 HA LEU 69 63.287 -0.388 -8.121 558 HB2 LEU 69 1HB LEU 69 63.667 -3.224 -9.105 559 HB3 LEU 69 2HB LEU 69 64.763 -2.328 -8.058 560 HG LEU 69 HG LEU 69 61.877 -2.886 -7.330 561 HD11 LEU 69 1HD1 LEU 69 64.270 -4.618 -7.223 562 HD12 LEU 69 2HD1 LEU 69 62.563 -5.049 -7.148 563 HD13 LEU 69 3HD1 LEU 69 63.396 -4.494 -5.698 564 HD21 LEU 69 3HD2 LEU 69 62.960 -2.515 -4.997 565 HD22 LEU 69 1HD2 LEU 69 62.696 -1.096 -6.010 566 HD23 LEU 69 2HD2 LEU 69 64.306 -1.806 -5.888 567 H VAL 70 H VAL 70 64.768 0.789 -9.168 568 HA VAL 70 HA VAL 70 65.334 0.126 -11.999 569 HB VAL 70 HB VAL 70 65.404 2.887 -10.774 570 HG11 VAL 70 1HG1 VAL 70 65.276 3.502 -13.231 571 HG12 VAL 70 2HG1 VAL 70 65.538 1.796 -13.599 572 HG13 VAL 70 3HG1 VAL 70 66.778 2.715 -12.745 573 HG21 VAL 70 3HG2 VAL 70 63.249 3.258 -11.902 574 HG22 VAL 70 1HG2 VAL 70 63.103 1.949 -10.731 575 HG23 VAL 70 2HG2 VAL 70 63.233 1.582 -12.451 576 H LEU 71 H LEU 71 67.441 0.580 -12.761 577 HA LEU 71 HA LEU 71 69.524 1.199 -10.809 578 HB2 LEU 71 1HB LEU 71 69.104 -1.316 -10.778 579 HB3 LEU 71 2HB LEU 71 69.689 -1.337 -12.441 580 HG LEU 71 HG LEU 71 71.717 0.027 -11.398 581 HD11 LEU 71 1HD1 LEU 71 70.651 -1.576 -9.051 582 HD12 LEU 71 2HD1 LEU 71 70.756 0.181 -9.139 583 HD13 LEU 71 3HD1 LEU 71 72.228 -0.789 -9.109 584 HD21 LEU 71 3HD2 LEU 71 72.886 -2.142 -11.035 585 HD22 LEU 71 1HD2 LEU 71 71.925 -2.147 -12.514 586 HD23 LEU 71 2HD2 LEU 71 71.328 -2.965 -11.070 587 H ARG 72 H ARG 72 70.787 2.657 -11.770 588 HA ARG 72 HA ARG 72 71.707 3.951 -13.448 589 HB2 ARG 72 1HB ARG 72 72.321 1.149 -14.416 590 HB3 ARG 72 2HB ARG 72 73.065 2.605 -15.073 591 HG2 ARG 72 1HG ARG 72 73.233 1.647 -12.199 592 HG3 ARG 72 2HG ARG 72 74.533 1.610 -13.385 593 HD2 ARG 72 1HD ARG 72 73.367 3.946 -11.922 594 HD3 ARG 72 2HD ARG 72 75.051 3.575 -12.271 595 HE ARG 72 HE ARG 72 73.687 4.099 -14.696 596 HH11 ARG 72 1HH1 ARG 72 73.941 5.881 -11.803 597 HH12 ARG 72 2HH1 ARG 72 74.561 7.316 -12.552 598 HH21 ARG 72 1HH2 ARG 72 74.873 5.861 -15.685 599 HH22 ARG 72 2HH2 ARG 72 75.089 7.305 -14.752 Start of MODEL 7 1 H1 MET 1 1H MET 1 50.027 -2.649 3.923 2 H2 MET 1 2H MET 1 49.373 -1.519 5.012 3 H3 MET 1 3H MET 1 48.476 -2.890 4.563 4 HA MET 1 HA MET 1 50.188 -2.613 6.731 5 HB2 MET 1 1HB MET 1 48.138 -3.929 6.724 6 HB3 MET 1 2HB MET 1 48.787 -4.996 5.479 7 HG2 MET 1 1HG MET 1 48.935 -5.970 7.780 8 HG3 MET 1 2HG MET 1 50.507 -5.805 6.999 9 HE1 MET 1 3HE MET 1 48.515 -5.204 10.140 10 HE2 MET 1 1HE MET 1 47.876 -3.946 9.075 11 HE3 MET 1 2HE MET 1 48.764 -3.505 10.533 12 H GLN 2 H GLN 2 50.386 -5.213 4.311 13 HA GLN 2 HA GLN 2 53.212 -5.598 4.893 14 HB2 GLN 2 1HB GLN 2 51.152 -7.055 3.257 15 HB3 GLN 2 2HB GLN 2 52.866 -7.419 3.065 16 HG2 GLN 2 1HG GLN 2 53.013 -7.845 5.513 17 HG3 GLN 2 2HG GLN 2 51.276 -7.565 5.642 18 HE21 GLN 2 2HE2 GLN 2 50.750 -9.776 6.221 19 HE22 GLN 2 1HE2 GLN 2 50.926 -11.055 5.119 20 H ILE 3 H ILE 3 54.744 -5.871 3.057 21 HA ILE 3 HA ILE 3 54.235 -3.913 0.885 22 HB ILE 3 HB ILE 3 56.676 -4.384 2.570 23 HG12 ILE 3 1HG1 ILE 3 54.819 -2.403 2.594 24 HG13 ILE 3 2HG1 ILE 3 56.504 -2.152 3.031 25 HG21 ILE 3 1HG2 ILE 3 56.600 -3.471 -0.318 26 HG22 ILE 3 2HG2 ILE 3 57.594 -4.742 0.397 27 HG23 ILE 3 3HG2 ILE 3 57.923 -3.052 0.768 28 HD11 ILE 3 3HD1 ILE 3 57.045 -1.241 0.911 29 HD12 ILE 3 1HD1 ILE 3 55.504 -0.510 1.341 30 HD13 ILE 3 2HD1 ILE 3 55.547 -1.835 0.191 31 H PHE 4 H PHE 4 55.290 -4.406 -1.130 32 HA PHE 4 HA PHE 4 56.217 -7.175 -1.423 33 HB2 PHE 4 1HB PHE 4 53.946 -7.433 -1.934 34 HB3 PHE 4 2HB PHE 4 53.869 -5.902 -2.790 35 HD1 PHE 4 HD1 PHE 4 56.552 -8.453 -3.136 36 HD2 PHE 4 HD2 PHE 4 53.081 -6.646 -4.906 37 HE1 PHE 4 HE1 PHE 4 57.043 -9.609 -5.266 38 HE2 PHE 4 HE2 PHE 4 53.569 -7.814 -7.040 39 HZ PHE 4 HZ PHE 4 55.551 -9.292 -7.220 40 H VAL 5 H VAL 5 57.885 -7.375 -2.774 41 HA VAL 5 HA VAL 5 58.473 -5.182 -4.670 42 HB VAL 5 HB VAL 5 60.441 -6.644 -2.893 43 HG11 VAL 5 1HG1 VAL 5 60.779 -4.572 -5.072 44 HG12 VAL 5 2HG1 VAL 5 61.484 -6.189 -5.007 45 HG13 VAL 5 3HG1 VAL 5 62.033 -4.941 -3.888 46 HG21 VAL 5 3HG2 VAL 5 60.709 -4.551 -1.753 47 HG22 VAL 5 1HG2 VAL 5 58.973 -4.844 -1.846 48 HG23 VAL 5 2HG2 VAL 5 59.734 -3.701 -2.952 49 H LYS 6 H LYS 6 59.281 -5.817 -6.652 50 HA LYS 6 HA LYS 6 59.561 -8.735 -7.086 51 HB2 LYS 6 1HB LYS 6 57.490 -7.409 -8.060 52 HB3 LYS 6 2HB LYS 6 58.653 -6.912 -9.285 53 HG2 LYS 6 1HG LYS 6 59.108 -9.195 -9.901 54 HG3 LYS 6 2HG LYS 6 58.210 -9.810 -8.515 55 HD2 LYS 6 1HD LYS 6 56.649 -10.055 -10.237 56 HD3 LYS 6 2HD LYS 6 56.196 -8.493 -9.560 57 HE2 LYS 6 1HE LYS 6 56.338 -7.819 -11.747 58 HE3 LYS 6 2HE LYS 6 58.058 -7.697 -11.378 59 HZ1 LYS 6 3HZ LYS 6 56.802 -10.183 -12.387 60 HZ2 LYS 6 1HZ LYS 6 58.454 -9.818 -12.291 61 HZ3 LYS 6 2HZ LYS 6 57.471 -9.007 -13.414 62 H THR 7 H THR 7 61.534 -9.296 -7.703 63 HA THR 7 HA THR 7 63.435 -7.285 -8.587 64 HB THR 7 HB THR 7 65.092 -8.882 -8.188 65 HG1 THR 7 HG1 THR 7 63.494 -11.100 -8.016 66 HG21 THR 7 3HG2 THR 7 63.604 -8.341 -6.170 67 HG22 THR 7 1HG2 THR 7 64.612 -9.782 -6.041 68 HG23 THR 7 2HG2 THR 7 62.893 -9.937 -6.407 69 H LEU 8 H LEU 8 64.976 -8.076 -10.417 70 HA LEU 8 HA LEU 8 63.432 -8.155 -12.815 71 HB2 LEU 8 1HB LEU 8 66.372 -8.260 -12.187 72 HB3 LEU 8 2HB LEU 8 65.797 -8.536 -13.830 73 HG LEU 8 HG LEU 8 64.643 -6.370 -13.815 74 HD11 LEU 8 1HD1 LEU 8 65.201 -4.823 -11.841 75 HD12 LEU 8 2HD1 LEU 8 65.667 -6.286 -10.973 76 HD13 LEU 8 3HD1 LEU 8 64.010 -6.089 -11.541 77 HD21 LEU 8 3HD2 LEU 8 66.772 -4.913 -13.410 78 HD22 LEU 8 1HD2 LEU 8 66.831 -6.155 -14.661 79 HD23 LEU 8 2HD2 LEU 8 67.570 -6.453 -13.088 80 H THR 9 H THR 9 64.388 -10.557 -10.669 81 HA THR 9 HA THR 9 64.583 -12.671 -12.686 82 HB THR 9 HB THR 9 64.997 -14.142 -10.726 83 HG1 THR 9 HG1 THR 9 63.964 -12.023 -9.466 84 HG21 THR 9 3HG2 THR 9 67.199 -13.344 -10.307 85 HG22 THR 9 1HG2 THR 9 66.717 -11.665 -10.548 86 HG23 THR 9 2HG2 THR 9 66.797 -12.766 -11.923 87 H GLY 10 H GLY 10 62.168 -11.027 -11.131 88 HA2 GLY 10 1HA GLY 10 59.879 -11.395 -11.183 89 HA3 GLY 10 2HA GLY 10 60.183 -12.991 -11.862 90 H LYS 11 H LYS 11 62.129 -12.768 -9.207 91 HA LYS 11 HA LYS 11 60.601 -14.618 -7.697 92 HB2 LYS 11 1HB LYS 11 63.209 -13.346 -7.508 93 HB3 LYS 11 2HB LYS 11 62.442 -13.450 -5.926 94 HG2 LYS 11 1HG LYS 11 61.923 -15.913 -6.563 95 HG3 LYS 11 2HG LYS 11 63.133 -15.693 -7.826 96 HD2 LYS 11 1HD LYS 11 63.682 -15.063 -4.915 97 HD3 LYS 11 2HD LYS 11 63.988 -16.650 -5.620 98 HE2 LYS 11 1HE LYS 11 65.515 -15.670 -7.256 99 HE3 LYS 11 2HE LYS 11 65.161 -14.052 -6.653 100 HZ1 LYS 11 3HZ LYS 11 66.437 -16.255 -5.128 101 HZ2 LYS 11 1HZ LYS 11 66.026 -14.740 -4.483 102 HZ3 LYS 11 2HZ LYS 11 67.202 -14.853 -5.704 103 H THR 12 H THR 12 59.105 -14.348 -6.176 104 HA THR 12 HA THR 12 58.219 -11.630 -5.570 105 HB THR 12 HB THR 12 56.784 -13.908 -4.350 106 HG1 THR 12 HG1 THR 12 57.264 -14.973 -6.182 107 HG21 THR 12 3HG2 THR 12 55.946 -11.559 -4.464 108 HG22 THR 12 1HG2 THR 12 54.858 -12.708 -5.240 109 HG23 THR 12 2HG2 THR 12 55.911 -11.690 -6.223 110 H ILE 13 H ILE 13 59.016 -10.618 -3.863 111 HA ILE 13 HA ILE 13 59.717 -12.200 -1.461 112 HB ILE 13 HB ILE 13 61.620 -11.104 -2.805 113 HG12 ILE 13 1HG1 ILE 13 61.453 -10.135 0.051 114 HG13 ILE 13 2HG1 ILE 13 61.607 -11.852 -0.321 115 HG21 ILE 13 1HG2 ILE 13 61.950 -8.761 -2.590 116 HG22 ILE 13 2HG2 ILE 13 60.668 -8.611 -1.390 117 HG23 ILE 13 3HG2 ILE 13 60.267 -8.950 -3.071 118 HD11 ILE 13 3HD1 ILE 13 63.717 -10.093 -0.076 119 HD12 ILE 13 1HD1 ILE 13 63.494 -10.164 -1.821 120 HD13 ILE 13 2HD1 ILE 13 63.786 -11.644 -0.909 121 H THR 14 H THR 14 58.496 -11.775 0.244 122 HA THR 14 HA THR 14 57.105 -9.164 0.401 123 HB THR 14 HB THR 14 55.484 -10.490 1.890 124 HG1 THR 14 HG1 THR 14 57.138 -12.299 1.817 125 HG21 THR 14 3HG2 THR 14 54.872 -9.753 -0.350 126 HG22 THR 14 1HG2 THR 14 54.286 -11.397 -0.098 127 HG23 THR 14 2HG2 THR 14 55.735 -11.114 -1.065 128 H LEU 15 H LEU 15 57.217 -8.001 2.272 129 HA LEU 15 HA LEU 15 58.945 -9.088 4.423 130 HB2 LEU 15 1HB LEU 15 58.703 -6.220 4.573 131 HB3 LEU 15 2HB LEU 15 60.153 -7.190 4.335 132 HG LEU 15 HG LEU 15 58.257 -6.571 2.062 133 HD11 LEU 15 1HD1 LEU 15 59.021 -4.439 3.000 134 HD12 LEU 15 2HD1 LEU 15 59.812 -4.741 1.454 135 HD13 LEU 15 3HD1 LEU 15 60.691 -5.004 2.962 136 HD21 LEU 15 3HD2 LEU 15 60.002 -7.333 0.682 137 HD22 LEU 15 1HD2 LEU 15 60.115 -8.425 2.062 138 HD23 LEU 15 2HD2 LEU 15 61.227 -7.065 1.923 139 H GLU 16 H GLU 16 58.335 -8.724 6.583 140 HA GLU 16 HA GLU 16 55.451 -8.237 6.878 141 HB2 GLU 16 1HB GLU 16 56.732 -10.240 7.938 142 HB3 GLU 16 2HB GLU 16 57.344 -9.052 9.087 143 HG2 GLU 16 1HG GLU 16 54.397 -9.484 8.517 144 HG3 GLU 16 2HG GLU 16 55.260 -10.238 9.855 145 H VAL 17 H VAL 17 54.980 -6.185 7.062 146 HA VAL 17 HA VAL 17 56.370 -4.547 9.052 147 HB VAL 17 HB VAL 17 57.573 -4.191 6.936 148 HG11 VAL 17 1HG1 VAL 17 56.505 -3.645 4.934 149 HG12 VAL 17 2HG1 VAL 17 55.081 -3.004 5.750 150 HG13 VAL 17 3HG1 VAL 17 55.327 -4.744 5.645 151 HG21 VAL 17 3HG2 VAL 17 56.775 -2.281 8.636 152 HG22 VAL 17 1HG2 VAL 17 55.901 -1.727 7.217 153 HG23 VAL 17 2HG2 VAL 17 57.650 -1.891 7.165 154 H GLU 18 H GLU 18 55.348 -2.369 9.180 155 HA GLU 18 HA GLU 18 52.423 -2.599 9.103 156 HB2 GLU 18 1HB GLU 18 52.672 -0.372 10.410 157 HB3 GLU 18 2HB GLU 18 53.172 -1.843 11.232 158 HG2 GLU 18 1HG GLU 18 55.260 -0.485 9.605 159 HG3 GLU 18 2HG GLU 18 54.740 0.363 11.058 160 HA PRO 19 HA PRO 19 52.347 0.150 5.692 161 HB2 PRO 19 1HB PRO 19 50.490 2.137 6.647 162 HB3 PRO 19 2HB PRO 19 50.186 0.771 5.560 163 HG2 PRO 19 1HG PRO 19 49.220 0.987 8.120 164 HG3 PRO 19 2HG PRO 19 49.401 -0.530 7.227 165 HD2 PRO 19 1HD PRO 19 51.154 0.639 9.342 166 HD3 PRO 19 2HD PRO 19 50.755 -1.065 9.023 167 H SER 20 H SER 20 53.556 1.399 8.650 168 HA SER 20 HA SER 20 53.990 4.059 7.589 169 HB2 SER 20 1HB SER 20 54.121 3.056 10.114 170 HB3 SER 20 2HB SER 20 55.825 2.998 9.681 171 HG SER 20 HG SER 20 54.136 5.264 9.404 172 H ASP 21 H ASP 21 55.477 0.928 7.594 173 HA ASP 21 HA ASP 21 57.511 0.280 6.609 174 HB2 ASP 21 1HB ASP 21 55.489 1.311 4.742 175 HB3 ASP 21 2HB ASP 21 57.078 0.942 4.081 176 H THR 22 H THR 22 58.850 2.166 7.840 177 HA THR 22 HA THR 22 59.356 4.336 5.958 178 HB THR 22 HB THR 22 60.424 5.405 7.690 179 HG1 THR 22 HG1 THR 22 61.381 3.773 9.376 180 HG21 THR 22 3HG2 THR 22 59.103 3.241 9.339 181 HG22 THR 22 1HG2 THR 22 58.190 4.499 8.504 182 HG23 THR 22 2HG2 THR 22 59.340 4.934 9.769 183 H ILE 23 H ILE 23 60.998 4.534 4.678 184 HA ILE 23 HA ILE 23 62.183 2.327 3.593 185 HB ILE 23 HB ILE 23 63.653 4.904 3.380 186 HG12 ILE 23 1HG1 ILE 23 61.339 5.683 3.692 187 HG13 ILE 23 2HG1 ILE 23 61.753 5.818 1.994 188 HG21 ILE 23 1HG2 ILE 23 63.096 4.280 0.891 189 HG22 ILE 23 2HG2 ILE 23 62.713 2.699 1.563 190 HG23 ILE 23 3HG2 ILE 23 64.330 3.374 1.760 191 HD11 ILE 23 3HD1 ILE 23 59.700 4.807 1.860 192 HD12 ILE 23 1HD1 ILE 23 59.922 3.875 3.335 193 HD13 ILE 23 2HD1 ILE 23 60.747 3.391 1.853 194 H GLU 24 H GLU 24 63.510 4.471 6.085 195 HA GLU 24 HA GLU 24 66.032 3.171 6.202 196 HB2 GLU 24 1HB GLU 24 64.751 5.239 7.627 197 HB3 GLU 24 2HB GLU 24 65.022 3.974 8.825 198 HG2 GLU 24 1HG GLU 24 67.411 3.858 8.077 199 HG3 GLU 24 2HG GLU 24 67.107 5.233 7.019 200 H ASN 25 H ASN 25 62.808 2.551 7.357 201 HA ASN 25 HA ASN 25 63.453 0.274 8.999 202 HB2 ASN 25 1HB ASN 25 61.523 1.739 9.459 203 HB3 ASN 25 2HB ASN 25 60.774 1.207 7.958 204 HD21 ASN 25 2HD2 ASN 25 62.454 -0.501 10.662 205 HD22 ASN 25 1HD2 ASN 25 61.226 -1.654 10.877 206 H VAL 26 H VAL 26 61.915 0.710 5.817 207 HA VAL 26 HA VAL 26 61.532 -2.089 5.375 208 HB VAL 26 HB VAL 26 61.598 0.083 3.275 209 HG11 VAL 26 1HG1 VAL 26 59.824 -2.348 3.355 210 HG12 VAL 26 2HG1 VAL 26 61.480 -2.485 2.768 211 HG13 VAL 26 3HG1 VAL 26 60.345 -1.404 1.962 212 HG21 VAL 26 3HG2 VAL 26 60.063 0.392 5.432 213 HG22 VAL 26 1HG2 VAL 26 59.065 -0.806 4.616 214 HG23 VAL 26 2HG2 VAL 26 59.428 0.725 3.824 215 H LYS 27 H LYS 27 64.011 0.243 4.517 216 HA LYS 27 HA LYS 27 65.382 -1.122 2.540 217 HB2 LYS 27 1HB LYS 27 66.279 0.777 4.688 218 HB3 LYS 27 2HB LYS 27 67.419 0.116 3.526 219 HG2 LYS 27 1HG LYS 27 64.847 1.326 2.568 220 HG3 LYS 27 2HG LYS 27 66.210 2.365 2.970 221 HD2 LYS 27 1HD LYS 27 67.380 1.751 1.118 222 HD3 LYS 27 2HD LYS 27 66.950 0.053 1.297 223 HE2 LYS 27 1HE LYS 27 65.277 2.245 0.051 224 HE3 LYS 27 2HE LYS 27 65.943 0.820 -0.735 225 HZ1 LYS 27 3HZ LYS 27 64.575 -0.511 0.876 226 HZ2 LYS 27 1HZ LYS 27 63.710 0.329 -0.315 227 HZ3 LYS 27 2HZ LYS 27 63.774 0.935 1.269 228 H ALA 28 H ALA 28 66.013 -1.293 6.057 229 HA ALA 28 HA ALA 28 68.078 -3.190 5.854 230 HB1 ALA 28 3HB ALA 28 67.445 -3.717 8.256 231 HB2 ALA 28 1HB ALA 28 66.151 -2.533 8.077 232 HB3 ALA 28 2HB ALA 28 67.833 -2.032 7.913 233 H LYS 29 H LYS 29 64.569 -3.522 5.991 234 HA LYS 29 HA LYS 29 64.473 -6.319 6.375 235 HB2 LYS 29 1HB LYS 29 62.577 -4.211 5.534 236 HB3 LYS 29 2HB LYS 29 62.230 -5.798 4.854 237 HG2 LYS 29 1HG LYS 29 61.443 -6.551 6.840 238 HG3 LYS 29 2HG LYS 29 62.905 -6.042 7.678 239 HD2 LYS 29 1HD LYS 29 62.023 -3.739 7.825 240 HD3 LYS 29 2HD LYS 29 60.549 -4.259 7.009 241 HE2 LYS 29 1HE LYS 29 60.293 -5.995 8.865 242 HE3 LYS 29 2HE LYS 29 61.570 -5.131 9.721 243 HZ1 LYS 29 3HZ LYS 29 58.917 -4.542 9.802 244 HZ2 LYS 29 1HZ LYS 29 59.528 -3.390 8.718 245 HZ3 LYS 29 2HZ LYS 29 60.177 -3.510 10.284 246 H ILE 30 H ILE 30 64.908 -4.304 3.513 247 HA ILE 30 HA ILE 30 64.593 -6.351 1.587 248 HB ILE 30 HB ILE 30 66.406 -3.947 1.309 249 HG12 ILE 30 1HG1 ILE 30 64.322 -3.054 2.070 250 HG13 ILE 30 2HG1 ILE 30 64.305 -2.881 0.322 251 HG21 ILE 30 1HG2 ILE 30 64.676 -5.268 -0.777 252 HG22 ILE 30 2HG2 ILE 30 66.298 -5.857 -0.427 253 HG23 ILE 30 3HG2 ILE 30 66.066 -4.213 -1.014 254 HD11 ILE 30 3HD1 ILE 30 63.115 -5.182 0.307 255 HD12 ILE 30 1HD1 ILE 30 62.178 -3.779 0.818 256 HD13 ILE 30 2HD1 ILE 30 62.830 -4.889 2.022 257 H GLN 31 H GLN 31 67.491 -5.121 3.252 258 HA GLN 31 HA GLN 31 69.314 -6.892 1.955 259 HB2 GLN 31 1HB GLN 31 70.062 -4.811 3.022 260 HB3 GLN 31 2HB GLN 31 69.589 -5.449 4.598 261 HG2 GLN 31 1HG GLN 31 71.206 -7.232 4.446 262 HG3 GLN 31 2HG GLN 31 71.569 -6.830 2.769 263 HE21 GLN 31 2HE2 GLN 31 71.631 -5.295 6.034 264 HE22 GLN 31 1HE2 GLN 31 73.030 -4.382 5.732 265 H ASP 32 H ASP 32 67.329 -7.107 4.813 266 HA ASP 32 HA ASP 32 68.563 -9.201 6.163 267 HB2 ASP 32 1HB ASP 32 66.284 -7.680 6.482 268 HB3 ASP 32 2HB ASP 32 65.634 -9.299 6.250 269 H LYS 33 H LYS 33 66.150 -9.379 3.535 270 HA LYS 33 HA LYS 33 65.772 -12.179 3.681 271 HB2 LYS 33 1HB LYS 33 65.313 -10.110 1.555 272 HB3 LYS 33 2HB LYS 33 65.083 -11.821 1.190 273 HG2 LYS 33 1HG LYS 33 63.832 -10.700 3.679 274 HG3 LYS 33 2HG LYS 33 63.068 -10.368 2.127 275 HD2 LYS 33 1HD LYS 33 62.980 -12.783 1.641 276 HD3 LYS 33 2HD LYS 33 63.752 -13.125 3.189 277 HE2 LYS 33 1HE LYS 33 61.489 -13.392 3.712 278 HE3 LYS 33 2HE LYS 33 61.776 -11.719 4.185 279 HZ1 LYS 33 3HZ LYS 33 60.690 -12.591 1.563 280 HZ2 LYS 33 1HZ LYS 33 60.917 -10.986 2.067 281 HZ3 LYS 33 2HZ LYS 33 59.768 -11.966 2.846 282 H GLU 34 H GLU 34 67.775 -10.276 1.439 283 HA GLU 34 HA GLU 34 69.686 -12.506 1.294 284 HB2 GLU 34 1HB GLU 34 68.345 -11.179 -1.081 285 HB3 GLU 34 2HB GLU 34 69.837 -12.110 -1.211 286 HG2 GLU 34 1HG GLU 34 68.219 -13.829 0.228 287 HG3 GLU 34 2HG GLU 34 67.061 -13.051 -0.846 288 H GLY 35 H GLY 35 71.741 -11.642 0.048 289 HA2 GLY 35 1HA GLY 35 72.408 -9.164 1.376 290 HA3 GLY 35 2HA GLY 35 73.479 -10.114 0.351 291 H ILE 36 H ILE 36 71.750 -7.389 0.659 292 HA ILE 36 HA ILE 36 72.394 -6.480 -1.989 293 HB ILE 36 HB ILE 36 70.196 -7.362 -2.470 294 HG12 ILE 36 1HG1 ILE 36 69.663 -4.439 -1.953 295 HG13 ILE 36 2HG1 ILE 36 70.869 -4.929 -3.143 296 HG21 ILE 36 1HG2 ILE 36 69.394 -7.565 -0.162 297 HG22 ILE 36 2HG2 ILE 36 68.224 -6.712 -1.164 298 HG23 ILE 36 3HG2 ILE 36 69.247 -5.810 -0.050 299 HD11 ILE 36 3HD1 ILE 36 69.084 -6.408 -4.187 300 HD12 ILE 36 1HD1 ILE 36 68.793 -4.676 -4.331 301 HD13 ILE 36 2HD1 ILE 36 67.919 -5.619 -3.124 302 HA PRO 37 HA PRO 37 73.223 -3.487 1.151 303 HB2 PRO 37 1HB PRO 37 74.026 -1.510 -0.779 304 HB3 PRO 37 2HB PRO 37 75.042 -2.485 0.292 305 HG2 PRO 37 1HG PRO 37 74.822 -2.720 -2.489 306 HG3 PRO 37 2HG PRO 37 75.623 -3.847 -1.385 307 HD2 PRO 37 1HD PRO 37 73.046 -4.133 -2.772 308 HD3 PRO 37 2HD PRO 37 74.055 -5.370 -1.989 309 HA PRO 38 HA PRO 38 69.281 -1.383 0.911 310 HB2 PRO 38 1HB PRO 38 69.849 0.066 3.329 311 HB3 PRO 38 2HB PRO 38 68.788 -1.330 3.103 312 HG2 PRO 38 1HG PRO 38 71.274 -1.262 4.423 313 HG3 PRO 38 2HG PRO 38 70.263 -2.672 4.082 314 HD2 PRO 38 1HD PRO 38 72.767 -1.886 2.824 315 HD3 PRO 38 2HD PRO 38 71.853 -3.397 2.652 316 H ASP 39 H ASP 39 72.162 0.481 1.891 317 HA ASP 39 HA ASP 39 71.190 3.037 1.246 318 HB2 ASP 39 1HB ASP 39 74.041 2.031 1.120 319 HB3 ASP 39 2HB ASP 39 73.544 3.720 1.193 320 H GLN 40 H GLN 40 72.426 0.470 -0.732 321 HA GLN 40 HA GLN 40 72.588 2.218 -3.087 322 HB2 GLN 40 1HB GLN 40 74.332 0.383 -2.397 323 HB3 GLN 40 2HB GLN 40 73.170 -0.728 -3.118 324 HG2 GLN 40 1HG GLN 40 74.393 -0.226 -5.008 325 HG3 GLN 40 2HG GLN 40 73.223 1.089 -5.087 326 HE21 GLN 40 2HE2 GLN 40 74.020 3.119 -3.663 327 HE22 GLN 40 1HE2 GLN 40 75.653 3.530 -3.883 328 H GLN 41 H GLN 41 70.159 0.859 -1.528 329 HA GLN 41 HA GLN 41 68.849 -0.197 -3.958 330 HB2 GLN 41 1HB GLN 41 69.107 -1.345 -1.429 331 HB3 GLN 41 2HB GLN 41 67.453 -0.743 -1.460 332 HG2 GLN 41 1HG GLN 41 68.721 -2.504 -3.574 333 HG3 GLN 41 2HG GLN 41 67.577 -3.042 -2.347 334 HE21 GLN 41 2HE2 GLN 41 66.757 -3.478 -4.919 335 HE22 GLN 41 1HE2 GLN 41 65.574 -2.352 -5.383 336 H ARG 42 H ARG 42 67.251 0.924 -4.823 337 HA ARG 42 HA ARG 42 65.754 2.864 -3.161 338 HB2 ARG 42 1HB ARG 42 66.846 3.274 -5.957 339 HB3 ARG 42 2HB ARG 42 65.640 4.321 -5.214 340 HG2 ARG 42 1HG ARG 42 67.491 5.494 -4.535 341 HG3 ARG 42 2HG ARG 42 67.490 4.310 -3.231 342 HD2 ARG 42 1HD ARG 42 69.723 4.581 -4.338 343 HD3 ARG 42 2HD ARG 42 69.104 2.933 -4.395 344 HE ARG 42 HE ARG 42 68.939 3.128 -6.708 345 HH11 ARG 42 1HH1 ARG 42 71.272 4.907 -6.804 346 HH12 ARG 42 2HH1 ARG 42 70.677 6.320 -7.609 347 HH21 ARG 42 1HH2 ARG 42 67.340 5.533 -7.091 348 HH22 ARG 42 2HH2 ARG 42 68.450 6.676 -7.771 349 H LEU 43 H LEU 43 63.559 2.865 -3.461 350 HA LEU 43 HA LEU 43 62.472 1.263 -5.699 351 HB2 LEU 43 1HB LEU 43 60.638 0.915 -3.634 352 HB3 LEU 43 2HB LEU 43 61.778 -0.292 -4.215 353 HG LEU 43 HG LEU 43 62.551 1.756 -2.134 354 HD11 LEU 43 1HD1 LEU 43 62.140 -0.178 -0.501 355 HD12 LEU 43 2HD1 LEU 43 61.187 -0.918 -1.784 356 HD13 LEU 43 3HD1 LEU 43 60.708 0.643 -1.119 357 HD21 LEU 43 3HD2 LEU 43 64.554 0.766 -2.463 358 HD22 LEU 43 1HD2 LEU 43 63.852 -0.468 -3.504 359 HD23 LEU 43 2HD2 LEU 43 63.877 -0.699 -1.757 360 H ILE 44 H ILE 44 60.234 1.776 -6.220 361 HA ILE 44 HA ILE 44 59.330 4.418 -5.277 362 HB ILE 44 HB ILE 44 60.501 4.887 -7.328 363 HG12 ILE 44 1HG1 ILE 44 57.607 4.729 -8.168 364 HG13 ILE 44 2HG1 ILE 44 58.116 5.818 -6.877 365 HG21 ILE 44 1HG2 ILE 44 60.764 3.107 -8.714 366 HG22 ILE 44 2HG2 ILE 44 59.206 3.581 -9.387 367 HG23 ILE 44 3HG2 ILE 44 59.287 2.334 -8.147 368 HD11 ILE 44 3HD1 ILE 44 59.609 6.996 -8.329 369 HD12 ILE 44 1HD1 ILE 44 58.093 6.835 -9.214 370 HD13 ILE 44 2HD1 ILE 44 59.450 5.775 -9.591 371 H PHE 45 H PHE 45 57.133 4.638 -5.101 372 HA PHE 45 HA PHE 45 55.467 2.356 -5.997 373 HB2 PHE 45 1HB PHE 45 55.553 1.939 -3.712 374 HB3 PHE 45 2HB PHE 45 55.671 3.647 -3.300 375 HD1 PHE 45 HD2 PHE 45 53.371 0.962 -4.419 376 HD2 PHE 45 HD1 PHE 45 53.710 5.014 -3.037 377 HE1 PHE 45 HE2 PHE 45 50.913 1.057 -4.089 378 HE2 PHE 45 HE1 PHE 45 51.255 5.108 -2.707 379 HZ PHE 45 HZ PHE 45 49.857 3.130 -3.232 380 H ALA 46 H ALA 46 53.611 2.860 -6.996 381 HA ALA 46 HA ALA 46 52.107 4.162 -8.160 382 HB1 ALA 46 3HB ALA 46 50.703 5.488 -6.761 383 HB2 ALA 46 1HB ALA 46 52.000 5.752 -5.596 384 HB3 ALA 46 2HB ALA 46 51.274 4.153 -5.760 385 H GLY 47 H GLY 47 54.873 4.960 -8.448 386 HA2 GLY 47 1HA GLY 47 55.852 6.643 -9.738 387 HA3 GLY 47 2HA GLY 47 54.422 7.637 -9.484 388 H LYS 48 H LYS 48 54.681 6.975 -6.507 389 HA LYS 48 HA LYS 48 56.310 9.277 -5.852 390 HB2 LYS 48 1HB LYS 48 55.003 7.348 -3.925 391 HB3 LYS 48 2HB LYS 48 55.468 9.024 -3.633 392 HG2 LYS 48 1HG LYS 48 53.839 9.534 -5.638 393 HG3 LYS 48 2HG LYS 48 53.164 7.955 -5.244 394 HD2 LYS 48 1HD LYS 48 53.566 10.113 -3.159 395 HD3 LYS 48 2HD LYS 48 52.077 9.958 -4.089 396 HE2 LYS 48 1HE LYS 48 52.852 7.373 -3.029 397 HE3 LYS 48 2HE LYS 48 52.747 8.562 -1.730 398 HZ1 LYS 48 3HZ LYS 48 50.603 7.632 -2.039 399 HZ2 LYS 48 1HZ LYS 48 50.652 7.881 -3.716 400 HZ3 LYS 48 2HZ LYS 48 50.552 9.210 -2.662 401 H GLN 49 H GLN 49 58.442 9.121 -5.674 402 HA GLN 49 HA GLN 49 59.817 6.639 -5.426 403 HB2 GLN 49 1HB GLN 49 61.813 8.262 -5.020 404 HB3 GLN 49 2HB GLN 49 61.023 8.255 -6.596 405 HG2 GLN 49 1HG GLN 49 59.888 10.099 -4.543 406 HG3 GLN 49 2HG GLN 49 61.461 10.528 -5.209 407 HE21 GLN 49 2HE2 GLN 49 61.442 11.587 -7.208 408 HE22 GLN 49 1HE2 GLN 49 60.096 11.665 -8.241 409 H LEU 50 H LEU 50 60.191 5.496 -3.651 410 HA LEU 50 HA LEU 50 59.712 6.610 -1.028 411 HB2 LEU 50 1HB LEU 50 60.718 3.882 -1.912 412 HB3 LEU 50 2HB LEU 50 60.305 4.307 -0.251 413 HG LEU 50 HG LEU 50 58.429 4.311 -2.641 414 HD11 LEU 50 1HD1 LEU 50 57.206 2.675 -1.016 415 HD12 LEU 50 2HD1 LEU 50 58.785 2.530 -0.241 416 HD13 LEU 50 3HD1 LEU 50 58.589 2.086 -1.936 417 HD21 LEU 50 3HD2 LEU 50 57.504 6.030 -1.454 418 HD22 LEU 50 1HD2 LEU 50 58.222 5.526 0.071 419 HD23 LEU 50 2HD2 LEU 50 56.787 4.705 -0.544 420 H GLU 51 H GLU 51 61.103 7.844 -0.102 421 HA GLU 51 HA GLU 51 63.866 7.975 -0.908 422 HB2 GLU 51 1HB GLU 51 62.492 9.641 1.180 423 HB3 GLU 51 2HB GLU 51 63.917 10.050 0.222 424 HG2 GLU 51 1HG GLU 51 62.450 9.797 -1.842 425 HG3 GLU 51 2HG GLU 51 61.071 9.735 -0.748 426 H ASP 52 H ASP 52 65.082 9.036 1.076 427 HA ASP 52 HA ASP 52 66.536 7.169 2.375 428 HB2 ASP 52 1HB ASP 52 65.981 9.897 3.507 429 HB3 ASP 52 2HB ASP 52 67.437 8.923 3.697 430 H GLY 53 H GLY 53 63.380 7.247 3.050 431 HA2 GLY 53 1HA GLY 53 62.754 5.766 4.992 432 HA3 GLY 53 2HA GLY 53 63.829 6.765 5.937 433 H ARG 54 H ARG 54 61.501 7.654 3.477 434 HA ARG 54 HA ARG 54 60.149 9.546 5.259 435 HB2 ARG 54 1HB ARG 54 60.394 9.219 2.397 436 HB3 ARG 54 2HB ARG 54 58.694 9.030 2.815 437 HG2 ARG 54 1HG ARG 54 59.087 11.374 2.396 438 HG3 ARG 54 2HG ARG 54 58.852 11.173 4.132 439 HD2 ARG 54 1HD ARG 54 61.021 11.713 4.621 440 HD3 ARG 54 2HD ARG 54 61.657 10.937 3.177 441 HE ARG 54 HE ARG 54 60.734 12.952 1.944 442 HH11 ARG 54 1HH2 ARG 54 61.227 13.172 5.369 443 HH12 ARG 54 2HH2 ARG 54 61.743 14.824 5.322 444 HH21 ARG 54 1HH1 ARG 54 61.564 15.079 1.874 445 HH22 ARG 54 2HH1 ARG 54 61.932 15.899 3.355 446 H THR 55 H THR 55 57.883 9.008 5.944 447 HA THR 55 HA THR 55 57.685 6.150 6.286 448 HB THR 55 HB THR 55 55.937 8.463 7.073 449 HG1 THR 55 HG1 THR 55 57.446 8.414 8.531 450 HG21 THR 55 3HG2 THR 55 54.695 6.787 8.446 451 HG22 THR 55 1HG2 THR 55 55.555 5.515 7.586 452 HG23 THR 55 2HG2 THR 55 54.455 6.579 6.715 453 H LEU 56 H LEU 56 56.335 4.752 5.402 454 HA LEU 56 HA LEU 56 55.140 5.400 2.886 455 HB2 LEU 56 1HB LEU 56 55.987 3.031 4.271 456 HB3 LEU 56 2HB LEU 56 54.436 2.787 3.470 457 HG LEU 56 HG LEU 56 55.393 3.639 1.360 458 HD11 LEU 56 1HD1 LEU 56 57.022 5.188 1.827 459 HD12 LEU 56 2HD1 LEU 56 58.035 3.785 1.506 460 HD13 LEU 56 3HD1 LEU 56 57.683 4.254 3.168 461 HD21 LEU 56 3HD2 LEU 56 57.532 1.728 2.105 462 HD22 LEU 56 1HD2 LEU 56 56.337 1.632 0.813 463 HD23 LEU 56 2HD2 LEU 56 55.894 1.178 2.451 464 H SER 57 H SER 57 53.935 4.840 6.137 465 HA SER 57 HA SER 57 51.265 4.278 5.522 466 HB2 SER 57 1HB SER 57 51.792 4.195 7.831 467 HB3 SER 57 2HB SER 57 52.523 5.799 7.809 468 HG SER 57 HG SER 57 49.782 5.235 7.319 469 H ASP 58 H ASP 58 53.163 7.169 5.408 470 HA ASP 58 HA ASP 58 51.003 8.997 4.898 471 HB2 ASP 58 1HB ASP 58 54.005 9.137 4.606 472 HB3 ASP 58 2HB ASP 58 52.965 10.433 4.020 473 H TYR 59 H TYR 59 53.069 6.865 3.071 474 HA TYR 59 HA TYR 59 52.336 7.932 0.484 475 HB2 TYR 59 1HB TYR 59 53.934 5.560 1.422 476 HB3 TYR 59 2HB TYR 59 53.443 5.695 -0.262 477 HD1 TYR 59 HD2 TYR 59 54.615 8.101 2.350 478 HD2 TYR 59 HD1 TYR 59 55.116 6.554 -1.615 479 HE1 TYR 59 HE2 TYR 59 56.410 9.759 1.940 480 HE2 TYR 59 HE1 TYR 59 56.911 8.218 -2.035 481 HH TYR 59 HH TYR 59 58.595 9.555 -0.446 482 H ASN 60 H ASN 60 50.608 6.500 2.744 483 HA ASN 60 HA ASN 60 48.705 5.223 2.830 484 HB2 ASN 60 1HB ASN 60 48.092 7.102 1.217 485 HB3 ASN 60 2HB ASN 60 48.374 5.943 -0.081 486 HD21 ASN 60 2HD2 ASN 60 45.903 6.449 -0.366 487 HD22 ASN 60 1HD2 ASN 60 44.832 5.453 0.496 488 H ILE 61 H ILE 61 50.982 3.685 2.432 489 HA ILE 61 HA ILE 61 50.769 2.007 0.170 490 HB ILE 61 HB ILE 61 52.068 1.474 2.837 491 HG12 ILE 61 1HG1 ILE 61 53.138 3.290 1.660 492 HG13 ILE 61 2HG1 ILE 61 54.122 1.850 1.452 493 HG21 ILE 61 1HG2 ILE 61 53.321 -0.196 1.141 494 HG22 ILE 61 2HG2 ILE 61 51.741 -0.175 0.363 495 HG23 ILE 61 3HG2 ILE 61 51.889 -0.690 2.043 496 HD11 ILE 61 3HD1 ILE 61 52.414 3.259 -0.565 497 HD12 ILE 61 1HD1 ILE 61 52.718 1.529 -0.745 498 HD13 ILE 61 2HD1 ILE 61 54.064 2.665 -0.723 499 H GLN 62 H GLN 62 49.803 0.224 -0.236 500 HA GLN 62 HA GLN 62 47.568 -0.546 1.477 501 HB2 GLN 62 1HB GLN 62 46.707 -1.621 -0.593 502 HB3 GLN 62 2HB GLN 62 46.980 0.111 -0.756 503 HG2 GLN 62 1HG GLN 62 49.170 -0.329 -1.803 504 HG3 GLN 62 2HG GLN 62 48.882 -2.064 -1.667 505 HE21 GLN 62 2HE2 GLN 62 46.828 0.702 -2.771 506 HE22 GLN 62 1HE2 GLN 62 46.403 -0.024 -4.244 507 H LYS 63 H LYS 63 46.854 -2.784 0.677 508 HA LYS 63 HA LYS 63 47.851 -4.746 2.183 509 HB2 LYS 63 1HB LYS 63 46.319 -4.816 -0.388 510 HB3 LYS 63 2HB LYS 63 46.730 -6.306 0.460 511 HG2 LYS 63 1HG LYS 63 45.567 -5.608 2.437 512 HG3 LYS 63 2HG LYS 63 45.376 -3.968 1.818 513 HD2 LYS 63 1HD LYS 63 43.991 -4.898 -0.056 514 HD3 LYS 63 2HD LYS 63 44.074 -6.477 0.727 515 HE2 LYS 63 1HE LYS 63 43.057 -3.993 2.128 516 HE3 LYS 63 2HE LYS 63 41.999 -5.117 1.275 517 HZ1 LYS 63 3HZ LYS 63 43.168 -6.878 2.717 518 HZ2 LYS 63 1HZ LYS 63 41.971 -5.909 3.428 519 HZ3 LYS 63 2HZ LYS 63 43.612 -5.565 3.701 520 H GLU 64 H GLU 64 50.223 -3.628 0.666 521 HA GLU 64 HA GLU 64 52.274 -4.695 0.246 522 HB2 GLU 64 1HB GLU 64 52.525 -6.984 0.060 523 HB3 GLU 64 2HB GLU 64 51.091 -6.853 1.063 524 HG2 GLU 64 1HG GLU 64 50.066 -8.216 -0.426 525 HG3 GLU 64 2HG GLU 64 50.066 -6.864 -1.552 526 H SER 65 H SER 65 51.360 -2.978 -1.310 527 HA SER 65 HA SER 65 50.815 -3.517 -4.011 528 HB2 SER 65 1HB SER 65 52.025 -1.179 -4.186 529 HB3 SER 65 2HB SER 65 50.461 -1.319 -3.391 530 HG SER 65 HG SER 65 52.978 -1.487 -2.087 531 H THR 66 H THR 66 52.192 -3.368 -5.838 532 HA THR 66 HA THR 66 54.818 -4.568 -5.459 533 HB THR 66 HB THR 66 53.738 -5.549 -7.269 534 HG1 THR 66 HG1 THR 66 55.047 -5.051 -8.862 535 HG21 THR 66 3HG2 THR 66 52.685 -2.776 -7.829 536 HG22 THR 66 1HG2 THR 66 51.770 -4.222 -7.401 537 HG23 THR 66 2HG2 THR 66 52.524 -4.093 -8.991 538 H LEU 67 H LEU 67 56.683 -3.457 -5.434 539 HA LEU 67 HA LEU 67 56.646 -0.597 -6.150 540 HB2 LEU 67 1HB LEU 67 58.448 -2.304 -4.442 541 HB3 LEU 67 2HB LEU 67 58.989 -0.733 -5.030 542 HG LEU 67 HG LEU 67 57.204 0.404 -3.910 543 HD11 LEU 67 1HD1 LEU 67 56.087 -2.376 -3.524 544 HD12 LEU 67 2HD1 LEU 67 55.309 -0.979 -4.268 545 HD13 LEU 67 3HD1 LEU 67 55.559 -1.024 -2.523 546 HD21 LEU 67 3HD2 LEU 67 57.563 -0.295 -1.551 547 HD22 LEU 67 1HD2 LEU 67 59.071 -0.238 -2.459 548 HD23 LEU 67 2HD2 LEU 67 58.304 -1.789 -2.125 549 H HIS 68 H HIS 68 57.768 0.196 -7.846 550 HA HIS 68 HA HIS 68 59.015 -1.703 -9.669 551 HB2 HIS 68 1HB HIS 68 57.682 -0.165 -10.824 552 HB3 HIS 68 2HB HIS 68 58.214 1.191 -9.834 553 HD1 HIS 68 HD1 HIS 68 59.890 2.655 -10.945 554 HD2 HIS 68 HD2 HIS 68 60.055 -1.239 -12.424 555 HE1 HIS 68 HE1 HIS 68 61.641 2.659 -12.777 556 H LEU 69 H LEU 69 61.151 -1.967 -9.962 557 HA LEU 69 HA LEU 69 62.969 -0.547 -8.184 558 HB2 LEU 69 1HB LEU 69 63.350 -2.847 -10.106 559 HB3 LEU 69 2HB LEU 69 64.655 -2.150 -9.149 560 HG LEU 69 HG LEU 69 62.143 -2.970 -7.731 561 HD11 LEU 69 1HD1 LEU 69 64.350 -4.920 -8.452 562 HD12 LEU 69 2HD1 LEU 69 62.780 -4.876 -9.254 563 HD13 LEU 69 3HD1 LEU 69 62.883 -5.267 -7.540 564 HD21 LEU 69 3HD2 LEU 69 64.097 -1.801 -6.627 565 HD22 LEU 69 1HD2 LEU 69 65.072 -3.225 -6.988 566 HD23 LEU 69 2HD2 LEU 69 63.685 -3.358 -5.907 567 H VAL 70 H VAL 70 65.065 0.238 -9.054 568 HA VAL 70 HA VAL 70 64.714 1.524 -11.703 569 HB VAL 70 HB VAL 70 66.138 3.373 -10.736 570 HG11 VAL 70 1HG1 VAL 70 63.665 3.516 -10.969 571 HG12 VAL 70 2HG1 VAL 70 64.251 4.409 -9.566 572 HG13 VAL 70 3HG1 VAL 70 63.493 2.831 -9.353 573 HG21 VAL 70 3HG2 VAL 70 66.972 1.915 -8.828 574 HG22 VAL 70 1HG2 VAL 70 65.378 2.092 -8.097 575 HG23 VAL 70 2HG2 VAL 70 66.396 3.510 -8.346 576 H LEU 71 H LEU 71 66.728 2.072 -12.803 577 HA LEU 71 HA LEU 71 68.423 -0.043 -13.235 578 HB2 LEU 71 1HB LEU 71 69.132 2.894 -13.449 579 HB3 LEU 71 2HB LEU 71 69.977 1.570 -14.250 580 HG LEU 71 HG LEU 71 67.014 1.817 -14.660 581 HD11 LEU 71 1HD1 LEU 71 67.484 3.328 -16.616 582 HD12 LEU 71 2HD1 LEU 71 69.119 3.544 -15.993 583 HD13 LEU 71 3HD1 LEU 71 67.736 4.097 -15.050 584 HD21 LEU 71 3HD2 LEU 71 68.358 -0.088 -15.569 585 HD22 LEU 71 1HD2 LEU 71 69.309 1.068 -16.502 586 HD23 LEU 71 2HD2 LEU 71 67.590 0.867 -16.837 587 H ARG 72 H ARG 72 69.586 2.888 -11.583 588 HA ARG 72 HA ARG 72 71.845 1.748 -10.430 589 HB2 ARG 72 1HB ARG 72 70.131 4.050 -9.471 590 HB3 ARG 72 2HB ARG 72 71.714 3.653 -8.804 591 HG2 ARG 72 1HG ARG 72 72.741 3.942 -11.020 592 HG3 ARG 72 2HG ARG 72 71.161 4.303 -11.715 593 HD2 ARG 72 1HD ARG 72 72.603 5.915 -9.593 594 HD3 ARG 72 2HD ARG 72 72.341 6.392 -11.267 595 HE ARG 72 HE ARG 72 70.369 6.420 -9.121 596 HH11 ARG 72 1HH2 ARG 72 68.918 5.182 -11.368 597 HH12 ARG 72 2HH2 ARG 72 68.349 6.540 -12.280 598 HH21 ARG 72 1HH1 ARG 72 70.538 8.786 -10.800 599 HH22 ARG 72 2HH1 ARG 72 69.267 8.581 -11.959 Start of MODEL 8 1 H1 MET 1 1H MET 1 48.209 -3.424 7.598 2 H2 MET 1 2H MET 1 49.851 -3.804 7.819 3 H3 MET 1 3H MET 1 48.721 -5.038 7.528 4 HA MET 1 HA MET 1 48.527 -4.567 5.312 5 HB2 MET 1 1HB MET 1 48.934 -1.840 6.307 6 HB3 MET 1 2HB MET 1 49.772 -2.126 4.783 7 HG2 MET 1 1HG MET 1 47.531 -1.338 4.289 8 HG3 MET 1 2HG MET 1 47.624 -3.042 3.849 9 HE1 MET 1 3HE MET 1 45.199 -1.007 7.102 10 HE2 MET 1 1HE MET 1 45.761 -0.381 5.545 11 HE3 MET 1 2HE MET 1 46.907 -0.654 6.855 12 H GLN 2 H GLN 2 49.984 -5.959 4.558 13 HA GLN 2 HA GLN 2 52.803 -5.730 5.238 14 HB2 GLN 2 1HB GLN 2 51.106 -7.758 3.805 15 HB3 GLN 2 2HB GLN 2 52.867 -7.830 3.702 16 HG2 GLN 2 1HG GLN 2 52.162 -9.230 5.549 17 HG3 GLN 2 2HG GLN 2 52.951 -7.800 6.211 18 HE21 GLN 2 2HE2 GLN 2 49.845 -9.444 5.852 19 HE22 GLN 2 1HE2 GLN 2 48.988 -8.430 6.910 20 H ILE 3 H ILE 3 54.462 -5.927 3.485 21 HA ILE 3 HA ILE 3 53.624 -4.418 1.091 22 HB ILE 3 HB ILE 3 55.936 -3.980 2.917 23 HG12 ILE 3 1HG1 ILE 3 53.956 -2.333 1.330 24 HG13 ILE 3 2HG1 ILE 3 54.124 -2.435 3.080 25 HG21 ILE 3 1HG2 ILE 3 55.979 -3.397 -0.069 26 HG22 ILE 3 2HG2 ILE 3 57.039 -4.526 0.773 27 HG23 ILE 3 3HG2 ILE 3 57.160 -2.802 1.096 28 HD11 ILE 3 3HD1 ILE 3 55.188 -0.436 2.704 29 HD12 ILE 3 1HD1 ILE 3 55.741 -0.899 1.096 30 HD13 ILE 3 2HD1 ILE 3 56.567 -1.521 2.526 31 H PHE 4 H PHE 4 54.693 -4.815 -0.830 32 HA PHE 4 HA PHE 4 56.297 -7.279 -0.992 33 HB2 PHE 4 1HB PHE 4 54.248 -8.219 -1.535 34 HB3 PHE 4 2HB PHE 4 53.626 -6.714 -2.202 35 HD1 PHE 4 HD1 PHE 4 56.783 -8.577 -2.903 36 HD2 PHE 4 HD2 PHE 4 53.045 -7.129 -4.440 37 HE1 PHE 4 HE1 PHE 4 57.427 -9.334 -5.173 38 HE2 PHE 4 HE2 PHE 4 53.690 -7.888 -6.714 39 HZ PHE 4 HZ PHE 4 55.880 -8.989 -7.078 40 H VAL 5 H VAL 5 57.953 -7.107 -2.408 41 HA VAL 5 HA VAL 5 57.953 -4.801 -4.273 42 HB VAL 5 HB VAL 5 60.266 -5.923 -2.677 43 HG11 VAL 5 1HG1 VAL 5 61.438 -3.903 -3.725 44 HG12 VAL 5 2HG1 VAL 5 60.092 -3.843 -4.864 45 HG13 VAL 5 3HG1 VAL 5 61.131 -5.267 -4.800 46 HG21 VAL 5 3HG2 VAL 5 60.189 -3.922 -1.425 47 HG22 VAL 5 1HG2 VAL 5 58.489 -4.361 -1.591 48 HG23 VAL 5 2HG2 VAL 5 59.182 -3.107 -2.620 49 H LYS 6 H LYS 6 58.804 -5.121 -6.315 50 HA LYS 6 HA LYS 6 59.195 -7.943 -7.083 51 HB2 LYS 6 1HB LYS 6 57.511 -6.967 -8.429 52 HB3 LYS 6 2HB LYS 6 58.417 -5.466 -8.624 53 HG2 LYS 6 1HG LYS 6 60.021 -6.513 -10.062 54 HG3 LYS 6 2HG LYS 6 59.429 -8.125 -9.660 55 HD2 LYS 6 1HD LYS 6 57.230 -7.514 -10.693 56 HD3 LYS 6 2HD LYS 6 57.942 -5.983 -11.203 57 HE2 LYS 6 1HE LYS 6 58.525 -8.761 -12.174 58 HE3 LYS 6 2HE LYS 6 58.301 -7.278 -13.102 59 HZ1 LYS 6 3HZ LYS 6 60.577 -7.686 -13.194 60 HZ2 LYS 6 1HZ LYS 6 60.670 -8.150 -11.566 61 HZ3 LYS 6 2HZ LYS 6 60.435 -6.516 -11.971 62 H THR 7 H THR 7 61.058 -8.651 -8.013 63 HA THR 7 HA THR 7 63.293 -6.711 -8.188 64 HB THR 7 HB THR 7 64.723 -8.794 -7.803 65 HG1 THR 7 HG1 THR 7 62.154 -9.782 -7.595 66 HG21 THR 7 3HG2 THR 7 64.431 -8.678 -5.381 67 HG22 THR 7 1HG2 THR 7 62.830 -7.967 -5.585 68 HG23 THR 7 2HG2 THR 7 64.264 -7.064 -6.072 69 H LEU 8 H LEU 8 64.958 -7.248 -9.790 70 HA LEU 8 HA LEU 8 63.816 -7.809 -12.343 71 HB2 LEU 8 1HB LEU 8 66.761 -7.725 -11.651 72 HB3 LEU 8 2HB LEU 8 66.038 -7.508 -13.238 73 HG LEU 8 HG LEU 8 66.434 -5.304 -12.615 74 HD11 LEU 8 1HD1 LEU 8 63.704 -5.723 -11.370 75 HD12 LEU 8 2HD1 LEU 8 63.995 -5.680 -13.110 76 HD13 LEU 8 3HD1 LEU 8 64.325 -4.257 -12.125 77 HD21 LEU 8 3HD2 LEU 8 67.224 -5.085 -10.508 78 HD22 LEU 8 1HD2 LEU 8 66.214 -6.385 -9.884 79 HD23 LEU 8 2HD2 LEU 8 65.553 -4.762 -10.059 80 H THR 9 H THR 9 64.651 -9.846 -9.880 81 HA THR 9 HA THR 9 65.658 -12.009 -11.577 82 HB THR 9 HB THR 9 65.009 -12.165 -8.636 83 HG1 THR 9 HG1 THR 9 67.432 -11.369 -9.873 84 HG21 THR 9 3HG2 THR 9 66.899 -13.649 -10.482 85 HG22 THR 9 1HG2 THR 9 65.442 -14.293 -9.728 86 HG23 THR 9 2HG2 THR 9 66.836 -13.873 -8.734 87 H GLY 10 H GLY 10 62.695 -10.794 -10.448 88 HA2 GLY 10 1HA GLY 10 60.548 -11.541 -10.926 89 HA3 GLY 10 2HA GLY 10 61.245 -13.005 -11.617 90 H LYS 11 H LYS 11 62.424 -12.224 -8.519 91 HA LYS 11 HA LYS 11 60.945 -14.478 -7.364 92 HB2 LYS 11 1HB LYS 11 63.596 -13.663 -7.182 93 HB3 LYS 11 2HB LYS 11 62.913 -13.159 -5.636 94 HG2 LYS 11 1HG LYS 11 62.028 -15.436 -5.281 95 HG3 LYS 11 2HG LYS 11 62.699 -15.940 -6.833 96 HD2 LYS 11 1HD LYS 11 64.966 -15.443 -6.046 97 HD3 LYS 11 2HD LYS 11 64.325 -14.865 -4.507 98 HE2 LYS 11 1HE LYS 11 65.195 -17.263 -4.511 99 HE3 LYS 11 2HE LYS 11 63.551 -17.047 -3.905 100 HZ1 LYS 11 3HZ LYS 11 62.642 -17.974 -5.767 101 HZ2 LYS 11 1HZ LYS 11 64.082 -18.865 -5.669 102 HZ3 LYS 11 2HZ LYS 11 63.958 -17.571 -6.763 103 H THR 12 H THR 12 59.367 -14.240 -5.900 104 HA THR 12 HA THR 12 58.395 -11.602 -5.282 105 HB THR 12 HB THR 12 56.737 -13.276 -5.636 106 HG1 THR 12 HG1 THR 12 55.852 -12.201 -4.057 107 HG21 THR 12 3HG2 THR 12 57.022 -15.101 -3.504 108 HG22 THR 12 1HG2 THR 12 58.628 -14.956 -4.217 109 HG23 THR 12 2HG2 THR 12 57.257 -15.432 -5.220 110 H ILE 13 H ILE 13 59.076 -10.374 -3.669 111 HA ILE 13 HA ILE 13 60.211 -11.673 -1.262 112 HB ILE 13 HB ILE 13 61.736 -10.213 -2.791 113 HG12 ILE 13 1HG1 ILE 13 61.493 -9.579 0.167 114 HG13 ILE 13 2HG1 ILE 13 62.300 -11.000 -0.492 115 HG21 ILE 13 1HG2 ILE 13 60.488 -7.972 -1.202 116 HG22 ILE 13 2HG2 ILE 13 59.911 -8.377 -2.817 117 HG23 ILE 13 3HG2 ILE 13 61.579 -7.867 -2.581 118 HD11 ILE 13 3HD1 ILE 13 63.247 -8.520 -1.736 119 HD12 ILE 13 1HD1 ILE 13 64.169 -9.824 -0.989 120 HD13 ILE 13 2HD1 ILE 13 63.497 -8.535 0.008 121 H THR 14 H THR 14 58.920 -11.516 0.440 122 HA THR 14 HA THR 14 57.120 -9.169 0.655 123 HB THR 14 HB THR 14 55.458 -10.518 1.534 124 HG1 THR 14 HG1 THR 14 56.852 -11.360 3.176 125 HG21 THR 14 3HG2 THR 14 56.926 -12.663 0.005 126 HG22 THR 14 1HG2 THR 14 56.234 -11.262 -0.817 127 HG23 THR 14 2HG2 THR 14 55.190 -12.362 0.083 128 H LEU 15 H LEU 15 57.216 -7.953 2.453 129 HA LEU 15 HA LEU 15 59.073 -8.815 4.596 130 HB2 LEU 15 1HB LEU 15 58.505 -5.951 4.531 131 HB3 LEU 15 2HB LEU 15 60.058 -6.785 4.535 132 HG LEU 15 HG LEU 15 58.295 -6.352 2.104 133 HD11 LEU 15 1HD1 LEU 15 60.184 -4.863 1.396 134 HD12 LEU 15 2HD1 LEU 15 60.891 -5.069 2.999 135 HD13 LEU 15 3HD1 LEU 15 59.326 -4.273 2.822 136 HD21 LEU 15 3HD2 LEU 15 60.405 -8.239 2.626 137 HD22 LEU 15 1HD2 LEU 15 60.992 -7.057 1.457 138 HD23 LEU 15 2HD2 LEU 15 59.525 -7.971 1.123 139 H GLU 16 H GLU 16 58.473 -8.454 6.751 140 HA GLU 16 HA GLU 16 55.568 -8.103 7.109 141 HB2 GLU 16 1HB GLU 16 57.549 -8.822 9.277 142 HB3 GLU 16 2HB GLU 16 55.821 -9.163 9.212 143 HG2 GLU 16 1HG GLU 16 56.143 -10.785 7.440 144 HG3 GLU 16 2HG GLU 16 57.846 -10.352 7.292 145 H VAL 17 H VAL 17 55.045 -6.044 7.268 146 HA VAL 17 HA VAL 17 56.473 -4.337 9.180 147 HB VAL 17 HB VAL 17 57.585 -4.024 7.007 148 HG11 VAL 17 1HG1 VAL 17 54.870 -3.102 6.025 149 HG12 VAL 17 2HG1 VAL 17 55.542 -4.693 5.681 150 HG13 VAL 17 3HG1 VAL 17 56.352 -3.251 5.080 151 HG21 VAL 17 3HG2 VAL 17 55.869 -1.588 7.346 152 HG22 VAL 17 1HG2 VAL 17 57.603 -1.704 7.090 153 HG23 VAL 17 2HG2 VAL 17 56.924 -2.076 8.670 154 H GLU 18 H GLU 18 55.421 -2.140 9.220 155 HA GLU 18 HA GLU 18 52.482 -2.399 9.067 156 HB2 GLU 18 1HB GLU 18 53.672 -0.191 10.661 157 HB3 GLU 18 2HB GLU 18 52.304 -1.234 11.039 158 HG2 GLU 18 1HG GLU 18 53.920 -1.898 12.605 159 HG3 GLU 18 2HG GLU 18 54.080 -3.105 11.330 160 HA PRO 19 HA PRO 19 52.397 0.543 5.866 161 HB2 PRO 19 1HB PRO 19 50.757 2.526 7.126 162 HB3 PRO 19 2HB PRO 19 50.294 1.320 5.918 163 HG2 PRO 19 1HG PRO 19 49.864 1.328 8.784 164 HG3 PRO 19 2HG PRO 19 49.113 0.327 7.532 165 HD2 PRO 19 1HD PRO 19 50.935 -0.590 9.390 166 HD3 PRO 19 2HD PRO 19 50.599 -1.375 7.836 167 H SER 20 H SER 20 53.742 1.447 8.969 168 HA SER 20 HA SER 20 54.239 4.154 8.069 169 HB2 SER 20 1HB SER 20 55.661 2.540 10.207 170 HB3 SER 20 2HB SER 20 55.861 4.268 9.932 171 HG SER 20 HG SER 20 54.195 4.487 11.180 172 H ASP 21 H ASP 21 55.616 0.988 7.837 173 HA ASP 21 HA ASP 21 57.629 0.355 6.778 174 HB2 ASP 21 1HB ASP 21 55.469 1.315 5.060 175 HB3 ASP 21 2HB ASP 21 57.040 1.188 4.268 176 H THR 22 H THR 22 59.045 2.209 7.997 177 HA THR 22 HA THR 22 59.415 4.407 6.124 178 HB THR 22 HB THR 22 60.431 5.479 7.843 179 HG1 THR 22 HG1 THR 22 62.323 4.193 7.395 180 HG21 THR 22 3HG2 THR 22 58.605 4.250 9.020 181 HG22 THR 22 1HG2 THR 22 59.972 4.621 10.070 182 HG23 THR 22 2HG2 THR 22 59.763 2.990 9.437 183 H ILE 23 H ILE 23 60.857 4.599 4.697 184 HA ILE 23 HA ILE 23 61.939 2.414 3.469 185 HB ILE 23 HB ILE 23 63.304 4.987 2.943 186 HG12 ILE 23 1HG1 ILE 23 60.294 4.592 2.852 187 HG13 ILE 23 2HG1 ILE 23 61.150 5.830 3.744 188 HG21 ILE 23 1HG2 ILE 23 63.144 2.781 1.526 189 HG22 ILE 23 2HG2 ILE 23 62.975 4.333 0.707 190 HG23 ILE 23 3HG2 ILE 23 61.544 3.381 1.099 191 HD11 ILE 23 3HD1 ILE 23 61.464 7.139 1.902 192 HD12 ILE 23 1HD1 ILE 23 60.023 6.290 1.357 193 HD13 ILE 23 2HD1 ILE 23 61.611 5.762 0.812 194 H GLU 24 H GLU 24 63.358 4.417 5.947 195 HA GLU 24 HA GLU 24 65.990 3.292 5.649 196 HB2 GLU 24 1HB GLU 24 65.544 5.431 6.898 197 HB3 GLU 24 2HB GLU 24 64.685 4.494 8.120 198 HG2 GLU 24 1HG GLU 24 67.357 3.419 7.502 199 HG3 GLU 24 2HG GLU 24 67.401 5.056 8.148 200 H ASN 25 H ASN 25 62.948 2.571 7.091 201 HA ASN 25 HA ASN 25 63.780 0.339 8.707 202 HB2 ASN 25 1HB ASN 25 61.647 1.974 8.792 203 HB3 ASN 25 2HB ASN 25 60.934 0.633 7.908 204 HD21 ASN 25 2HD2 ASN 25 61.240 1.754 10.989 205 HD22 ASN 25 1HD2 ASN 25 61.249 0.285 11.838 206 H VAL 26 H VAL 26 62.104 0.729 5.589 207 HA VAL 26 HA VAL 26 61.734 -2.071 5.187 208 HB VAL 26 HB VAL 26 61.672 0.192 3.182 209 HG11 VAL 26 1HG1 VAL 26 60.128 -1.610 2.050 210 HG12 VAL 26 2HG1 VAL 26 61.027 -2.744 3.057 211 HG13 VAL 26 3HG1 VAL 26 61.879 -1.744 1.881 212 HG21 VAL 26 3HG2 VAL 26 59.471 -1.225 4.715 213 HG22 VAL 26 1HG2 VAL 26 59.229 0.034 3.504 214 HG23 VAL 26 2HG2 VAL 26 60.033 0.416 5.028 215 H LYS 27 H LYS 27 64.215 0.236 4.269 216 HA LYS 27 HA LYS 27 65.547 -1.177 2.294 217 HB2 LYS 27 1HB LYS 27 66.117 1.019 4.090 218 HB3 LYS 27 2HB LYS 27 67.548 0.031 3.872 219 HG2 LYS 27 1HG LYS 27 67.525 1.712 2.133 220 HG3 LYS 27 2HG LYS 27 67.169 0.153 1.386 221 HD2 LYS 27 1HD LYS 27 64.649 0.934 2.009 222 HD3 LYS 27 2HD LYS 27 65.401 2.512 1.789 223 HE2 LYS 27 1HE LYS 27 65.369 0.236 -0.207 224 HE3 LYS 27 2HE LYS 27 64.504 1.767 -0.339 225 HZ1 LYS 27 3HZ LYS 27 66.472 1.940 -1.627 226 HZ2 LYS 27 1HZ LYS 27 67.439 1.355 -0.361 227 HZ3 LYS 27 2HZ LYS 27 66.709 2.883 -0.232 228 H ALA 28 H ALA 28 66.166 -1.305 5.810 229 HA ALA 28 HA ALA 28 68.156 -3.286 5.641 230 HB1 ALA 28 3HB ALA 28 67.983 -2.070 7.672 231 HB2 ALA 28 1HB ALA 28 67.518 -3.725 8.061 232 HB3 ALA 28 2HB ALA 28 66.280 -2.485 7.860 233 H LYS 29 H LYS 29 64.637 -3.459 5.776 234 HA LYS 29 HA LYS 29 64.432 -6.253 6.216 235 HB2 LYS 29 1HB LYS 29 62.589 -4.146 5.159 236 HB3 LYS 29 2HB LYS 29 62.182 -5.828 4.829 237 HG2 LYS 29 1HG LYS 29 62.184 -6.368 7.174 238 HG3 LYS 29 2HG LYS 29 62.852 -4.790 7.593 239 HD2 LYS 29 1HD LYS 29 60.762 -3.769 6.551 240 HD3 LYS 29 2HD LYS 29 60.096 -5.401 6.507 241 HE2 LYS 29 1HE LYS 29 60.900 -3.780 8.924 242 HE3 LYS 29 2HE LYS 29 59.328 -4.495 8.563 243 HZ1 LYS 29 3HZ LYS 29 61.753 -5.751 9.594 244 HZ2 LYS 29 1HZ LYS 29 60.793 -6.672 8.541 245 HZ3 LYS 29 2HZ LYS 29 60.125 -6.054 9.976 246 H ILE 30 H ILE 30 64.900 -4.272 3.327 247 HA ILE 30 HA ILE 30 64.549 -6.341 1.422 248 HB ILE 30 HB ILE 30 66.369 -3.927 1.205 249 HG12 ILE 30 1HG1 ILE 30 64.150 -3.134 1.710 250 HG13 ILE 30 2HG1 ILE 30 64.381 -2.942 -0.022 251 HG21 ILE 30 1HG2 ILE 30 65.113 -4.756 -1.252 252 HG22 ILE 30 2HG2 ILE 30 65.904 -6.150 -0.524 253 HG23 ILE 30 3HG2 ILE 30 66.832 -4.692 -0.866 254 HD11 ILE 30 3HD1 ILE 30 62.736 -5.007 1.434 255 HD12 ILE 30 1HD1 ILE 30 63.288 -5.286 -0.218 256 HD13 ILE 30 2HD1 ILE 30 62.241 -3.915 0.143 257 H GLN 31 H GLN 31 67.302 -5.285 3.346 258 HA GLN 31 HA GLN 31 69.260 -6.919 2.066 259 HB2 GLN 31 1HB GLN 31 69.684 -4.874 3.499 260 HB3 GLN 31 2HB GLN 31 69.346 -5.888 4.900 261 HG2 GLN 31 1HG GLN 31 71.118 -7.503 3.840 262 HG3 GLN 31 2HG GLN 31 71.624 -6.075 2.942 263 HE21 GLN 31 2HE2 GLN 31 73.485 -5.339 3.998 264 HE22 GLN 31 1HE2 GLN 31 73.606 -5.092 5.672 265 H ASP 32 H ASP 32 67.112 -7.425 4.828 266 HA ASP 32 HA ASP 32 68.364 -9.686 5.912 267 HB2 ASP 32 1HB ASP 32 65.443 -8.930 5.993 268 HB3 ASP 32 2HB ASP 32 66.230 -10.102 7.048 269 H LYS 33 H LYS 33 65.724 -9.587 3.481 270 HA LYS 33 HA LYS 33 65.279 -12.369 3.440 271 HB2 LYS 33 1HB LYS 33 64.977 -10.545 1.056 272 HB3 LYS 33 2HB LYS 33 64.059 -12.004 1.428 273 HG2 LYS 33 1HG LYS 33 63.993 -9.370 2.924 274 HG3 LYS 33 2HG LYS 33 62.678 -10.113 2.015 275 HD2 LYS 33 1HD LYS 33 62.892 -12.100 3.626 276 HD3 LYS 33 2HD LYS 33 63.888 -11.039 4.625 277 HE2 LYS 33 1HE LYS 33 61.079 -10.381 3.703 278 HE3 LYS 33 2HE LYS 33 61.483 -11.018 5.296 279 HZ1 LYS 33 3HZ LYS 33 61.442 -8.389 4.584 280 HZ2 LYS 33 1HZ LYS 33 63.094 -8.769 4.577 281 HZ3 LYS 33 2HZ LYS 33 62.169 -9.035 5.977 282 H GLU 34 H GLU 34 67.244 -10.404 1.214 283 HA GLU 34 HA GLU 34 69.016 -12.723 0.807 284 HB2 GLU 34 1HB GLU 34 67.587 -11.132 -1.324 285 HB3 GLU 34 2HB GLU 34 69.113 -11.948 -1.664 286 HG2 GLU 34 1HG GLU 34 68.199 -14.077 -1.353 287 HG3 GLU 34 2HG GLU 34 66.882 -13.476 -0.348 288 H GLY 35 H GLY 35 71.128 -11.906 -0.313 289 HA2 GLY 35 1HA GLY 35 71.923 -9.542 1.157 290 HA3 GLY 35 2HA GLY 35 72.953 -10.508 0.101 291 H ILE 36 H ILE 36 71.344 -7.701 0.496 292 HA ILE 36 HA ILE 36 72.085 -6.727 -2.110 293 HB ILE 36 HB ILE 36 69.906 -7.341 -2.791 294 HG12 ILE 36 1HG1 ILE 36 68.504 -5.118 -2.459 295 HG13 ILE 36 2HG1 ILE 36 70.010 -4.495 -1.800 296 HG21 ILE 36 1HG2 ILE 36 68.931 -6.423 -0.077 297 HG22 ILE 36 2HG2 ILE 36 69.118 -8.096 -0.599 298 HG23 ILE 36 3HG2 ILE 36 67.914 -7.062 -1.365 299 HD11 ILE 36 3HD1 ILE 36 69.876 -5.889 -4.483 300 HD12 ILE 36 1HD1 ILE 36 71.177 -4.881 -3.849 301 HD13 ILE 36 2HD1 ILE 36 69.641 -4.151 -4.310 302 HA PRO 37 HA PRO 37 72.905 -3.850 1.178 303 HB2 PRO 37 1HB PRO 37 73.999 -1.943 -0.679 304 HB3 PRO 37 2HB PRO 37 74.859 -2.961 0.485 305 HG2 PRO 37 1HG PRO 37 74.861 -3.208 -2.310 306 HG3 PRO 37 2HG PRO 37 75.531 -4.348 -1.135 307 HD2 PRO 37 1HD PRO 37 73.093 -4.585 -2.739 308 HD3 PRO 37 2HD PRO 37 73.951 -5.829 -1.807 309 HA PRO 38 HA PRO 38 69.104 -1.622 0.517 310 HB2 PRO 38 1HB PRO 38 69.581 0.092 2.775 311 HB3 PRO 38 2HB PRO 38 68.487 -1.293 2.646 312 HG2 PRO 38 1HG PRO 38 70.936 -1.129 4.070 313 HG3 PRO 38 2HG PRO 38 69.849 -2.512 3.913 314 HD2 PRO 38 1HD PRO 38 72.438 -2.142 2.697 315 HD3 PRO 38 2HD PRO 38 71.363 -3.550 2.597 316 H ASP 39 H ASP 39 72.207 -0.048 0.921 317 HA ASP 39 HA ASP 39 71.386 2.575 0.180 318 HB2 ASP 39 1HB ASP 39 74.137 1.527 -0.407 319 HB3 ASP 39 2HB ASP 39 73.648 3.121 0.166 320 H GLN 40 H GLN 40 72.171 -0.311 -1.601 321 HA GLN 40 HA GLN 40 72.266 1.126 -4.156 322 HB2 GLN 40 1HB GLN 40 73.831 -0.816 -3.483 323 HB3 GLN 40 2HB GLN 40 72.444 -1.860 -3.786 324 HG2 GLN 40 1HG GLN 40 72.316 -0.515 -6.062 325 HG3 GLN 40 2HG GLN 40 74.012 -0.183 -5.721 326 HE21 GLN 40 2HE2 GLN 40 75.163 -2.412 -4.876 327 HE22 GLN 40 1HE2 GLN 40 74.874 -3.741 -5.892 328 H GLN 41 H GLN 41 70.013 -0.419 -2.140 329 HA GLN 41 HA GLN 41 68.281 -1.391 -4.242 330 HB2 GLN 41 1HB GLN 41 68.384 -2.461 -2.001 331 HB3 GLN 41 2HB GLN 41 67.683 -0.999 -1.304 332 HG2 GLN 41 1HG GLN 41 65.944 -2.691 -1.728 333 HG3 GLN 41 2HG GLN 41 65.691 -1.267 -2.730 334 HE21 GLN 41 2HE2 GLN 41 66.728 -4.666 -2.799 335 HE22 GLN 41 1HE2 GLN 41 66.635 -4.834 -4.485 336 H ARG 42 H ARG 42 66.472 -0.448 -5.064 337 HA ARG 42 HA ARG 42 65.808 2.287 -4.130 338 HB2 ARG 42 1HB ARG 42 67.020 2.196 -6.349 339 HB3 ARG 42 2HB ARG 42 65.632 1.316 -6.987 340 HG2 ARG 42 1HG ARG 42 64.859 3.412 -7.493 341 HG3 ARG 42 2HG ARG 42 64.363 3.419 -5.802 342 HD2 ARG 42 1HD ARG 42 66.609 4.414 -5.231 343 HD3 ARG 42 2HD ARG 42 66.917 4.565 -6.958 344 HE ARG 42 HE ARG 42 64.932 6.062 -7.042 345 HH11 ARG 42 1HH2 ARG 42 67.286 7.089 -5.232 346 HH12 ARG 42 2HH2 ARG 42 66.379 7.805 -3.942 347 HH21 ARG 42 1HH1 ARG 42 63.399 6.272 -4.828 348 HH22 ARG 42 2HH1 ARG 42 64.181 7.343 -3.714 349 H LEU 43 H LEU 43 63.686 2.717 -3.802 350 HA LEU 43 HA LEU 43 61.720 0.640 -4.587 351 HB2 LEU 43 1HB LEU 43 62.371 1.778 -1.954 352 HB3 LEU 43 2HB LEU 43 60.654 1.829 -2.331 353 HG LEU 43 HG LEU 43 60.767 -0.613 -2.915 354 HD11 LEU 43 1HD1 LEU 43 63.607 -0.187 -1.980 355 HD12 LEU 43 2HD1 LEU 43 63.037 -1.011 -3.431 356 HD13 LEU 43 3HD1 LEU 43 62.836 -1.768 -1.853 357 HD21 LEU 43 3HD2 LEU 43 60.041 0.196 -0.677 358 HD22 LEU 43 1HD2 LEU 43 61.711 0.102 -0.119 359 HD23 LEU 43 2HD2 LEU 43 60.851 -1.367 -0.582 360 H ILE 44 H ILE 44 59.986 1.349 -5.677 361 HA ILE 44 HA ILE 44 59.237 4.201 -5.527 362 HB ILE 44 HB ILE 44 59.504 2.621 -8.101 363 HG12 ILE 44 1HG1 ILE 44 61.166 4.838 -6.866 364 HG13 ILE 44 2HG1 ILE 44 61.700 3.213 -7.288 365 HG21 ILE 44 1HG2 ILE 44 57.645 4.340 -7.983 366 HG22 ILE 44 2HG2 ILE 44 58.864 4.667 -9.212 367 HG23 ILE 44 3HG2 ILE 44 58.882 5.560 -7.694 368 HD11 ILE 44 3HD1 ILE 44 62.476 4.457 -9.108 369 HD12 ILE 44 1HD1 ILE 44 61.074 5.526 -9.102 370 HD13 ILE 44 2HD1 ILE 44 60.923 3.877 -9.708 371 H PHE 45 H PHE 45 57.038 4.599 -5.652 372 HA PHE 45 HA PHE 45 55.238 2.361 -6.271 373 HB2 PHE 45 1HB PHE 45 55.326 2.005 -3.967 374 HB3 PHE 45 2HB PHE 45 55.496 3.722 -3.608 375 HD1 PHE 45 HD1 PHE 45 53.558 5.214 -3.606 376 HD2 PHE 45 HD2 PHE 45 53.135 1.028 -4.479 377 HE1 PHE 45 HE1 PHE 45 51.105 5.400 -3.307 378 HE2 PHE 45 HE2 PHE 45 50.680 1.215 -4.181 379 HZ PHE 45 HZ PHE 45 49.664 3.401 -3.595 380 H ALA 46 H ALA 46 53.361 2.969 -7.201 381 HA ALA 46 HA ALA 46 51.949 4.350 -8.393 382 HB1 ALA 46 3HB ALA 46 50.844 6.056 -7.019 383 HB2 ALA 46 1HB ALA 46 52.121 5.921 -5.811 384 HB3 ALA 46 2HB ALA 46 51.045 4.557 -6.112 385 H GLY 47 H GLY 47 54.581 4.787 -9.117 386 HA2 GLY 47 1HA GLY 47 55.761 6.297 -10.406 387 HA3 GLY 47 2HA GLY 47 54.425 7.430 -10.212 388 H LYS 48 H LYS 48 54.722 6.953 -7.192 389 HA LYS 48 HA LYS 48 56.555 9.159 -6.759 390 HB2 LYS 48 1HB LYS 48 54.845 7.558 -4.844 391 HB3 LYS 48 2HB LYS 48 55.797 8.975 -4.403 392 HG2 LYS 48 1HG LYS 48 54.481 10.066 -6.453 393 HG3 LYS 48 2HG LYS 48 53.313 8.801 -6.077 394 HD2 LYS 48 1HD LYS 48 54.416 10.685 -3.978 395 HD3 LYS 48 2HD LYS 48 52.949 11.029 -4.893 396 HE2 LYS 48 1HE LYS 48 51.727 9.587 -3.646 397 HE3 LYS 48 2HE LYS 48 52.937 8.316 -3.795 398 HZ1 LYS 48 3HZ LYS 48 52.733 8.955 -1.511 399 HZ2 LYS 48 1HZ LYS 48 52.983 10.590 -1.888 400 HZ3 LYS 48 2HZ LYS 48 54.248 9.472 -2.083 401 H GLN 49 H GLN 49 58.607 8.979 -6.247 402 HA GLN 49 HA GLN 49 59.799 6.389 -5.806 403 HB2 GLN 49 1HB GLN 49 61.893 7.923 -5.497 404 HB3 GLN 49 2HB GLN 49 61.168 7.776 -7.098 405 HG2 GLN 49 1HG GLN 49 60.213 9.932 -5.230 406 HG3 GLN 49 2HG GLN 49 61.706 10.164 -6.135 407 HE21 GLN 49 2HE2 GLN 49 58.422 10.745 -6.320 408 HE22 GLN 49 1HE2 GLN 49 58.256 10.819 -8.007 409 H LEU 50 H LEU 50 60.180 5.460 -3.888 410 HA LEU 50 HA LEU 50 59.515 6.874 -1.460 411 HB2 LEU 50 1HB LEU 50 60.692 4.103 -1.853 412 HB3 LEU 50 2HB LEU 50 60.045 4.735 -0.344 413 HG LEU 50 HG LEU 50 58.553 4.041 -2.878 414 HD11 LEU 50 1HD1 LEU 50 58.656 2.227 -1.345 415 HD12 LEU 50 2HD1 LEU 50 57.059 2.935 -1.118 416 HD13 LEU 50 3HD1 LEU 50 58.346 3.273 0.038 417 HD21 LEU 50 3HD2 LEU 50 56.528 5.029 -1.639 418 HD22 LEU 50 1HD2 LEU 50 57.629 6.170 -2.402 419 HD23 LEU 50 2HD2 LEU 50 57.699 5.906 -0.658 420 H GLU 51 H GLU 51 60.816 7.938 -0.197 421 HA GLU 51 HA GLU 51 63.523 8.418 -1.048 422 HB2 GLU 51 1HB GLU 51 62.061 9.684 1.254 423 HB3 GLU 51 2HB GLU 51 63.442 10.327 0.361 424 HG2 GLU 51 1HG GLU 51 61.999 10.232 -1.724 425 HG3 GLU 51 2HG GLU 51 60.630 9.887 -0.669 426 H ASP 52 H ASP 52 64.767 9.321 0.970 427 HA ASP 52 HA ASP 52 66.394 7.395 1.981 428 HB2 ASP 52 1HB ASP 52 65.771 10.118 3.099 429 HB3 ASP 52 2HB ASP 52 67.135 9.121 3.605 430 H GLY 53 H GLY 53 63.266 7.377 2.910 431 HA2 GLY 53 1HA GLY 53 62.790 5.722 4.748 432 HA3 GLY 53 2HA GLY 53 63.986 6.587 5.676 433 H ARG 54 H ARG 54 61.412 7.787 3.605 434 HA ARG 54 HA ARG 54 60.359 9.532 5.709 435 HB2 ARG 54 1HB ARG 54 59.823 9.058 2.779 436 HB3 ARG 54 2HB ARG 54 58.489 9.658 3.760 437 HG2 ARG 54 1HG ARG 54 61.106 11.044 4.116 438 HG3 ARG 54 2HG ARG 54 60.301 11.291 2.568 439 HD2 ARG 54 1HD ARG 54 59.504 13.028 3.988 440 HD3 ARG 54 2HD ARG 54 58.196 11.856 3.897 441 HE ARG 54 HE ARG 54 59.925 12.360 6.221 442 HH11 ARG 54 1HH1 ARG 54 56.865 11.512 5.052 443 HH12 ARG 54 2HH1 ARG 54 56.455 10.473 6.375 444 HH21 ARG 54 1HH2 ARG 54 59.607 10.614 7.811 445 HH22 ARG 54 2HH2 ARG 54 58.006 9.966 7.937 446 H THR 55 H THR 55 57.985 9.048 6.421 447 HA THR 55 HA THR 55 57.836 6.173 6.741 448 HB THR 55 HB THR 55 56.315 8.530 7.741 449 HG1 THR 55 HG1 THR 55 57.093 6.119 8.993 450 HG21 THR 55 3HG2 THR 55 54.679 6.780 8.743 451 HG22 THR 55 1HG2 THR 55 55.178 5.775 7.387 452 HG23 THR 55 2HG2 THR 55 54.407 7.330 7.089 453 H LEU 56 H LEU 56 56.538 4.785 5.763 454 HA LEU 56 HA LEU 56 55.382 5.530 3.265 455 HB2 LEU 56 1HB LEU 56 56.217 3.097 4.546 456 HB3 LEU 56 2HB LEU 56 54.724 2.885 3.642 457 HG LEU 56 HG LEU 56 55.836 4.015 1.679 458 HD11 LEU 56 1HD1 LEU 56 58.510 3.548 2.891 459 HD12 LEU 56 2HD1 LEU 56 57.635 4.969 3.454 460 HD13 LEU 56 3HD1 LEU 56 57.999 4.780 1.740 461 HD21 LEU 56 3HD2 LEU 56 56.145 1.374 2.540 462 HD22 LEU 56 1HD2 LEU 56 57.774 1.869 2.099 463 HD23 LEU 56 2HD2 LEU 56 56.465 1.983 0.924 464 H SER 57 H SER 57 54.118 4.906 6.457 465 HA SER 57 HA SER 57 51.481 4.265 5.813 466 HB2 SER 57 1HB SER 57 51.940 4.242 8.129 467 HB3 SER 57 2HB SER 57 52.689 5.834 8.086 468 HG SER 57 HG SER 57 50.085 5.138 8.424 469 H ASP 58 H ASP 58 53.298 7.195 5.623 470 HA ASP 58 HA ASP 58 51.092 8.955 5.057 471 HB2 ASP 58 1HB ASP 58 54.063 9.254 4.509 472 HB3 ASP 58 2HB ASP 58 52.864 10.540 4.369 473 H TYR 59 H TYR 59 53.176 6.792 3.303 474 HA TYR 59 HA TYR 59 52.556 7.816 0.675 475 HB2 TYR 59 1HB TYR 59 54.108 5.517 1.776 476 HB3 TYR 59 2HB TYR 59 53.578 5.429 0.105 477 HD1 TYR 59 HD2 TYR 59 55.354 7.621 2.528 478 HD2 TYR 59 HD1 TYR 59 54.698 6.595 -1.581 479 HE1 TYR 59 HE2 TYR 59 57.191 9.150 1.864 480 HE2 TYR 59 HE1 TYR 59 56.527 8.132 -2.258 481 HH TYR 59 HH TYR 59 57.622 10.465 -0.748 482 H ASN 60 H ASN 60 50.682 6.299 2.865 483 HA ASN 60 HA ASN 60 48.770 5.020 2.759 484 HB2 ASN 60 1HB ASN 60 48.846 6.350 0.057 485 HB3 ASN 60 2HB ASN 60 47.521 5.287 0.524 486 HD21 ASN 60 2HD2 ASN 60 46.239 5.947 2.471 487 HD22 ASN 60 1HD2 ASN 60 46.175 7.586 2.905 488 H ILE 61 H ILE 61 51.055 3.475 2.445 489 HA ILE 61 HA ILE 61 51.061 1.900 0.095 490 HB ILE 61 HB ILE 61 52.042 1.195 2.863 491 HG12 ILE 61 1HG1 ILE 61 53.174 3.156 2.010 492 HG13 ILE 61 2HG1 ILE 61 54.251 1.780 1.829 493 HG21 ILE 61 1HG2 ILE 61 52.280 -0.879 1.978 494 HG22 ILE 61 2HG2 ILE 61 53.549 -0.178 0.975 495 HG23 ILE 61 3HG2 ILE 61 51.909 -0.314 0.348 496 HD11 ILE 61 3HD1 ILE 61 53.239 1.588 -0.565 497 HD12 ILE 61 1HD1 ILE 61 54.437 2.842 -0.248 498 HD13 ILE 61 2HD1 ILE 61 52.726 3.255 -0.297 499 H GLN 62 H GLN 62 50.134 0.121 -0.482 500 HA GLN 62 HA GLN 62 47.659 -0.617 0.863 501 HB2 GLN 62 1HB GLN 62 47.716 0.077 -1.512 502 HB3 GLN 62 2HB GLN 62 48.726 -1.318 -1.877 503 HG2 GLN 62 1HG GLN 62 46.986 -2.843 -1.464 504 HG3 GLN 62 2HG GLN 62 46.063 -1.676 -0.512 505 HE21 GLN 62 2HE2 GLN 62 46.679 -2.868 -3.736 506 HE22 GLN 62 1HE2 GLN 62 45.598 -1.834 -4.537 507 H LYS 63 H LYS 63 46.979 -2.852 0.225 508 HA LYS 63 HA LYS 63 47.836 -4.795 1.866 509 HB2 LYS 63 1HB LYS 63 46.507 -5.119 -0.815 510 HB3 LYS 63 2HB LYS 63 46.598 -6.371 0.425 511 HG2 LYS 63 1HG LYS 63 45.454 -4.860 2.022 512 HG3 LYS 63 2HG LYS 63 45.329 -3.638 0.759 513 HD2 LYS 63 1HD LYS 63 43.369 -4.583 0.140 514 HD3 LYS 63 2HD LYS 63 44.286 -5.988 -0.402 515 HE2 LYS 63 1HE LYS 63 43.293 -5.589 2.438 516 HE3 LYS 63 2HE LYS 63 42.469 -6.565 1.223 517 HZ1 LYS 63 3HZ LYS 63 44.912 -7.109 2.696 518 HZ2 LYS 63 1HZ LYS 63 44.930 -7.553 1.059 519 HZ3 LYS 63 2HZ LYS 63 43.740 -8.183 2.097 520 H GLU 64 H GLU 64 50.264 -3.836 0.441 521 HA GLU 64 HA GLU 64 52.287 -4.979 0.056 522 HB2 GLU 64 1HB GLU 64 50.738 -7.375 -0.905 523 HB3 GLU 64 2HB GLU 64 52.421 -7.290 -0.424 524 HG2 GLU 64 1HG GLU 64 51.947 -7.587 1.751 525 HG3 GLU 64 2HG GLU 64 50.620 -6.443 1.731 526 H SER 65 H SER 65 51.307 -3.191 -1.516 527 HA SER 65 HA SER 65 50.799 -3.851 -4.213 528 HB2 SER 65 1HB SER 65 51.426 -1.484 -2.612 529 HB3 SER 65 2HB SER 65 52.082 -1.403 -4.244 530 HG SER 65 HG SER 65 50.084 -1.535 -5.064 531 H THR 66 H THR 66 52.245 -3.779 -6.020 532 HA THR 66 HA THR 66 54.933 -4.729 -5.392 533 HB THR 66 HB THR 66 54.849 -5.772 -7.402 534 HG1 THR 66 HG1 THR 66 53.773 -3.343 -8.389 535 HG21 THR 66 3HG2 THR 66 52.015 -4.767 -7.667 536 HG22 THR 66 1HG2 THR 66 52.467 -5.942 -6.433 537 HG23 THR 66 2HG2 THR 66 52.671 -6.334 -8.141 538 H LEU 67 H LEU 67 56.661 -3.429 -5.316 539 HA LEU 67 HA LEU 67 56.444 -0.718 -6.458 540 HB2 LEU 67 1HB LEU 67 58.355 -1.890 -4.418 541 HB3 LEU 67 2HB LEU 67 58.473 -0.252 -5.057 542 HG LEU 67 HG LEU 67 55.885 -0.199 -4.321 543 HD11 LEU 67 1HD1 LEU 67 55.462 -1.465 -2.334 544 HD12 LEU 67 2HD1 LEU 67 57.142 -1.996 -2.238 545 HD13 LEU 67 3HD1 LEU 67 56.097 -2.603 -3.521 546 HD21 LEU 67 3HD2 LEU 67 56.661 0.790 -2.153 547 HD22 LEU 67 1HD2 LEU 67 57.562 1.393 -3.544 548 HD23 LEU 67 2HD2 LEU 67 58.278 0.173 -2.491 549 H HIS 68 H HIS 68 57.952 0.091 -7.883 550 HA HIS 68 HA HIS 68 59.555 -1.931 -9.300 551 HB2 HIS 68 1HB HIS 68 58.475 0.782 -10.049 552 HB3 HIS 68 2HB HIS 68 59.762 0.022 -10.985 553 HD1 HIS 68 HD1 HIS 68 59.182 -2.392 -12.014 554 HD2 HIS 68 HD2 HIS 68 55.924 -0.231 -10.567 555 HE1 HIS 68 HE1 HIS 68 57.113 -3.475 -12.994 556 H LEU 69 H LEU 69 61.753 -1.631 -9.698 557 HA LEU 69 HA LEU 69 63.069 0.369 -7.958 558 HB2 LEU 69 1HB LEU 69 64.725 -1.872 -8.903 559 HB3 LEU 69 2HB LEU 69 64.540 -1.212 -7.278 560 HG LEU 69 HG LEU 69 62.235 -2.346 -7.258 561 HD11 LEU 69 1HD1 LEU 69 61.577 -3.611 -9.013 562 HD12 LEU 69 2HD1 LEU 69 63.144 -4.411 -9.123 563 HD13 LEU 69 3HD1 LEU 69 62.886 -2.866 -9.927 564 HD21 LEU 69 3HD2 LEU 69 63.323 -4.612 -6.793 565 HD22 LEU 69 1HD2 LEU 69 63.992 -3.244 -5.901 566 HD23 LEU 69 2HD2 LEU 69 64.843 -3.882 -7.308 567 H VAL 70 H VAL 70 64.525 1.752 -8.818 568 HA VAL 70 HA VAL 70 65.526 1.318 -11.539 569 HB VAL 70 HB VAL 70 64.324 3.995 -10.873 570 HG11 VAL 70 1HG1 VAL 70 64.156 4.106 -13.338 571 HG12 VAL 70 2HG1 VAL 70 64.808 2.473 -13.454 572 HG13 VAL 70 3HG1 VAL 70 65.812 3.780 -12.829 573 HG21 VAL 70 3HG2 VAL 70 62.514 2.377 -10.524 574 HG22 VAL 70 1HG2 VAL 70 62.885 1.603 -12.065 575 HG23 VAL 70 2HG2 VAL 70 62.254 3.248 -12.034 576 H LEU 71 H LEU 71 67.226 2.915 -12.107 577 HA LEU 71 HA LEU 71 69.040 4.265 -11.630 578 HB2 LEU 71 1HB LEU 71 67.299 5.144 -9.769 579 HB3 LEU 71 2HB LEU 71 68.482 4.389 -8.706 580 HG LEU 71 HG LEU 71 69.111 6.707 -9.004 581 HD11 LEU 71 1HD1 LEU 71 70.858 4.768 -9.192 582 HD12 LEU 71 2HD1 LEU 71 71.356 6.411 -9.586 583 HD13 LEU 71 3HD1 LEU 71 70.979 5.272 -10.879 584 HD21 LEU 71 3HD2 LEU 71 69.554 6.446 -11.944 585 HD22 LEU 71 1HD2 LEU 71 69.077 7.853 -10.997 586 HD23 LEU 71 2HD2 LEU 71 67.884 6.623 -11.410 587 H ARG 72 H ARG 72 70.819 3.067 -11.834 588 HA ARG 72 HA ARG 72 71.423 0.618 -10.822 589 HB2 ARG 72 1HB ARG 72 73.869 1.371 -10.932 590 HB3 ARG 72 2HB ARG 72 72.921 1.542 -12.410 591 HG2 ARG 72 1HG ARG 72 72.543 3.901 -11.949 592 HG3 ARG 72 2HG ARG 72 73.359 3.761 -10.392 593 HD2 ARG 72 1HD ARG 72 75.466 3.288 -11.454 594 HD3 ARG 72 2HD ARG 72 74.699 3.135 -13.034 595 HE ARG 72 HE ARG 72 74.087 5.621 -12.621 596 HH11 ARG 72 1HH1 ARG 72 76.822 5.062 -13.826 597 HH12 ARG 72 2HH1 ARG 72 77.851 6.030 -12.824 598 HH21 ARG 72 1HH2 ARG 72 75.488 6.431 -10.322 599 HH22 ARG 72 2HH2 ARG 72 77.097 6.805 -10.841 Start of MODEL 9 1 H1 MET 1 1H MET 1 51.118 -3.105 7.422 2 H2 MET 1 2H MET 1 49.428 -3.043 7.587 3 H3 MET 1 3H MET 1 50.274 -1.706 6.974 4 HA MET 1 HA MET 1 49.328 -4.051 5.625 5 HB2 MET 1 1HB MET 1 50.181 -1.244 4.941 6 HB3 MET 1 2HB MET 1 49.865 -2.418 3.665 7 HG2 MET 1 1HG MET 1 47.597 -2.549 4.155 8 HG3 MET 1 2HG MET 1 47.829 -2.106 5.846 9 HE1 MET 1 3HE MET 1 45.659 -0.566 3.346 10 HE2 MET 1 1HE MET 1 45.499 0.582 4.683 11 HE3 MET 1 2HE MET 1 45.645 -1.143 5.009 12 H GLN 2 H GLN 2 50.460 -5.485 4.468 13 HA GLN 2 HA GLN 2 53.310 -5.669 4.796 14 HB2 GLN 2 1HB GLN 2 51.519 -7.303 2.988 15 HB3 GLN 2 2HB GLN 2 53.117 -7.744 3.585 16 HG2 GLN 2 1HG GLN 2 51.886 -7.279 5.946 17 HG3 GLN 2 2HG GLN 2 50.490 -7.773 4.992 18 HE21 GLN 2 2HE2 GLN 2 53.923 -8.914 5.020 19 HE22 GLN 2 1HE2 GLN 2 53.523 -10.546 5.255 20 H ILE 3 H ILE 3 54.749 -6.059 2.901 21 HA ILE 3 HA ILE 3 53.975 -4.608 0.469 22 HB ILE 3 HB ILE 3 56.247 -3.882 2.295 23 HG12 ILE 3 1HG1 ILE 3 54.196 -2.315 0.699 24 HG13 ILE 3 2HG1 ILE 3 54.133 -2.629 2.432 25 HG21 ILE 3 1HG2 ILE 3 57.038 -2.481 0.268 26 HG22 ILE 3 2HG2 ILE 3 56.082 -3.591 -0.711 27 HG23 ILE 3 3HG2 ILE 3 57.426 -4.199 0.254 28 HD11 ILE 3 3HD1 ILE 3 56.668 -1.549 2.065 29 HD12 ILE 3 1HD1 ILE 3 55.253 -0.705 2.681 30 HD13 ILE 3 2HD1 ILE 3 55.651 -0.610 0.971 31 H PHE 4 H PHE 4 54.941 -5.359 -1.375 32 HA PHE 4 HA PHE 4 57.054 -7.351 -1.075 33 HB2 PHE 4 1HB PHE 4 55.938 -9.106 -2.071 34 HB3 PHE 4 2HB PHE 4 54.651 -8.370 -1.122 35 HD1 PHE 4 HD2 PHE 4 53.859 -6.033 -2.697 36 HD2 PHE 4 HD1 PHE 4 54.992 -9.964 -4.002 37 HE1 PHE 4 HE2 PHE 4 52.503 -5.751 -4.752 38 HE2 PHE 4 HE1 PHE 4 53.644 -9.676 -6.056 39 HZ PHE 4 HZ PHE 4 52.398 -7.568 -6.433 40 H VAL 5 H VAL 5 58.539 -7.309 -2.575 41 HA VAL 5 HA VAL 5 58.185 -5.416 -4.814 42 HB VAL 5 HB VAL 5 60.802 -6.418 -3.706 43 HG11 VAL 5 1HG1 VAL 5 60.080 -3.741 -4.897 44 HG12 VAL 5 2HG1 VAL 5 60.614 -5.104 -5.882 45 HG13 VAL 5 3HG1 VAL 5 61.687 -4.426 -4.656 46 HG21 VAL 5 3HG2 VAL 5 59.008 -4.212 -2.661 47 HG22 VAL 5 1HG2 VAL 5 60.733 -4.298 -2.299 48 HG23 VAL 5 2HG2 VAL 5 59.655 -5.588 -1.767 49 H LYS 6 H LYS 6 58.316 -6.142 -6.876 50 HA LYS 6 HA LYS 6 59.134 -8.956 -7.295 51 HB2 LYS 6 1HB LYS 6 56.770 -8.125 -7.936 52 HB3 LYS 6 2HB LYS 6 57.574 -7.291 -9.266 53 HG2 LYS 6 1HG LYS 6 58.659 -9.884 -9.318 54 HG3 LYS 6 2HG LYS 6 56.951 -10.136 -8.976 55 HD2 LYS 6 1HD LYS 6 57.989 -8.406 -11.243 56 HD3 LYS 6 2HD LYS 6 57.499 -10.089 -11.429 57 HE2 LYS 6 1HE LYS 6 55.774 -7.727 -10.668 58 HE3 LYS 6 2HE LYS 6 55.584 -8.815 -12.040 59 HZ1 LYS 6 3HZ LYS 6 55.453 -10.569 -10.087 60 HZ2 LYS 6 1HZ LYS 6 54.081 -9.740 -10.643 61 HZ3 LYS 6 2HZ LYS 6 54.878 -9.215 -9.237 62 H THR 7 H THR 7 60.994 -9.327 -8.332 63 HA THR 7 HA THR 7 62.329 -7.087 -9.692 64 HB THR 7 HB THR 7 63.633 -9.754 -9.283 65 HG1 THR 7 HG1 THR 7 63.868 -9.423 -7.182 66 HG21 THR 7 3HG2 THR 7 64.672 -7.718 -10.440 67 HG22 THR 7 1HG2 THR 7 65.613 -8.436 -9.134 68 HG23 THR 7 2HG2 THR 7 64.695 -6.957 -8.849 69 H LEU 8 H LEU 8 63.403 -7.461 -11.740 70 HA LEU 8 HA LEU 8 61.705 -8.616 -13.680 71 HB2 LEU 8 1HB LEU 8 63.917 -6.908 -13.689 72 HB3 LEU 8 2HB LEU 8 64.481 -8.327 -14.564 73 HG LEU 8 HG LEU 8 61.778 -7.187 -15.238 74 HD11 LEU 8 1HD1 LEU 8 63.083 -5.194 -15.345 75 HD12 LEU 8 2HD1 LEU 8 63.005 -5.800 -17.000 76 HD13 LEU 8 3HD1 LEU 8 64.462 -6.049 -16.038 77 HD21 LEU 8 3HD2 LEU 8 62.371 -8.062 -17.460 78 HD22 LEU 8 1HD2 LEU 8 62.563 -9.320 -16.239 79 HD23 LEU 8 2HD2 LEU 8 63.981 -8.485 -16.875 80 H THR 9 H THR 9 63.650 -10.120 -11.480 81 HA THR 9 HA THR 9 64.522 -12.308 -13.214 82 HB THR 9 HB THR 9 65.714 -13.126 -11.315 83 HG1 THR 9 HG1 THR 9 63.696 -11.941 -10.001 84 HG21 THR 9 3HG2 THR 9 65.812 -10.130 -10.970 85 HG22 THR 9 1HG2 THR 9 66.471 -10.925 -12.400 86 HG23 THR 9 2HG2 THR 9 67.129 -11.292 -10.806 87 H GLY 10 H GLY 10 61.650 -11.488 -12.048 88 HA2 GLY 10 1HA GLY 10 59.689 -12.671 -11.775 89 HA3 GLY 10 2HA GLY 10 60.580 -14.131 -12.190 90 H LYS 11 H LYS 11 61.927 -12.284 -9.645 91 HA LYS 11 HA LYS 11 61.091 -14.335 -7.709 92 HB2 LYS 11 1HB LYS 11 63.549 -13.684 -8.117 93 HB3 LYS 11 2HB LYS 11 63.169 -12.199 -7.245 94 HG2 LYS 11 1HG LYS 11 63.877 -13.557 -5.494 95 HG3 LYS 11 2HG LYS 11 62.140 -13.861 -5.469 96 HD2 LYS 11 1HD LYS 11 62.823 -15.767 -7.222 97 HD3 LYS 11 2HD LYS 11 64.366 -15.642 -6.379 98 HE2 LYS 11 1HE LYS 11 63.020 -15.842 -4.207 99 HE3 LYS 11 2HE LYS 11 61.662 -16.332 -5.220 100 HZ1 LYS 11 3HZ LYS 11 63.677 -17.854 -6.160 101 HZ2 LYS 11 1HZ LYS 11 62.527 -18.365 -5.023 102 HZ3 LYS 11 2HZ LYS 11 64.040 -17.789 -4.502 103 H THR 12 H THR 12 59.560 -13.912 -6.271 104 HA THR 12 HA THR 12 58.761 -11.111 -5.811 105 HB THR 12 HB THR 12 56.899 -12.457 -6.483 106 HG1 THR 12 HG1 THR 12 56.958 -12.193 -3.662 107 HG21 THR 12 3HG2 THR 12 57.546 -14.386 -4.243 108 HG22 THR 12 1HG2 THR 12 58.044 -14.651 -5.914 109 HG23 THR 12 2HG2 THR 12 56.331 -14.574 -5.507 110 H ILE 13 H ILE 13 59.446 -10.149 -4.022 111 HA ILE 13 HA ILE 13 60.096 -11.822 -1.661 112 HB ILE 13 HB ILE 13 62.062 -10.717 -2.735 113 HG12 ILE 13 1HG1 ILE 13 61.400 -9.493 -0.044 114 HG13 ILE 13 2HG1 ILE 13 61.867 -11.182 -0.245 115 HG21 ILE 13 1HG2 ILE 13 61.155 -8.067 -1.709 116 HG22 ILE 13 2HG2 ILE 13 60.439 -8.626 -3.216 117 HG23 ILE 13 3HG2 ILE 13 62.185 -8.447 -3.090 118 HD11 ILE 13 3HD1 ILE 13 64.050 -10.652 -0.529 119 HD12 ILE 13 1HD1 ILE 13 63.619 -9.066 0.108 120 HD13 ILE 13 2HD1 ILE 13 63.672 -9.331 -1.634 121 H THR 14 H THR 14 58.477 -11.635 -0.245 122 HA THR 14 HA THR 14 57.115 -9.043 0.051 123 HB THR 14 HB THR 14 55.678 -11.010 -0.341 124 HG1 THR 14 HG1 THR 14 54.362 -9.985 0.903 125 HG21 THR 14 3HG2 THR 14 56.597 -12.006 2.357 126 HG22 THR 14 1HG2 THR 14 57.311 -12.582 0.852 127 HG23 THR 14 2HG2 THR 14 55.596 -12.843 1.170 128 H LEU 15 H LEU 15 57.180 -7.894 1.907 129 HA LEU 15 HA LEU 15 58.889 -8.945 4.090 130 HB2 LEU 15 1HB LEU 15 58.612 -6.092 4.254 131 HB3 LEU 15 2HB LEU 15 60.075 -7.028 3.952 132 HG LEU 15 HG LEU 15 58.069 -6.287 1.809 133 HD11 LEU 15 1HD1 LEU 15 59.007 -4.227 2.469 134 HD12 LEU 15 2HD1 LEU 15 59.970 -4.729 1.080 135 HD13 LEU 15 3HD1 LEU 15 60.603 -4.935 2.714 136 HD21 LEU 15 3HD2 LEU 15 60.600 -6.779 0.704 137 HD22 LEU 15 1HD2 LEU 15 59.202 -7.848 0.635 138 HD23 LEU 15 2HD2 LEU 15 60.395 -8.042 1.918 139 H GLU 16 H GLU 16 58.187 -8.651 6.226 140 HA GLU 16 HA GLU 16 55.293 -8.155 6.431 141 HB2 GLU 16 1HB GLU 16 56.401 -10.214 7.469 142 HB3 GLU 16 2HB GLU 16 57.172 -9.108 8.605 143 HG2 GLU 16 1HG GLU 16 55.307 -9.266 9.873 144 HG3 GLU 16 2HG GLU 16 54.476 -8.339 8.628 145 H VAL 17 H VAL 17 54.842 -6.095 6.662 146 HA VAL 17 HA VAL 17 56.175 -4.562 8.772 147 HB VAL 17 HB VAL 17 57.463 -4.136 6.715 148 HG11 VAL 17 1HG1 VAL 17 55.499 -4.655 5.197 149 HG12 VAL 17 2HG1 VAL 17 56.413 -3.214 4.752 150 HG13 VAL 17 3HG1 VAL 17 54.868 -3.055 5.585 151 HG21 VAL 17 3HG2 VAL 17 55.892 -1.629 6.923 152 HG22 VAL 17 1HG2 VAL 17 57.615 -1.902 7.128 153 HG23 VAL 17 2HG2 VAL 17 56.511 -2.260 8.447 154 H GLU 18 H GLU 18 55.106 -2.527 9.202 155 HA GLU 18 HA GLU 18 52.210 -2.709 8.891 156 HB2 GLU 18 1HB GLU 18 53.501 -0.320 10.148 157 HB3 GLU 18 2HB GLU 18 52.074 -1.220 10.658 158 HG2 GLU 18 1HG GLU 18 53.669 -1.766 12.301 159 HG3 GLU 18 2HG GLU 18 53.731 -3.141 11.202 160 HA PRO 19 HA PRO 19 52.200 0.187 5.607 161 HB2 PRO 19 1HB PRO 19 50.467 2.229 6.662 162 HB3 PRO 19 2HB PRO 19 50.076 0.925 5.529 163 HG2 PRO 19 1HG PRO 19 49.163 1.103 8.117 164 HG3 PRO 19 2HG PRO 19 49.227 -0.383 7.155 165 HD2 PRO 19 1HD PRO 19 51.069 0.551 9.308 166 HD3 PRO 19 2HD PRO 19 50.577 -1.102 8.876 167 H SER 20 H SER 20 53.462 1.287 8.608 168 HA SER 20 HA SER 20 54.032 3.931 7.576 169 HB2 SER 20 1HB SER 20 53.927 3.865 9.939 170 HB3 SER 20 2HB SER 20 54.927 2.419 10.021 171 HG SER 20 HG SER 20 55.687 4.955 10.102 172 H ASP 21 H ASP 21 55.470 0.756 7.608 173 HA ASP 21 HA ASP 21 57.584 0.128 6.813 174 HB2 ASP 21 1HB ASP 21 56.930 1.475 4.304 175 HB3 ASP 21 2HB ASP 21 57.267 -0.209 4.629 176 H THR 22 H THR 22 58.916 1.840 8.234 177 HA THR 22 HA THR 22 59.511 4.169 6.601 178 HB THR 22 HB THR 22 61.526 3.896 8.580 179 HG1 THR 22 HG1 THR 22 59.235 2.556 9.206 180 HG21 THR 22 3HG2 THR 22 60.342 5.968 7.895 181 HG22 THR 22 1HG2 THR 22 60.347 5.756 9.647 182 HG23 THR 22 2HG2 THR 22 58.893 5.392 8.718 183 H ILE 23 H ILE 23 61.005 4.349 5.212 184 HA ILE 23 HA ILE 23 62.042 2.164 3.960 185 HB ILE 23 HB ILE 23 63.394 4.795 3.584 186 HG12 ILE 23 1HG1 ILE 23 60.448 4.163 3.185 187 HG13 ILE 23 2HG1 ILE 23 61.121 5.457 4.159 188 HG21 ILE 23 1HG2 ILE 23 63.982 3.473 1.810 189 HG22 ILE 23 2HG2 ILE 23 62.429 3.999 1.176 190 HG23 ILE 23 3HG2 ILE 23 62.566 2.436 1.971 191 HD11 ILE 23 3HD1 ILE 23 61.783 5.442 1.250 192 HD12 ILE 23 1HD1 ILE 23 61.545 6.802 2.345 193 HD13 ILE 23 2HD1 ILE 23 60.157 5.914 1.728 194 H GLU 24 H GLU 24 63.661 4.145 6.422 195 HA GLU 24 HA GLU 24 66.173 2.847 6.101 196 HB2 GLU 24 1HB GLU 24 66.475 3.376 8.562 197 HB3 GLU 24 2HB GLU 24 66.087 4.775 7.563 198 HG2 GLU 24 1HG GLU 24 63.760 4.682 8.240 199 HG3 GLU 24 2HG GLU 24 64.035 3.175 9.114 200 H ASN 25 H ASN 25 63.087 2.102 7.482 201 HA ASN 25 HA ASN 25 63.859 -0.354 8.785 202 HB2 ASN 25 1HB ASN 25 61.864 1.266 9.322 203 HB3 ASN 25 2HB ASN 25 61.017 0.317 8.102 204 HD21 ASN 25 2HD2 ASN 25 61.697 0.414 11.404 205 HD22 ASN 25 1HD2 ASN 25 61.412 -1.221 11.766 206 H VAL 26 H VAL 26 62.113 0.492 5.775 207 HA VAL 26 HA VAL 26 61.627 -2.232 5.063 208 HB VAL 26 HB VAL 26 61.678 0.131 3.184 209 HG11 VAL 26 1HG1 VAL 26 61.473 -1.895 1.966 210 HG12 VAL 26 2HG1 VAL 26 59.819 -1.308 2.143 211 HG13 VAL 26 3HG1 VAL 26 60.410 -2.607 3.178 212 HG21 VAL 26 3HG2 VAL 26 59.262 0.343 3.719 213 HG22 VAL 26 1HG2 VAL 26 60.270 0.668 5.126 214 HG23 VAL 26 2HG2 VAL 26 59.447 -0.882 4.976 215 H LYS 27 H LYS 27 63.977 0.186 3.880 216 HA LYS 27 HA LYS 27 65.228 -1.432 1.980 217 HB2 LYS 27 1HB LYS 27 66.665 0.555 3.741 218 HB3 LYS 27 2HB LYS 27 67.085 0.068 2.101 219 HG2 LYS 27 1HG LYS 27 64.505 1.473 2.836 220 HG3 LYS 27 2HG LYS 27 65.934 2.304 2.236 221 HD2 LYS 27 1HD LYS 27 64.700 0.015 0.708 222 HD3 LYS 27 2HD LYS 27 64.104 1.656 0.530 223 HE2 LYS 27 1HE LYS 27 67.021 0.990 0.232 224 HE3 LYS 27 2HE LYS 27 65.891 0.922 -1.118 225 HZ1 LYS 27 3HZ LYS 27 67.171 3.107 -0.584 226 HZ2 LYS 27 1HZ LYS 27 65.950 3.319 0.574 227 HZ3 LYS 27 2HZ LYS 27 65.543 3.167 -1.068 228 H ALA 28 H ALA 28 65.613 -1.256 5.455 229 HA ALA 28 HA ALA 28 67.896 -2.962 5.568 230 HB1 ALA 28 3HB ALA 28 67.324 -1.499 7.439 231 HB2 ALA 28 1HB ALA 28 67.310 -3.183 7.962 232 HB3 ALA 28 2HB ALA 28 65.791 -2.344 7.652 233 H LYS 29 H LYS 29 64.396 -3.425 5.548 234 HA LYS 29 HA LYS 29 64.444 -6.223 6.120 235 HB2 LYS 29 1HB LYS 29 62.398 -4.386 4.876 236 HB3 LYS 29 2HB LYS 29 62.164 -6.130 4.833 237 HG2 LYS 29 1HG LYS 29 62.618 -6.072 7.376 238 HG3 LYS 29 2HG LYS 29 62.367 -4.331 7.250 239 HD2 LYS 29 1HD LYS 29 60.137 -4.674 6.331 240 HD3 LYS 29 2HD LYS 29 60.384 -6.420 6.303 241 HE2 LYS 29 1HE LYS 29 60.834 -5.134 8.936 242 HE3 LYS 29 2HE LYS 29 59.169 -5.106 8.359 243 HZ1 LYS 29 3HZ LYS 29 60.544 -7.244 9.487 244 HZ2 LYS 29 1HZ LYS 29 60.287 -7.640 7.858 245 HZ3 LYS 29 2HZ LYS 29 58.968 -7.238 8.851 246 H ILE 30 H ILE 30 64.714 -4.242 3.216 247 HA ILE 30 HA ILE 30 64.613 -6.363 1.330 248 HB ILE 30 HB ILE 30 66.127 -3.745 1.101 249 HG12 ILE 30 1HG1 ILE 30 63.807 -3.241 1.559 250 HG13 ILE 30 2HG1 ILE 30 64.061 -3.028 -0.167 251 HG21 ILE 30 1HG2 ILE 30 65.149 -5.771 -0.926 252 HG22 ILE 30 2HG2 ILE 30 66.819 -5.318 -0.594 253 HG23 ILE 30 3HG2 ILE 30 65.727 -4.161 -1.354 254 HD11 ILE 30 3HD1 ILE 30 63.298 -5.524 -0.334 255 HD12 ILE 30 1HD1 ILE 30 62.080 -4.269 -0.106 256 HD13 ILE 30 2HD1 ILE 30 62.613 -5.238 1.266 257 H GLN 31 H GLN 31 67.222 -4.837 3.153 258 HA GLN 31 HA GLN 31 69.336 -6.380 2.014 259 HB2 GLN 31 1HB GLN 31 69.792 -4.250 3.111 260 HB3 GLN 31 2HB GLN 31 69.170 -4.877 4.637 261 HG2 GLN 31 1HG GLN 31 70.953 -6.510 4.767 262 HG3 GLN 31 2HG GLN 31 71.510 -6.099 3.146 263 HE21 GLN 31 2HE2 GLN 31 73.517 -5.089 3.500 264 HE22 GLN 31 1HE2 GLN 31 73.753 -3.788 4.564 265 H ASP 32 H ASP 32 67.181 -6.782 4.763 266 HA ASP 32 HA ASP 32 68.537 -8.805 6.140 267 HB2 ASP 32 1HB ASP 32 66.655 -7.642 7.118 268 HB3 ASP 32 2HB ASP 32 65.572 -8.290 5.888 269 H LYS 33 H LYS 33 66.094 -9.104 3.547 270 HA LYS 33 HA LYS 33 66.046 -11.949 3.592 271 HB2 LYS 33 1HB LYS 33 65.338 -10.031 1.358 272 HB3 LYS 33 2HB LYS 33 64.923 -11.745 1.398 273 HG2 LYS 33 1HG LYS 33 64.137 -9.997 3.715 274 HG3 LYS 33 2HG LYS 33 63.178 -9.945 2.237 275 HD2 LYS 33 1HD LYS 33 62.650 -12.270 2.377 276 HD3 LYS 33 2HD LYS 33 63.871 -12.547 3.618 277 HE2 LYS 33 1HE LYS 33 61.660 -12.467 4.657 278 HE3 LYS 33 2HE LYS 33 62.599 -11.062 5.162 279 HZ1 LYS 33 3HZ LYS 33 61.408 -10.181 2.916 280 HZ2 LYS 33 1HZ LYS 33 60.822 -9.917 4.486 281 HZ3 LYS 33 2HZ LYS 33 60.207 -11.200 3.556 282 H GLU 34 H GLU 34 67.620 -9.644 1.407 283 HA GLU 34 HA GLU 34 69.697 -11.670 0.821 284 HB2 GLU 34 1HB GLU 34 68.270 -11.541 -1.149 285 HB3 GLU 34 2HB GLU 34 68.342 -9.780 -1.130 286 HG2 GLU 34 1HG GLU 34 70.743 -9.835 -1.574 287 HG3 GLU 34 2HG GLU 34 70.746 -11.594 -1.481 288 H GLY 35 H GLY 35 71.828 -10.693 0.400 289 HA2 GLY 35 1HA GLY 35 72.180 -8.316 2.000 290 HA3 GLY 35 2HA GLY 35 73.451 -9.194 1.150 291 H ILE 36 H ILE 36 71.717 -6.458 1.301 292 HA ILE 36 HA ILE 36 72.805 -5.449 -1.174 293 HB ILE 36 HB ILE 36 70.221 -6.412 -1.250 294 HG12 ILE 36 1HG1 ILE 36 71.679 -5.701 -3.159 295 HG13 ILE 36 2HG1 ILE 36 70.004 -5.188 -3.332 296 HG21 ILE 36 1HG2 ILE 36 68.765 -4.382 -1.338 297 HG22 ILE 36 2HG2 ILE 36 70.078 -3.446 -0.636 298 HG23 ILE 36 3HG2 ILE 36 69.340 -4.758 0.285 299 HD11 ILE 36 3HD1 ILE 36 71.572 -3.198 -1.892 300 HD12 ILE 36 1HD1 ILE 36 70.584 -3.012 -3.340 301 HD13 ILE 36 2HD1 ILE 36 72.259 -3.544 -3.478 302 HA PRO 37 HA PRO 37 73.148 -2.529 2.161 303 HB2 PRO 37 1HB PRO 37 74.535 -0.644 0.482 304 HB3 PRO 37 2HB PRO 37 75.196 -1.677 1.755 305 HG2 PRO 37 1HG PRO 37 75.646 -1.934 -0.983 306 HG3 PRO 37 2HG PRO 37 76.022 -3.131 0.263 307 HD2 PRO 37 1HD PRO 37 73.818 -3.117 -1.704 308 HD3 PRO 37 2HD PRO 37 74.524 -4.474 -0.801 309 HA PRO 38 HA PRO 38 69.440 -0.224 1.273 310 HB2 PRO 38 1HB PRO 38 70.092 1.819 3.193 311 HB3 PRO 38 2HB PRO 38 68.937 0.491 3.357 312 HG2 PRO 38 1HG PRO 38 71.602 0.752 4.458 313 HG3 PRO 38 2HG PRO 38 70.329 -0.405 4.863 314 HD2 PRO 38 1HD PRO 38 72.680 -1.025 3.522 315 HD3 PRO 38 2HD PRO 38 71.206 -2.017 3.496 316 H ASP 39 H ASP 39 72.499 1.537 1.674 317 HA ASP 39 HA ASP 39 71.768 3.934 0.417 318 HB2 ASP 39 1HB ASP 39 74.454 2.558 0.570 319 HB3 ASP 39 2HB ASP 39 74.215 4.218 0.027 320 H GLN 40 H GLN 40 72.670 0.832 -0.928 321 HA GLN 40 HA GLN 40 72.792 1.977 -3.636 322 HB2 GLN 40 1HB GLN 40 74.316 0.034 -2.407 323 HB3 GLN 40 2HB GLN 40 73.180 -0.927 -3.350 324 HG2 GLN 40 1HG GLN 40 75.091 -0.477 -4.749 325 HG3 GLN 40 2HG GLN 40 73.755 0.506 -5.346 326 HE21 GLN 40 2HE2 GLN 40 74.048 2.767 -5.374 327 HE22 GLN 40 1HE2 GLN 40 75.404 3.553 -4.721 328 H GLN 41 H GLN 41 70.410 1.121 -1.679 329 HA GLN 41 HA GLN 41 68.845 -0.209 -3.813 330 HB2 GLN 41 1HB GLN 41 69.304 -1.645 -1.817 331 HB3 GLN 41 2HB GLN 41 68.418 -0.484 -0.833 332 HG2 GLN 41 1HG GLN 41 66.823 -2.148 -1.398 333 HG3 GLN 41 2HG GLN 41 66.478 -0.809 -2.491 334 HE21 GLN 41 2HE2 GLN 41 67.299 -4.154 -2.355 335 HE22 GLN 41 1HE2 GLN 41 67.574 -4.375 -4.016 336 H ARG 42 H ARG 42 67.098 0.828 -4.513 337 HA ARG 42 HA ARG 42 65.861 2.905 -2.812 338 HB2 ARG 42 1HB ARG 42 67.380 3.825 -4.675 339 HB3 ARG 42 2HB ARG 42 66.159 3.227 -5.796 340 HG2 ARG 42 1HG ARG 42 65.391 5.396 -5.443 341 HG3 ARG 42 2HG ARG 42 64.494 4.526 -4.199 342 HD2 ARG 42 1HD ARG 42 65.496 6.534 -3.233 343 HD3 ARG 42 2HD ARG 42 66.267 5.107 -2.551 344 HE ARG 42 HE ARG 42 67.686 6.058 -4.846 345 HH11 ARG 42 1HH1 ARG 42 67.683 5.729 -1.477 346 HH12 ARG 42 2HH1 ARG 42 68.923 6.902 -1.185 347 HH21 ARG 42 1HH2 ARG 42 69.051 7.979 -4.479 348 HH22 ARG 42 2HH2 ARG 42 69.699 8.175 -2.885 349 H LEU 43 H LEU 43 63.601 3.012 -2.927 350 HA LEU 43 HA LEU 43 62.302 1.031 -4.715 351 HB2 LEU 43 1HB LEU 43 61.374 1.769 -1.933 352 HB3 LEU 43 2HB LEU 43 60.691 0.532 -2.984 353 HG LEU 43 HG LEU 43 63.588 0.419 -2.142 354 HD11 LEU 43 1HD1 LEU 43 61.190 -0.708 -0.660 355 HD12 LEU 43 2HD1 LEU 43 62.251 0.573 -0.080 356 HD13 LEU 43 3HD1 LEU 43 62.875 -1.063 -0.284 357 HD21 LEU 43 3HD2 LEU 43 62.276 -1.040 -3.981 358 HD22 LEU 43 1HD2 LEU 43 61.817 -1.958 -2.549 359 HD23 LEU 43 2HD2 LEU 43 63.520 -1.747 -2.952 360 H ILE 44 H ILE 44 60.331 1.590 -5.626 361 HA ILE 44 HA ILE 44 59.318 4.309 -5.108 362 HB ILE 44 HB ILE 44 59.184 4.836 -7.436 363 HG12 ILE 44 1HG1 ILE 44 60.108 1.979 -7.867 364 HG13 ILE 44 2HG1 ILE 44 58.573 2.690 -8.371 365 HG21 ILE 44 1HG2 ILE 44 61.441 4.986 -6.218 366 HG22 ILE 44 2HG2 ILE 44 61.493 5.015 -7.981 367 HG23 ILE 44 3HG2 ILE 44 61.893 3.533 -7.110 368 HD11 ILE 44 3HD1 ILE 44 61.330 3.195 -9.481 369 HD12 ILE 44 1HD1 ILE 44 60.039 4.375 -9.701 370 HD13 ILE 44 2HD1 ILE 44 59.861 2.746 -10.346 371 H PHE 45 H PHE 45 57.107 4.543 -5.286 372 HA PHE 45 HA PHE 45 55.572 2.094 -5.950 373 HB2 PHE 45 1HB PHE 45 55.249 2.157 -3.669 374 HB3 PHE 45 2HB PHE 45 55.461 3.903 -3.580 375 HD1 PHE 45 HD2 PHE 45 53.157 1.670 -5.548 376 HD2 PHE 45 HD1 PHE 45 53.531 4.931 -2.774 377 HE1 PHE 45 HE2 PHE 45 50.696 1.973 -5.570 378 HE2 PHE 45 HE1 PHE 45 51.070 5.233 -2.798 379 HZ PHE 45 HZ PHE 45 49.652 3.755 -4.195 380 H ALA 46 H ALA 46 54.386 2.416 -7.708 381 HA ALA 46 HA ALA 46 53.166 3.475 -9.357 382 HB1 ALA 46 3HB ALA 46 51.975 4.775 -6.897 383 HB2 ALA 46 1HB ALA 46 51.489 3.225 -7.584 384 HB3 ALA 46 2HB ALA 46 51.223 4.714 -8.491 385 H GLY 47 H GLY 47 55.656 4.710 -9.022 386 HA2 GLY 47 1HA GLY 47 56.558 6.595 -10.093 387 HA3 GLY 47 2HA GLY 47 54.998 7.398 -9.957 388 H LYS 48 H LYS 48 54.985 6.525 -6.996 389 HA LYS 48 HA LYS 48 56.298 8.930 -6.032 390 HB2 LYS 48 1HB LYS 48 54.432 6.904 -4.894 391 HB3 LYS 48 2HB LYS 48 55.490 7.731 -3.758 392 HG2 LYS 48 1HG LYS 48 54.568 9.825 -4.207 393 HG3 LYS 48 2HG LYS 48 54.004 9.352 -5.807 394 HD2 LYS 48 1HD LYS 48 52.859 8.048 -3.340 395 HD3 LYS 48 2HD LYS 48 52.253 9.610 -3.886 396 HE2 LYS 48 1HE LYS 48 51.944 8.522 -6.187 397 HE3 LYS 48 2HE LYS 48 52.215 6.980 -5.378 398 HZ1 LYS 48 3HZ LYS 48 50.421 7.854 -3.762 399 HZ2 LYS 48 1HZ LYS 48 49.946 7.205 -5.256 400 HZ3 LYS 48 2HZ LYS 48 50.005 8.890 -5.043 401 H GLN 49 H GLN 49 58.401 8.951 -5.642 402 HA GLN 49 HA GLN 49 59.899 6.514 -5.309 403 HB2 GLN 49 1HB GLN 49 61.004 8.177 -6.557 404 HB3 GLN 49 2HB GLN 49 60.622 9.436 -5.383 405 HG2 GLN 49 1HG GLN 49 62.192 8.597 -3.810 406 HG3 GLN 49 2HG GLN 49 62.341 7.060 -4.660 407 HE21 GLN 49 2HE2 GLN 49 64.636 7.247 -5.068 408 HE22 GLN 49 1HE2 GLN 49 65.273 8.427 -6.108 409 H LEU 50 H LEU 50 60.281 5.501 -3.469 410 HA LEU 50 HA LEU 50 59.643 6.749 -0.933 411 HB2 LEU 50 1HB LEU 50 60.672 3.987 -1.661 412 HB3 LEU 50 2HB LEU 50 60.315 4.489 -0.013 413 HG LEU 50 HG LEU 50 58.357 4.337 -2.327 414 HD11 LEU 50 1HD1 LEU 50 57.290 2.611 -1.038 415 HD12 LEU 50 2HD1 LEU 50 58.323 2.932 0.355 416 HD13 LEU 50 3HD1 LEU 50 59.007 2.220 -1.105 417 HD21 LEU 50 3HD2 LEU 50 58.185 5.688 0.347 418 HD22 LEU 50 1HD2 LEU 50 56.749 4.874 -0.271 419 HD23 LEU 50 2HD2 LEU 50 57.490 6.174 -1.200 420 H GLU 51 H GLU 51 61.023 7.697 0.408 421 HA GLU 51 HA GLU 51 63.759 8.078 -0.512 422 HB2 GLU 51 1HB GLU 51 61.800 9.608 1.047 423 HB3 GLU 51 2HB GLU 51 63.462 9.790 1.597 424 HG2 GLU 51 1HG GLU 51 64.194 10.491 -0.580 425 HG3 GLU 51 2HG GLU 51 62.645 10.064 -1.304 426 H ASP 52 H ASP 52 65.026 8.981 1.502 427 HA ASP 52 HA ASP 52 66.525 7.010 2.607 428 HB2 ASP 52 1HB ASP 52 67.327 8.735 4.192 429 HB3 ASP 52 2HB ASP 52 67.268 9.289 2.520 430 H GLY 53 H GLY 53 63.392 7.114 3.413 431 HA2 GLY 53 1HA GLY 53 62.789 5.529 5.276 432 HA3 GLY 53 2HA GLY 53 63.939 6.418 6.240 433 H ARG 54 H ARG 54 61.555 7.566 3.957 434 HA ARG 54 HA ARG 54 60.340 9.372 5.917 435 HB2 ARG 54 1HB ARG 54 60.379 9.091 2.995 436 HB3 ARG 54 2HB ARG 54 58.725 9.191 3.592 437 HG2 ARG 54 1HG ARG 54 59.326 11.259 4.839 438 HG3 ARG 54 2HG ARG 54 60.953 11.171 4.160 439 HD2 ARG 54 1HD ARG 54 60.104 11.421 1.914 440 HD3 ARG 54 2HD ARG 54 58.442 11.267 2.471 441 HE ARG 54 HE ARG 54 59.865 13.480 3.670 442 HH11 ARG 54 1HH2 ARG 54 56.890 13.053 2.677 443 HH12 ARG 54 2HH2 ARG 54 56.800 14.314 1.493 444 HH21 ARG 54 1HH1 ARG 54 60.229 14.837 1.400 445 HH22 ARG 54 2HH1 ARG 54 58.691 15.324 0.769 446 H THR 55 H THR 55 57.993 8.864 6.566 447 HA THR 55 HA THR 55 57.771 5.986 6.755 448 HB THR 55 HB THR 55 56.139 8.302 7.742 449 HG1 THR 55 HG1 THR 55 57.111 7.770 9.513 450 HG21 THR 55 3HG2 THR 55 54.788 6.348 8.872 451 HG22 THR 55 1HG2 THR 55 55.310 5.445 7.454 452 HG23 THR 55 2HG2 THR 55 54.348 6.906 7.257 453 H LEU 56 H LEU 56 56.418 4.650 5.748 454 HA LEU 56 HA LEU 56 55.369 5.459 3.223 455 HB2 LEU 56 1HB LEU 56 55.867 2.929 4.589 456 HB3 LEU 56 2HB LEU 56 54.517 2.911 3.460 457 HG LEU 56 HG LEU 56 56.069 4.018 1.764 458 HD11 LEU 56 1HD1 LEU 56 58.451 2.974 3.155 459 HD12 LEU 56 2HD1 LEU 56 57.726 4.389 3.917 460 HD13 LEU 56 3HD1 LEU 56 58.243 4.459 2.237 461 HD21 LEU 56 3HD2 LEU 56 56.288 1.945 0.923 462 HD22 LEU 56 1HD2 LEU 56 55.847 1.280 2.490 463 HD23 LEU 56 2HD2 LEU 56 57.539 1.561 2.100 464 H SER 57 H SER 57 54.008 4.803 6.363 465 HA SER 57 HA SER 57 51.352 4.376 5.624 466 HB2 SER 57 1HB SER 57 51.773 4.102 7.923 467 HB3 SER 57 2HB SER 57 52.612 5.646 8.050 468 HG SER 57 HG SER 57 49.878 5.420 7.353 469 H ASP 58 H ASP 58 53.313 7.241 5.819 470 HA ASP 58 HA ASP 58 51.193 9.124 5.370 471 HB2 ASP 58 1HB ASP 58 53.514 9.623 6.348 472 HB3 ASP 58 2HB ASP 58 54.113 9.518 4.693 473 H TYR 59 H TYR 59 53.168 7.007 3.482 474 HA TYR 59 HA TYR 59 52.652 8.278 0.930 475 HB2 TYR 59 1HB TYR 59 54.152 5.914 1.900 476 HB3 TYR 59 2HB TYR 59 53.507 5.791 0.272 477 HD1 TYR 59 HD1 TYR 59 53.874 7.821 -1.275 478 HD2 TYR 59 HD2 TYR 59 56.167 7.069 2.268 479 HE1 TYR 59 HE1 TYR 59 55.681 9.290 -2.132 480 HE2 TYR 59 HE2 TYR 59 57.978 8.524 1.415 481 HH TYR 59 HH TYR 59 58.795 9.377 -0.738 482 H ASN 60 H ASN 60 50.729 6.695 3.030 483 HA ASN 60 HA ASN 60 48.727 5.586 2.875 484 HB2 ASN 60 1HB ASN 60 48.630 7.588 1.051 485 HB3 ASN 60 2HB ASN 60 48.406 6.205 -0.013 486 HD21 ASN 60 2HD2 ASN 60 46.922 4.490 1.734 487 HD22 ASN 60 1HD2 ASN 60 45.426 5.224 2.054 488 H ILE 61 H ILE 61 50.974 3.964 2.551 489 HA ILE 61 HA ILE 61 50.839 2.386 0.202 490 HB ILE 61 HB ILE 61 52.033 1.846 2.914 491 HG12 ILE 61 1HG1 ILE 61 53.191 3.517 1.564 492 HG13 ILE 61 2HG1 ILE 61 54.129 2.036 1.588 493 HG21 ILE 61 1HG2 ILE 61 51.856 0.080 0.472 494 HG22 ILE 61 2HG2 ILE 61 51.517 -0.335 2.152 495 HG23 ILE 61 3HG2 ILE 61 53.180 -0.077 1.625 496 HD11 ILE 61 3HD1 ILE 61 52.701 1.533 -0.621 497 HD12 ILE 61 1HD1 ILE 61 54.213 2.437 -0.667 498 HD13 ILE 61 2HD1 ILE 61 52.674 3.297 -0.675 499 H GLN 62 H GLN 62 49.839 0.629 -0.306 500 HA GLN 62 HA GLN 62 47.420 -0.016 1.178 501 HB2 GLN 62 1HB GLN 62 47.397 0.629 -1.231 502 HB3 GLN 62 2HB GLN 62 48.289 -0.846 -1.594 503 HG2 GLN 62 1HG GLN 62 46.474 -2.223 -1.121 504 HG3 GLN 62 2HG GLN 62 45.743 -1.058 -0.015 505 HE21 GLN 62 2HE2 GLN 62 43.905 -1.947 -1.718 506 HE22 GLN 62 1HE2 GLN 62 43.635 -0.890 -3.018 507 H LYS 63 H LYS 63 46.664 -2.260 0.579 508 HA LYS 63 HA LYS 63 47.566 -4.159 2.240 509 HB2 LYS 63 1HB LYS 63 45.435 -4.022 0.781 510 HB3 LYS 63 2HB LYS 63 46.359 -4.988 -0.366 511 HG2 LYS 63 1HG LYS 63 46.439 -6.837 1.036 512 HG3 LYS 63 2HG LYS 63 46.320 -5.869 2.503 513 HD2 LYS 63 1HD LYS 63 44.220 -6.995 2.279 514 HD3 LYS 63 2HD LYS 63 43.932 -5.321 1.813 515 HE2 LYS 63 1HE LYS 63 43.976 -5.875 -0.524 516 HE3 LYS 63 2HE LYS 63 44.578 -7.500 -0.188 517 HZ1 LYS 63 3HZ LYS 63 41.892 -6.506 -0.131 518 HZ2 LYS 63 1HZ LYS 63 42.306 -7.328 1.296 519 HZ3 LYS 63 2HZ LYS 63 42.455 -8.107 -0.207 520 H GLU 64 H GLU 64 49.952 -3.244 0.690 521 HA GLU 64 HA GLU 64 51.948 -4.461 0.307 522 HB2 GLU 64 1HB GLU 64 50.623 -6.511 1.160 523 HB3 GLU 64 2HB GLU 64 50.304 -6.829 -0.541 524 HG2 GLU 64 1HG GLU 64 52.793 -6.726 -0.930 525 HG3 GLU 64 2HG GLU 64 52.995 -6.689 0.814 526 H SER 65 H SER 65 50.955 -2.705 -1.335 527 HA SER 65 HA SER 65 50.448 -3.472 -4.009 528 HB2 SER 65 1HB SER 65 51.938 -0.994 -3.778 529 HB3 SER 65 2HB SER 65 50.259 -1.243 -4.253 530 HG SER 65 HG SER 65 50.776 -0.028 -2.216 531 H THR 66 H THR 66 51.928 -3.397 -5.819 532 HA THR 66 HA THR 66 54.537 -4.499 -5.148 533 HB THR 66 HB THR 66 53.028 -5.418 -6.960 534 HG1 THR 66 HG1 THR 66 54.886 -5.523 -8.461 535 HG21 THR 66 3HG2 THR 66 54.098 -3.180 -8.662 536 HG22 THR 66 1HG2 THR 66 52.566 -3.001 -7.805 537 HG23 THR 66 2HG2 THR 66 52.766 -4.285 -8.997 538 H LEU 67 H LEU 67 56.370 -3.382 -5.062 539 HA LEU 67 HA LEU 67 56.451 -0.644 -6.160 540 HB2 LEU 67 1HB LEU 67 58.272 -2.067 -4.192 541 HB3 LEU 67 2HB LEU 67 58.538 -0.432 -4.791 542 HG LEU 67 HG LEU 67 56.177 0.100 -3.952 543 HD11 LEU 67 1HD1 LEU 67 56.624 -2.634 -2.762 544 HD12 LEU 67 2HD1 LEU 67 55.192 -2.004 -3.573 545 HD13 LEU 67 3HD1 LEU 67 55.596 -1.452 -1.949 546 HD21 LEU 67 3HD2 LEU 67 57.009 0.255 -1.549 547 HD22 LEU 67 1HD2 LEU 67 58.072 0.964 -2.764 548 HD23 LEU 67 2HD2 LEU 67 58.445 -0.619 -2.082 549 H HIS 68 H HIS 68 57.875 -0.090 -7.774 550 HA HIS 68 HA HIS 68 59.016 -2.285 -9.284 551 HB2 HIS 68 1HB HIS 68 57.838 -0.361 -10.357 552 HB3 HIS 68 2HB HIS 68 59.170 0.675 -9.855 553 HD1 HIS 68 HD1 HIS 68 59.992 -2.807 -10.860 554 HD2 HIS 68 HD2 HIS 68 59.933 0.967 -12.631 555 HE1 HIS 68 HE1 HIS 68 61.263 -3.019 -13.040 556 H LEU 69 H LEU 69 61.119 -2.772 -9.578 557 HA LEU 69 HA LEU 69 63.119 -1.207 -8.054 558 HB2 LEU 69 1HB LEU 69 62.438 -3.718 -7.433 559 HB3 LEU 69 2HB LEU 69 63.587 -4.085 -8.715 560 HG LEU 69 HG LEU 69 64.815 -4.064 -6.645 561 HD11 LEU 69 1HD1 LEU 69 66.510 -2.488 -7.144 562 HD12 LEU 69 2HD1 LEU 69 65.362 -1.346 -7.842 563 HD13 LEU 69 3HD1 LEU 69 65.757 -2.836 -8.699 564 HD21 LEU 69 3HD2 LEU 69 64.586 -2.497 -4.950 565 HD22 LEU 69 1HD2 LEU 69 62.952 -2.470 -5.610 566 HD23 LEU 69 2HD2 LEU 69 64.102 -1.210 -6.052 567 H VAL 70 H VAL 70 64.643 -0.280 -9.276 568 HA VAL 70 HA VAL 70 65.203 -1.429 -11.952 569 HB VAL 70 HB VAL 70 65.346 1.486 -11.146 570 HG11 VAL 70 1HG1 VAL 70 66.860 1.077 -12.947 571 HG12 VAL 70 2HG1 VAL 70 65.396 1.709 -13.700 572 HG13 VAL 70 3HG1 VAL 70 65.732 -0.021 -13.742 573 HG21 VAL 70 3HG2 VAL 70 63.339 1.628 -12.713 574 HG22 VAL 70 1HG2 VAL 70 63.033 0.859 -11.156 575 HG23 VAL 70 2HG2 VAL 70 63.239 -0.129 -12.603 576 H LEU 71 H LEU 71 67.383 -0.966 -12.774 577 HA LEU 71 HA LEU 71 69.447 -1.927 -11.324 578 HB2 LEU 71 1HB LEU 71 69.633 0.376 -13.281 579 HB3 LEU 71 2HB LEU 71 70.978 -0.647 -12.777 580 HG LEU 71 HG LEU 71 68.520 -1.977 -13.863 581 HD11 LEU 71 1HD1 LEU 71 70.594 -0.495 -15.499 582 HD12 LEU 71 2HD1 LEU 71 68.843 -0.285 -15.538 583 HD13 LEU 71 3HD1 LEU 71 69.568 -1.764 -16.168 584 HD21 LEU 71 3HD2 LEU 71 71.498 -2.510 -14.141 585 HD22 LEU 71 1HD2 LEU 71 70.201 -3.576 -14.682 586 HD23 LEU 71 2HD2 LEU 71 70.437 -3.278 -12.961 587 H ARG 72 H ARG 72 68.786 1.568 -11.620 588 HA ARG 72 HA ARG 72 69.837 1.943 -8.893 589 HB2 ARG 72 1HB ARG 72 70.863 4.141 -9.888 590 HB3 ARG 72 2HB ARG 72 71.740 2.620 -10.052 591 HG2 ARG 72 1HG ARG 72 71.672 3.859 -12.193 592 HG3 ARG 72 2HG ARG 72 70.828 2.316 -12.314 593 HD2 ARG 72 1HD ARG 72 68.702 3.339 -12.269 594 HD3 ARG 72 2HD ARG 72 69.340 4.840 -11.605 595 HE ARG 72 HE ARG 72 70.540 4.460 -14.106 596 HH11 ARG 72 1HH1 ARG 72 67.790 5.741 -12.550 597 HH12 ARG 72 2HH1 ARG 72 66.988 6.222 -14.007 598 HH21 ARG 72 1HH2 ARG 72 69.328 4.743 -16.096 599 HH22 ARG 72 2HH2 ARG 72 67.859 5.657 -16.015 Start of MODEL 10 1 H1 MET 1 1H MET 1 48.453 -1.350 5.049 2 H2 MET 1 2H MET 1 48.171 -2.659 4.004 3 H3 MET 1 3H MET 1 49.711 -1.948 4.084 4 HA MET 1 HA MET 1 49.202 -2.653 6.668 5 HB2 MET 1 1HB MET 1 47.249 -3.945 5.695 6 HB3 MET 1 2HB MET 1 48.426 -4.947 4.850 7 HG2 MET 1 1HG MET 1 48.197 -6.196 6.779 8 HG3 MET 1 2HG MET 1 49.483 -5.112 7.304 9 HE1 MET 1 3HE MET 1 48.098 -4.362 10.579 10 HE2 MET 1 1HE MET 1 49.392 -3.938 9.449 11 HE3 MET 1 2HE MET 1 48.972 -5.627 9.716 12 H GLN 2 H GLN 2 49.974 -5.137 4.338 13 HA GLN 2 HA GLN 2 52.797 -5.015 5.137 14 HB2 GLN 2 1HB GLN 2 51.121 -7.163 3.818 15 HB3 GLN 2 2HB GLN 2 52.866 -7.299 4.056 16 HG2 GLN 2 1HG GLN 2 52.388 -6.752 6.531 17 HG3 GLN 2 2HG GLN 2 50.701 -7.088 6.153 18 HE21 GLN 2 2HE2 GLN 2 51.170 -9.275 4.286 19 HE22 GLN 2 1HE2 GLN 2 51.781 -10.579 5.187 20 H ILE 3 H ILE 3 54.409 -5.526 3.355 21 HA ILE 3 HA ILE 3 53.562 -4.158 0.877 22 HB ILE 3 HB ILE 3 56.015 -3.820 2.530 23 HG12 ILE 3 1HG1 ILE 3 54.153 -2.110 0.862 24 HG13 ILE 3 2HG1 ILE 3 54.433 -2.038 2.599 25 HG21 ILE 3 1HG2 ILE 3 55.959 -3.502 -0.496 26 HG22 ILE 3 2HG2 ILE 3 56.870 -4.739 0.373 27 HG23 ILE 3 3HG2 ILE 3 57.290 -3.043 0.563 28 HD11 ILE 3 3HD1 ILE 3 56.405 -0.858 2.362 29 HD12 ILE 3 1HD1 ILE 3 55.548 -0.291 0.937 30 HD13 ILE 3 2HD1 ILE 3 56.766 -1.545 0.786 31 H PHE 4 H PHE 4 54.659 -4.698 -1.025 32 HA PHE 4 HA PHE 4 55.885 -7.368 -1.110 33 HB2 PHE 4 1HB PHE 4 53.770 -8.052 -1.713 34 HB3 PHE 4 2HB PHE 4 53.316 -6.451 -2.288 35 HD1 PHE 4 HD2 PHE 4 56.210 -8.638 -3.174 36 HD2 PHE 4 HD1 PHE 4 52.641 -6.667 -4.522 37 HE1 PHE 4 HE2 PHE 4 56.713 -9.326 -5.501 38 HE2 PHE 4 HE1 PHE 4 53.142 -7.361 -6.851 39 HZ PHE 4 HZ PHE 4 55.179 -8.689 -7.339 40 H VAL 5 H VAL 5 57.560 -7.470 -2.536 41 HA VAL 5 HA VAL 5 57.861 -5.275 -4.498 42 HB VAL 5 HB VAL 5 60.148 -6.441 -2.909 43 HG11 VAL 5 1HG1 VAL 5 61.292 -4.405 -3.768 44 HG12 VAL 5 2HG1 VAL 5 59.836 -4.004 -4.677 45 HG13 VAL 5 3HG1 VAL 5 60.747 -5.461 -5.072 46 HG21 VAL 5 3HG2 VAL 5 58.441 -3.987 -2.439 47 HG22 VAL 5 1HG2 VAL 5 60.061 -4.156 -1.764 48 HG23 VAL 5 2HG2 VAL 5 58.792 -5.291 -1.303 49 H LYS 6 H LYS 6 58.764 -5.819 -6.462 50 HA LYS 6 HA LYS 6 59.016 -8.713 -6.987 51 HB2 LYS 6 1HB LYS 6 58.676 -8.124 -9.346 52 HB3 LYS 6 2HB LYS 6 57.364 -7.486 -8.353 53 HG2 LYS 6 1HG LYS 6 58.565 -5.292 -8.266 54 HG3 LYS 6 2HG LYS 6 59.760 -5.942 -9.389 55 HD2 LYS 6 1HD LYS 6 56.784 -5.723 -9.936 56 HD3 LYS 6 2HD LYS 6 58.019 -4.639 -10.574 57 HE2 LYS 6 1HE LYS 6 59.085 -6.991 -11.358 58 HE3 LYS 6 2HE LYS 6 57.379 -7.443 -11.349 59 HZ1 LYS 6 3HZ LYS 6 56.925 -6.099 -13.072 60 HZ2 LYS 6 1HZ LYS 6 58.585 -6.230 -13.392 61 HZ3 LYS 6 2HZ LYS 6 57.989 -4.877 -12.556 62 H THR 7 H THR 7 60.926 -9.589 -7.604 63 HA THR 7 HA THR 7 63.284 -7.881 -7.564 64 HB THR 7 HB THR 7 64.483 -10.097 -7.848 65 HG1 THR 7 HG1 THR 7 63.321 -11.788 -8.226 66 HG21 THR 7 3HG2 THR 7 62.533 -9.853 -5.543 67 HG22 THR 7 1HG2 THR 7 64.099 -9.050 -5.643 68 HG23 THR 7 2HG2 THR 7 64.014 -10.809 -5.546 69 H LEU 8 H LEU 8 64.973 -8.158 -9.243 70 HA LEU 8 HA LEU 8 63.897 -7.651 -11.838 71 HB2 LEU 8 1HB LEU 8 66.296 -7.607 -12.537 72 HB3 LEU 8 2HB LEU 8 65.942 -6.557 -11.170 73 HG LEU 8 HG LEU 8 66.594 -8.729 -9.762 74 HD11 LEU 8 1HD1 LEU 8 68.617 -9.769 -10.988 75 HD12 LEU 8 2HD1 LEU 8 67.893 -9.132 -12.464 76 HD13 LEU 8 3HD1 LEU 8 67.015 -10.304 -11.483 77 HD21 LEU 8 3HD2 LEU 8 67.724 -6.466 -9.781 78 HD22 LEU 8 1HD2 LEU 8 68.740 -7.055 -11.096 79 HD23 LEU 8 2HD2 LEU 8 68.817 -7.822 -9.511 80 H THR 9 H THR 9 64.537 -10.498 -10.168 81 HA THR 9 HA THR 9 65.083 -12.074 -12.587 82 HB THR 9 HB THR 9 64.771 -13.252 -9.843 83 HG1 THR 9 HG1 THR 9 67.224 -12.766 -9.958 84 HG21 THR 9 3HG2 THR 9 66.292 -14.880 -10.669 85 HG22 THR 9 1HG2 THR 9 66.793 -13.845 -12.006 86 HG23 THR 9 2HG2 THR 9 65.185 -14.568 -12.006 87 H GLY 10 H GLY 10 62.509 -11.070 -10.616 88 HA2 GLY 10 1HA GLY 10 60.234 -11.410 -11.308 89 HA3 GLY 10 2HA GLY 10 60.695 -12.989 -11.938 90 H LYS 11 H LYS 11 62.348 -12.875 -9.177 91 HA LYS 11 HA LYS 11 60.584 -14.643 -7.787 92 HB2 LYS 11 1HB LYS 11 63.209 -13.329 -7.115 93 HB3 LYS 11 2HB LYS 11 62.323 -14.258 -5.905 94 HG2 LYS 11 1HG LYS 11 62.399 -16.244 -7.265 95 HG3 LYS 11 2HG LYS 11 63.049 -15.343 -8.637 96 HD2 LYS 11 1HD LYS 11 65.141 -15.012 -7.575 97 HD3 LYS 11 2HD LYS 11 64.498 -15.442 -5.990 98 HE2 LYS 11 1HE LYS 11 65.818 -17.304 -6.852 99 HE3 LYS 11 2HE LYS 11 64.115 -17.765 -6.816 100 HZ1 LYS 11 3HZ LYS 11 64.612 -16.529 -9.263 101 HZ2 LYS 11 1HZ LYS 11 64.224 -18.154 -8.976 102 HZ3 LYS 11 2HZ LYS 11 65.850 -17.667 -9.019 103 H THR 12 H THR 12 58.952 -14.140 -6.463 104 HA THR 12 HA THR 12 58.444 -11.379 -5.775 105 HB THR 12 HB THR 12 56.327 -12.101 -5.060 106 HG1 THR 12 HG1 THR 12 57.293 -13.762 -3.678 107 HG21 THR 12 3HG2 THR 12 56.887 -12.553 -7.506 108 HG22 THR 12 1HG2 THR 12 55.520 -13.456 -6.853 109 HG23 THR 12 2HG2 THR 12 57.084 -14.247 -7.052 110 H ILE 13 H ILE 13 59.381 -10.425 -4.107 111 HA ILE 13 HA ILE 13 60.049 -12.034 -1.716 112 HB ILE 13 HB ILE 13 61.909 -10.850 -3.033 113 HG12 ILE 13 1HG1 ILE 13 61.533 -10.157 -0.102 114 HG13 ILE 13 2HG1 ILE 13 62.162 -11.687 -0.714 115 HG21 ILE 13 1HG2 ILE 13 62.141 -8.524 -2.909 116 HG22 ILE 13 2HG2 ILE 13 61.020 -8.382 -1.555 117 HG23 ILE 13 3HG2 ILE 13 60.411 -8.713 -3.176 118 HD11 ILE 13 3HD1 ILE 13 63.641 -9.350 -0.156 119 HD12 ILE 13 1HD1 ILE 13 63.601 -9.476 -1.913 120 HD13 ILE 13 2HD1 ILE 13 64.221 -10.812 -0.950 121 H THR 14 H THR 14 58.561 -11.804 -0.185 122 HA THR 14 HA THR 14 57.149 -9.229 0.080 123 HB THR 14 HB THR 14 55.571 -10.586 1.517 124 HG1 THR 14 HG1 THR 14 57.365 -12.561 0.638 125 HG21 THR 14 3HG2 THR 14 54.549 -11.736 -0.455 126 HG22 THR 14 1HG2 THR 14 56.018 -11.392 -1.369 127 HG23 THR 14 2HG2 THR 14 55.009 -10.066 -0.788 128 H LEU 15 H LEU 15 57.190 -8.061 1.927 129 HA LEU 15 HA LEU 15 58.963 -9.025 4.096 130 HB2 LEU 15 1HB LEU 15 58.635 -6.213 4.311 131 HB3 LEU 15 2HB LEU 15 60.094 -7.092 3.855 132 HG LEU 15 HG LEU 15 57.898 -6.312 1.916 133 HD11 LEU 15 1HD1 LEU 15 58.911 -4.278 2.631 134 HD12 LEU 15 2HD1 LEU 15 59.706 -4.689 1.112 135 HD13 LEU 15 3HD1 LEU 15 60.520 -4.997 2.647 136 HD21 LEU 15 3HD2 LEU 15 60.441 -6.763 0.688 137 HD22 LEU 15 1HD2 LEU 15 58.966 -7.710 0.501 138 HD23 LEU 15 2HD2 LEU 15 60.130 -8.129 1.756 139 H GLU 16 H GLU 16 58.231 -8.826 6.217 140 HA GLU 16 HA GLU 16 55.331 -8.367 6.429 141 HB2 GLU 16 1HB GLU 16 57.379 -9.664 8.245 142 HB3 GLU 16 2HB GLU 16 55.745 -9.286 8.790 143 HG2 GLU 16 1HG GLU 16 54.815 -10.987 7.588 144 HG3 GLU 16 2HG GLU 16 55.861 -10.704 6.197 145 H VAL 17 H VAL 17 54.865 -6.321 6.727 146 HA VAL 17 HA VAL 17 56.168 -4.840 8.889 147 HB VAL 17 HB VAL 17 57.494 -4.354 6.879 148 HG11 VAL 17 1HG1 VAL 17 55.523 -4.866 5.334 149 HG12 VAL 17 2HG1 VAL 17 56.486 -3.459 4.897 150 HG13 VAL 17 3HG1 VAL 17 54.931 -3.248 5.705 151 HG21 VAL 17 3HG2 VAL 17 55.797 -1.911 7.225 152 HG22 VAL 17 1HG2 VAL 17 57.547 -2.063 7.222 153 HG23 VAL 17 2HG2 VAL 17 56.627 -2.547 8.640 154 H GLU 18 H GLU 18 55.179 -2.674 9.118 155 HA GLU 18 HA GLU 18 52.260 -2.825 8.904 156 HB2 GLU 18 1HB GLU 18 52.577 -0.625 10.310 157 HB3 GLU 18 2HB GLU 18 52.881 -2.174 11.086 158 HG2 GLU 18 1HG GLU 18 55.120 -0.740 9.679 159 HG3 GLU 18 2HG GLU 18 54.656 -0.257 11.308 160 HA PRO 19 HA PRO 19 52.339 0.081 5.626 161 HB2 PRO 19 1HB PRO 19 50.533 2.090 6.619 162 HB3 PRO 19 2HB PRO 19 50.207 0.775 5.477 163 HG2 PRO 19 1HG PRO 19 49.206 0.944 8.039 164 HG3 PRO 19 2HG PRO 19 49.316 -0.534 7.074 165 HD2 PRO 19 1HD PRO 19 51.071 0.410 9.285 166 HD3 PRO 19 2HD PRO 19 50.620 -1.248 8.831 167 H SER 20 H SER 20 53.524 1.202 8.662 168 HA SER 20 HA SER 20 54.060 3.869 7.672 169 HB2 SER 20 1HB SER 20 55.479 4.125 9.645 170 HB3 SER 20 2HB SER 20 53.939 3.413 10.112 171 HG SER 20 HG SER 20 56.489 2.331 10.083 172 H ASP 21 H ASP 21 55.515 0.716 7.644 173 HA ASP 21 HA ASP 21 57.608 0.103 6.775 174 HB2 ASP 21 1HB ASP 21 55.622 0.994 4.880 175 HB3 ASP 21 2HB ASP 21 57.258 1.058 4.229 176 H THR 22 H THR 22 59.009 1.794 8.102 177 HA THR 22 HA THR 22 59.527 4.138 6.467 178 HB THR 22 HB THR 22 61.612 3.970 8.314 179 HG1 THR 22 HG1 THR 22 59.236 3.032 9.537 180 HG21 THR 22 3HG2 THR 22 60.344 5.641 9.566 181 HG22 THR 22 1HG2 THR 22 58.856 5.143 8.761 182 HG23 THR 22 2HG2 THR 22 60.140 5.919 7.836 183 H ILE 23 H ILE 23 61.052 4.398 5.073 184 HA ILE 23 HA ILE 23 62.041 2.275 3.665 185 HB ILE 23 HB ILE 23 63.614 4.781 3.469 186 HG12 ILE 23 1HG1 ILE 23 61.343 5.558 4.244 187 HG13 ILE 23 2HG1 ILE 23 61.716 6.080 2.616 188 HG21 ILE 23 1HG2 ILE 23 63.907 3.812 1.443 189 HG22 ILE 23 2HG2 ILE 23 62.249 4.279 1.081 190 HG23 ILE 23 3HG2 ILE 23 62.587 2.671 1.709 191 HD11 ILE 23 3HD1 ILE 23 60.453 4.048 1.795 192 HD12 ILE 23 1HD1 ILE 23 59.484 5.278 2.595 193 HD13 ILE 23 2HD1 ILE 23 59.926 3.805 3.456 194 H GLU 24 H GLU 24 63.855 4.234 6.058 195 HA GLU 24 HA GLU 24 66.275 2.798 5.757 196 HB2 GLU 24 1HB GLU 24 65.925 4.905 7.164 197 HB3 GLU 24 2HB GLU 24 65.182 3.864 8.377 198 HG2 GLU 24 1HG GLU 24 67.347 2.443 8.176 199 HG3 GLU 24 2HG GLU 24 68.034 3.871 7.402 200 H ASN 25 H ASN 25 63.218 2.212 7.224 201 HA ASN 25 HA ASN 25 63.926 -0.144 8.714 202 HB2 ASN 25 1HB ASN 25 61.775 1.651 8.622 203 HB3 ASN 25 2HB ASN 25 61.101 0.104 8.129 204 HD21 ASN 25 2HD2 ASN 25 63.395 1.333 10.656 205 HD22 ASN 25 1HD2 ASN 25 62.755 0.364 11.895 206 H VAL 26 H VAL 26 62.393 0.507 5.574 207 HA VAL 26 HA VAL 26 61.665 -2.203 5.098 208 HB VAL 26 HB VAL 26 61.984 0.024 3.084 209 HG11 VAL 26 1HG1 VAL 26 61.831 -2.117 1.986 210 HG12 VAL 26 2HG1 VAL 26 60.244 -1.356 1.879 211 HG13 VAL 26 3HG1 VAL 26 60.532 -2.633 3.061 212 HG21 VAL 26 3HG2 VAL 26 60.368 0.911 4.490 213 HG22 VAL 26 1HG2 VAL 26 59.872 -0.671 5.088 214 HG23 VAL 26 2HG2 VAL 26 59.340 -0.122 3.500 215 H LYS 27 H LYS 27 64.403 -0.260 3.773 216 HA LYS 27 HA LYS 27 65.380 -2.248 2.065 217 HB2 LYS 27 1HB LYS 27 67.608 -0.856 3.248 218 HB3 LYS 27 2HB LYS 27 66.968 -0.729 1.615 219 HG2 LYS 27 1HG LYS 27 65.871 0.698 4.037 220 HG3 LYS 27 2HG LYS 27 66.893 1.434 2.815 221 HD2 LYS 27 1HD LYS 27 64.171 0.203 2.275 222 HD3 LYS 27 2HD LYS 27 64.516 1.919 2.401 223 HE2 LYS 27 1HE LYS 27 65.263 -0.002 0.246 224 HE3 LYS 27 2HE LYS 27 64.658 1.649 0.113 225 HZ1 LYS 27 3HZ LYS 27 66.743 2.508 0.783 226 HZ2 LYS 27 1HZ LYS 27 67.048 1.372 -0.438 227 HZ3 LYS 27 2HZ LYS 27 67.337 0.968 1.185 228 H ALA 28 H ALA 28 66.028 -1.697 5.485 229 HA ALA 28 HA ALA 28 68.027 -3.612 5.830 230 HB1 ALA 28 3HB ALA 28 67.046 -3.761 8.200 231 HB2 ALA 28 1HB ALA 28 65.870 -2.566 7.657 232 HB3 ALA 28 2HB ALA 28 67.589 -2.174 7.655 233 H LYS 29 H LYS 29 64.510 -3.899 5.677 234 HA LYS 29 HA LYS 29 64.431 -6.695 6.287 235 HB2 LYS 29 1HB LYS 29 62.499 -4.676 5.241 236 HB3 LYS 29 2HB LYS 29 62.179 -6.357 4.820 237 HG2 LYS 29 1HG LYS 29 62.101 -7.017 7.117 238 HG3 LYS 29 2HG LYS 29 62.767 -5.475 7.653 239 HD2 LYS 29 1HD LYS 29 60.726 -4.333 6.778 240 HD3 LYS 29 2HD LYS 29 60.055 -5.914 6.374 241 HE2 LYS 29 1HE LYS 29 60.921 -5.085 9.157 242 HE3 LYS 29 2HE LYS 29 59.252 -5.067 8.584 243 HZ1 LYS 29 3HZ LYS 29 61.030 -7.440 8.765 244 HZ2 LYS 29 1HZ LYS 29 59.468 -7.449 8.099 245 HZ3 LYS 29 2HZ LYS 29 59.686 -7.106 9.749 246 H ILE 30 H ILE 30 64.770 -4.732 3.382 247 HA ILE 30 HA ILE 30 64.641 -6.882 1.511 248 HB ILE 30 HB ILE 30 66.048 -4.220 1.176 249 HG12 ILE 30 1HG1 ILE 30 63.769 -3.756 1.822 250 HG13 ILE 30 2HG1 ILE 30 63.858 -3.560 0.076 251 HG21 ILE 30 1HG2 ILE 30 65.845 -4.607 -1.164 252 HG22 ILE 30 2HG2 ILE 30 64.738 -5.958 -0.919 253 HG23 ILE 30 3HG2 ILE 30 66.439 -6.125 -0.493 254 HD11 ILE 30 3HD1 ILE 30 63.122 -6.040 -0.033 255 HD12 ILE 30 1HD1 ILE 30 61.905 -4.842 0.401 256 HD13 ILE 30 2HD1 ILE 30 62.653 -5.831 1.655 257 H GLN 31 H GLN 31 67.162 -5.457 3.460 258 HA GLN 31 HA GLN 31 69.371 -6.690 2.152 259 HB2 GLN 31 1HB GLN 31 69.500 -4.700 3.696 260 HB3 GLN 31 2HB GLN 31 69.228 -5.813 5.039 261 HG2 GLN 31 1HG GLN 31 71.219 -7.155 4.000 262 HG3 GLN 31 2HG GLN 31 71.586 -5.642 3.174 263 HE21 GLN 31 2HE2 GLN 31 71.305 -7.145 6.395 264 HE22 GLN 31 1HE2 GLN 31 72.181 -5.941 7.210 265 H ASP 32 H ASP 32 67.174 -7.668 4.709 266 HA ASP 32 HA ASP 32 68.602 -9.809 5.799 267 HB2 ASP 32 1HB ASP 32 66.553 -8.871 6.785 268 HB3 ASP 32 2HB ASP 32 65.607 -9.544 5.459 269 H LYS 33 H LYS 33 66.312 -9.835 3.048 270 HA LYS 33 HA LYS 33 66.515 -12.658 2.651 271 HB2 LYS 33 1HB LYS 33 65.627 -10.454 0.779 272 HB3 LYS 33 2HB LYS 33 65.415 -12.181 0.474 273 HG2 LYS 33 1HG LYS 33 64.435 -11.104 3.091 274 HG3 LYS 33 2HG LYS 33 63.498 -10.716 1.651 275 HD2 LYS 33 1HD LYS 33 63.171 -13.039 1.131 276 HD3 LYS 33 2HD LYS 33 64.336 -13.536 2.359 277 HE2 LYS 33 1HE LYS 33 62.008 -13.831 3.150 278 HE3 LYS 33 2HE LYS 33 62.877 -12.647 4.127 279 HZ1 LYS 33 3HZ LYS 33 61.865 -10.880 2.840 280 HZ2 LYS 33 1HZ LYS 33 60.666 -11.868 3.521 281 HZ3 LYS 33 2HZ LYS 33 61.049 -12.015 1.873 282 H GLU 34 H GLU 34 67.871 -9.891 0.870 283 HA GLU 34 HA GLU 34 70.172 -11.578 0.095 284 HB2 GLU 34 1HB GLU 34 68.579 -9.701 -1.676 285 HB3 GLU 34 2HB GLU 34 70.189 -10.295 -2.090 286 HG2 GLU 34 1HG GLU 34 69.459 -12.530 -2.249 287 HG3 GLU 34 2HG GLU 34 67.985 -12.210 -1.338 288 H GLY 35 H GLY 35 72.163 -10.299 -0.204 289 HA2 GLY 35 1HA GLY 35 72.204 -8.108 1.682 290 HA3 GLY 35 2HA GLY 35 73.586 -8.756 0.811 291 H ILE 36 H ILE 36 71.604 -6.208 1.186 292 HA ILE 36 HA ILE 36 72.761 -4.816 -1.063 293 HB ILE 36 HB ILE 36 70.662 -5.678 -2.044 294 HG12 ILE 36 1HG1 ILE 36 69.605 -3.396 -2.519 295 HG13 ILE 36 2HG1 ILE 36 70.775 -2.718 -1.392 296 HG21 ILE 36 1HG2 ILE 36 69.623 -5.529 0.444 297 HG22 ILE 36 2HG2 ILE 36 68.622 -5.556 -1.004 298 HG23 ILE 36 3HG2 ILE 36 68.995 -4.022 -0.216 299 HD11 ILE 36 3HD1 ILE 36 71.153 -3.363 -4.148 300 HD12 ILE 36 1HD1 ILE 36 72.195 -4.425 -3.203 301 HD13 ILE 36 2HD1 ILE 36 72.320 -2.675 -3.023 302 HA PRO 37 HA PRO 37 72.668 -2.309 2.618 303 HB2 PRO 37 1HB PRO 37 74.241 -0.287 1.292 304 HB3 PRO 37 2HB PRO 37 74.748 -1.439 2.533 305 HG2 PRO 37 1HG PRO 37 75.529 -1.456 -0.129 306 HG3 PRO 37 2HG PRO 37 75.708 -2.790 1.020 307 HD2 PRO 37 1HD PRO 37 73.738 -2.460 -1.175 308 HD3 PRO 37 2HD PRO 37 74.349 -3.941 -0.404 309 HA PRO 38 HA PRO 38 69.151 0.268 1.753 310 HB2 PRO 38 1HB PRO 38 69.917 2.237 3.715 311 HB3 PRO 38 2HB PRO 38 68.686 0.981 3.861 312 HG2 PRO 38 1HG PRO 38 71.378 1.058 4.934 313 HG3 PRO 38 2HG PRO 38 70.023 0.005 5.362 314 HD2 PRO 38 1HD PRO 38 72.280 -0.834 4.022 315 HD3 PRO 38 2HD PRO 38 70.709 -1.661 3.941 316 H ASP 39 H ASP 39 72.354 1.723 2.133 317 HA ASP 39 HA ASP 39 71.821 4.236 0.989 318 HB2 ASP 39 1HB ASP 39 73.899 3.482 2.275 319 HB3 ASP 39 2HB ASP 39 74.455 2.788 0.754 320 H GLN 40 H GLN 40 72.331 1.118 -0.483 321 HA GLN 40 HA GLN 40 72.480 2.398 -3.145 322 HB2 GLN 40 1HB GLN 40 73.157 -0.455 -2.411 323 HB3 GLN 40 2HB GLN 40 73.447 0.344 -3.956 324 HG2 GLN 40 1HG GLN 40 74.792 2.072 -2.516 325 HG3 GLN 40 2HG GLN 40 74.826 0.779 -1.319 326 HE21 GLN 40 2HE2 GLN 40 76.132 -1.095 -1.770 327 HE22 GLN 40 1HE2 GLN 40 77.173 -1.173 -3.110 328 H GLN 41 H GLN 41 70.121 1.405 -1.209 329 HA GLN 41 HA GLN 41 68.666 -0.010 -3.369 330 HB2 GLN 41 1HB GLN 41 68.933 -1.337 -1.309 331 HB3 GLN 41 2HB GLN 41 68.126 -0.070 -0.395 332 HG2 GLN 41 1HG GLN 41 66.511 -1.814 -0.956 333 HG3 GLN 41 2HG GLN 41 66.113 -0.348 -1.845 334 HE21 GLN 41 2HE2 GLN 41 66.483 -0.338 -4.177 335 HE22 GLN 41 1HE2 GLN 41 66.777 -1.778 -5.027 336 H ARG 42 H ARG 42 67.087 1.047 -4.337 337 HA ARG 42 HA ARG 42 65.644 3.173 -2.877 338 HB2 ARG 42 1HB ARG 42 65.548 4.374 -5.146 339 HB3 ARG 42 2HB ARG 42 67.072 4.437 -4.261 340 HG2 ARG 42 1HG ARG 42 67.860 2.464 -5.605 341 HG3 ARG 42 2HG ARG 42 66.388 2.596 -6.570 342 HD2 ARG 42 1HD ARG 42 68.287 3.778 -7.636 343 HD3 ARG 42 2HD ARG 42 66.987 4.887 -7.205 344 HE ARG 42 HE ARG 42 68.394 5.860 -5.615 345 HH11 ARG 42 1HH1 ARG 42 69.654 2.838 -6.727 346 HH12 ARG 42 2HH1 ARG 42 71.224 3.080 -6.038 347 HH21 ARG 42 1HH2 ARG 42 70.473 6.209 -4.753 348 HH22 ARG 42 2HH2 ARG 42 71.686 4.985 -4.920 349 H LEU 43 H LEU 43 63.450 3.106 -3.091 350 HA LEU 43 HA LEU 43 62.339 1.269 -5.140 351 HB2 LEU 43 1HB LEU 43 60.922 1.753 -2.539 352 HB3 LEU 43 2HB LEU 43 60.812 0.379 -3.636 353 HG LEU 43 HG LEU 43 63.313 1.030 -2.052 354 HD11 LEU 43 1HD1 LEU 43 61.159 -1.004 -1.406 355 HD12 LEU 43 2HD1 LEU 43 61.354 0.536 -0.569 356 HD13 LEU 43 3HD1 LEU 43 62.622 -0.686 -0.473 357 HD21 LEU 43 3HD2 LEU 43 62.348 -1.452 -3.509 358 HD22 LEU 43 1HD2 LEU 43 63.849 -1.330 -2.593 359 HD23 LEU 43 2HD2 LEU 43 63.629 -0.371 -4.055 360 H ILE 44 H ILE 44 60.143 1.752 -5.830 361 HA ILE 44 HA ILE 44 59.290 4.552 -5.428 362 HB ILE 44 HB ILE 44 59.657 3.146 -8.085 363 HG12 ILE 44 1HG1 ILE 44 60.692 5.831 -7.145 364 HG13 ILE 44 2HG1 ILE 44 61.608 4.338 -6.937 365 HG21 ILE 44 1HG2 ILE 44 57.557 4.290 -8.242 366 HG22 ILE 44 2HG2 ILE 44 58.749 5.359 -8.984 367 HG23 ILE 44 3HG2 ILE 44 58.173 5.680 -7.348 368 HD11 ILE 44 3HD1 ILE 44 61.664 3.960 -9.322 369 HD12 ILE 44 1HD1 ILE 44 62.192 5.616 -9.028 370 HD13 ILE 44 2HD1 ILE 44 60.557 5.303 -9.609 371 H PHE 45 H PHE 45 57.063 4.870 -5.469 372 HA PHE 45 HA PHE 45 55.329 2.599 -6.148 373 HB2 PHE 45 1HB PHE 45 55.464 2.094 -3.886 374 HB3 PHE 45 2HB PHE 45 55.664 3.779 -3.411 375 HD1 PHE 45 HD2 PHE 45 53.215 1.259 -4.627 376 HD2 PHE 45 HD1 PHE 45 53.780 5.181 -2.972 377 HE1 PHE 45 HE2 PHE 45 50.775 1.434 -4.212 378 HE2 PHE 45 HE1 PHE 45 51.344 5.357 -2.553 379 HZ PHE 45 HZ PHE 45 49.841 3.485 -3.172 380 H ALA 46 H ALA 46 53.580 3.242 -7.220 381 HA ALA 46 HA ALA 46 52.122 4.656 -8.315 382 HB1 ALA 46 3HB ALA 46 50.845 6.154 -6.786 383 HB2 ALA 46 1HB ALA 46 51.997 5.775 -5.504 384 HB3 ALA 46 2HB ALA 46 50.979 4.504 -6.180 385 H GLY 47 H GLY 47 54.730 5.407 -8.806 386 HA2 GLY 47 1HA GLY 47 55.827 7.188 -9.797 387 HA3 GLY 47 2HA GLY 47 54.400 8.174 -9.494 388 H LYS 48 H LYS 48 54.596 7.253 -6.584 389 HA LYS 48 HA LYS 48 56.169 9.492 -5.677 390 HB2 LYS 48 1HB LYS 48 53.970 8.284 -4.678 391 HB3 LYS 48 2HB LYS 48 55.204 7.455 -3.730 392 HG2 LYS 48 1HG LYS 48 56.126 9.626 -3.018 393 HG3 LYS 48 2HG LYS 48 54.917 10.464 -3.985 394 HD2 LYS 48 1HD LYS 48 53.734 8.480 -2.165 395 HD3 LYS 48 2HD LYS 48 54.618 9.747 -1.315 396 HE2 LYS 48 1HE LYS 48 52.293 10.443 -1.625 397 HE3 LYS 48 2HE LYS 48 53.347 11.459 -2.606 398 HZ1 LYS 48 3HZ LYS 48 52.423 10.714 -4.471 399 HZ2 LYS 48 1HZ LYS 48 51.190 10.069 -3.502 400 HZ3 LYS 48 2HZ LYS 48 52.497 9.092 -3.974 401 H GLN 49 H GLN 49 58.273 9.447 -5.206 402 HA GLN 49 HA GLN 49 59.713 6.945 -5.314 403 HB2 GLN 49 1HB GLN 49 60.616 9.000 -6.339 404 HB3 GLN 49 2HB GLN 49 60.715 9.741 -4.742 405 HG2 GLN 49 1HG GLN 49 62.508 8.446 -4.092 406 HG3 GLN 49 2HG GLN 49 62.010 7.069 -5.072 407 HE21 GLN 49 2HE2 GLN 49 61.913 8.003 -7.633 408 HE22 GLN 49 1HE2 GLN 49 63.405 8.664 -8.106 409 H LEU 50 H LEU 50 60.135 5.683 -3.642 410 HA LEU 50 HA LEU 50 59.605 6.564 -0.941 411 HB2 LEU 50 1HB LEU 50 60.578 3.962 -2.148 412 HB3 LEU 50 2HB LEU 50 60.416 4.194 -0.409 413 HG LEU 50 HG LEU 50 58.177 4.600 -2.424 414 HD11 LEU 50 1HD1 LEU 50 58.517 2.263 -2.348 415 HD12 LEU 50 2HD1 LEU 50 57.235 2.545 -1.173 416 HD13 LEU 50 3HD1 LEU 50 58.890 2.282 -0.624 417 HD21 LEU 50 3HD2 LEU 50 57.373 5.839 -0.716 418 HD22 LEU 50 1HD2 LEU 50 58.500 5.167 0.451 419 HD23 LEU 50 2HD2 LEU 50 57.022 4.292 0.041 420 H GLU 51 H GLU 51 60.978 7.699 0.168 421 HA GLU 51 HA GLU 51 63.728 7.985 -0.696 422 HB2 GLU 51 1HB GLU 51 62.304 9.516 1.466 423 HB3 GLU 51 2HB GLU 51 63.748 9.992 0.572 424 HG2 GLU 51 1HG GLU 51 62.171 9.649 -1.532 425 HG3 GLU 51 2HG GLU 51 60.895 9.911 -0.345 426 H ASP 52 H ASP 52 64.931 8.986 1.302 427 HA ASP 52 HA ASP 52 66.493 7.120 2.467 428 HB2 ASP 52 1HB ASP 52 67.332 8.880 3.892 429 HB3 ASP 52 2HB ASP 52 67.000 9.513 2.280 430 H GLY 53 H GLY 53 63.352 7.099 3.331 431 HA2 GLY 53 1HA GLY 53 62.885 5.527 5.255 432 HA3 GLY 53 2HA GLY 53 64.018 6.496 6.154 433 H ARG 54 H ARG 54 61.512 7.539 3.925 434 HA ARG 54 HA ARG 54 60.294 9.283 5.945 435 HB2 ARG 54 1HB ARG 54 59.845 8.777 2.987 436 HB3 ARG 54 2HB ARG 54 58.585 9.541 3.955 437 HG2 ARG 54 1HG ARG 54 60.182 11.287 4.660 438 HG3 ARG 54 2HG ARG 54 61.434 10.536 3.672 439 HD2 ARG 54 1HD ARG 54 60.323 11.063 1.655 440 HD3 ARG 54 2HD ARG 54 58.796 11.371 2.475 441 HE ARG 54 HE ARG 54 59.823 13.426 3.375 442 HH11 ARG 54 1HH1 ARG 54 59.828 13.251 0.219 443 HH12 ARG 54 2HH1 ARG 54 61.339 14.030 -0.110 444 HH21 ARG 54 1HH2 ARG 54 62.464 13.817 3.162 445 HH22 ARG 54 2HH2 ARG 54 62.830 14.350 1.556 446 H THR 55 H THR 55 58.012 8.730 6.664 447 HA THR 55 HA THR 55 57.785 5.848 6.789 448 HB THR 55 HB THR 55 56.525 8.176 8.062 449 HG1 THR 55 HG1 THR 55 57.920 6.835 9.157 450 HG21 THR 55 3HG2 THR 55 54.922 5.700 7.443 451 HG22 THR 55 1HG2 THR 55 54.481 7.373 7.122 452 HG23 THR 55 2HG2 THR 55 54.535 6.777 8.780 453 H LEU 56 H LEU 56 56.376 4.559 5.801 454 HA LEU 56 HA LEU 56 55.266 5.409 3.313 455 HB2 LEU 56 1HB LEU 56 55.961 2.925 4.576 456 HB3 LEU 56 2HB LEU 56 54.406 2.803 3.758 457 HG LEU 56 HG LEU 56 55.420 3.762 1.710 458 HD11 LEU 56 1HD1 LEU 56 57.181 5.115 2.195 459 HD12 LEU 56 2HD1 LEU 56 58.109 3.631 1.967 460 HD13 LEU 56 3HD1 LEU 56 57.672 4.157 3.591 461 HD21 LEU 56 3HD2 LEU 56 57.430 1.673 2.227 462 HD22 LEU 56 1HD2 LEU 56 56.159 1.739 1.012 463 HD23 LEU 56 2HD2 LEU 56 55.787 1.187 2.641 464 H SER 57 H SER 57 53.951 4.759 6.475 465 HA SER 57 HA SER 57 51.290 4.301 5.817 466 HB2 SER 57 1HB SER 57 51.870 4.151 8.125 467 HB3 SER 57 2HB SER 57 52.546 5.777 8.138 468 HG SER 57 HG SER 57 50.538 5.951 9.008 469 H ASP 58 H ASP 58 53.248 7.167 5.757 470 HA ASP 58 HA ASP 58 51.109 9.036 5.281 471 HB2 ASP 58 1HB ASP 58 53.578 9.452 6.135 472 HB3 ASP 58 2HB ASP 58 53.937 9.542 4.411 473 H TYR 59 H TYR 59 53.123 6.900 3.402 474 HA TYR 59 HA TYR 59 52.498 8.087 0.837 475 HB2 TYR 59 1HB TYR 59 53.926 5.581 1.708 476 HB3 TYR 59 2HB TYR 59 53.516 5.852 0.017 477 HD1 TYR 59 HD2 TYR 59 54.829 7.877 2.865 478 HD2 TYR 59 HD1 TYR 59 55.202 6.788 -1.261 479 HE1 TYR 59 HE2 TYR 59 56.768 9.400 2.648 480 HE2 TYR 59 HE1 TYR 59 57.151 8.313 -1.489 481 HH TYR 59 HH TYR 59 58.249 10.052 -0.481 482 H ASN 60 H ASN 60 50.595 6.641 2.959 483 HA ASN 60 HA ASN 60 48.647 5.426 2.880 484 HB2 ASN 60 1HB ASN 60 48.669 6.573 0.078 485 HB3 ASN 60 2HB ASN 60 47.269 5.828 0.850 486 HD21 ASN 60 2HD2 ASN 60 47.038 6.865 3.308 487 HD22 ASN 60 1HD2 ASN 60 47.045 8.562 3.304 488 H ILE 61 H ILE 61 50.891 3.814 2.508 489 HA ILE 61 HA ILE 61 50.774 2.239 0.164 490 HB ILE 61 HB ILE 61 51.818 1.483 2.893 491 HG12 ILE 61 1HG1 ILE 61 52.978 3.426 2.037 492 HG13 ILE 61 2HG1 ILE 61 53.999 2.018 1.801 493 HG21 ILE 61 1HG2 ILE 61 51.519 -0.531 1.658 494 HG22 ILE 61 2HG2 ILE 61 53.217 -0.103 1.450 495 HG23 ILE 61 3HG2 ILE 61 52.061 0.220 0.157 496 HD11 ILE 61 3HD1 ILE 61 54.172 3.055 -0.275 497 HD12 ILE 61 1HD1 ILE 61 52.498 3.602 -0.249 498 HD13 ILE 61 2HD1 ILE 61 52.868 1.906 -0.560 499 H GLN 62 H GLN 62 49.796 0.496 -0.383 500 HA GLN 62 HA GLN 62 47.364 -0.249 1.043 501 HB2 GLN 62 1HB GLN 62 47.155 0.433 -1.258 502 HB3 GLN 62 2HB GLN 62 48.392 -0.709 -1.761 503 HG2 GLN 62 1HG GLN 62 46.968 -2.582 -1.324 504 HG3 GLN 62 2HG GLN 62 45.799 -1.576 -0.465 505 HE21 GLN 62 2HE2 GLN 62 44.009 -1.915 -1.889 506 HE22 GLN 62 1HE2 GLN 62 44.018 -1.407 -3.509 507 H LYS 63 H LYS 63 46.688 -2.500 0.426 508 HA LYS 63 HA LYS 63 47.673 -4.409 2.028 509 HB2 LYS 63 1HB LYS 63 45.509 -4.276 0.589 510 HB3 LYS 63 2HB LYS 63 46.430 -5.250 -0.554 511 HG2 LYS 63 1HG LYS 63 46.627 -7.054 0.930 512 HG3 LYS 63 2HG LYS 63 46.348 -6.049 2.350 513 HD2 LYS 63 1HD LYS 63 44.309 -7.180 2.141 514 HD3 LYS 63 2HD LYS 63 43.977 -5.662 1.311 515 HE2 LYS 63 1HE LYS 63 44.958 -7.090 -0.767 516 HE3 LYS 63 2HE LYS 63 44.275 -8.403 0.193 517 HZ1 LYS 63 3HZ LYS 63 42.609 -7.565 -1.280 518 HZ2 LYS 63 1HZ LYS 63 42.866 -5.972 -0.761 519 HZ3 LYS 63 2HZ LYS 63 42.191 -7.112 0.303 520 H GLU 64 H GLU 64 50.007 -3.417 0.487 521 HA GLU 64 HA GLU 64 52.029 -4.532 0.031 522 HB2 GLU 64 1HB GLU 64 50.395 -6.949 -0.744 523 HB3 GLU 64 2HB GLU 64 52.136 -6.867 -0.556 524 HG2 GLU 64 1HG GLU 64 52.050 -6.910 1.727 525 HG3 GLU 64 2HG GLU 64 50.517 -6.048 1.804 526 H SER 65 H SER 65 51.047 -2.770 -1.528 527 HA SER 65 HA SER 65 50.455 -3.417 -4.210 528 HB2 SER 65 1HB SER 65 50.870 -1.142 -4.656 529 HB3 SER 65 2HB SER 65 50.276 -1.167 -2.997 530 HG SER 65 HG SER 65 52.634 -0.316 -3.935 531 H THR 66 H THR 66 51.858 -3.228 -6.062 532 HA THR 66 HA THR 66 54.442 -4.479 -5.631 533 HB THR 66 HB THR 66 53.286 -3.495 -8.246 534 HG1 THR 66 HG1 THR 66 51.761 -4.863 -7.789 535 HG21 THR 66 3HG2 THR 66 54.629 -5.442 -9.102 536 HG22 THR 66 1HG2 THR 66 55.287 -5.635 -7.475 537 HG23 THR 66 2HG2 THR 66 55.603 -4.159 -8.386 538 H LEU 67 H LEU 67 56.316 -3.440 -5.473 539 HA LEU 67 HA LEU 67 56.415 -0.550 -6.029 540 HB2 LEU 67 1HB LEU 67 57.909 -2.432 -4.247 541 HB3 LEU 67 2HB LEU 67 58.763 -1.004 -4.824 542 HG LEU 67 HG LEU 67 56.909 0.416 -3.963 543 HD11 LEU 67 1HD1 LEU 67 55.463 -1.977 -3.890 544 HD12 LEU 67 2HD1 LEU 67 54.954 -0.440 -3.206 545 HD13 LEU 67 3HD1 LEU 67 55.778 -1.624 -2.196 546 HD21 LEU 67 3HD2 LEU 67 58.150 -1.471 -1.939 547 HD22 LEU 67 1HD2 LEU 67 57.434 0.092 -1.556 548 HD23 LEU 67 2HD2 LEU 67 58.879 0.006 -2.559 549 H HIS 68 H HIS 68 57.741 0.322 -7.566 550 HA HIS 68 HA HIS 68 58.962 -1.551 -9.454 551 HB2 HIS 68 1HB HIS 68 58.279 1.377 -9.540 552 HB3 HIS 68 2HB HIS 68 59.333 0.651 -10.753 553 HD1 HIS 68 HD1 HIS 68 57.848 -2.129 -10.884 554 HD2 HIS 68 HD2 HIS 68 55.989 1.591 -11.168 555 HE1 HIS 68 HE1 HIS 68 55.662 -2.512 -12.101 556 H LEU 69 H LEU 69 61.082 -1.750 -9.854 557 HA LEU 69 HA LEU 69 62.957 -0.053 -8.309 558 HB2 LEU 69 1HB LEU 69 63.101 -3.013 -8.927 559 HB3 LEU 69 2HB LEU 69 64.459 -2.078 -8.305 560 HG LEU 69 HG LEU 69 62.698 -1.331 -6.465 561 HD11 LEU 69 1HD1 LEU 69 61.009 -2.896 -7.881 562 HD12 LEU 69 2HD1 LEU 69 60.864 -2.666 -6.141 563 HD13 LEU 69 3HD1 LEU 69 61.660 -4.106 -6.776 564 HD21 LEU 69 3HD2 LEU 69 63.987 -4.077 -6.508 565 HD22 LEU 69 1HD2 LEU 69 63.463 -3.214 -5.062 566 HD23 LEU 69 2HD2 LEU 69 64.784 -2.576 -6.040 567 H VAL 70 H VAL 70 65.195 -0.060 -9.282 568 HA VAL 70 HA VAL 70 65.108 -0.235 -12.235 569 HB VAL 70 HB VAL 70 66.763 1.856 -11.942 570 HG11 VAL 70 1HG1 VAL 70 63.738 1.841 -12.030 571 HG12 VAL 70 2HG1 VAL 70 64.860 1.968 -13.384 572 HG13 VAL 70 3HG1 VAL 70 64.686 3.312 -12.255 573 HG21 VAL 70 3HG2 VAL 70 66.382 1.731 -9.415 574 HG22 VAL 70 1HG2 VAL 70 64.738 2.283 -9.731 575 HG23 VAL 70 2HG2 VAL 70 66.108 3.310 -10.153 576 H LEU 71 H LEU 71 67.195 -0.480 -13.240 577 HA LEU 71 HA LEU 71 69.528 -1.020 -11.641 578 HB2 LEU 71 1HB LEU 71 69.708 -3.412 -12.358 579 HB3 LEU 71 2HB LEU 71 68.406 -3.113 -11.211 580 HG LEU 71 HG LEU 71 67.900 -3.046 -14.191 581 HD11 LEU 71 1HD1 LEU 71 68.951 -5.235 -13.571 582 HD12 LEU 71 2HD1 LEU 71 67.283 -5.395 -14.121 583 HD13 LEU 71 3HD1 LEU 71 67.656 -5.479 -12.400 584 HD21 LEU 71 3HD2 LEU 71 65.636 -3.963 -13.129 585 HD22 LEU 71 1HD2 LEU 71 65.991 -2.239 -13.142 586 HD23 LEU 71 2HD2 LEU 71 66.262 -3.183 -11.679 587 H ARG 72 H ARG 72 71.403 -1.255 -12.890 588 HA ARG 72 HA ARG 72 72.717 -0.605 -14.682 589 HB2 ARG 72 1HB ARG 72 71.985 -3.020 -15.136 590 HB3 ARG 72 2HB ARG 72 70.844 -2.337 -16.293 591 HG2 ARG 72 1HG ARG 72 72.665 -2.678 -17.688 592 HG3 ARG 72 2HG ARG 72 73.003 -1.035 -17.146 593 HD2 ARG 72 1HD ARG 72 75.054 -2.088 -16.774 594 HD3 ARG 72 2HD ARG 72 74.288 -2.237 -15.196 595 HE ARG 72 HE ARG 72 74.207 -4.532 -15.515 596 HH11 ARG 72 1HH2 ARG 72 76.555 -4.135 -17.442 597 HH12 ARG 72 2HH2 ARG 72 76.024 -5.048 -18.815 598 HH21 ARG 72 1HH1 ARG 72 72.719 -5.192 -17.772 599 HH22 ARG 72 2HH1 ARG 72 73.852 -5.647 -19.002
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