NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
599441 | 2n9j | 25908 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HN GLY 1 1.884 0.000 0.829 2 HA2 GLY 1 1HA GLY 1 1.782 0.860 -1.849 3 HA3 GLY 1 2HA GLY 1 3.138 0.104 -1.034 4 H ASP 2 HN ASP 2 0.999 -0.231 -3.593 5 HA ASP 2 HA ASP 2 0.293 -2.888 -3.494 6 HB2 ASP 2 2HB ASP 2 -0.235 -0.876 -5.190 7 HB3 ASP 2 3HB ASP 2 1.076 -1.590 -6.109 8 HD2 ASP 2 HD2 ASP 2 -1.204 -4.126 -4.738 9 H VAL 3 HN VAL 3 1.508 -4.778 -3.815 10 HA VAL 3 HA VAL 3 4.332 -4.496 -4.206 11 HB VAL 3 HB VAL 3 4.471 -6.673 -3.502 12 HG11 VAL 3 1HG1 VAL 3 3.066 -5.074 -1.955 13 HG12 VAL 3 2HG1 VAL 3 1.749 -6.215 -2.319 14 HG13 VAL 3 3HG1 VAL 3 3.244 -6.798 -1.548 15 HG21 VAL 3 3HG2 VAL 3 2.406 -8.245 -3.649 16 HG22 VAL 3 1HG2 VAL 3 1.804 -7.076 -4.849 17 HG23 VAL 3 2HG2 VAL 3 3.348 -7.919 -5.124 18 H GLU 4 HN GLU 4 1.465 -5.498 -6.096 19 HA GLU 4 HA GLU 4 2.633 -6.819 -8.130 20 HB2 GLU 4 2HB GLU 4 0.299 -4.881 -8.070 21 HB3 GLU 4 3HB GLU 4 0.758 -5.684 -9.559 22 HG2 GLU 4 2HG GLU 4 0.668 -7.898 -8.161 23 HG3 GLU 4 3HG GLU 4 -0.198 -6.953 -6.966 24 HE2 GLU 4 HE2 GLU 4 -0.517 -7.883 -10.417 25 H LYS 5 HN LYS 5 2.059 -3.224 -8.017 26 HA LYS 5 HA LYS 5 3.292 -2.569 -10.361 27 HB2 LYS 5 2HB LYS 5 2.742 -1.170 -7.787 28 HB3 LYS 5 3HB LYS 5 3.884 -0.408 -8.876 29 HG2 LYS 5 2HG LYS 5 1.141 -1.389 -9.785 30 HG3 LYS 5 3HG LYS 5 1.420 0.240 -9.202 31 HD2 LYS 5 2HD LYS 5 3.212 0.509 -10.985 32 HD3 LYS 5 3HD LYS 5 2.772 -1.068 -11.608 33 HE2 LYS 5 2HE LYS 5 1.237 1.516 -11.719 34 HE3 LYS 5 3HE LYS 5 1.438 0.292 -12.958 35 HZ1 LYS 5 2HZ LYS 5 -0.638 -0.311 -12.329 36 HZ3 LYS 5 1HZ LYS 5 -0.569 0.444 -10.888 37 H GLY 6 HN GLY 6 4.702 -3.802 -7.397 38 HA2 GLY 6 1HA GLY 6 7.393 -2.961 -8.186 39 HA3 GLY 6 2HA GLY 6 6.911 -3.706 -6.675 40 H LYS 7 HN LYS 7 5.196 -5.743 -8.241 41 HA LYS 7 HA LYS 7 7.237 -7.704 -8.440 42 HB2 LYS 7 2HB LYS 7 4.736 -7.908 -7.715 43 HB3 LYS 7 3HB LYS 7 4.418 -8.065 -9.431 44 HG2 LYS 7 2HG LYS 7 5.532 -10.108 -9.604 45 HG3 LYS 7 3HG LYS 7 6.651 -9.737 -8.308 46 HD2 LYS 7 2HD LYS 7 5.273 -11.331 -7.279 47 HD3 LYS 7 3HD LYS 7 4.518 -9.838 -6.756 48 HE2 LYS 7 2HE LYS 7 3.608 -11.707 -8.980 49 HE3 LYS 7 3HE LYS 7 2.731 -11.255 -7.533 50 HZ1 LYS 7 2HZ LYS 7 1.796 -9.813 -9.035 51 HZ3 LYS 7 1HZ LYS 7 3.116 -9.705 -9.982 52 H LYS 8 HN LYS 8 4.898 -6.364 -10.884 53 HA LYS 8 HA LYS 8 6.058 -7.554 -13.077 54 HB2 LYS 8 2HB LYS 8 4.366 -5.108 -12.656 55 HB3 LYS 8 3HB LYS 8 5.028 -5.431 -14.246 56 HG2 LYS 8 2HG LYS 8 3.472 -7.513 -12.646 57 HG3 LYS 8 3HG LYS 8 2.707 -6.422 -13.785 58 HD2 LYS 8 2HD LYS 8 4.514 -7.301 -15.490 59 HD3 LYS 8 3HD LYS 8 4.731 -8.614 -14.350 60 HE2 LYS 8 2HE LYS 8 2.069 -8.766 -14.467 61 HE3 LYS 8 3HE LYS 8 2.280 -7.908 -15.981 62 HZ1 LYS 8 2HZ LYS 8 2.605 -10.614 -15.603 63 HZ3 LYS 8 1HZ LYS 8 4.130 -10.070 -15.775 64 H ILE 9 HN ILE 9 6.785 -4.362 -11.537 65 HA ILE 9 HA ILE 9 8.710 -3.595 -13.405 66 HB ILE 9 HB ILE 9 8.004 -2.832 -10.606 67 HG12 ILE 9 2HG1 ILE 9 8.214 -1.160 -13.121 68 HG13 ILE 9 3HG1 ILE 9 6.767 -2.043 -12.678 69 HG21 ILE 9 1HG2 ILE 9 10.545 -2.087 -12.046 70 HG22 ILE 9 2HG2 ILE 9 9.794 -1.007 -10.847 71 HG23 ILE 9 3HG2 ILE 9 10.322 -2.639 -10.369 72 HD11 ILE 9 3HD1 ILE 9 6.172 -0.267 -11.404 73 HD12 ILE 9 1HD1 ILE 9 7.515 -0.683 -10.313 74 HD13 ILE 9 2HD1 ILE 9 7.768 0.490 -11.628 75 H PHE 10 HN PHE 10 8.895 -5.547 -10.386 76 HA PHE 10 HA PHE 10 11.691 -5.707 -10.342 77 HB2 PHE 10 2HB PHE 10 10.479 -6.313 -8.359 78 HB3 PHE 10 3HB PHE 10 9.284 -7.224 -9.260 79 HD1 PHE 10 HD1 PHE 10 12.762 -7.302 -8.011 80 HD2 PHE 10 HD2 PHE 10 9.549 -9.548 -9.635 81 HE1 PHE 10 HE1 PHE 10 13.975 -9.431 -7.466 82 HE2 PHE 10 HE2 PHE 10 10.762 -11.677 -9.091 83 HZ PHE 10 HZ PHE 10 12.961 -11.593 -8.013 84 H ILE 11 HN ILE 11 9.329 -7.127 -12.450 85 HA ILE 11 HA ILE 11 10.972 -9.431 -13.051 86 HB ILE 11 HB ILE 11 8.329 -8.428 -14.102 87 HG12 ILE 11 2HG1 ILE 11 8.817 -10.983 -12.586 88 HG13 ILE 11 3HG1 ILE 11 8.641 -9.465 -11.727 89 HG21 ILE 11 1HG2 ILE 11 9.641 -9.587 -15.870 90 HG22 ILE 11 2HG2 ILE 11 9.721 -11.021 -14.819 91 HG23 ILE 11 3HG2 ILE 11 8.147 -10.438 -15.409 92 HD11 ILE 11 3HD1 ILE 11 6.396 -9.657 -11.911 93 HD12 ILE 11 1HD1 ILE 11 6.554 -9.518 -13.678 94 HD13 ILE 11 2HD1 ILE 11 6.581 -11.122 -12.906 95 H MET 12 HN MET 12 9.604 -6.625 -14.922 96 HA MET 12 HA MET 12 11.193 -7.050 -17.129 97 HB2 MET 12 2HB MET 12 9.710 -4.682 -15.933 98 HB3 MET 12 3HB MET 12 10.731 -4.403 -17.330 99 HG2 MET 12 2HG MET 12 9.480 -6.057 -18.653 100 HG3 MET 12 3HG MET 12 8.552 -6.543 -17.248 101 HE1 MET 12 3HE MET 12 5.953 -4.664 -19.455 102 HE2 MET 12 1HE MET 12 7.105 -6.007 -19.647 103 HE3 MET 12 2HE MET 12 6.048 -5.939 -18.217 104 H LYS 13 HN LYS 13 12.067 -5.950 -13.980 105 HA LYS 13 HA LYS 13 14.498 -4.702 -15.053 106 HB2 LYS 13 2HB LYS 13 13.068 -4.324 -12.409 107 HB3 LYS 13 3HB LYS 13 14.664 -3.687 -12.750 108 HG2 LYS 13 2HG LYS 13 13.678 -2.514 -14.791 109 HG3 LYS 13 3HG LYS 13 12.091 -3.035 -14.259 110 HD2 LYS 13 2HD LYS 13 12.820 -1.916 -11.951 111 HD3 LYS 13 3HD LYS 13 13.973 -1.056 -12.952 112 HE2 LYS 13 2HE LYS 13 12.290 0.058 -14.181 113 HE3 LYS 13 3HE LYS 13 11.080 -1.162 -13.835 114 HZ1 LYS 13 2HZ LYS 13 11.258 1.158 -12.504 115 HZ3 LYS 13 1HZ LYS 13 12.113 0.208 -11.495 116 H CYS 14 HN CYS 14 13.150 -7.066 -12.691 117 HA CYS 14 HA CYS 14 15.827 -8.256 -12.621 118 HB2 CYS 14 2HB CYS 14 13.989 -8.692 -10.325 119 HB3 CYS 14 3HB CYS 14 15.740 -8.637 -10.376 120 H SER 15 HN SER 15 14.998 -9.458 -14.560 121 HA SER 15 HA SER 15 12.988 -11.427 -13.804 122 HB2 SER 15 2HB SER 15 13.105 -11.755 -16.468 123 HB3 SER 15 3HB SER 15 12.090 -10.533 -15.729 124 HG SER 15 HG SER 15 13.742 -9.979 -17.569 125 H GLN 16 HN GLN 16 13.561 -13.600 -13.740 126 HA GLN 16 HA GLN 16 15.005 -15.237 -13.439 127 HB2 GLN 16 2HB GLN 16 15.849 -14.738 -16.312 128 HB3 GLN 16 3HB GLN 16 15.653 -16.275 -15.494 129 HG2 GLN 16 2HG GLN 16 13.169 -15.764 -15.266 130 HG3 GLN 16 3HG GLN 16 13.421 -14.330 -16.242 131 HE21 GLN 16 1HE2 GLN 16 12.550 -14.706 -18.138 132 HE22 GLN 16 2HE2 GLN 16 12.816 -16.083 -19.154 133 H CYS 17 HN CYS 17 16.176 -13.033 -12.301 134 HA CYS 17 HA CYS 17 18.975 -13.482 -12.982 135 HB2 CYS 17 2HB CYS 17 17.731 -11.181 -13.758 136 HB3 CYS 17 3HB CYS 17 18.324 -10.720 -12.175 137 H HIS 18 HN HIS 18 16.553 -11.973 -10.730 138 HA HIS 18 HA HIS 18 18.333 -12.676 -8.523 139 HB2 HIS 18 2HB HIS 18 16.405 -10.492 -9.034 140 HB3 HIS 18 3HB HIS 18 16.357 -11.153 -7.412 141 HD1 HIS 18 HD1 HIS 18 18.915 -11.316 -6.246 142 HD2 HIS 18 HD2 HIS 18 18.306 -8.558 -9.347 143 HE1 HIS 18 HE1 HIS 18 20.800 -9.607 -6.063 144 H THR 19 HN THR 19 16.618 -12.924 -6.406 145 HA THR 19 HA THR 19 14.408 -14.631 -7.092 146 HB THR 19 HB THR 19 15.499 -16.557 -5.725 147 HG1 THR 19 HG1 THR 19 17.933 -16.291 -5.939 148 HG21 THR 19 1HG2 THR 19 16.527 -17.522 -7.638 149 HG22 THR 19 2HG2 THR 19 15.396 -16.356 -8.366 150 HG23 THR 19 3HG2 THR 19 17.123 -15.950 -8.221 151 H VAL 20 HN VAL 20 13.104 -15.209 -5.224 152 HA VAL 20 HA VAL 20 13.817 -13.710 -2.817 153 HB VAL 20 HB VAL 20 11.620 -12.743 -2.680 154 HG11 VAL 20 1HG1 VAL 20 13.128 -12.262 -5.252 155 HG12 VAL 20 2HG1 VAL 20 11.679 -11.317 -4.833 156 HG13 VAL 20 3HG1 VAL 20 13.102 -11.284 -3.765 157 HG21 VAL 20 3HG2 VAL 20 10.106 -12.902 -4.752 158 HG22 VAL 20 1HG2 VAL 20 11.076 -14.327 -5.196 159 HG23 VAL 20 2HG2 VAL 20 10.167 -14.311 -3.666 160 H GLU 21 HN GLU 21 11.583 -16.052 -4.439 161 HA GLU 21 HA GLU 21 10.719 -17.150 -2.012 162 HB2 GLU 21 2HB GLU 21 9.945 -19.061 -3.572 163 HB3 GLU 21 3HB GLU 21 9.278 -17.467 -3.865 164 HG2 GLU 21 2HG GLU 21 10.510 -17.148 -5.828 165 HG3 GLU 21 3HG GLU 21 11.828 -18.175 -5.301 166 HE2 GLU 21 HE2 GLU 21 10.243 -21.135 -6.131 167 H LYS 22 HN LYS 22 11.215 -19.287 -1.109 168 HA LYS 22 HA LYS 22 13.920 -19.766 -0.854 169 HB2 LYS 22 2HB LYS 22 11.799 -20.514 0.534 170 HB3 LYS 22 3HB LYS 22 11.923 -21.965 -0.439 171 HG2 LYS 22 2HG LYS 22 14.002 -22.569 0.459 172 HG3 LYS 22 3HG LYS 22 14.453 -20.914 0.817 173 HD2 LYS 22 2HD LYS 22 12.352 -21.087 2.500 174 HD3 LYS 22 3HD LYS 22 12.718 -22.798 2.407 175 HE2 LYS 22 2HE LYS 22 14.903 -20.755 2.972 176 HE3 LYS 22 3HE LYS 22 13.900 -21.387 4.263 177 HZ1 LYS 22 2HZ LYS 22 15.274 -23.148 4.284 178 HZ3 LYS 22 1HZ LYS 22 16.060 -22.670 2.940 179 H GLY 23 HN GLY 23 11.505 -21.116 -3.139 180 HA2 GLY 23 1HA GLY 23 13.112 -23.169 -4.191 181 HA3 GLY 23 2HA GLY 23 11.739 -22.403 -4.966 182 H GLY 24 HN GLY 24 13.076 -19.649 -4.661 183 HA2 GLY 24 1HA GLY 24 14.392 -19.658 -7.196 184 HA3 GLY 24 2HA GLY 24 14.162 -18.300 -6.113 185 H LYS 25 HN LYS 25 16.252 -21.069 -6.941 186 HA LYS 25 HA LYS 25 18.139 -20.580 -4.879 187 HB2 LYS 25 2HB LYS 25 19.288 -22.382 -5.741 188 HB3 LYS 25 3HB LYS 25 17.651 -22.739 -6.252 189 HG2 LYS 25 2HG LYS 25 18.153 -21.642 -8.480 190 HG3 LYS 25 3HG LYS 25 19.812 -21.418 -7.961 191 HD2 LYS 25 2HD LYS 25 19.519 -23.476 -9.360 192 HD3 LYS 25 3HD LYS 25 20.151 -23.837 -7.766 193 HE2 LYS 25 2HE LYS 25 18.088 -24.736 -7.003 194 HE3 LYS 25 3HE LYS 25 17.155 -23.904 -8.230 195 HZ1 LYS 25 2HZ LYS 25 17.339 -26.166 -8.907 196 HZ3 LYS 25 1HZ LYS 25 18.946 -26.228 -8.651 197 H HIS 26 HN HIS 26 20.490 -20.006 -5.405 198 HA HIS 26 HA HIS 26 20.478 -17.448 -6.576 199 HB2 HIS 26 2HB HIS 26 22.940 -19.074 -5.942 200 HB3 HIS 26 3HB HIS 26 22.755 -17.332 -5.934 201 HD1 HIS 26 HD1 HIS 26 22.153 -16.251 -3.733 202 HD2 HIS 26 HD2 HIS 26 21.479 -20.392 -3.734 203 HE1 HIS 26 HE1 HIS 26 21.544 -16.877 -1.335 204 H LYS 27 HN LYS 27 20.785 -16.823 -8.661 205 HA LYS 27 HA LYS 27 21.958 -18.824 -10.463 206 HB2 LYS 27 2HB LYS 27 19.427 -17.248 -10.707 207 HB3 LYS 27 3HB LYS 27 20.360 -17.535 -12.161 208 HG2 LYS 27 2HG LYS 27 20.441 -20.044 -11.268 209 HG3 LYS 27 3HG LYS 27 19.048 -19.552 -10.325 210 HD2 LYS 27 2HD LYS 27 19.295 -19.301 -13.361 211 HD3 LYS 27 3HD LYS 27 18.390 -20.546 -12.522 212 HE2 LYS 27 2HE LYS 27 17.837 -17.551 -12.266 213 HE3 LYS 27 3HE LYS 27 16.955 -18.630 -13.328 214 HZ1 LYS 27 2HZ LYS 27 15.930 -19.650 -11.546 215 HZ3 LYS 27 1HZ LYS 27 16.119 -18.171 -10.892 216 H THR 28 HN THR 28 20.900 -15.722 -11.683 217 HA THR 28 HA THR 28 23.569 -15.043 -12.399 218 HB THR 28 HB THR 28 21.160 -13.187 -12.484 219 HG1 THR 28 HG1 THR 28 20.401 -14.534 -14.195 220 HG21 THR 28 1HG2 THR 28 22.098 -12.860 -14.843 221 HG22 THR 28 2HG2 THR 28 23.178 -12.299 -13.545 222 HG23 THR 28 3HG2 THR 28 23.490 -13.854 -14.353 223 H GLY 29 HN GLY 29 21.289 -13.986 -9.837 224 HA2 GLY 29 1HA GLY 29 23.562 -12.550 -8.608 225 HA3 GLY 29 2HA GLY 29 21.960 -11.846 -8.695 226 HA PRO 30 HA PRO 30 22.311 -14.445 -4.907 227 HB2 PRO 30 2HB PRO 30 22.420 -12.492 -2.998 228 HB3 PRO 30 3HB PRO 30 23.843 -13.300 -3.625 229 HG2 PRO 30 2HG PRO 30 22.854 -10.574 -4.200 230 HG3 PRO 30 3HG PRO 30 24.454 -11.240 -4.464 231 HD2 PRO 30 2HD PRO 30 22.436 -10.783 -6.451 232 HD3 PRO 30 3HD PRO 30 23.991 -11.555 -6.694 233 H ASN 31 HN ASN 31 20.670 -15.057 -3.449 234 HA ASN 31 HA ASN 31 18.176 -14.130 -4.376 235 HB2 ASN 31 2HB ASN 31 18.316 -16.436 -3.660 236 HB3 ASN 31 3HB ASN 31 19.063 -16.001 -2.136 237 HD21 ASN 31 1HD2 ASN 31 16.179 -16.576 -3.825 238 HD22 ASN 31 2HD2 ASN 31 15.032 -16.173 -2.592 239 H LEU 32 HN LEU 32 16.455 -13.231 -2.831 240 HA LEU 32 HA LEU 32 17.663 -11.709 -0.634 241 HB2 LEU 32 2HB LEU 32 15.518 -10.565 -2.399 242 HB3 LEU 32 3HB LEU 32 16.543 -9.744 -1.239 243 HG LEU 32 HG LEU 32 17.575 -10.985 -3.801 244 HD11 LEU 32 1HD1 LEU 32 17.707 -8.186 -3.993 245 HD12 LEU 32 2HD1 LEU 32 16.669 -9.296 -4.920 246 HD13 LEU 32 3HD1 LEU 32 16.063 -8.556 -3.418 247 HD21 LEU 32 3HD2 LEU 32 19.634 -10.323 -3.219 248 HD22 LEU 32 1HD2 LEU 32 19.058 -8.786 -2.530 249 HD23 LEU 32 2HD2 LEU 32 18.978 -10.280 -1.565 250 H HIS 33 HN HIS 33 16.904 -12.930 1.063 251 HA HIS 33 HA HIS 33 13.996 -13.303 1.102 252 HB2 HIS 33 2HB HIS 33 15.144 -15.436 0.884 253 HB3 HIS 33 3HB HIS 33 16.171 -15.070 2.256 254 HD1 HIS 33 HD1 HIS 33 12.528 -15.818 1.429 255 HD2 HIS 33 HD2 HIS 33 15.107 -15.710 4.735 256 HE1 HIS 33 HE1 HIS 33 11.231 -16.827 3.381 257 H GLY 34 HN GLY 34 16.976 -12.815 3.110 258 HA2 GLY 34 1HA GLY 34 15.292 -11.651 5.221 259 HA3 GLY 34 2HA GLY 34 16.939 -12.224 5.387 260 H LEU 35 HN LEU 35 15.937 -10.286 2.570 261 HA LEU 35 HA LEU 35 17.955 -8.515 2.629 262 HB2 LEU 35 2HB LEU 35 16.483 -8.652 0.779 263 HB3 LEU 35 3HB LEU 35 15.096 -8.184 1.743 264 HG LEU 35 HG LEU 35 16.546 -5.967 2.089 265 HD11 LEU 35 1HD1 LEU 35 18.503 -6.457 0.915 266 HD12 LEU 35 2HD1 LEU 35 17.621 -7.209 -0.436 267 HD13 LEU 35 3HD1 LEU 35 17.569 -5.444 -0.213 268 HD21 LEU 35 3HD2 LEU 35 14.337 -6.759 0.501 269 HD22 LEU 35 1HD2 LEU 35 14.754 -5.131 1.089 270 HD23 LEU 35 2HD2 LEU 35 15.347 -5.684 -0.496 271 H PHE 36 HN PHE 36 14.672 -7.495 3.791 272 HA PHE 36 HA PHE 36 15.654 -5.325 5.213 273 HB2 PHE 36 2HB PHE 36 13.167 -7.111 5.328 274 HB3 PHE 36 3HB PHE 36 13.317 -5.745 6.415 275 HD1 PHE 36 HD2 PHE 36 13.105 -6.707 2.855 276 HD2 PHE 36 HD1 PHE 36 12.907 -3.532 5.663 277 HE1 PHE 36 HE2 PHE 36 12.184 -5.193 1.078 278 HE2 PHE 36 HE1 PHE 36 11.986 -2.018 3.886 279 HZ PHE 36 HZ PHE 36 11.636 -2.866 1.614 280 H GLY 37 HN GLY 37 17.230 -5.564 6.767 281 HA2 GLY 37 1HA GLY 37 17.501 -5.877 9.118 282 HA3 GLY 37 2HA GLY 37 16.563 -7.354 9.018 283 H ARG 38 HN ARG 38 18.705 -6.864 6.319 284 HA ARG 38 HA ARG 38 20.770 -8.404 7.643 285 HB2 ARG 38 2HB ARG 38 19.311 -10.019 6.417 286 HB3 ARG 38 3HB ARG 38 19.517 -9.101 4.938 287 HG2 ARG 38 2HG ARG 38 21.784 -9.731 4.695 288 HG3 ARG 38 3HG ARG 38 21.978 -10.085 6.400 289 HD2 ARG 38 2HD ARG 38 21.811 -12.261 5.611 290 HD3 ARG 38 3HD ARG 38 20.107 -11.950 5.873 291 HE ARG 38 HE ARG 38 20.949 -11.105 3.220 292 HH11 ARG 38 2HH2 ARG 38 19.996 -13.941 5.118 293 HH12 ARG 38 1HH2 ARG 38 19.457 -14.837 3.738 294 HH22 ARG 38 HH1 ARG 38 19.608 -13.846 1.561 295 H LYS 39 HN LYS 39 22.887 -7.888 6.923 296 HA LYS 39 HA LYS 39 23.082 -5.489 5.373 297 HB2 LYS 39 2HB LYS 39 24.898 -7.177 7.028 298 HB3 LYS 39 3HB LYS 39 25.642 -6.205 5.775 299 HG2 LYS 39 2HG LYS 39 24.989 -4.179 6.751 300 HG3 LYS 39 3HG LYS 39 23.572 -4.874 7.514 301 HD2 LYS 39 2HD LYS 39 26.415 -5.579 8.370 302 HD3 LYS 39 3HD LYS 39 25.514 -4.256 9.084 303 HE2 LYS 39 2HE LYS 39 23.814 -5.744 9.950 304 HE3 LYS 39 3HE LYS 39 24.380 -7.082 8.969 305 HZ1 LYS 39 2HZ LYS 39 26.408 -5.993 10.715 306 HZ3 LYS 39 1HZ LYS 39 25.998 -7.549 10.465 307 H THR 40 HN THR 40 25.322 -5.727 3.825 308 HA THR 40 HA THR 40 24.322 -7.429 1.690 309 HB THR 40 HB THR 40 25.711 -6.026 0.293 310 HG1 THR 40 HG1 THR 40 27.423 -4.811 1.337 311 HG21 THR 40 1HG2 THR 40 25.064 -4.127 2.587 312 HG22 THR 40 2HG2 THR 40 25.051 -3.789 0.840 313 HG23 THR 40 3HG2 THR 40 23.772 -4.796 1.562 314 H GLY 41 HN GLY 41 25.765 -8.826 0.437 315 HA2 GLY 41 1HA GLY 41 27.224 -10.527 0.286 316 HA3 GLY 41 2HA GLY 41 28.297 -9.609 1.324 317 H GLN 42 HN GLN 42 24.982 -10.794 2.127 318 HA GLN 42 HA GLN 42 26.222 -12.271 4.303 319 HB2 GLN 42 2HB GLN 42 23.288 -11.509 4.009 320 HB3 GLN 42 3HB GLN 42 24.082 -12.107 5.452 321 HG2 GLN 42 2HG GLN 42 24.972 -9.533 4.087 322 HG3 GLN 42 3HG GLN 42 23.689 -9.545 5.282 323 HE21 GLN 42 1HE2 GLN 42 26.946 -9.235 4.773 324 HE22 GLN 42 2HE2 GLN 42 27.555 -9.505 6.372 325 H ALA 43 HN ALA 43 26.097 -13.200 1.464 326 HA ALA 43 HA ALA 43 24.267 -15.474 1.804 327 HB1 ALA 43 3HB ALA 43 25.411 -14.134 -0.678 328 HB2 ALA 43 1HB ALA 43 24.467 -15.643 -0.701 329 HB3 ALA 43 2HB ALA 43 23.715 -14.131 -0.137 330 HA PRO 44 HA PRO 44 28.219 -17.418 2.323 331 HB2 PRO 44 2HB PRO 44 27.329 -19.519 3.829 332 HB3 PRO 44 3HB PRO 44 27.858 -17.998 4.522 333 HG2 PRO 44 2HG PRO 44 25.106 -19.029 4.193 334 HG3 PRO 44 3HG PRO 44 25.680 -17.746 5.240 335 HD2 PRO 44 2HD PRO 44 24.267 -17.437 2.763 336 HD3 PRO 44 3HD PRO 44 24.942 -16.157 3.751 337 H GLY 45 HN GLY 45 25.615 -18.054 0.494 338 HA2 GLY 45 1HA GLY 45 26.660 -20.650 -0.423 339 HA3 GLY 45 2HA GLY 45 25.060 -20.002 -0.723 340 H TYR 46 HN TYR 46 26.654 -17.247 -1.133 341 HA TYR 46 HA TYR 46 27.923 -17.793 -3.674 342 HB2 TYR 46 2HB TYR 46 25.398 -17.592 -4.060 343 HB3 TYR 46 3HB TYR 46 25.426 -16.029 -3.267 344 HD1 TYR 46 HD1 TYR 46 27.815 -17.442 -5.783 345 HD2 TYR 46 HD2 TYR 46 24.833 -14.494 -4.930 346 HE1 TYR 46 HE1 TYR 46 28.283 -16.313 -8.012 347 HE2 TYR 46 HE2 TYR 46 25.311 -13.376 -7.163 348 HH TYR 46 HH TYR 46 27.410 -14.875 -9.517 349 H SER 47 HN SER 47 29.842 -16.807 -3.125 350 HA SER 47 HA SER 47 29.844 -14.450 -1.570 351 HB2 SER 47 2HB SER 47 32.080 -15.737 -3.199 352 HB3 SER 47 3HB SER 47 32.302 -14.483 -1.995 353 HG SER 47 HG SER 47 31.047 -16.171 -0.564 354 H TYR 48 HN TYR 48 29.984 -12.296 -2.238 355 HA TYR 48 HA TYR 48 29.638 -11.856 -5.096 356 HB2 TYR 48 2HB TYR 48 29.615 -9.920 -2.706 357 HB3 TYR 48 3HB TYR 48 28.863 -9.647 -4.265 358 HD1 TYR 48 HD2 TYR 48 27.935 -12.808 -4.087 359 HD2 TYR 48 HD1 TYR 48 27.350 -9.253 -1.780 360 HE1 TYR 48 HE2 TYR 48 25.746 -13.740 -3.192 361 HE2 TYR 48 HE1 TYR 48 25.163 -10.197 -0.893 362 HH TYR 48 HH TYR 48 23.784 -11.851 -0.904 363 H THR 49 HN THR 49 30.575 -9.243 -5.354 364 HA THR 49 HA THR 49 33.365 -9.726 -5.667 365 HB THR 49 HB THR 49 33.171 -7.208 -6.392 366 HG1 THR 49 HG1 THR 49 30.938 -6.553 -6.493 367 HG21 THR 49 1HG2 THR 49 31.946 -7.765 -8.464 368 HG22 THR 49 2HG2 THR 49 33.014 -9.126 -8.042 369 HG23 THR 49 3HG2 THR 49 31.270 -9.224 -7.700 370 H ALA 50 HN ALA 50 34.756 -7.523 -5.038 371 HA ALA 50 HA ALA 50 34.734 -7.672 -2.131 372 HB1 ALA 50 3HB ALA 50 36.985 -6.524 -2.451 373 HB2 ALA 50 1HB ALA 50 36.847 -8.152 -3.158 374 HB3 ALA 50 2HB ALA 50 36.740 -6.715 -4.204 375 H ALA 51 HN ALA 51 33.288 -5.824 -4.516 376 HA ALA 51 HA ALA 51 33.671 -3.296 -3.110 377 HB1 ALA 51 3HB ALA 51 32.365 -2.416 -5.092 378 HB2 ALA 51 1HB ALA 51 33.913 -3.189 -5.507 379 HB3 ALA 51 2HB ALA 51 32.385 -4.067 -5.757 380 H ASN 52 HN ASN 52 31.210 -5.781 -3.942 381 HA ASN 52 HA ASN 52 29.139 -4.275 -2.718 382 HB2 ASN 52 2HB ASN 52 29.038 -6.147 -4.612 383 HB3 ASN 52 3HB ASN 52 28.999 -7.264 -3.263 384 HD21 ASN 52 1HD2 ASN 52 27.276 -7.264 -1.823 385 HD22 ASN 52 2HD2 ASN 52 25.743 -6.546 -2.187 386 H LYS 53 HN LYS 53 31.253 -7.106 -1.962 387 HA LYS 53 HA LYS 53 29.987 -7.824 0.435 388 HB2 LYS 53 2HB LYS 53 31.635 -9.147 -1.040 389 HB3 LYS 53 3HB LYS 53 32.904 -8.277 -0.203 390 HG2 LYS 53 2HG LYS 53 31.497 -9.050 1.969 391 HG3 LYS 53 3HG LYS 53 30.964 -10.313 0.878 392 HD2 LYS 53 2HD LYS 53 33.516 -10.616 0.325 393 HD3 LYS 53 3HD LYS 53 33.796 -9.690 1.786 394 HE2 LYS 53 2HE LYS 53 33.821 -12.080 2.337 395 HE3 LYS 53 3HE LYS 53 32.424 -11.336 3.089 396 HZ1 LYS 53 2HZ LYS 53 31.555 -13.225 2.050 397 HZ3 LYS 53 1HZ LYS 53 32.474 -13.085 0.713 398 H ASN 54 HN ASN 54 31.841 -5.061 -0.449 399 HA ASN 54 HA ASN 54 32.711 -4.658 2.278 400 HB2 ASN 54 2HB ASN 54 34.059 -4.145 0.020 401 HB3 ASN 54 3HB ASN 54 33.132 -2.658 0.033 402 HD21 ASN 54 1HD2 ASN 54 36.005 -3.826 0.759 403 HD22 ASN 54 2HD2 ASN 54 36.469 -2.881 2.135 404 H LYS 55 HN LYS 55 30.032 -4.092 0.246 405 HA LYS 55 HA LYS 55 29.399 -1.442 1.121 406 HB2 LYS 55 2HB LYS 55 28.767 -2.616 -1.097 407 HB3 LYS 55 3HB LYS 55 27.495 -3.391 -0.175 408 HG2 LYS 55 2HG LYS 55 26.484 -1.418 -1.062 409 HG3 LYS 55 3HG LYS 55 26.801 -1.037 0.618 410 HD2 LYS 55 2HD LYS 55 29.150 -0.179 -0.417 411 HD3 LYS 55 3HD LYS 55 28.168 -0.004 -1.858 412 HE2 LYS 55 2HE LYS 55 26.463 1.186 -0.170 413 HE3 LYS 55 3HE LYS 55 27.905 1.413 0.800 414 HZ1 LYS 55 2HZ LYS 55 28.926 2.359 -1.326 415 HZ3 LYS 55 1HZ LYS 55 27.795 3.286 -0.609 416 H GLY 56 HN GLY 56 29.958 -2.485 3.453 417 HA2 GLY 56 1HA GLY 56 28.003 -4.037 4.734 418 HA3 GLY 56 2HA GLY 56 29.180 -2.989 5.500 419 H ILE 57 HN ILE 57 25.907 -3.158 4.059 420 HA ILE 57 HA ILE 57 25.045 -1.094 5.860 421 HB ILE 57 HB ILE 57 24.113 0.353 4.141 422 HG12 ILE 57 2HG1 ILE 57 25.279 -0.019 1.780 423 HG13 ILE 57 3HG1 ILE 57 25.284 -1.693 2.297 424 HG21 ILE 57 1HG2 ILE 57 26.154 1.466 3.496 425 HG22 ILE 57 2HG2 ILE 57 26.329 0.820 5.146 426 HG23 ILE 57 3HG2 ILE 57 27.097 -0.018 3.776 427 HD11 ILE 57 3HD1 ILE 57 23.117 -1.840 1.665 428 HD12 ILE 57 1HD1 ILE 57 22.703 -0.703 2.971 429 HD13 ILE 57 2HD1 ILE 57 23.058 -0.091 1.338 430 H ILE 58 HN ILE 58 22.779 -1.175 6.227 431 HA ILE 58 HA ILE 58 21.646 -3.711 5.541 432 HB ILE 58 HB ILE 58 20.616 -1.351 7.116 433 HG12 ILE 58 2HG1 ILE 58 22.637 -2.826 7.889 434 HG13 ILE 58 3HG1 ILE 58 21.376 -2.380 9.021 435 HG21 ILE 58 1HG2 ILE 58 18.712 -2.516 6.218 436 HG22 ILE 58 2HG2 ILE 58 19.391 -4.090 6.698 437 HG23 ILE 58 3HG2 ILE 58 18.879 -2.925 7.942 438 HD11 ILE 58 3HD1 ILE 58 20.317 -4.536 8.862 439 HD12 ILE 58 1HD1 ILE 58 21.278 -4.975 7.430 440 HD13 ILE 58 2HD1 ILE 58 22.061 -4.852 9.023 441 H TRP 59 HN TRP 59 19.636 -4.048 4.388 442 HA TRP 59 HA TRP 59 19.326 -2.071 2.260 443 HB2 TRP 59 2HB TRP 59 18.695 -4.997 2.517 444 HB3 TRP 59 3HB TRP 59 17.923 -4.018 1.286 445 HD1 TRP 59 HD1 TRP 59 20.678 -6.278 1.417 446 HE1 TRP 59 HE1 TRP 59 22.609 -5.832 -0.325 447 HE3 TRP 59 HE3 TRP 59 19.309 -1.503 0.332 448 HZ2 TRP 59 HZ2 TRP 59 23.331 -3.582 -1.925 449 HZ3 TRP 59 HZ3 TRP 59 20.681 -0.251 -1.331 450 HH2 TRP 59 HH2 TRP 59 22.631 -1.216 -2.445 451 H GLY 60 HN GLY 60 18.101 -0.486 3.444 452 HA2 GLY 60 1HA GLY 60 15.496 -1.420 4.469 453 HA3 GLY 60 2HA GLY 60 16.331 0.044 4.948 454 H GLU 61 HN GLU 61 13.912 0.709 4.337 455 HA GLU 61 HA GLU 61 13.473 0.961 1.543 456 HB2 GLU 61 2HB GLU 61 11.997 2.264 3.874 457 HB3 GLU 61 3HB GLU 61 11.419 2.166 2.222 458 HG2 GLU 61 2HG GLU 61 11.827 -0.456 2.566 459 HG3 GLU 61 3HG GLU 61 11.706 -0.044 4.265 460 HE2 GLU 61 HE2 GLU 61 8.444 0.766 2.038 461 H ASP 62 HN ASP 62 15.329 2.658 3.874 462 HA ASP 62 HA ASP 62 14.969 5.213 2.625 463 HB2 ASP 62 2HB ASP 62 16.582 4.128 4.946 464 HB3 ASP 62 3HB ASP 62 17.026 5.679 4.263 465 HD2 ASP 62 HD2 ASP 62 13.596 6.762 5.209 466 H THR 63 HN THR 63 17.174 2.414 2.672 467 HA THR 63 HA THR 63 19.200 3.844 1.138 468 HB THR 63 HB THR 63 20.509 1.776 1.557 469 HG1 THR 63 HG1 THR 63 19.166 0.021 1.715 470 HG21 THR 63 1HG2 THR 63 19.062 3.131 3.812 471 HG22 THR 63 2HG2 THR 63 19.803 1.558 4.193 472 HG23 THR 63 3HG2 THR 63 20.809 2.890 3.575 473 H LEU 64 HN LEU 64 17.144 0.873 0.813 474 HA LEU 64 HA LEU 64 17.803 0.112 -1.670 475 HB2 LEU 64 2HB LEU 64 15.165 0.191 -0.242 476 HB3 LEU 64 3HB LEU 64 15.272 -0.434 -1.876 477 HG LEU 64 HG LEU 64 16.998 -1.490 0.370 478 HD11 LEU 64 1HD1 LEU 64 14.436 -2.799 -0.531 479 HD12 LEU 64 2HD1 LEU 64 15.426 -3.137 0.909 480 HD13 LEU 64 3HD1 LEU 64 14.477 -1.634 0.814 481 HD21 LEU 64 3HD2 LEU 64 17.964 -2.261 -1.559 482 HD22 LEU 64 1HD2 LEU 64 16.782 -3.556 -1.250 483 HD23 LEU 64 2HD2 LEU 64 16.427 -2.295 -2.455 484 H MET 65 HN MET 65 15.750 2.924 -0.772 485 HA MET 65 HA MET 65 14.811 3.545 -3.251 486 HB2 MET 65 2HB MET 65 14.565 4.627 -0.789 487 HB3 MET 65 3HB MET 65 15.786 5.733 -1.385 488 HG2 MET 65 2HG MET 65 13.899 6.881 -2.098 489 HG3 MET 65 3HG MET 65 14.139 5.870 -3.509 490 HE1 MET 65 3HE MET 65 11.622 3.487 -3.791 491 HE2 MET 65 1HE MET 65 11.185 5.142 -4.276 492 HE3 MET 65 2HE MET 65 12.867 4.582 -4.437 493 H GLU 66 HN GLU 66 17.642 5.207 -1.672 494 HA GLU 66 HA GLU 66 18.508 6.572 -3.803 495 HB2 GLU 66 2HB GLU 66 19.429 6.208 -1.290 496 HB3 GLU 66 3HB GLU 66 20.620 5.238 -2.134 497 HG2 GLU 66 2HG GLU 66 21.689 7.271 -2.339 498 HG3 GLU 66 3HG GLU 66 20.669 7.405 -3.758 499 HE2 GLU 66 HE2 GLU 66 20.673 10.313 -1.888 500 H TYR 67 HN TYR 67 19.764 3.283 -2.861 501 HA TYR 67 HA TYR 67 21.386 2.833 -4.996 502 HB2 TYR 67 2HB TYR 67 21.066 1.353 -3.001 503 HB3 TYR 67 3HB TYR 67 19.403 1.044 -3.460 504 HD1 TYR 67 HD1 TYR 67 22.938 0.377 -4.361 505 HD2 TYR 67 HD2 TYR 67 18.845 -0.657 -5.056 506 HE1 TYR 67 HE1 TYR 67 23.671 -1.685 -5.655 507 HE2 TYR 67 HE2 TYR 67 19.592 -2.716 -6.348 508 HH TYR 67 HH TYR 67 23.004 -3.272 -7.035 509 H LEU 68 HN LEU 68 17.807 2.422 -4.808 510 HA LEU 68 HA LEU 68 17.546 1.167 -7.300 511 HB2 LEU 68 2HB LEU 68 15.735 2.592 -5.399 512 HB3 LEU 68 3HB LEU 68 15.156 2.250 -7.017 513 HG LEU 68 HG LEU 68 16.233 0.150 -5.116 514 HD11 LEU 68 1HD1 LEU 68 14.065 -0.391 -4.459 515 HD12 LEU 68 2HD1 LEU 68 14.075 1.389 -4.437 516 HD13 LEU 68 3HD1 LEU 68 13.323 0.520 -5.796 517 HD21 LEU 68 3HD2 LEU 68 15.743 0.093 -7.912 518 HD22 LEU 68 1HD2 LEU 68 16.194 -1.249 -6.834 519 HD23 LEU 68 2HD2 LEU 68 14.478 -0.880 -7.125 520 H GLU 69 HN GLU 69 17.879 4.565 -6.285 521 HA GLU 69 HA GLU 69 17.035 5.610 -8.756 522 HB2 GLU 69 2HB GLU 69 16.953 6.954 -6.710 523 HB3 GLU 69 3HB GLU 69 18.686 6.810 -6.492 524 HG2 GLU 69 2HG GLU 69 19.145 8.141 -8.464 525 HG3 GLU 69 3HG GLU 69 17.478 8.052 -8.998 526 HE2 GLU 69 HE2 GLU 69 16.280 10.495 -7.177 527 H ASN 70 HN ASN 70 20.188 4.647 -7.333 528 HA ASN 70 HA ASN 70 21.264 4.437 -9.944 529 HB2 ASN 70 2HB ASN 70 22.261 6.598 -8.030 530 HB3 ASN 70 3HB ASN 70 23.299 5.942 -9.280 531 HD21 ASN 70 1HD2 ASN 70 21.672 8.537 -8.644 532 HD22 ASN 70 2HD2 ASN 70 21.002 8.990 -10.176 533 HA PRO 71 HA PRO 71 22.953 1.657 -6.776 534 HB2 PRO 71 2HB PRO 71 22.693 -0.668 -8.189 535 HB3 PRO 71 3HB PRO 71 21.466 -0.073 -7.089 536 HG2 PRO 71 2HG PRO 71 21.474 -0.049 -10.045 537 HG3 PRO 71 3HG PRO 71 20.119 0.138 -8.949 538 HD2 PRO 71 2HD PRO 71 21.444 2.220 -10.412 539 HD3 PRO 71 3HD PRO 71 20.166 2.420 -9.229 540 H LYS 72 HN LYS 72 23.674 1.968 -10.153 541 HA LYS 72 HA LYS 72 26.034 0.572 -10.249 542 HB2 LYS 72 2HB LYS 72 24.860 1.534 -12.189 543 HB3 LYS 72 3HB LYS 72 25.307 3.148 -11.676 544 HG2 LYS 72 2HG LYS 72 27.664 2.713 -12.012 545 HG3 LYS 72 3HG LYS 72 27.398 0.987 -12.168 546 HD2 LYS 72 2HD LYS 72 26.046 2.894 -14.101 547 HD3 LYS 72 3HD LYS 72 27.729 2.468 -14.338 548 HE2 LYS 72 2HE LYS 72 27.089 0.028 -14.304 549 HE3 LYS 72 3HE LYS 72 25.407 0.489 -14.139 550 HZ1 LYS 72 2HZ LYS 72 25.741 1.790 -16.273 551 HZ3 LYS 72 1HZ LYS 72 25.799 0.171 -16.446 552 H LYS 73 HN LYS 73 25.534 4.061 -9.373 553 HA LYS 73 HA LYS 73 28.256 4.444 -8.729 554 HB2 LYS 73 2HB LYS 73 27.657 6.613 -8.263 555 HB3 LYS 73 3HB LYS 73 26.374 6.143 -9.360 556 HG2 LYS 73 2HG LYS 73 24.979 5.503 -7.308 557 HG3 LYS 73 3HG LYS 73 26.231 6.218 -6.312 558 HD2 LYS 73 2HD LYS 73 24.751 7.717 -8.525 559 HD3 LYS 73 3HD LYS 73 24.301 7.780 -6.832 560 HE2 LYS 73 2HE LYS 73 25.674 9.667 -6.974 561 HE3 LYS 73 3HE LYS 73 26.843 8.466 -6.462 562 HZ1 LYS 73 2HZ LYS 73 27.941 9.167 -8.304 563 HZ3 LYS 73 1HZ LYS 73 26.622 9.792 -9.025 564 H TYR 74 HN TYR 74 25.333 3.469 -6.892 565 HA TYR 74 HA TYR 74 26.283 3.755 -4.332 566 HB2 TYR 74 2HB TYR 74 24.032 2.849 -5.556 567 HB3 TYR 74 3HB TYR 74 24.773 1.282 -5.296 568 HD1 TYR 74 HD1 TYR 74 25.412 0.638 -2.883 569 HD2 TYR 74 HD2 TYR 74 22.826 3.912 -3.829 570 HE1 TYR 74 HE1 TYR 74 24.487 0.600 -0.516 571 HE2 TYR 74 HE2 TYR 74 21.910 3.864 -1.458 572 HH TYR 74 HH TYR 74 22.873 3.072 0.826 573 H ILE 75 HN ILE 75 27.072 1.294 -6.792 574 HA ILE 75 HA ILE 75 29.193 0.362 -5.052 575 HB ILE 75 HB ILE 75 27.359 -1.664 -6.299 576 HG12 ILE 75 2HG1 ILE 75 27.136 -0.457 -3.528 577 HG13 ILE 75 3HG1 ILE 75 25.946 -0.370 -4.812 578 HG21 ILE 75 1HG2 ILE 75 29.709 -2.259 -5.636 579 HG22 ILE 75 2HG2 ILE 75 29.252 -1.908 -3.952 580 HG23 ILE 75 3HG2 ILE 75 28.432 -3.213 -4.843 581 HD11 ILE 75 3HD1 ILE 75 26.828 -2.824 -3.246 582 HD12 ILE 75 1HD1 ILE 75 25.192 -2.135 -3.391 583 HD13 ILE 75 2HD1 ILE 75 25.937 -2.960 -4.782 584 HA PRO 76 HA PRO 76 30.554 0.863 -9.264 585 HB2 PRO 76 2HB PRO 76 33.004 1.921 -8.674 586 HB3 PRO 76 3HB PRO 76 31.577 2.901 -8.947 587 HG2 PRO 76 2HG PRO 76 32.921 2.255 -6.395 588 HG3 PRO 76 3HG PRO 76 31.784 3.543 -6.741 589 HD2 PRO 76 2HD PRO 76 31.233 1.094 -5.353 590 HD3 PRO 76 3HD PRO 76 30.073 2.328 -5.802 591 H GLY 77 HN GLY 77 31.743 -0.431 -10.633 592 HA2 GLY 77 1HA GLY 77 33.156 -2.115 -11.165 593 HA3 GLY 77 2HA GLY 77 33.856 -2.033 -9.561 594 H THR 78 HN THR 78 30.344 -2.339 -9.879 595 HA THR 78 HA THR 78 30.491 -4.925 -8.579 596 HB THR 78 HB THR 78 28.943 -2.894 -7.998 597 HG1 THR 78 HG1 THR 78 28.721 -5.143 -7.233 598 HG21 THR 78 1HG2 THR 78 26.970 -4.172 -9.859 599 HG22 THR 78 2HG2 THR 78 27.069 -2.483 -9.304 600 HG23 THR 78 3HG2 THR 78 28.130 -3.053 -10.615 601 H LYS 79 HN LYS 79 28.498 -6.440 -9.397 602 HA LYS 79 HA LYS 79 29.223 -6.968 -12.182 603 HB2 LYS 79 2HB LYS 79 27.792 -8.948 -10.445 604 HB3 LYS 79 3HB LYS 79 28.906 -9.222 -11.769 605 HG2 LYS 79 2HG LYS 79 30.617 -7.945 -10.122 606 HG3 LYS 79 3HG LYS 79 29.502 -8.520 -8.898 607 HD2 LYS 79 2HD LYS 79 30.549 -10.429 -11.013 608 HD3 LYS 79 3HD LYS 79 31.537 -10.041 -9.619 609 HE2 LYS 79 2HE LYS 79 30.369 -11.936 -8.860 610 HE3 LYS 79 3HE LYS 79 29.389 -10.635 -8.212 611 HZ1 LYS 79 2HZ LYS 79 28.398 -12.597 -9.738 612 HZ3 LYS 79 1HZ LYS 79 28.667 -11.482 -10.895 613 H MET 80 HN MET 80 26.588 -6.105 -9.988 614 HA MET 80 HA MET 80 24.486 -6.853 -11.639 615 HB2 MET 80 2HB MET 80 24.227 -6.250 -9.240 616 HB3 MET 80 3HB MET 80 24.772 -4.615 -9.558 617 HG2 MET 80 2HG MET 80 22.758 -3.981 -10.563 618 HG3 MET 80 3HG MET 80 22.414 -5.595 -11.153 619 HE1 MET 80 3HE MET 80 19.968 -4.292 -10.061 620 HE2 MET 80 1HE MET 80 19.802 -4.091 -8.300 621 HE3 MET 80 2HE MET 80 20.979 -3.106 -9.201 622 H ILE 81 HN ILE 81 23.473 -5.885 -13.388 623 HA ILE 81 HA ILE 81 24.631 -3.324 -14.243 624 HB ILE 81 HB ILE 81 23.827 -5.791 -15.719 625 HG12 ILE 81 2HG1 ILE 81 26.156 -3.859 -15.916 626 HG13 ILE 81 3HG1 ILE 81 26.177 -5.447 -15.176 627 HG21 ILE 81 1HG2 ILE 81 22.418 -4.156 -16.770 628 HG22 ILE 81 2HG2 ILE 81 23.758 -2.989 -16.866 629 HG23 ILE 81 3HG2 ILE 81 23.805 -4.479 -17.837 630 HD11 ILE 81 3HD1 ILE 81 25.366 -6.329 -17.501 631 HD12 ILE 81 1HD1 ILE 81 25.891 -4.743 -18.114 632 HD13 ILE 81 2HD1 ILE 81 27.067 -5.831 -17.338 633 H PHE 82 HN PHE 82 23.292 -1.591 -14.409 634 HA PHE 82 HA PHE 82 20.524 -1.935 -14.970 635 HB2 PHE 82 2HB PHE 82 20.918 -2.454 -12.427 636 HB3 PHE 82 3HB PHE 82 21.379 -0.772 -12.258 637 HD1 PHE 82 HD2 PHE 82 18.598 -2.425 -14.129 638 HD2 PHE 82 HD1 PHE 82 19.719 0.348 -11.120 639 HE1 PHE 82 HE2 PHE 82 16.189 -1.796 -13.812 640 HE2 PHE 82 HE1 PHE 82 17.310 0.978 -10.802 641 HZ PHE 82 HZ PHE 82 15.574 -0.102 -12.152 642 H VAL 83 HN VAL 83 19.416 0.160 -15.254 643 HA VAL 83 HA VAL 83 21.375 2.239 -15.868 644 HB VAL 83 HB VAL 83 19.577 3.169 -17.255 645 HG11 VAL 83 1HG1 VAL 83 20.096 1.827 -19.003 646 HG12 VAL 83 2HG1 VAL 83 21.186 1.059 -17.825 647 HG13 VAL 83 3HG1 VAL 83 19.590 0.345 -18.157 648 HG21 VAL 83 3HG2 VAL 83 17.697 2.269 -15.830 649 HG22 VAL 83 1HG2 VAL 83 17.478 2.070 -17.585 650 HG23 VAL 83 2HG2 VAL 83 17.975 0.682 -16.588 651 H GLY 84 HN GLY 84 18.473 1.478 -13.924 652 HA2 GLY 84 1HA GLY 84 18.422 2.598 -11.755 653 HA3 GLY 84 2HA GLY 84 18.810 4.094 -12.581 654 H ILE 85 HN ILE 85 16.622 4.327 -11.092 655 HA ILE 85 HA ILE 85 14.437 4.128 -13.041 656 HB ILE 85 HB ILE 85 14.178 3.706 -10.063 657 HG12 ILE 85 2HG1 ILE 85 13.886 1.556 -12.159 658 HG13 ILE 85 3HG1 ILE 85 15.440 1.905 -11.429 659 HG21 ILE 85 1HG2 ILE 85 12.052 4.240 -10.483 660 HG22 ILE 85 2HG2 ILE 85 12.275 4.136 -12.246 661 HG23 ILE 85 3HG2 ILE 85 11.950 2.662 -11.301 662 HD11 ILE 85 3HD1 ILE 85 13.934 0.082 -10.319 663 HD12 ILE 85 1HD1 ILE 85 14.716 1.279 -9.259 664 HD13 ILE 85 2HD1 ILE 85 12.997 1.456 -9.685 665 H LYS 86 HN LYS 86 13.065 5.931 -13.172 666 HA LYS 86 HA LYS 86 14.205 8.314 -11.967 667 HB2 LYS 86 2HB LYS 86 13.808 8.303 -14.378 668 HB3 LYS 86 3HB LYS 86 12.112 7.939 -14.129 669 HG2 LYS 86 2HG LYS 86 12.047 10.108 -12.674 670 HG3 LYS 86 3HG LYS 86 13.602 10.487 -13.388 671 HD2 LYS 86 2HD LYS 86 11.354 9.695 -15.240 672 HD3 LYS 86 3HD LYS 86 11.299 11.292 -14.519 673 HE2 LYS 86 2HE LYS 86 13.752 11.574 -15.332 674 HE3 LYS 86 3HE LYS 86 13.490 10.130 -16.289 675 HZ1 LYS 86 2HZ LYS 86 11.418 11.396 -17.136 676 HZ3 LYS 86 1HZ LYS 86 12.869 11.859 -17.713 677 H LYS 87 HN LYS 87 10.827 7.090 -12.535 678 HA LYS 87 HA LYS 87 9.637 8.676 -10.637 679 HB2 LYS 87 2HB LYS 87 8.916 5.987 -11.805 680 HB3 LYS 87 3HB LYS 87 7.884 6.781 -10.632 681 HG2 LYS 87 2HG LYS 87 8.864 8.242 -13.116 682 HG3 LYS 87 3HG LYS 87 7.432 7.233 -13.161 683 HD2 LYS 87 2HD LYS 87 6.423 8.581 -11.309 684 HD3 LYS 87 3HD LYS 87 7.857 9.587 -11.258 685 HE2 LYS 87 2HE LYS 87 6.270 9.242 -13.833 686 HE3 LYS 87 3HE LYS 87 5.811 10.440 -12.639 687 HZ1 LYS 87 2HZ LYS 87 7.812 11.597 -12.954 688 HZ3 LYS 87 1HZ LYS 87 7.455 11.133 -14.474 689 H LYS 88 HN LYS 88 9.416 8.658 -8.433 690 HA LYS 88 HA LYS 88 11.128 6.815 -7.023 691 HB2 LYS 88 2HB LYS 88 10.902 8.265 -5.182 692 HB3 LYS 88 3HB LYS 88 10.997 9.308 -6.587 693 HG2 LYS 88 2HG LYS 88 8.473 9.435 -6.620 694 HG3 LYS 88 3HG LYS 88 8.429 8.469 -5.159 695 HD2 LYS 88 2HD LYS 88 8.253 10.885 -4.626 696 HD3 LYS 88 3HD LYS 88 9.708 10.197 -3.932 697 HE2 LYS 88 2HE LYS 88 11.105 11.154 -5.666 698 HE3 LYS 88 3HE LYS 88 9.719 11.573 -6.652 699 HZ1 LYS 88 2HZ LYS 88 9.158 12.892 -4.383 700 HZ3 LYS 88 1HZ LYS 88 9.972 13.568 -5.620 701 H GLU 89 HN GLU 89 7.750 7.180 -7.879 702 HA GLU 89 HA GLU 89 6.736 5.701 -5.716 703 HB2 GLU 89 2HB GLU 89 5.660 6.519 -8.429 704 HB3 GLU 89 3HB GLU 89 4.737 5.442 -7.401 705 HG2 GLU 89 2HG GLU 89 3.985 7.682 -6.905 706 HG3 GLU 89 3HG GLU 89 4.939 7.159 -5.531 707 HE2 GLU 89 HE2 GLU 89 5.668 10.427 -6.263 708 H GLU 90 HN GLU 90 7.618 4.896 -9.136 709 HA GLU 90 HA GLU 90 6.794 2.282 -9.077 710 HB2 GLU 90 2HB GLU 90 8.801 3.856 -10.668 711 HB3 GLU 90 3HB GLU 90 8.855 2.110 -10.809 712 HG2 GLU 90 2HG GLU 90 7.343 2.739 -12.518 713 HG3 GLU 90 3HG GLU 90 6.283 2.236 -11.216 714 HE2 GLU 90 HE2 GLU 90 5.905 4.881 -13.265 715 H ARG 91 HN ARG 91 9.544 3.846 -7.548 716 HA ARG 91 HA ARG 91 11.005 1.425 -7.268 717 HB2 ARG 91 2HB ARG 91 11.310 4.241 -6.141 718 HB3 ARG 91 3HB ARG 91 12.362 2.941 -5.617 719 HG2 ARG 91 2HG ARG 91 13.058 2.534 -7.976 720 HG3 ARG 91 3HG ARG 91 11.978 3.800 -8.525 721 HD2 ARG 91 2HD ARG 91 14.011 4.492 -6.399 722 HD3 ARG 91 3HD ARG 91 14.575 4.293 -8.046 723 HE ARG 91 HE ARG 91 12.455 5.948 -8.445 724 HH11 ARG 91 2HH2 ARG 91 15.066 6.100 -6.055 725 HH12 ARG 91 1HH2 ARG 91 15.024 7.828 -5.937 726 HH22 ARG 91 HH1 ARG 91 13.449 9.057 -7.259 727 H ALA 92 HN ALA 92 8.762 3.452 -5.335 728 HA ALA 92 HA ALA 92 9.197 2.269 -2.851 729 HB1 ALA 92 3HB ALA 92 7.999 4.285 -2.858 730 HB2 ALA 92 1HB ALA 92 6.920 3.755 -4.170 731 HB3 ALA 92 2HB ALA 92 6.731 3.079 -2.534 732 H ASP 93 HN ASP 93 6.580 1.606 -5.294 733 HA ASP 93 HA ASP 93 5.473 -0.501 -3.995 734 HB2 ASP 93 2HB ASP 93 5.845 -0.023 -6.986 735 HB3 ASP 93 3HB ASP 93 4.804 -1.279 -6.346 736 HD2 ASP 93 HD2 ASP 93 4.875 1.789 -7.364 737 H LEU 94 HN LEU 94 8.427 -0.272 -5.997 738 HA LEU 94 HA LEU 94 8.778 -3.017 -6.463 739 HB2 LEU 94 2HB LEU 94 9.849 -1.252 -7.759 740 HB3 LEU 94 3HB LEU 94 10.770 -0.748 -6.356 741 HG LEU 94 HG LEU 94 11.869 -2.240 -8.190 742 HD11 LEU 94 1HD1 LEU 94 13.527 -2.770 -6.705 743 HD12 LEU 94 2HD1 LEU 94 12.635 -1.554 -5.759 744 HD13 LEU 94 3HD1 LEU 94 12.389 -3.287 -5.438 745 HD21 LEU 94 3HD2 LEU 94 10.318 -4.289 -6.594 746 HD22 LEU 94 1HD2 LEU 94 10.285 -4.007 -8.351 747 HD23 LEU 94 2HD2 LEU 94 11.744 -4.681 -7.585 748 H ILE 95 HN ILE 95 9.815 -0.800 -3.819 749 HA ILE 95 HA ILE 95 11.184 -2.957 -2.486 750 HB ILE 95 HB ILE 95 10.613 -0.132 -1.585 751 HG12 ILE 95 2HG1 ILE 95 13.215 -1.125 -2.744 752 HG13 ILE 95 3HG1 ILE 95 11.946 -0.494 -3.775 753 HG21 ILE 95 1HG2 ILE 95 12.718 -0.651 -0.182 754 HG22 ILE 95 2HG2 ILE 95 11.150 -1.304 0.351 755 HG23 ILE 95 3HG2 ILE 95 12.315 -2.358 -0.487 756 HD11 ILE 95 3HD1 ILE 95 13.872 0.997 -2.318 757 HD12 ILE 95 1HD1 ILE 95 12.484 1.637 -3.231 758 HD13 ILE 95 2HD1 ILE 95 12.319 1.280 -1.495 759 H ALA 96 HN ALA 96 7.962 -1.771 -2.779 760 HA ALA 96 HA ALA 96 7.130 -2.466 -0.130 761 HB1 ALA 96 3HB ALA 96 5.189 -1.455 -0.751 762 HB2 ALA 96 1HB ALA 96 6.154 -0.863 -2.124 763 HB3 ALA 96 2HB ALA 96 5.127 -2.305 -2.313 764 H TYR 97 HN TYR 97 7.667 -4.109 -3.193 765 HA TYR 97 HA TYR 97 6.065 -6.389 -2.329 766 HB2 TYR 97 2HB TYR 97 5.817 -5.756 -4.663 767 HB3 TYR 97 3HB TYR 97 7.522 -5.384 -4.824 768 HD1 TYR 97 HD2 TYR 97 5.799 -8.471 -3.563 769 HD2 TYR 97 HD1 TYR 97 8.371 -6.743 -6.513 770 HE1 TYR 97 HE2 TYR 97 6.212 -10.772 -4.561 771 HE2 TYR 97 HE1 TYR 97 8.775 -9.051 -7.501 772 HH TYR 97 HH TYR 97 7.977 -11.145 -7.562 773 H LEU 98 HN LEU 98 9.452 -5.524 -3.292 774 HA LEU 98 HA LEU 98 10.564 -8.020 -2.981 775 HB2 LEU 98 2HB LEU 98 11.609 -5.221 -2.731 776 HB3 LEU 98 3HB LEU 98 12.649 -6.584 -2.369 777 HG LEU 98 HG LEU 98 11.265 -6.038 -5.009 778 HD11 LEU 98 1HD1 LEU 98 13.303 -5.351 -5.873 779 HD12 LEU 98 2HD1 LEU 98 13.313 -4.643 -4.240 780 HD13 LEU 98 3HD1 LEU 98 14.238 -6.127 -4.572 781 HD21 LEU 98 3HD2 LEU 98 11.482 -8.194 -5.481 782 HD22 LEU 98 1HD2 LEU 98 13.247 -8.017 -5.323 783 HD23 LEU 98 2HD2 LEU 98 12.272 -8.504 -3.916 784 H LYS 99 HN LYS 99 9.431 -5.697 -0.567 785 HA LYS 99 HA LYS 99 10.869 -6.856 1.593 786 HB2 LYS 99 2HB LYS 99 10.060 -4.503 1.524 787 HB3 LYS 99 3HB LYS 99 8.409 -5.082 1.620 788 HG2 LYS 99 2HG LYS 99 8.953 -6.228 3.791 789 HG3 LYS 99 3HG LYS 99 10.588 -5.603 3.699 790 HD2 LYS 99 2HD LYS 99 9.764 -3.283 3.794 791 HD3 LYS 99 3HD LYS 99 8.101 -3.830 3.710 792 HE2 LYS 99 2HE LYS 99 8.628 -5.190 5.877 793 HE3 LYS 99 3HE LYS 99 10.077 -4.212 5.994 794 HZ1 LYS 99 2HZ LYS 99 7.742 -3.441 7.009 795 HZ3 LYS 99 1HZ LYS 99 7.603 -2.741 5.545 796 H LYS 100 HN LYS 100 7.553 -7.205 0.214 797 HA LYS 100 HA LYS 100 6.834 -9.128 2.212 798 HB2 LYS 100 2HB LYS 100 5.260 -7.494 1.100 799 HB3 LYS 100 3HB LYS 100 5.398 -8.443 -0.366 800 HG2 LYS 100 2HG LYS 100 4.769 -10.488 1.181 801 HG3 LYS 100 3HG LYS 100 4.210 -9.265 2.304 802 HD2 LYS 100 2HD LYS 100 3.317 -9.238 -0.603 803 HD3 LYS 100 3HD LYS 100 2.501 -10.243 0.578 804 HE2 LYS 100 2HE LYS 100 2.951 -7.280 1.101 805 HE3 LYS 100 3HE LYS 100 1.581 -7.827 0.155 806 HZ1 LYS 100 2HZ LYS 100 1.070 -9.336 2.116 807 HZ3 LYS 100 1HZ LYS 100 0.852 -7.747 2.396 808 H ALA 101 HN ALA 101 8.699 -9.132 -0.678 809 HA ALA 101 HA ALA 101 8.056 -11.868 -1.355 810 HB1 ALA 101 3HB ALA 101 8.708 -9.825 -2.907 811 HB2 ALA 101 1HB ALA 101 10.369 -10.316 -2.498 812 HB3 ALA 101 2HB ALA 101 9.271 -11.468 -3.295 813 H THR 102 HN THR 102 10.630 -9.947 0.255 814 HA THR 102 HA THR 102 12.311 -12.265 0.583 815 HB THR 102 HB THR 102 13.720 -10.583 1.822 816 HG1 THR 102 HG1 THR 102 12.547 -8.872 2.589 817 HG21 THR 102 1HG2 THR 102 13.365 -8.682 -0.152 818 HG22 THR 102 2HG2 THR 102 14.345 -10.152 -0.363 819 HG23 THR 102 3HG2 THR 102 12.659 -10.118 -0.932 820 H ASN 103 HN ASN 103 10.252 -10.190 2.715 821 HA ASN 103 HA ASN 103 10.786 -11.322 5.073 822 HB2 ASN 103 2HB ASN 103 9.157 -9.455 4.708 823 HB3 ASN 103 3HB ASN 103 8.017 -10.576 3.991 824 HD21 ASN 103 1HD2 ASN 103 9.712 -9.655 6.921 825 HD22 ASN 103 2HD2 ASN 103 8.641 -10.393 8.064 826 H GLU 104 HN GLU 104 8.235 -12.390 2.691 827 HA GLU 104 HA GLU 104 7.296 -14.532 4.058 828 HB2 GLU 104 2HB GLU 104 6.577 -15.410 1.845 829 HB3 GLU 104 3HB GLU 104 6.264 -13.693 2.000 830 HG2 GLU 104 2HG GLU 104 8.155 -13.113 0.619 831 HG3 GLU 104 3HG GLU 104 8.829 -14.727 0.727 832 HE2 GLU 104 HE2 GLU 104 7.867 -15.799 -1.818 833 HHA HEC 500 HHA HEC 500 23.792 -7.277 -4.957 834 HHB HEC 500 HHB HEC 500 17.770 -5.131 -5.190 835 HHC HEC 500 HHC HEC 500 17.965 -6.101 -11.562 836 HHD HEC 500 HHD HEC 500 23.204 -9.695 -10.801 837 HMA1 HEC 500 1HMA HEC 500 18.490 -5.205 -2.983 838 HMA2 HEC 500 2HMA HEC 500 19.976 -5.269 -2.029 839 HMA3 HEC 500 3HMA HEC 500 19.680 -3.881 -3.092 840 HAA1 HEC 500 1HAA HEC 500 23.508 -6.304 -3.228 841 HAA2 HEC 500 2HAA HEC 500 22.422 -5.319 -2.386 842 HBA1 HEC 500 1HBA HEC 500 21.360 -7.117 -1.287 843 HBA2 HEC 500 2HBA HEC 500 21.759 -8.244 -2.598 844 HMB1 HEC 500 1HMB HEC 500 14.703 -5.260 -7.403 845 HMB2 HEC 500 2HMB HEC 500 15.660 -5.260 -5.937 846 HMB3 HEC 500 3HMB HEC 500 15.577 -3.776 -6.911 847 HAB HEC 500 HAB HEC 500 16.361 -4.732 -11.080 848 HBB1 HEC 500 1HBB HEC 500 14.361 -3.823 -9.059 849 HBB2 HEC 500 2HBB HEC 500 15.858 -2.955 -9.490 850 HBB3 HEC 500 3HBB HEC 500 14.628 -3.238 -10.705 851 HMC1 HEC 500 1HMC HEC 500 18.297 -8.753 -13.456 852 HMC2 HEC 500 2HMC HEC 500 18.389 -6.987 -13.508 853 HMC3 HEC 500 3HMC HEC 500 19.584 -7.937 -14.366 854 HAC HEC 500 HAC HEC 500 22.182 -10.478 -12.464 855 HBC1 HEC 500 1HBC HEC 500 22.701 -8.702 -14.128 856 HBC2 HEC 500 2HBC HEC 500 22.376 -10.306 -14.824 857 HBC3 HEC 500 3HBC HEC 500 21.141 -9.053 -14.915 858 HMD1 HEC 500 1HMD HEC 500 24.989 -11.181 -8.949 859 HMD2 HEC 500 2HMD HEC 500 25.416 -9.891 -10.085 860 HMD3 HEC 500 3HMD HEC 500 26.273 -10.065 -8.527 861 HAD1 HEC 500 1HAD HEC 500 25.485 -8.894 -5.215 862 HAD2 HEC 500 2HAD HEC 500 26.288 -9.545 -6.579 863 HBD1 HEC 500 1HBD HEC 500 26.084 -6.679 -5.654 864 HBD2 HEC 500 2HBD HEC 500 27.520 -7.601 -6.154 Start of MODEL 2 1 H1 GLY 1 HN GLY 1 0.478 0.017 -0.769 2 HA2 GLY 1 1HA GLY 1 2.748 1.024 -2.047 3 HA3 GLY 1 2HA GLY 1 3.294 -0.097 -0.814 4 H ASP 2 HN ASP 2 1.164 0.253 -3.694 5 HA ASP 2 HA ASP 2 0.243 -2.271 -3.910 6 HB2 ASP 2 2HB ASP 2 1.188 -0.299 -6.029 7 HB3 ASP 2 3HB ASP 2 0.445 -1.822 -6.472 8 HD2 ASP 2 HD2 ASP 2 -1.705 -1.749 -4.500 9 H VAL 3 HN VAL 3 1.323 -4.244 -4.044 10 HA VAL 3 HA VAL 3 4.142 -4.263 -4.563 11 HB VAL 3 HB VAL 3 4.106 -6.396 -3.730 12 HG11 VAL 3 1HG1 VAL 3 2.864 -6.353 -1.747 13 HG12 VAL 3 2HG1 VAL 3 2.995 -4.633 -2.187 14 HG13 VAL 3 3HG1 VAL 3 1.487 -5.522 -2.510 15 HG21 VAL 3 3HG2 VAL 3 1.341 -6.628 -4.922 16 HG22 VAL 3 1HG2 VAL 3 2.798 -7.592 -5.265 17 HG23 VAL 3 2HG2 VAL 3 1.937 -7.797 -3.720 18 H GLU 4 HN GLU 4 1.103 -5.189 -6.239 19 HA GLU 4 HA GLU 4 2.108 -6.669 -8.257 20 HB2 GLU 4 2HB GLU 4 -0.143 -4.624 -8.236 21 HB3 GLU 4 3HB GLU 4 0.180 -5.629 -9.634 22 HG2 GLU 4 2HG GLU 4 -0.224 -6.816 -6.857 23 HG3 GLU 4 3HG GLU 4 -1.570 -6.501 -7.934 24 HE2 GLU 4 HE2 GLU 4 0.803 -9.296 -7.676 25 H LYS 5 HN LYS 5 1.682 -3.053 -8.277 26 HA LYS 5 HA LYS 5 2.750 -2.542 -10.732 27 HB2 LYS 5 2HB LYS 5 2.541 -1.019 -8.167 28 HB3 LYS 5 3HB LYS 5 3.550 -0.353 -9.434 29 HG2 LYS 5 2HG LYS 5 1.162 0.439 -9.552 30 HG3 LYS 5 3HG LYS 5 1.700 -0.350 -11.022 31 HD2 LYS 5 2HD LYS 5 0.603 -2.465 -10.320 32 HD3 LYS 5 3HD LYS 5 0.124 -1.736 -8.801 33 HE2 LYS 5 2HE LYS 5 -1.730 -1.745 -10.495 34 HE3 LYS 5 3HE LYS 5 -1.328 -0.130 -9.946 35 HZ1 LYS 5 2HZ LYS 5 -0.152 0.290 -11.955 36 HZ3 LYS 5 1HZ LYS 5 -1.531 -0.431 -12.436 37 H GLY 6 HN GLY 6 4.346 -3.732 -7.842 38 HA2 GLY 6 1HA GLY 6 6.996 -3.081 -8.913 39 HA3 GLY 6 2HA GLY 6 6.618 -3.697 -7.317 40 H LYS 7 HN LYS 7 4.664 -5.730 -8.574 41 HA LYS 7 HA LYS 7 6.493 -7.851 -8.719 42 HB2 LYS 7 2HB LYS 7 4.227 -8.147 -7.908 43 HB3 LYS 7 3HB LYS 7 3.558 -7.662 -9.453 44 HG2 LYS 7 2HG LYS 7 3.495 -9.996 -9.648 45 HG3 LYS 7 3HG LYS 7 5.020 -9.634 -10.433 46 HD2 LYS 7 2HD LYS 7 6.304 -10.326 -8.544 47 HD3 LYS 7 3HD LYS 7 4.941 -10.197 -7.451 48 HE2 LYS 7 2HE LYS 7 4.748 -12.149 -9.750 49 HE3 LYS 7 3HE LYS 7 5.754 -12.577 -8.380 50 HZ1 LYS 7 2HZ LYS 7 3.889 -13.112 -7.277 51 HZ3 LYS 7 1HZ LYS 7 2.952 -12.668 -8.532 52 H LYS 8 HN LYS 8 4.884 -5.797 -11.175 53 HA LYS 8 HA LYS 8 5.835 -7.413 -13.338 54 HB2 LYS 8 2HB LYS 8 4.367 -4.789 -13.113 55 HB3 LYS 8 3HB LYS 8 5.000 -5.339 -14.651 56 HG2 LYS 8 2HG LYS 8 2.559 -6.003 -14.047 57 HG3 LYS 8 3HG LYS 8 3.599 -7.251 -14.702 58 HD2 LYS 8 2HD LYS 8 4.064 -8.123 -12.446 59 HD3 LYS 8 3HD LYS 8 3.185 -6.797 -11.711 60 HE2 LYS 8 2HE LYS 8 1.558 -8.489 -11.694 61 HE3 LYS 8 3HE LYS 8 1.155 -7.645 -13.176 62 HZ1 LYS 8 2HZ LYS 8 2.740 -10.145 -12.963 63 HZ3 LYS 8 1HZ LYS 8 2.590 -9.313 -14.353 64 H ILE 9 HN ILE 9 6.636 -4.147 -11.971 65 HA ILE 9 HA ILE 9 8.765 -3.670 -13.705 66 HB ILE 9 HB ILE 9 8.185 -2.651 -10.923 67 HG12 ILE 9 2HG1 ILE 9 7.742 -1.177 -13.514 68 HG13 ILE 9 3HG1 ILE 9 6.536 -2.292 -12.903 69 HG21 ILE 9 1HG2 ILE 9 10.020 -1.375 -12.956 70 HG22 ILE 9 2HG2 ILE 9 9.778 -0.936 -11.249 71 HG23 ILE 9 3HG2 ILE 9 10.601 -2.457 -11.667 72 HD11 ILE 9 3HD1 ILE 9 5.792 -0.422 -11.791 73 HD12 ILE 9 1HD1 ILE 9 7.040 -0.895 -10.614 74 HD13 ILE 9 2HD1 ILE 9 7.390 0.360 -11.826 75 H PHE 10 HN PHE 10 8.419 -5.768 -10.906 76 HA PHE 10 HA PHE 10 11.132 -5.901 -10.200 77 HB2 PHE 10 2HB PHE 10 9.514 -6.752 -8.645 78 HB3 PHE 10 3HB PHE 10 8.589 -7.547 -9.904 79 HD1 PHE 10 HD1 PHE 10 11.958 -7.738 -8.302 80 HD2 PHE 10 HD2 PHE 10 8.726 -9.845 -10.070 81 HE1 PHE 10 HE1 PHE 10 13.073 -9.918 -7.745 82 HE2 PHE 10 HE2 PHE 10 9.841 -12.023 -9.514 83 HZ PHE 10 HZ PHE 10 12.001 -12.033 -8.357 84 H ILE 11 HN ILE 11 9.173 -7.457 -12.732 85 HA ILE 11 HA ILE 11 11.193 -9.436 -13.268 86 HB ILE 11 HB ILE 11 8.613 -8.688 -14.644 87 HG12 ILE 11 2HG1 ILE 11 9.283 -11.136 -12.989 88 HG13 ILE 11 3HG1 ILE 11 8.510 -9.707 -12.334 89 HG21 ILE 11 1HG2 ILE 11 10.387 -11.076 -15.215 90 HG22 ILE 11 2HG2 ILE 11 8.860 -10.642 -16.021 91 HG23 ILE 11 3HG2 ILE 11 10.298 -9.613 -16.226 92 HD11 ILE 11 3HD1 ILE 11 6.686 -11.107 -12.897 93 HD12 ILE 11 1HD1 ILE 11 6.782 -9.991 -14.281 94 HD13 ILE 11 2HD1 ILE 11 7.444 -11.638 -14.418 95 H MET 12 HN MET 12 9.646 -6.920 -15.386 96 HA MET 12 HA MET 12 11.395 -6.885 -17.362 97 HB2 MET 12 2HB MET 12 9.926 -4.643 -15.917 98 HB3 MET 12 3HB MET 12 10.955 -4.243 -17.278 99 HG2 MET 12 2HG MET 12 8.656 -6.258 -17.360 100 HG3 MET 12 3HG MET 12 8.571 -4.616 -17.964 101 HE1 MET 12 3HE MET 12 8.336 -7.319 -20.491 102 HE2 MET 12 1HE MET 12 9.659 -8.305 -19.821 103 HE3 MET 12 2HE MET 12 8.383 -7.681 -18.748 104 H LYS 13 HN LYS 13 11.979 -5.664 -14.074 105 HA LYS 13 HA LYS 13 14.549 -4.574 -14.931 106 HB2 LYS 13 2HB LYS 13 13.185 -4.351 -12.233 107 HB3 LYS 13 3HB LYS 13 14.605 -3.478 -12.772 108 HG2 LYS 13 2HG LYS 13 12.052 -3.292 -14.392 109 HG3 LYS 13 3HG LYS 13 12.204 -2.349 -12.923 110 HD2 LYS 13 2HD LYS 13 13.076 -0.844 -14.484 111 HD3 LYS 13 3HD LYS 13 14.546 -1.628 -13.943 112 HE2 LYS 13 2HE LYS 13 14.805 -2.842 -15.926 113 HE3 LYS 13 3HE LYS 13 13.084 -2.902 -16.246 114 HZ1 LYS 13 2HZ LYS 13 14.214 -0.233 -16.291 115 HZ3 LYS 13 1HZ LYS 13 13.166 -0.921 -17.330 116 H CYS 14 HN CYS 14 13.009 -7.085 -12.884 117 HA CYS 14 HA CYS 14 15.639 -8.350 -12.741 118 HB2 CYS 14 2HB CYS 14 13.811 -8.693 -10.421 119 HB3 CYS 14 3HB CYS 14 15.561 -8.753 -10.498 120 H SER 15 HN SER 15 14.812 -9.568 -14.626 121 HA SER 15 HA SER 15 12.419 -11.071 -14.250 122 HB2 SER 15 2HB SER 15 13.099 -12.063 -16.506 123 HB3 SER 15 3HB SER 15 12.833 -10.331 -16.485 124 HG SER 15 HG SER 15 14.822 -10.114 -17.222 125 H GLN 16 HN GLN 16 15.513 -12.381 -15.558 126 HA GLN 16 HA GLN 16 15.286 -14.484 -13.550 127 HB2 GLN 16 2HB GLN 16 16.762 -15.727 -15.390 128 HB3 GLN 16 3HB GLN 16 15.015 -15.669 -15.519 129 HG2 GLN 16 2HG GLN 16 15.124 -13.775 -17.072 130 HG3 GLN 16 3HG GLN 16 16.850 -13.605 -16.821 131 HE21 GLN 16 1HE2 GLN 16 18.153 -14.533 -18.205 132 HE22 GLN 16 2HE2 GLN 16 17.776 -15.825 -19.296 133 H CYS 17 HN CYS 17 16.508 -12.510 -12.388 134 HA CYS 17 HA CYS 17 19.351 -13.117 -12.702 135 HB2 CYS 17 2HB CYS 17 18.013 -10.484 -12.847 136 HB3 CYS 17 3HB CYS 17 19.430 -10.549 -11.818 137 H HIS 18 HN HIS 18 16.735 -11.618 -10.672 138 HA HIS 18 HA HIS 18 18.150 -12.663 -8.330 139 HB2 HIS 18 2HB HIS 18 16.409 -10.226 -8.704 140 HB3 HIS 18 3HB HIS 18 16.709 -10.905 -7.117 141 HD1 HIS 18 HD1 HIS 18 19.544 -11.328 -6.764 142 HD2 HIS 18 HD2 HIS 18 18.187 -8.248 -9.267 143 HE1 HIS 18 HE1 HIS 18 21.475 -9.673 -6.974 144 H THR 19 HN THR 19 16.561 -13.203 -6.454 145 HA THR 19 HA THR 19 14.042 -14.269 -7.506 146 HB THR 19 HB THR 19 14.618 -16.411 -6.198 147 HG1 THR 19 HG1 THR 19 17.099 -16.484 -6.007 148 HG21 THR 19 1HG2 THR 19 14.909 -16.514 -8.632 149 HG22 THR 19 2HG2 THR 19 16.417 -15.573 -8.529 150 HG23 THR 19 3HG2 THR 19 16.355 -17.229 -7.879 151 H VAL 20 HN VAL 20 12.723 -15.205 -5.530 152 HA VAL 20 HA VAL 20 13.188 -13.513 -3.196 153 HB VAL 20 HB VAL 20 10.842 -12.841 -3.171 154 HG11 VAL 20 1HG1 VAL 20 12.448 -11.311 -4.157 155 HG12 VAL 20 2HG1 VAL 20 12.312 -12.130 -5.732 156 HG13 VAL 20 3HG1 VAL 20 10.922 -11.238 -5.069 157 HG21 VAL 20 3HG2 VAL 20 9.561 -13.116 -5.390 158 HG22 VAL 20 1HG2 VAL 20 10.718 -14.421 -5.743 159 HG23 VAL 20 2HG2 VAL 20 9.668 -14.526 -4.310 160 H GLU 21 HN GLU 21 11.139 -16.084 -4.733 161 HA GLU 21 HA GLU 21 10.004 -17.191 -2.625 162 HB2 GLU 21 2HB GLU 21 10.080 -19.344 -3.807 163 HB3 GLU 21 3HB GLU 21 9.821 -18.039 -4.949 164 HG2 GLU 21 2HG GLU 21 12.521 -18.092 -5.052 165 HG3 GLU 21 3HG GLU 21 12.268 -19.747 -4.535 166 HE2 GLU 21 HE2 GLU 21 10.903 -21.074 -6.796 167 H LYS 22 HN LYS 22 10.713 -17.732 -0.611 168 HA LYS 22 HA LYS 22 13.311 -17.833 0.181 169 HB2 LYS 22 2HB LYS 22 12.358 -19.277 2.099 170 HB3 LYS 22 3HB LYS 22 11.740 -17.653 1.877 171 HG2 LYS 22 2HG LYS 22 9.643 -18.442 1.534 172 HG3 LYS 22 3HG LYS 22 10.194 -19.451 0.212 173 HD2 LYS 22 2HD LYS 22 11.120 -20.977 2.231 174 HD3 LYS 22 3HD LYS 22 9.861 -20.151 3.127 175 HE2 LYS 22 2HE LYS 22 9.414 -21.644 0.497 176 HE3 LYS 22 3HE LYS 22 9.078 -22.307 2.085 177 HZ1 LYS 22 2HZ LYS 22 7.207 -21.056 2.264 178 HZ3 LYS 22 1HZ LYS 22 7.291 -20.908 0.644 179 H GLY 23 HN GLY 23 11.254 -20.531 -1.047 180 HA2 GLY 23 1HA GLY 23 13.432 -22.426 -0.781 181 HA3 GLY 23 2HA GLY 23 11.817 -22.723 -1.391 182 H GLY 24 HN GLY 24 14.373 -20.329 -2.365 183 HA2 GLY 24 1HA GLY 24 14.185 -21.434 -5.104 184 HA3 GLY 24 2HA GLY 24 14.419 -19.739 -4.729 185 H LYS 25 HN LYS 25 16.322 -20.379 -6.324 186 HA LYS 25 HA LYS 25 18.602 -21.112 -4.624 187 HB2 LYS 25 2HB LYS 25 19.498 -22.482 -6.234 188 HB3 LYS 25 3HB LYS 25 17.789 -22.800 -6.450 189 HG2 LYS 25 2HG LYS 25 17.687 -21.185 -8.323 190 HG3 LYS 25 3HG LYS 25 19.364 -20.744 -8.070 191 HD2 LYS 25 2HD LYS 25 18.509 -23.606 -8.681 192 HD3 LYS 25 3HD LYS 25 18.890 -22.454 -9.946 193 HE2 LYS 25 2HE LYS 25 21.152 -22.083 -8.750 194 HE3 LYS 25 3HE LYS 25 20.755 -23.472 -7.757 195 HZ1 LYS 25 2HZ LYS 25 20.781 -24.878 -9.640 196 HZ3 LYS 25 1HZ LYS 25 22.071 -23.912 -9.880 197 H HIS 26 HN HIS 26 20.739 -20.302 -5.842 198 HA HIS 26 HA HIS 26 20.169 -17.510 -6.499 199 HB2 HIS 26 2HB HIS 26 22.738 -18.733 -5.457 200 HB3 HIS 26 3HB HIS 26 22.432 -17.029 -5.725 201 HD1 HIS 26 HD1 HIS 26 22.566 -16.177 -3.342 202 HD2 HIS 26 HD2 HIS 26 19.938 -19.419 -3.767 203 HE1 HIS 26 HE1 HIS 26 21.350 -16.409 -1.111 204 H LYS 27 HN LYS 27 20.721 -16.697 -8.485 205 HA LYS 27 HA LYS 27 22.260 -18.508 -10.214 206 HB2 LYS 27 2HB LYS 27 19.702 -17.058 -10.645 207 HB3 LYS 27 3HB LYS 27 20.831 -17.046 -11.984 208 HG2 LYS 27 2HG LYS 27 21.033 -19.657 -11.423 209 HG3 LYS 27 3HG LYS 27 19.471 -19.403 -10.672 210 HD2 LYS 27 2HD LYS 27 20.194 -18.778 -13.573 211 HD3 LYS 27 3HD LYS 27 19.185 -20.101 -13.024 212 HE2 LYS 27 2HE LYS 27 18.574 -17.124 -12.958 213 HE3 LYS 27 3HE LYS 27 17.655 -18.399 -13.734 214 HZ1 LYS 27 2HZ LYS 27 17.943 -18.031 -10.799 215 HZ3 LYS 27 1HZ LYS 27 17.156 -19.281 -11.485 216 H THR 28 HN THR 28 21.243 -15.291 -11.231 217 HA THR 28 HA THR 28 23.980 -14.527 -11.572 218 HB THR 28 HB THR 28 23.006 -12.680 -12.772 219 HG1 THR 28 HG1 THR 28 21.441 -11.779 -11.466 220 HG21 THR 28 1HG2 THR 28 22.261 -15.125 -13.557 221 HG22 THR 28 2HG2 THR 28 20.667 -14.598 -12.965 222 HG23 THR 28 3HG2 THR 28 21.479 -13.690 -14.263 223 H GLY 29 HN GLY 29 21.381 -13.845 -9.224 224 HA2 GLY 29 1HA GLY 29 23.396 -12.438 -7.595 225 HA3 GLY 29 2HA GLY 29 21.828 -11.711 -7.885 226 HA PRO 30 HA PRO 30 21.594 -14.620 -4.306 227 HB2 PRO 30 2HB PRO 30 21.527 -12.848 -2.227 228 HB3 PRO 30 3HB PRO 30 22.986 -13.674 -2.735 229 HG2 PRO 30 2HG PRO 30 22.199 -10.859 -3.180 230 HG3 PRO 30 3HG PRO 30 23.790 -11.586 -3.293 231 HD2 PRO 30 2HD PRO 30 22.079 -10.851 -5.475 232 HD3 PRO 30 3HD PRO 30 23.619 -11.682 -5.584 233 H ASN 31 HN ASN 31 19.732 -15.320 -3.245 234 HA ASN 31 HA ASN 31 17.430 -14.319 -4.397 235 HB2 ASN 31 2HB ASN 31 17.929 -16.615 -3.188 236 HB3 ASN 31 3HB ASN 31 17.470 -15.774 -1.720 237 HD21 ASN 31 1HD2 ASN 31 16.405 -17.597 -4.268 238 HD22 ASN 31 2HD2 ASN 31 14.704 -17.276 -4.214 239 H LEU 32 HN LEU 32 15.468 -13.538 -2.914 240 HA LEU 32 HA LEU 32 16.518 -11.586 -0.985 241 HB2 LEU 32 2HB LEU 32 14.579 -11.329 -3.223 242 HB3 LEU 32 3HB LEU 32 14.223 -10.448 -1.750 243 HG LEU 32 HG LEU 32 16.564 -9.459 -1.912 244 HD11 LEU 32 1HD1 LEU 32 16.895 -11.352 -3.910 245 HD12 LEU 32 2HD1 LEU 32 16.701 -9.824 -4.803 246 HD13 LEU 32 3HD1 LEU 32 17.969 -9.976 -3.561 247 HD21 LEU 32 3HD2 LEU 32 14.795 -8.730 -4.247 248 HD22 LEU 32 1HD2 LEU 32 14.363 -8.356 -2.562 249 HD23 LEU 32 2HD2 LEU 32 15.846 -7.677 -3.271 250 H HIS 33 HN HIS 33 16.293 -13.066 0.773 251 HA HIS 33 HA HIS 33 13.484 -13.640 1.384 252 HB2 HIS 33 2HB HIS 33 14.749 -15.680 0.869 253 HB3 HIS 33 3HB HIS 33 15.936 -15.274 2.093 254 HD1 HIS 33 HD1 HIS 33 12.292 -14.721 2.860 255 HD2 HIS 33 HD2 HIS 33 15.265 -17.592 3.581 256 HE1 HIS 33 HE1 HIS 33 11.356 -16.286 4.644 257 H GLY 34 HN GLY 34 16.769 -13.171 2.872 258 HA2 GLY 34 1HA GLY 34 15.447 -11.983 5.218 259 HA3 GLY 34 2HA GLY 34 17.079 -12.616 5.141 260 H LEU 35 HN LEU 35 15.828 -10.646 2.468 261 HA LEU 35 HA LEU 35 17.883 -8.936 2.289 262 HB2 LEU 35 2HB LEU 35 15.916 -9.187 0.768 263 HB3 LEU 35 3HB LEU 35 14.993 -8.172 1.858 264 HG LEU 35 HG LEU 35 16.829 -6.401 1.490 265 HD11 LEU 35 1HD1 LEU 35 17.643 -6.883 -1.059 266 HD12 LEU 35 2HD1 LEU 35 18.619 -7.201 0.394 267 HD13 LEU 35 3HD1 LEU 35 17.700 -8.522 -0.367 268 HD21 LEU 35 3HD2 LEU 35 14.950 -5.643 0.525 269 HD22 LEU 35 1HD2 LEU 35 15.755 -6.102 -0.996 270 HD23 LEU 35 2HD2 LEU 35 14.583 -7.208 -0.240 271 H PHE 36 HN PHE 36 14.801 -7.795 3.825 272 HA PHE 36 HA PHE 36 16.089 -5.701 5.155 273 HB2 PHE 36 2HB PHE 36 13.459 -7.250 5.471 274 HB3 PHE 36 3HB PHE 36 13.817 -5.878 6.502 275 HD1 PHE 36 HD2 PHE 36 13.280 -6.891 2.985 276 HD2 PHE 36 HD1 PHE 36 13.516 -3.663 5.730 277 HE1 PHE 36 HE2 PHE 36 12.367 -5.338 1.237 278 HE2 PHE 36 HE1 PHE 36 12.603 -2.110 3.982 279 HZ PHE 36 HZ PHE 36 12.040 -2.966 1.756 280 H GLY 37 HN GLY 37 17.843 -6.317 6.449 281 HA2 GLY 37 1HA GLY 37 18.233 -6.631 8.819 282 HA3 GLY 37 2HA GLY 37 17.130 -7.992 8.781 283 H ARG 38 HN ARG 38 19.470 -7.289 6.162 284 HA ARG 38 HA ARG 38 21.183 -9.373 7.191 285 HB2 ARG 38 2HB ARG 38 19.677 -10.590 5.685 286 HB3 ARG 38 3HB ARG 38 19.876 -9.387 4.428 287 HG2 ARG 38 2HG ARG 38 22.396 -9.965 4.457 288 HG3 ARG 38 3HG ARG 38 21.977 -11.336 5.464 289 HD2 ARG 38 2HD ARG 38 20.774 -10.801 2.705 290 HD3 ARG 38 3HD ARG 38 22.106 -11.900 3.004 291 HE ARG 38 HE ARG 38 20.018 -12.646 4.774 292 HH11 ARG 38 2HH2 ARG 38 20.594 -12.548 1.279 293 HH12 ARG 38 1HH2 ARG 38 19.519 -13.864 0.940 294 HH22 ARG 38 HH1 ARG 38 18.358 -14.927 2.747 295 H LYS 39 HN LYS 39 23.129 -8.285 7.325 296 HA LYS 39 HA LYS 39 23.756 -5.981 5.966 297 HB2 LYS 39 2HB LYS 39 24.857 -7.299 8.001 298 HB3 LYS 39 3HB LYS 39 25.941 -7.870 6.749 299 HG2 LYS 39 2HG LYS 39 26.825 -5.752 6.339 300 HG3 LYS 39 3HG LYS 39 25.341 -4.924 6.770 301 HD2 LYS 39 2HD LYS 39 26.744 -6.417 8.971 302 HD3 LYS 39 3HD LYS 39 27.522 -4.960 8.387 303 HE2 LYS 39 2HE LYS 39 24.579 -5.015 9.182 304 HE3 LYS 39 3HE LYS 39 25.850 -4.680 10.341 305 HZ1 LYS 39 2HZ LYS 39 25.410 -2.567 9.589 306 HZ3 LYS 39 1HZ LYS 39 24.959 -3.031 8.094 307 H THR 40 HN THR 40 25.950 -5.951 4.516 308 HA THR 40 HA THR 40 25.140 -7.240 2.079 309 HB THR 40 HB THR 40 27.306 -5.968 1.324 310 HG1 THR 40 HG1 THR 40 27.816 -4.357 3.087 311 HG21 THR 40 1HG2 THR 40 26.046 -3.680 2.275 312 HG22 THR 40 2HG2 THR 40 25.592 -4.525 0.777 313 HG23 THR 40 3HG2 THR 40 24.715 -4.861 2.288 314 H GLY 41 HN GLY 41 26.710 -8.454 0.696 315 HA2 GLY 41 1HA GLY 41 27.757 -10.448 0.461 316 HA3 GLY 41 2HA GLY 41 29.001 -9.663 1.415 317 H GLN 42 HN GLN 42 25.699 -11.049 2.093 318 HA GLN 42 HA GLN 42 26.954 -12.426 4.336 319 HB2 GLN 42 2HB GLN 42 24.093 -11.442 3.967 320 HB3 GLN 42 3HB GLN 42 24.589 -12.479 5.290 321 HG2 GLN 42 2HG GLN 42 25.675 -9.690 4.680 322 HG3 GLN 42 3HG GLN 42 24.621 -10.123 6.012 323 HE21 GLN 42 1HE2 GLN 42 27.825 -10.098 4.756 324 HE22 GLN 42 2HE2 GLN 42 28.665 -10.704 6.145 325 H ALA 43 HN ALA 43 25.003 -12.687 1.393 326 HA ALA 43 HA ALA 43 23.713 -15.020 1.582 327 HB1 ALA 43 3HB ALA 43 25.432 -13.910 -0.662 328 HB2 ALA 43 1HB ALA 43 24.396 -15.343 -0.863 329 HB3 ALA 43 2HB ALA 43 23.670 -13.771 -0.452 330 HA PRO 44 HA PRO 44 27.098 -17.613 2.789 331 HB2 PRO 44 2HB PRO 44 25.598 -19.477 4.110 332 HB3 PRO 44 3HB PRO 44 26.255 -18.051 4.887 333 HG2 PRO 44 2HG PRO 44 23.468 -18.595 4.068 334 HG3 PRO 44 3HG PRO 44 24.066 -17.398 5.201 335 HD2 PRO 44 2HD PRO 44 23.190 -16.928 2.511 336 HD3 PRO 44 3HD PRO 44 23.896 -15.754 3.604 337 H GLY 45 HN GLY 45 26.852 -17.661 0.250 338 HA2 GLY 45 1HA GLY 45 27.112 -20.383 -0.427 339 HA3 GLY 45 2HA GLY 45 25.514 -19.834 -0.888 340 H TYR 46 HN TYR 46 25.947 -17.161 -1.633 341 HA TYR 46 HA TYR 46 27.733 -17.527 -3.940 342 HB2 TYR 46 2HB TYR 46 25.151 -17.210 -4.155 343 HB3 TYR 46 3HB TYR 46 25.363 -15.621 -3.449 344 HD1 TYR 46 HD1 TYR 46 27.480 -17.361 -6.001 345 HD2 TYR 46 HD2 TYR 46 24.808 -14.125 -5.164 346 HE1 TYR 46 HE1 TYR 46 27.921 -16.389 -8.309 347 HE2 TYR 46 HE2 TYR 46 25.259 -13.165 -7.473 348 HH TYR 46 HH TYR 46 26.383 -14.775 -9.906 349 H SER 47 HN SER 47 29.536 -16.286 -4.029 350 HA SER 47 HA SER 47 29.691 -14.111 -2.129 351 HB2 SER 47 2HB SER 47 32.096 -14.215 -2.460 352 HB3 SER 47 3HB SER 47 31.503 -15.846 -2.216 353 HG SER 47 HG SER 47 32.547 -16.272 -4.039 354 H TYR 48 HN TYR 48 30.066 -11.935 -2.756 355 HA TYR 48 HA TYR 48 29.498 -11.409 -5.570 356 HB2 TYR 48 2HB TYR 48 29.811 -9.460 -3.223 357 HB3 TYR 48 3HB TYR 48 28.841 -9.227 -4.664 358 HD1 TYR 48 HD2 TYR 48 27.700 -12.203 -4.450 359 HD2 TYR 48 HD1 TYR 48 27.918 -8.867 -1.779 360 HE1 TYR 48 HE2 TYR 48 25.653 -13.055 -3.208 361 HE2 TYR 48 HE1 TYR 48 25.869 -9.732 -0.545 362 HH TYR 48 HH TYR 48 23.949 -11.134 -1.011 363 H THR 49 HN THR 49 30.583 -8.962 -6.028 364 HA THR 49 HA THR 49 33.323 -9.598 -6.430 365 HB THR 49 HB THR 49 33.312 -7.323 -7.487 366 HG1 THR 49 HG1 THR 49 31.170 -6.213 -7.250 367 HG21 THR 49 1HG2 THR 49 32.135 -9.322 -8.661 368 HG22 THR 49 2HG2 THR 49 30.612 -8.636 -8.046 369 HG23 THR 49 3HG2 THR 49 31.622 -7.696 -9.170 370 H ALA 50 HN ALA 50 35.091 -7.941 -5.862 371 HA ALA 50 HA ALA 50 35.176 -7.840 -3.016 372 HB1 ALA 50 3HB ALA 50 37.407 -6.654 -3.588 373 HB2 ALA 50 1HB ALA 50 37.211 -8.345 -4.107 374 HB3 ALA 50 2HB ALA 50 37.012 -7.024 -5.283 375 H ALA 51 HN ALA 51 33.916 -5.797 -5.497 376 HA ALA 51 HA ALA 51 34.376 -3.342 -4.058 377 HB1 ALA 51 3HB ALA 51 34.177 -2.629 -6.184 378 HB2 ALA 51 1HB ALA 51 33.523 -4.199 -6.710 379 HB3 ALA 51 2HB ALA 51 32.432 -2.953 -6.057 380 H ASN 52 HN ASN 52 31.985 -5.926 -4.246 381 HA ASN 52 HA ASN 52 29.979 -4.272 -3.026 382 HB2 ASN 52 2HB ASN 52 29.539 -6.141 -4.771 383 HB3 ASN 52 3HB ASN 52 29.897 -7.293 -3.500 384 HD21 ASN 52 1HD2 ASN 52 28.713 -6.920 -1.402 385 HD22 ASN 52 2HD2 ASN 52 27.027 -6.530 -1.489 386 H LYS 53 HN LYS 53 31.556 -7.498 -2.340 387 HA LYS 53 HA LYS 53 30.756 -7.923 0.182 388 HB2 LYS 53 2HB LYS 53 32.424 -9.188 -1.431 389 HB3 LYS 53 3HB LYS 53 33.648 -8.384 -0.470 390 HG2 LYS 53 2HG LYS 53 32.239 -9.264 1.595 391 HG3 LYS 53 3HG LYS 53 31.549 -10.379 0.433 392 HD2 LYS 53 2HD LYS 53 34.055 -10.886 -0.218 393 HD3 LYS 53 3HD LYS 53 34.443 -10.134 1.316 394 HE2 LYS 53 2HE LYS 53 32.819 -12.652 0.813 395 HE3 LYS 53 3HE LYS 53 34.235 -12.457 1.826 396 HZ1 LYS 53 2HZ LYS 53 32.973 -11.665 3.531 397 HZ3 LYS 53 1HZ LYS 53 31.737 -12.412 2.779 398 H ASN 54 HN ASN 54 32.975 -5.405 -0.948 399 HA ASN 54 HA ASN 54 34.175 -4.835 1.467 400 HB2 ASN 54 2HB ASN 54 34.503 -3.893 -1.031 401 HB3 ASN 54 3HB ASN 54 33.438 -2.619 -0.469 402 HD21 ASN 54 1HD2 ASN 54 36.575 -3.627 -0.738 403 HD22 ASN 54 2HD2 ASN 54 37.350 -2.612 0.433 404 H LYS 55 HN LYS 55 31.284 -3.358 -0.197 405 HA LYS 55 HA LYS 55 30.556 -1.457 1.545 406 HB2 LYS 55 2HB LYS 55 29.445 -2.359 -0.640 407 HB3 LYS 55 3HB LYS 55 28.469 -3.330 0.445 408 HG2 LYS 55 2HG LYS 55 27.177 -1.373 0.241 409 HG3 LYS 55 3HG LYS 55 28.044 -1.083 1.736 410 HD2 LYS 55 2HD LYS 55 29.857 -0.017 0.031 411 HD3 LYS 55 3HD LYS 55 28.429 0.191 -0.965 412 HE2 LYS 55 2HE LYS 55 27.382 1.636 0.592 413 HE3 LYS 55 3HE LYS 55 28.326 1.036 1.942 414 HZ1 LYS 55 2HZ LYS 55 30.190 2.071 0.207 415 HZ3 LYS 55 1HZ LYS 55 29.660 2.793 1.567 416 H GLY 56 HN GLY 56 29.340 -1.272 3.482 417 HA2 GLY 56 1HA GLY 56 28.807 -3.778 4.922 418 HA3 GLY 56 2HA GLY 56 29.875 -2.592 5.644 419 H ILE 57 HN ILE 57 26.553 -3.069 4.318 420 HA ILE 57 HA ILE 57 25.545 -1.358 6.415 421 HB ILE 57 HB ILE 57 24.177 -0.056 4.756 422 HG12 ILE 57 2HG1 ILE 57 25.518 0.159 2.492 423 HG13 ILE 57 3HG1 ILE 57 26.017 -1.481 2.860 424 HG21 ILE 57 1HG2 ILE 57 26.129 0.841 6.011 425 HG22 ILE 57 2HG2 ILE 57 27.168 0.412 4.630 426 HG23 ILE 57 3HG2 ILE 57 25.873 1.617 4.429 427 HD11 ILE 57 3HD1 ILE 57 23.888 -1.261 1.454 428 HD12 ILE 57 1HD1 ILE 57 23.739 -2.276 2.909 429 HD13 ILE 57 2HD1 ILE 57 23.095 -0.617 2.912 430 H ILE 58 HN ILE 58 22.986 -1.350 6.195 431 HA ILE 58 HA ILE 58 22.281 -4.128 5.584 432 HB ILE 58 HB ILE 58 21.301 -2.129 7.594 433 HG12 ILE 58 2HG1 ILE 58 23.205 -3.884 7.929 434 HG13 ILE 58 3HG1 ILE 58 22.010 -3.630 9.184 435 HG21 ILE 58 1HG2 ILE 58 19.313 -3.008 6.415 436 HG22 ILE 58 2HG2 ILE 58 19.835 -4.663 6.811 437 HG23 ILE 58 3HG2 ILE 58 19.401 -3.530 8.114 438 HD11 ILE 58 3HD1 ILE 58 22.488 -6.073 8.610 439 HD12 ILE 58 1HD1 ILE 58 20.772 -5.606 8.546 440 HD13 ILE 58 2HD1 ILE 58 21.705 -5.775 7.039 441 H TRP 59 HN TRP 59 20.327 -4.590 4.429 442 HA TRP 59 HA TRP 59 19.646 -2.438 2.590 443 HB2 TRP 59 2HB TRP 59 19.149 -5.416 2.561 444 HB3 TRP 59 3HB TRP 59 18.462 -4.314 1.385 445 HD1 TRP 59 HD1 TRP 59 21.396 -6.472 1.764 446 HE1 TRP 59 HE1 TRP 59 23.366 -5.919 0.098 447 HE3 TRP 59 HE3 TRP 59 19.641 -1.905 0.374 448 HZ2 TRP 59 HZ2 TRP 59 23.957 -3.684 -1.577 449 HZ3 TRP 59 HZ3 TRP 59 20.975 -0.603 -1.280 450 HH2 TRP 59 HH2 TRP 59 23.063 -1.423 -2.248 451 H GLY 60 HN GLY 60 17.449 -1.740 2.294 452 HA2 GLY 60 1HA GLY 60 15.335 -2.833 3.900 453 HA3 GLY 60 2HA GLY 60 15.934 -1.308 4.522 454 H GLU 61 HN GLU 61 14.095 -0.053 4.022 455 HA GLU 61 HA GLU 61 13.147 -0.112 1.313 456 HB2 GLU 61 2HB GLU 61 12.219 1.058 3.915 457 HB3 GLU 61 3HB GLU 61 11.692 1.868 2.454 458 HG2 GLU 61 2HG GLU 61 11.154 -0.658 1.677 459 HG3 GLU 61 3HG GLU 61 11.072 -0.923 3.409 460 HE2 GLU 61 HE2 GLU 61 9.552 1.276 0.971 461 H ASP 62 HN ASP 62 14.727 2.197 3.609 462 HA ASP 62 HA ASP 62 14.802 4.296 1.778 463 HB2 ASP 62 2HB ASP 62 15.116 4.393 4.318 464 HB3 ASP 62 3HB ASP 62 16.733 3.761 4.082 465 HD2 ASP 62 HD2 ASP 62 17.634 6.068 1.963 466 H THR 63 HN THR 63 17.491 2.207 3.109 467 HA THR 63 HA THR 63 19.526 2.938 1.496 468 HB THR 63 HB THR 63 20.409 0.664 1.967 469 HG1 THR 63 HG1 THR 63 17.561 0.315 2.575 470 HG21 THR 63 1HG2 THR 63 19.347 2.397 3.972 471 HG22 THR 63 2HG2 THR 63 18.814 0.757 4.413 472 HG23 THR 63 3HG2 THR 63 20.548 1.104 4.206 473 H LEU 64 HN LEU 64 17.094 0.377 0.667 474 HA LEU 64 HA LEU 64 18.140 -0.112 -1.865 475 HB2 LEU 64 2HB LEU 64 15.423 -0.503 -0.630 476 HB3 LEU 64 3HB LEU 64 15.761 -0.960 -2.288 477 HG LEU 64 HG LEU 64 17.235 -2.023 0.138 478 HD11 LEU 64 1HD1 LEU 64 15.649 -3.551 0.409 479 HD12 LEU 64 2HD1 LEU 64 14.653 -2.663 -0.767 480 HD13 LEU 64 3HD1 LEU 64 15.705 -3.991 -1.315 481 HD21 LEU 64 3HD2 LEU 64 17.475 -2.574 -2.815 482 HD22 LEU 64 1HD2 LEU 64 18.747 -2.184 -1.633 483 HD23 LEU 64 2HD2 LEU 64 17.959 -3.779 -1.597 484 H MET 65 HN MET 65 15.256 1.902 -0.936 485 HA MET 65 HA MET 65 14.622 2.873 -3.333 486 HB2 MET 65 2HB MET 65 13.334 3.506 -1.386 487 HB3 MET 65 3HB MET 65 14.733 4.188 -0.581 488 HG2 MET 65 2HG MET 65 13.144 5.922 -1.532 489 HG3 MET 65 3HG MET 65 14.796 6.089 -2.091 490 HE1 MET 65 3HE MET 65 11.691 3.592 -3.635 491 HE2 MET 65 1HE MET 65 11.378 4.963 -2.544 492 HE3 MET 65 2HE MET 65 11.034 5.113 -4.284 493 H GLU 66 HN GLU 66 17.477 3.731 -1.388 494 HA GLU 66 HA GLU 66 18.075 6.004 -2.991 495 HB2 GLU 66 2HB GLU 66 18.752 5.955 -0.639 496 HB3 GLU 66 3HB GLU 66 19.679 4.489 -0.887 497 HG2 GLU 66 2HG GLU 66 21.220 5.675 -2.418 498 HG3 GLU 66 3HG GLU 66 20.254 7.134 -2.305 499 HE2 GLU 66 HE2 GLU 66 20.047 6.542 0.829 500 H TYR 67 HN TYR 67 19.080 2.563 -2.778 501 HA TYR 67 HA TYR 67 21.248 2.748 -4.551 502 HB2 TYR 67 2HB TYR 67 20.506 0.890 -2.886 503 HB3 TYR 67 3HB TYR 67 19.246 0.466 -4.028 504 HD1 TYR 67 HD2 TYR 67 22.845 1.341 -4.618 505 HD2 TYR 67 HD1 TYR 67 19.787 -1.643 -4.863 506 HE1 TYR 67 HE2 TYR 67 24.452 -0.217 -5.825 507 HE2 TYR 67 HE1 TYR 67 21.405 -3.191 -6.069 508 HH TYR 67 HH TYR 67 24.056 -3.382 -6.059 509 H LEU 68 HN LEU 68 17.794 1.746 -5.065 510 HA LEU 68 HA LEU 68 17.954 1.139 -7.720 511 HB2 LEU 68 2HB LEU 68 15.814 2.156 -5.913 512 HB3 LEU 68 3HB LEU 68 15.499 2.154 -7.636 513 HG LEU 68 HG LEU 68 14.616 0.144 -6.646 514 HD11 LEU 68 1HD1 LEU 68 16.216 0.214 -8.869 515 HD12 LEU 68 2HD1 LEU 68 16.922 -1.133 -7.943 516 HD13 LEU 68 3HD1 LEU 68 15.194 -1.157 -8.372 517 HD21 LEU 68 3HD2 LEU 68 17.300 -0.900 -5.855 518 HD22 LEU 68 1HD2 LEU 68 16.488 0.259 -4.776 519 HD23 LEU 68 2HD2 LEU 68 15.684 -1.269 -5.206 520 H GLU 69 HN GLU 69 17.556 4.377 -6.173 521 HA GLU 69 HA GLU 69 17.091 5.852 -8.385 522 HB2 GLU 69 2HB GLU 69 17.076 6.784 -6.120 523 HB3 GLU 69 3HB GLU 69 18.802 6.534 -5.957 524 HG2 GLU 69 2HG GLU 69 19.166 8.100 -7.917 525 HG3 GLU 69 3HG GLU 69 17.442 8.410 -7.948 526 HE2 GLU 69 HE2 GLU 69 18.476 11.091 -6.190 527 H ASN 70 HN ASN 70 20.261 4.663 -7.130 528 HA ASN 70 HA ASN 70 21.313 4.695 -9.739 529 HB2 ASN 70 2HB ASN 70 22.054 6.895 -7.800 530 HB3 ASN 70 3HB ASN 70 23.334 6.228 -8.794 531 HD21 ASN 70 1HD2 ASN 70 21.855 8.849 -8.709 532 HD22 ASN 70 2HD2 ASN 70 21.347 9.155 -10.336 533 HA PRO 71 HA PRO 71 23.178 1.811 -6.779 534 HB2 PRO 71 2HB PRO 71 23.048 -0.420 -8.352 535 HB3 PRO 71 3HB PRO 71 21.790 0.028 -7.218 536 HG2 PRO 71 2HG PRO 71 21.797 0.261 -10.165 537 HG3 PRO 71 3HG PRO 71 20.433 0.295 -9.065 538 HD2 PRO 71 2HD PRO 71 21.640 2.545 -10.372 539 HD3 PRO 71 3HD PRO 71 20.353 2.589 -9.183 540 H LYS 72 HN LYS 72 24.094 3.267 -9.540 541 HA LYS 72 HA LYS 72 26.516 1.738 -9.892 542 HB2 LYS 72 2HB LYS 72 25.460 2.568 -11.874 543 HB3 LYS 72 3HB LYS 72 25.373 4.198 -11.237 544 HG2 LYS 72 2HG LYS 72 27.726 4.537 -11.425 545 HG3 LYS 72 3HG LYS 72 28.063 2.820 -11.517 546 HD2 LYS 72 2HD LYS 72 26.345 4.072 -13.668 547 HD3 LYS 72 3HD LYS 72 28.076 4.343 -13.715 548 HE2 LYS 72 2HE LYS 72 26.949 1.534 -13.401 549 HE3 LYS 72 3HE LYS 72 27.104 2.266 -14.986 550 HZ1 LYS 72 2HZ LYS 72 29.515 2.687 -14.336 551 HZ3 LYS 72 1HZ LYS 72 29.125 1.128 -14.597 552 H LYS 73 HN LYS 73 25.359 4.638 -8.212 553 HA LYS 73 HA LYS 73 28.053 5.544 -7.702 554 HB2 LYS 73 2HB LYS 73 27.105 7.496 -6.965 555 HB3 LYS 73 3HB LYS 73 25.876 6.956 -8.092 556 HG2 LYS 73 2HG LYS 73 24.736 5.791 -6.081 557 HG3 LYS 73 3HG LYS 73 25.847 6.679 -5.056 558 HD2 LYS 73 2HD LYS 73 23.825 7.883 -7.004 559 HD3 LYS 73 3HD LYS 73 23.728 7.917 -5.255 560 HE2 LYS 73 2HE LYS 73 25.889 9.233 -5.198 561 HE3 LYS 73 3HE LYS 73 25.887 9.261 -6.951 562 HZ1 LYS 73 2HZ LYS 73 24.861 11.264 -5.962 563 HZ3 LYS 73 1HZ LYS 73 23.688 10.362 -5.284 564 H TYR 74 HN TYR 74 25.334 3.910 -6.003 565 HA TYR 74 HA TYR 74 26.389 3.958 -3.446 566 HB2 TYR 74 2HB TYR 74 24.138 3.067 -4.683 567 HB3 TYR 74 3HB TYR 74 24.993 1.537 -4.674 568 HD1 TYR 74 HD1 TYR 74 26.228 1.224 -2.154 569 HD2 TYR 74 HD2 TYR 74 22.535 3.203 -3.024 570 HE1 TYR 74 HE1 TYR 74 25.434 0.804 0.224 571 HE2 TYR 74 HE2 TYR 74 21.754 2.777 -0.642 572 HH TYR 74 HH TYR 74 22.604 0.708 1.188 573 H ILE 75 HN ILE 75 27.059 1.772 -6.220 574 HA ILE 75 HA ILE 75 29.438 0.882 -4.831 575 HB ILE 75 HB ILE 75 27.416 -1.112 -5.853 576 HG12 ILE 75 2HG1 ILE 75 28.048 -0.289 -3.004 577 HG13 ILE 75 3HG1 ILE 75 26.540 -0.021 -3.856 578 HG21 ILE 75 1HG2 ILE 75 29.988 -1.510 -4.301 579 HG22 ILE 75 2HG2 ILE 75 28.870 -2.779 -4.855 580 HG23 ILE 75 3HG2 ILE 75 29.772 -1.806 -6.043 581 HD11 ILE 75 3HD1 ILE 75 27.758 -2.730 -3.150 582 HD12 ILE 75 1HD1 ILE 75 26.306 -1.995 -2.430 583 HD13 ILE 75 2HD1 ILE 75 26.289 -2.516 -4.132 584 HA PRO 76 HA PRO 76 30.185 1.679 -9.148 585 HB2 PRO 76 2HB PRO 76 32.636 2.846 -8.826 586 HB3 PRO 76 3HB PRO 76 31.137 3.754 -8.847 587 HG2 PRO 76 2HG PRO 76 32.848 3.053 -6.541 588 HG3 PRO 76 3HG PRO 76 31.610 4.288 -6.654 589 HD2 PRO 76 2HD PRO 76 31.379 1.741 -5.355 590 HD3 PRO 76 3HD PRO 76 30.108 2.927 -5.569 591 H GLY 77 HN GLY 77 30.695 0.064 -10.471 592 HA2 GLY 77 1HA GLY 77 32.488 -1.256 -11.338 593 HA3 GLY 77 2HA GLY 77 33.111 -1.454 -9.712 594 H THR 78 HN THR 78 29.961 -1.644 -9.008 595 HA THR 78 HA THR 78 29.903 -4.371 -8.584 596 HB THR 78 HB THR 78 28.446 -2.775 -7.414 597 HG1 THR 78 HG1 THR 78 26.364 -3.949 -8.055 598 HG21 THR 78 1HG2 THR 78 28.086 -1.315 -9.570 599 HG22 THR 78 2HG2 THR 78 26.821 -2.499 -9.975 600 HG23 THR 78 3HG2 THR 78 26.696 -1.541 -8.480 601 H LYS 79 HN LYS 79 28.216 -5.931 -9.510 602 HA LYS 79 HA LYS 79 28.687 -5.978 -12.371 603 HB2 LYS 79 2HB LYS 79 27.380 -8.109 -10.669 604 HB3 LYS 79 3HB LYS 79 28.100 -8.288 -12.256 605 HG2 LYS 79 2HG LYS 79 30.273 -7.320 -11.002 606 HG3 LYS 79 3HG LYS 79 29.458 -7.946 -9.583 607 HD2 LYS 79 2HD LYS 79 29.844 -9.653 -12.075 608 HD3 LYS 79 3HD LYS 79 31.085 -9.541 -10.843 609 HE2 LYS 79 2HE LYS 79 29.916 -11.378 -10.028 610 HE3 LYS 79 3HE LYS 79 29.050 -10.104 -9.192 611 HZ1 LYS 79 2HZ LYS 79 27.537 -11.648 -10.336 612 HZ3 LYS 79 1HZ LYS 79 28.190 -11.282 -11.782 613 H MET 80 HN MET 80 26.262 -5.012 -10.103 614 HA MET 80 HA MET 80 23.954 -5.693 -11.370 615 HB2 MET 80 2HB MET 80 24.884 -3.404 -9.626 616 HB3 MET 80 3HB MET 80 23.315 -3.229 -10.384 617 HG2 MET 80 2HG MET 80 23.922 -5.839 -8.992 618 HG3 MET 80 3HG MET 80 23.596 -4.437 -7.994 619 HE1 MET 80 3HE MET 80 20.640 -2.923 -9.433 620 HE2 MET 80 1HE MET 80 20.333 -3.705 -7.864 621 HE3 MET 80 2HE MET 80 21.915 -2.955 -8.190 622 H ILE 81 HN ILE 81 24.132 -5.611 -13.670 623 HA ILE 81 HA ILE 81 24.936 -3.219 -14.976 624 HB ILE 81 HB ILE 81 23.770 -5.846 -15.823 625 HG12 ILE 81 2HG1 ILE 81 26.133 -5.820 -15.303 626 HG13 ILE 81 3HG1 ILE 81 25.906 -6.032 -17.028 627 HG21 ILE 81 1HG2 ILE 81 24.368 -4.690 -18.203 628 HG22 ILE 81 2HG2 ILE 81 22.731 -4.785 -17.512 629 HG23 ILE 81 3HG2 ILE 81 23.693 -3.301 -17.319 630 HD11 ILE 81 3HD1 ILE 81 27.221 -3.839 -15.578 631 HD12 ILE 81 1HD1 ILE 81 27.347 -4.298 -17.293 632 HD13 ILE 81 2HD1 ILE 81 26.018 -3.247 -16.748 633 H PHE 82 HN PHE 82 23.486 -1.772 -13.650 634 HA PHE 82 HA PHE 82 20.966 -1.494 -15.089 635 HB2 PHE 82 2HB PHE 82 20.857 -2.721 -12.747 636 HB3 PHE 82 3HB PHE 82 21.282 -1.168 -12.056 637 HD1 PHE 82 HD2 PHE 82 18.937 -2.105 -14.811 638 HD2 PHE 82 HD1 PHE 82 19.425 -0.303 -10.999 639 HE1 PHE 82 HE2 PHE 82 16.517 -1.441 -14.815 640 HE2 PHE 82 HE1 PHE 82 17.004 0.362 -11.005 641 HZ PHE 82 HZ PHE 82 15.579 -0.215 -12.911 642 H VAL 83 HN VAL 83 20.050 0.710 -14.933 643 HA VAL 83 HA VAL 83 22.191 2.652 -14.434 644 HB VAL 83 HB VAL 83 21.057 4.068 -16.019 645 HG11 VAL 83 1HG1 VAL 83 21.914 3.032 -17.837 646 HG12 VAL 83 2HG1 VAL 83 22.462 1.824 -16.649 647 HG13 VAL 83 3HG1 VAL 83 20.964 1.549 -17.572 648 HG21 VAL 83 3HG2 VAL 83 18.749 3.602 -15.622 649 HG22 VAL 83 1HG2 VAL 83 19.084 3.160 -17.314 650 HG23 VAL 83 2HG2 VAL 83 18.947 1.891 -16.073 651 H GLY 84 HN GLY 84 18.913 1.597 -13.598 652 HA2 GLY 84 1HA GLY 84 18.322 2.231 -11.286 653 HA3 GLY 84 2HA GLY 84 18.726 3.879 -11.722 654 H ILE 85 HN ILE 85 16.295 3.854 -10.807 655 HA ILE 85 HA ILE 85 14.537 3.559 -13.143 656 HB ILE 85 HB ILE 85 13.820 3.382 -10.214 657 HG12 ILE 85 2HG1 ILE 85 13.767 1.094 -12.176 658 HG13 ILE 85 3HG1 ILE 85 15.231 1.488 -11.296 659 HG21 ILE 85 1HG2 ILE 85 11.878 2.295 -12.048 660 HG22 ILE 85 2HG2 ILE 85 11.688 3.555 -10.805 661 HG23 ILE 85 3HG2 ILE 85 12.220 3.996 -12.445 662 HD11 ILE 85 3HD1 ILE 85 12.606 1.196 -9.806 663 HD12 ILE 85 1HD1 ILE 85 13.557 -0.241 -10.253 664 HD13 ILE 85 2HD1 ILE 85 14.265 1.001 -9.193 665 H LYS 86 HN LYS 86 13.233 5.302 -13.734 666 HA LYS 86 HA LYS 86 14.150 7.837 -12.746 667 HB2 LYS 86 2HB LYS 86 12.261 6.967 -14.937 668 HB3 LYS 86 3HB LYS 86 12.435 8.650 -14.487 669 HG2 LYS 86 2HG LYS 86 14.823 8.623 -14.997 670 HG3 LYS 86 3HG LYS 86 14.817 6.882 -15.197 671 HD2 LYS 86 2HD LYS 86 13.031 7.319 -17.077 672 HD3 LYS 86 3HD LYS 86 13.578 8.983 -17.009 673 HE2 LYS 86 2HE LYS 86 14.793 7.641 -18.748 674 HE3 LYS 86 3HE LYS 86 15.876 8.325 -17.552 675 HZ1 LYS 86 2HZ LYS 86 16.207 6.246 -16.581 676 HZ3 LYS 86 1HZ LYS 86 16.078 5.822 -18.148 677 H LYS 87 HN LYS 87 10.808 6.480 -13.208 678 HA LYS 87 HA LYS 87 9.606 8.279 -11.480 679 HB2 LYS 87 2HB LYS 87 8.854 5.600 -12.613 680 HB3 LYS 87 3HB LYS 87 7.840 6.331 -11.385 681 HG2 LYS 87 2HG LYS 87 7.829 8.466 -12.818 682 HG3 LYS 87 3HG LYS 87 8.611 7.535 -14.080 683 HD2 LYS 87 2HD LYS 87 6.725 6.057 -14.312 684 HD3 LYS 87 3HD LYS 87 6.021 6.584 -12.797 685 HE2 LYS 87 2HE LYS 87 4.721 7.838 -14.259 686 HE3 LYS 87 3HE LYS 87 6.024 8.980 -14.002 687 HZ1 LYS 87 2HZ LYS 87 5.872 8.841 -16.313 688 HZ3 LYS 87 1HZ LYS 87 5.587 7.238 -16.340 689 H LYS 88 HN LYS 88 10.153 8.625 -9.393 690 HA LYS 88 HA LYS 88 11.449 6.692 -7.828 691 HB2 LYS 88 2HB LYS 88 11.597 8.339 -6.241 692 HB3 LYS 88 3HB LYS 88 11.354 9.310 -7.679 693 HG2 LYS 88 2HG LYS 88 9.093 8.415 -5.830 694 HG3 LYS 88 3HG LYS 88 9.889 9.972 -5.715 695 HD2 LYS 88 2HD LYS 88 9.144 10.607 -7.953 696 HD3 LYS 88 3HD LYS 88 8.554 8.989 -8.276 697 HE2 LYS 88 2HE LYS 88 6.558 10.043 -7.673 698 HE3 LYS 88 3HE LYS 88 7.054 9.406 -6.117 699 HZ1 LYS 88 2HZ LYS 88 8.196 11.988 -6.642 700 HZ3 LYS 88 1HZ LYS 88 7.356 11.488 -5.339 701 H GLU 89 HN GLU 89 8.138 7.114 -8.745 702 HA GLU 89 HA GLU 89 7.108 5.887 -6.383 703 HB2 GLU 89 2HB GLU 89 5.816 7.582 -7.686 704 HB3 GLU 89 3HB GLU 89 5.765 6.491 -9.056 705 HG2 GLU 89 2HG GLU 89 4.497 4.828 -7.743 706 HG3 GLU 89 3HG GLU 89 4.644 5.808 -6.298 707 HE2 GLU 89 HE2 GLU 89 1.920 6.197 -6.548 708 H GLU 90 HN GLU 90 8.624 4.848 -9.299 709 HA GLU 90 HA GLU 90 7.200 2.377 -9.447 710 HB2 GLU 90 2HB GLU 90 9.485 3.650 -10.956 711 HB3 GLU 90 3HB GLU 90 9.220 1.925 -11.119 712 HG2 GLU 90 2HG GLU 90 6.685 2.656 -11.525 713 HG3 GLU 90 3HG GLU 90 7.401 4.207 -11.918 714 HE2 GLU 90 HE2 GLU 90 7.095 1.814 -14.730 715 H ARG 91 HN ARG 91 9.724 3.679 -7.532 716 HA ARG 91 HA ARG 91 10.986 1.103 -7.214 717 HB2 ARG 91 2HB ARG 91 11.733 3.645 -5.714 718 HB3 ARG 91 3HB ARG 91 12.758 2.272 -6.085 719 HG2 ARG 91 2HG ARG 91 12.734 2.831 -8.483 720 HG3 ARG 91 3HG ARG 91 11.566 4.109 -8.213 721 HD2 ARG 91 2HD ARG 91 13.462 4.955 -6.473 722 HD3 ARG 91 3HD ARG 91 14.503 4.052 -7.554 723 HE ARG 91 HE ARG 91 12.879 5.593 -9.242 724 HH11 ARG 91 2HH2 ARG 91 15.179 6.261 -6.631 725 HH12 ARG 91 1HH2 ARG 91 15.639 7.806 -7.264 726 HH22 ARG 91 HH1 ARG 91 14.631 8.592 -9.291 727 H ALA 92 HN ALA 92 8.810 3.414 -5.623 728 HA ALA 92 HA ALA 92 9.043 2.320 -3.016 729 HB1 ALA 92 3HB ALA 92 7.253 4.248 -4.467 730 HB2 ALA 92 1HB ALA 92 6.701 3.584 -2.910 731 HB3 ALA 92 2HB ALA 92 8.232 4.488 -3.000 732 H ASP 93 HN ASP 93 7.450 1.358 -5.974 733 HA ASP 93 HA ASP 93 5.554 -0.261 -4.536 734 HB2 ASP 93 2HB ASP 93 6.105 0.237 -7.492 735 HB3 ASP 93 3HB ASP 93 4.952 -0.971 -6.960 736 HD2 ASP 93 HD2 ASP 93 3.441 2.268 -5.485 737 H LEU 94 HN LEU 94 8.519 -0.453 -6.569 738 HA LEU 94 HA LEU 94 8.510 -3.266 -6.829 739 HB2 LEU 94 2HB LEU 94 9.737 -1.335 -8.136 740 HB3 LEU 94 3HB LEU 94 11.004 -1.626 -6.960 741 HG LEU 94 HG LEU 94 9.941 -3.466 -9.090 742 HD11 LEU 94 1HD1 LEU 94 11.750 -2.186 -9.860 743 HD12 LEU 94 2HD1 LEU 94 12.646 -2.365 -8.331 744 HD13 LEU 94 3HD1 LEU 94 12.459 -3.760 -9.422 745 HD21 LEU 94 3HD2 LEU 94 11.484 -5.221 -8.007 746 HD22 LEU 94 1HD2 LEU 94 11.300 -4.259 -6.521 747 HD23 LEU 94 2HD2 LEU 94 9.867 -4.965 -7.306 748 H ILE 95 HN ILE 95 9.912 -0.939 -4.477 749 HA ILE 95 HA ILE 95 11.279 -3.030 -3.069 750 HB ILE 95 HB ILE 95 10.782 -0.118 -2.444 751 HG12 ILE 95 2HG1 ILE 95 13.387 -1.390 -3.279 752 HG13 ILE 95 3HG1 ILE 95 12.226 -0.834 -4.467 753 HG21 ILE 95 1HG2 ILE 95 11.087 -1.329 -0.369 754 HG22 ILE 95 2HG2 ILE 95 12.536 -2.136 -1.015 755 HG23 ILE 95 3HG2 ILE 95 12.546 -0.378 -0.735 756 HD11 ILE 95 3HD1 ILE 95 13.413 0.883 -2.238 757 HD12 ILE 95 1HD1 ILE 95 13.898 0.927 -3.951 758 HD13 ILE 95 2HD1 ILE 95 12.262 1.441 -3.475 759 H ALA 96 HN ALA 96 8.058 -1.737 -3.206 760 HA ALA 96 HA ALA 96 7.365 -2.345 -0.506 761 HB1 ALA 96 3HB ALA 96 6.049 -0.676 -1.489 762 HB2 ALA 96 1HB ALA 96 5.911 -1.554 -3.032 763 HB3 ALA 96 2HB ALA 96 4.998 -2.108 -1.607 764 H TYR 97 HN TYR 97 7.231 -3.995 -3.693 765 HA TYR 97 HA TYR 97 5.767 -6.221 -2.628 766 HB2 TYR 97 2HB TYR 97 5.494 -5.677 -4.976 767 HB3 TYR 97 3HB TYR 97 7.205 -5.365 -5.185 768 HD1 TYR 97 HD2 TYR 97 5.579 -8.374 -3.673 769 HD2 TYR 97 HD1 TYR 97 7.814 -6.783 -6.956 770 HE1 TYR 97 HE2 TYR 97 5.899 -10.719 -4.602 771 HE2 TYR 97 HE1 TYR 97 8.126 -9.133 -7.874 772 HH TYR 97 HH TYR 97 6.712 -11.928 -6.190 773 H LEU 98 HN LEU 98 9.180 -5.512 -3.592 774 HA LEU 98 HA LEU 98 10.236 -8.014 -3.348 775 HB2 LEU 98 2HB LEU 98 11.309 -5.258 -2.863 776 HB3 LEU 98 3HB LEU 98 12.310 -6.656 -2.525 777 HG LEU 98 HG LEU 98 11.117 -5.867 -5.194 778 HD11 LEU 98 1HD1 LEU 98 13.835 -5.702 -3.962 779 HD12 LEU 98 2HD1 LEU 98 13.703 -6.017 -5.709 780 HD13 LEU 98 3HD1 LEU 98 12.977 -4.549 -5.012 781 HD21 LEU 98 3HD2 LEU 98 11.022 -8.093 -5.548 782 HD22 LEU 98 1HD2 LEU 98 12.770 -7.901 -5.825 783 HD23 LEU 98 2HD2 LEU 98 12.176 -8.467 -4.244 784 H LYS 99 HN LYS 99 9.717 -5.560 -0.731 785 HA LYS 99 HA LYS 99 10.786 -7.071 1.327 786 HB2 LYS 99 2HB LYS 99 10.346 -4.722 1.582 787 HB3 LYS 99 3HB LYS 99 8.632 -4.943 1.298 788 HG2 LYS 99 2HG LYS 99 8.489 -6.370 3.363 789 HG3 LYS 99 3HG LYS 99 10.197 -6.103 3.654 790 HD2 LYS 99 2HD LYS 99 9.668 -3.572 3.634 791 HD3 LYS 99 3HD LYS 99 7.974 -4.016 3.668 792 HE2 LYS 99 2HE LYS 99 9.993 -5.014 5.730 793 HE3 LYS 99 3HE LYS 99 9.043 -3.558 5.953 794 HZ1 LYS 99 2HZ LYS 99 7.035 -5.052 5.541 795 HZ3 LYS 99 1HZ LYS 99 7.808 -5.290 6.954 796 H LYS 100 HN LYS 100 7.470 -7.013 -0.087 797 HA LYS 100 HA LYS 100 6.469 -8.881 1.811 798 HB2 LYS 100 2HB LYS 100 5.192 -7.101 0.454 799 HB3 LYS 100 3HB LYS 100 5.252 -8.239 -0.877 800 HG2 LYS 100 2HG LYS 100 4.227 -9.990 0.670 801 HG3 LYS 100 3HG LYS 100 4.030 -8.735 1.876 802 HD2 LYS 100 2HD LYS 100 2.655 -7.406 0.230 803 HD3 LYS 100 3HD LYS 100 2.806 -8.717 -0.923 804 HE2 LYS 100 2HE LYS 100 1.486 -8.887 1.828 805 HE3 LYS 100 3HE LYS 100 0.656 -8.888 0.284 806 HZ1 LYS 100 2HZ LYS 100 0.844 -11.130 0.576 807 HZ3 LYS 100 1HZ LYS 100 2.154 -11.045 1.539 808 H ALA 101 HN ALA 101 8.452 -9.073 -1.032 809 HA ALA 101 HA ALA 101 7.651 -11.737 -1.733 810 HB1 ALA 101 3HB ALA 101 8.713 -11.175 -3.630 811 HB2 ALA 101 1HB ALA 101 9.092 -9.593 -2.906 812 HB3 ALA 101 2HB ALA 101 10.242 -10.943 -2.749 813 H THR 102 HN THR 102 10.215 -10.122 0.193 814 HA THR 102 HA THR 102 11.613 -12.594 0.652 815 HB THR 102 HB THR 102 13.136 -11.164 1.864 816 HG1 THR 102 HG1 THR 102 12.291 -9.344 2.906 817 HG21 THR 102 1HG2 THR 102 12.227 -8.870 0.269 818 HG22 THR 102 2HG2 THR 102 13.730 -9.811 0.116 819 HG23 THR 102 3HG2 THR 102 12.249 -10.360 -0.705 820 H ASN 103 HN ASN 103 9.383 -10.456 2.517 821 HA ASN 103 HA ASN 103 9.492 -11.518 4.924 822 HB2 ASN 103 2HB ASN 103 7.848 -9.767 4.150 823 HB3 ASN 103 3HB ASN 103 6.893 -11.018 3.378 824 HD21 ASN 103 1HD2 ASN 103 5.080 -10.955 4.537 825 HD22 ASN 103 2HD2 ASN 103 4.949 -11.266 6.236 826 H GLU 104 HN GLU 104 7.095 -12.719 2.441 827 HA GLU 104 HA GLU 104 6.389 -14.982 3.781 828 HB2 GLU 104 2HB GLU 104 5.653 -15.827 1.516 829 HB3 GLU 104 3HB GLU 104 5.099 -14.207 1.892 830 HG2 GLU 104 2HG GLU 104 6.946 -13.233 0.550 831 HG3 GLU 104 3HG GLU 104 7.584 -14.832 0.227 832 HE2 GLU 104 HE2 GLU 104 4.724 -13.054 -1.640 833 HHA HEC 500 HHA HEC 500 24.027 -6.948 -5.589 834 HHB HEC 500 HHB HEC 500 17.917 -5.060 -5.433 835 HHC HEC 500 HHC HEC 500 17.764 -5.964 -11.816 836 HHD HEC 500 HHD HEC 500 23.186 -9.338 -11.413 837 HMA1 HEC 500 1HMA HEC 500 18.773 -5.122 -3.274 838 HMA2 HEC 500 2HMA HEC 500 20.316 -5.132 -2.413 839 HMA3 HEC 500 3HMA HEC 500 19.897 -3.748 -3.440 840 HAA1 HEC 500 1HAA HEC 500 23.810 -5.944 -3.831 841 HAA2 HEC 500 2HAA HEC 500 22.694 -5.099 -2.883 842 HBA1 HEC 500 1HBA HEC 500 23.194 -8.052 -2.982 843 HBA2 HEC 500 2HBA HEC 500 22.940 -7.000 -1.576 844 HMB1 HEC 500 1HMB HEC 500 14.729 -5.299 -7.456 845 HMB2 HEC 500 2HMB HEC 500 15.773 -5.272 -6.052 846 HMB3 HEC 500 3HMB HEC 500 15.569 -3.784 -7.002 847 HAB HEC 500 HAB HEC 500 16.135 -4.669 -11.221 848 HBB1 HEC 500 1HBB HEC 500 14.515 -3.745 -8.881 849 HBB2 HEC 500 2HBB HEC 500 15.625 -2.841 -9.945 850 HBB3 HEC 500 3HBB HEC 500 14.110 -3.454 -10.577 851 HMC1 HEC 500 1HMC HEC 500 18.090 -8.583 -13.756 852 HMC2 HEC 500 2HMC HEC 500 18.104 -6.814 -13.793 853 HMC3 HEC 500 3HMC HEC 500 19.284 -7.705 -14.734 854 HAC HEC 500 HAC HEC 500 22.098 -10.150 -13.021 855 HBC1 HEC 500 1HBC HEC 500 20.842 -8.761 -15.389 856 HBC2 HEC 500 2HBC HEC 500 22.408 -8.315 -14.676 857 HBC3 HEC 500 3HBC HEC 500 22.199 -9.916 -15.380 858 HMD1 HEC 500 1HMD HEC 500 25.141 -10.763 -9.691 859 HMD2 HEC 500 2HMD HEC 500 25.444 -9.446 -10.836 860 HMD3 HEC 500 3HMD HEC 500 26.401 -9.596 -9.335 861 HAD1 HEC 500 1HAD HEC 500 25.806 -7.829 -6.043 862 HAD2 HEC 500 2HAD HEC 500 26.175 -9.306 -6.827 863 HBD1 HEC 500 1HBD HEC 500 27.564 -8.269 -8.390 864 HBD2 HEC 500 2HBD HEC 500 26.539 -6.818 -8.449 Start of MODEL 3 1 H1 GLY 1 HN GLY 1 2.080 -0.469 0.693 2 HA2 GLY 1 1HA GLY 1 1.870 0.641 -1.889 3 HA3 GLY 1 2HA GLY 1 3.268 -0.152 -1.190 4 H ASP 2 HN ASP 2 0.754 -0.377 -3.523 5 HA ASP 2 HA ASP 2 0.164 -2.982 -3.713 6 HB2 ASP 2 2HB ASP 2 0.606 -0.782 -5.712 7 HB3 ASP 2 3HB ASP 2 0.479 -2.405 -6.357 8 HD2 ASP 2 HD2 ASP 2 -2.792 -1.769 -4.285 9 H VAL 3 HN VAL 3 1.466 -4.813 -3.850 10 HA VAL 3 HA VAL 3 4.245 -4.511 -4.496 11 HB VAL 3 HB VAL 3 4.501 -6.610 -3.616 12 HG11 VAL 3 1HG1 VAL 3 3.013 -4.884 -2.169 13 HG12 VAL 3 2HG1 VAL 3 1.905 -6.276 -2.206 14 HG13 VAL 3 3HG1 VAL 3 3.552 -6.466 -1.557 15 HG21 VAL 3 3HG2 VAL 3 2.590 -8.293 -3.493 16 HG22 VAL 3 1HG2 VAL 3 1.701 -7.214 -4.594 17 HG23 VAL 3 2HG2 VAL 3 3.238 -7.945 -5.114 18 H GLU 4 HN GLU 4 1.282 -5.913 -5.985 19 HA GLU 4 HA GLU 4 2.343 -7.301 -8.013 20 HB2 GLU 4 2HB GLU 4 -0.058 -5.424 -8.172 21 HB3 GLU 4 3HB GLU 4 0.272 -6.730 -9.293 22 HG2 GLU 4 2HG GLU 4 -1.023 -7.983 -7.883 23 HG3 GLU 4 3HG GLU 4 0.429 -8.089 -6.908 24 HE2 GLU 4 HE2 GLU 4 -1.430 -4.916 -5.593 25 H LYS 5 HN LYS 5 1.672 -3.730 -8.015 26 HA LYS 5 HA LYS 5 2.546 -3.194 -10.564 27 HB2 LYS 5 2HB LYS 5 2.281 -1.634 -8.029 28 HB3 LYS 5 3HB LYS 5 3.194 -0.910 -9.337 29 HG2 LYS 5 2HG LYS 5 0.871 -0.235 -9.585 30 HG3 LYS 5 3HG LYS 5 1.252 -1.341 -10.891 31 HD2 LYS 5 2HD LYS 5 0.274 -3.228 -9.485 32 HD3 LYS 5 3HD LYS 5 -0.231 -2.030 -8.311 33 HE2 LYS 5 2HE LYS 5 -2.169 -2.160 -9.597 34 HE3 LYS 5 3HE LYS 5 -1.350 -0.856 -10.433 35 HZ1 LYS 5 2HZ LYS 5 -1.892 -2.327 -12.140 36 HZ3 LYS 5 1HZ LYS 5 -1.588 -3.671 -11.271 37 H GLY 6 HN GLY 6 4.382 -3.897 -7.600 38 HA2 GLY 6 1HA GLY 6 6.902 -3.118 -8.832 39 HA3 GLY 6 2HA GLY 6 6.643 -3.722 -7.206 40 H LYS 7 HN LYS 7 4.836 -5.946 -8.492 41 HA LYS 7 HA LYS 7 6.933 -7.861 -8.657 42 HB2 LYS 7 2HB LYS 7 4.508 -8.082 -7.724 43 HB3 LYS 7 3HB LYS 7 4.059 -8.382 -9.391 44 HG2 LYS 7 2HG LYS 7 5.178 -10.415 -9.483 45 HG3 LYS 7 3HG LYS 7 6.438 -9.901 -8.381 46 HD2 LYS 7 2HD LYS 7 4.901 -11.650 -7.406 47 HD3 LYS 7 3HD LYS 7 4.989 -10.185 -6.449 48 HE2 LYS 7 2HE LYS 7 2.631 -11.091 -6.810 49 HE3 LYS 7 3HE LYS 7 2.847 -9.408 -7.245 50 HZ1 LYS 7 2HZ LYS 7 3.029 -11.614 -9.223 51 HZ3 LYS 7 1HZ LYS 7 2.989 -10.021 -9.554 52 H LYS 8 HN LYS 8 4.953 -5.994 -10.952 53 HA LYS 8 HA LYS 8 5.916 -7.584 -13.172 54 HB2 LYS 8 2HB LYS 8 4.133 -5.131 -13.119 55 HB3 LYS 8 3HB LYS 8 4.468 -6.129 -14.519 56 HG2 LYS 8 2HG LYS 8 3.131 -7.094 -11.946 57 HG3 LYS 8 3HG LYS 8 2.298 -6.735 -13.444 58 HD2 LYS 8 2HD LYS 8 3.847 -8.488 -14.560 59 HD3 LYS 8 3HD LYS 8 4.322 -8.957 -12.939 60 HE2 LYS 8 2HE LYS 8 1.694 -9.102 -12.519 61 HE3 LYS 8 3HE LYS 8 1.612 -9.217 -14.266 62 HZ1 LYS 8 2HZ LYS 8 2.433 -11.212 -12.416 63 HZ3 LYS 8 1HZ LYS 8 3.616 -10.966 -13.508 64 H ILE 9 HN ILE 9 6.704 -4.669 -11.375 65 HA ILE 9 HA ILE 9 8.315 -3.601 -13.514 66 HB ILE 9 HB ILE 9 7.764 -2.767 -10.672 67 HG12 ILE 9 2HG1 ILE 9 7.119 -1.304 -13.237 68 HG13 ILE 9 3HG1 ILE 9 6.034 -2.498 -12.549 69 HG21 ILE 9 1HG2 ILE 9 9.039 -0.663 -12.055 70 HG22 ILE 9 2HG2 ILE 9 9.629 -1.569 -10.641 71 HG23 ILE 9 3HG2 ILE 9 10.051 -2.109 -12.284 72 HD11 ILE 9 3HD1 ILE 9 6.715 0.237 -11.569 73 HD12 ILE 9 1HD1 ILE 9 5.199 -0.683 -11.416 74 HD13 ILE 9 2HD1 ILE 9 6.555 -1.012 -10.311 75 H PHE 10 HN PHE 10 8.642 -5.673 -10.657 76 HA PHE 10 HA PHE 10 11.484 -5.425 -10.553 77 HB2 PHE 10 2HB PHE 10 10.258 -6.013 -8.534 78 HB3 PHE 10 3HB PHE 10 9.289 -7.204 -9.379 79 HD1 PHE 10 HD1 PHE 10 12.759 -6.517 -8.240 80 HD2 PHE 10 HD2 PHE 10 9.917 -9.457 -9.373 81 HE1 PHE 10 HE1 PHE 10 14.333 -8.325 -7.496 82 HE2 PHE 10 HE2 PHE 10 11.490 -11.265 -8.629 83 HZ PHE 10 HZ PHE 10 13.680 -10.677 -7.700 84 H ILE 11 HN ILE 11 9.155 -7.325 -12.378 85 HA ILE 11 HA ILE 11 11.107 -9.369 -12.999 86 HB ILE 11 HB ILE 11 8.239 -8.916 -13.816 87 HG12 ILE 11 2HG1 ILE 11 9.363 -11.162 -12.139 88 HG13 ILE 11 3HG1 ILE 11 8.878 -9.637 -11.425 89 HG21 ILE 11 1HG2 ILE 11 8.256 -10.911 -15.054 90 HG22 ILE 11 2HG2 ILE 11 9.712 -10.034 -15.578 91 HG23 ILE 11 3HG2 ILE 11 9.854 -11.389 -14.433 92 HD11 ILE 11 3HD1 ILE 11 6.671 -10.105 -12.944 93 HD12 ILE 11 1HD1 ILE 11 7.194 -11.782 -12.656 94 HD13 ILE 11 2HD1 ILE 11 6.844 -10.710 -11.279 95 H MET 12 HN MET 12 9.182 -6.852 -14.780 96 HA MET 12 HA MET 12 10.434 -7.228 -17.193 97 HB2 MET 12 2HB MET 12 8.978 -4.947 -15.820 98 HB3 MET 12 3HB MET 12 9.771 -4.608 -17.347 99 HG2 MET 12 2HG MET 12 8.518 -6.744 -18.230 100 HG3 MET 12 3HG MET 12 7.519 -6.577 -16.800 101 HE1 MET 12 3HE MET 12 4.960 -4.936 -17.531 102 HE2 MET 12 1HE MET 12 6.136 -5.077 -16.203 103 HE3 MET 12 2HE MET 12 5.766 -3.481 -16.897 104 H LYS 13 HN LYS 13 11.710 -5.944 -14.250 105 HA LYS 13 HA LYS 13 13.898 -4.679 -15.748 106 HB2 LYS 13 2HB LYS 13 12.813 -4.044 -12.990 107 HB3 LYS 13 3HB LYS 13 14.285 -3.363 -13.653 108 HG2 LYS 13 2HG LYS 13 12.922 -2.514 -15.631 109 HG3 LYS 13 3HG LYS 13 11.475 -3.068 -14.812 110 HD2 LYS 13 2HD LYS 13 12.490 -1.627 -12.780 111 HD3 LYS 13 3HD LYS 13 13.321 -0.796 -14.080 112 HE2 LYS 13 2HE LYS 13 10.333 -1.293 -14.273 113 HE3 LYS 13 3HE LYS 13 10.935 0.046 -13.316 114 HZ1 LYS 13 2HZ LYS 13 10.592 0.855 -15.517 115 HZ3 LYS 13 1HZ LYS 13 11.378 -0.389 -16.215 116 H CYS 14 HN CYS 14 12.907 -6.927 -13.148 117 HA CYS 14 HA CYS 14 15.642 -7.962 -13.220 118 HB2 CYS 14 2HB CYS 14 14.150 -8.225 -10.672 119 HB3 CYS 14 3HB CYS 14 15.870 -8.055 -10.964 120 H SER 15 HN SER 15 14.712 -9.446 -14.864 121 HA SER 15 HA SER 15 12.984 -11.429 -13.602 122 HB2 SER 15 2HB SER 15 12.420 -11.935 -16.143 123 HB3 SER 15 3HB SER 15 11.597 -10.643 -15.292 124 HG SER 15 HG SER 15 13.655 -10.487 -17.276 125 H GLN 16 HN GLN 16 13.568 -13.640 -13.872 126 HA GLN 16 HA GLN 16 15.070 -15.235 -13.916 127 HB2 GLN 16 2HB GLN 16 14.940 -14.197 -16.743 128 HB3 GLN 16 3HB GLN 16 16.101 -15.459 -16.381 129 HG2 GLN 16 2HG GLN 16 14.431 -17.023 -15.789 130 HG3 GLN 16 3HG GLN 16 13.253 -15.781 -15.413 131 HE21 GLN 16 1HE2 GLN 16 12.019 -14.866 -16.989 132 HE22 GLN 16 2HE2 GLN 16 11.939 -15.437 -18.622 133 H CYS 17 HN CYS 17 16.175 -12.939 -12.715 134 HA CYS 17 HA CYS 17 18.961 -13.310 -13.471 135 HB2 CYS 17 2HB CYS 17 17.693 -11.074 -14.306 136 HB3 CYS 17 3HB CYS 17 18.203 -10.546 -12.714 137 H HIS 18 HN HIS 18 16.549 -11.829 -11.194 138 HA HIS 18 HA HIS 18 18.404 -12.390 -9.013 139 HB2 HIS 18 2HB HIS 18 16.336 -10.354 -9.536 140 HB3 HIS 18 3HB HIS 18 16.301 -11.009 -7.911 141 HD1 HIS 18 HD1 HIS 18 18.931 -11.078 -6.790 142 HD2 HIS 18 HD2 HIS 18 18.028 -8.232 -9.737 143 HE1 HIS 18 HE1 HIS 18 20.677 -9.231 -6.560 144 H THR 19 HN THR 19 16.814 -12.775 -6.851 145 HA THR 19 HA THR 19 14.722 -14.664 -7.472 146 HB THR 19 HB THR 19 15.957 -16.476 -6.126 147 HG1 THR 19 HG1 THR 19 18.385 -15.952 -6.276 148 HG21 THR 19 1HG2 THR 19 17.545 -15.601 -8.585 149 HG22 THR 19 2HG2 THR 19 17.307 -17.256 -7.973 150 HG23 THR 19 3HG2 THR 19 15.950 -16.379 -8.721 151 H VAL 20 HN VAL 20 13.218 -14.823 -5.858 152 HA VAL 20 HA VAL 20 13.898 -13.352 -3.404 153 HB VAL 20 HB VAL 20 11.586 -12.619 -3.328 154 HG11 VAL 20 1HG1 VAL 20 12.190 -11.811 -6.098 155 HG12 VAL 20 2HG1 VAL 20 11.996 -10.825 -4.628 156 HG13 VAL 20 3HG1 VAL 20 13.550 -11.628 -4.963 157 HG21 VAL 20 3HG2 VAL 20 10.291 -12.946 -5.604 158 HG22 VAL 20 1HG2 VAL 20 11.316 -14.397 -5.730 159 HG23 VAL 20 2HG2 VAL 20 10.231 -14.192 -4.333 160 H GLU 21 HN GLU 21 12.035 -16.032 -4.937 161 HA GLU 21 HA GLU 21 10.886 -17.070 -2.716 162 HB2 GLU 21 2HB GLU 21 11.153 -19.324 -3.976 163 HB3 GLU 21 3HB GLU 21 10.277 -18.038 -4.780 164 HG2 GLU 21 2HG GLU 21 12.073 -17.547 -6.252 165 HG3 GLU 21 3HG GLU 21 13.266 -18.293 -5.207 166 HE2 GLU 21 HE2 GLU 21 10.326 -20.276 -6.131 167 H LYS 22 HN LYS 22 11.467 -18.768 -1.198 168 HA LYS 22 HA LYS 22 14.221 -18.592 -0.421 169 HB2 LYS 22 2HB LYS 22 12.075 -18.630 1.062 170 HB3 LYS 22 3HB LYS 22 12.159 -20.369 0.867 171 HG2 LYS 22 2HG LYS 22 14.666 -18.873 1.661 172 HG3 LYS 22 3HG LYS 22 13.434 -19.156 2.875 173 HD2 LYS 22 2HD LYS 22 14.650 -21.361 1.146 174 HD3 LYS 22 3HD LYS 22 15.221 -20.958 2.753 175 HE2 LYS 22 2HE LYS 22 12.509 -22.091 1.965 176 HE3 LYS 22 3HE LYS 22 13.695 -22.791 3.048 177 HZ1 LYS 22 2HZ LYS 22 12.262 -21.831 4.552 178 HZ3 LYS 22 1HZ LYS 22 11.821 -20.604 3.576 179 H GLY 23 HN GLY 23 11.980 -21.062 -1.784 180 HA2 GLY 23 1HA GLY 23 14.090 -23.058 -1.833 181 HA3 GLY 23 2HA GLY 23 12.423 -23.245 -2.339 182 H GLY 24 HN GLY 24 15.168 -21.036 -3.267 183 HA2 GLY 24 1HA GLY 24 14.846 -21.963 -6.048 184 HA3 GLY 24 2HA GLY 24 14.815 -20.251 -5.674 185 H LYS 25 HN LYS 25 16.764 -21.393 -7.405 186 HA LYS 25 HA LYS 25 19.163 -21.740 -5.834 187 HB2 LYS 25 2HB LYS 25 20.141 -22.538 -7.761 188 HB3 LYS 25 3HB LYS 25 18.468 -22.995 -8.007 189 HG2 LYS 25 2HG LYS 25 18.119 -20.885 -9.347 190 HG3 LYS 25 3HG LYS 25 19.818 -20.502 -9.147 191 HD2 LYS 25 2HD LYS 25 19.505 -21.585 -11.319 192 HD3 LYS 25 3HD LYS 25 20.428 -22.654 -10.283 193 HE2 LYS 25 2HE LYS 25 18.448 -24.010 -9.793 194 HE3 LYS 25 3HE LYS 25 17.399 -22.861 -10.599 195 HZ1 LYS 25 2HZ LYS 25 18.294 -24.962 -11.868 196 HZ3 LYS 25 1HZ LYS 25 19.595 -24.026 -12.160 197 H HIS 26 HN HIS 26 21.178 -20.450 -6.885 198 HA HIS 26 HA HIS 26 20.411 -17.667 -6.552 199 HB2 HIS 26 2HB HIS 26 22.997 -19.190 -6.294 200 HB3 HIS 26 3HB HIS 26 22.999 -17.445 -6.448 201 HD1 HIS 26 HD1 HIS 26 22.297 -16.052 -4.404 202 HD2 HIS 26 HD2 HIS 26 21.805 -20.183 -3.866 203 HE1 HIS 26 HE1 HIS 26 21.806 -16.397 -1.924 204 H LYS 27 HN LYS 27 19.446 -17.343 -8.649 205 HA LYS 27 HA LYS 27 20.617 -18.020 -11.048 206 HB2 LYS 27 2HB LYS 27 18.803 -15.705 -10.315 207 HB3 LYS 27 3HB LYS 27 19.218 -16.134 -11.962 208 HG2 LYS 27 2HG LYS 27 17.907 -18.027 -9.953 209 HG3 LYS 27 3HG LYS 27 17.046 -17.148 -11.201 210 HD2 LYS 27 2HD LYS 27 19.169 -19.301 -11.598 211 HD3 LYS 27 3HD LYS 27 17.473 -19.397 -12.027 212 HE2 LYS 27 2HE LYS 27 18.020 -17.259 -13.517 213 HE3 LYS 27 3HE LYS 27 19.677 -17.811 -13.368 214 HZ1 LYS 27 2HZ LYS 27 18.236 -20.072 -14.000 215 HZ3 LYS 27 1HZ LYS 27 19.181 -19.229 -15.024 216 H THR 28 HN THR 28 21.130 -15.876 -12.637 217 HA THR 28 HA THR 28 23.741 -15.334 -12.337 218 HB THR 28 HB THR 28 21.748 -13.250 -13.339 219 HG1 THR 28 HG1 THR 28 21.758 -14.723 -15.252 220 HG21 THR 28 1HG2 THR 28 24.193 -12.749 -13.625 221 HG22 THR 28 2HG2 THR 28 24.407 -14.326 -14.421 222 HG23 THR 28 3HG2 THR 28 23.408 -13.070 -15.189 223 H GLY 29 HN GLY 29 21.090 -13.836 -10.514 224 HA2 GLY 29 1HA GLY 29 23.104 -12.173 -9.124 225 HA3 GLY 29 2HA GLY 29 21.421 -11.734 -9.341 226 HA PRO 30 HA PRO 30 22.031 -14.212 -5.451 227 HB2 PRO 30 2HB PRO 30 22.302 -12.258 -3.559 228 HB3 PRO 30 3HB PRO 30 23.663 -13.117 -4.251 229 HG2 PRO 30 2HG PRO 30 22.744 -10.360 -4.791 230 HG3 PRO 30 3HG PRO 30 24.304 -11.083 -5.129 231 HD2 PRO 30 2HD PRO 30 22.209 -10.561 -7.018 232 HD3 PRO 30 3HD PRO 30 23.721 -11.388 -7.333 233 H ASN 31 HN ASN 31 20.446 -14.754 -3.900 234 HA ASN 31 HA ASN 31 17.951 -13.655 -4.692 235 HB2 ASN 31 2HB ASN 31 18.414 -16.103 -4.013 236 HB3 ASN 31 3HB ASN 31 18.529 -15.545 -2.355 237 HD21 ASN 31 1HD2 ASN 31 16.571 -17.088 -4.305 238 HD22 ASN 31 2HD2 ASN 31 15.004 -16.563 -3.788 239 H LEU 32 HN LEU 32 16.422 -12.594 -3.152 240 HA LEU 32 HA LEU 32 17.833 -11.319 -0.911 241 HB2 LEU 32 2HB LEU 32 15.518 -10.104 -2.395 242 HB3 LEU 32 3HB LEU 32 16.642 -9.333 -1.293 243 HG LEU 32 HG LEU 32 17.287 -8.550 -3.384 244 HD11 LEU 32 1HD1 LEU 32 19.081 -9.899 -1.933 245 HD12 LEU 32 2HD1 LEU 32 19.182 -10.844 -3.438 246 HD13 LEU 32 3HD1 LEU 32 19.490 -9.092 -3.466 247 HD21 LEU 32 3HD2 LEU 32 15.857 -10.429 -4.523 248 HD22 LEU 32 1HD2 LEU 32 17.181 -9.634 -5.409 249 HD23 LEU 32 2HD2 LEU 32 17.431 -11.243 -4.691 250 H HIS 33 HN HIS 33 17.266 -12.772 0.713 251 HA HIS 33 HA HIS 33 14.387 -13.187 1.038 252 HB2 HIS 33 2HB HIS 33 15.643 -15.246 0.754 253 HB3 HIS 33 3HB HIS 33 16.749 -14.798 2.039 254 HD1 HIS 33 HD1 HIS 33 16.103 -16.964 3.370 255 HD2 HIS 33 HD2 HIS 33 12.933 -14.291 2.739 256 HE1 HIS 33 HE1 HIS 33 14.221 -17.709 4.923 257 H GLY 34 HN GLY 34 17.456 -12.582 2.885 258 HA2 GLY 34 1HA GLY 34 15.837 -11.417 5.050 259 HA3 GLY 34 2HA GLY 34 17.494 -11.976 5.163 260 H LEU 35 HN LEU 35 16.465 -10.116 2.324 261 HA LEU 35 HA LEU 35 18.447 -8.313 2.335 262 HB2 LEU 35 2HB LEU 35 16.648 -8.697 0.622 263 HB3 LEU 35 3HB LEU 35 15.600 -7.663 1.573 264 HG LEU 35 HG LEU 35 17.519 -5.904 1.327 265 HD11 LEU 35 1HD1 LEU 35 18.141 -6.975 -1.320 266 HD12 LEU 35 2HD1 LEU 35 19.209 -6.273 -0.080 267 HD13 LEU 35 3HD1 LEU 35 18.754 -7.993 0.007 268 HD21 LEU 35 3HD2 LEU 35 16.533 -5.561 -1.171 269 HD22 LEU 35 1HD2 LEU 35 15.324 -6.680 -0.496 270 HD23 LEU 35 2HD2 LEU 35 15.659 -5.134 0.319 271 H PHE 36 HN PHE 36 15.195 -7.719 3.855 272 HA PHE 36 HA PHE 36 16.215 -5.390 5.168 273 HB2 PHE 36 2HB PHE 36 13.644 -7.065 5.198 274 HB3 PHE 36 3HB PHE 36 13.824 -5.681 6.258 275 HD1 PHE 36 HD1 PHE 36 13.826 -6.678 2.684 276 HD2 PHE 36 HD2 PHE 36 13.392 -3.510 5.474 277 HE1 PHE 36 HE1 PHE 36 13.034 -5.166 0.843 278 HE2 PHE 36 HE2 PHE 36 12.598 -1.998 3.634 279 HZ PHE 36 HZ PHE 36 12.429 -2.845 1.341 280 H GLY 37 HN GLY 37 18.005 -6.353 6.401 281 HA2 GLY 37 1HA GLY 37 17.972 -6.557 8.948 282 HA3 GLY 37 2HA GLY 37 17.129 -8.062 8.639 283 H ARG 38 HN ARG 38 18.952 -7.948 5.950 284 HA ARG 38 HA ARG 38 21.139 -9.315 7.290 285 HB2 ARG 38 2HB ARG 38 19.721 -10.658 5.681 286 HB3 ARG 38 3HB ARG 38 20.190 -9.570 4.390 287 HG2 ARG 38 2HG ARG 38 22.569 -10.188 4.679 288 HG3 ARG 38 3HG ARG 38 22.170 -11.193 6.058 289 HD2 ARG 38 2HD ARG 38 21.561 -11.670 3.129 290 HD3 ARG 38 3HD ARG 38 22.301 -12.759 4.286 291 HE ARG 38 HE ARG 38 19.413 -12.264 3.935 292 HH11 ARG 38 2HH2 ARG 38 21.931 -13.674 5.989 293 HH12 ARG 38 1HH2 ARG 38 20.836 -14.728 6.821 294 HH22 ARG 38 HH1 ARG 38 18.511 -14.699 6.240 295 H LYS 39 HN LYS 39 23.209 -8.468 7.097 296 HA LYS 39 HA LYS 39 23.615 -5.939 6.064 297 HB2 LYS 39 2HB LYS 39 25.039 -7.766 7.585 298 HB3 LYS 39 3HB LYS 39 26.011 -7.632 6.134 299 HG2 LYS 39 2HG LYS 39 26.866 -5.812 7.280 300 HG3 LYS 39 3HG LYS 39 25.534 -5.004 6.476 301 HD2 LYS 39 2HD LYS 39 25.371 -4.350 8.775 302 HD3 LYS 39 3HD LYS 39 24.103 -5.537 8.543 303 HE2 LYS 39 2HE LYS 39 25.294 -6.038 10.628 304 HE3 LYS 39 3HE LYS 39 25.605 -7.319 9.472 305 HZ1 LYS 39 2HZ LYS 39 27.556 -6.061 10.761 306 HZ3 LYS 39 1HZ LYS 39 27.499 -5.101 9.447 307 H THR 40 HN THR 40 25.856 -5.921 4.436 308 HA THR 40 HA THR 40 24.730 -7.033 1.957 309 HB THR 40 HB THR 40 26.344 -5.170 1.018 310 HG1 THR 40 HG1 THR 40 27.363 -4.935 3.179 311 HG21 THR 40 1HG2 THR 40 24.229 -4.286 0.761 312 HG22 THR 40 2HG2 THR 40 23.687 -4.906 2.339 313 HG23 THR 40 3HG2 THR 40 24.606 -3.384 2.248 314 H GLY 41 HN GLY 41 25.600 -8.906 1.339 315 HA2 GLY 41 1HA GLY 41 27.414 -10.045 0.396 316 HA3 GLY 41 2HA GLY 41 28.528 -9.109 1.374 317 H GLN 42 HN GLN 42 25.516 -10.885 2.338 318 HA GLN 42 HA GLN 42 27.222 -12.412 4.147 319 HB2 GLN 42 2HB GLN 42 24.259 -12.124 4.616 320 HB3 GLN 42 3HB GLN 42 25.548 -12.347 5.783 321 HG2 GLN 42 2HG GLN 42 24.749 -9.810 4.322 322 HG3 GLN 42 3HG GLN 42 24.900 -10.069 6.049 323 HE21 GLN 42 1HE2 GLN 42 27.364 -11.525 5.950 324 HE22 GLN 42 2HE2 GLN 42 28.641 -10.415 5.579 325 H ALA 43 HN ALA 43 25.108 -12.497 1.409 326 HA ALA 43 HA ALA 43 23.709 -14.770 1.520 327 HB1 ALA 43 3HB ALA 43 25.242 -13.339 -0.601 328 HB2 ALA 43 1HB ALA 43 24.714 -14.995 -0.985 329 HB3 ALA 43 2HB ALA 43 23.515 -13.761 -0.525 330 HA PRO 44 HA PRO 44 26.979 -17.576 2.549 331 HB2 PRO 44 2HB PRO 44 25.411 -19.421 3.815 332 HB3 PRO 44 3HB PRO 44 26.152 -18.066 4.641 333 HG2 PRO 44 2HG PRO 44 23.327 -18.436 3.852 334 HG3 PRO 44 3HG PRO 44 24.002 -17.323 5.024 335 HD2 PRO 44 2HD PRO 44 23.107 -16.690 2.374 336 HD3 PRO 44 3HD PRO 44 23.888 -15.602 3.504 337 H GLY 45 HN GLY 45 24.616 -17.597 0.322 338 HA2 GLY 45 1HA GLY 45 25.265 -20.339 -0.557 339 HA3 GLY 45 2HA GLY 45 23.831 -19.430 -0.988 340 H TYR 46 HN TYR 46 25.863 -16.958 -1.130 341 HA TYR 46 HA TYR 46 27.473 -17.572 -3.395 342 HB2 TYR 46 2HB TYR 46 25.116 -17.481 -4.352 343 HB3 TYR 46 3HB TYR 46 24.889 -15.904 -3.622 344 HD1 TYR 46 HD1 TYR 46 27.869 -17.204 -5.476 345 HD2 TYR 46 HD2 TYR 46 24.584 -14.463 -5.447 346 HE1 TYR 46 HE1 TYR 46 28.767 -16.093 -7.580 347 HE2 TYR 46 HE2 TYR 46 25.493 -13.362 -7.550 348 HH TYR 46 HH TYR 46 28.575 -14.418 -8.948 349 H SER 47 HN SER 47 29.200 -16.228 -3.258 350 HA SER 47 HA SER 47 28.867 -13.876 -1.615 351 HB2 SER 47 2HB SER 47 31.315 -15.335 -2.689 352 HB3 SER 47 3HB SER 47 31.430 -13.809 -1.834 353 HG SER 47 HG SER 47 30.953 -14.769 0.054 354 H TYR 48 HN TYR 48 29.311 -11.741 -2.368 355 HA TYR 48 HA TYR 48 29.208 -11.496 -5.272 356 HB2 TYR 48 2HB TYR 48 29.152 -9.270 -3.180 357 HB3 TYR 48 3HB TYR 48 28.305 -9.317 -4.714 358 HD1 TYR 48 HD2 TYR 48 27.299 -12.289 -4.154 359 HD2 TYR 48 HD1 TYR 48 27.118 -8.603 -1.989 360 HE1 TYR 48 HE2 TYR 48 25.195 -13.082 -2.965 361 HE2 TYR 48 HE1 TYR 48 25.016 -9.409 -0.807 362 HH TYR 48 HH TYR 48 23.330 -12.218 -1.844 363 H THR 49 HN THR 49 30.322 -9.088 -5.808 364 HA THR 49 HA THR 49 33.028 -9.624 -5.974 365 HB THR 49 HB THR 49 33.039 -7.032 -6.436 366 HG1 THR 49 HG1 THR 49 30.744 -6.325 -6.632 367 HG21 THR 49 1HG2 THR 49 32.785 -8.663 -8.308 368 HG22 THR 49 2HG2 THR 49 31.059 -8.846 -7.916 369 HG23 THR 49 3HG2 THR 49 31.674 -7.290 -8.525 370 H ALA 50 HN ALA 50 34.685 -7.768 -5.148 371 HA ALA 50 HA ALA 50 34.642 -8.149 -2.274 372 HB1 ALA 50 3HB ALA 50 36.700 -8.717 -3.322 373 HB2 ALA 50 1HB ALA 50 36.703 -7.231 -4.302 374 HB3 ALA 50 2HB ALA 50 36.989 -7.141 -2.549 375 H ALA 51 HN ALA 51 33.109 -6.055 -4.230 376 HA ALA 51 HA ALA 51 33.893 -3.644 -2.784 377 HB1 ALA 51 3HB ALA 51 32.182 -4.180 -5.239 378 HB2 ALA 51 1HB ALA 51 32.340 -2.574 -4.487 379 HB3 ALA 51 2HB ALA 51 33.772 -3.382 -5.169 380 H ASN 52 HN ASN 52 30.990 -5.670 -3.573 381 HA ASN 52 HA ASN 52 29.306 -4.195 -1.904 382 HB2 ASN 52 2HB ASN 52 28.718 -5.873 -3.824 383 HB3 ASN 52 3HB ASN 52 28.941 -7.139 -2.632 384 HD21 ASN 52 1HD2 ASN 52 27.766 -6.824 -0.537 385 HD22 ASN 52 2HD2 ASN 52 26.135 -6.241 -0.598 386 H LYS 53 HN LYS 53 31.097 -7.342 -1.587 387 HA LYS 53 HA LYS 53 30.191 -8.107 0.889 388 HB2 LYS 53 2HB LYS 53 31.812 -9.208 -0.897 389 HB3 LYS 53 3HB LYS 53 33.060 -8.547 0.141 390 HG2 LYS 53 2HG LYS 53 31.511 -9.638 2.070 391 HG3 LYS 53 3HG LYS 53 31.011 -10.671 0.746 392 HD2 LYS 53 2HD LYS 53 33.592 -10.941 0.285 393 HD3 LYS 53 3HD LYS 53 33.791 -10.325 1.913 394 HE2 LYS 53 2HE LYS 53 32.498 -12.156 2.860 395 HE3 LYS 53 3HE LYS 53 31.960 -12.681 1.276 396 HZ1 LYS 53 2HZ LYS 53 34.808 -12.693 2.122 397 HZ3 LYS 53 1HZ LYS 53 34.222 -13.308 0.734 398 H ASN 54 HN ASN 54 32.465 -5.541 -0.024 399 HA ASN 54 HA ASN 54 33.579 -5.260 2.528 400 HB2 ASN 54 2HB ASN 54 33.482 -3.653 -0.018 401 HB3 ASN 54 3HB ASN 54 33.898 -2.772 1.439 402 HD21 ASN 54 1HD2 ASN 54 34.548 -6.181 0.836 403 HD22 ASN 54 2HD2 ASN 54 36.276 -6.087 0.780 404 H LYS 55 HN LYS 55 30.670 -4.065 0.840 405 HA LYS 55 HA LYS 55 30.057 -1.872 2.410 406 HB2 LYS 55 2HB LYS 55 28.996 -2.870 0.216 407 HB3 LYS 55 3HB LYS 55 27.916 -3.682 1.332 408 HG2 LYS 55 2HG LYS 55 26.755 -1.682 0.988 409 HG3 LYS 55 3HG LYS 55 27.666 -1.281 2.430 410 HD2 LYS 55 2HD LYS 55 29.506 -0.398 0.798 411 HD3 LYS 55 3HD LYS 55 28.273 -0.485 -0.443 412 HE2 LYS 55 2HE LYS 55 27.932 1.700 0.283 413 HE3 LYS 55 3HE LYS 55 26.813 0.866 1.344 414 HZ1 LYS 55 2HZ LYS 55 28.339 2.410 2.529 415 HZ3 LYS 55 1HZ LYS 55 29.615 1.493 2.104 416 H GLY 56 HN GLY 56 29.009 -1.557 4.371 417 HA2 GLY 56 1HA GLY 56 28.255 -3.993 5.857 418 HA3 GLY 56 2HA GLY 56 29.336 -2.808 6.562 419 H ILE 57 HN ILE 57 26.082 -3.091 4.979 420 HA ILE 57 HA ILE 57 24.982 -1.442 7.075 421 HB ILE 57 HB ILE 57 23.982 0.174 5.566 422 HG12 ILE 57 2HG1 ILE 57 25.248 0.231 3.208 423 HG13 ILE 57 3HG1 ILE 57 25.300 -1.500 3.474 424 HG21 ILE 57 1HG2 ILE 57 26.995 0.070 5.264 425 HG22 ILE 57 2HG2 ILE 57 25.959 1.509 5.117 426 HG23 ILE 57 3HG2 ILE 57 26.116 0.681 6.685 427 HD11 ILE 57 3HD1 ILE 57 22.683 -0.104 3.989 428 HD12 ILE 57 1HD1 ILE 57 23.195 -0.328 2.298 429 HD13 ILE 57 2HD1 ILE 57 22.991 -1.742 3.360 430 H ILE 58 HN ILE 58 22.773 -1.849 7.406 431 HA ILE 58 HA ILE 58 21.866 -4.282 6.183 432 HB ILE 58 HB ILE 58 20.783 -2.459 8.323 433 HG12 ILE 58 2HG1 ILE 58 22.792 -3.987 8.725 434 HG13 ILE 58 3HG1 ILE 58 21.454 -4.097 9.851 435 HG21 ILE 58 1HG2 ILE 58 18.783 -3.223 7.458 436 HG22 ILE 58 2HG2 ILE 58 19.473 -4.779 6.939 437 HG23 ILE 58 3HG2 ILE 58 19.164 -4.474 8.666 438 HD11 ILE 58 3HD1 ILE 58 20.565 -6.074 8.604 439 HD12 ILE 58 1HD1 ILE 58 21.950 -5.971 7.491 440 HD13 ILE 58 2HD1 ILE 58 22.215 -6.352 9.209 441 H TRP 59 HN TRP 59 20.546 -4.484 4.448 442 HA TRP 59 HA TRP 59 19.892 -2.250 2.906 443 HB2 TRP 59 2HB TRP 59 19.098 -5.145 2.873 444 HB3 TRP 59 3HB TRP 59 18.325 -4.004 1.792 445 HD1 TRP 59 HD1 TRP 59 20.991 -6.378 1.578 446 HE1 TRP 59 HE1 TRP 59 22.855 -5.838 -0.210 447 HE3 TRP 59 HE3 TRP 59 19.756 -1.480 1.002 448 HZ2 TRP 59 HZ2 TRP 59 23.586 -3.474 -1.633 449 HZ3 TRP 59 HZ3 TRP 59 21.094 -0.126 -0.607 450 HH2 TRP 59 HH2 TRP 59 22.952 -1.048 -1.900 451 H GLY 60 HN GLY 60 17.825 -1.229 2.533 452 HA2 GLY 60 1HA GLY 60 15.596 -1.927 4.253 453 HA3 GLY 60 2HA GLY 60 16.373 -0.401 4.628 454 H GLU 61 HN GLU 61 14.370 0.706 4.019 455 HA GLU 61 HA GLU 61 13.554 0.459 1.288 456 HB2 GLU 61 2HB GLU 61 12.597 2.326 3.503 457 HB3 GLU 61 3HB GLU 61 11.828 2.151 1.938 458 HG2 GLU 61 2HG GLU 61 10.552 0.640 3.162 459 HG3 GLU 61 3HG GLU 61 11.801 -0.443 2.582 460 HE2 GLU 61 HE2 GLU 61 10.387 -0.649 5.256 461 H ASP 62 HN ASP 62 15.054 2.959 3.437 462 HA ASP 62 HA ASP 62 15.205 4.911 1.478 463 HB2 ASP 62 2HB ASP 62 15.610 4.968 4.092 464 HB3 ASP 62 3HB ASP 62 17.272 4.598 3.679 465 HD2 ASP 62 HD2 ASP 62 15.868 7.884 4.170 466 H THR 63 HN THR 63 17.763 2.701 2.864 467 HA THR 63 HA THR 63 19.838 3.349 1.201 468 HB THR 63 HB THR 63 20.449 0.835 1.689 469 HG1 THR 63 HG1 THR 63 18.877 0.136 3.462 470 HG21 THR 63 1HG2 THR 63 21.180 2.729 3.194 471 HG22 THR 63 2HG2 THR 63 19.617 2.618 4.039 472 HG23 THR 63 3HG2 THR 63 20.765 1.259 4.109 473 H LEU 64 HN LEU 64 17.039 1.213 0.525 474 HA LEU 64 HA LEU 64 18.140 0.369 -1.973 475 HB2 LEU 64 2HB LEU 64 15.507 0.039 -0.567 476 HB3 LEU 64 3HB LEU 64 15.694 -0.435 -2.243 477 HG LEU 64 HG LEU 64 17.258 -1.521 0.114 478 HD11 LEU 64 1HD1 LEU 64 15.983 -3.630 -1.110 479 HD12 LEU 64 2HD1 LEU 64 15.441 -2.795 0.365 480 HD13 LEU 64 3HD1 LEU 64 14.777 -2.326 -1.217 481 HD21 LEU 64 3HD2 LEU 64 17.901 -1.493 -2.701 482 HD22 LEU 64 1HD2 LEU 64 18.843 -2.110 -1.323 483 HD23 LEU 64 2HD2 LEU 64 17.654 -3.160 -2.130 484 H MET 65 HN MET 65 16.060 2.995 -0.774 485 HA MET 65 HA MET 65 14.851 3.726 -3.103 486 HB2 MET 65 2HB MET 65 14.818 4.667 -0.588 487 HB3 MET 65 3HB MET 65 15.998 5.808 -1.203 488 HG2 MET 65 2HG MET 65 14.072 7.009 -1.690 489 HG3 MET 65 3HG MET 65 14.185 6.088 -3.177 490 HE1 MET 65 3HE MET 65 11.027 4.246 -3.364 491 HE2 MET 65 1HE MET 65 11.788 5.731 -3.981 492 HE3 MET 65 2HE MET 65 12.729 4.222 -3.886 493 H GLU 66 HN GLU 66 17.975 5.039 -1.765 494 HA GLU 66 HA GLU 66 18.501 6.519 -4.075 495 HB2 GLU 66 2HB GLU 66 19.469 7.040 -1.851 496 HB3 GLU 66 3HB GLU 66 20.387 5.548 -1.883 497 HG2 GLU 66 2HG GLU 66 22.052 6.636 -2.966 498 HG3 GLU 66 3HG GLU 66 20.988 6.840 -4.343 499 HE2 GLU 66 HE2 GLU 66 20.807 9.831 -1.672 500 H TYR 67 HN TYR 67 19.776 3.354 -2.837 501 HA TYR 67 HA TYR 67 21.579 2.797 -4.810 502 HB2 TYR 67 2HB TYR 67 21.154 1.423 -2.778 503 HB3 TYR 67 3HB TYR 67 19.504 1.116 -3.281 504 HD1 TYR 67 HD1 TYR 67 23.034 0.226 -3.817 505 HD2 TYR 67 HD2 TYR 67 18.993 -0.566 -4.976 506 HE1 TYR 67 HE1 TYR 67 23.774 -1.923 -4.955 507 HE2 TYR 67 HE2 TYR 67 19.746 -2.713 -6.110 508 HH TYR 67 HH TYR 67 22.808 -3.334 -6.936 509 H LEU 68 HN LEU 68 18.220 1.403 -4.771 510 HA LEU 68 HA LEU 68 18.184 0.386 -7.261 511 HB2 LEU 68 2HB LEU 68 16.408 0.581 -5.303 512 HB3 LEU 68 3HB LEU 68 15.758 1.847 -6.325 513 HG LEU 68 HG LEU 68 16.125 -1.072 -7.042 514 HD11 LEU 68 1HD1 LEU 68 13.635 -0.956 -7.341 515 HD12 LEU 68 2HD1 LEU 68 14.203 -0.761 -5.665 516 HD13 LEU 68 3HD1 LEU 68 13.684 0.662 -6.600 517 HD21 LEU 68 3HD2 LEU 68 15.013 -0.458 -9.203 518 HD22 LEU 68 1HD2 LEU 68 15.295 1.252 -8.795 519 HD23 LEU 68 2HD2 LEU 68 16.675 0.151 -9.017 520 H GLU 69 HN GLU 69 17.369 3.806 -6.368 521 HA GLU 69 HA GLU 69 16.691 4.712 -8.809 522 HB2 GLU 69 2HB GLU 69 16.620 6.034 -6.701 523 HB3 GLU 69 3HB GLU 69 18.368 6.171 -6.719 524 HG2 GLU 69 2HG GLU 69 18.350 7.510 -8.728 525 HG3 GLU 69 3HG GLU 69 16.675 7.117 -9.067 526 HE2 GLU 69 HE2 GLU 69 15.757 10.008 -7.443 527 H ASN 70 HN ASN 70 20.016 4.289 -7.463 528 HA ASN 70 HA ASN 70 21.020 3.934 -10.075 529 HB2 ASN 70 2HB ASN 70 21.577 6.518 -8.570 530 HB3 ASN 70 3HB ASN 70 22.805 5.859 -9.633 531 HD21 ASN 70 1HD2 ASN 70 20.268 7.922 -9.432 532 HD22 ASN 70 2HD2 ASN 70 19.786 8.037 -11.091 533 HA PRO 71 HA PRO 71 23.311 1.938 -6.718 534 HB2 PRO 71 2HB PRO 71 23.532 -0.525 -7.883 535 HB3 PRO 71 3HB PRO 71 22.214 -0.085 -6.815 536 HG2 PRO 71 2HG PRO 71 22.202 -0.365 -9.758 537 HG3 PRO 71 3HG PRO 71 20.843 -0.349 -8.651 538 HD2 PRO 71 2HD PRO 71 21.698 1.798 -10.350 539 HD3 PRO 71 3HD PRO 71 20.413 1.851 -9.159 540 H LYS 72 HN LYS 72 23.951 2.631 -9.943 541 HA LYS 72 HA LYS 72 26.534 1.541 -10.102 542 HB2 LYS 72 2HB LYS 72 25.291 3.883 -11.576 543 HB3 LYS 72 3HB LYS 72 26.785 3.081 -12.022 544 HG2 LYS 72 2HG LYS 72 24.168 1.550 -11.717 545 HG3 LYS 72 3HG LYS 72 24.624 2.310 -13.230 546 HD2 LYS 72 2HD LYS 72 26.533 0.422 -11.805 547 HD3 LYS 72 3HD LYS 72 25.269 -0.202 -12.843 548 HE2 LYS 72 2HE LYS 72 26.167 1.426 -14.658 549 HE3 LYS 72 3HE LYS 72 27.560 1.650 -13.620 550 HZ1 LYS 72 2HZ LYS 72 28.305 -0.170 -14.730 551 HZ3 LYS 72 1HZ LYS 72 26.826 -0.678 -15.180 552 H LYS 73 HN LYS 73 25.214 4.113 -8.224 553 HA LYS 73 HA LYS 73 27.878 5.305 -7.933 554 HB2 LYS 73 2HB LYS 73 26.881 7.321 -7.403 555 HB3 LYS 73 3HB LYS 73 25.794 6.686 -8.621 556 HG2 LYS 73 2HG LYS 73 24.606 5.597 -6.447 557 HG3 LYS 73 3HG LYS 73 25.374 6.958 -5.653 558 HD2 LYS 73 2HD LYS 73 23.685 7.288 -8.171 559 HD3 LYS 73 3HD LYS 73 22.985 7.340 -6.564 560 HE2 LYS 73 2HE LYS 73 23.418 9.615 -6.958 561 HE3 LYS 73 3HE LYS 73 24.847 9.140 -6.063 562 HZ1 LYS 73 2HZ LYS 73 25.398 10.377 -8.104 563 HZ3 LYS 73 1HZ LYS 73 24.699 9.233 -9.030 564 H TYR 74 HN TYR 74 25.185 3.632 -6.305 565 HA TYR 74 HA TYR 74 26.099 4.047 -3.675 566 HB2 TYR 74 2HB TYR 74 23.843 3.143 -4.807 567 HB3 TYR 74 3HB TYR 74 24.647 1.587 -4.788 568 HD1 TYR 74 HD1 TYR 74 25.793 1.068 -2.350 569 HD2 TYR 74 HD2 TYR 74 22.385 3.555 -3.059 570 HE1 TYR 74 HE1 TYR 74 25.022 0.707 0.046 571 HE2 TYR 74 HE2 TYR 74 21.626 3.186 -0.661 572 HH TYR 74 HH TYR 74 23.570 2.098 1.697 573 H ILE 75 HN ILE 75 26.709 1.485 -6.141 574 HA ILE 75 HA ILE 75 28.960 0.627 -4.483 575 HB ILE 75 HB ILE 75 27.060 -1.287 -5.837 576 HG12 ILE 75 2HG1 ILE 75 27.228 -0.520 -2.908 577 HG13 ILE 75 3HG1 ILE 75 25.910 -0.147 -4.000 578 HG21 ILE 75 1HG2 ILE 75 28.939 -2.120 -3.690 579 HG22 ILE 75 2HG2 ILE 75 28.390 -2.986 -5.145 580 HG23 ILE 75 3HG2 ILE 75 29.641 -1.728 -5.277 581 HD11 ILE 75 3HD1 ILE 75 25.758 -2.714 -4.418 582 HD12 ILE 75 1HD1 ILE 75 26.777 -2.867 -2.967 583 HD13 ILE 75 2HD1 ILE 75 25.178 -2.095 -2.852 584 HA PRO 76 HA PRO 76 30.315 1.445 -8.661 585 HB2 PRO 76 2HB PRO 76 32.660 2.682 -7.998 586 HB3 PRO 76 3HB PRO 76 31.160 3.550 -8.262 587 HG2 PRO 76 2HG PRO 76 32.518 2.930 -5.709 588 HG3 PRO 76 3HG PRO 76 31.283 4.130 -6.032 589 HD2 PRO 76 2HD PRO 76 30.920 1.598 -4.734 590 HD3 PRO 76 3HD PRO 76 29.667 2.746 -5.160 591 H GLY 77 HN GLY 77 30.755 -0.448 -9.611 592 HA2 GLY 77 1HA GLY 77 32.875 -1.620 -10.215 593 HA3 GLY 77 2HA GLY 77 33.106 -1.857 -8.493 594 H THR 78 HN THR 78 29.935 -2.047 -8.372 595 HA THR 78 HA THR 78 29.727 -4.755 -8.076 596 HB THR 78 HB THR 78 28.110 -2.893 -7.379 597 HG1 THR 78 HG1 THR 78 26.587 -4.551 -7.341 598 HG21 THR 78 1HG2 THR 78 26.986 -1.717 -8.981 599 HG22 THR 78 2HG2 THR 78 27.881 -2.598 -10.243 600 HG23 THR 78 3HG2 THR 78 26.336 -3.239 -9.635 601 H LYS 79 HN LYS 79 28.241 -6.265 -9.386 602 HA LYS 79 HA LYS 79 28.954 -5.964 -12.221 603 HB2 LYS 79 2HB LYS 79 28.872 -8.612 -12.033 604 HB3 LYS 79 3HB LYS 79 30.334 -7.700 -11.719 605 HG2 LYS 79 2HG LYS 79 29.877 -7.722 -9.287 606 HG3 LYS 79 3HG LYS 79 28.341 -8.525 -9.555 607 HD2 LYS 79 2HD LYS 79 29.930 -10.295 -10.849 608 HD3 LYS 79 3HD LYS 79 31.130 -9.640 -9.752 609 HE2 LYS 79 2HE LYS 79 29.491 -10.087 -7.834 610 HE3 LYS 79 3HE LYS 79 28.469 -10.926 -8.984 611 HZ1 LYS 79 2HZ LYS 79 31.306 -11.664 -8.511 612 HZ3 LYS 79 1HZ LYS 79 30.224 -12.505 -9.391 613 H MET 80 HN MET 80 26.589 -4.880 -11.065 614 HA MET 80 HA MET 80 24.589 -6.848 -11.828 615 HB2 MET 80 2HB MET 80 24.236 -5.849 -9.616 616 HB3 MET 80 3HB MET 80 24.496 -4.231 -10.239 617 HG2 MET 80 2HG MET 80 22.396 -4.179 -11.356 618 HG3 MET 80 3HG MET 80 22.248 -5.924 -11.372 619 HE1 MET 80 3HE MET 80 19.877 -3.591 -9.881 620 HE2 MET 80 1HE MET 80 20.739 -2.972 -8.453 621 HE3 MET 80 2HE MET 80 21.457 -2.795 -10.072 622 H ILE 81 HN ILE 81 23.689 -6.704 -13.835 623 HA ILE 81 HA ILE 81 24.210 -4.352 -15.408 624 HB ILE 81 HB ILE 81 22.601 -6.784 -16.167 625 HG12 ILE 81 2HG1 ILE 81 24.662 -7.649 -15.307 626 HG13 ILE 81 3HG1 ILE 81 24.727 -7.716 -17.057 627 HG21 ILE 81 1HG2 ILE 81 22.360 -5.000 -17.738 628 HG22 ILE 81 2HG2 ILE 81 24.113 -4.692 -17.748 629 HG23 ILE 81 3HG2 ILE 81 23.471 -6.200 -18.440 630 HD11 ILE 81 3HD1 ILE 81 26.854 -6.856 -16.088 631 HD12 ILE 81 1HD1 ILE 81 26.071 -5.639 -17.124 632 HD13 ILE 81 2HD1 ILE 81 25.962 -5.504 -15.352 633 H PHE 82 HN PHE 82 22.972 -2.567 -15.252 634 HA PHE 82 HA PHE 82 20.177 -2.739 -15.556 635 HB2 PHE 82 2HB PHE 82 20.642 -3.395 -13.075 636 HB3 PHE 82 3HB PHE 82 21.276 -1.778 -12.849 637 HD1 PHE 82 HD2 PHE 82 18.293 -2.798 -14.820 638 HD2 PHE 82 HD1 PHE 82 19.754 -0.820 -11.361 639 HE1 PHE 82 HE2 PHE 82 15.980 -1.959 -14.321 640 HE2 PHE 82 HE1 PHE 82 17.441 0.018 -10.863 641 HZ PHE 82 HZ PHE 82 15.582 -0.562 -12.349 642 H VAL 83 HN VAL 83 19.149 -0.485 -15.361 643 HA VAL 83 HA VAL 83 21.196 1.498 -16.071 644 HB VAL 83 HB VAL 83 19.449 2.566 -17.396 645 HG11 VAL 83 1HG1 VAL 83 19.164 -0.140 -18.488 646 HG12 VAL 83 2HG1 VAL 83 19.968 1.294 -19.171 647 HG13 VAL 83 3HG1 VAL 83 20.835 0.253 -18.016 648 HG21 VAL 83 3HG2 VAL 83 17.287 1.483 -17.783 649 HG22 VAL 83 1HG2 VAL 83 17.707 0.201 -16.621 650 HG23 VAL 83 2HG2 VAL 83 17.498 1.878 -16.062 651 H GLY 84 HN GLY 84 18.101 0.894 -14.314 652 HA2 GLY 84 1HA GLY 84 18.041 1.788 -12.044 653 HA3 GLY 84 2HA GLY 84 18.712 3.281 -12.673 654 H ILE 85 HN ILE 85 16.261 3.185 -11.212 655 HA ILE 85 HA ILE 85 14.247 3.548 -13.306 656 HB ILE 85 HB ILE 85 13.897 3.264 -10.320 657 HG12 ILE 85 2HG1 ILE 85 13.693 1.210 -12.537 658 HG13 ILE 85 3HG1 ILE 85 14.812 1.209 -11.188 659 HG21 ILE 85 1HG2 ILE 85 11.942 3.406 -12.622 660 HG22 ILE 85 2HG2 ILE 85 11.516 2.768 -11.015 661 HG23 ILE 85 3HG2 ILE 85 12.047 4.458 -11.190 662 HD11 ILE 85 3HD1 ILE 85 12.689 1.223 -9.667 663 HD12 ILE 85 1HD1 ILE 85 11.812 0.752 -11.143 664 HD13 ILE 85 2HD1 ILE 85 13.106 -0.290 -10.506 665 H LYS 86 HN LYS 86 12.694 5.426 -12.927 666 HA LYS 86 HA LYS 86 14.280 7.726 -12.023 667 HB2 LYS 86 2HB LYS 86 13.664 7.492 -14.498 668 HB3 LYS 86 3HB LYS 86 12.007 7.797 -14.016 669 HG2 LYS 86 2HG LYS 86 12.744 9.941 -12.920 670 HG3 LYS 86 3HG LYS 86 14.380 9.643 -13.470 671 HD2 LYS 86 2HD LYS 86 12.251 9.518 -15.575 672 HD3 LYS 86 3HD LYS 86 12.555 11.101 -14.890 673 HE2 LYS 86 2HE LYS 86 14.183 11.159 -16.527 674 HE3 LYS 86 3HE LYS 86 15.129 10.357 -15.289 675 HZ1 LYS 86 2HZ LYS 86 15.373 8.854 -16.982 676 HZ3 LYS 86 1HZ LYS 86 13.959 9.214 -17.706 677 H LYS 87 HN LYS 87 10.758 7.072 -12.612 678 HA LYS 87 HA LYS 87 9.800 8.743 -10.697 679 HB2 LYS 87 2HB LYS 87 8.735 6.156 -11.830 680 HB3 LYS 87 3HB LYS 87 7.823 7.082 -10.658 681 HG2 LYS 87 2HG LYS 87 8.274 9.130 -12.245 682 HG3 LYS 87 3HG LYS 87 8.699 7.923 -13.443 683 HD2 LYS 87 2HD LYS 87 6.103 7.601 -11.927 684 HD3 LYS 87 3HD LYS 87 6.183 8.801 -13.202 685 HE2 LYS 87 2HE LYS 87 5.376 6.582 -14.038 686 HE3 LYS 87 3HE LYS 87 6.841 7.104 -14.849 687 HZ1 LYS 87 2HZ LYS 87 6.872 4.741 -14.053 688 HZ3 LYS 87 1HZ LYS 87 6.879 5.272 -12.513 689 H LYS 88 HN LYS 88 10.193 8.918 -8.563 690 HA LYS 88 HA LYS 88 11.525 6.932 -7.124 691 HB2 LYS 88 2HB LYS 88 11.247 8.372 -5.235 692 HB3 LYS 88 3HB LYS 88 11.550 9.374 -6.639 693 HG2 LYS 88 2HG LYS 88 8.995 9.618 -6.873 694 HG3 LYS 88 3HG LYS 88 8.859 8.850 -5.303 695 HD2 LYS 88 2HD LYS 88 10.160 11.513 -5.978 696 HD3 LYS 88 3HD LYS 88 8.845 11.207 -4.861 697 HE2 LYS 88 2HE LYS 88 11.698 10.179 -4.476 698 HE3 LYS 88 3HE LYS 88 11.063 11.629 -3.722 699 HZ1 LYS 88 2HZ LYS 88 9.873 10.400 -2.247 700 HZ3 LYS 88 1HZ LYS 88 10.890 9.185 -2.621 701 H GLU 89 HN GLU 89 8.037 7.916 -7.198 702 HA GLU 89 HA GLU 89 7.116 6.248 -5.286 703 HB2 GLU 89 2HB GLU 89 5.915 7.283 -7.862 704 HB3 GLU 89 3HB GLU 89 4.992 6.174 -6.869 705 HG2 GLU 89 2HG GLU 89 5.636 7.808 -4.889 706 HG3 GLU 89 3HG GLU 89 5.986 8.952 -6.169 707 HE2 GLU 89 HE2 GLU 89 2.656 9.791 -6.093 708 H GLU 90 HN GLU 90 7.890 5.494 -8.722 709 HA GLU 90 HA GLU 90 6.789 2.988 -8.814 710 HB2 GLU 90 2HB GLU 90 8.011 4.514 -10.622 711 HB3 GLU 90 3HB GLU 90 9.415 3.558 -10.194 712 HG2 GLU 90 2HG GLU 90 8.040 1.461 -10.627 713 HG3 GLU 90 3HG GLU 90 6.738 2.484 -11.198 714 HE2 GLU 90 HE2 GLU 90 8.277 2.006 -14.294 715 H ARG 91 HN ARG 91 9.954 4.106 -7.530 716 HA ARG 91 HA ARG 91 11.010 1.556 -7.196 717 HB2 ARG 91 2HB ARG 91 11.590 4.281 -5.981 718 HB3 ARG 91 3HB ARG 91 12.440 2.868 -5.386 719 HG2 ARG 91 2HG ARG 91 13.066 2.357 -7.830 720 HG3 ARG 91 3HG ARG 91 12.428 3.935 -8.243 721 HD2 ARG 91 2HD ARG 91 14.545 3.587 -6.077 722 HD3 ARG 91 3HD ARG 91 14.979 3.770 -7.765 723 HE ARG 91 HE ARG 91 13.804 5.843 -6.018 724 HH11 ARG 91 2HH2 ARG 91 14.656 4.899 -9.325 725 HH12 ARG 91 1HH2 ARG 91 14.642 6.524 -9.924 726 HH22 ARG 91 HH1 ARG 91 14.129 8.323 -8.427 727 H ALA 92 HN ALA 92 8.616 3.419 -5.439 728 HA ALA 92 HA ALA 92 8.983 2.139 -2.919 729 HB1 ALA 92 3HB ALA 92 7.403 4.262 -4.089 730 HB2 ALA 92 1HB ALA 92 6.348 3.168 -3.163 731 HB3 ALA 92 2HB ALA 92 7.747 3.933 -2.374 732 H ASP 93 HN ASP 93 6.616 1.817 -5.654 733 HA ASP 93 HA ASP 93 5.135 -0.188 -4.537 734 HB2 ASP 93 2HB ASP 93 4.290 -0.577 -6.748 735 HB3 ASP 93 3HB ASP 93 4.690 1.127 -6.684 736 HD2 ASP 93 HD2 ASP 93 5.154 0.763 -9.420 737 H LEU 94 HN LEU 94 8.325 -0.179 -6.113 738 HA LEU 94 HA LEU 94 8.376 -3.028 -6.489 739 HB2 LEU 94 2HB LEU 94 9.529 -1.080 -7.831 740 HB3 LEU 94 3HB LEU 94 10.788 -1.268 -6.628 741 HG LEU 94 HG LEU 94 9.769 -3.431 -8.490 742 HD11 LEU 94 1HD1 LEU 94 11.346 -2.857 -9.951 743 HD12 LEU 94 2HD1 LEU 94 11.517 -1.342 -9.031 744 HD13 LEU 94 3HD1 LEU 94 12.586 -2.722 -8.681 745 HD21 LEU 94 3HD2 LEU 94 11.648 -3.502 -6.159 746 HD22 LEU 94 1HD2 LEU 94 10.417 -4.679 -6.675 747 HD23 LEU 94 2HD2 LEU 94 11.954 -4.554 -7.561 748 H ILE 95 HN ILE 95 9.658 -0.585 -4.182 749 HA ILE 95 HA ILE 95 11.141 -2.530 -2.719 750 HB ILE 95 HB ILE 95 10.377 0.342 -2.249 751 HG12 ILE 95 2HG1 ILE 95 13.135 -0.829 -2.610 752 HG13 ILE 95 3HG1 ILE 95 12.133 -0.417 -3.987 753 HG21 ILE 95 1HG2 ILE 95 11.749 -1.591 -0.392 754 HG22 ILE 95 2HG2 ILE 95 12.116 0.151 -0.350 755 HG23 ILE 95 3HG2 ILE 95 10.456 -0.416 -0.049 756 HD11 ILE 95 3HD1 ILE 95 11.830 1.890 -2.643 757 HD12 ILE 95 1HD1 ILE 95 13.384 1.391 -1.933 758 HD13 ILE 95 2HD1 ILE 95 13.238 1.605 -3.695 759 H ALA 96 HN ALA 96 7.808 -1.676 -2.981 760 HA ALA 96 HA ALA 96 7.131 -2.361 -0.277 761 HB1 ALA 96 3HB ALA 96 5.261 -2.160 -2.656 762 HB2 ALA 96 1HB ALA 96 4.910 -1.849 -0.939 763 HB3 ALA 96 2HB ALA 96 5.930 -0.717 -1.859 764 H TYR 97 HN TYR 97 7.474 -3.963 -3.429 765 HA TYR 97 HA TYR 97 6.120 -6.342 -2.475 766 HB2 TYR 97 2HB TYR 97 5.820 -5.700 -4.814 767 HB3 TYR 97 3HB TYR 97 7.520 -5.313 -4.999 768 HD1 TYR 97 HD2 TYR 97 6.022 -8.419 -3.555 769 HD2 TYR 97 HD1 TYR 97 8.186 -6.667 -6.803 770 HE1 TYR 97 HE2 TYR 97 6.447 -10.729 -4.527 771 HE2 TYR 97 HE1 TYR 97 8.603 -8.983 -7.765 772 HH TYR 97 HH TYR 97 6.937 -11.732 -6.630 773 H LEU 98 HN LEU 98 9.426 -5.420 -3.677 774 HA LEU 98 HA LEU 98 10.661 -7.818 -3.274 775 HB2 LEU 98 2HB LEU 98 11.545 -4.968 -3.242 776 HB3 LEU 98 3HB LEU 98 12.680 -6.198 -2.721 777 HG LEU 98 HG LEU 98 11.324 -6.017 -5.424 778 HD11 LEU 98 1HD1 LEU 98 14.271 -5.827 -4.771 779 HD12 LEU 98 2HD1 LEU 98 13.458 -5.481 -6.316 780 HD13 LEU 98 3HD1 LEU 98 13.201 -4.412 -4.916 781 HD21 LEU 98 3HD2 LEU 98 13.382 -7.925 -5.526 782 HD22 LEU 98 1HD2 LEU 98 12.438 -8.309 -4.067 783 HD23 LEU 98 2HD2 LEU 98 11.628 -8.203 -5.648 784 H LYS 99 HN LYS 99 9.729 -5.326 -0.885 785 HA LYS 99 HA LYS 99 11.209 -6.481 1.237 786 HB2 LYS 99 2HB LYS 99 10.620 -4.147 1.294 787 HB3 LYS 99 3HB LYS 99 8.912 -4.508 1.151 788 HG2 LYS 99 2HG LYS 99 9.097 -5.815 3.346 789 HG3 LYS 99 3HG LYS 99 10.731 -5.203 3.502 790 HD2 LYS 99 2HD LYS 99 9.964 -2.906 3.620 791 HD3 LYS 99 3HD LYS 99 8.345 -3.348 3.114 792 HE2 LYS 99 2HE LYS 99 8.484 -2.944 5.580 793 HE3 LYS 99 3HE LYS 99 7.958 -4.574 5.208 794 HZ1 LYS 99 2HZ LYS 99 10.720 -3.788 5.967 795 HZ3 LYS 99 1HZ LYS 99 10.298 -5.297 5.526 796 H LYS 100 HN LYS 100 7.864 -6.827 -0.037 797 HA LYS 100 HA LYS 100 7.104 -8.565 2.106 798 HB2 LYS 100 2HB LYS 100 5.540 -7.030 0.905 799 HB3 LYS 100 3HB LYS 100 5.718 -8.014 -0.533 800 HG2 LYS 100 2HG LYS 100 4.978 -10.028 0.885 801 HG3 LYS 100 3HG LYS 100 4.584 -8.892 2.159 802 HD2 LYS 100 2HD LYS 100 3.045 -7.682 0.571 803 HD3 LYS 100 3HD LYS 100 3.408 -8.875 -0.661 804 HE2 LYS 100 2HE LYS 100 2.592 -10.672 0.989 805 HE3 LYS 100 3HE LYS 100 2.031 -9.370 2.018 806 HZ1 LYS 100 2HZ LYS 100 0.874 -8.607 -0.205 807 HZ3 LYS 100 1HZ LYS 100 0.175 -9.746 0.727 808 H ALA 101 HN ALA 101 8.986 -8.856 -0.759 809 HA ALA 101 HA ALA 101 8.289 -11.620 -1.219 810 HB1 ALA 101 3HB ALA 101 9.736 -9.460 -2.576 811 HB2 ALA 101 1HB ALA 101 10.604 -11.012 -2.653 812 HB3 ALA 101 2HB ALA 101 8.933 -10.895 -3.256 813 H THR 102 HN THR 102 10.909 -9.653 0.266 814 HA THR 102 HA THR 102 12.493 -11.990 0.835 815 HB THR 102 HB THR 102 14.013 -10.319 1.811 816 HG1 THR 102 HG1 THR 102 12.993 -8.575 2.711 817 HG21 THR 102 1HG2 THR 102 14.492 -9.714 -0.347 818 HG22 THR 102 2HG2 THR 102 12.789 -9.891 -0.836 819 HG23 THR 102 3HG2 THR 102 13.354 -8.365 -0.115 820 H ASN 103 HN ASN 103 10.110 -9.934 2.518 821 HA ASN 103 HA ASN 103 10.697 -10.941 5.054 822 HB2 ASN 103 2HB ASN 103 9.416 -8.842 4.713 823 HB3 ASN 103 3HB ASN 103 8.136 -9.719 3.899 824 HD21 ASN 103 1HD2 ASN 103 6.686 -8.864 5.435 825 HD22 ASN 103 2HD2 ASN 103 6.523 -9.543 7.020 826 H GLU 104 HN GLU 104 7.885 -11.525 2.793 827 HA GLU 104 HA GLU 104 6.573 -13.424 4.073 828 HB2 GLU 104 2HB GLU 104 5.850 -14.290 1.884 829 HB3 GLU 104 3HB GLU 104 5.956 -12.542 1.844 830 HG2 GLU 104 2HG GLU 104 8.270 -12.750 0.832 831 HG3 GLU 104 3HG GLU 104 8.056 -14.488 0.781 832 HE2 GLU 104 HE2 GLU 104 7.034 -15.141 -1.285 833 HHA HEC 500 HHA HEC 500 23.619 -6.979 -5.406 834 HHB HEC 500 HHB HEC 500 17.682 -4.638 -5.860 835 HHC HEC 500 HHC HEC 500 18.025 -5.755 -12.202 836 HHD HEC 500 HHD HEC 500 23.114 -9.506 -11.211 837 HMA1 HEC 500 1HMA HEC 500 18.337 -4.687 -3.631 838 HMA2 HEC 500 2HMA HEC 500 19.793 -4.779 -2.634 839 HMA3 HEC 500 3HMA HEC 500 19.575 -3.405 -3.734 840 HAA1 HEC 500 1HAA HEC 500 23.247 -5.391 -3.592 841 HAA2 HEC 500 2HAA HEC 500 21.841 -5.259 -2.662 842 HBA1 HEC 500 1HBA HEC 500 22.715 -7.935 -3.804 843 HBA2 HEC 500 2HBA HEC 500 23.271 -7.331 -2.231 844 HMB1 HEC 500 1HMB HEC 500 14.677 -4.713 -8.157 845 HMB2 HEC 500 2HMB HEC 500 15.591 -4.712 -6.665 846 HMB3 HEC 500 3HMB HEC 500 15.587 -3.249 -7.672 847 HAB HEC 500 HAB HEC 500 16.455 -4.323 -11.794 848 HBB1 HEC 500 1HBB HEC 500 15.935 -2.416 -10.338 849 HBB2 HEC 500 2HBB HEC 500 14.702 -2.905 -11.531 850 HBB3 HEC 500 3HBB HEC 500 14.465 -3.257 -9.831 851 HMC1 HEC 500 1HMC HEC 500 18.319 -8.459 -14.028 852 HMC2 HEC 500 2HMC HEC 500 18.472 -6.699 -14.115 853 HMC3 HEC 500 3HMC HEC 500 19.659 -7.707 -14.918 854 HAC HEC 500 HAC HEC 500 22.114 -10.291 -12.888 855 HBC1 HEC 500 1HBC HEC 500 21.183 -8.895 -15.397 856 HBC2 HEC 500 2HBC HEC 500 22.711 -8.546 -14.558 857 HBC3 HEC 500 3HBC HEC 500 22.437 -10.150 -15.235 858 HMD1 HEC 500 1HMD HEC 500 24.795 -11.009 -9.278 859 HMD2 HEC 500 2HMD HEC 500 25.298 -9.760 -10.429 860 HMD3 HEC 500 3HMD HEC 500 26.103 -9.927 -8.843 861 HAD1 HEC 500 1HAD HEC 500 25.287 -8.261 -5.590 862 HAD2 HEC 500 2HAD HEC 500 25.851 -9.519 -6.605 863 HBD1 HEC 500 1HBD HEC 500 27.242 -8.079 -7.824 864 HBD2 HEC 500 2HBD HEC 500 26.123 -6.711 -7.628 Start of MODEL 4 1 H1 GLY 1 HN GLY 1 1.171 0.724 -0.373 2 HA2 GLY 1 1HA GLY 1 1.961 0.711 -3.121 3 HA3 GLY 1 2HA GLY 1 2.924 0.266 -1.726 4 H ASP 2 HN ASP 2 0.965 -0.881 -4.380 5 HA ASP 2 HA ASP 2 0.548 -3.469 -3.344 6 HB2 ASP 2 2HB ASP 2 0.354 -2.182 -6.086 7 HB3 ASP 2 3HB ASP 2 0.189 -3.920 -5.928 8 HD2 ASP 2 HD2 ASP 2 -2.866 -1.590 -5.030 9 H VAL 3 HN VAL 3 1.762 -5.409 -3.853 10 HA VAL 3 HA VAL 3 4.515 -4.925 -4.497 11 HB VAL 3 HB VAL 3 4.899 -7.020 -3.661 12 HG11 VAL 3 1HG1 VAL 3 3.364 -5.435 -2.153 13 HG12 VAL 3 2HG1 VAL 3 2.261 -6.827 -2.276 14 HG13 VAL 3 3HG1 VAL 3 3.896 -7.043 -1.607 15 HG21 VAL 3 3HG2 VAL 3 2.173 -7.762 -4.730 16 HG22 VAL 3 1HG2 VAL 3 3.765 -8.440 -5.150 17 HG23 VAL 3 2HG2 VAL 3 3.034 -8.798 -3.566 18 H GLU 4 HN GLU 4 1.603 -6.316 -6.051 19 HA GLU 4 HA GLU 4 2.718 -7.659 -8.099 20 HB2 GLU 4 2HB GLU 4 0.247 -5.876 -8.095 21 HB3 GLU 4 3HB GLU 4 0.636 -6.970 -9.408 22 HG2 GLU 4 2HG GLU 4 0.764 -8.837 -7.607 23 HG3 GLU 4 3HG GLU 4 0.014 -7.690 -6.514 24 HE2 GLU 4 HE2 GLU 4 -3.081 -8.555 -7.735 25 H LYS 5 HN LYS 5 1.820 -4.130 -8.142 26 HA LYS 5 HA LYS 5 2.766 -3.524 -10.628 27 HB2 LYS 5 2HB LYS 5 2.387 -1.994 -8.087 28 HB3 LYS 5 3HB LYS 5 3.267 -1.220 -9.389 29 HG2 LYS 5 2HG LYS 5 1.016 -0.622 -9.821 30 HG3 LYS 5 3HG LYS 5 1.300 -1.949 -10.930 31 HD2 LYS 5 2HD LYS 5 0.069 -3.496 -9.602 32 HD3 LYS 5 3HD LYS 5 0.196 -2.509 -8.160 33 HE2 LYS 5 2HE LYS 5 -1.282 -1.472 -10.605 34 HE3 LYS 5 3HE LYS 5 -2.081 -2.550 -9.478 35 HZ1 LYS 5 2HZ LYS 5 -2.220 -0.904 -7.947 36 HZ3 LYS 5 1HZ LYS 5 -1.900 0.132 -9.161 37 H GLY 6 HN GLY 6 4.553 -4.397 -7.730 38 HA2 GLY 6 1HA GLY 6 7.070 -3.396 -8.837 39 HA3 GLY 6 2HA GLY 6 6.799 -4.071 -7.242 40 H LYS 7 HN LYS 7 5.144 -6.353 -8.510 41 HA LYS 7 HA LYS 7 7.364 -8.115 -8.832 42 HB2 LYS 7 2HB LYS 7 5.142 -8.594 -7.664 43 HB3 LYS 7 3HB LYS 7 4.438 -8.753 -9.260 44 HG2 LYS 7 2HG LYS 7 5.628 -10.702 -9.755 45 HG3 LYS 7 3HG LYS 7 6.983 -10.270 -8.732 46 HD2 LYS 7 2HD LYS 7 5.905 -10.991 -6.756 47 HD3 LYS 7 3HD LYS 7 4.302 -10.821 -7.442 48 HE2 LYS 7 2HE LYS 7 4.986 -12.732 -9.079 49 HE3 LYS 7 3HE LYS 7 6.348 -13.003 -8.011 50 HZ1 LYS 7 2HZ LYS 7 3.477 -13.225 -7.317 51 HZ3 LYS 7 1HZ LYS 7 4.629 -13.167 -6.168 52 H LYS 8 HN LYS 8 5.130 -6.333 -10.934 53 HA LYS 8 HA LYS 8 5.905 -7.873 -13.248 54 HB2 LYS 8 2HB LYS 8 3.989 -5.625 -12.694 55 HB3 LYS 8 3HB LYS 8 4.491 -5.943 -14.342 56 HG2 LYS 8 2HG LYS 8 3.497 -8.193 -12.553 57 HG3 LYS 8 3HG LYS 8 2.370 -7.176 -13.428 58 HD2 LYS 8 2HD LYS 8 4.682 -8.406 -14.940 59 HD3 LYS 8 3HD LYS 8 3.321 -9.426 -14.516 60 HE2 LYS 8 2HE LYS 8 3.250 -6.871 -16.182 61 HE3 LYS 8 3HE LYS 8 2.909 -8.499 -16.732 62 HZ1 LYS 8 2HZ LYS 8 1.046 -8.447 -14.992 63 HZ3 LYS 8 1HZ LYS 8 0.812 -7.545 -16.327 64 H ILE 9 HN ILE 9 6.789 -4.884 -11.556 65 HA ILE 9 HA ILE 9 8.347 -3.953 -13.801 66 HB ILE 9 HB ILE 9 7.817 -2.920 -11.023 67 HG12 ILE 9 2HG1 ILE 9 7.190 -1.588 -13.656 68 HG13 ILE 9 3HG1 ILE 9 6.111 -2.783 -12.965 69 HG21 ILE 9 1HG2 ILE 9 9.198 -1.031 -11.427 70 HG22 ILE 9 2HG2 ILE 9 10.186 -2.473 -11.761 71 HG23 ILE 9 3HG2 ILE 9 9.508 -1.528 -13.109 72 HD11 ILE 9 3HD1 ILE 9 6.466 0.003 -12.215 73 HD12 ILE 9 1HD1 ILE 9 5.225 -1.150 -11.673 74 HD13 ILE 9 2HD1 ILE 9 6.781 -1.049 -10.814 75 H PHE 10 HN PHE 10 8.696 -5.989 -10.974 76 HA PHE 10 HA PHE 10 11.512 -5.639 -10.734 77 HB2 PHE 10 2HB PHE 10 10.287 -6.400 -8.796 78 HB3 PHE 10 3HB PHE 10 9.321 -7.515 -9.740 79 HD1 PHE 10 HD2 PHE 10 12.730 -6.963 -8.397 80 HD2 PHE 10 HD1 PHE 10 9.965 -9.767 -9.977 81 HE1 PHE 10 HE2 PHE 10 14.267 -8.840 -7.755 82 HE2 PHE 10 HE1 PHE 10 11.502 -11.644 -9.335 83 HZ PHE 10 HZ PHE 10 13.635 -11.159 -8.231 84 H ILE 11 HN ILE 11 9.392 -7.460 -12.834 85 HA ILE 11 HA ILE 11 11.366 -9.481 -13.402 86 HB ILE 11 HB ILE 11 8.621 -8.853 -14.470 87 HG12 ILE 11 2HG1 ILE 11 9.544 -11.345 -13.039 88 HG13 ILE 11 3HG1 ILE 11 9.042 -9.918 -12.154 89 HG21 ILE 11 1HG2 ILE 11 8.737 -10.786 -15.884 90 HG22 ILE 11 2HG2 ILE 11 10.100 -9.713 -16.285 91 HG23 ILE 11 3HG2 ILE 11 10.376 -11.175 -15.307 92 HD11 ILE 11 3HD1 ILE 11 7.048 -11.184 -12.351 93 HD12 ILE 11 1HD1 ILE 11 6.899 -9.976 -13.649 94 HD13 ILE 11 2HD1 ILE 11 7.397 -11.640 -14.035 95 H MET 12 HN MET 12 9.663 -6.936 -15.369 96 HA MET 12 HA MET 12 11.333 -7.136 -17.526 97 HB2 MET 12 2HB MET 12 9.505 -5.037 -16.352 98 HB3 MET 12 3HB MET 12 10.587 -4.503 -17.622 99 HG2 MET 12 2HG MET 12 8.486 -5.214 -18.650 100 HG3 MET 12 3HG MET 12 9.733 -6.361 -19.100 101 HE1 MET 12 3HE MET 12 6.318 -5.889 -17.163 102 HE2 MET 12 1HE MET 12 6.480 -6.343 -18.877 103 HE3 MET 12 2HE MET 12 5.830 -7.513 -17.704 104 H LYS 13 HN LYS 13 11.961 -5.806 -14.367 105 HA LYS 13 HA LYS 13 14.271 -4.335 -15.408 106 HB2 LYS 13 2HB LYS 13 13.040 -4.183 -12.643 107 HB3 LYS 13 3HB LYS 13 14.274 -3.135 -13.312 108 HG2 LYS 13 2HG LYS 13 11.616 -3.415 -14.743 109 HG3 LYS 13 3HG LYS 13 11.736 -2.372 -13.341 110 HD2 LYS 13 2HD LYS 13 12.273 -0.848 -15.018 111 HD3 LYS 13 3HD LYS 13 13.878 -1.410 -14.598 112 HE2 LYS 13 2HE LYS 13 14.125 -2.634 -16.563 113 HE3 LYS 13 3HE LYS 13 12.416 -3.003 -16.681 114 HZ1 LYS 13 2HZ LYS 13 12.052 -0.639 -17.306 115 HZ3 LYS 13 1HZ LYS 13 13.015 -1.404 -18.374 116 H CYS 14 HN CYS 14 13.185 -7.014 -13.314 117 HA CYS 14 HA CYS 14 15.969 -7.879 -13.229 118 HB2 CYS 14 2HB CYS 14 14.351 -8.403 -10.797 119 HB3 CYS 14 3HB CYS 14 16.078 -8.170 -10.979 120 H SER 15 HN SER 15 15.219 -9.269 -15.024 121 HA SER 15 HA SER 15 13.482 -11.397 -14.043 122 HB2 SER 15 2HB SER 15 12.201 -10.499 -15.770 123 HB3 SER 15 3HB SER 15 13.599 -9.974 -16.687 124 HG SER 15 HG SER 15 12.296 -11.925 -17.474 125 H GLN 16 HN GLN 16 14.172 -13.560 -14.416 126 HA GLN 16 HA GLN 16 15.625 -15.162 -14.628 127 HB2 GLN 16 2HB GLN 16 16.024 -13.586 -17.157 128 HB3 GLN 16 3HB GLN 16 17.169 -14.869 -16.821 129 HG2 GLN 16 2HG GLN 16 15.542 -16.086 -17.957 130 HG3 GLN 16 3HG GLN 16 14.973 -16.295 -16.313 131 HE21 GLN 16 1HE2 GLN 16 12.986 -15.719 -15.819 132 HE22 GLN 16 2HE2 GLN 16 11.919 -14.747 -16.776 133 H CYS 17 HN CYS 17 16.389 -12.797 -13.004 134 HA CYS 17 HA CYS 17 19.275 -13.252 -13.077 135 HB2 CYS 17 2HB CYS 17 17.825 -10.655 -13.165 136 HB3 CYS 17 3HB CYS 17 19.242 -10.745 -12.137 137 H HIS 18 HN HIS 18 16.545 -11.726 -11.204 138 HA HIS 18 HA HIS 18 17.752 -12.835 -8.787 139 HB2 HIS 18 2HB HIS 18 15.921 -10.502 -9.314 140 HB3 HIS 18 3HB HIS 18 16.019 -11.215 -7.716 141 HD1 HIS 18 HD1 HIS 18 18.525 -11.238 -6.613 142 HD2 HIS 18 HD2 HIS 18 17.921 -8.702 -9.899 143 HE1 HIS 18 HE1 HIS 18 20.449 -9.563 -6.586 144 H THR 19 HN THR 19 16.178 -13.691 -7.112 145 HA THR 19 HA THR 19 13.922 -15.022 -8.463 146 HB THR 19 HB THR 19 14.441 -16.961 -6.956 147 HG1 THR 19 HG1 THR 19 16.669 -16.607 -5.896 148 HG21 THR 19 1HG2 THR 19 15.668 -16.730 -9.217 149 HG22 THR 19 2HG2 THR 19 17.023 -16.028 -8.301 150 HG23 THR 19 3HG2 THR 19 16.510 -17.704 -7.987 151 H VAL 20 HN VAL 20 15.208 -13.518 -5.471 152 HA VAL 20 HA VAL 20 14.181 -12.789 -3.644 153 HB VAL 20 HB VAL 20 12.360 -11.294 -4.010 154 HG11 VAL 20 1HG1 VAL 20 13.162 -10.107 -6.150 155 HG12 VAL 20 2HG1 VAL 20 14.350 -10.362 -4.849 156 HG13 VAL 20 3HG1 VAL 20 14.355 -11.423 -6.277 157 HG21 VAL 20 3HG2 VAL 20 11.933 -12.363 -6.803 158 HG22 VAL 20 1HG2 VAL 20 11.052 -13.025 -5.405 159 HG23 VAL 20 2HG2 VAL 20 10.880 -11.306 -5.832 160 H GLU 21 HN GLU 21 13.752 -15.648 -4.447 161 HA GLU 21 HA GLU 21 11.328 -16.017 -2.874 162 HB2 GLU 21 2HB GLU 21 10.970 -18.146 -4.284 163 HB3 GLU 21 3HB GLU 21 10.596 -16.615 -5.050 164 HG2 GLU 21 2HG GLU 21 12.444 -16.708 -6.476 165 HG3 GLU 21 3HG GLU 21 13.411 -17.635 -5.347 166 HE2 GLU 21 HE2 GLU 21 12.566 -20.076 -7.800 167 H LYS 22 HN LYS 22 11.638 -17.285 -1.081 168 HA LYS 22 HA LYS 22 14.254 -18.356 -0.645 169 HB2 LYS 22 2HB LYS 22 13.577 -18.651 1.579 170 HB3 LYS 22 3HB LYS 22 12.763 -17.189 1.062 171 HG2 LYS 22 2HG LYS 22 10.778 -18.804 0.414 172 HG3 LYS 22 3HG LYS 22 11.587 -19.959 1.453 173 HD2 LYS 22 2HD LYS 22 11.572 -18.201 3.300 174 HD3 LYS 22 3HD LYS 22 10.598 -17.184 2.255 175 HE2 LYS 22 2HE LYS 22 9.835 -19.982 3.225 176 HE3 LYS 22 3HE LYS 22 9.175 -18.477 3.837 177 HZ1 LYS 22 2HZ LYS 22 7.672 -19.312 2.196 178 HZ3 LYS 22 1HZ LYS 22 8.844 -19.555 1.092 179 H GLY 23 HN GLY 23 14.810 -20.142 -1.809 180 HA2 GLY 23 1HA GLY 23 14.349 -22.630 -1.342 181 HA3 GLY 23 2HA GLY 23 12.801 -22.276 -2.085 182 H GLY 24 HN GLY 24 14.146 -20.154 -3.874 183 HA2 GLY 24 1HA GLY 24 14.717 -21.928 -6.055 184 HA3 GLY 24 2HA GLY 24 14.717 -20.176 -6.067 185 H LYS 25 HN LYS 25 16.704 -21.856 -7.354 186 HA LYS 25 HA LYS 25 19.010 -22.001 -5.706 187 HB2 LYS 25 2HB LYS 25 20.022 -22.988 -7.513 188 HB3 LYS 25 3HB LYS 25 18.340 -23.327 -7.866 189 HG2 LYS 25 2HG LYS 25 18.222 -21.386 -9.390 190 HG3 LYS 25 3HG LYS 25 19.856 -20.914 -8.966 191 HD2 LYS 25 2HD LYS 25 19.081 -23.541 -10.323 192 HD3 LYS 25 3HD LYS 25 19.770 -22.151 -11.137 193 HE2 LYS 25 2HE LYS 25 21.714 -23.374 -10.752 194 HE3 LYS 25 3HE LYS 25 21.689 -22.403 -9.293 195 HZ1 LYS 25 2HZ LYS 25 21.797 -24.432 -8.303 196 HZ3 LYS 25 1HZ LYS 25 21.204 -25.247 -9.583 197 H HIS 26 HN HIS 26 21.130 -20.854 -6.631 198 HA HIS 26 HA HIS 26 20.492 -18.036 -6.487 199 HB2 HIS 26 2HB HIS 26 22.986 -19.679 -6.114 200 HB3 HIS 26 3HB HIS 26 23.098 -17.949 -6.364 201 HD1 HIS 26 HD1 HIS 26 22.609 -16.433 -4.379 202 HD2 HIS 26 HD2 HIS 26 21.544 -20.432 -3.692 203 HE1 HIS 26 HE1 HIS 26 22.021 -16.600 -1.902 204 H LYS 27 HN LYS 27 19.495 -18.031 -8.681 205 HA LYS 27 HA LYS 27 20.836 -18.733 -10.979 206 HB2 LYS 27 2HB LYS 27 18.703 -16.694 -10.364 207 HB3 LYS 27 3HB LYS 27 19.341 -16.863 -11.987 208 HG2 LYS 27 2HG LYS 27 18.898 -19.484 -11.480 209 HG3 LYS 27 3HG LYS 27 17.719 -18.816 -10.369 210 HD2 LYS 27 2HD LYS 27 17.845 -18.524 -13.385 211 HD3 LYS 27 3HD LYS 27 16.508 -19.079 -12.398 212 HE2 LYS 27 2HE LYS 27 16.725 -16.586 -11.369 213 HE3 LYS 27 3HE LYS 27 17.428 -16.264 -12.941 214 HZ1 LYS 27 2HZ LYS 27 14.699 -17.208 -12.344 215 HZ3 LYS 27 1HZ LYS 27 15.338 -17.491 -13.815 216 H THR 28 HN THR 28 21.227 -16.642 -12.676 217 HA THR 28 HA THR 28 23.763 -15.850 -12.306 218 HB THR 28 HB THR 28 21.698 -13.958 -13.499 219 HG1 THR 28 HG1 THR 28 21.480 -15.551 -15.163 220 HG21 THR 28 1HG2 THR 28 23.492 -14.312 -15.434 221 HG22 THR 28 2HG2 THR 28 23.865 -13.206 -14.090 222 HG23 THR 28 3HG2 THR 28 24.536 -14.854 -14.098 223 H GLY 29 HN GLY 29 20.924 -14.540 -10.645 224 HA2 GLY 29 1HA GLY 29 22.702 -12.584 -9.314 225 HA3 GLY 29 2HA GLY 29 20.984 -12.361 -9.579 226 HA PRO 30 HA PRO 30 21.831 -14.588 -5.569 227 HB2 PRO 30 2HB PRO 30 21.993 -12.544 -3.763 228 HB3 PRO 30 3HB PRO 30 23.401 -13.341 -4.436 229 HG2 PRO 30 2HG PRO 30 22.298 -10.674 -5.077 230 HG3 PRO 30 3HG PRO 30 23.899 -11.307 -5.406 231 HD2 PRO 30 2HD PRO 30 21.755 -11.001 -7.286 232 HD3 PRO 30 3HD PRO 30 23.315 -11.742 -7.586 233 H ASN 31 HN ASN 31 20.283 -15.207 -4.033 234 HA ASN 31 HA ASN 31 17.720 -14.345 -4.830 235 HB2 ASN 31 2HB ASN 31 18.605 -16.651 -3.769 236 HB3 ASN 31 3HB ASN 31 18.217 -15.863 -2.252 237 HD21 ASN 31 1HD2 ASN 31 17.077 -17.977 -4.349 238 HD22 ASN 31 2HD2 ASN 31 15.366 -17.718 -4.264 239 H LEU 32 HN LEU 32 16.061 -13.593 -3.067 240 HA LEU 32 HA LEU 32 17.389 -11.915 -1.062 241 HB2 LEU 32 2HB LEU 32 14.990 -11.016 -2.639 242 HB3 LEU 32 3HB LEU 32 15.993 -10.075 -1.553 243 HG LEU 32 HG LEU 32 16.501 -9.405 -3.780 244 HD11 LEU 32 1HD1 LEU 32 18.636 -9.215 -3.224 245 HD12 LEU 32 2HD1 LEU 32 18.455 -10.543 -2.054 246 HD13 LEU 32 3HD1 LEU 32 18.935 -10.895 -3.731 247 HD21 LEU 32 3HD2 LEU 32 15.716 -11.842 -4.607 248 HD22 LEU 32 1HD2 LEU 32 16.674 -10.723 -5.608 249 HD23 LEU 32 2HD2 LEU 32 17.482 -12.040 -4.726 250 H HIS 33 HN HIS 33 16.925 -13.085 0.760 251 HA HIS 33 HA HIS 33 14.114 -13.843 1.086 252 HB2 HIS 33 2HB HIS 33 15.409 -15.812 1.099 253 HB3 HIS 33 3HB HIS 33 16.673 -15.091 2.074 254 HD1 HIS 33 HD1 HIS 33 16.256 -17.303 3.601 255 HD2 HIS 33 HD2 HIS 33 13.201 -14.427 3.592 256 HE1 HIS 33 HE1 HIS 33 14.791 -17.809 5.627 257 H GLY 34 HN GLY 34 16.948 -13.188 3.267 258 HA2 GLY 34 1HA GLY 34 15.145 -11.587 4.954 259 HA3 GLY 34 2HA GLY 34 16.651 -12.336 5.445 260 H LEU 35 HN LEU 35 16.366 -10.640 2.324 261 HA LEU 35 HA LEU 35 18.582 -9.146 2.518 262 HB2 LEU 35 2HB LEU 35 17.479 -9.211 0.476 263 HB3 LEU 35 3HB LEU 35 15.955 -8.676 1.156 264 HG LEU 35 HG LEU 35 17.378 -6.468 1.657 265 HD11 LEU 35 1HD1 LEU 35 18.894 -7.914 -0.483 266 HD12 LEU 35 2HD1 LEU 35 18.743 -6.142 -0.566 267 HD13 LEU 35 3HD1 LEU 35 19.486 -6.906 0.860 268 HD21 LEU 35 3HD2 LEU 35 15.284 -6.567 0.407 269 HD22 LEU 35 1HD2 LEU 35 16.466 -5.514 -0.407 270 HD23 LEU 35 2HD2 LEU 35 16.155 -7.151 -1.031 271 H PHE 36 HN PHE 36 15.316 -8.251 3.785 272 HA PHE 36 HA PHE 36 16.300 -5.784 4.835 273 HB2 PHE 36 2HB PHE 36 13.776 -7.466 4.805 274 HB3 PHE 36 3HB PHE 36 13.894 -6.257 6.069 275 HD1 PHE 36 HD1 PHE 36 14.252 -6.594 2.372 276 HD2 PHE 36 HD2 PHE 36 13.174 -4.101 5.631 277 HE1 PHE 36 HE1 PHE 36 13.460 -4.837 0.764 278 HE2 PHE 36 HE2 PHE 36 12.382 -2.342 4.024 279 HZ PHE 36 HZ PHE 36 12.535 -2.731 1.610 280 H GLY 37 HN GLY 37 18.114 -6.537 6.161 281 HA2 GLY 37 1HA GLY 37 18.038 -6.476 8.734 282 HA3 GLY 37 2HA GLY 37 17.332 -8.069 8.549 283 H ARG 38 HN ARG 38 19.158 -8.100 5.888 284 HA ARG 38 HA ARG 38 21.362 -9.283 7.331 285 HB2 ARG 38 2HB ARG 38 21.823 -10.527 5.319 286 HB3 ARG 38 3HB ARG 38 20.078 -10.521 5.477 287 HG2 ARG 38 2HG ARG 38 19.933 -8.598 3.887 288 HG3 ARG 38 3HG ARG 38 21.679 -8.585 3.737 289 HD2 ARG 38 2HD ARG 38 20.358 -9.841 1.895 290 HD3 ARG 38 3HD ARG 38 21.726 -10.683 2.596 291 HE ARG 38 HE ARG 38 19.125 -11.182 3.909 292 HH11 ARG 38 2HH2 ARG 38 21.504 -12.302 1.534 293 HH12 ARG 38 1HH2 ARG 38 20.917 -13.932 1.530 294 HH22 ARG 38 HH1 ARG 38 19.062 -14.515 2.932 295 H LYS 39 HN LYS 39 23.623 -8.825 6.658 296 HA LYS 39 HA LYS 39 23.939 -6.043 6.004 297 HB2 LYS 39 2HB LYS 39 25.219 -7.531 7.757 298 HB3 LYS 39 3HB LYS 39 26.215 -7.966 6.384 299 HG2 LYS 39 2HG LYS 39 26.947 -5.730 6.034 300 HG3 LYS 39 3HG LYS 39 25.602 -5.046 6.925 301 HD2 LYS 39 2HD LYS 39 26.783 -6.597 8.882 302 HD3 LYS 39 3HD LYS 39 28.186 -6.139 7.936 303 HE2 LYS 39 2HE LYS 39 27.013 -3.707 8.061 304 HE3 LYS 39 3HE LYS 39 26.298 -4.392 9.506 305 HZ1 LYS 39 2HZ LYS 39 28.780 -5.085 9.964 306 HZ3 LYS 39 1HZ LYS 39 28.280 -3.580 10.330 307 H THR 40 HN THR 40 25.822 -5.497 4.391 308 HA THR 40 HA THR 40 25.004 -6.589 1.867 309 HB THR 40 HB THR 40 26.904 -4.898 1.166 310 HG1 THR 40 HG1 THR 40 27.941 -4.703 3.203 311 HG21 THR 40 1HG2 THR 40 25.480 -2.931 1.660 312 HG22 THR 40 2HG2 THR 40 24.455 -4.285 1.131 313 HG23 THR 40 3HG2 THR 40 24.564 -3.875 2.859 314 H GLY 41 HN GLY 41 25.641 -8.540 1.196 315 HA2 GLY 41 1HA GLY 41 27.223 -9.967 0.325 316 HA3 GLY 41 2HA GLY 41 28.499 -9.091 1.146 317 H GLN 42 HN GLN 42 25.431 -10.646 2.333 318 HA GLN 42 HA GLN 42 27.129 -12.121 4.192 319 HB2 GLN 42 2HB GLN 42 24.331 -10.979 4.500 320 HB3 GLN 42 3HB GLN 42 24.917 -12.240 5.565 321 HG2 GLN 42 2HG GLN 42 26.395 -9.609 5.104 322 HG3 GLN 42 3HG GLN 42 25.268 -9.864 6.421 323 HE21 GLN 42 1HE2 GLN 42 28.426 -10.324 5.236 324 HE22 GLN 42 2HE2 GLN 42 29.099 -11.223 6.554 325 H ALA 43 HN ALA 43 25.025 -12.303 1.482 326 HA ALA 43 HA ALA 43 23.485 -14.471 1.746 327 HB1 ALA 43 3HB ALA 43 25.052 -13.224 -0.434 328 HB2 ALA 43 1HB ALA 43 24.613 -14.924 -0.723 329 HB3 ALA 43 2HB ALA 43 23.343 -13.721 -0.392 330 HA PRO 44 HA PRO 44 26.566 -17.382 3.039 331 HB2 PRO 44 2HB PRO 44 24.873 -19.025 4.417 332 HB3 PRO 44 3HB PRO 44 25.686 -17.656 5.148 333 HG2 PRO 44 2HG PRO 44 22.854 -17.916 4.344 334 HG3 PRO 44 3HG PRO 44 23.581 -16.757 5.439 335 HD2 PRO 44 2HD PRO 44 22.758 -16.279 2.733 336 HD3 PRO 44 3HD PRO 44 23.591 -15.156 3.789 337 H GLY 45 HN GLY 45 26.675 -17.674 0.640 338 HA2 GLY 45 1HA GLY 45 26.513 -20.355 0.023 339 HA3 GLY 45 2HA GLY 45 24.984 -19.671 -0.488 340 H TYR 46 HN TYR 46 25.631 -17.120 -1.385 341 HA TYR 46 HA TYR 46 27.608 -17.672 -3.495 342 HB2 TYR 46 2HB TYR 46 25.075 -17.643 -4.079 343 HB3 TYR 46 3HB TYR 46 25.032 -15.979 -3.532 344 HD1 TYR 46 HD1 TYR 46 27.767 -17.568 -5.504 345 HD2 TYR 46 HD2 TYR 46 24.447 -14.869 -5.542 346 HE1 TYR 46 HE1 TYR 46 28.423 -16.782 -7.831 347 HE2 TYR 46 HE2 TYR 46 25.115 -14.093 -7.868 348 HH TYR 46 HH TYR 46 26.379 -15.106 -9.808 349 H SER 47 HN SER 47 29.242 -16.645 -2.115 350 HA SER 47 HA SER 47 28.951 -14.163 -1.009 351 HB2 SER 47 2HB SER 47 31.449 -14.067 -1.076 352 HB3 SER 47 3HB SER 47 30.848 -15.605 -0.490 353 HG SER 47 HG SER 47 32.590 -15.809 -2.078 354 H TYR 48 HN TYR 48 28.960 -12.065 -1.804 355 HA TYR 48 HA TYR 48 28.890 -11.754 -4.658 356 HB2 TYR 48 2HB TYR 48 28.916 -9.727 -2.338 357 HB3 TYR 48 3HB TYR 48 28.300 -9.421 -3.949 358 HD1 TYR 48 HD2 TYR 48 27.113 -12.513 -3.743 359 HD2 TYR 48 HD1 TYR 48 26.635 -8.822 -1.633 360 HE1 TYR 48 HE2 TYR 48 24.793 -13.234 -2.992 361 HE2 TYR 48 HE1 TYR 48 24.317 -9.556 -0.889 362 HH TYR 48 HH TYR 48 22.961 -11.304 -0.695 363 H THR 49 HN THR 49 30.004 -9.362 -5.246 364 HA THR 49 HA THR 49 32.789 -9.994 -5.274 365 HB THR 49 HB THR 49 32.842 -7.820 -6.595 366 HG1 THR 49 HG1 THR 49 30.605 -6.930 -6.876 367 HG21 THR 49 1HG2 THR 49 32.221 -9.894 -7.832 368 HG22 THR 49 2HG2 THR 49 30.535 -9.713 -7.293 369 HG23 THR 49 3HG2 THR 49 31.248 -8.517 -8.402 370 H ALA 50 HN ALA 50 34.288 -7.852 -4.930 371 HA ALA 50 HA ALA 50 34.063 -7.424 -2.072 372 HB1 ALA 50 3HB ALA 50 36.198 -8.154 -3.088 373 HB2 ALA 50 1HB ALA 50 36.227 -6.677 -4.081 374 HB3 ALA 50 2HB ALA 50 36.358 -6.561 -2.310 375 H ALA 51 HN ALA 51 32.397 -6.115 -4.445 376 HA ALA 51 HA ALA 51 33.022 -3.326 -3.854 377 HB1 ALA 51 3HB ALA 51 30.887 -4.249 -5.768 378 HB2 ALA 51 1HB ALA 51 31.937 -2.814 -5.848 379 HB3 ALA 51 2HB ALA 51 32.599 -4.424 -6.219 380 H ASN 52 HN ASN 52 30.483 -5.846 -3.523 381 HA ASN 52 HA ASN 52 28.866 -3.915 -2.094 382 HB2 ASN 52 2HB ASN 52 27.825 -5.392 -3.879 383 HB3 ASN 52 3HB ASN 52 28.225 -6.798 -2.913 384 HD21 ASN 52 1HD2 ASN 52 27.337 -6.970 -0.765 385 HD22 ASN 52 2HD2 ASN 52 25.783 -6.296 -0.400 386 H LYS 53 HN LYS 53 31.090 -6.580 -1.710 387 HA LYS 53 HA LYS 53 30.068 -7.507 0.794 388 HB2 LYS 53 2HB LYS 53 31.243 -9.016 -0.708 389 HB3 LYS 53 3HB LYS 53 32.678 -8.012 -0.662 390 HG2 LYS 53 2HG LYS 53 32.522 -8.361 1.962 391 HG3 LYS 53 3HG LYS 53 31.498 -9.721 1.547 392 HD2 LYS 53 2HD LYS 53 33.447 -10.364 -0.120 393 HD3 LYS 53 3HD LYS 53 34.420 -9.282 0.856 394 HE2 LYS 53 2HE LYS 53 34.549 -11.670 1.631 395 HE3 LYS 53 3HE LYS 53 33.972 -10.584 2.880 396 HZ1 LYS 53 2HZ LYS 53 31.984 -11.903 1.161 397 HZ3 LYS 53 1HZ LYS 53 31.831 -11.421 2.709 398 H ASN 54 HN ASN 54 32.281 -4.995 -0.354 399 HA ASN 54 HA ASN 54 33.612 -4.675 2.090 400 HB2 ASN 54 2HB ASN 54 34.484 -2.613 1.096 401 HB3 ASN 54 3HB ASN 54 34.427 -3.832 -0.161 402 HD21 ASN 54 1HD2 ASN 54 33.800 -3.051 -2.010 403 HD22 ASN 54 2HD2 ASN 54 32.575 -1.860 -2.294 404 H LYS 55 HN LYS 55 30.529 -3.618 0.701 405 HA LYS 55 HA LYS 55 30.051 -1.318 2.158 406 HB2 LYS 55 2HB LYS 55 28.399 -3.357 0.745 407 HB3 LYS 55 3HB LYS 55 27.565 -2.308 1.874 408 HG2 LYS 55 2HG LYS 55 29.323 -1.402 -0.455 409 HG3 LYS 55 3HG LYS 55 27.574 -1.309 -0.388 410 HD2 LYS 55 2HD LYS 55 28.059 0.070 1.860 411 HD3 LYS 55 3HD LYS 55 29.621 0.331 1.110 412 HE2 LYS 55 2HE LYS 55 28.064 0.920 -1.028 413 HE3 LYS 55 3HE LYS 55 26.907 1.295 0.234 414 HZ1 LYS 55 2HZ LYS 55 28.591 3.106 -0.539 415 HZ3 LYS 55 1HZ LYS 55 29.639 2.366 0.463 416 H GLY 56 HN GLY 56 28.645 -0.984 4.064 417 HA2 GLY 56 1HA GLY 56 28.625 -3.280 5.912 418 HA3 GLY 56 2HA GLY 56 29.374 -1.770 6.392 419 H ILE 57 HN ILE 57 26.689 -1.444 4.181 420 HA ILE 57 HA ILE 57 25.122 -0.295 6.340 421 HB ILE 57 HB ILE 57 23.800 0.694 4.581 422 HG12 ILE 57 2HG1 ILE 57 24.879 0.318 2.166 423 HG13 ILE 57 3HG1 ILE 57 25.268 -1.248 2.850 424 HG21 ILE 57 1HG2 ILE 57 26.269 1.421 3.325 425 HG22 ILE 57 2HG2 ILE 57 25.300 2.325 4.514 426 HG23 ILE 57 3HG2 ILE 57 26.550 1.185 5.067 427 HD11 ILE 57 3HD1 ILE 57 23.024 -1.155 1.677 428 HD12 ILE 57 1HD1 ILE 57 22.931 -1.694 3.371 429 HD13 ILE 57 2HD1 ILE 57 22.473 -0.029 2.940 430 H ILE 58 HN ILE 58 22.555 -0.645 5.800 431 HA ILE 58 HA ILE 58 22.249 -3.564 5.651 432 HB ILE 58 HB ILE 58 20.686 -1.580 7.307 433 HG12 ILE 58 2HG1 ILE 58 22.982 -1.939 8.135 434 HG13 ILE 58 3HG1 ILE 58 21.761 -2.548 9.236 435 HG21 ILE 58 1HG2 ILE 58 19.130 -3.220 6.857 436 HG22 ILE 58 2HG2 ILE 58 20.353 -4.509 6.753 437 HG23 ILE 58 3HG2 ILE 58 19.891 -3.847 8.338 438 HD11 ILE 58 3HD1 ILE 58 23.308 -4.248 7.225 439 HD12 ILE 58 1HD1 ILE 58 23.633 -4.162 8.973 440 HD13 ILE 58 2HD1 ILE 58 22.102 -4.852 8.386 441 H TRP 59 HN TRP 59 20.760 -4.381 4.222 442 HA TRP 59 HA TRP 59 19.783 -2.595 2.238 443 HB2 TRP 59 2HB TRP 59 19.559 -5.550 2.737 444 HB3 TRP 59 3HB TRP 59 18.616 -4.774 1.480 445 HD1 TRP 59 HD1 TRP 59 21.691 -6.611 1.684 446 HE1 TRP 59 HE1 TRP 59 23.455 -6.072 -0.203 447 HE3 TRP 59 HE3 TRP 59 19.558 -2.238 0.206 448 HZ2 TRP 59 HZ2 TRP 59 23.755 -3.926 -2.059 449 HZ3 TRP 59 HZ3 TRP 59 20.650 -0.983 -1.651 450 HH2 TRP 59 HH2 TRP 59 22.677 -1.761 -2.773 451 H GLY 60 HN GLY 60 18.385 -1.099 3.309 452 HA2 GLY 60 1HA GLY 60 15.940 -2.306 4.460 453 HA3 GLY 60 2HA GLY 60 16.644 -0.788 4.979 454 H GLU 61 HN GLU 61 14.793 0.486 4.498 455 HA GLU 61 HA GLU 61 13.823 0.390 1.791 456 HB2 GLU 61 2HB GLU 61 12.885 1.545 4.391 457 HB3 GLU 61 3HB GLU 61 12.382 2.391 2.940 458 HG2 GLU 61 2HG GLU 61 11.826 -0.123 2.118 459 HG3 GLU 61 3HG GLU 61 11.709 -0.402 3.844 460 HE2 GLU 61 HE2 GLU 61 9.137 2.287 2.287 461 H ASP 62 HN ASP 62 15.016 2.949 4.095 462 HA ASP 62 HA ASP 62 15.184 4.981 2.340 463 HB2 ASP 62 2HB ASP 62 15.646 5.212 4.746 464 HB3 ASP 62 3HB ASP 62 17.090 4.231 4.602 465 HD2 ASP 62 HD2 ASP 62 16.835 7.579 5.077 466 H THR 63 HN THR 63 17.575 2.347 3.029 467 HA THR 63 HA THR 63 19.597 3.332 1.322 468 HB THR 63 HB THR 63 20.631 1.188 1.812 469 HG1 THR 63 HG1 THR 63 19.195 -0.485 1.645 470 HG21 THR 63 1HG2 THR 63 19.552 2.737 3.895 471 HG22 THR 63 2HG2 THR 63 18.963 1.096 4.252 472 HG23 THR 63 3HG2 THR 63 20.711 1.400 4.096 473 H LEU 64 HN LEU 64 17.220 0.629 0.842 474 HA LEU 64 HA LEU 64 17.859 -0.051 -1.684 475 HB2 LEU 64 2HB LEU 64 15.292 0.051 -0.166 476 HB3 LEU 64 3HB LEU 64 15.238 -0.332 -1.875 477 HG LEU 64 HG LEU 64 16.898 -1.839 0.163 478 HD11 LEU 64 1HD1 LEU 64 15.157 -3.129 0.682 479 HD12 LEU 64 2HD1 LEU 64 14.137 -1.868 -0.051 480 HD13 LEU 64 3HD1 LEU 64 14.648 -3.273 -1.017 481 HD21 LEU 64 3HD2 LEU 64 16.381 -2.227 -2.780 482 HD22 LEU 64 1HD2 LEU 64 17.931 -2.167 -1.907 483 HD23 LEU 64 2HD2 LEU 64 16.862 -3.578 -1.726 484 H MET 65 HN MET 65 15.766 2.725 -0.678 485 HA MET 65 HA MET 65 14.942 3.570 -3.087 486 HB2 MET 65 2HB MET 65 14.758 4.534 -0.579 487 HB3 MET 65 3HB MET 65 16.052 5.591 -1.107 488 HG2 MET 65 2HG MET 65 14.254 6.901 -1.765 489 HG3 MET 65 3HG MET 65 14.422 5.947 -3.225 490 HE1 MET 65 3HE MET 65 11.709 5.767 -4.093 491 HE2 MET 65 1HE MET 65 13.003 4.549 -4.160 492 HE3 MET 65 2HE MET 65 11.367 4.080 -3.641 493 H GLU 66 HN GLU 66 17.874 4.989 -1.454 494 HA GLU 66 HA GLU 66 18.804 6.429 -3.495 495 HB2 GLU 66 2HB GLU 66 19.740 5.856 -1.044 496 HB3 GLU 66 3HB GLU 66 20.823 4.816 -1.948 497 HG2 GLU 66 2HG GLU 66 22.076 6.753 -2.057 498 HG3 GLU 66 3HG GLU 66 21.082 7.030 -3.474 499 HE2 GLU 66 HE2 GLU 66 22.111 9.085 -1.366 500 H TYR 67 HN TYR 67 19.742 2.969 -2.851 501 HA TYR 67 HA TYR 67 21.347 2.555 -5.007 502 HB2 TYR 67 2HB TYR 67 20.411 1.080 -2.973 503 HB3 TYR 67 3HB TYR 67 19.149 0.620 -4.099 504 HD1 TYR 67 HD1 TYR 67 22.778 1.164 -4.814 505 HD2 TYR 67 HD2 TYR 67 19.577 -1.657 -4.496 506 HE1 TYR 67 HE1 TYR 67 24.279 -0.658 -5.760 507 HE2 TYR 67 HE2 TYR 67 21.089 -3.468 -5.442 508 HH TYR 67 HH TYR 67 24.376 -2.693 -6.517 509 H LEU 68 HN LEU 68 17.738 2.443 -4.881 510 HA LEU 68 HA LEU 68 17.441 1.516 -7.521 511 HB2 LEU 68 2HB LEU 68 15.626 2.898 -5.557 512 HB3 LEU 68 3HB LEU 68 15.096 2.500 -7.179 513 HG LEU 68 HG LEU 68 16.153 0.466 -5.197 514 HD11 LEU 68 1HD1 LEU 68 13.890 1.782 -4.743 515 HD12 LEU 68 2HD1 LEU 68 13.260 0.599 -5.913 516 HD13 LEU 68 3HD1 LEU 68 14.054 0.039 -4.421 517 HD21 LEU 68 3HD2 LEU 68 14.410 -0.498 -7.319 518 HD22 LEU 68 1HD2 LEU 68 15.877 0.285 -7.955 519 HD23 LEU 68 2HD2 LEU 68 16.015 -1.067 -6.803 520 H GLU 69 HN GLU 69 18.106 4.674 -6.082 521 HA GLU 69 HA GLU 69 17.300 6.091 -8.409 522 HB2 GLU 69 2HB GLU 69 17.202 7.130 -6.171 523 HB3 GLU 69 3HB GLU 69 18.934 6.948 -5.981 524 HG2 GLU 69 2HG GLU 69 19.423 8.584 -7.635 525 HG3 GLU 69 3HG GLU 69 17.839 8.454 -8.375 526 HE2 GLU 69 HE2 GLU 69 18.683 8.985 -4.978 527 H ASN 70 HN ASN 70 20.315 4.723 -7.061 528 HA ASN 70 HA ASN 70 21.501 4.869 -9.621 529 HB2 ASN 70 2HB ASN 70 21.912 7.205 -8.561 530 HB3 ASN 70 3HB ASN 70 22.922 6.392 -7.382 531 HD21 ASN 70 1HD2 ASN 70 23.885 8.345 -9.065 532 HD22 ASN 70 2HD2 ASN 70 25.024 7.676 -10.186 533 HA PRO 71 HA PRO 71 22.885 1.547 -6.846 534 HB2 PRO 71 2HB PRO 71 22.508 -0.532 -8.581 535 HB3 PRO 71 3HB PRO 71 21.294 -0.011 -7.430 536 HG2 PRO 71 2HG PRO 71 21.388 0.429 -10.352 537 HG3 PRO 71 3HG PRO 71 20.018 0.556 -9.266 538 HD2 PRO 71 2HD PRO 71 21.522 2.723 -10.391 539 HD3 PRO 71 3HD PRO 71 20.228 2.845 -9.217 540 H LYS 72 HN LYS 72 23.917 2.852 -9.739 541 HA LYS 72 HA LYS 72 26.183 1.131 -10.039 542 HB2 LYS 72 2HB LYS 72 24.850 2.589 -11.797 543 HB3 LYS 72 3HB LYS 72 25.977 3.839 -11.311 544 HG2 LYS 72 2HG LYS 72 26.887 1.049 -12.142 545 HG3 LYS 72 3HG LYS 72 26.702 2.359 -13.291 546 HD2 LYS 72 2HD LYS 72 28.576 2.289 -10.883 547 HD3 LYS 72 3HD LYS 72 29.038 2.269 -12.573 548 HE2 LYS 72 2HE LYS 72 27.948 4.569 -10.936 549 HE3 LYS 72 3HE LYS 72 29.360 4.533 -11.974 550 HZ1 LYS 72 2HZ LYS 72 28.081 4.886 -13.829 551 HZ3 LYS 72 1HZ LYS 72 27.070 5.590 -12.765 552 H LYS 73 HN LYS 73 25.553 4.463 -8.778 553 HA LYS 73 HA LYS 73 28.246 4.945 -8.116 554 HB2 LYS 73 2HB LYS 73 27.016 6.877 -8.330 555 HB3 LYS 73 3HB LYS 73 25.603 6.215 -7.534 556 HG2 LYS 73 2HG LYS 73 26.856 6.239 -5.346 557 HG3 LYS 73 3HG LYS 73 28.225 6.968 -6.160 558 HD2 LYS 73 2HD LYS 73 25.519 8.285 -6.437 559 HD3 LYS 73 3HD LYS 73 26.389 8.475 -4.927 560 HE2 LYS 73 2HE LYS 73 28.251 9.549 -5.998 561 HE3 LYS 73 3HE LYS 73 27.758 9.008 -7.591 562 HZ1 LYS 73 2HZ LYS 73 26.876 11.097 -7.652 563 HZ3 LYS 73 1HZ LYS 73 26.730 11.243 -6.037 564 H TYR 74 HN TYR 74 25.424 3.628 -6.292 565 HA TYR 74 HA TYR 74 26.464 3.538 -3.782 566 HB2 TYR 74 2HB TYR 74 24.222 2.690 -5.018 567 HB3 TYR 74 3HB TYR 74 25.069 1.159 -5.112 568 HD1 TYR 74 HD2 TYR 74 26.264 0.561 -2.680 569 HD2 TYR 74 HD1 TYR 74 22.701 2.851 -3.285 570 HE1 TYR 74 HE2 TYR 74 25.492 -0.004 -0.325 571 HE2 TYR 74 HE1 TYR 74 21.941 2.278 -0.928 572 HH TYR 74 HH TYR 74 23.354 1.618 1.307 573 H ILE 75 HN ILE 75 26.883 1.040 -6.387 574 HA ILE 75 HA ILE 75 29.347 0.248 -5.029 575 HB ILE 75 HB ILE 75 27.406 -1.781 -6.112 576 HG12 ILE 75 2HG1 ILE 75 27.630 -0.781 -3.257 577 HG13 ILE 75 3HG1 ILE 75 26.255 -0.579 -4.324 578 HG21 ILE 75 1HG2 ILE 75 30.101 -1.859 -5.145 579 HG22 ILE 75 2HG2 ILE 75 29.057 -2.774 -4.032 580 HG23 ILE 75 3HG2 ILE 75 29.086 -3.184 -5.764 581 HD11 ILE 75 3HD1 ILE 75 27.002 -3.387 -4.251 582 HD12 ILE 75 1HD1 ILE 75 26.788 -2.773 -2.595 583 HD13 ILE 75 2HD1 ILE 75 25.464 -2.627 -3.776 584 HA PRO 76 HA PRO 76 30.161 0.964 -9.348 585 HB2 PRO 76 2HB PRO 76 32.634 2.079 -9.015 586 HB3 PRO 76 3HB PRO 76 31.157 3.021 -9.066 587 HG2 PRO 76 2HG PRO 76 32.826 2.315 -6.730 588 HG3 PRO 76 3HG PRO 76 31.618 3.576 -6.875 589 HD2 PRO 76 2HD PRO 76 31.314 1.054 -5.543 590 HD3 PRO 76 3HD PRO 76 30.072 2.265 -5.789 591 H GLY 77 HN GLY 77 30.207 -1.121 -10.075 592 HA2 GLY 77 1HA GLY 77 32.166 -2.372 -11.087 593 HA3 GLY 77 2HA GLY 77 32.707 -2.556 -9.430 594 H THR 78 HN THR 78 29.601 -2.574 -8.728 595 HA THR 78 HA THR 78 29.316 -5.225 -8.218 596 HB THR 78 HB THR 78 27.844 -3.473 -7.312 597 HG1 THR 78 HG1 THR 78 25.867 -4.697 -7.746 598 HG21 THR 78 1HG2 THR 78 27.688 -2.502 -9.930 599 HG22 THR 78 2HG2 THR 78 26.118 -3.313 -9.721 600 HG23 THR 78 3HG2 THR 78 26.610 -2.021 -8.599 601 H LYS 79 HN LYS 79 27.742 -6.836 -9.163 602 HA LYS 79 HA LYS 79 28.333 -7.003 -12.010 603 HB2 LYS 79 2HB LYS 79 27.104 -9.182 -10.328 604 HB3 LYS 79 3HB LYS 79 28.028 -9.325 -11.810 605 HG2 LYS 79 2HG LYS 79 29.976 -8.207 -10.419 606 HG3 LYS 79 3HG LYS 79 29.030 -8.674 -9.020 607 HD2 LYS 79 2HD LYS 79 29.808 -10.645 -11.215 608 HD3 LYS 79 3HD LYS 79 30.799 -10.368 -9.797 609 HE2 LYS 79 2HE LYS 79 29.515 -12.169 -9.052 610 HE3 LYS 79 3HE LYS 79 28.537 -10.835 -8.471 611 HZ1 LYS 79 2HZ LYS 79 27.698 -12.806 -10.189 612 HZ3 LYS 79 1HZ LYS 79 27.865 -11.513 -11.165 613 H MET 80 HN MET 80 26.203 -5.244 -10.571 614 HA MET 80 HA MET 80 23.753 -6.399 -11.397 615 HB2 MET 80 2HB MET 80 24.284 -4.616 -9.519 616 HB3 MET 80 3HB MET 80 24.263 -3.442 -10.820 617 HG2 MET 80 2HG MET 80 22.020 -3.349 -10.225 618 HG3 MET 80 3HG MET 80 21.927 -4.638 -11.408 619 HE1 MET 80 3HE MET 80 20.910 -4.188 -7.369 620 HE2 MET 80 1HE MET 80 22.471 -4.945 -6.970 621 HE3 MET 80 2HE MET 80 22.421 -3.508 -8.019 622 H ILE 81 HN ILE 81 22.391 -5.774 -13.162 623 HA ILE 81 HA ILE 81 23.799 -4.232 -15.228 624 HB ILE 81 HB ILE 81 22.030 -6.661 -15.494 625 HG12 ILE 81 2HG1 ILE 81 24.955 -6.141 -16.079 626 HG13 ILE 81 3HG1 ILE 81 24.282 -7.250 -14.902 627 HG21 ILE 81 1HG2 ILE 81 23.167 -5.851 -17.988 628 HG22 ILE 81 2HG2 ILE 81 21.453 -6.034 -17.539 629 HG23 ILE 81 3HG2 ILE 81 22.277 -4.476 -17.292 630 HD11 ILE 81 3HD1 ILE 81 24.692 -8.742 -16.631 631 HD12 ILE 81 1HD1 ILE 81 23.040 -8.247 -17.069 632 HD13 ILE 81 2HD1 ILE 81 24.436 -7.512 -17.893 633 H PHE 82 HN PHE 82 22.781 -2.347 -14.105 634 HA PHE 82 HA PHE 82 20.245 -1.821 -15.355 635 HB2 PHE 82 2HB PHE 82 19.893 -2.978 -13.034 636 HB3 PHE 82 3HB PHE 82 20.641 -1.565 -12.318 637 HD1 PHE 82 HD1 PHE 82 18.071 -2.022 -14.998 638 HD2 PHE 82 HD2 PHE 82 19.066 -0.262 -11.267 639 HE1 PHE 82 HE1 PHE 82 15.843 -0.867 -14.948 640 HE2 PHE 82 HE2 PHE 82 16.839 0.893 -11.218 641 HZ PHE 82 HZ PHE 82 15.253 0.577 -13.059 642 H VAL 83 HN VAL 83 19.518 0.547 -14.625 643 HA VAL 83 HA VAL 83 21.979 2.144 -14.441 644 HB VAL 83 HB VAL 83 20.680 3.828 -15.790 645 HG11 VAL 83 1HG1 VAL 83 22.367 2.803 -17.000 646 HG12 VAL 83 2HG1 VAL 83 21.640 1.185 -16.853 647 HG13 VAL 83 3HG1 VAL 83 20.933 2.382 -17.966 648 HG21 VAL 83 3HG2 VAL 83 18.427 2.992 -15.460 649 HG22 VAL 83 1HG2 VAL 83 18.827 2.945 -17.194 650 HG23 VAL 83 2HG2 VAL 83 18.850 1.446 -16.235 651 H GLY 84 HN GLY 84 18.441 1.933 -13.733 652 HA2 GLY 84 1HA GLY 84 18.165 2.431 -11.231 653 HA3 GLY 84 2HA GLY 84 18.794 4.007 -11.671 654 H ILE 85 HN ILE 85 16.214 3.697 -10.539 655 HA ILE 85 HA ILE 85 14.441 4.059 -12.844 656 HB ILE 85 HB ILE 85 13.783 3.515 -9.946 657 HG12 ILE 85 2HG1 ILE 85 13.669 1.627 -12.316 658 HG13 ILE 85 3HG1 ILE 85 14.945 1.637 -11.116 659 HG21 ILE 85 1HG2 ILE 85 11.512 2.969 -10.973 660 HG22 ILE 85 2HG2 ILE 85 11.955 4.687 -10.844 661 HG23 ILE 85 3HG2 ILE 85 12.075 3.852 -12.412 662 HD11 ILE 85 3HD1 ILE 85 12.903 1.484 -9.397 663 HD12 ILE 85 1HD1 ILE 85 12.061 0.820 -10.818 664 HD13 ILE 85 2HD1 ILE 85 13.531 0.026 -10.204 665 H LYS 86 HN LYS 86 12.976 5.894 -12.872 666 HA LYS 86 HA LYS 86 14.219 8.198 -11.591 667 HB2 LYS 86 2HB LYS 86 13.703 7.967 -14.127 668 HB3 LYS 86 3HB LYS 86 12.042 8.293 -13.674 669 HG2 LYS 86 2HG LYS 86 12.809 10.467 -14.048 670 HG3 LYS 86 3HG LYS 86 13.090 10.325 -12.324 671 HD2 LYS 86 2HD LYS 86 15.468 9.432 -13.004 672 HD3 LYS 86 3HD LYS 86 15.114 10.111 -14.580 673 HE2 LYS 86 2HE LYS 86 16.206 11.899 -13.486 674 HE3 LYS 86 3HE LYS 86 14.514 12.307 -13.284 675 HZ1 LYS 86 2HZ LYS 86 15.870 12.420 -11.196 676 HZ3 LYS 86 1HZ LYS 86 16.045 10.802 -11.234 677 H LYS 87 HN LYS 87 10.781 7.429 -12.445 678 HA LYS 87 HA LYS 87 9.568 8.934 -10.589 679 HB2 LYS 87 2HB LYS 87 8.702 6.138 -11.388 680 HB3 LYS 87 3HB LYS 87 7.672 7.403 -10.746 681 HG2 LYS 87 2HG LYS 87 8.587 8.837 -12.772 682 HG3 LYS 87 3HG LYS 87 9.057 7.287 -13.443 683 HD2 LYS 87 2HD LYS 87 6.692 6.477 -13.199 684 HD3 LYS 87 3HD LYS 87 6.230 8.042 -12.558 685 HE2 LYS 87 2HE LYS 87 5.677 8.302 -14.822 686 HE3 LYS 87 3HE LYS 87 7.286 8.995 -14.788 687 HZ1 LYS 87 2HZ LYS 87 6.623 6.219 -15.613 688 HZ3 LYS 87 1HZ LYS 87 8.144 6.788 -15.493 689 H LYS 88 HN LYS 88 8.983 8.835 -8.404 690 HA LYS 88 HA LYS 88 10.766 7.266 -6.800 691 HB2 LYS 88 2HB LYS 88 10.144 8.645 -5.049 692 HB3 LYS 88 3HB LYS 88 9.969 9.703 -6.433 693 HG2 LYS 88 2HG LYS 88 7.494 9.011 -6.515 694 HG3 LYS 88 3HG LYS 88 7.743 8.207 -4.979 695 HD2 LYS 88 2HD LYS 88 8.337 11.164 -5.462 696 HD3 LYS 88 3HD LYS 88 6.833 10.570 -4.786 697 HE2 LYS 88 2HE LYS 88 9.584 10.615 -3.554 698 HE3 LYS 88 3HE LYS 88 8.043 11.040 -2.834 699 HZ1 LYS 88 2HZ LYS 88 7.511 8.782 -2.523 700 HZ3 LYS 88 1HZ LYS 88 9.096 8.823 -2.150 701 H GLU 89 HN GLU 89 7.250 7.345 -7.577 702 HA GLU 89 HA GLU 89 6.445 5.487 -5.734 703 HB2 GLU 89 2HB GLU 89 5.113 6.972 -7.460 704 HB3 GLU 89 3HB GLU 89 5.252 5.582 -8.517 705 HG2 GLU 89 2HG GLU 89 4.257 4.150 -6.664 706 HG3 GLU 89 3HG GLU 89 4.004 5.611 -5.729 707 HE2 GLU 89 HE2 GLU 89 1.002 5.431 -6.805 708 H GLU 90 HN GLU 90 7.236 4.907 -9.244 709 HA GLU 90 HA GLU 90 6.964 2.289 -9.395 710 HB2 GLU 90 2HB GLU 90 8.295 4.250 -10.879 711 HB3 GLU 90 3HB GLU 90 9.565 3.093 -10.534 712 HG2 GLU 90 2HG GLU 90 8.740 1.959 -12.339 713 HG3 GLU 90 3HG GLU 90 7.516 1.386 -11.223 714 HE2 GLU 90 HE2 GLU 90 5.131 3.749 -12.438 715 H ARG 91 HN ARG 91 9.629 4.007 -7.717 716 HA ARG 91 HA ARG 91 11.102 1.655 -7.267 717 HB2 ARG 91 2HB ARG 91 11.180 4.487 -6.169 718 HB3 ARG 91 3HB ARG 91 12.185 3.248 -5.440 719 HG2 ARG 91 2HG ARG 91 13.165 2.745 -7.706 720 HG3 ARG 91 3HG ARG 91 12.195 4.031 -8.395 721 HD2 ARG 91 2HD ARG 91 14.005 4.635 -6.036 722 HD3 ARG 91 3HD ARG 91 14.696 4.514 -7.642 723 HE ARG 91 HE ARG 91 12.619 6.205 -8.120 724 HH11 ARG 91 2HH2 ARG 91 15.042 6.214 -5.533 725 HH12 ARG 91 1HH2 ARG 91 15.002 7.934 -5.333 726 HH22 ARG 91 HH1 ARG 91 13.539 9.243 -6.708 727 H ALA 92 HN ALA 92 9.068 3.808 -5.147 728 HA ALA 92 HA ALA 92 9.244 2.411 -2.813 729 HB1 ALA 92 3HB ALA 92 8.036 4.295 -2.445 730 HB2 ALA 92 1HB ALA 92 7.365 4.300 -4.094 731 HB3 ALA 92 2HB ALA 92 6.627 3.279 -2.835 732 H ASP 93 HN ASP 93 6.681 1.997 -5.365 733 HA ASP 93 HA ASP 93 5.384 -0.075 -4.239 734 HB2 ASP 93 2HB ASP 93 6.005 0.602 -7.135 735 HB3 ASP 93 3HB ASP 93 5.045 -0.813 -6.752 736 HD2 ASP 93 HD2 ASP 93 4.011 1.665 -8.104 737 H LEU 94 HN LEU 94 8.097 -0.246 -6.679 738 HA LEU 94 HA LEU 94 8.396 -2.954 -6.789 739 HB2 LEU 94 2HB LEU 94 9.525 -1.504 -8.296 740 HB3 LEU 94 3HB LEU 94 10.403 -0.716 -7.000 741 HG LEU 94 HG LEU 94 11.543 -2.941 -6.557 742 HD11 LEU 94 1HD1 LEU 94 10.604 -3.700 -9.323 743 HD12 LEU 94 2HD1 LEU 94 11.462 -4.692 -8.120 744 HD13 LEU 94 3HD1 LEU 94 9.762 -4.236 -7.849 745 HD21 LEU 94 3HD2 LEU 94 12.207 -0.869 -8.200 746 HD22 LEU 94 1HD2 LEU 94 13.274 -2.236 -7.799 747 HD23 LEU 94 2HD2 LEU 94 12.335 -2.254 -9.311 748 H ILE 95 HN ILE 95 9.411 -0.674 -4.238 749 HA ILE 95 HA ILE 95 11.003 -2.626 -2.891 750 HB ILE 95 HB ILE 95 10.054 0.157 -2.318 751 HG12 ILE 95 2HG1 ILE 95 12.862 -0.960 -2.344 752 HG13 ILE 95 3HG1 ILE 95 12.054 -0.431 -3.806 753 HG21 ILE 95 1HG2 ILE 95 9.834 -1.070 -0.200 754 HG22 ILE 95 2HG2 ILE 95 11.522 -1.616 -0.347 755 HG23 ILE 95 3HG2 ILE 95 11.160 0.116 -0.152 756 HD11 ILE 95 3HD1 ILE 95 13.510 1.324 -2.624 757 HD12 ILE 95 1HD1 ILE 95 11.846 1.829 -3.010 758 HD13 ILE 95 2HD1 ILE 95 12.269 1.353 -1.347 759 H ALA 96 HN ALA 96 7.620 -1.492 -2.825 760 HA ALA 96 HA ALA 96 6.874 -2.566 -0.381 761 HB1 ALA 96 3HB ALA 96 4.882 -1.733 -1.026 762 HB2 ALA 96 1HB ALA 96 5.680 -1.233 -2.537 763 HB3 ALA 96 2HB ALA 96 4.825 -2.793 -2.456 764 H TYR 97 HN TYR 97 7.719 -4.090 -3.437 765 HA TYR 97 HA TYR 97 6.523 -6.612 -2.569 766 HB2 TYR 97 2HB TYR 97 6.128 -6.037 -4.895 767 HB3 TYR 97 3HB TYR 97 7.734 -5.362 -5.083 768 HD1 TYR 97 HD2 TYR 97 6.959 -8.686 -3.600 769 HD2 TYR 97 HD1 TYR 97 8.452 -6.566 -7.003 770 HE1 TYR 97 HE2 TYR 97 7.765 -10.872 -4.617 771 HE2 TYR 97 HE1 TYR 97 9.252 -8.759 -8.009 772 HH TYR 97 HH TYR 97 8.394 -11.313 -7.672 773 H LEU 98 HN LEU 98 9.669 -5.020 -3.267 774 HA LEU 98 HA LEU 98 11.163 -7.417 -2.947 775 HB2 LEU 98 2HB LEU 98 11.875 -4.492 -3.062 776 HB3 LEU 98 3HB LEU 98 13.077 -5.739 -2.795 777 HG LEU 98 HG LEU 98 11.408 -5.228 -5.251 778 HD11 LEU 98 1HD1 LEU 98 13.788 -5.526 -6.254 779 HD12 LEU 98 2HD1 LEU 98 13.375 -4.016 -5.407 780 HD13 LEU 98 3HD1 LEU 98 14.338 -5.265 -4.582 781 HD21 LEU 98 3HD2 LEU 98 12.686 -7.809 -4.398 782 HD22 LEU 98 1HD2 LEU 98 11.105 -7.519 -5.164 783 HD23 LEU 98 2HD2 LEU 98 12.599 -7.370 -6.121 784 H LYS 99 HN LYS 99 9.519 -5.295 -0.790 785 HA LYS 99 HA LYS 99 11.309 -5.968 1.411 786 HB2 LYS 99 2HB LYS 99 10.732 -3.646 1.286 787 HB3 LYS 99 3HB LYS 99 9.025 -4.004 1.126 788 HG2 LYS 99 2HG LYS 99 9.057 -5.056 3.418 789 HG3 LYS 99 3HG LYS 99 10.745 -4.614 3.576 790 HD2 LYS 99 2HD LYS 99 9.890 -2.171 3.006 791 HD3 LYS 99 3HD LYS 99 8.319 -2.797 3.466 792 HE2 LYS 99 2HE LYS 99 9.285 -3.535 5.675 793 HE3 LYS 99 3HE LYS 99 10.827 -2.841 5.214 794 HZ1 LYS 99 2HZ LYS 99 8.960 -1.460 6.516 795 HZ3 LYS 99 1HZ LYS 99 8.538 -1.054 4.997 796 H LYS 100 HN LYS 100 8.316 -6.900 -0.130 797 HA LYS 100 HA LYS 100 7.474 -8.330 2.272 798 HB2 LYS 100 2HB LYS 100 5.844 -6.885 1.055 799 HB3 LYS 100 3HB LYS 100 6.009 -7.919 -0.350 800 HG2 LYS 100 2HG LYS 100 5.377 -9.893 1.207 801 HG3 LYS 100 3HG LYS 100 4.925 -8.683 2.392 802 HD2 LYS 100 2HD LYS 100 2.896 -9.163 1.236 803 HD3 LYS 100 3HD LYS 100 3.430 -7.637 0.562 804 HE2 LYS 100 2HE LYS 100 2.890 -8.890 -1.367 805 HE3 LYS 100 3HE LYS 100 4.628 -9.082 -1.264 806 HZ1 LYS 100 2HZ LYS 100 4.312 -11.283 -1.078 807 HZ3 LYS 100 1HZ LYS 100 2.697 -11.105 -1.172 808 H ALA 101 HN ALA 101 9.188 -8.710 -0.719 809 HA ALA 101 HA ALA 101 8.563 -11.496 -1.022 810 HB1 ALA 101 3HB ALA 101 10.379 -11.326 -2.773 811 HB2 ALA 101 1HB ALA 101 9.034 -10.181 -2.993 812 HB3 ALA 101 2HB ALA 101 10.580 -9.618 -2.312 813 H THR 102 HN THR 102 10.940 -9.468 0.652 814 HA THR 102 HA THR 102 12.473 -11.881 1.338 815 HB THR 102 HB THR 102 14.284 -10.295 1.838 816 HG1 THR 102 HG1 THR 102 13.353 -8.427 2.623 817 HG21 THR 102 1HG2 THR 102 12.755 -9.593 -0.717 818 HG22 THR 102 2HG2 THR 102 14.346 -8.897 -0.324 819 HG23 THR 102 3HG2 THR 102 14.178 -10.652 -0.568 820 H ASN 103 HN ASN 103 9.822 -11.379 2.445 821 HA ASN 103 HA ASN 103 10.667 -10.933 5.200 822 HB2 ASN 103 2HB ASN 103 9.122 -9.134 4.342 823 HB3 ASN 103 3HB ASN 103 7.928 -10.355 3.951 824 HD21 ASN 103 1HD2 ASN 103 6.610 -11.143 5.470 825 HD22 ASN 103 2HD2 ASN 103 6.612 -10.692 7.142 826 H GLU 104 HN GLU 104 8.214 -12.464 2.987 827 HA GLU 104 HA GLU 104 6.958 -14.116 4.651 828 HB2 GLU 104 2HB GLU 104 7.974 -14.865 1.873 829 HB3 GLU 104 3HB GLU 104 6.645 -15.643 2.711 830 HG2 GLU 104 2HG GLU 104 5.715 -13.131 2.881 831 HG3 GLU 104 3HG GLU 104 6.770 -12.876 1.507 832 HE2 GLU 104 HE2 GLU 104 3.681 -13.350 1.849 833 HHA HEC 500 HHA HEC 500 23.668 -7.939 -5.480 834 HHB HEC 500 HHB HEC 500 17.858 -5.264 -5.649 835 HHC HEC 500 HHC HEC 500 18.076 -5.856 -12.065 836 HHD HEC 500 HHD HEC 500 22.971 -9.935 -11.469 837 HMA1 HEC 500 1HMA HEC 500 18.532 -5.535 -3.442 838 HMA2 HEC 500 2HMA HEC 500 19.991 -5.788 -2.477 839 HMA3 HEC 500 3HMA HEC 500 19.834 -4.316 -3.454 840 HAA1 HEC 500 1HAA HEC 500 23.397 -6.490 -3.532 841 HAA2 HEC 500 2HAA HEC 500 22.008 -6.371 -2.574 842 HBA1 HEC 500 1HBA HEC 500 23.214 -8.889 -3.743 843 HBA2 HEC 500 2HBA HEC 500 22.902 -8.504 -2.039 844 HMB1 HEC 500 1HMB HEC 500 14.830 -4.989 -7.900 845 HMB2 HEC 500 2HMB HEC 500 15.758 -5.162 -6.426 846 HMB3 HEC 500 3HMB HEC 500 15.820 -3.619 -7.306 847 HAB HEC 500 HAB HEC 500 16.589 -4.384 -11.517 848 HBB1 HEC 500 1HBB HEC 500 16.158 -2.637 -9.757 849 HBB2 HEC 500 2HBB HEC 500 15.050 -2.833 -11.141 850 HBB3 HEC 500 3HBB HEC 500 14.578 -3.401 -9.552 851 HMC1 HEC 500 1HMC HEC 500 18.209 -8.407 -14.117 852 HMC2 HEC 500 2HMC HEC 500 18.454 -6.656 -14.058 853 HMC3 HEC 500 3HMC HEC 500 19.578 -7.652 -14.959 854 HAC HEC 500 HAC HEC 500 21.913 -10.523 -13.190 855 HBC1 HEC 500 1HBC HEC 500 21.027 -8.890 -15.568 856 HBC2 HEC 500 2HBC HEC 500 22.571 -8.661 -14.717 857 HBC3 HEC 500 3HBC HEC 500 22.237 -10.198 -15.512 858 HMD1 HEC 500 1HMD HEC 500 24.589 -11.682 -9.693 859 HMD2 HEC 500 2HMD HEC 500 25.145 -10.367 -10.742 860 HMD3 HEC 500 3HMD HEC 500 25.957 -10.709 -9.188 861 HAD1 HEC 500 1HAD HEC 500 25.288 -9.190 -5.809 862 HAD2 HEC 500 2HAD HEC 500 25.688 -10.498 -6.839 863 HBD1 HEC 500 1HBD HEC 500 26.979 -9.035 -8.316 864 HBD2 HEC 500 2HBD HEC 500 26.306 -7.597 -7.517 Start of MODEL 5 1 H1 GLY 1 HN GLY 1 0.376 0.110 -0.692 2 HA2 GLY 1 1HA GLY 1 2.764 0.893 -2.051 3 HA3 GLY 1 2HA GLY 1 3.120 0.057 -0.553 4 H ASP 2 HN ASP 2 1.040 -0.215 -3.515 5 HA ASP 2 HA ASP 2 0.291 -2.788 -3.264 6 HB2 ASP 2 2HB ASP 2 -0.044 -0.932 -5.166 7 HB3 ASP 2 3HB ASP 2 1.254 -1.803 -5.956 8 HD2 ASP 2 HD2 ASP 2 -1.837 -2.498 -7.129 9 H VAL 3 HN VAL 3 1.169 -4.690 -4.783 10 HA VAL 3 HA VAL 3 4.102 -4.701 -4.585 11 HB VAL 3 HB VAL 3 3.526 -7.298 -4.513 12 HG11 VAL 3 1HG1 VAL 3 3.112 -6.104 -1.854 13 HG12 VAL 3 2HG1 VAL 3 4.399 -7.183 -2.442 14 HG13 VAL 3 3HG1 VAL 3 4.499 -5.431 -2.744 15 HG21 VAL 3 3HG2 VAL 3 1.084 -5.961 -3.304 16 HG22 VAL 3 1HG2 VAL 3 1.129 -7.112 -4.661 17 HG23 VAL 3 2HG2 VAL 3 1.548 -7.655 -3.018 18 H GLU 4 HN GLU 4 1.235 -6.089 -6.325 19 HA GLU 4 HA GLU 4 2.416 -7.303 -8.358 20 HB2 GLU 4 2HB GLU 4 -0.057 -5.559 -8.274 21 HB3 GLU 4 3HB GLU 4 0.424 -6.319 -9.778 22 HG2 GLU 4 2HG GLU 4 0.314 -8.030 -7.293 23 HG3 GLU 4 3HG GLU 4 -1.200 -7.562 -8.039 24 HE2 GLU 4 HE2 GLU 4 -1.319 -9.610 -10.311 25 H LYS 5 HN LYS 5 1.940 -3.735 -8.050 26 HA LYS 5 HA LYS 5 2.860 -3.019 -10.558 27 HB2 LYS 5 2HB LYS 5 2.738 -1.642 -7.886 28 HB3 LYS 5 3HB LYS 5 3.522 -0.855 -9.242 29 HG2 LYS 5 2HG LYS 5 0.748 -2.056 -9.551 30 HG3 LYS 5 3HG LYS 5 0.953 -0.459 -8.861 31 HD2 LYS 5 2HD LYS 5 2.317 -1.135 -11.482 32 HD3 LYS 5 3HD LYS 5 0.609 -0.743 -11.478 33 HE2 LYS 5 2HE LYS 5 1.528 1.386 -11.774 34 HE3 LYS 5 3HE LYS 5 1.368 1.351 -10.030 35 HZ1 LYS 5 2HZ LYS 5 3.577 1.662 -9.936 36 HZ3 LYS 5 1HZ LYS 5 3.747 1.527 -11.549 37 H GLY 6 HN GLY 6 4.662 -3.572 -7.471 38 HA2 GLY 6 1HA GLY 6 7.204 -3.015 -8.700 39 HA3 GLY 6 2HA GLY 6 6.900 -3.613 -7.082 40 H LYS 7 HN LYS 7 5.018 -5.701 -8.669 41 HA LYS 7 HA LYS 7 6.983 -7.758 -8.619 42 HB2 LYS 7 2HB LYS 7 4.732 -8.209 -7.877 43 HB3 LYS 7 3HB LYS 7 4.061 -7.712 -9.418 44 HG2 LYS 7 2HG LYS 7 4.116 -10.040 -9.678 45 HG3 LYS 7 3HG LYS 7 5.630 -9.580 -10.431 46 HD2 LYS 7 2HD LYS 7 6.923 -10.256 -8.540 47 HD3 LYS 7 3HD LYS 7 5.537 -10.238 -7.468 48 HE2 LYS 7 2HE LYS 7 5.669 -12.148 -9.835 49 HE3 LYS 7 3HE LYS 7 6.414 -12.554 -8.302 50 HZ1 LYS 7 2HZ LYS 7 4.076 -11.917 -7.366 51 HZ3 LYS 7 1HZ LYS 7 4.278 -13.384 -8.046 52 H LYS 8 HN LYS 8 4.715 -6.850 -11.305 53 HA LYS 8 HA LYS 8 6.186 -8.046 -13.292 54 HB2 LYS 8 2HB LYS 8 4.356 -5.634 -13.456 55 HB3 LYS 8 3HB LYS 8 4.903 -6.575 -14.828 56 HG2 LYS 8 2HG LYS 8 3.555 -7.965 -12.493 57 HG3 LYS 8 3HG LYS 8 2.582 -7.141 -13.694 58 HD2 LYS 8 2HD LYS 8 4.695 -9.213 -14.433 59 HD3 LYS 8 3HD LYS 8 3.025 -9.640 -14.118 60 HE2 LYS 8 2HE LYS 8 3.971 -7.671 -16.257 61 HE3 LYS 8 3HE LYS 8 3.449 -9.317 -16.555 62 HZ1 LYS 8 2HZ LYS 8 1.429 -8.352 -16.799 63 HZ3 LYS 8 1HZ LYS 8 1.832 -6.989 -16.004 64 H ILE 9 HN ILE 9 6.558 -4.839 -11.755 65 HA ILE 9 HA ILE 9 8.373 -3.840 -13.667 66 HB ILE 9 HB ILE 9 7.714 -3.112 -10.820 67 HG12 ILE 9 2HG1 ILE 9 7.149 -1.657 -13.418 68 HG13 ILE 9 3HG1 ILE 9 6.019 -2.750 -12.645 69 HG21 ILE 9 1HG2 ILE 9 9.530 -1.855 -10.653 70 HG22 ILE 9 2HG2 ILE 9 10.093 -2.436 -12.238 71 HG23 ILE 9 3HG2 ILE 9 9.074 -0.981 -12.134 72 HD11 ILE 9 3HD1 ILE 9 6.834 -1.054 -10.552 73 HD12 ILE 9 1HD1 ILE 9 6.679 0.024 -11.960 74 HD13 ILE 9 2HD1 ILE 9 5.294 -0.967 -11.443 75 H PHE 10 HN PHE 10 8.728 -5.647 -10.567 76 HA PHE 10 HA PHE 10 11.532 -5.498 -10.527 77 HB2 PHE 10 2HB PHE 10 10.308 -6.065 -8.510 78 HB3 PHE 10 3HB PHE 10 9.327 -7.252 -9.346 79 HD1 PHE 10 HD2 PHE 10 12.808 -6.601 -8.218 80 HD2 PHE 10 HD1 PHE 10 9.914 -9.512 -9.292 81 HE1 PHE 10 HE2 PHE 10 14.354 -8.422 -7.446 82 HE2 PHE 10 HE1 PHE 10 11.460 -11.333 -8.520 83 HZ PHE 10 HZ PHE 10 13.661 -10.767 -7.606 84 H ILE 11 HN ILE 11 9.220 -7.553 -12.249 85 HA ILE 11 HA ILE 11 11.212 -9.552 -12.835 86 HB ILE 11 HB ILE 11 8.337 -9.141 -13.635 87 HG12 ILE 11 2HG1 ILE 11 9.738 -11.142 -11.840 88 HG13 ILE 11 3HG1 ILE 11 8.660 -9.854 -11.339 89 HG21 ILE 11 1HG2 ILE 11 10.035 -11.529 -14.383 90 HG22 ILE 11 2HG2 ILE 11 8.368 -11.156 -14.883 91 HG23 ILE 11 3HG2 ILE 11 9.720 -10.166 -15.484 92 HD11 ILE 11 3HD1 ILE 11 6.955 -11.020 -13.020 93 HD12 ILE 11 1HD1 ILE 11 8.006 -12.433 -12.764 94 HD13 ILE 11 2HD1 ILE 11 7.188 -11.669 -11.379 95 H MET 12 HN MET 12 9.094 -7.514 -14.975 96 HA MET 12 HA MET 12 10.431 -7.815 -17.251 97 HB2 MET 12 2HB MET 12 9.036 -5.414 -15.999 98 HB3 MET 12 3HB MET 12 9.741 -5.254 -17.595 99 HG2 MET 12 2HG MET 12 7.875 -7.570 -16.964 100 HG3 MET 12 3HG MET 12 7.227 -5.999 -17.394 101 HE1 MET 12 3HE MET 12 6.114 -7.628 -18.904 102 HE2 MET 12 1HE MET 12 6.295 -6.428 -20.205 103 HE3 MET 12 2HE MET 12 6.724 -8.130 -20.498 104 H LYS 13 HN LYS 13 11.542 -6.046 -14.405 105 HA LYS 13 HA LYS 13 13.761 -4.933 -15.955 106 HB2 LYS 13 2HB LYS 13 12.801 -4.281 -13.152 107 HB3 LYS 13 3HB LYS 13 14.139 -3.508 -13.977 108 HG2 LYS 13 2HG LYS 13 12.614 -2.706 -15.763 109 HG3 LYS 13 3HG LYS 13 11.267 -3.545 -15.021 110 HD2 LYS 13 2HD LYS 13 10.930 -1.446 -14.096 111 HD3 LYS 13 3HD LYS 13 11.990 -2.112 -12.869 112 HE2 LYS 13 2HE LYS 13 12.770 0.135 -13.521 113 HE3 LYS 13 3HE LYS 13 13.961 -1.065 -13.980 114 HZ1 LYS 13 2HZ LYS 13 13.746 -0.363 -16.086 115 HZ3 LYS 13 1HZ LYS 13 12.606 0.722 -15.668 116 H CYS 14 HN CYS 14 12.880 -7.135 -13.271 117 HA CYS 14 HA CYS 14 15.616 -8.151 -13.421 118 HB2 CYS 14 2HB CYS 14 14.313 -8.295 -10.771 119 HB3 CYS 14 3HB CYS 14 15.999 -8.079 -11.196 120 H SER 15 HN SER 15 14.678 -9.775 -14.875 121 HA SER 15 HA SER 15 13.004 -11.661 -13.410 122 HB2 SER 15 2HB SER 15 11.678 -10.614 -15.183 123 HB3 SER 15 3HB SER 15 12.925 -10.938 -16.371 124 HG SER 15 HG SER 15 12.360 -13.046 -16.480 125 H GLN 16 HN GLN 16 13.421 -13.954 -13.869 126 HA GLN 16 HA GLN 16 14.897 -15.580 -13.910 127 HB2 GLN 16 2HB GLN 16 15.226 -14.469 -16.730 128 HB3 GLN 16 3HB GLN 16 15.795 -16.051 -16.235 129 HG2 GLN 16 2HG GLN 16 13.393 -16.560 -15.474 130 HG3 GLN 16 3HG GLN 16 12.908 -15.066 -16.250 131 HE21 GLN 16 1HE2 GLN 16 11.615 -16.947 -17.277 132 HE22 GLN 16 2HE2 GLN 16 12.227 -17.562 -18.777 133 H CYS 17 HN CYS 17 16.012 -13.221 -12.703 134 HA CYS 17 HA CYS 17 18.813 -13.698 -13.360 135 HB2 CYS 17 2HB CYS 17 17.630 -11.426 -14.211 136 HB3 CYS 17 3HB CYS 17 18.099 -10.923 -12.600 137 H HIS 18 HN HIS 18 16.616 -11.823 -11.129 138 HA HIS 18 HA HIS 18 18.325 -12.551 -8.917 139 HB2 HIS 18 2HB HIS 18 16.249 -10.517 -9.471 140 HB3 HIS 18 3HB HIS 18 16.257 -11.137 -7.831 141 HD1 HIS 18 HD1 HIS 18 18.858 -11.123 -6.713 142 HD2 HIS 18 HD2 HIS 18 17.981 -8.440 -9.816 143 HE1 HIS 18 HE1 HIS 18 20.614 -9.278 -6.580 144 H THR 19 HN THR 19 16.747 -12.933 -6.772 145 HA THR 19 HA THR 19 14.678 -14.861 -7.444 146 HB THR 19 HB THR 19 15.923 -16.487 -5.794 147 HG1 THR 19 HG1 THR 19 17.951 -14.609 -6.785 148 HG21 THR 19 1HG2 THR 19 17.226 -17.492 -7.575 149 HG22 THR 19 2HG2 THR 19 15.797 -16.778 -8.360 150 HG23 THR 19 3HG2 THR 19 17.365 -15.938 -8.432 151 H VAL 20 HN VAL 20 13.125 -15.128 -5.845 152 HA VAL 20 HA VAL 20 13.560 -13.463 -3.462 153 HB VAL 20 HB VAL 20 11.230 -12.793 -3.584 154 HG11 VAL 20 1HG1 VAL 20 12.246 -11.069 -4.613 155 HG12 VAL 20 2HG1 VAL 20 13.213 -12.136 -5.658 156 HG13 VAL 20 3HG1 VAL 20 11.537 -11.734 -6.104 157 HG21 VAL 20 3HG2 VAL 20 11.185 -14.644 -5.954 158 HG22 VAL 20 1HG2 VAL 20 10.020 -14.476 -4.619 159 HG23 VAL 20 2HG2 VAL 20 10.088 -13.243 -5.901 160 H GLU 21 HN GLU 21 11.827 -16.234 -4.998 161 HA GLU 21 HA GLU 21 10.603 -17.198 -2.768 162 HB2 GLU 21 2HB GLU 21 10.670 -19.419 -3.940 163 HB3 GLU 21 3HB GLU 21 10.140 -18.106 -4.973 164 HG2 GLU 21 2HG GLU 21 12.657 -17.904 -5.674 165 HG3 GLU 21 3HG GLU 21 12.851 -19.483 -4.940 166 HE2 GLU 21 HE2 GLU 21 9.848 -20.198 -6.858 167 H LYS 22 HN LYS 22 11.149 -18.981 -1.281 168 HA LYS 22 HA LYS 22 13.936 -18.811 -0.506 169 HB2 LYS 22 2HB LYS 22 12.344 -18.458 1.243 170 HB3 LYS 22 3HB LYS 22 11.452 -19.908 0.830 171 HG2 LYS 22 2HG LYS 22 13.236 -21.349 1.584 172 HG3 LYS 22 3HG LYS 22 14.382 -20.025 1.650 173 HD2 LYS 22 2HD LYS 22 13.718 -20.454 3.926 174 HD3 LYS 22 3HD LYS 22 12.932 -18.958 3.460 175 HE2 LYS 22 2HE LYS 22 11.477 -20.729 4.677 176 HE3 LYS 22 3HE LYS 22 10.798 -19.989 3.242 177 HZ1 LYS 22 2HZ LYS 22 10.520 -22.152 2.639 178 HZ3 LYS 22 1HZ LYS 22 11.686 -22.726 3.620 179 H GLY 23 HN GLY 23 11.823 -20.842 -2.350 180 HA2 GLY 23 1HA GLY 23 13.552 -23.190 -1.957 181 HA3 GLY 23 2HA GLY 23 11.959 -23.167 -2.690 182 H GLY 24 HN GLY 24 14.768 -20.964 -3.305 183 HA2 GLY 24 1HA GLY 24 14.913 -22.061 -6.047 184 HA3 GLY 24 2HA GLY 24 14.839 -20.337 -5.743 185 H LYS 25 HN LYS 25 17.013 -21.527 -7.129 186 HA LYS 25 HA LYS 25 19.153 -21.777 -5.191 187 HB2 LYS 25 2HB LYS 25 20.443 -22.646 -6.931 188 HB3 LYS 25 3HB LYS 25 18.835 -23.264 -7.251 189 HG2 LYS 25 2HG LYS 25 18.437 -21.486 -8.923 190 HG3 LYS 25 3HG LYS 25 19.981 -20.747 -8.547 191 HD2 LYS 25 2HD LYS 25 21.097 -22.951 -9.230 192 HD3 LYS 25 3HD LYS 25 19.530 -23.496 -9.793 193 HE2 LYS 25 2HE LYS 25 20.676 -20.850 -10.754 194 HE3 LYS 25 3HE LYS 25 21.163 -22.355 -11.508 195 HZ1 LYS 25 2HZ LYS 25 19.017 -22.724 -12.296 196 HZ3 LYS 25 1HZ LYS 25 19.091 -21.101 -12.409 197 H HIS 26 HN HIS 26 21.317 -20.598 -6.324 198 HA HIS 26 HA HIS 26 20.581 -17.798 -6.106 199 HB2 HIS 26 2HB HIS 26 23.163 -19.327 -5.803 200 HB3 HIS 26 3HB HIS 26 23.157 -17.583 -5.977 201 HD1 HIS 26 HD1 HIS 26 22.021 -16.179 -4.026 202 HD2 HIS 26 HD2 HIS 26 22.386 -20.293 -3.295 203 HE1 HIS 26 HE1 HIS 26 21.636 -16.497 -1.523 204 H LYS 27 HN LYS 27 19.586 -17.702 -8.260 205 HA LYS 27 HA LYS 27 20.869 -18.409 -10.594 206 HB2 LYS 27 2HB LYS 27 18.683 -16.527 -9.833 207 HB3 LYS 27 3HB LYS 27 19.386 -16.335 -11.426 208 HG2 LYS 27 2HG LYS 27 18.729 -18.487 -12.136 209 HG3 LYS 27 3HG LYS 27 18.645 -19.117 -10.503 210 HD2 LYS 27 2HD LYS 27 16.376 -18.866 -10.898 211 HD3 LYS 27 3HD LYS 27 16.709 -17.273 -10.249 212 HE2 LYS 27 2HE LYS 27 16.566 -16.229 -12.337 213 HE3 LYS 27 3HE LYS 27 17.095 -17.653 -13.211 214 HZ1 LYS 27 2HZ LYS 27 14.449 -17.470 -11.874 215 HZ3 LYS 27 1HZ LYS 27 14.943 -18.654 -12.877 216 H THR 28 HN THR 28 21.236 -16.288 -12.272 217 HA THR 28 HA THR 28 23.796 -15.536 -11.948 218 HB THR 28 HB THR 28 21.699 -13.634 -13.079 219 HG1 THR 28 HG1 THR 28 22.823 -16.098 -14.205 220 HG21 THR 28 1HG2 THR 28 24.106 -13.025 -13.393 221 HG22 THR 28 2HG2 THR 28 24.417 -14.640 -14.073 222 HG23 THR 28 3HG2 THR 28 23.363 -13.498 -14.939 223 H GLY 29 HN GLY 29 21.000 -14.190 -10.232 224 HA2 GLY 29 1HA GLY 29 22.862 -12.352 -8.846 225 HA3 GLY 29 2HA GLY 29 21.183 -11.980 -9.183 226 HA PRO 30 HA PRO 30 21.667 -14.342 -5.184 227 HB2 PRO 30 2HB PRO 30 22.016 -12.367 -3.328 228 HB3 PRO 30 3HB PRO 30 23.338 -13.313 -3.981 229 HG2 PRO 30 2HG PRO 30 22.578 -10.522 -4.591 230 HG3 PRO 30 3HG PRO 30 24.102 -11.335 -4.891 231 HD2 PRO 30 2HD PRO 30 22.065 -10.741 -6.821 232 HD3 PRO 30 3HD PRO 30 23.535 -11.655 -7.095 233 H ASN 31 HN ASN 31 20.038 -14.757 -3.636 234 HA ASN 31 HA ASN 31 17.591 -13.717 -4.521 235 HB2 ASN 31 2HB ASN 31 18.201 -15.993 -3.286 236 HB3 ASN 31 3HB ASN 31 17.976 -15.062 -1.819 237 HD21 ASN 31 1HD2 ASN 31 16.504 -17.156 -3.730 238 HD22 ASN 31 2HD2 ASN 31 14.841 -16.693 -3.594 239 H LEU 32 HN LEU 32 16.292 -12.062 -3.574 240 HA LEU 32 HA LEU 32 17.661 -10.269 -1.810 241 HB2 LEU 32 2HB LEU 32 14.880 -10.200 -2.988 242 HB3 LEU 32 3HB LEU 32 15.626 -8.900 -2.082 243 HG LEU 32 HG LEU 32 16.052 -8.152 -4.181 244 HD11 LEU 32 1HD1 LEU 32 18.332 -8.546 -4.836 245 HD12 LEU 32 2HD1 LEU 32 18.234 -8.547 -3.058 246 HD13 LEU 32 3HD1 LEU 32 18.370 -10.085 -3.943 247 HD21 LEU 32 3HD2 LEU 32 16.421 -10.968 -5.231 248 HD22 LEU 32 1HD2 LEU 32 14.878 -10.080 -5.239 249 HD23 LEU 32 2HD2 LEU 32 16.262 -9.469 -6.176 250 H HIS 33 HN HIS 33 15.744 -13.088 -1.443 251 HA HIS 33 HA HIS 33 14.071 -12.670 0.588 252 HB2 HIS 33 2HB HIS 33 14.217 -14.844 -0.232 253 HB3 HIS 33 3HB HIS 33 15.955 -14.926 -0.023 254 HD1 HIS 33 HD1 HIS 33 16.862 -15.404 2.417 255 HD2 HIS 33 HD2 HIS 33 12.692 -15.590 2.003 256 HE1 HIS 33 HE1 HIS 33 15.987 -16.561 4.516 257 H GLY 34 HN GLY 34 17.649 -12.668 0.755 258 HA2 GLY 34 1HA GLY 34 17.515 -12.147 3.645 259 HA3 GLY 34 2HA GLY 34 18.931 -12.617 2.724 260 H LEU 35 HN LEU 35 16.446 -10.026 2.157 261 HA LEU 35 HA LEU 35 18.654 -8.156 1.795 262 HB2 LEU 35 2HB LEU 35 16.992 -8.383 0.015 263 HB3 LEU 35 3HB LEU 35 15.714 -7.943 1.130 264 HG LEU 35 HG LEU 35 17.099 -5.744 1.454 265 HD11 LEU 35 1HD1 LEU 35 19.062 -6.595 0.172 266 HD12 LEU 35 2HD1 LEU 35 18.063 -6.550 -1.301 267 HD13 LEU 35 3HD1 LEU 35 18.419 -5.044 -0.421 268 HD21 LEU 35 3HD2 LEU 35 15.201 -5.059 0.524 269 HD22 LEU 35 1HD2 LEU 35 16.003 -5.212 -1.059 270 HD23 LEU 35 2HD2 LEU 35 15.040 -6.562 -0.415 271 H PHE 36 HN PHE 36 15.308 -7.783 3.143 272 HA PHE 36 HA PHE 36 16.175 -5.809 4.954 273 HB2 PHE 36 2HB PHE 36 13.705 -7.605 4.634 274 HB3 PHE 36 3HB PHE 36 13.779 -6.380 5.885 275 HD1 PHE 36 HD2 PHE 36 13.776 -6.906 2.229 276 HD2 PHE 36 HD1 PHE 36 13.395 -4.093 5.383 277 HE1 PHE 36 HE2 PHE 36 12.944 -5.189 0.598 278 HE2 PHE 36 HE1 PHE 36 12.562 -2.377 3.752 279 HZ PHE 36 HZ PHE 36 12.346 -2.945 1.378 280 H GLY 37 HN GLY 37 17.264 -6.070 6.841 281 HA2 GLY 37 1HA GLY 37 17.443 -6.924 9.001 282 HA3 GLY 37 2HA GLY 37 16.631 -8.396 8.506 283 H ARG 38 HN ARG 38 19.032 -7.214 6.260 284 HA ARG 38 HA ARG 38 21.044 -8.897 7.480 285 HB2 ARG 38 2HB ARG 38 19.612 -10.076 5.595 286 HB3 ARG 38 3HB ARG 38 20.524 -9.069 4.488 287 HG2 ARG 38 2HG ARG 38 22.615 -10.058 5.119 288 HG3 ARG 38 3HG ARG 38 21.946 -10.752 6.583 289 HD2 ARG 38 2HD ARG 38 21.372 -11.614 3.711 290 HD3 ARG 38 3HD ARG 38 22.188 -12.545 4.951 291 HE ARG 38 HE ARG 38 19.282 -12.094 4.719 292 HH11 ARG 38 2HH2 ARG 38 21.931 -13.225 6.783 293 HH12 ARG 38 1HH2 ARG 38 20.895 -14.157 7.813 294 HH22 ARG 38 HH1 ARG 38 18.539 -14.201 7.379 295 H LYS 39 HN LYS 39 23.265 -8.496 6.483 296 HA LYS 39 HA LYS 39 23.431 -5.691 5.695 297 HB2 LYS 39 2HB LYS 39 25.142 -7.577 7.210 298 HB3 LYS 39 3HB LYS 39 25.999 -6.477 6.149 299 HG2 LYS 39 2HG LYS 39 24.875 -4.533 7.185 300 HG3 LYS 39 3HG LYS 39 23.893 -5.592 8.178 301 HD2 LYS 39 2HD LYS 39 25.624 -4.996 9.659 302 HD3 LYS 39 3HD LYS 39 26.176 -6.546 9.056 303 HE2 LYS 39 2HE LYS 39 27.296 -4.953 7.160 304 HE3 LYS 39 3HE LYS 39 27.233 -3.793 8.472 305 HZ1 LYS 39 2HZ LYS 39 29.272 -5.349 8.298 306 HZ3 LYS 39 1HZ LYS 39 28.324 -6.488 8.972 307 H THR 40 HN THR 40 25.782 -5.550 4.311 308 HA THR 40 HA THR 40 25.025 -6.859 1.826 309 HB THR 40 HB THR 40 26.956 -5.255 1.045 310 HG1 THR 40 HG1 THR 40 27.605 -5.121 3.424 311 HG21 THR 40 1HG2 THR 40 24.407 -4.217 2.383 312 HG22 THR 40 2HG2 THR 40 25.504 -3.179 1.439 313 HG23 THR 40 3HG2 THR 40 24.657 -4.530 0.648 314 H GLY 41 HN GLY 41 26.072 -8.506 0.851 315 HA2 GLY 41 1HA GLY 41 27.689 -10.032 0.433 316 HA3 GLY 41 2HA GLY 41 28.796 -9.138 1.456 317 H GLN 42 HN GLN 42 25.573 -10.669 2.149 318 HA GLN 42 HA GLN 42 26.931 -12.107 4.290 319 HB2 GLN 42 2HB GLN 42 23.990 -11.326 4.054 320 HB3 GLN 42 3HB GLN 42 24.698 -12.199 5.400 321 HG2 GLN 42 2HG GLN 42 25.256 -9.333 4.540 322 HG3 GLN 42 3HG GLN 42 24.600 -9.885 6.069 323 HE21 GLN 42 1HE2 GLN 42 27.274 -8.739 4.580 324 HE22 GLN 42 2HE2 GLN 42 28.530 -9.330 5.617 325 H ALA 43 HN ALA 43 24.709 -12.317 1.499 326 HA ALA 43 HA ALA 43 23.611 -14.744 1.688 327 HB1 ALA 43 3HB ALA 43 23.200 -13.446 -0.249 328 HB2 ALA 43 1HB ALA 43 24.933 -13.333 -0.646 329 HB3 ALA 43 2HB ALA 43 24.070 -14.877 -0.852 330 HA PRO 44 HA PRO 44 27.283 -17.145 2.312 331 HB2 PRO 44 2HB PRO 44 26.085 -19.186 3.679 332 HB3 PRO 44 3HB PRO 44 26.737 -17.761 4.463 333 HG2 PRO 44 2HG PRO 44 23.913 -18.463 3.949 334 HG3 PRO 44 3HG PRO 44 24.563 -17.291 5.077 335 HD2 PRO 44 2HD PRO 44 23.334 -16.735 2.547 336 HD3 PRO 44 3HD PRO 44 24.090 -15.576 3.622 337 H GLY 45 HN GLY 45 24.570 -17.556 0.465 338 HA2 GLY 45 1HA GLY 45 25.400 -20.178 -0.535 339 HA3 GLY 45 2HA GLY 45 23.927 -19.310 -0.917 340 H TYR 46 HN TYR 46 26.201 -16.912 -1.042 341 HA TYR 46 HA TYR 46 27.541 -17.509 -3.466 342 HB2 TYR 46 2HB TYR 46 25.125 -17.191 -4.218 343 HB3 TYR 46 3HB TYR 46 25.093 -15.634 -3.415 344 HD1 TYR 46 HD1 TYR 46 28.088 -16.738 -5.252 345 HD2 TYR 46 HD2 TYR 46 24.476 -14.455 -5.458 346 HE1 TYR 46 HE1 TYR 46 28.907 -15.621 -7.383 347 HE2 TYR 46 HE2 TYR 46 25.308 -13.345 -7.589 348 HH TYR 46 HH TYR 46 27.604 -14.512 -9.449 349 H SER 47 HN SER 47 29.433 -16.507 -2.979 350 HA SER 47 HA SER 47 29.399 -14.188 -1.336 351 HB2 SER 47 2HB SER 47 31.873 -14.304 -1.562 352 HB3 SER 47 3HB SER 47 31.187 -15.846 -1.090 353 HG SER 47 HG SER 47 32.534 -16.427 -2.728 354 H TYR 48 HN TYR 48 29.239 -12.094 -2.058 355 HA TYR 48 HA TYR 48 29.123 -11.580 -4.857 356 HB2 TYR 48 2HB TYR 48 29.375 -9.705 -2.427 357 HB3 TYR 48 3HB TYR 48 28.678 -9.277 -3.976 358 HD1 TYR 48 HD2 TYR 48 27.383 -12.341 -3.844 359 HD2 TYR 48 HD1 TYR 48 27.169 -8.730 -1.560 360 HE1 TYR 48 HE2 TYR 48 25.082 -13.009 -2.991 361 HE2 TYR 48 HE1 TYR 48 24.869 -9.409 -0.715 362 HH TYR 48 HH TYR 48 23.301 -10.885 -0.760 363 H THR 49 HN THR 49 30.320 -9.208 -5.361 364 HA THR 49 HA THR 49 33.054 -9.960 -5.617 365 HB THR 49 HB THR 49 33.093 -7.553 -6.626 366 HG1 THR 49 HG1 THR 49 30.833 -6.776 -6.862 367 HG21 THR 49 1HG2 THR 49 32.053 -9.968 -7.678 368 HG22 THR 49 2HG2 THR 49 30.786 -8.757 -7.996 369 HG23 THR 49 3HG2 THR 49 32.437 -8.498 -8.606 370 H ALA 50 HN ALA 50 34.767 -8.098 -5.142 371 HA ALA 50 HA ALA 50 34.781 -7.924 -2.278 372 HB1 ALA 50 3HB ALA 50 36.754 -6.851 -4.333 373 HB2 ALA 50 1HB ALA 50 37.056 -7.128 -2.602 374 HB3 ALA 50 2HB ALA 50 36.773 -8.509 -3.687 375 H ALA 51 HN ALA 51 33.632 -6.006 -4.913 376 HA ALA 51 HA ALA 51 34.089 -3.464 -3.689 377 HB1 ALA 51 3HB ALA 51 33.885 -3.183 -5.950 378 HB2 ALA 51 1HB ALA 51 32.784 -4.569 -6.132 379 HB3 ALA 51 2HB ALA 51 32.161 -3.011 -5.539 380 H ASN 52 HN ASN 52 31.661 -6.031 -3.535 381 HA ASN 52 HA ASN 52 29.845 -4.234 -2.183 382 HB2 ASN 52 2HB ASN 52 29.211 -6.076 -3.983 383 HB3 ASN 52 3HB ASN 52 29.371 -7.205 -2.652 384 HD21 ASN 52 1HD2 ASN 52 28.057 -6.962 -0.788 385 HD22 ASN 52 2HD2 ASN 52 26.513 -6.183 -0.863 386 H LYS 53 HN LYS 53 31.632 -7.372 -1.784 387 HA LYS 53 HA LYS 53 30.867 -8.117 0.697 388 HB2 LYS 53 2HB LYS 53 32.531 -9.180 -0.970 389 HB3 LYS 53 3HB LYS 53 33.759 -8.229 -0.160 390 HG2 LYS 53 2HG LYS 53 32.662 -9.245 2.052 391 HG3 LYS 53 3HG LYS 53 32.060 -10.470 0.953 392 HD2 LYS 53 2HD LYS 53 34.599 -10.504 0.103 393 HD3 LYS 53 3HD LYS 53 34.920 -9.816 1.682 394 HE2 LYS 53 2HE LYS 53 33.417 -12.429 1.169 395 HE3 LYS 53 3HE LYS 53 35.078 -12.306 1.713 396 HZ1 LYS 53 2HZ LYS 53 34.192 -11.055 3.686 397 HZ3 LYS 53 1HZ LYS 53 33.697 -12.606 3.630 398 H ASN 54 HN ASN 54 32.840 -5.321 -0.224 399 HA ASN 54 HA ASN 54 33.892 -4.884 2.333 400 HB2 ASN 54 2HB ASN 54 33.605 -3.301 -0.222 401 HB3 ASN 54 3HB ASN 54 33.953 -2.393 1.236 402 HD21 ASN 54 1HD2 ASN 54 34.922 -5.700 0.428 403 HD22 ASN 54 2HD2 ASN 54 36.634 -5.439 0.407 404 H LYS 55 HN LYS 55 31.125 -3.489 0.426 405 HA LYS 55 HA LYS 55 30.229 -1.613 2.180 406 HB2 LYS 55 2HB LYS 55 29.370 -1.976 -0.100 407 HB3 LYS 55 3HB LYS 55 28.570 -3.445 0.422 408 HG2 LYS 55 2HG LYS 55 26.864 -1.790 0.525 409 HG3 LYS 55 3HG LYS 55 27.362 -1.994 2.193 410 HD2 LYS 55 2HD LYS 55 27.398 0.335 2.028 411 HD3 LYS 55 3HD LYS 55 29.066 -0.032 1.638 412 HE2 LYS 55 2HE LYS 55 27.070 0.032 -0.626 413 HE3 LYS 55 3HE LYS 55 27.571 1.561 0.068 414 HZ1 LYS 55 2HZ LYS 55 29.208 -0.405 -1.371 415 HZ3 LYS 55 1HZ LYS 55 29.946 0.506 -0.239 416 H GLY 56 HN GLY 56 28.999 -1.544 4.057 417 HA2 GLY 56 1HA GLY 56 28.082 -4.114 5.156 418 HA3 GLY 56 2HA GLY 56 29.193 -3.128 6.088 419 H ILE 57 HN ILE 57 26.020 -2.972 4.341 420 HA ILE 57 HA ILE 57 25.004 -1.387 6.559 421 HB ILE 57 HB ILE 57 23.994 0.249 5.085 422 HG12 ILE 57 2HG1 ILE 57 25.146 0.248 2.669 423 HG13 ILE 57 3HG1 ILE 57 25.158 -1.482 2.947 424 HG21 ILE 57 1HG2 ILE 57 26.933 0.198 4.413 425 HG22 ILE 57 2HG2 ILE 57 25.882 1.589 4.773 426 HG23 ILE 57 3HG2 ILE 57 26.356 0.473 6.075 427 HD11 ILE 57 3HD1 ILE 57 22.756 -1.543 3.270 428 HD12 ILE 57 1HD1 ILE 57 22.664 0.234 3.318 429 HD13 ILE 57 2HD1 ILE 57 23.067 -0.596 1.796 430 H ILE 58 HN ILE 58 22.579 -1.341 6.560 431 HA ILE 58 HA ILE 58 21.637 -3.937 5.708 432 HB ILE 58 HB ILE 58 20.254 -1.782 7.308 433 HG12 ILE 58 2HG1 ILE 58 22.495 -2.767 8.192 434 HG13 ILE 58 3HG1 ILE 58 21.113 -2.649 9.263 435 HG21 ILE 58 1HG2 ILE 58 19.575 -4.615 6.593 436 HG22 ILE 58 2HG2 ILE 58 19.030 -3.932 8.143 437 HG23 ILE 58 3HG2 ILE 58 18.545 -3.164 6.612 438 HD11 ILE 58 3HD1 ILE 58 22.330 -4.885 9.325 439 HD12 ILE 58 1HD1 ILE 58 20.584 -4.998 8.994 440 HD13 ILE 58 2HD1 ILE 58 21.753 -5.164 7.663 441 H TRP 59 HN TRP 59 19.664 -4.234 4.455 442 HA TRP 59 HA TRP 59 19.429 -2.136 2.439 443 HB2 TRP 59 2HB TRP 59 18.767 -5.069 2.504 444 HB3 TRP 59 3HB TRP 59 18.089 -4.012 1.282 445 HD1 TRP 59 HD1 TRP 59 20.881 -6.274 1.580 446 HE1 TRP 59 HE1 TRP 59 22.895 -5.785 -0.054 447 HE3 TRP 59 HE3 TRP 59 19.452 -1.541 0.393 448 HZ2 TRP 59 HZ2 TRP 59 23.647 -3.524 -1.624 449 HZ3 TRP 59 HZ3 TRP 59 20.883 -0.261 -1.199 450 HH2 TRP 59 HH2 TRP 59 22.916 -1.179 -2.196 451 H GLY 60 HN GLY 60 18.055 -0.584 3.354 452 HA2 GLY 60 1HA GLY 60 15.490 -1.567 4.437 453 HA3 GLY 60 2HA GLY 60 16.253 -0.036 4.822 454 H GLU 61 HN GLU 61 13.896 0.613 4.176 455 HA GLU 61 HA GLU 61 13.443 0.612 1.357 456 HB2 GLU 61 2HB GLU 61 11.888 2.011 3.578 457 HB3 GLU 61 3HB GLU 61 11.333 1.760 1.934 458 HG2 GLU 61 2HG GLU 61 11.784 -0.796 2.429 459 HG3 GLU 61 3HG GLU 61 11.766 -0.308 4.112 460 HE2 GLU 61 HE2 GLU 61 8.325 0.937 3.508 461 H ASP 62 HN ASP 62 15.168 2.544 3.621 462 HA ASP 62 HA ASP 62 14.745 4.982 2.169 463 HB2 ASP 62 2HB ASP 62 16.489 4.208 4.547 464 HB3 ASP 62 3HB ASP 62 16.556 5.806 3.830 465 HD2 ASP 62 HD2 ASP 62 13.945 6.424 3.527 466 H THR 63 HN THR 63 17.292 2.497 2.823 467 HA THR 63 HA THR 63 19.283 3.825 1.255 468 HB THR 63 HB THR 63 20.594 1.832 1.818 469 HG1 THR 63 HG1 THR 63 19.431 -0.050 1.925 470 HG21 THR 63 1HG2 THR 63 19.149 3.291 3.829 471 HG22 THR 63 2HG2 THR 63 19.089 1.573 4.289 472 HG23 THR 63 3HG2 THR 63 20.660 2.372 4.035 473 H LEU 64 HN LEU 64 16.688 1.491 0.644 474 HA LEU 64 HA LEU 64 17.781 0.748 -1.906 475 HB2 LEU 64 2HB LEU 64 15.215 0.162 -0.444 476 HB3 LEU 64 3HB LEU 64 15.472 -0.337 -2.105 477 HG LEU 64 HG LEU 64 17.389 -1.106 0.098 478 HD11 LEU 64 1HD1 LEU 64 16.174 -2.955 0.705 479 HD12 LEU 64 2HD1 LEU 64 14.866 -1.783 0.417 480 HD13 LEU 64 3HD1 LEU 64 15.260 -2.999 -0.822 481 HD21 LEU 64 3HD2 LEU 64 16.835 -2.163 -2.681 482 HD22 LEU 64 1HD2 LEU 64 18.327 -1.411 -2.065 483 HD23 LEU 64 2HD2 LEU 64 17.832 -3.017 -1.480 484 H MET 65 HN MET 65 15.970 3.388 -0.586 485 HA MET 65 HA MET 65 14.538 3.955 -2.968 486 HB2 MET 65 2HB MET 65 15.020 5.226 -0.273 487 HB3 MET 65 3HB MET 65 14.518 6.309 -1.556 488 HG2 MET 65 2HG MET 65 12.984 3.731 -1.208 489 HG3 MET 65 3HG MET 65 12.722 5.004 -0.033 490 HE1 MET 65 3HE MET 65 12.672 4.776 -4.317 491 HE2 MET 65 1HE MET 65 12.258 3.490 -3.159 492 HE3 MET 65 2HE MET 65 10.966 4.413 -3.962 493 H GLU 66 HN GLU 66 17.740 4.677 -1.664 494 HA GLU 66 HA GLU 66 18.102 6.756 -3.643 495 HB2 GLU 66 2HB GLU 66 18.948 7.400 -1.511 496 HB3 GLU 66 3HB GLU 66 19.692 5.840 -1.229 497 HG2 GLU 66 2HG GLU 66 21.343 6.262 -3.027 498 HG3 GLU 66 3HG GLU 66 20.565 7.782 -3.419 499 HE2 GLU 66 HE2 GLU 66 23.187 6.744 -1.446 500 H TYR 67 HN TYR 67 19.097 3.436 -2.789 501 HA TYR 67 HA TYR 67 21.242 3.246 -4.598 502 HB2 TYR 67 2HB TYR 67 20.964 1.629 -2.798 503 HB3 TYR 67 3HB TYR 67 19.265 1.403 -3.161 504 HD1 TYR 67 HD1 TYR 67 18.600 0.079 -5.206 505 HD2 TYR 67 HD2 TYR 67 22.644 0.276 -3.825 506 HE1 TYR 67 HE1 TYR 67 19.174 -1.986 -6.573 507 HE2 TYR 67 HE2 TYR 67 23.205 -1.790 -5.195 508 HH TYR 67 HH TYR 67 22.506 -3.152 -6.761 509 H LEU 68 HN LEU 68 17.701 2.778 -4.901 510 HA LEU 68 HA LEU 68 17.828 1.487 -7.407 511 HB2 LEU 68 2HB LEU 68 15.733 2.752 -5.709 512 HB3 LEU 68 3HB LEU 68 15.367 2.498 -7.404 513 HG LEU 68 HG LEU 68 16.416 0.237 -5.713 514 HD11 LEU 68 1HD1 LEU 68 14.450 -0.192 -4.690 515 HD12 LEU 68 2HD1 LEU 68 14.227 1.564 -4.871 516 HD13 LEU 68 3HD1 LEU 68 13.478 0.447 -6.038 517 HD21 LEU 68 3HD2 LEU 68 14.457 -0.560 -7.605 518 HD22 LEU 68 1HD2 LEU 68 15.577 0.550 -8.429 519 HD23 LEU 68 2HD2 LEU 68 16.204 -0.897 -7.605 520 H GLU 69 HN GLU 69 17.981 4.856 -6.323 521 HA GLU 69 HA GLU 69 17.288 5.991 -8.778 522 HB2 GLU 69 2HB GLU 69 17.162 7.403 -6.872 523 HB3 GLU 69 3HB GLU 69 18.771 6.974 -6.325 524 HG2 GLU 69 2HG GLU 69 19.796 8.188 -8.201 525 HG3 GLU 69 3HG GLU 69 18.226 8.494 -8.916 526 HE2 GLU 69 HE2 GLU 69 17.020 10.639 -7.190 527 H ASN 70 HN ASN 70 20.393 4.909 -7.321 528 HA ASN 70 HA ASN 70 21.504 4.693 -9.913 529 HB2 ASN 70 2HB ASN 70 22.302 6.959 -8.079 530 HB3 ASN 70 3HB ASN 70 23.585 6.158 -8.963 531 HD21 ASN 70 1HD2 ASN 70 23.681 6.257 -11.187 532 HD22 ASN 70 2HD2 ASN 70 22.775 7.390 -12.134 533 HA PRO 71 HA PRO 71 23.089 1.921 -6.665 534 HB2 PRO 71 2HB PRO 71 22.653 -0.440 -7.970 535 HB3 PRO 71 3HB PRO 71 21.499 0.266 -6.855 536 HG2 PRO 71 2HG PRO 71 21.405 0.173 -9.808 537 HG3 PRO 71 3HG PRO 71 20.101 0.479 -8.678 538 HD2 PRO 71 2HD PRO 71 21.485 2.425 -10.268 539 HD3 PRO 71 3HD PRO 71 20.262 2.741 -9.053 540 H LYS 72 HN LYS 72 23.906 2.680 -9.813 541 HA LYS 72 HA LYS 72 26.115 0.943 -10.081 542 HB2 LYS 72 2HB LYS 72 25.134 3.417 -11.472 543 HB3 LYS 72 3HB LYS 72 26.755 2.835 -11.796 544 HG2 LYS 72 2HG LYS 72 24.493 0.836 -11.846 545 HG3 LYS 72 3HG LYS 72 24.640 1.948 -13.193 546 HD2 LYS 72 2HD LYS 72 25.949 0.093 -13.873 547 HD3 LYS 72 3HD LYS 72 27.142 1.238 -13.295 548 HE2 LYS 72 2HE LYS 72 27.527 0.036 -11.290 549 HE3 LYS 72 3HE LYS 72 25.973 -0.772 -11.353 550 HZ1 LYS 72 2HZ LYS 72 27.330 -2.438 -12.127 551 HZ3 LYS 72 1HZ LYS 72 28.427 -1.440 -12.797 552 H LYS 73 HN LYS 73 25.488 3.674 -8.074 553 HA LYS 73 HA LYS 73 28.358 4.193 -7.799 554 HB2 LYS 73 2HB LYS 73 25.889 5.811 -7.176 555 HB3 LYS 73 3HB LYS 73 27.431 6.192 -6.437 556 HG2 LYS 73 2HG LYS 73 27.573 7.507 -8.354 557 HG3 LYS 73 3HG LYS 73 28.342 6.043 -8.936 558 HD2 LYS 73 2HD LYS 73 25.907 5.325 -9.652 559 HD3 LYS 73 3HD LYS 73 25.518 7.024 -9.468 560 HE2 LYS 73 2HE LYS 73 27.444 5.728 -11.419 561 HE3 LYS 73 3HE LYS 73 26.128 6.835 -11.757 562 HZ1 LYS 73 2HZ LYS 73 27.390 8.645 -11.044 563 HZ3 LYS 73 1HZ LYS 73 28.545 7.731 -11.737 564 H TYR 74 HN TYR 74 25.345 3.650 -5.845 565 HA TYR 74 HA TYR 74 26.364 3.477 -3.368 566 HB2 TYR 74 2HB TYR 74 24.003 2.943 -4.565 567 HB3 TYR 74 3HB TYR 74 24.569 1.285 -4.524 568 HD1 TYR 74 HD1 TYR 74 25.610 0.647 -2.053 569 HD2 TYR 74 HD2 TYR 74 22.571 3.550 -2.855 570 HE1 TYR 74 HE1 TYR 74 24.755 0.422 0.330 571 HE2 TYR 74 HE2 TYR 74 21.727 3.315 -0.468 572 HH TYR 74 HH TYR 74 23.076 2.507 1.845 573 H ILE 75 HN ILE 75 26.840 1.142 -6.025 574 HA ILE 75 HA ILE 75 28.735 -0.254 -4.290 575 HB ILE 75 HB ILE 75 26.820 -1.684 -6.126 576 HG12 ILE 75 2HG1 ILE 75 25.699 -0.509 -4.172 577 HG13 ILE 75 3HG1 ILE 75 25.438 -2.237 -4.308 578 HG21 ILE 75 1HG2 ILE 75 27.634 -3.689 -5.131 579 HG22 ILE 75 2HG2 ILE 75 29.047 -2.732 -5.634 580 HG23 ILE 75 3HG2 ILE 75 28.572 -2.784 -3.919 581 HD11 ILE 75 3HD1 ILE 75 26.000 -1.408 -1.962 582 HD12 ILE 75 1HD1 ILE 75 27.046 -2.717 -2.563 583 HD13 ILE 75 2HD1 ILE 75 27.632 -1.037 -2.564 584 HA PRO 76 HA PRO 76 30.745 0.910 -8.090 585 HB2 PRO 76 2HB PRO 76 33.167 1.524 -6.983 586 HB3 PRO 76 3HB PRO 76 31.894 2.705 -7.217 587 HG2 PRO 76 2HG PRO 76 32.779 1.405 -4.715 588 HG3 PRO 76 3HG PRO 76 31.829 2.863 -4.916 589 HD2 PRO 76 2HD PRO 76 30.856 0.271 -4.167 590 HD3 PRO 76 3HD PRO 76 29.893 1.701 -4.483 591 H GLY 77 HN GLY 77 30.843 -0.928 -9.259 592 HA2 GLY 77 1HA GLY 77 32.414 -2.488 -10.110 593 HA3 GLY 77 2HA GLY 77 33.093 -2.678 -8.506 594 H THR 78 HN THR 78 29.618 -2.645 -9.535 595 HA THR 78 HA THR 78 29.358 -5.290 -8.284 596 HB THR 78 HB THR 78 27.996 -3.436 -7.324 597 HG1 THR 78 HG1 THR 78 25.938 -4.608 -7.766 598 HG21 THR 78 1HG2 THR 78 27.020 -3.230 -10.211 599 HG22 THR 78 2HG2 THR 78 26.031 -2.675 -8.840 600 HG23 THR 78 3HG2 THR 78 27.608 -1.916 -9.164 601 H LYS 79 HN LYS 79 27.935 -6.885 -9.299 602 HA LYS 79 HA LYS 79 28.536 -7.025 -12.096 603 HB2 LYS 79 2HB LYS 79 26.885 -8.929 -10.413 604 HB3 LYS 79 3HB LYS 79 27.642 -9.260 -11.959 605 HG2 LYS 79 2HG LYS 79 29.874 -8.535 -10.708 606 HG3 LYS 79 3HG LYS 79 28.953 -8.869 -9.255 607 HD2 LYS 79 2HD LYS 79 28.364 -11.155 -10.404 608 HD3 LYS 79 3HD LYS 79 29.689 -10.791 -11.492 609 HE2 LYS 79 2HE LYS 79 30.068 -10.668 -8.475 610 HE3 LYS 79 3HE LYS 79 30.201 -12.188 -9.337 611 HZ1 LYS 79 2HZ LYS 79 31.768 -9.789 -10.105 612 HZ3 LYS 79 1HZ LYS 79 31.997 -11.312 -10.632 613 H MET 80 HN MET 80 26.012 -5.703 -10.147 614 HA MET 80 HA MET 80 23.737 -6.196 -11.436 615 HB2 MET 80 2HB MET 80 24.924 -3.644 -10.273 616 HB3 MET 80 3HB MET 80 23.322 -3.593 -10.981 617 HG2 MET 80 2HG MET 80 24.005 -5.727 -8.931 618 HG3 MET 80 3HG MET 80 23.577 -4.112 -8.404 619 HE1 MET 80 3HE MET 80 21.831 -2.849 -9.139 620 HE2 MET 80 1HE MET 80 20.558 -3.315 -10.292 621 HE3 MET 80 2HE MET 80 20.300 -3.536 -8.544 622 H ILE 81 HN ILE 81 22.530 -5.277 -13.221 623 HA ILE 81 HA ILE 81 24.165 -3.767 -15.124 624 HB ILE 81 HB ILE 81 22.408 -6.083 -15.921 625 HG12 ILE 81 2HG1 ILE 81 24.360 -6.776 -14.469 626 HG13 ILE 81 3HG1 ILE 81 24.285 -7.503 -16.062 627 HG21 ILE 81 1HG2 ILE 81 22.600 -4.968 -17.869 628 HG22 ILE 81 2HG2 ILE 81 24.039 -4.065 -17.340 629 HG23 ILE 81 3HG2 ILE 81 24.202 -5.740 -17.918 630 HD11 ILE 81 3HD1 ILE 81 26.009 -6.055 -16.923 631 HD12 ILE 81 1HD1 ILE 81 25.918 -4.994 -15.496 632 HD13 ILE 81 2HD1 ILE 81 26.586 -6.636 -15.343 633 H PHE 82 HN PHE 82 22.581 -2.379 -13.484 634 HA PHE 82 HA PHE 82 20.057 -2.069 -14.945 635 HB2 PHE 82 2HB PHE 82 20.340 -2.576 -12.337 636 HB3 PHE 82 3HB PHE 82 20.835 -0.899 -12.225 637 HD1 PHE 82 HD1 PHE 82 18.060 -2.888 -13.754 638 HD2 PHE 82 HD2 PHE 82 19.205 0.621 -11.660 639 HE1 PHE 82 HE1 PHE 82 15.653 -2.187 -13.611 640 HE2 PHE 82 HE2 PHE 82 16.799 1.321 -11.516 641 HZ PHE 82 HZ PHE 82 15.052 -0.091 -12.493 642 H VAL 83 HN VAL 83 19.240 0.399 -14.565 643 HA VAL 83 HA VAL 83 21.521 2.117 -15.257 644 HB VAL 83 HB VAL 83 19.801 3.325 -16.705 645 HG11 VAL 83 1HG1 VAL 83 21.334 0.874 -17.225 646 HG12 VAL 83 2HG1 VAL 83 20.013 1.146 -18.386 647 HG13 VAL 83 3HG1 VAL 83 21.257 2.397 -18.143 648 HG21 VAL 83 3HG2 VAL 83 17.766 2.306 -15.899 649 HG22 VAL 83 1HG2 VAL 83 17.989 1.860 -17.608 650 HG23 VAL 83 2HG2 VAL 83 18.358 0.682 -16.326 651 H GLY 84 HN GLY 84 18.171 1.864 -13.928 652 HA2 GLY 84 1HA GLY 84 18.106 2.922 -11.639 653 HA3 GLY 84 2HA GLY 84 18.673 4.371 -12.444 654 H ILE 85 HN ILE 85 16.226 4.323 -11.017 655 HA ILE 85 HA ILE 85 14.288 4.444 -13.224 656 HB ILE 85 HB ILE 85 13.860 3.776 -10.311 657 HG12 ILE 85 2HG1 ILE 85 13.454 2.093 -12.801 658 HG13 ILE 85 3HG1 ILE 85 14.826 1.965 -11.718 659 HG21 ILE 85 1HG2 ILE 85 12.052 5.199 -11.219 660 HG22 ILE 85 2HG2 ILE 85 11.793 4.007 -12.515 661 HG23 ILE 85 3HG2 ILE 85 11.507 3.553 -10.817 662 HD11 ILE 85 3HD1 ILE 85 13.223 0.268 -11.067 663 HD12 ILE 85 1HD1 ILE 85 13.192 1.531 -9.813 664 HD13 ILE 85 2HD1 ILE 85 11.898 1.457 -11.033 665 H LYS 86 HN LYS 86 12.958 6.292 -13.376 666 HA LYS 86 HA LYS 86 14.076 8.585 -11.978 667 HB2 LYS 86 2HB LYS 86 12.495 8.176 -14.495 668 HB3 LYS 86 3HB LYS 86 12.424 9.732 -13.694 669 HG2 LYS 86 2HG LYS 86 15.079 9.481 -13.616 670 HG3 LYS 86 3HG LYS 86 14.815 8.338 -14.918 671 HD2 LYS 86 2HD LYS 86 13.996 9.977 -16.388 672 HD3 LYS 86 3HD LYS 86 13.435 11.015 -15.093 673 HE2 LYS 86 2HE LYS 86 16.360 10.531 -15.838 674 HE3 LYS 86 3HE LYS 86 15.439 11.975 -16.211 675 HZ1 LYS 86 2HZ LYS 86 15.211 12.410 -13.845 676 HZ3 LYS 86 1HZ LYS 86 16.793 12.205 -14.170 677 H LYS 87 HN LYS 87 11.049 6.703 -12.378 678 HA LYS 87 HA LYS 87 9.515 8.521 -10.810 679 HB2 LYS 87 2HB LYS 87 8.915 5.648 -11.574 680 HB3 LYS 87 3HB LYS 87 7.768 6.835 -10.989 681 HG2 LYS 87 2HG LYS 87 9.286 6.863 -13.629 682 HG3 LYS 87 3HG LYS 87 7.552 6.787 -13.395 683 HD2 LYS 87 2HD LYS 87 9.350 9.161 -12.714 684 HD3 LYS 87 3HD LYS 87 8.236 9.068 -14.064 685 HE2 LYS 87 2HE LYS 87 7.338 8.798 -11.159 686 HE3 LYS 87 3HE LYS 87 7.381 10.335 -12.000 687 HZ1 LYS 87 2HZ LYS 87 6.021 8.281 -13.494 688 HZ3 LYS 87 1HZ LYS 87 5.526 9.794 -13.150 689 H LYS 88 HN LYS 88 9.365 8.679 -8.630 690 HA LYS 88 HA LYS 88 11.048 6.998 -7.051 691 HB2 LYS 88 2HB LYS 88 10.949 9.298 -6.466 692 HB3 LYS 88 3HB LYS 88 9.197 9.308 -6.447 693 HG2 LYS 88 2HG LYS 88 9.100 7.976 -4.443 694 HG3 LYS 88 3HG LYS 88 10.784 7.509 -4.574 695 HD2 LYS 88 2HD LYS 88 11.572 9.639 -3.889 696 HD3 LYS 88 3HD LYS 88 10.074 10.443 -4.316 697 HE2 LYS 88 2HE LYS 88 10.149 8.343 -2.115 698 HE3 LYS 88 3HE LYS 88 10.564 10.012 -1.783 699 HZ1 LYS 88 2HZ LYS 88 8.047 9.061 -1.759 700 HZ3 LYS 88 1HZ LYS 88 8.097 9.686 -3.262 701 H GLU 89 HN GLU 89 7.553 7.296 -7.766 702 HA GLU 89 HA GLU 89 6.658 5.675 -5.722 703 HB2 GLU 89 2HB GLU 89 5.581 6.393 -8.460 704 HB3 GLU 89 3HB GLU 89 4.721 5.243 -7.455 705 HG2 GLU 89 2HG GLU 89 3.715 7.205 -6.722 706 HG3 GLU 89 3HG GLU 89 5.039 7.122 -5.577 707 HE2 GLU 89 HE2 GLU 89 4.840 10.098 -8.151 708 H GLU 90 HN GLU 90 7.504 4.862 -9.161 709 HA GLU 90 HA GLU 90 6.905 2.233 -9.115 710 HB2 GLU 90 2HB GLU 90 8.999 3.859 -10.550 711 HB3 GLU 90 3HB GLU 90 9.036 2.115 -10.724 712 HG2 GLU 90 2HG GLU 90 6.538 2.239 -11.338 713 HG3 GLU 90 3HG GLU 90 6.720 3.981 -11.404 714 HE2 GLU 90 HE2 GLU 90 7.253 3.146 -14.732 715 H ARG 91 HN ARG 91 9.762 3.891 -7.731 716 HA ARG 91 HA ARG 91 11.166 1.518 -7.234 717 HB2 ARG 91 2HB ARG 91 11.374 4.385 -6.256 718 HB3 ARG 91 3HB ARG 91 12.368 3.149 -5.512 719 HG2 ARG 91 2HG ARG 91 13.321 2.541 -7.720 720 HG3 ARG 91 3HG ARG 91 12.275 3.701 -8.515 721 HD2 ARG 91 2HD ARG 91 14.146 4.613 -6.302 722 HD3 ARG 91 3HD ARG 91 14.755 4.392 -7.930 723 HE ARG 91 HE ARG 91 12.558 5.929 -8.414 724 HH11 ARG 91 2HH2 ARG 91 15.143 6.283 -6.016 725 HH12 ARG 91 1HH2 ARG 91 15.026 8.010 -5.961 726 HH22 ARG 91 HH1 ARG 91 13.407 9.120 -7.337 727 H ALA 92 HN ALA 92 8.869 3.571 -5.379 728 HA ALA 92 HA ALA 92 9.235 2.411 -2.878 729 HB1 ALA 92 3HB ALA 92 6.574 3.416 -3.914 730 HB2 ALA 92 1HB ALA 92 7.277 3.578 -2.287 731 HB3 ALA 92 2HB ALA 92 7.934 4.531 -3.639 732 H ASP 93 HN ASP 93 6.579 1.761 -5.284 733 HA ASP 93 HA ASP 93 5.499 -0.354 -4.007 734 HB2 ASP 93 2HB ASP 93 5.859 -0.354 -7.024 735 HB3 ASP 93 3HB ASP 93 4.485 -0.933 -6.103 736 HD2 ASP 93 HD2 ASP 93 4.052 2.216 -7.865 737 H LEU 94 HN LEU 94 8.332 -0.196 -6.238 738 HA LEU 94 HA LEU 94 8.718 -2.900 -6.649 739 HB2 LEU 94 2HB LEU 94 9.822 -1.116 -7.891 740 HB3 LEU 94 3HB LEU 94 10.736 -0.658 -6.467 741 HG LEU 94 HG LEU 94 11.830 -2.121 -8.331 742 HD11 LEU 94 1HD1 LEU 94 12.658 -1.462 -5.958 743 HD12 LEU 94 2HD1 LEU 94 12.279 -3.152 -5.544 744 HD13 LEU 94 3HD1 LEU 94 13.458 -2.793 -6.829 745 HD21 LEU 94 3HD2 LEU 94 11.626 -4.495 -8.089 746 HD22 LEU 94 1HD2 LEU 94 10.542 -4.316 -6.688 747 HD23 LEU 94 2HD2 LEU 94 9.995 -3.817 -8.308 748 H ILE 95 HN ILE 95 10.314 -0.776 -4.162 749 HA ILE 95 HA ILE 95 11.442 -2.984 -2.818 750 HB ILE 95 HB ILE 95 10.975 -0.131 -1.944 751 HG12 ILE 95 2HG1 ILE 95 13.628 -1.226 -2.802 752 HG13 ILE 95 3HG1 ILE 95 12.456 -0.810 -4.037 753 HG21 ILE 95 1HG2 ILE 95 11.481 -0.938 0.088 754 HG22 ILE 95 2HG2 ILE 95 12.131 -2.463 -0.561 755 HG23 ILE 95 3HG2 ILE 95 13.144 -0.999 -0.544 756 HD11 ILE 95 3HD1 ILE 95 12.629 1.445 -3.638 757 HD12 ILE 95 1HD1 ILE 95 12.761 1.223 -1.877 758 HD13 ILE 95 2HD1 ILE 95 14.189 0.989 -2.912 759 H ALA 96 HN ALA 96 8.239 -1.725 -3.002 760 HA ALA 96 HA ALA 96 7.428 -2.385 -0.359 761 HB1 ALA 96 3HB ALA 96 5.278 -1.754 -1.103 762 HB2 ALA 96 1HB ALA 96 6.379 -0.746 -2.073 763 HB3 ALA 96 2HB ALA 96 5.633 -2.195 -2.791 764 H TYR 97 HN TYR 97 7.589 -4.063 -3.522 765 HA TYR 97 HA TYR 97 6.229 -6.376 -2.420 766 HB2 TYR 97 2HB TYR 97 5.726 -5.856 -4.725 767 HB3 TYR 97 3HB TYR 97 7.374 -5.362 -5.060 768 HD1 TYR 97 HD2 TYR 97 5.991 -8.542 -3.620 769 HD2 TYR 97 HD1 TYR 97 8.185 -6.686 -6.790 770 HE1 TYR 97 HE2 TYR 97 6.476 -10.824 -4.629 771 HE2 TYR 97 HE1 TYR 97 8.662 -8.975 -7.790 772 HH TYR 97 HH TYR 97 7.505 -11.923 -6.175 773 H LEU 98 HN LEU 98 9.486 -5.473 -3.736 774 HA LEU 98 HA LEU 98 10.669 -7.947 -3.461 775 HB2 LEU 98 2HB LEU 98 11.618 -5.123 -3.547 776 HB3 LEU 98 3HB LEU 98 12.759 -6.360 -3.059 777 HG LEU 98 HG LEU 98 11.208 -6.345 -5.663 778 HD11 LEU 98 1HD1 LEU 98 13.435 -4.807 -4.935 779 HD12 LEU 98 2HD1 LEU 98 14.079 -6.139 -5.926 780 HD13 LEU 98 3HD1 LEU 98 12.795 -5.088 -6.572 781 HD21 LEU 98 3HD2 LEU 98 12.385 -8.503 -4.324 782 HD22 LEU 98 1HD2 LEU 98 11.865 -8.436 -6.025 783 HD23 LEU 98 2HD2 LEU 98 13.548 -8.048 -5.593 784 H LYS 99 HN LYS 99 9.611 -5.654 -1.031 785 HA LYS 99 HA LYS 99 11.326 -6.751 1.005 786 HB2 LYS 99 2HB LYS 99 10.726 -4.365 0.984 787 HB3 LYS 99 3HB LYS 99 9.031 -4.773 1.162 788 HG2 LYS 99 2HG LYS 99 9.642 -6.006 3.318 789 HG3 LYS 99 3HG LYS 99 11.263 -5.361 3.159 790 HD2 LYS 99 2HD LYS 99 10.281 -3.025 3.124 791 HD3 LYS 99 3HD LYS 99 8.698 -3.720 3.407 792 HE2 LYS 99 2HE LYS 99 11.048 -4.270 5.268 793 HE3 LYS 99 3HE LYS 99 10.006 -2.879 5.483 794 HZ1 LYS 99 2HZ LYS 99 8.154 -4.279 5.877 795 HZ3 LYS 99 1HZ LYS 99 9.354 -4.989 6.717 796 H LYS 100 HN LYS 100 7.780 -6.738 0.225 797 HA LYS 100 HA LYS 100 7.109 -8.502 2.299 798 HB2 LYS 100 2HB LYS 100 5.615 -6.909 0.957 799 HB3 LYS 100 3HB LYS 100 5.585 -8.144 -0.286 800 HG2 LYS 100 2HG LYS 100 4.707 -9.800 1.358 801 HG3 LYS 100 3HG LYS 100 4.773 -8.592 2.626 802 HD2 LYS 100 2HD LYS 100 3.216 -8.007 0.092 803 HD3 LYS 100 3HD LYS 100 2.502 -9.028 1.324 804 HE2 LYS 100 2HE LYS 100 3.700 -6.327 2.050 805 HE3 LYS 100 3HE LYS 100 2.065 -6.444 1.432 806 HZ1 LYS 100 2HZ LYS 100 1.450 -7.819 3.272 807 HZ3 LYS 100 1HZ LYS 100 2.278 -6.576 3.922 808 H ALA 101 HN ALA 101 8.782 -8.953 -0.701 809 HA ALA 101 HA ALA 101 8.017 -11.733 -0.934 810 HB1 ALA 101 3HB ALA 101 9.963 -9.949 -2.451 811 HB2 ALA 101 1HB ALA 101 9.626 -11.648 -2.861 812 HB3 ALA 101 2HB ALA 101 8.329 -10.434 -2.963 813 H THR 102 HN THR 102 10.575 -9.702 0.450 814 HA THR 102 HA THR 102 12.059 -12.151 1.142 815 HB THR 102 HB THR 102 14.018 -10.631 1.297 816 HG1 THR 102 HG1 THR 102 13.571 -8.359 0.853 817 HG21 THR 102 1HG2 THR 102 14.017 -9.660 -1.062 818 HG22 THR 102 2HG2 THR 102 13.624 -11.395 -1.003 819 HG23 THR 102 3HG2 THR 102 12.327 -10.196 -1.219 820 H ASN 103 HN ASN 103 9.575 -10.833 2.415 821 HA ASN 103 HA ASN 103 10.802 -10.300 4.998 822 HB2 ASN 103 2HB ASN 103 9.339 -8.483 4.359 823 HB3 ASN 103 3HB ASN 103 8.099 -9.577 3.780 824 HD21 ASN 103 1HD2 ASN 103 9.271 -7.763 6.368 825 HD22 ASN 103 2HD2 ASN 103 8.220 -8.319 7.628 826 H GLU 104 HN GLU 104 8.546 -12.320 3.108 827 HA GLU 104 HA GLU 104 7.144 -13.530 5.103 828 HB2 GLU 104 2HB GLU 104 8.150 -14.642 2.451 829 HB3 GLU 104 3HB GLU 104 7.005 -15.494 3.468 830 HG2 GLU 104 2HG GLU 104 6.625 -12.761 2.168 831 HG3 GLU 104 3HG GLU 104 5.754 -14.235 1.795 832 HE2 GLU 104 HE2 GLU 104 4.291 -11.899 4.502 833 HHA HEC 500 HHA HEC 500 23.474 -7.061 -5.376 834 HHB HEC 500 HHB HEC 500 17.646 -4.526 -6.117 835 HHC HEC 500 HHC HEC 500 18.114 -5.984 -12.381 836 HHD HEC 500 HHD HEC 500 23.024 -9.865 -11.056 837 HMA1 HEC 500 1HMA HEC 500 18.239 -4.483 -3.871 838 HMA2 HEC 500 2HMA HEC 500 19.664 -4.579 -2.830 839 HMA3 HEC 500 3HMA HEC 500 19.528 -3.257 -4.004 840 HAA1 HEC 500 1HAA HEC 500 23.125 -5.397 -3.666 841 HAA2 HEC 500 2HAA HEC 500 21.709 -5.112 -2.785 842 HBA1 HEC 500 1HBA HEC 500 22.864 -7.812 -3.538 843 HBA2 HEC 500 2HBA HEC 500 22.601 -7.150 -1.913 844 HMB1 HEC 500 1HMB HEC 500 14.703 -4.607 -8.492 845 HMB2 HEC 500 2HMB HEC 500 15.576 -4.564 -6.976 846 HMB3 HEC 500 3HMB HEC 500 15.656 -3.155 -8.057 847 HAB HEC 500 HAB HEC 500 16.590 -4.474 -12.093 848 HBB1 HEC 500 1HBB HEC 500 14.703 -3.002 -11.850 849 HBB2 HEC 500 2HBB HEC 500 14.776 -3.275 -10.090 850 HBB3 HEC 500 3HBB HEC 500 16.082 -2.436 -10.902 851 HMC1 HEC 500 1HMC HEC 500 18.350 -8.788 -14.058 852 HMC2 HEC 500 2HMC HEC 500 18.574 -7.041 -14.230 853 HMC3 HEC 500 3HMC HEC 500 19.742 -8.133 -14.947 854 HAC HEC 500 HAC HEC 500 22.039 -10.699 -12.718 855 HBC1 HEC 500 1HBC HEC 500 22.423 -10.700 -15.058 856 HBC2 HEC 500 2HBC HEC 500 21.215 -9.422 -15.314 857 HBC3 HEC 500 3HBC HEC 500 22.723 -9.038 -14.489 858 HMD1 HEC 500 1HMD HEC 500 24.593 -11.329 -9.001 859 HMD2 HEC 500 2HMD HEC 500 25.175 -10.161 -10.200 860 HMD3 HEC 500 3HMD HEC 500 25.931 -10.276 -8.586 861 HAD1 HEC 500 1HAD HEC 500 25.054 -8.721 -5.413 862 HAD2 HEC 500 2HAD HEC 500 25.830 -9.653 -6.622 863 HBD1 HEC 500 1HBD HEC 500 26.626 -7.559 -7.736 864 HBD2 HEC 500 2HBD HEC 500 25.723 -6.610 -6.534 Start of MODEL 6 1 H1 GLY 1 HN GLY 1 0.938 0.058 -0.034 2 HA2 GLY 1 1HA GLY 1 2.759 1.105 -1.980 3 HA3 GLY 1 2HA GLY 1 3.593 0.343 -0.640 4 H ASP 2 HN ASP 2 1.330 -0.153 -3.352 5 HA ASP 2 HA ASP 2 0.636 -2.746 -2.913 6 HB2 ASP 2 2HB ASP 2 1.365 -1.594 -5.640 7 HB3 ASP 2 3HB ASP 2 0.209 -2.869 -5.315 8 HD2 ASP 2 HD2 ASP 2 -0.686 -0.109 -6.562 9 H VAL 3 HN VAL 3 1.492 -4.732 -4.209 10 HA VAL 3 HA VAL 3 4.426 -4.610 -4.283 11 HB VAL 3 HB VAL 3 4.033 -6.104 -2.623 12 HG11 VAL 3 1HG1 VAL 3 2.059 -7.731 -2.667 13 HG12 VAL 3 2HG1 VAL 3 1.677 -6.008 -2.438 14 HG13 VAL 3 3HG1 VAL 3 1.436 -6.769 -4.029 15 HG21 VAL 3 3HG2 VAL 3 5.058 -7.217 -4.754 16 HG22 VAL 3 1HG2 VAL 3 4.580 -8.233 -3.373 17 HG23 VAL 3 2HG2 VAL 3 3.525 -8.119 -4.802 18 H GLU 4 HN GLU 4 1.427 -5.811 -5.871 19 HA GLU 4 HA GLU 4 2.532 -7.217 -7.898 20 HB2 GLU 4 2HB GLU 4 0.084 -5.402 -7.917 21 HB3 GLU 4 3HB GLU 4 0.461 -6.519 -9.214 22 HG2 GLU 4 2HG GLU 4 0.134 -8.432 -7.847 23 HG3 GLU 4 3HG GLU 4 0.357 -7.533 -6.360 24 HE2 GLU 4 HE2 GLU 4 -1.543 -6.114 -5.773 25 H LYS 5 HN LYS 5 1.809 -3.655 -7.846 26 HA LYS 5 HA LYS 5 2.719 -3.076 -10.381 27 HB2 LYS 5 2HB LYS 5 2.530 -1.479 -7.829 28 HB3 LYS 5 3HB LYS 5 3.182 -0.766 -9.291 29 HG2 LYS 5 2HG LYS 5 0.419 -2.029 -8.975 30 HG3 LYS 5 3HG LYS 5 0.763 -0.320 -9.147 31 HD2 LYS 5 2HD LYS 5 0.977 -2.510 -11.227 32 HD3 LYS 5 3HD LYS 5 0.143 -0.973 -11.339 33 HE2 LYS 5 2HE LYS 5 3.180 -1.298 -11.218 34 HE3 LYS 5 3HE LYS 5 2.263 -1.025 -12.686 35 HZ1 LYS 5 2HZ LYS 5 1.921 1.153 -12.138 36 HZ3 LYS 5 1HZ LYS 5 3.261 0.964 -11.232 37 H GLY 6 HN GLY 6 4.479 -4.041 -7.509 38 HA2 GLY 6 1HA GLY 6 7.020 -3.086 -8.617 39 HA3 GLY 6 2HA GLY 6 6.737 -3.723 -7.010 40 H LYS 7 HN LYS 7 4.997 -5.960 -8.329 41 HA LYS 7 HA LYS 7 7.151 -7.817 -8.543 42 HB2 LYS 7 2HB LYS 7 4.895 -8.230 -7.467 43 HB3 LYS 7 3HB LYS 7 4.207 -8.288 -9.078 44 HG2 LYS 7 2HG LYS 7 5.260 -10.297 -9.618 45 HG3 LYS 7 3HG LYS 7 6.647 -9.977 -8.594 46 HD2 LYS 7 2HD LYS 7 5.116 -11.826 -7.753 47 HD3 LYS 7 3HD LYS 7 5.431 -10.555 -6.588 48 HE2 LYS 7 2HE LYS 7 3.047 -11.018 -6.534 49 HE3 LYS 7 3HE LYS 7 3.260 -9.444 -7.276 50 HZ1 LYS 7 2HZ LYS 7 3.067 -11.890 -8.933 51 HZ3 LYS 7 1HZ LYS 7 2.844 -10.348 -9.406 52 H LYS 8 HN LYS 8 5.353 -5.768 -10.728 53 HA LYS 8 HA LYS 8 5.992 -7.413 -13.022 54 HB2 LYS 8 2HB LYS 8 4.616 -4.717 -12.818 55 HB3 LYS 8 3HB LYS 8 4.778 -5.671 -14.278 56 HG2 LYS 8 2HG LYS 8 3.380 -6.627 -11.733 57 HG3 LYS 8 3HG LYS 8 2.553 -5.975 -13.134 58 HD2 LYS 8 2HD LYS 8 4.290 -8.487 -13.090 59 HD3 LYS 8 3HD LYS 8 2.541 -8.450 -13.189 60 HE2 LYS 8 2HE LYS 8 3.068 -8.673 -15.450 61 HE3 LYS 8 3HE LYS 8 2.980 -6.926 -15.330 62 HZ1 LYS 8 2HZ LYS 8 5.047 -7.147 -16.265 63 HZ3 LYS 8 1HZ LYS 8 5.349 -8.610 -15.617 64 H ILE 9 HN ILE 9 6.947 -4.284 -11.505 65 HA ILE 9 HA ILE 9 8.824 -3.698 -13.564 66 HB ILE 9 HB ILE 9 8.279 -2.555 -10.831 67 HG12 ILE 9 2HG1 ILE 9 7.914 -1.180 -13.485 68 HG13 ILE 9 3HG1 ILE 9 6.696 -2.290 -12.889 69 HG21 ILE 9 1HG2 ILE 9 9.770 -0.641 -11.996 70 HG22 ILE 9 2HG2 ILE 9 10.433 -1.880 -10.903 71 HG23 ILE 9 3HG2 ILE 9 10.561 -2.089 -12.667 72 HD11 ILE 9 3HD1 ILE 9 7.492 0.398 -11.847 73 HD12 ILE 9 1HD1 ILE 9 5.894 -0.384 -11.875 74 HD13 ILE 9 2HD1 ILE 9 7.080 -0.829 -10.625 75 H PHE 10 HN PHE 10 8.734 -5.992 -11.055 76 HA PHE 10 HA PHE 10 11.567 -5.874 -10.506 77 HB2 PHE 10 2HB PHE 10 10.200 -6.522 -8.642 78 HB3 PHE 10 3HB PHE 10 9.100 -7.437 -9.653 79 HD1 PHE 10 HD1 PHE 10 12.560 -7.483 -8.294 80 HD2 PHE 10 HD2 PHE 10 9.327 -9.755 -9.842 81 HE1 PHE 10 HE1 PHE 10 13.750 -9.603 -7.670 82 HE2 PHE 10 HE2 PHE 10 10.518 -11.875 -9.217 83 HZ PHE 10 HZ PHE 10 12.715 -11.773 -8.139 84 H ILE 11 HN ILE 11 9.293 -7.556 -12.625 85 HA ILE 11 HA ILE 11 11.171 -9.672 -13.194 86 HB ILE 11 HB ILE 11 8.423 -8.962 -14.201 87 HG12 ILE 11 2HG1 ILE 11 9.446 -11.306 -12.571 88 HG13 ILE 11 3HG1 ILE 11 8.604 -9.912 -11.923 89 HG21 ILE 11 1HG2 ILE 11 10.061 -11.368 -15.036 90 HG22 ILE 11 2HG2 ILE 11 8.427 -10.920 -15.581 91 HG23 ILE 11 3HG2 ILE 11 9.824 -9.914 -16.035 92 HD11 ILE 11 3HD1 ILE 11 7.021 -10.868 -14.108 93 HD12 ILE 11 1HD1 ILE 11 7.487 -12.285 -13.137 94 HD13 ILE 11 2HD1 ILE 11 6.632 -10.924 -12.371 95 H MET 12 HN MET 12 9.426 -7.299 -15.324 96 HA MET 12 HA MET 12 10.874 -7.505 -17.511 97 HB2 MET 12 2HB MET 12 9.628 -5.155 -16.071 98 HB3 MET 12 3HB MET 12 10.610 -4.787 -17.475 99 HG2 MET 12 2HG MET 12 9.181 -6.703 -18.640 100 HG3 MET 12 3HG MET 12 8.054 -6.411 -17.330 101 HE1 MET 12 3HE MET 12 8.054 -4.345 -21.136 102 HE2 MET 12 1HE MET 12 9.707 -4.758 -20.626 103 HE3 MET 12 2HE MET 12 8.436 -6.003 -20.616 104 H LYS 13 HN LYS 13 11.997 -6.103 -14.449 105 HA LYS 13 HA LYS 13 14.482 -5.278 -15.761 106 HB2 LYS 13 2HB LYS 13 12.996 -4.383 -13.331 107 HB3 LYS 13 3HB LYS 13 14.745 -4.298 -13.282 108 HG2 LYS 13 2HG LYS 13 14.867 -2.709 -14.988 109 HG3 LYS 13 3HG LYS 13 13.401 -3.268 -15.768 110 HD2 LYS 13 2HD LYS 13 12.492 -2.380 -13.266 111 HD3 LYS 13 3HD LYS 13 13.741 -1.220 -13.669 112 HE2 LYS 13 2HE LYS 13 12.062 -0.191 -14.850 113 HE3 LYS 13 3HE LYS 13 12.466 -1.366 -16.087 114 HZ1 LYS 13 2HZ LYS 13 10.470 -2.331 -15.803 115 HZ3 LYS 13 1HZ LYS 13 10.037 -1.130 -14.794 116 H CYS 14 HN CYS 14 13.389 -6.849 -12.665 117 HA CYS 14 HA CYS 14 15.893 -8.332 -12.699 118 HB2 CYS 14 2HB CYS 14 14.056 -8.665 -10.417 119 HB3 CYS 14 3HB CYS 14 15.793 -8.441 -10.452 120 H SER 15 HN SER 15 14.783 -9.447 -14.699 121 HA SER 15 HA SER 15 12.877 -11.433 -13.773 122 HB2 SER 15 2HB SER 15 12.881 -11.845 -16.425 123 HB3 SER 15 3HB SER 15 11.909 -10.587 -15.687 124 HG SER 15 HG SER 15 13.010 -9.163 -16.831 125 H GLN 16 HN GLN 16 13.416 -13.622 -13.715 126 HA GLN 16 HA GLN 16 14.840 -15.277 -13.433 127 HB2 GLN 16 2HB GLN 16 14.967 -14.575 -16.366 128 HB3 GLN 16 3HB GLN 16 15.978 -15.876 -15.770 129 HG2 GLN 16 2HG GLN 16 14.039 -17.062 -16.305 130 HG3 GLN 16 3HG GLN 16 13.743 -16.723 -14.612 131 HE21 GLN 16 1HE2 GLN 16 11.745 -16.172 -14.245 132 HE22 GLN 16 2HE2 GLN 16 10.728 -15.173 -15.228 133 H CYS 17 HN CYS 17 16.002 -12.790 -12.562 134 HA CYS 17 HA CYS 17 18.808 -13.368 -13.165 135 HB2 CYS 17 2HB CYS 17 17.542 -11.081 -13.964 136 HB3 CYS 17 3HB CYS 17 18.180 -10.592 -12.406 137 H HIS 18 HN HIS 18 16.366 -11.914 -10.914 138 HA HIS 18 HA HIS 18 18.192 -12.536 -8.715 139 HB2 HIS 18 2HB HIS 18 16.298 -10.344 -9.258 140 HB3 HIS 18 3HB HIS 18 16.192 -10.993 -7.635 141 HD1 HIS 18 HD1 HIS 18 18.810 -11.284 -6.500 142 HD2 HIS 18 HD2 HIS 18 18.141 -8.348 -9.421 143 HE1 HIS 18 HE1 HIS 18 20.689 -9.578 -6.243 144 H THR 19 HN THR 19 16.771 -12.988 -6.572 145 HA THR 19 HA THR 19 14.453 -14.624 -7.194 146 HB THR 19 HB THR 19 15.598 -16.537 -5.854 147 HG1 THR 19 HG1 THR 19 18.014 -16.255 -6.094 148 HG21 THR 19 1HG2 THR 19 17.267 -16.057 -8.310 149 HG22 THR 19 2HG2 THR 19 16.392 -17.524 -7.811 150 HG23 THR 19 3HG2 THR 19 15.507 -16.170 -8.554 151 H VAL 20 HN VAL 20 13.035 -14.897 -5.462 152 HA VAL 20 HA VAL 20 13.855 -13.500 -3.013 153 HB VAL 20 HB VAL 20 11.614 -12.568 -2.860 154 HG11 VAL 20 1HG1 VAL 20 13.310 -11.981 -5.269 155 HG12 VAL 20 2HG1 VAL 20 11.761 -11.128 -5.060 156 HG13 VAL 20 3HG1 VAL 20 13.023 -11.002 -3.810 157 HG21 VAL 20 3HG2 VAL 20 11.171 -14.117 -5.408 158 HG22 VAL 20 1HG2 VAL 20 10.163 -14.039 -3.943 159 HG23 VAL 20 2HG2 VAL 20 10.222 -12.652 -5.058 160 H GLU 21 HN GLU 21 11.664 -15.894 -4.601 161 HA GLU 21 HA GLU 21 10.579 -16.918 -2.303 162 HB2 GLU 21 2HB GLU 21 9.788 -18.685 -3.654 163 HB3 GLU 21 3HB GLU 21 10.002 -17.372 -4.794 164 HG2 GLU 21 2HG GLU 21 12.467 -18.416 -5.020 165 HG3 GLU 21 3HG GLU 21 11.670 -19.861 -4.429 166 HE2 GLU 21 HE2 GLU 21 10.664 -17.783 -7.573 167 H LYS 22 HN LYS 22 11.049 -18.906 -1.087 168 HA LYS 22 HA LYS 22 13.718 -19.071 -0.309 169 HB2 LYS 22 2HB LYS 22 11.640 -19.665 1.016 170 HB3 LYS 22 3HB LYS 22 11.579 -21.171 0.122 171 HG2 LYS 22 2HG LYS 22 13.778 -21.840 0.949 172 HG3 LYS 22 3HG LYS 22 14.058 -20.259 1.651 173 HD2 LYS 22 2HD LYS 22 11.735 -22.040 2.507 174 HD3 LYS 22 3HD LYS 22 13.308 -22.115 3.275 175 HE2 LYS 22 2HE LYS 22 13.149 -19.682 3.844 176 HE3 LYS 22 3HE LYS 22 11.577 -19.604 3.075 177 HZ1 LYS 22 2HZ LYS 22 10.618 -20.844 4.765 178 HZ3 LYS 22 1HZ LYS 22 11.758 -20.065 5.628 179 H GLY 23 HN GLY 23 11.730 -21.107 -2.533 180 HA2 GLY 23 1HA GLY 23 13.809 -22.982 -3.045 181 HA3 GLY 23 2HA GLY 23 12.323 -22.760 -3.949 182 H GLY 24 HN GLY 24 13.525 -19.685 -3.840 183 HA2 GLY 24 1HA GLY 24 14.347 -19.691 -6.550 184 HA3 GLY 24 2HA GLY 24 14.441 -18.360 -5.414 185 H LYS 25 HN LYS 25 16.174 -20.971 -6.989 186 HA LYS 25 HA LYS 25 18.441 -20.933 -5.283 187 HB2 LYS 25 2HB LYS 25 19.299 -22.544 -6.679 188 HB3 LYS 25 3HB LYS 25 17.581 -22.750 -6.955 189 HG2 LYS 25 2HG LYS 25 19.411 -21.037 -8.703 190 HG3 LYS 25 3HG LYS 25 18.943 -22.684 -9.080 191 HD2 LYS 25 2HD LYS 25 16.986 -20.369 -8.692 192 HD3 LYS 25 3HD LYS 25 17.525 -20.965 -10.250 193 HE2 LYS 25 2HE LYS 25 16.623 -23.266 -9.588 194 HE3 LYS 25 3HE LYS 25 15.939 -22.523 -8.156 195 HZ1 LYS 25 2HZ LYS 25 14.296 -22.557 -9.914 196 HZ3 LYS 25 1HZ LYS 25 15.281 -21.786 -10.957 197 H HIS 26 HN HIS 26 20.659 -20.242 -6.055 198 HA HIS 26 HA HIS 26 20.431 -17.531 -6.965 199 HB2 HIS 26 2HB HIS 26 23.003 -18.987 -6.374 200 HB3 HIS 26 3HB HIS 26 22.662 -17.273 -6.254 201 HD1 HIS 26 HD1 HIS 26 21.983 -16.402 -3.988 202 HD2 HIS 26 HD2 HIS 26 21.615 -20.571 -4.286 203 HE1 HIS 26 HE1 HIS 26 21.403 -17.238 -1.648 204 H LYS 27 HN LYS 27 20.992 -16.717 -8.963 205 HA LYS 27 HA LYS 27 22.232 -18.603 -10.831 206 HB2 LYS 27 2HB LYS 27 19.615 -17.169 -11.109 207 HB3 LYS 27 3HB LYS 27 20.606 -17.390 -12.537 208 HG2 LYS 27 2HG LYS 27 20.789 -19.901 -11.682 209 HG3 LYS 27 3HG LYS 27 19.356 -19.498 -10.757 210 HD2 LYS 27 2HD LYS 27 19.684 -19.346 -13.787 211 HD3 LYS 27 3HD LYS 27 18.653 -20.447 -12.894 212 HE2 LYS 27 2HE LYS 27 18.321 -17.416 -12.757 213 HE3 LYS 27 3HE LYS 27 17.491 -18.401 -13.946 214 HZ1 LYS 27 2HZ LYS 27 16.246 -19.453 -12.289 215 HZ3 LYS 27 1HZ LYS 27 16.329 -17.937 -11.701 216 H THR 28 HN THR 28 20.991 -15.526 -11.949 217 HA THR 28 HA THR 28 23.641 -14.639 -12.531 218 HB THR 28 HB THR 28 21.065 -13.020 -12.716 219 HG1 THR 28 HG1 THR 28 20.459 -14.909 -13.765 220 HG21 THR 28 1HG2 THR 28 23.203 -11.959 -13.512 221 HG22 THR 28 2HG2 THR 28 23.481 -13.363 -14.570 222 HG23 THR 28 3HG2 THR 28 22.091 -12.290 -14.861 223 H GLY 29 HN GLY 29 21.139 -13.806 -10.094 224 HA2 GLY 29 1HA GLY 29 23.214 -12.201 -8.727 225 HA3 GLY 29 2HA GLY 29 21.547 -11.676 -8.853 226 HA PRO 30 HA PRO 30 22.145 -14.475 -5.194 227 HB2 PRO 30 2HB PRO 30 22.464 -12.678 -3.160 228 HB3 PRO 30 3HB PRO 30 23.805 -13.499 -3.933 229 HG2 PRO 30 2HG PRO 30 22.917 -10.696 -4.247 230 HG3 PRO 30 3HG PRO 30 24.463 -11.411 -4.660 231 HD2 PRO 30 2HD PRO 30 22.355 -10.717 -6.475 232 HD3 PRO 30 3HD PRO 30 23.851 -11.537 -6.872 233 H ASN 31 HN ASN 31 20.553 -15.146 -3.723 234 HA ASN 31 HA ASN 31 18.059 -14.065 -4.414 235 HB2 ASN 31 2HB ASN 31 18.136 -16.401 -3.811 236 HB3 ASN 31 3HB ASN 31 19.014 -16.076 -2.331 237 HD21 ASN 31 1HD2 ASN 31 16.008 -16.544 -3.773 238 HD22 ASN 31 2HD2 ASN 31 14.969 -16.122 -2.452 239 H LEU 32 HN LEU 32 16.569 -12.876 -2.989 240 HA LEU 32 HA LEU 32 17.934 -11.587 -0.729 241 HB2 LEU 32 2HB LEU 32 15.710 -10.333 -2.310 242 HB3 LEU 32 3HB LEU 32 16.845 -9.573 -1.212 243 HG LEU 32 HG LEU 32 18.641 -10.343 -2.974 244 HD11 LEU 32 1HD1 LEU 32 16.093 -10.887 -4.341 245 HD12 LEU 32 2HD1 LEU 32 17.241 -9.902 -5.278 246 HD13 LEU 32 3HD1 LEU 32 17.733 -11.499 -4.665 247 HD21 LEU 32 3HD2 LEU 32 16.757 -7.999 -3.306 248 HD22 LEU 32 1HD2 LEU 32 18.313 -8.044 -2.444 249 HD23 LEU 32 2HD2 LEU 32 18.274 -8.193 -4.217 250 H HIS 33 HN HIS 33 17.261 -12.981 0.907 251 HA HIS 33 HA HIS 33 14.361 -13.313 1.126 252 HB2 HIS 33 2HB HIS 33 15.555 -15.410 0.983 253 HB3 HIS 33 3HB HIS 33 16.655 -14.933 2.260 254 HD1 HIS 33 HD1 HIS 33 15.899 -17.079 3.608 255 HD2 HIS 33 HD2 HIS 33 12.883 -14.238 2.956 256 HE1 HIS 33 HE1 HIS 33 13.989 -17.690 5.186 257 H GLY 34 HN GLY 34 17.376 -12.475 2.936 258 HA2 GLY 34 1HA GLY 34 15.714 -11.375 5.100 259 HA3 GLY 34 2HA GLY 34 17.416 -11.780 5.187 260 H LEU 35 HN LEU 35 16.140 -10.124 2.319 261 HA LEU 35 HA LEU 35 17.957 -8.159 2.198 262 HB2 LEU 35 2HB LEU 35 16.168 -8.746 0.551 263 HB3 LEU 35 3HB LEU 35 15.037 -7.814 1.512 264 HG LEU 35 HG LEU 35 16.600 -5.819 1.174 265 HD11 LEU 35 1HD1 LEU 35 18.019 -7.877 -0.378 266 HD12 LEU 35 2HD1 LEU 35 17.772 -6.339 -1.238 267 HD13 LEU 35 3HD1 LEU 35 18.607 -6.356 0.334 268 HD21 LEU 35 3HD2 LEU 35 14.650 -7.031 -0.618 269 HD22 LEU 35 1HD2 LEU 35 14.850 -5.335 -0.115 270 HD23 LEU 35 2HD2 LEU 35 15.796 -5.975 -1.480 271 H PHE 36 HN PHE 36 14.687 -7.701 3.728 272 HA PHE 36 HA PHE 36 15.602 -5.297 4.980 273 HB2 PHE 36 2HB PHE 36 13.107 -7.071 4.973 274 HB3 PHE 36 3HB PHE 36 13.214 -5.730 6.097 275 HD1 PHE 36 HD1 PHE 36 13.773 -6.344 2.449 276 HD2 PHE 36 HD2 PHE 36 12.221 -3.765 5.440 277 HE1 PHE 36 HE1 PHE 36 12.934 -4.785 0.670 278 HE2 PHE 36 HE2 PHE 36 11.382 -2.206 3.661 279 HZ PHE 36 HZ PHE 36 11.748 -2.735 1.297 280 H GLY 37 HN GLY 37 17.269 -5.764 6.453 281 HA2 GLY 37 1HA GLY 37 17.425 -5.998 8.862 282 HA3 GLY 37 2HA GLY 37 16.445 -7.446 8.743 283 H ARG 38 HN ARG 38 18.972 -6.616 6.349 284 HA ARG 38 HA ARG 38 20.762 -8.483 7.622 285 HB2 ARG 38 2HB ARG 38 19.423 -9.876 6.056 286 HB3 ARG 38 3HB ARG 38 19.776 -8.776 4.739 287 HG2 ARG 38 2HG ARG 38 22.107 -9.367 4.717 288 HG3 ARG 38 3HG ARG 38 22.013 -10.133 6.291 289 HD2 ARG 38 2HD ARG 38 21.951 -12.020 4.914 290 HD3 ARG 38 3HD ARG 38 20.234 -11.718 5.095 291 HE ARG 38 HE ARG 38 21.241 -10.219 2.852 292 HH11 ARG 38 2HH2 ARG 38 20.439 -13.535 3.807 293 HH12 ARG 38 1HH2 ARG 38 20.106 -14.053 2.188 294 HH22 ARG 38 HH1 ARG 38 20.324 -12.487 0.386 295 H LYS 39 HN LYS 39 22.986 -8.448 6.469 296 HA LYS 39 HA LYS 39 23.488 -5.702 5.630 297 HB2 LYS 39 2HB LYS 39 25.076 -7.860 6.945 298 HB3 LYS 39 3HB LYS 39 25.944 -6.739 5.915 299 HG2 LYS 39 2HG LYS 39 25.945 -5.821 8.164 300 HG3 LYS 39 3HG LYS 39 24.893 -4.819 7.184 301 HD2 LYS 39 2HD LYS 39 23.673 -5.197 9.204 302 HD3 LYS 39 3HD LYS 39 22.930 -6.261 8.025 303 HE2 LYS 39 2HE LYS 39 23.302 -7.472 10.145 304 HE3 LYS 39 3HE LYS 39 24.280 -8.175 8.871 305 HZ1 LYS 39 2HZ LYS 39 25.853 -7.901 10.509 306 HZ3 LYS 39 1HZ LYS 39 25.159 -6.581 11.165 307 H THR 40 HN THR 40 25.641 -5.785 4.036 308 HA THR 40 HA THR 40 24.577 -7.099 1.663 309 HB THR 40 HB THR 40 26.507 -5.601 0.668 310 HG1 THR 40 HG1 THR 40 26.864 -3.839 2.362 311 HG21 THR 40 1HG2 THR 40 24.562 -4.440 0.222 312 HG22 THR 40 2HG2 THR 40 23.877 -4.802 1.824 313 HG23 THR 40 3HG2 THR 40 25.032 -3.462 1.632 314 H GLY 41 HN GLY 41 25.642 -8.627 0.428 315 HA2 GLY 41 1HA GLY 41 27.073 -10.302 -0.016 316 HA3 GLY 41 2HA GLY 41 28.313 -9.409 0.841 317 H GLN 42 HN GLN 42 25.295 -11.319 1.541 318 HA GLN 42 HA GLN 42 26.739 -12.397 3.837 319 HB2 GLN 42 2HB GLN 42 23.736 -12.010 3.471 320 HB3 GLN 42 3HB GLN 42 24.476 -12.787 4.856 321 HG2 GLN 42 2HG GLN 42 24.854 -9.890 3.973 322 HG3 GLN 42 3HG GLN 42 24.016 -10.446 5.408 323 HE21 GLN 42 1HE2 GLN 42 26.884 -9.318 4.156 324 HE22 GLN 42 2HE2 GLN 42 27.978 -9.738 5.431 325 H ALA 43 HN ALA 43 24.653 -13.036 1.003 326 HA ALA 43 HA ALA 43 23.915 -15.590 1.274 327 HB1 ALA 43 3HB ALA 43 24.151 -15.768 -1.174 328 HB2 ALA 43 1HB ALA 43 23.526 -14.167 -0.712 329 HB3 ALA 43 2HB ALA 43 25.233 -14.354 -1.179 330 HA PRO 44 HA PRO 44 27.880 -17.399 2.076 331 HB2 PRO 44 2HB PRO 44 26.955 -19.540 3.503 332 HB3 PRO 44 3HB PRO 44 27.372 -18.004 4.239 333 HG2 PRO 44 2HG PRO 44 24.694 -19.133 3.696 334 HG3 PRO 44 3HG PRO 44 25.138 -17.835 4.787 335 HD2 PRO 44 2HD PRO 44 23.909 -17.565 2.208 336 HD3 PRO 44 3HD PRO 44 24.459 -16.267 3.250 337 H GLY 45 HN GLY 45 25.439 -18.131 0.059 338 HA2 GLY 45 1HA GLY 45 26.706 -20.649 -0.811 339 HA3 GLY 45 2HA GLY 45 25.067 -20.138 -1.161 340 H TYR 46 HN TYR 46 26.707 -17.292 -1.413 341 HA TYR 46 HA TYR 46 27.996 -17.699 -3.944 342 HB2 TYR 46 2HB TYR 46 25.435 -17.639 -4.348 343 HB3 TYR 46 3HB TYR 46 25.418 -16.036 -3.641 344 HD1 TYR 46 HD1 TYR 46 27.710 -17.667 -6.133 345 HD2 TYR 46 HD2 TYR 46 24.990 -14.472 -5.300 346 HE1 TYR 46 HE1 TYR 46 28.194 -16.651 -8.413 347 HE2 TYR 46 HE2 TYR 46 25.482 -13.466 -7.583 348 HH TYR 46 HH TYR 46 28.086 -14.244 -9.369 349 H SER 47 HN SER 47 29.786 -16.468 -3.652 350 HA SER 47 HA SER 47 29.543 -14.121 -2.006 351 HB2 SER 47 2HB SER 47 32.112 -14.059 -2.489 352 HB3 SER 47 3HB SER 47 31.481 -15.321 -1.450 353 HG SER 47 HG SER 47 32.860 -16.310 -2.951 354 H TYR 48 HN TYR 48 29.871 -11.974 -2.750 355 HA TYR 48 HA TYR 48 29.718 -11.700 -5.659 356 HB2 TYR 48 2HB TYR 48 29.444 -9.526 -3.527 357 HB3 TYR 48 3HB TYR 48 28.640 -9.604 -5.082 358 HD1 TYR 48 HD2 TYR 48 27.868 -12.665 -4.600 359 HD2 TYR 48 HD1 TYR 48 27.328 -9.044 -2.385 360 HE1 TYR 48 HE2 TYR 48 25.807 -13.648 -3.482 361 HE2 TYR 48 HE1 TYR 48 25.269 -10.040 -1.275 362 HH TYR 48 HH TYR 48 23.748 -11.676 -1.446 363 H THR 49 HN THR 49 30.640 -9.209 -6.153 364 HA THR 49 HA THR 49 33.397 -9.527 -6.235 365 HB THR 49 HB THR 49 33.236 -6.999 -6.829 366 HG1 THR 49 HG1 THR 49 30.858 -6.458 -7.050 367 HG21 THR 49 1HG2 THR 49 31.123 -7.876 -8.540 368 HG22 THR 49 2HG2 THR 49 32.862 -7.847 -8.918 369 HG23 THR 49 3HG2 THR 49 32.125 -9.311 -8.224 370 H ALA 50 HN ALA 50 34.898 -7.597 -5.392 371 HA ALA 50 HA ALA 50 34.724 -7.853 -2.509 372 HB1 ALA 50 3HB ALA 50 36.884 -6.635 -4.276 373 HB2 ALA 50 1HB ALA 50 37.030 -7.069 -2.555 374 HB3 ALA 50 2HB ALA 50 36.823 -8.344 -3.780 375 H ALA 51 HN ALA 51 33.053 -5.997 -4.479 376 HA ALA 51 HA ALA 51 33.742 -3.434 -3.263 377 HB1 ALA 51 3HB ALA 51 32.180 -2.532 -4.964 378 HB2 ALA 51 1HB ALA 51 33.461 -3.521 -5.704 379 HB3 ALA 51 2HB ALA 51 31.824 -4.191 -5.505 380 H ASN 52 HN ASN 52 31.029 -5.796 -3.638 381 HA ASN 52 HA ASN 52 29.406 -4.256 -1.874 382 HB2 ASN 52 2HB ASN 52 28.528 -5.687 -3.807 383 HB3 ASN 52 3HB ASN 52 28.986 -7.112 -2.896 384 HD21 ASN 52 1HD2 ASN 52 27.878 -7.708 -1.063 385 HD22 ASN 52 2HD2 ASN 52 26.336 -7.056 -0.620 386 H LYS 53 HN LYS 53 31.163 -7.434 -1.902 387 HA LYS 53 HA LYS 53 30.436 -8.442 0.510 388 HB2 LYS 53 2HB LYS 53 32.027 -9.322 -1.366 389 HB3 LYS 53 3HB LYS 53 33.298 -8.585 -0.412 390 HG2 LYS 53 2HG LYS 53 32.063 -9.877 1.599 391 HG3 LYS 53 3HG LYS 53 31.490 -10.895 0.293 392 HD2 LYS 53 2HD LYS 53 34.042 -10.909 -0.450 393 HD3 LYS 53 3HD LYS 53 34.339 -10.414 1.206 394 HE2 LYS 53 2HE LYS 53 33.143 -13.003 0.188 395 HE3 LYS 53 3HE LYS 53 34.448 -12.773 1.337 396 HZ1 LYS 53 2HZ LYS 53 32.962 -12.367 3.039 397 HZ3 LYS 53 1HZ LYS 53 32.034 -13.369 2.152 398 H ASN 54 HN ASN 54 32.657 -5.733 -0.192 399 HA ASN 54 HA ASN 54 33.629 -5.614 2.451 400 HB2 ASN 54 2HB ASN 54 34.564 -4.605 0.153 401 HB3 ASN 54 3HB ASN 54 33.578 -3.221 0.582 402 HD21 ASN 54 1HD2 ASN 54 36.563 -4.572 0.815 403 HD22 ASN 54 2HD2 ASN 54 37.204 -3.743 2.194 404 H LYS 55 HN LYS 55 31.042 -4.030 0.501 405 HA LYS 55 HA LYS 55 30.334 -1.944 2.078 406 HB2 LYS 55 2HB LYS 55 29.380 -2.817 -0.172 407 HB3 LYS 55 3HB LYS 55 28.256 -3.727 0.816 408 HG2 LYS 55 2HG LYS 55 27.268 -1.554 0.210 409 HG3 LYS 55 3HG LYS 55 27.521 -1.629 1.942 410 HD2 LYS 55 2HD LYS 55 29.272 -0.080 1.905 411 HD3 LYS 55 3HD LYS 55 29.760 -0.502 0.276 412 HE2 LYS 55 2HE LYS 55 27.319 0.494 -0.319 413 HE3 LYS 55 3HE LYS 55 27.574 1.365 1.181 414 HZ1 LYS 55 2HZ LYS 55 29.955 1.610 -0.171 415 HZ3 LYS 55 1HZ LYS 55 28.815 2.766 -0.045 416 H GLY 56 HN GLY 56 29.135 -1.587 3.955 417 HA2 GLY 56 1HA GLY 56 28.179 -3.980 5.384 418 HA3 GLY 56 2HA GLY 56 29.314 -2.894 6.161 419 H ILE 57 HN ILE 57 26.085 -3.007 4.540 420 HA ILE 57 HA ILE 57 25.148 -1.078 6.504 421 HB ILE 57 HB ILE 57 24.023 0.249 4.762 422 HG12 ILE 57 2HG1 ILE 57 25.107 0.044 2.416 423 HG13 ILE 57 3HG1 ILE 57 25.558 -1.574 2.914 424 HG21 ILE 57 1HG2 ILE 57 26.269 0.817 5.816 425 HG22 ILE 57 2HG2 ILE 57 27.008 0.256 4.297 426 HG23 ILE 57 3HG2 ILE 57 25.873 1.627 4.280 427 HD11 ILE 57 3HD1 ILE 57 22.744 -0.942 3.551 428 HD12 ILE 57 1HD1 ILE 57 23.108 -0.850 1.810 429 HD13 ILE 57 2HD1 ILE 57 23.428 -2.353 2.709 430 H ILE 58 HN ILE 58 22.835 -1.181 6.838 431 HA ILE 58 HA ILE 58 21.831 -3.815 6.214 432 HB ILE 58 HB ILE 58 21.074 -1.594 8.066 433 HG12 ILE 58 2HG1 ILE 58 22.729 -3.568 8.508 434 HG13 ILE 58 3HG1 ILE 58 21.594 -3.071 9.747 435 HG21 ILE 58 1HG2 ILE 58 19.278 -3.933 7.365 436 HG22 ILE 58 2HG2 ILE 58 19.021 -2.769 8.687 437 HG23 ILE 58 3HG2 ILE 58 18.968 -2.220 6.995 438 HD11 ILE 58 3HD1 ILE 58 20.033 -4.873 9.099 439 HD12 ILE 58 1HD1 ILE 58 21.115 -5.348 7.769 440 HD13 ILE 58 2HD1 ILE 58 21.639 -5.550 9.458 441 H TRP 59 HN TRP 59 20.288 -4.310 4.713 442 HA TRP 59 HA TRP 59 19.608 -2.261 2.838 443 HB2 TRP 59 2HB TRP 59 19.124 -5.212 3.067 444 HB3 TRP 59 3HB TRP 59 18.213 -4.262 1.910 445 HD1 TRP 59 HD1 TRP 59 21.118 -6.344 1.832 446 HE1 TRP 59 HE1 TRP 59 22.888 -5.759 -0.036 447 HE3 TRP 59 HE3 TRP 59 19.354 -1.670 0.884 448 HZ2 TRP 59 HZ2 TRP 59 23.342 -3.459 -1.664 449 HZ3 TRP 59 HZ3 TRP 59 20.517 -0.321 -0.860 450 HH2 TRP 59 HH2 TRP 59 22.446 -1.145 -2.115 451 H GLY 60 HN GLY 60 17.368 -1.645 2.301 452 HA2 GLY 60 1HA GLY 60 15.181 -2.393 3.945 453 HA3 GLY 60 2HA GLY 60 15.853 -0.869 4.491 454 H GLU 61 HN GLU 61 14.036 0.387 3.839 455 HA GLU 61 HA GLU 61 13.275 0.243 1.073 456 HB2 GLU 61 2HB GLU 61 12.245 2.088 3.272 457 HB3 GLU 61 3HB GLU 61 11.494 1.820 1.711 458 HG2 GLU 61 2HG GLU 61 11.334 -0.669 2.335 459 HG3 GLU 61 3HG GLU 61 11.843 -0.222 3.951 460 HE2 GLU 61 HE2 GLU 61 8.868 0.827 1.859 461 H ASP 62 HN ASP 62 14.402 2.822 3.385 462 HA ASP 62 HA ASP 62 14.756 4.756 1.482 463 HB2 ASP 62 2HB ASP 62 15.941 5.952 3.155 464 HB3 ASP 62 3HB ASP 62 14.869 4.905 4.064 465 HD2 ASP 62 HD2 ASP 62 16.041 3.490 5.596 466 H THR 63 HN THR 63 17.014 2.251 2.819 467 HA THR 63 HA THR 63 19.305 3.080 1.437 468 HB THR 63 HB THR 63 19.963 0.629 1.955 469 HG1 THR 63 HG1 THR 63 18.191 -0.278 3.429 470 HG21 THR 63 1HG2 THR 63 18.830 2.515 4.061 471 HG22 THR 63 2HG2 THR 63 19.475 0.922 4.523 472 HG23 THR 63 3HG2 THR 63 20.534 2.119 3.737 473 H LEU 64 HN LEU 64 16.438 1.301 0.399 474 HA LEU 64 HA LEU 64 17.797 0.498 -2.045 475 HB2 LEU 64 2HB LEU 64 15.116 -0.133 -0.828 476 HB3 LEU 64 3HB LEU 64 15.510 -0.554 -2.482 477 HG LEU 64 HG LEU 64 17.060 -1.488 -0.050 478 HD11 LEU 64 1HD1 LEU 64 15.722 -3.607 -1.443 479 HD12 LEU 64 2HD1 LEU 64 15.563 -3.093 0.254 480 HD13 LEU 64 3HD1 LEU 64 14.538 -2.354 -0.999 481 HD21 LEU 64 3HD2 LEU 64 17.289 -2.144 -2.994 482 HD22 LEU 64 1HD2 LEU 64 18.529 -1.465 -1.911 483 HD23 LEU 64 2HD2 LEU 64 17.996 -3.150 -1.706 484 H MET 65 HN MET 65 15.866 3.066 -0.728 485 HA MET 65 HA MET 65 14.541 3.783 -3.086 486 HB2 MET 65 2HB MET 65 14.298 4.506 -0.501 487 HB3 MET 65 3HB MET 65 15.383 5.799 -0.974 488 HG2 MET 65 2HG MET 65 13.353 6.829 -1.456 489 HG3 MET 65 3HG MET 65 13.652 6.070 -3.007 490 HE1 MET 65 3HE MET 65 12.451 3.388 -3.539 491 HE2 MET 65 1HE MET 65 10.774 3.982 -3.621 492 HE3 MET 65 2HE MET 65 12.116 5.026 -4.153 493 H GLU 66 HN GLU 66 17.738 4.595 -1.673 494 HA GLU 66 HA GLU 66 18.209 6.550 -3.709 495 HB2 GLU 66 2HB GLU 66 19.136 7.043 -1.549 496 HB3 GLU 66 3HB GLU 66 19.858 5.454 -1.403 497 HG2 GLU 66 2HG GLU 66 21.460 5.941 -3.192 498 HG3 GLU 66 3HG GLU 66 20.656 7.452 -3.568 499 HE2 GLU 66 HE2 GLU 66 21.964 9.294 -1.218 500 H TYR 67 HN TYR 67 19.136 3.179 -2.906 501 HA TYR 67 HA TYR 67 21.179 2.880 -4.772 502 HB2 TYR 67 2HB TYR 67 20.295 1.382 -2.812 503 HB3 TYR 67 3HB TYR 67 19.017 0.872 -3.897 504 HD1 TYR 67 HD1 TYR 67 22.642 1.426 -4.648 505 HD2 TYR 67 HD2 TYR 67 19.449 -1.398 -4.287 506 HE1 TYR 67 HE1 TYR 67 24.147 -0.405 -5.566 507 HE2 TYR 67 HE2 TYR 67 20.965 -3.220 -5.207 508 HH TYR 67 HH TYR 67 23.987 -2.490 -6.649 509 H LEU 68 HN LEU 68 17.612 2.299 -5.047 510 HA LEU 68 HA LEU 68 17.657 1.253 -7.610 511 HB2 LEU 68 2HB LEU 68 15.651 2.559 -5.848 512 HB3 LEU 68 3HB LEU 68 15.261 2.438 -7.552 513 HG LEU 68 HG LEU 68 16.023 0.089 -5.796 514 HD11 LEU 68 1HD1 LEU 68 13.247 0.543 -6.830 515 HD12 LEU 68 2HD1 LEU 68 13.806 -0.387 -5.419 516 HD13 LEU 68 3HD1 LEU 68 13.788 1.391 -5.362 517 HD21 LEU 68 3HD2 LEU 68 14.534 -0.484 -8.232 518 HD22 LEU 68 1HD2 LEU 68 16.095 0.305 -8.563 519 HD23 LEU 68 2HD2 LEU 68 16.042 -1.198 -7.612 520 H GLU 69 HN GLU 69 17.607 4.654 -6.437 521 HA GLU 69 HA GLU 69 17.146 5.824 -8.888 522 HB2 GLU 69 2HB GLU 69 17.006 7.033 -6.742 523 HB3 GLU 69 3HB GLU 69 18.732 6.856 -6.496 524 HG2 GLU 69 2HG GLU 69 18.417 9.071 -7.374 525 HG3 GLU 69 3HG GLU 69 19.090 8.126 -8.687 526 HE2 GLU 69 HE2 GLU 69 17.207 7.530 -10.466 527 H ASN 70 HN ASN 70 20.204 4.781 -7.286 528 HA ASN 70 HA ASN 70 21.423 4.546 -9.828 529 HB2 ASN 70 2HB ASN 70 21.673 7.062 -9.054 530 HB3 ASN 70 3HB ASN 70 22.825 6.436 -7.891 531 HD21 ASN 70 1HD2 ASN 70 22.609 7.878 -10.752 532 HD22 ASN 70 2HD2 ASN 70 24.009 7.278 -11.579 533 HA PRO 71 HA PRO 71 22.955 1.765 -6.606 534 HB2 PRO 71 2HB PRO 71 22.950 -0.517 -8.109 535 HB3 PRO 71 3HB PRO 71 21.587 -0.011 -7.130 536 HG2 PRO 71 2HG PRO 71 21.910 0.117 -10.065 537 HG3 PRO 71 3HG PRO 71 20.439 0.210 -9.118 538 HD2 PRO 71 2HD PRO 71 21.819 2.394 -10.365 539 HD3 PRO 71 3HD PRO 71 20.415 2.501 -9.322 540 H LYS 72 HN LYS 72 24.140 2.944 -9.463 541 HA LYS 72 HA LYS 72 26.547 1.415 -9.496 542 HB2 LYS 72 2HB LYS 72 25.799 4.005 -10.887 543 HB3 LYS 72 3HB LYS 72 27.237 3.060 -11.214 544 HG2 LYS 72 2HG LYS 72 25.472 1.069 -11.524 545 HG3 LYS 72 3HG LYS 72 24.350 2.387 -11.800 546 HD2 LYS 72 2HD LYS 72 25.111 2.062 -13.975 547 HD3 LYS 72 3HD LYS 72 26.258 3.275 -13.441 548 HE2 LYS 72 2HE LYS 72 27.991 1.665 -13.092 549 HE3 LYS 72 3HE LYS 72 26.866 0.323 -13.059 550 HZ1 LYS 72 2HZ LYS 72 28.231 1.208 -15.268 551 HZ3 LYS 72 1HZ LYS 72 26.717 1.744 -15.536 552 H LYS 73 HN LYS 73 25.574 4.716 -8.377 553 HA LYS 73 HA LYS 73 28.141 5.429 -7.505 554 HB2 LYS 73 2HB LYS 73 27.157 7.367 -6.771 555 HB3 LYS 73 3HB LYS 73 25.985 6.844 -7.962 556 HG2 LYS 73 2HG LYS 73 24.667 5.724 -6.112 557 HG3 LYS 73 3HG LYS 73 25.808 6.369 -4.949 558 HD2 LYS 73 2HD LYS 73 24.209 8.108 -6.883 559 HD3 LYS 73 3HD LYS 73 23.692 7.755 -5.247 560 HE2 LYS 73 2HE LYS 73 24.813 9.808 -4.972 561 HE3 LYS 73 3HE LYS 73 26.058 8.654 -4.534 562 HZ1 LYS 73 2HZ LYS 73 27.209 9.845 -6.089 563 HZ3 LYS 73 1HZ LYS 73 25.889 10.327 -6.914 564 H TYR 74 HN TYR 74 25.347 3.816 -5.897 565 HA TYR 74 HA TYR 74 26.337 3.820 -3.316 566 HB2 TYR 74 2HB TYR 74 24.103 2.981 -4.613 567 HB3 TYR 74 3HB TYR 74 24.932 1.438 -4.611 568 HD1 TYR 74 HD2 TYR 74 26.046 0.943 -2.116 569 HD2 TYR 74 HD1 TYR 74 22.527 3.233 -2.940 570 HE1 TYR 74 HE2 TYR 74 25.194 0.495 0.238 571 HE2 TYR 74 HE1 TYR 74 21.687 2.778 -0.584 572 HH TYR 74 HH TYR 74 23.641 1.669 1.841 573 H ILE 75 HN ILE 75 26.713 1.294 -5.903 574 HA ILE 75 HA ILE 75 29.156 0.462 -4.521 575 HB ILE 75 HB ILE 75 27.168 -1.498 -5.654 576 HG12 ILE 75 2HG1 ILE 75 27.432 -0.489 -2.811 577 HG13 ILE 75 3HG1 ILE 75 26.022 -0.402 -3.847 578 HG21 ILE 75 1HG2 ILE 75 29.361 -2.018 -3.650 579 HG22 ILE 75 2HG2 ILE 75 28.485 -3.172 -4.685 580 HG23 ILE 75 3HG2 ILE 75 29.661 -2.046 -5.405 581 HD11 ILE 75 3HD1 ILE 75 26.350 -3.063 -3.955 582 HD12 ILE 75 1HD1 ILE 75 27.182 -2.776 -2.407 583 HD13 ILE 75 2HD1 ILE 75 25.481 -2.291 -2.606 584 HA PRO 76 HA PRO 76 30.044 1.226 -8.825 585 HB2 PRO 76 2HB PRO 76 32.498 2.363 -8.438 586 HB3 PRO 76 3HB PRO 76 31.014 3.291 -8.517 587 HG2 PRO 76 2HG PRO 76 32.640 2.596 -6.149 588 HG3 PRO 76 3HG PRO 76 31.424 3.845 -6.316 589 HD2 PRO 76 2HD PRO 76 31.117 1.318 -4.996 590 HD3 PRO 76 3HD PRO 76 29.869 2.518 -5.265 591 H GLY 77 HN GLY 77 30.317 -0.652 -9.860 592 HA2 GLY 77 1HA GLY 77 32.195 -1.952 -10.745 593 HA3 GLY 77 2HA GLY 77 32.781 -2.106 -9.102 594 H THR 78 HN THR 78 29.438 -2.130 -8.839 595 HA THR 78 HA THR 78 29.330 -4.847 -8.148 596 HB THR 78 HB THR 78 27.824 -3.207 -7.153 597 HG1 THR 78 HG1 THR 78 25.827 -4.359 -7.734 598 HG21 THR 78 1HG2 THR 78 27.650 -2.146 -9.794 599 HG22 THR 78 2HG2 THR 78 26.036 -2.798 -9.429 600 HG23 THR 78 3HG2 THR 78 26.766 -1.578 -8.358 601 H LYS 79 HN LYS 79 27.706 -6.433 -9.108 602 HA LYS 79 HA LYS 79 28.280 -6.541 -11.964 603 HB2 LYS 79 2HB LYS 79 27.131 -8.756 -10.261 604 HB3 LYS 79 3HB LYS 79 27.943 -8.883 -11.809 605 HG2 LYS 79 2HG LYS 79 29.974 -7.745 -10.516 606 HG3 LYS 79 3HG LYS 79 29.138 -8.313 -9.084 607 HD2 LYS 79 2HD LYS 79 29.777 -10.153 -11.431 608 HD3 LYS 79 3HD LYS 79 30.899 -9.904 -10.108 609 HE2 LYS 79 2HE LYS 79 28.024 -10.885 -9.765 610 HE3 LYS 79 3HE LYS 79 29.428 -11.934 -9.805 611 HZ1 LYS 79 2HZ LYS 79 29.836 -9.845 -7.926 612 HZ3 LYS 79 1HZ LYS 79 29.821 -11.451 -7.659 613 H MET 80 HN MET 80 26.135 -4.869 -10.413 614 HA MET 80 HA MET 80 23.700 -6.031 -11.279 615 HB2 MET 80 2HB MET 80 24.150 -4.385 -9.295 616 HB3 MET 80 3HB MET 80 24.211 -3.115 -10.501 617 HG2 MET 80 2HG MET 80 21.948 -3.004 -10.005 618 HG3 MET 80 3HG MET 80 21.872 -4.217 -11.268 619 HE1 MET 80 3HE MET 80 21.609 -4.264 -6.907 620 HE2 MET 80 1HE MET 80 21.216 -3.041 -8.140 621 HE3 MET 80 2HE MET 80 19.985 -4.224 -7.636 622 H ILE 81 HN ILE 81 23.653 -6.315 -13.530 623 HA ILE 81 HA ILE 81 24.646 -4.476 -15.363 624 HB ILE 81 HB ILE 81 22.732 -6.769 -15.456 625 HG12 ILE 81 2HG1 ILE 81 24.451 -7.744 -16.880 626 HG13 ILE 81 3HG1 ILE 81 25.358 -6.245 -16.878 627 HG21 ILE 81 1HG2 ILE 81 22.681 -6.454 -17.973 628 HG22 ILE 81 2HG2 ILE 81 21.667 -5.349 -17.013 629 HG23 ILE 81 3HG2 ILE 81 23.217 -4.782 -17.680 630 HD11 ILE 81 3HD1 ILE 81 25.754 -6.408 -14.467 631 HD12 ILE 81 1HD1 ILE 81 24.686 -7.828 -14.356 632 HD13 ILE 81 2HD1 ILE 81 26.229 -7.943 -15.233 633 H PHE 82 HN PHE 82 21.877 -4.342 -13.290 634 HA PHE 82 HA PHE 82 20.047 -2.969 -14.798 635 HB2 PHE 82 2HB PHE 82 19.969 -3.860 -12.364 636 HB3 PHE 82 3HB PHE 82 20.900 -2.454 -11.887 637 HD1 PHE 82 HD1 PHE 82 18.096 -2.611 -14.323 638 HD2 PHE 82 HD2 PHE 82 19.419 -1.282 -10.516 639 HE1 PHE 82 HE1 PHE 82 15.974 -1.300 -14.043 640 HE2 PHE 82 HE2 PHE 82 17.297 0.028 -10.236 641 HZ PHE 82 HZ PHE 82 15.599 0.004 -12.003 642 H VAL 83 HN VAL 83 19.424 -0.551 -14.395 643 HA VAL 83 HA VAL 83 21.883 1.048 -14.578 644 HB VAL 83 HB VAL 83 20.668 2.482 -16.158 645 HG11 VAL 83 1HG1 VAL 83 22.128 0.525 -16.865 646 HG12 VAL 83 2HG1 VAL 83 20.622 -0.381 -17.147 647 HG13 VAL 83 3HG1 VAL 83 20.954 1.101 -18.074 648 HG21 VAL 83 3HG2 VAL 83 18.378 2.068 -15.490 649 HG22 VAL 83 1HG2 VAL 83 18.574 1.637 -17.207 650 HG23 VAL 83 2HG2 VAL 83 18.507 0.359 -15.969 651 H GLY 84 HN GLY 84 18.354 1.016 -13.764 652 HA2 GLY 84 1HA GLY 84 18.186 1.854 -11.327 653 HA3 GLY 84 2HA GLY 84 18.795 3.343 -12.020 654 H ILE 85 HN ILE 85 16.472 3.810 -10.929 655 HA ILE 85 HA ILE 85 14.523 3.602 -13.119 656 HB ILE 85 HB ILE 85 14.058 3.528 -10.137 657 HG12 ILE 85 2HG1 ILE 85 13.912 1.465 -12.328 658 HG13 ILE 85 3HG1 ILE 85 14.756 1.386 -10.795 659 HG21 ILE 85 1HG2 ILE 85 11.680 3.328 -10.662 660 HG22 ILE 85 2HG2 ILE 85 12.340 4.876 -11.240 661 HG23 ILE 85 3HG2 ILE 85 12.032 3.555 -12.392 662 HD11 ILE 85 3HD1 ILE 85 12.847 0.042 -10.426 663 HD12 ILE 85 1HD1 ILE 85 12.379 1.603 -9.709 664 HD13 ILE 85 2HD1 ILE 85 11.780 1.148 -11.323 665 H LYS 86 HN LYS 86 13.002 5.456 -13.266 666 HA LYS 86 HA LYS 86 14.346 7.902 -12.348 667 HB2 LYS 86 2HB LYS 86 13.026 7.153 -14.925 668 HB3 LYS 86 3HB LYS 86 12.892 8.814 -14.384 669 HG2 LYS 86 2HG LYS 86 14.901 8.963 -15.540 670 HG3 LYS 86 3HG LYS 86 15.522 8.553 -13.954 671 HD2 LYS 86 2HD LYS 86 16.625 6.924 -15.172 672 HD3 LYS 86 3HD LYS 86 15.148 6.038 -14.851 673 HE2 LYS 86 2HE LYS 86 14.350 7.301 -17.109 674 HE3 LYS 86 3HE LYS 86 16.076 7.321 -17.411 675 HZ1 LYS 86 2HZ LYS 86 14.279 5.064 -17.399 676 HZ3 LYS 86 1HZ LYS 86 15.663 4.773 -16.593 677 H LYS 87 HN LYS 87 11.301 6.065 -12.638 678 HA LYS 87 HA LYS 87 9.790 8.227 -11.467 679 HB2 LYS 87 2HB LYS 87 9.169 5.515 -12.590 680 HB3 LYS 87 3HB LYS 87 8.015 6.272 -11.513 681 HG2 LYS 87 2HG LYS 87 9.189 7.800 -13.866 682 HG3 LYS 87 3HG LYS 87 7.809 6.740 -14.079 683 HD2 LYS 87 2HD LYS 87 7.756 8.803 -11.861 684 HD3 LYS 87 3HD LYS 87 7.452 9.314 -13.510 685 HE2 LYS 87 2HE LYS 87 5.548 7.825 -13.722 686 HE3 LYS 87 3HE LYS 87 5.955 6.979 -12.243 687 HZ1 LYS 87 2HZ LYS 87 4.325 8.470 -11.557 688 HZ3 LYS 87 1HZ LYS 87 4.820 9.682 -12.525 689 H LYS 88 HN LYS 88 9.979 8.658 -9.337 690 HA LYS 88 HA LYS 88 11.049 6.761 -7.538 691 HB2 LYS 88 2HB LYS 88 11.072 8.481 -6.023 692 HB3 LYS 88 3HB LYS 88 11.051 9.386 -7.522 693 HG2 LYS 88 2HG LYS 88 8.547 8.674 -5.923 694 HG3 LYS 88 3HG LYS 88 9.385 10.208 -5.799 695 HD2 LYS 88 2HD LYS 88 8.944 10.721 -8.152 696 HD3 LYS 88 3HD LYS 88 8.310 9.113 -8.438 697 HE2 LYS 88 2HE LYS 88 6.354 9.522 -7.091 698 HE3 LYS 88 3HE LYS 88 7.055 10.955 -6.364 699 HZ1 LYS 88 2HZ LYS 88 6.526 10.794 -9.276 700 HZ3 LYS 88 1HZ LYS 88 6.828 12.134 -8.401 701 H GLU 89 HN GLU 89 7.908 7.247 -8.898 702 HA GLU 89 HA GLU 89 6.505 6.236 -6.639 703 HB2 GLU 89 2HB GLU 89 5.484 7.827 -8.273 704 HB3 GLU 89 3HB GLU 89 5.599 6.610 -9.528 705 HG2 GLU 89 2HG GLU 89 4.100 5.103 -8.257 706 HG3 GLU 89 3HG GLU 89 4.048 6.238 -6.923 707 HE2 GLU 89 HE2 GLU 89 1.505 5.705 -8.684 708 H GLU 90 HN GLU 90 8.455 4.885 -9.112 709 HA GLU 90 HA GLU 90 7.003 2.374 -9.017 710 HB2 GLU 90 2HB GLU 90 9.046 3.572 -10.886 711 HB3 GLU 90 3HB GLU 90 8.927 1.826 -10.790 712 HG2 GLU 90 2HG GLU 90 7.400 2.358 -12.512 713 HG3 GLU 90 3HG GLU 90 6.358 2.165 -11.116 714 HE2 GLU 90 HE2 GLU 90 5.042 4.778 -10.898 715 H ARG 91 HN ARG 91 9.541 4.038 -7.468 716 HA ARG 91 HA ARG 91 11.105 1.669 -7.035 717 HB2 ARG 91 2HB ARG 91 11.395 4.549 -6.045 718 HB3 ARG 91 3HB ARG 91 12.521 3.273 -5.623 719 HG2 ARG 91 2HG ARG 91 12.729 2.879 -8.208 720 HG3 ARG 91 3HG ARG 91 11.967 4.448 -8.371 721 HD2 ARG 91 2HD ARG 91 14.424 4.045 -6.614 722 HD3 ARG 91 3HD ARG 91 14.566 4.386 -8.327 723 HE ARG 91 HE ARG 91 13.651 6.248 -6.234 724 HH11 ARG 91 2HH2 ARG 91 13.833 5.604 -9.714 725 HH12 ARG 91 1HH2 ARG 91 13.621 7.264 -10.159 726 HH22 ARG 91 HH1 ARG 91 13.351 8.914 -8.441 727 H ALA 92 HN ALA 92 8.716 3.762 -5.419 728 HA ALA 92 HA ALA 92 9.161 2.655 -2.820 729 HB1 ALA 92 3HB ALA 92 7.516 4.731 -4.106 730 HB2 ALA 92 1HB ALA 92 6.658 3.851 -2.818 731 HB3 ALA 92 2HB ALA 92 8.198 4.670 -2.463 732 H ASP 93 HN ASP 93 7.575 1.644 -5.726 733 HA ASP 93 HA ASP 93 5.690 0.017 -4.277 734 HB2 ASP 93 2HB ASP 93 6.246 0.535 -7.224 735 HB3 ASP 93 3HB ASP 93 5.164 -0.749 -6.724 736 HD2 ASP 93 HD2 ASP 93 3.243 2.308 -7.368 737 H LEU 94 HN LEU 94 8.484 -0.249 -6.589 738 HA LEU 94 HA LEU 94 8.586 -3.007 -6.748 739 HB2 LEU 94 2HB LEU 94 9.773 -1.639 -8.281 740 HB3 LEU 94 3HB LEU 94 10.692 -0.868 -7.003 741 HG LEU 94 HG LEU 94 11.763 -3.103 -6.530 742 HD11 LEU 94 1HD1 LEU 94 10.028 -4.512 -7.560 743 HD12 LEU 94 2HD1 LEU 94 10.490 -3.893 -9.164 744 HD13 LEU 94 3HD1 LEU 94 11.650 -4.850 -8.212 745 HD21 LEU 94 3HD2 LEU 94 12.573 -1.150 -8.123 746 HD22 LEU 94 1HD2 LEU 94 13.470 -2.681 -7.987 747 HD23 LEU 94 2HD2 LEU 94 12.380 -2.407 -9.368 748 H ILE 95 HN ILE 95 9.707 -0.751 -4.225 749 HA ILE 95 HA ILE 95 11.176 -2.806 -2.859 750 HB ILE 95 HB ILE 95 10.476 0.058 -2.258 751 HG12 ILE 95 2HG1 ILE 95 13.186 -1.227 -2.656 752 HG13 ILE 95 3HG1 ILE 95 12.243 -0.577 -3.982 753 HG21 ILE 95 1HG2 ILE 95 12.130 -1.774 -0.502 754 HG22 ILE 95 2HG2 ILE 95 11.747 -0.058 -0.222 755 HG23 ILE 95 3HG2 ILE 95 10.455 -1.280 -0.158 756 HD11 ILE 95 3HD1 ILE 95 13.672 1.213 -3.316 757 HD12 ILE 95 1HD1 ILE 95 12.093 1.613 -2.600 758 HD13 ILE 95 2HD1 ILE 95 13.377 0.913 -1.587 759 H ALA 96 HN ALA 96 7.974 -1.192 -2.641 760 HA ALA 96 HA ALA 96 7.188 -2.197 -0.191 761 HB1 ALA 96 3HB ALA 96 5.472 -0.879 -0.791 762 HB2 ALA 96 1HB ALA 96 6.036 -0.862 -2.478 763 HB3 ALA 96 2HB ALA 96 4.932 -2.143 -1.922 764 H TYR 97 HN TYR 97 7.796 -3.822 -3.219 765 HA TYR 97 HA TYR 97 6.164 -6.110 -2.463 766 HB2 TYR 97 2HB TYR 97 6.122 -5.524 -4.813 767 HB3 TYR 97 3HB TYR 97 7.821 -5.099 -4.821 768 HD1 TYR 97 HD2 TYR 97 6.580 -8.255 -3.347 769 HD2 TYR 97 HD1 TYR 97 8.376 -6.416 -6.766 770 HE1 TYR 97 HE2 TYR 97 7.153 -10.547 -4.286 771 HE2 TYR 97 HE1 TYR 97 8.943 -8.714 -7.695 772 HH TYR 97 HH TYR 97 7.538 -11.474 -6.654 773 H LEU 98 HN LEU 98 9.615 -5.465 -3.430 774 HA LEU 98 HA LEU 98 10.606 -7.935 -2.782 775 HB2 LEU 98 2HB LEU 98 11.725 -5.184 -2.994 776 HB3 LEU 98 3HB LEU 98 12.726 -6.416 -2.250 777 HG LEU 98 HG LEU 98 11.605 -6.399 -5.059 778 HD11 LEU 98 1HD1 LEU 98 14.382 -6.913 -4.995 779 HD12 LEU 98 2HD1 LEU 98 13.542 -5.455 -5.575 780 HD13 LEU 98 3HD1 LEU 98 14.085 -5.557 -3.882 781 HD21 LEU 98 3HD2 LEU 98 12.465 -8.673 -3.390 782 HD22 LEU 98 1HD2 LEU 98 11.448 -8.629 -4.850 783 HD23 LEU 98 2HD2 LEU 98 13.221 -8.588 -4.999 784 H LYS 99 HN LYS 99 9.632 -5.250 -0.677 785 HA LYS 99 HA LYS 99 10.989 -6.195 1.619 786 HB2 LYS 99 2HB LYS 99 10.062 -4.393 2.686 787 HB3 LYS 99 3HB LYS 99 9.982 -3.843 1.025 788 HG2 LYS 99 2HG LYS 99 7.619 -4.612 0.862 789 HG3 LYS 99 3HG LYS 99 7.692 -5.229 2.501 790 HD2 LYS 99 2HD LYS 99 8.247 -2.868 3.290 791 HD3 LYS 99 3HD LYS 99 7.973 -2.308 1.652 792 HE2 LYS 99 2HE LYS 99 5.882 -1.954 2.729 793 HE3 LYS 99 3HE LYS 99 5.637 -3.431 1.820 794 HZ1 LYS 99 2HZ LYS 99 4.868 -3.655 4.123 795 HZ3 LYS 99 1HZ LYS 99 6.356 -3.336 4.702 796 H LYS 100 HN LYS 100 7.849 -6.866 0.067 797 HA LYS 100 HA LYS 100 7.013 -8.444 2.351 798 HB2 LYS 100 2HB LYS 100 5.546 -6.867 0.869 799 HB3 LYS 100 3HB LYS 100 5.515 -8.216 -0.249 800 HG2 LYS 100 2HG LYS 100 4.722 -9.703 1.650 801 HG3 LYS 100 3HG LYS 100 4.640 -8.286 2.678 802 HD2 LYS 100 2HD LYS 100 3.091 -7.244 0.884 803 HD3 LYS 100 3HD LYS 100 3.015 -8.837 0.158 804 HE2 LYS 100 2HE LYS 100 2.250 -9.741 2.428 805 HE3 LYS 100 3HE LYS 100 2.148 -8.083 2.987 806 HZ1 LYS 100 2HZ LYS 100 0.759 -8.788 0.496 807 HZ3 LYS 100 1HZ LYS 100 0.362 -7.657 1.598 808 H ALA 101 HN ALA 101 8.842 -8.777 -0.556 809 HA ALA 101 HA ALA 101 8.156 -11.539 -0.978 810 HB1 ALA 101 3HB ALA 101 8.759 -9.986 -2.827 811 HB2 ALA 101 1HB ALA 101 10.389 -9.818 -2.131 812 HB3 ALA 101 2HB ALA 101 9.844 -11.396 -2.750 813 H THR 102 HN THR 102 10.776 -9.593 0.536 814 HA THR 102 HA THR 102 12.294 -11.968 1.166 815 HB THR 102 HB THR 102 13.865 -10.313 2.106 816 HG1 THR 102 HG1 THR 102 12.911 -8.471 2.882 817 HG21 THR 102 1HG2 THR 102 13.318 -8.433 0.077 818 HG22 THR 102 2HG2 THR 102 14.398 -9.840 -0.073 819 HG23 THR 102 3HG2 THR 102 12.696 -9.965 -0.580 820 H ASN 103 HN ASN 103 9.858 -9.896 2.687 821 HA ASN 103 HA ASN 103 10.348 -10.402 5.299 822 HB2 ASN 103 2HB ASN 103 8.561 -8.883 4.622 823 HB3 ASN 103 3HB ASN 103 7.709 -10.161 3.776 824 HD21 ASN 103 1HD2 ASN 103 8.947 -9.257 6.978 825 HD22 ASN 103 2HD2 ASN 103 7.668 -9.948 7.918 826 H GLU 104 HN GLU 104 8.207 -12.266 3.005 827 HA GLU 104 HA GLU 104 7.399 -14.217 4.687 828 HB2 GLU 104 2HB GLU 104 8.107 -14.438 1.729 829 HB3 GLU 104 3HB GLU 104 7.192 -15.646 2.607 830 HG2 GLU 104 2HG GLU 104 6.399 -12.750 2.082 831 HG3 GLU 104 3HG GLU 104 5.598 -14.194 1.494 832 HE2 GLU 104 HE2 GLU 104 3.634 -14.685 3.247 833 HHA HEC 500 HHA HEC 500 23.651 -7.190 -5.246 834 HHB HEC 500 HHB HEC 500 17.631 -5.034 -5.452 835 HHC HEC 500 HHC HEC 500 17.799 -5.997 -11.826 836 HHD HEC 500 HHD HEC 500 23.034 -9.601 -11.089 837 HMA1 HEC 500 1HMA HEC 500 18.359 -5.111 -3.247 838 HMA2 HEC 500 2HMA HEC 500 19.850 -5.179 -2.299 839 HMA3 HEC 500 3HMA HEC 500 19.551 -3.789 -3.360 840 HAA1 HEC 500 1HAA HEC 500 23.376 -6.221 -3.514 841 HAA2 HEC 500 2HAA HEC 500 22.296 -5.231 -2.668 842 HBA1 HEC 500 1HBA HEC 500 22.898 -7.679 -1.783 843 HBA2 HEC 500 2HBA HEC 500 21.281 -6.994 -1.529 844 HMB1 HEC 500 1HMB HEC 500 14.555 -5.155 -7.652 845 HMB2 HEC 500 2HMB HEC 500 15.517 -5.158 -6.190 846 HMB3 HEC 500 3HMB HEC 500 15.434 -3.673 -7.163 847 HAB HEC 500 HAB HEC 500 16.198 -4.626 -11.335 848 HBB1 HEC 500 1HBB HEC 500 15.226 -2.775 -10.801 849 HBB2 HEC 500 2HBB HEC 500 13.893 -3.767 -10.154 850 HBB3 HEC 500 3HBB HEC 500 15.162 -3.200 -9.087 851 HMC1 HEC 500 1HMC HEC 500 18.117 -8.648 -13.723 852 HMC2 HEC 500 2HMC HEC 500 18.212 -6.881 -13.774 853 HMC3 HEC 500 3HMC HEC 500 19.403 -7.833 -14.638 854 HAC HEC 500 HAC HEC 500 22.004 -10.381 -12.750 855 HBC1 HEC 500 1HBC HEC 500 20.946 -8.963 -15.195 856 HBC2 HEC 500 2HBC HEC 500 22.487 -8.578 -14.397 857 HBC3 HEC 500 3HBC HEC 500 22.248 -10.176 -15.101 858 HMD1 HEC 500 1HMD HEC 500 24.825 -11.093 -9.246 859 HMD2 HEC 500 2HMD HEC 500 25.249 -9.802 -10.383 860 HMD3 HEC 500 3HMD HEC 500 26.111 -9.978 -8.830 861 HAD1 HEC 500 1HAD HEC 500 25.352 -8.407 -5.514 862 HAD2 HEC 500 2HAD HEC 500 25.917 -9.630 -6.570 863 HBD1 HEC 500 1HBD HEC 500 27.195 -8.115 -7.842 864 HBD2 HEC 500 2HBD HEC 500 26.076 -6.777 -7.506 Start of MODEL 7 1 H1 GLY 1 HN GLY 1 -0.473 -0.378 -0.952 2 HA2 GLY 1 1HA GLY 1 1.776 0.463 -2.640 3 HA3 GLY 1 2HA GLY 1 2.127 -0.265 -1.085 4 H ASP 2 HN ASP 2 0.522 -0.789 -4.257 5 HA ASP 2 HA ASP 2 -0.207 -3.416 -3.807 6 HB2 ASP 2 2HB ASP 2 0.574 -1.967 -6.378 7 HB3 ASP 2 3HB ASP 2 -0.150 -3.562 -6.356 8 HD2 ASP 2 HD2 ASP 2 -2.381 -0.400 -5.307 9 H VAL 3 HN VAL 3 0.842 -5.320 -5.186 10 HA VAL 3 HA VAL 3 3.761 -5.097 -4.920 11 HB VAL 3 HB VAL 3 3.358 -7.732 -4.859 12 HG11 VAL 3 1HG1 VAL 3 4.168 -7.542 -2.771 13 HG12 VAL 3 2HG1 VAL 3 4.130 -5.786 -3.065 14 HG13 VAL 3 3HG1 VAL 3 2.777 -6.577 -2.219 15 HG21 VAL 3 3HG2 VAL 3 1.361 -8.247 -3.476 16 HG22 VAL 3 1HG2 VAL 3 0.808 -6.569 -3.690 17 HG23 VAL 3 2HG2 VAL 3 0.943 -7.648 -5.099 18 H GLU 4 HN GLU 4 1.073 -6.673 -6.780 19 HA GLU 4 HA GLU 4 2.435 -7.815 -8.750 20 HB2 GLU 4 2HB GLU 4 -0.152 -6.231 -8.834 21 HB3 GLU 4 3HB GLU 4 0.447 -7.049 -10.263 22 HG2 GLU 4 2HG GLU 4 0.520 -9.208 -8.980 23 HG3 GLU 4 3HG GLU 4 -0.117 -8.381 -7.571 24 HE2 GLU 4 HE2 GLU 4 -2.469 -9.542 -7.848 25 H LYS 5 HN LYS 5 1.591 -4.295 -8.566 26 HA LYS 5 HA LYS 5 2.587 -3.523 -11.008 27 HB2 LYS 5 2HB LYS 5 2.123 -2.189 -8.374 28 HB3 LYS 5 3HB LYS 5 3.084 -1.330 -9.560 29 HG2 LYS 5 2HG LYS 5 0.390 -2.573 -10.258 30 HG3 LYS 5 3HG LYS 5 0.526 -0.945 -9.627 31 HD2 LYS 5 2HD LYS 5 1.965 -0.280 -11.519 32 HD3 LYS 5 3HD LYS 5 1.997 -1.926 -12.119 33 HE2 LYS 5 2HE LYS 5 -0.219 0.099 -12.238 34 HE3 LYS 5 3HE LYS 5 0.297 -1.054 -13.453 35 HZ1 LYS 5 2HZ LYS 5 -1.814 -1.742 -12.519 36 HZ3 LYS 5 1HZ LYS 5 -1.236 -1.718 -10.997 37 H GLY 6 HN GLY 6 4.298 -4.031 -7.874 38 HA2 GLY 6 1HA GLY 6 6.840 -3.238 -8.992 39 HA3 GLY 6 2HA GLY 6 6.519 -3.867 -7.387 40 H LYS 7 HN LYS 7 4.871 -6.127 -8.895 41 HA LYS 7 HA LYS 7 7.110 -7.927 -8.992 42 HB2 LYS 7 2HB LYS 7 4.724 -8.302 -7.996 43 HB3 LYS 7 3HB LYS 7 4.264 -8.656 -9.648 44 HG2 LYS 7 2HG LYS 7 5.536 -10.600 -9.747 45 HG3 LYS 7 3HG LYS 7 6.765 -9.986 -8.659 46 HD2 LYS 7 2HD LYS 7 5.768 -11.455 -7.188 47 HD3 LYS 7 3HD LYS 7 4.714 -10.087 -6.896 48 HE2 LYS 7 2HE LYS 7 4.184 -12.469 -8.723 49 HE3 LYS 7 3HE LYS 7 3.297 -12.018 -7.281 50 HZ1 LYS 7 2HZ LYS 7 2.318 -10.212 -8.381 51 HZ3 LYS 7 1HZ LYS 7 2.337 -11.340 -9.557 52 H LYS 8 HN LYS 8 5.098 -6.074 -11.217 53 HA LYS 8 HA LYS 8 5.922 -7.673 -13.479 54 HB2 LYS 8 2HB LYS 8 4.151 -5.246 -13.144 55 HB3 LYS 8 3HB LYS 8 4.612 -5.855 -14.721 56 HG2 LYS 8 2HG LYS 8 3.450 -7.743 -12.648 57 HG3 LYS 8 3HG LYS 8 2.386 -6.722 -13.596 58 HD2 LYS 8 2HD LYS 8 4.372 -8.778 -14.669 59 HD3 LYS 8 3HD LYS 8 2.624 -8.890 -14.715 60 HE2 LYS 8 2HE LYS 8 2.808 -6.573 -16.032 61 HE3 LYS 8 3HE LYS 8 4.450 -7.102 -16.337 62 HZ1 LYS 8 2HZ LYS 8 2.046 -8.734 -16.963 63 HZ3 LYS 8 1HZ LYS 8 3.583 -9.131 -17.330 64 H ILE 9 HN ILE 9 7.055 -4.977 -11.600 65 HA ILE 9 HA ILE 9 8.700 -4.023 -13.810 66 HB ILE 9 HB ILE 9 8.059 -2.957 -11.068 67 HG12 ILE 9 2HG1 ILE 9 7.699 -1.472 -13.645 68 HG13 ILE 9 3HG1 ILE 9 6.562 -2.743 -13.245 69 HG21 ILE 9 1HG2 ILE 9 9.483 -0.958 -12.242 70 HG22 ILE 9 2HG2 ILE 9 10.138 -2.110 -11.054 71 HG23 ILE 9 3HG2 ILE 9 10.382 -2.391 -12.794 72 HD11 ILE 9 3HD1 ILE 9 5.478 -1.156 -12.024 73 HD12 ILE 9 1HD1 ILE 9 6.780 -1.371 -10.830 74 HD13 ILE 9 2HD1 ILE 9 6.888 -0.069 -12.038 75 H PHE 10 HN PHE 10 8.742 -6.234 -11.162 76 HA PHE 10 HA PHE 10 11.557 -5.990 -10.661 77 HB2 PHE 10 2HB PHE 10 10.211 -6.735 -8.814 78 HB3 PHE 10 3HB PHE 10 9.190 -7.721 -9.842 79 HD1 PHE 10 HD1 PHE 10 12.678 -7.530 -8.546 80 HD2 PHE 10 HD2 PHE 10 9.531 -10.017 -9.932 81 HE1 PHE 10 HE1 PHE 10 14.007 -9.564 -7.913 82 HE2 PHE 10 HE2 PHE 10 10.860 -12.052 -9.300 83 HZ PHE 10 HZ PHE 10 13.081 -11.800 -8.298 84 H ILE 11 HN ILE 11 9.398 -7.846 -12.773 85 HA ILE 11 HA ILE 11 11.413 -9.820 -13.348 86 HB ILE 11 HB ILE 11 8.687 -9.279 -14.525 87 HG12 ILE 11 2HG1 ILE 11 9.611 -11.390 -12.553 88 HG13 ILE 11 3HG1 ILE 11 8.691 -9.956 -12.143 89 HG21 ILE 11 1HG2 ILE 11 10.268 -10.393 -16.108 90 HG22 ILE 11 2HG2 ILE 11 10.435 -11.718 -14.930 91 HG23 ILE 11 3HG2 ILE 11 8.852 -11.375 -15.667 92 HD11 ILE 11 3HD1 ILE 11 7.797 -12.198 -14.013 93 HD12 ILE 11 1HD1 ILE 11 7.157 -11.848 -12.390 94 HD13 ILE 11 2HD1 ILE 11 6.875 -10.703 -13.723 95 H MET 12 HN MET 12 9.519 -7.688 -15.589 96 HA MET 12 HA MET 12 11.093 -7.772 -17.696 97 HB2 MET 12 2HB MET 12 9.469 -5.577 -16.406 98 HB3 MET 12 3HB MET 12 10.487 -5.102 -17.751 99 HG2 MET 12 2HG MET 12 8.570 -5.704 -18.927 100 HG3 MET 12 3HG MET 12 9.394 -7.251 -18.925 101 HE1 MET 12 3HE MET 12 6.876 -7.825 -19.580 102 HE2 MET 12 1HE MET 12 7.613 -9.197 -18.719 103 HE3 MET 12 2HE MET 12 5.951 -8.692 -18.330 104 H LYS 13 HN LYS 13 11.867 -6.140 -14.640 105 HA LYS 13 HA LYS 13 14.266 -4.997 -15.857 106 HB2 LYS 13 2HB LYS 13 13.128 -4.510 -13.091 107 HB3 LYS 13 3HB LYS 13 14.415 -3.619 -13.878 108 HG2 LYS 13 2HG LYS 13 12.629 -3.187 -15.777 109 HG3 LYS 13 3HG LYS 13 11.457 -3.649 -14.557 110 HD2 LYS 13 2HD LYS 13 11.544 -1.378 -14.110 111 HD3 LYS 13 3HD LYS 13 12.842 -1.900 -13.055 112 HE2 LYS 13 2HE LYS 13 14.301 -1.577 -15.310 113 HE3 LYS 13 3HE LYS 13 13.003 -0.466 -15.699 114 HZ1 LYS 13 2HZ LYS 13 13.601 0.159 -13.115 115 HZ3 LYS 13 1HZ LYS 13 14.150 0.973 -14.413 116 H CYS 14 HN CYS 14 13.397 -6.630 -12.724 117 HA CYS 14 HA CYS 14 16.062 -7.763 -12.708 118 HB2 CYS 14 2HB CYS 14 14.144 -8.386 -10.535 119 HB3 CYS 14 3HB CYS 14 15.854 -8.007 -10.463 120 H SER 15 HN SER 15 15.123 -8.943 -14.808 121 HA SER 15 HA SER 15 13.549 -11.238 -14.004 122 HB2 SER 15 2HB SER 15 13.811 -11.570 -16.675 123 HB3 SER 15 3HB SER 15 12.569 -10.559 -15.963 124 HG SER 15 HG SER 15 13.623 -9.357 -17.588 125 H GLN 16 HN GLN 16 14.279 -13.432 -14.498 126 HA GLN 16 HA GLN 16 15.841 -14.955 -14.189 127 HB2 GLN 16 2HB GLN 16 17.171 -15.370 -16.188 128 HB3 GLN 16 3HB GLN 16 15.605 -14.750 -16.671 129 HG2 GLN 16 2HG GLN 16 16.482 -12.586 -17.192 130 HG3 GLN 16 3HG GLN 16 17.947 -12.857 -16.268 131 HE21 GLN 16 1HE2 GLN 16 18.584 -11.973 -18.521 132 HE22 GLN 16 2HE2 GLN 16 19.068 -13.154 -19.692 133 H CYS 17 HN CYS 17 16.393 -12.584 -12.617 134 HA CYS 17 HA CYS 17 19.289 -12.885 -12.452 135 HB2 CYS 17 2HB CYS 17 17.778 -10.349 -12.852 136 HB3 CYS 17 3HB CYS 17 19.114 -10.320 -11.718 137 H HIS 18 HN HIS 18 16.263 -11.499 -10.981 138 HA HIS 18 HA HIS 18 17.270 -12.445 -8.396 139 HB2 HIS 18 2HB HIS 18 15.661 -9.999 -9.126 140 HB3 HIS 18 3HB HIS 18 15.648 -10.645 -7.498 141 HD1 HIS 18 HD1 HIS 18 18.421 -11.167 -6.710 142 HD2 HIS 18 HD2 HIS 18 17.486 -7.992 -9.286 143 HE1 HIS 18 HE1 HIS 18 20.370 -9.528 -6.561 144 H THR 19 HN THR 19 15.759 -13.491 -6.979 145 HA THR 19 HA THR 19 13.358 -14.445 -8.398 146 HB THR 19 HB THR 19 13.727 -16.434 -6.733 147 HG1 THR 19 HG1 THR 19 15.931 -16.435 -5.934 148 HG21 THR 19 1HG2 THR 19 14.671 -16.054 -9.318 149 HG22 THR 19 2HG2 THR 19 16.180 -16.345 -8.421 150 HG23 THR 19 3HG2 THR 19 14.878 -17.557 -8.386 151 H VAL 20 HN VAL 20 14.692 -12.944 -5.484 152 HA VAL 20 HA VAL 20 13.730 -12.182 -3.636 153 HB VAL 20 HB VAL 20 11.839 -10.769 -3.964 154 HG11 VAL 20 1HG1 VAL 20 12.499 -9.549 -6.061 155 HG12 VAL 20 2HG1 VAL 20 13.850 -9.915 -4.960 156 HG13 VAL 20 3HG1 VAL 20 13.606 -10.894 -6.427 157 HG21 VAL 20 3HG2 VAL 20 10.269 -10.908 -5.702 158 HG22 VAL 20 1HG2 VAL 20 11.313 -11.959 -6.689 159 HG23 VAL 20 2HG2 VAL 20 10.531 -12.603 -5.225 160 H GLU 21 HN GLU 21 13.357 -15.087 -4.326 161 HA GLU 21 HA GLU 21 10.855 -15.501 -2.889 162 HB2 GLU 21 2HB GLU 21 12.288 -17.073 -5.020 163 HB3 GLU 21 3HB GLU 21 11.338 -17.962 -3.847 164 HG2 GLU 21 2HG GLU 21 10.159 -15.551 -5.270 165 HG3 GLU 21 3HG GLU 21 10.174 -17.120 -6.049 166 HE2 GLU 21 HE2 GLU 21 7.083 -16.695 -4.273 167 H LYS 22 HN LYS 22 10.852 -16.725 -0.973 168 HA LYS 22 HA LYS 22 13.246 -16.794 0.467 169 HB2 LYS 22 2HB LYS 22 10.653 -18.264 1.025 170 HB3 LYS 22 3HB LYS 22 11.927 -17.930 2.181 171 HG2 LYS 22 2HG LYS 22 11.431 -15.646 2.293 172 HG3 LYS 22 3HG LYS 22 10.797 -15.588 0.661 173 HD2 LYS 22 2HD LYS 22 8.845 -15.403 1.973 174 HD3 LYS 22 3HD LYS 22 8.865 -17.105 1.563 175 HE2 LYS 22 2HE LYS 22 9.842 -15.867 4.180 176 HE3 LYS 22 3HE LYS 22 8.393 -16.831 3.966 177 HZ1 LYS 22 2HZ LYS 22 9.663 -18.758 3.632 178 HZ3 LYS 22 1HZ LYS 22 10.515 -18.002 4.794 179 H GLY 23 HN GLY 23 11.599 -19.146 -1.636 180 HA2 GLY 23 1HA GLY 23 13.608 -21.181 -0.918 181 HA3 GLY 23 2HA GLY 23 12.071 -21.466 -1.711 182 H GLY 24 HN GLY 24 13.083 -18.657 -3.136 183 HA2 GLY 24 1HA GLY 24 13.537 -19.649 -5.639 184 HA3 GLY 24 2HA GLY 24 14.141 -18.113 -5.049 185 H LYS 25 HN LYS 25 15.746 -19.174 -6.885 186 HA LYS 25 HA LYS 25 17.901 -20.407 -5.316 187 HB2 LYS 25 2HB LYS 25 18.426 -21.878 -7.024 188 HB3 LYS 25 3HB LYS 25 16.674 -21.882 -7.056 189 HG2 LYS 25 2HG LYS 25 16.741 -20.129 -8.879 190 HG3 LYS 25 3HG LYS 25 18.490 -20.239 -8.882 191 HD2 LYS 25 2HD LYS 25 17.902 -21.719 -10.616 192 HD3 LYS 25 3HD LYS 25 18.121 -22.810 -9.261 193 HE2 LYS 25 2HE LYS 25 15.396 -21.628 -9.955 194 HE3 LYS 25 3HE LYS 25 15.974 -23.116 -10.680 195 HZ1 LYS 25 2HZ LYS 25 15.770 -24.232 -8.704 196 HZ3 LYS 25 1HZ LYS 25 14.645 -23.096 -8.393 197 H HIS 26 HN HIS 26 20.119 -19.934 -6.279 198 HA HIS 26 HA HIS 26 20.153 -17.112 -6.927 199 HB2 HIS 26 2HB HIS 26 22.483 -18.944 -6.314 200 HB3 HIS 26 3HB HIS 26 22.490 -17.191 -6.336 201 HD1 HIS 26 HD1 HIS 26 22.791 -16.467 -3.964 202 HD2 HIS 26 HD2 HIS 26 20.024 -19.600 -4.318 203 HE1 HIS 26 HE1 HIS 26 21.848 -16.857 -1.625 204 H LYS 27 HN LYS 27 20.611 -16.301 -8.929 205 HA LYS 27 HA LYS 27 21.697 -18.204 -10.884 206 HB2 LYS 27 2HB LYS 27 19.369 -16.297 -11.190 207 HB3 LYS 27 3HB LYS 27 20.235 -16.952 -12.566 208 HG2 LYS 27 2HG LYS 27 19.823 -19.279 -11.283 209 HG3 LYS 27 3HG LYS 27 18.504 -18.386 -10.553 210 HD2 LYS 27 2HD LYS 27 18.942 -18.535 -13.570 211 HD3 LYS 27 3HD LYS 27 17.920 -19.660 -12.697 212 HE2 LYS 27 2HE LYS 27 16.727 -17.513 -11.755 213 HE3 LYS 27 3HE LYS 27 17.528 -16.668 -13.067 214 HZ1 LYS 27 2HZ LYS 27 15.744 -19.019 -13.422 215 HZ3 LYS 27 1HZ LYS 27 16.471 -18.210 -14.633 216 H THR 28 HN THR 28 20.799 -14.892 -11.700 217 HA THR 28 HA THR 28 23.508 -14.306 -12.384 218 HB THR 28 HB THR 28 21.222 -12.307 -12.245 219 HG1 THR 28 HG1 THR 28 20.483 -13.380 -14.218 220 HG21 THR 28 1HG2 THR 28 22.163 -11.807 -14.577 221 HG22 THR 28 2HG2 THR 28 23.280 -11.443 -13.239 222 HG23 THR 28 3HG2 THR 28 23.494 -12.927 -14.200 223 H GLY 29 HN GLY 29 21.439 -13.769 -9.571 224 HA2 GLY 29 1HA GLY 29 23.742 -12.524 -8.238 225 HA3 GLY 29 2HA GLY 29 22.205 -11.681 -8.233 226 HA PRO 30 HA PRO 30 22.223 -14.616 -4.733 227 HB2 PRO 30 2HB PRO 30 22.008 -12.815 -2.689 228 HB3 PRO 30 3HB PRO 30 23.538 -13.482 -3.220 229 HG2 PRO 30 2HG PRO 30 22.425 -10.786 -3.700 230 HG3 PRO 30 3HG PRO 30 24.085 -11.330 -3.844 231 HD2 PRO 30 2HD PRO 30 22.247 -10.844 -5.992 232 HD3 PRO 30 3HD PRO 30 23.867 -11.498 -6.126 233 H ASN 31 HN ASN 31 20.492 -15.438 -3.498 234 HA ASN 31 HA ASN 31 18.051 -14.726 -4.638 235 HB2 ASN 31 2HB ASN 31 18.451 -16.986 -3.737 236 HB3 ASN 31 3HB ASN 31 18.747 -16.344 -2.133 237 HD21 ASN 31 1HD2 ASN 31 16.464 -17.506 -4.339 238 HD22 ASN 31 2HD2 ASN 31 15.009 -17.192 -3.454 239 H LEU 32 HN LEU 32 16.521 -13.190 -3.945 240 HA LEU 32 HA LEU 32 17.266 -11.559 -1.674 241 HB2 LEU 32 2HB LEU 32 15.493 -11.307 -4.042 242 HB3 LEU 32 3HB LEU 32 15.023 -10.424 -2.602 243 HG LEU 32 HG LEU 32 17.086 -9.186 -2.586 244 HD11 LEU 32 1HD1 LEU 32 18.642 -9.571 -4.670 245 HD12 LEU 32 2HD1 LEU 32 18.819 -10.558 -3.199 246 HD13 LEU 32 3HD1 LEU 32 17.955 -11.213 -4.610 247 HD21 LEU 32 3HD2 LEU 32 16.786 -7.839 -4.498 248 HD22 LEU 32 1HD2 LEU 32 16.175 -9.203 -5.466 249 HD23 LEU 32 2HD2 LEU 32 15.186 -8.536 -4.144 250 H HIS 33 HN HIS 33 16.935 -13.265 -0.049 251 HA HIS 33 HA HIS 33 14.078 -13.692 0.446 252 HB2 HIS 33 2HB HIS 33 14.958 -15.814 0.068 253 HB3 HIS 33 3HB HIS 33 16.479 -15.447 0.855 254 HD1 HIS 33 HD1 HIS 33 13.313 -14.572 2.675 255 HD2 HIS 33 HD2 HIS 33 16.122 -17.687 2.577 256 HE1 HIS 33 HE1 HIS 33 12.863 -16.005 4.737 257 H GLY 34 HN GLY 34 17.307 -13.309 2.068 258 HA2 GLY 34 1HA GLY 34 15.916 -12.193 4.408 259 HA3 GLY 34 2HA GLY 34 17.548 -12.829 4.363 260 H LEU 35 HN LEU 35 16.470 -10.810 1.672 261 HA LEU 35 HA LEU 35 18.527 -9.080 1.701 262 HB2 LEU 35 2HB LEU 35 17.195 -8.990 -0.157 263 HB3 LEU 35 3HB LEU 35 15.703 -8.916 0.762 264 HG LEU 35 HG LEU 35 16.487 -6.547 1.465 265 HD11 LEU 35 1HD1 LEU 35 18.687 -6.343 0.811 266 HD12 LEU 35 2HD1 LEU 35 18.430 -7.211 -0.722 267 HD13 LEU 35 3HD1 LEU 35 17.839 -5.542 -0.534 268 HD21 LEU 35 3HD2 LEU 35 14.701 -7.378 -0.307 269 HD22 LEU 35 1HD2 LEU 35 15.127 -5.657 -0.138 270 HD23 LEU 35 2HD2 LEU 35 15.840 -6.626 -1.449 271 H PHE 36 HN PHE 36 15.290 -7.985 2.921 272 HA PHE 36 HA PHE 36 16.398 -5.882 4.381 273 HB2 PHE 36 2HB PHE 36 13.791 -7.471 4.313 274 HB3 PHE 36 3HB PHE 36 13.995 -6.245 5.548 275 HD1 PHE 36 HD1 PHE 36 13.886 -6.789 1.892 276 HD2 PHE 36 HD2 PHE 36 13.733 -3.948 5.040 277 HE1 PHE 36 HE1 PHE 36 13.141 -5.028 0.266 278 HE2 PHE 36 HE2 PHE 36 12.988 -2.186 3.415 279 HZ PHE 36 HZ PHE 36 12.701 -2.748 1.047 280 H GLY 37 HN GLY 37 17.758 -6.074 6.100 281 HA2 GLY 37 1HA GLY 37 18.070 -6.513 8.367 282 HA3 GLY 37 2HA GLY 37 16.941 -7.852 8.282 283 H ARG 38 HN ARG 38 19.657 -7.176 6.002 284 HA ARG 38 HA ARG 38 21.195 -9.259 7.223 285 HB2 ARG 38 2HB ARG 38 19.785 -10.572 5.698 286 HB3 ARG 38 3HB ARG 38 20.113 -9.474 4.372 287 HG2 ARG 38 2HG ARG 38 22.369 -10.203 4.153 288 HG3 ARG 38 3HG ARG 38 22.409 -10.883 5.767 289 HD2 ARG 38 2HD ARG 38 22.133 -12.850 4.567 290 HD3 ARG 38 3HD ARG 38 20.444 -12.441 4.788 291 HE ARG 38 HE ARG 38 21.481 -11.170 2.405 292 HH11 ARG 38 2HH2 ARG 38 20.390 -14.308 3.637 293 HH12 ARG 38 1HH2 ARG 38 19.931 -14.901 2.076 294 HH22 ARG 38 HH1 ARG 38 20.226 -13.499 0.155 295 H LYS 39 HN LYS 39 23.116 -8.132 7.437 296 HA LYS 39 HA LYS 39 23.890 -5.930 6.069 297 HB2 LYS 39 2HB LYS 39 24.915 -7.294 8.104 298 HB3 LYS 39 3HB LYS 39 25.985 -7.917 6.864 299 HG2 LYS 39 2HG LYS 39 26.968 -5.840 6.457 300 HG3 LYS 39 3HG LYS 39 25.524 -4.945 6.886 301 HD2 LYS 39 2HD LYS 39 26.875 -6.512 9.074 302 HD3 LYS 39 3HD LYS 39 27.681 -5.062 8.511 303 HE2 LYS 39 2HE LYS 39 24.726 -4.920 9.142 304 HE3 LYS 39 3HE LYS 39 25.867 -4.948 10.472 305 HZ1 LYS 39 2HZ LYS 39 26.499 -2.844 10.010 306 HZ3 LYS 39 1HZ LYS 39 25.186 -2.728 9.053 307 H THR 40 HN THR 40 25.854 -5.747 4.513 308 HA THR 40 HA THR 40 25.132 -7.208 2.147 309 HB THR 40 HB THR 40 27.071 -5.706 1.258 310 HG1 THR 40 HG1 THR 40 27.510 -4.011 2.960 311 HG21 THR 40 1HG2 THR 40 25.640 -3.543 2.231 312 HG22 THR 40 2HG2 THR 40 25.162 -4.489 0.801 313 HG23 THR 40 3HG2 THR 40 24.446 -4.853 2.390 314 H GLY 41 HN GLY 41 26.530 -8.519 0.851 315 HA2 GLY 41 1HA GLY 41 27.899 -10.284 0.598 316 HA3 GLY 41 2HA GLY 41 29.072 -9.349 1.504 317 H GLN 42 HN GLN 42 25.955 -11.079 2.263 318 HA GLN 42 HA GLN 42 27.370 -12.217 4.545 319 HB2 GLN 42 2HB GLN 42 24.418 -11.586 4.136 320 HB3 GLN 42 3HB GLN 42 25.002 -12.556 5.474 321 HG2 GLN 42 2HG GLN 42 25.817 -9.676 4.859 322 HG3 GLN 42 3HG GLN 42 24.760 -10.190 6.158 323 HE21 GLN 42 1HE2 GLN 42 27.996 -9.911 5.006 324 HE22 GLN 42 2HE2 GLN 42 28.834 -10.407 6.439 325 H ALA 43 HN ALA 43 25.065 -12.849 1.845 326 HA ALA 43 HA ALA 43 24.372 -15.404 2.199 327 HB1 ALA 43 3HB ALA 43 24.443 -15.598 -0.290 328 HB2 ALA 43 1HB ALA 43 23.721 -14.067 0.264 329 HB3 ALA 43 2HB ALA 43 25.391 -14.093 -0.352 330 HA PRO 44 HA PRO 44 28.406 -17.193 2.599 331 HB2 PRO 44 2HB PRO 44 27.643 -19.330 4.123 332 HB3 PRO 44 3HB PRO 44 28.125 -17.789 4.806 333 HG2 PRO 44 2HG PRO 44 25.411 -18.932 4.545 334 HG3 PRO 44 3HG PRO 44 25.959 -17.627 5.579 335 HD2 PRO 44 2HD PRO 44 24.470 -17.375 3.140 336 HD3 PRO 44 3HD PRO 44 25.117 -16.069 4.113 337 H GLY 45 HN GLY 45 25.661 -18.086 0.988 338 HA2 GLY 45 1HA GLY 45 26.796 -20.600 0.014 339 HA3 GLY 45 2HA GLY 45 25.189 -19.968 -0.287 340 H TYR 46 HN TYR 46 26.223 -17.201 -0.934 341 HA TYR 46 HA TYR 46 27.711 -17.742 -3.391 342 HB2 TYR 46 2HB TYR 46 25.198 -17.744 -3.812 343 HB3 TYR 46 3HB TYR 46 25.077 -16.181 -3.028 344 HD1 TYR 46 HD1 TYR 46 27.489 -17.489 -5.592 345 HD2 TYR 46 HD2 TYR 46 24.475 -14.609 -4.630 346 HE1 TYR 46 HE1 TYR 46 27.871 -16.333 -7.825 347 HE2 TYR 46 HE2 TYR 46 24.866 -13.463 -6.866 348 HH TYR 46 HH TYR 46 25.860 -13.581 -8.796 349 H SER 47 HN SER 47 29.528 -16.534 -3.097 350 HA SER 47 HA SER 47 29.406 -14.171 -1.531 351 HB2 SER 47 2HB SER 47 31.768 -14.128 -1.721 352 HB3 SER 47 3HB SER 47 31.372 -15.835 -1.732 353 HG SER 47 HG SER 47 32.198 -16.010 -3.697 354 H TYR 48 HN TYR 48 29.769 -11.982 -2.270 355 HA TYR 48 HA TYR 48 28.976 -11.611 -5.057 356 HB2 TYR 48 2HB TYR 48 29.346 -9.580 -2.783 357 HB3 TYR 48 3HB TYR 48 28.336 -9.387 -4.202 358 HD1 TYR 48 HD2 TYR 48 27.409 -12.495 -3.737 359 HD2 TYR 48 HD1 TYR 48 27.321 -8.868 -1.470 360 HE1 TYR 48 HE2 TYR 48 25.408 -13.355 -2.425 361 HE2 TYR 48 HE1 TYR 48 25.319 -9.740 -0.165 362 HH TYR 48 HH TYR 48 23.389 -11.947 -1.095 363 H THR 49 HN THR 49 29.926 -9.140 -5.682 364 HA THR 49 HA THR 49 32.503 -9.609 -6.529 365 HB THR 49 HB THR 49 32.435 -6.990 -6.747 366 HG1 THR 49 HG1 THR 49 30.043 -6.410 -6.380 367 HG21 THR 49 1HG2 THR 49 30.053 -8.594 -7.818 368 HG22 THR 49 2HG2 THR 49 30.658 -7.052 -8.471 369 HG23 THR 49 3HG2 THR 49 31.652 -8.524 -8.597 370 H ALA 50 HN ALA 50 34.394 -7.962 -5.978 371 HA ALA 50 HA ALA 50 34.966 -8.504 -3.184 372 HB1 ALA 50 3HB ALA 50 36.486 -7.993 -5.691 373 HB2 ALA 50 1HB ALA 50 37.217 -7.359 -4.197 374 HB3 ALA 50 2HB ALA 50 36.844 -9.094 -4.339 375 H ALA 51 HN ALA 51 33.744 -5.971 -5.188 376 HA ALA 51 HA ALA 51 34.767 -3.871 -3.466 377 HB1 ALA 51 3HB ALA 51 33.459 -4.102 -6.130 378 HB2 ALA 51 1HB ALA 51 33.051 -2.649 -5.186 379 HB3 ALA 51 2HB ALA 51 34.750 -3.007 -5.580 380 H ASN 52 HN ASN 52 31.870 -5.841 -4.039 381 HA ASN 52 HA ASN 52 30.183 -4.111 -2.566 382 HB2 ASN 52 2HB ASN 52 29.487 -5.832 -4.375 383 HB3 ASN 52 3HB ASN 52 29.744 -7.078 -3.170 384 HD21 ASN 52 1HD2 ASN 52 28.544 -6.974 -1.177 385 HD22 ASN 52 2HD2 ASN 52 26.951 -6.292 -1.143 386 H LYS 53 HN LYS 53 31.756 -7.355 -2.051 387 HA LYS 53 HA LYS 53 30.854 -7.980 0.418 388 HB2 LYS 53 2HB LYS 53 32.552 -9.137 -1.227 389 HB3 LYS 53 3HB LYS 53 33.762 -8.365 -0.223 390 HG2 LYS 53 2HG LYS 53 32.264 -9.371 1.769 391 HG3 LYS 53 3HG LYS 53 31.752 -10.490 0.521 392 HD2 LYS 53 2HD LYS 53 34.311 -10.798 0.032 393 HD3 LYS 53 3HD LYS 53 34.561 -10.034 1.588 394 HE2 LYS 53 2HE LYS 53 32.987 -11.781 2.602 395 HE3 LYS 53 3HE LYS 53 32.989 -12.595 1.050 396 HZ1 LYS 53 2HZ LYS 53 35.657 -12.054 1.814 397 HZ3 LYS 53 1HZ LYS 53 34.960 -13.506 1.575 398 H ASN 54 HN ASN 54 33.419 -5.607 -0.442 399 HA ASN 54 HA ASN 54 34.369 -5.133 2.063 400 HB2 ASN 54 2HB ASN 54 34.115 -3.527 -0.474 401 HB3 ASN 54 3HB ASN 54 34.511 -2.627 0.976 402 HD21 ASN 54 1HD2 ASN 54 35.345 -5.846 -0.312 403 HD22 ASN 54 2HD2 ASN 54 37.066 -5.696 -0.178 404 H LYS 55 HN LYS 55 31.561 -3.673 0.286 405 HA LYS 55 HA LYS 55 30.834 -1.710 2.027 406 HB2 LYS 55 2HB LYS 55 29.851 -2.570 -0.272 407 HB3 LYS 55 3HB LYS 55 28.716 -3.415 0.761 408 HG2 LYS 55 2HG LYS 55 27.588 -1.396 0.552 409 HG3 LYS 55 3HG LYS 55 28.543 -1.032 1.976 410 HD2 LYS 55 2HD LYS 55 30.355 -0.216 0.207 411 HD3 LYS 55 3HD LYS 55 28.985 -0.129 -0.881 412 HE2 LYS 55 2HE LYS 55 27.827 1.453 0.553 413 HE3 LYS 55 3HE LYS 55 28.957 1.190 1.868 414 HZ1 LYS 55 2HZ LYS 55 30.560 2.461 0.829 415 HZ3 LYS 55 1HZ LYS 55 29.245 3.214 0.230 416 H GLY 56 HN GLY 56 29.607 -1.541 3.926 417 HA2 GLY 56 1HA GLY 56 28.773 -4.061 5.191 418 HA3 GLY 56 2HA GLY 56 29.908 -3.020 6.029 419 H ILE 57 HN ILE 57 26.616 -3.147 4.567 420 HA ILE 57 HA ILE 57 25.716 -1.360 6.669 421 HB ILE 57 HB ILE 57 24.416 -0.040 4.954 422 HG12 ILE 57 2HG1 ILE 57 25.842 0.042 2.718 423 HG13 ILE 57 3HG1 ILE 57 26.193 -1.624 3.136 424 HG21 ILE 57 1HG2 ILE 57 26.314 1.477 4.488 425 HG22 ILE 57 2HG2 ILE 57 26.259 0.931 6.182 426 HG23 ILE 57 3HG2 ILE 57 27.434 0.214 5.054 427 HD11 ILE 57 3HD1 ILE 57 23.947 -2.295 2.960 428 HD12 ILE 57 1HD1 ILE 57 23.330 -0.652 3.251 429 HD13 ILE 57 2HD1 ILE 57 24.061 -1.062 1.681 430 H ILE 58 HN ILE 58 23.188 -1.233 6.547 431 HA ILE 58 HA ILE 58 22.289 -3.953 5.924 432 HB ILE 58 HB ILE 58 21.413 -1.926 7.969 433 HG12 ILE 58 2HG1 ILE 58 23.407 -3.559 8.287 434 HG13 ILE 58 3HG1 ILE 58 22.227 -3.378 9.569 435 HG21 ILE 58 1HG2 ILE 58 20.034 -4.548 7.334 436 HG22 ILE 58 2HG2 ILE 58 19.591 -3.372 8.595 437 HG23 ILE 58 3HG2 ILE 58 19.426 -2.938 6.877 438 HD11 ILE 58 3HD1 ILE 58 21.169 -5.452 9.068 439 HD12 ILE 58 1HD1 ILE 58 21.897 -5.526 7.446 440 HD13 ILE 58 2HD1 ILE 58 22.906 -5.793 8.887 441 H TRP 59 HN TRP 59 20.511 -4.302 4.597 442 HA TRP 59 HA TRP 59 19.858 -2.118 2.861 443 HB2 TRP 59 2HB TRP 59 19.007 -5.011 2.988 444 HB3 TRP 59 3HB TRP 59 18.371 -3.881 1.809 445 HD1 TRP 59 HD1 TRP 59 21.073 -6.338 2.110 446 HE1 TRP 59 HE1 TRP 59 22.975 -6.078 0.299 447 HE3 TRP 59 HE3 TRP 59 19.729 -1.669 0.611 448 HZ2 TRP 59 HZ2 TRP 59 23.688 -3.993 -1.516 449 HZ3 TRP 59 HZ3 TRP 59 21.081 -0.593 -1.186 450 HH2 TRP 59 HH2 TRP 59 22.999 -1.678 -2.241 451 H GLY 60 HN GLY 60 17.603 -1.384 2.489 452 HA2 GLY 60 1HA GLY 60 15.535 -2.054 4.332 453 HA3 GLY 60 2HA GLY 60 16.306 -0.543 4.770 454 H GLU 61 HN GLU 61 14.220 0.512 4.283 455 HA GLU 61 HA GLU 61 13.354 0.431 1.564 456 HB2 GLU 61 2HB GLU 61 12.396 1.717 4.114 457 HB3 GLU 61 3HB GLU 61 11.829 2.384 2.596 458 HG2 GLU 61 2HG GLU 61 11.242 -0.071 1.937 459 HG3 GLU 61 3HG GLU 61 11.471 -0.454 3.632 460 HE2 GLU 61 HE2 GLU 61 8.548 0.065 2.072 461 H ASP 62 HN ASP 62 15.153 2.628 3.753 462 HA ASP 62 HA ASP 62 15.126 4.773 1.925 463 HB2 ASP 62 2HB ASP 62 15.473 4.965 4.423 464 HB3 ASP 62 3HB ASP 62 17.035 4.194 4.240 465 HD2 ASP 62 HD2 ASP 62 17.496 7.808 4.341 466 H THR 63 HN THR 63 17.737 2.536 3.163 467 HA THR 63 HA THR 63 19.764 3.276 1.483 468 HB THR 63 HB THR 63 20.676 1.043 2.032 469 HG1 THR 63 HG1 THR 63 17.912 0.609 2.922 470 HG21 THR 63 1HG2 THR 63 19.012 1.316 4.472 471 HG22 THR 63 2HG2 THR 63 20.781 1.402 4.301 472 HG23 THR 63 3HG2 THR 63 19.786 2.842 3.980 473 H LEU 64 HN LEU 64 16.807 1.546 0.686 474 HA LEU 64 HA LEU 64 17.909 0.655 -1.838 475 HB2 LEU 64 2HB LEU 64 15.321 0.281 -0.374 476 HB3 LEU 64 3HB LEU 64 15.417 -0.061 -2.090 477 HG LEU 64 HG LEU 64 17.176 -1.339 0.022 478 HD11 LEU 64 1HD1 LEU 64 15.511 -3.274 -1.143 479 HD12 LEU 64 2HD1 LEU 64 15.449 -2.640 0.519 480 HD13 LEU 64 3HD1 LEU 64 14.451 -1.898 -0.755 481 HD21 LEU 64 3HD2 LEU 64 17.251 -1.313 -2.897 482 HD22 LEU 64 1HD2 LEU 64 18.473 -1.848 -1.718 483 HD23 LEU 64 2HD2 LEU 64 17.174 -2.957 -2.219 484 H MET 65 HN MET 65 15.703 3.145 -0.497 485 HA MET 65 HA MET 65 14.669 4.029 -2.884 486 HB2 MET 65 2HB MET 65 15.161 5.174 -0.133 487 HB3 MET 65 3HB MET 65 14.758 6.325 -1.392 488 HG2 MET 65 2HG MET 65 13.057 3.841 -1.166 489 HG3 MET 65 3HG MET 65 12.849 5.086 0.050 490 HE1 MET 65 3HE MET 65 10.484 4.325 -2.672 491 HE2 MET 65 1HE MET 65 11.388 4.855 -4.110 492 HE3 MET 65 2HE MET 65 12.099 3.655 -3.004 493 H GLU 66 HN GLU 66 17.920 4.161 -1.735 494 HA GLU 66 HA GLU 66 18.483 6.379 -3.538 495 HB2 GLU 66 2HB GLU 66 19.290 6.855 -1.318 496 HB3 GLU 66 3HB GLU 66 19.997 5.260 -1.150 497 HG2 GLU 66 2HG GLU 66 21.713 5.744 -2.798 498 HG3 GLU 66 3HG GLU 66 20.907 7.217 -3.302 499 HE2 GLU 66 HE2 GLU 66 23.232 6.242 -0.688 500 H TYR 67 HN TYR 67 19.389 3.020 -2.606 501 HA TYR 67 HA TYR 67 21.465 2.701 -4.448 502 HB2 TYR 67 2HB TYR 67 20.768 1.251 -2.443 503 HB3 TYR 67 3HB TYR 67 19.353 0.745 -3.344 504 HD1 TYR 67 HD2 TYR 67 22.878 1.125 -4.545 505 HD2 TYR 67 HD1 TYR 67 19.658 -1.555 -3.675 506 HE1 TYR 67 HE2 TYR 67 24.199 -0.801 -5.551 507 HE2 TYR 67 HE1 TYR 67 20.990 -3.471 -4.683 508 HH TYR 67 HH TYR 67 24.285 -2.936 -5.893 509 H LEU 68 HN LEU 68 17.966 1.729 -4.659 510 HA LEU 68 HA LEU 68 18.132 0.736 -7.248 511 HB2 LEU 68 2HB LEU 68 15.825 1.901 -5.689 512 HB3 LEU 68 3HB LEU 68 15.651 1.115 -7.246 513 HG LEU 68 HG LEU 68 16.439 -0.097 -4.602 514 HD11 LEU 68 1HD1 LEU 68 14.012 0.166 -5.509 515 HD12 LEU 68 2HD1 LEU 68 14.447 -1.202 -6.561 516 HD13 LEU 68 3HD1 LEU 68 14.525 -1.380 -4.791 517 HD21 LEU 68 3HD2 LEU 68 18.081 -1.077 -5.934 518 HD22 LEU 68 1HD2 LEU 68 16.745 -2.252 -5.984 519 HD23 LEU 68 2HD2 LEU 68 17.021 -1.157 -7.361 520 H GLU 69 HN GLU 69 18.014 4.033 -5.987 521 HA GLU 69 HA GLU 69 17.115 5.206 -8.370 522 HB2 GLU 69 2HB GLU 69 16.911 6.376 -6.239 523 HB3 GLU 69 3HB GLU 69 18.643 6.328 -5.986 524 HG2 GLU 69 2HG GLU 69 19.023 7.796 -7.927 525 HG3 GLU 69 3HG GLU 69 17.323 7.747 -8.345 526 HE2 GLU 69 HE2 GLU 69 16.356 8.750 -5.339 527 H ASN 70 HN ASN 70 20.278 4.170 -7.119 528 HA ASN 70 HA ASN 70 21.382 4.318 -9.684 529 HB2 ASN 70 2HB ASN 70 22.016 6.527 -7.713 530 HB3 ASN 70 3HB ASN 70 23.323 5.927 -8.713 531 HD21 ASN 70 1HD2 ASN 70 21.447 8.403 -8.529 532 HD22 ASN 70 2HD2 ASN 70 21.029 8.738 -10.176 533 HA PRO 71 HA PRO 71 23.302 1.521 -6.653 534 HB2 PRO 71 2HB PRO 71 23.140 -0.766 -8.140 535 HB3 PRO 71 3HB PRO 71 21.914 -0.286 -6.983 536 HG2 PRO 71 2HG PRO 71 21.827 -0.161 -9.936 537 HG3 PRO 71 3HG PRO 71 20.499 -0.096 -8.794 538 HD2 PRO 71 2HD PRO 71 21.648 2.112 -10.221 539 HD3 PRO 71 3HD PRO 71 20.398 2.192 -8.995 540 H LYS 72 HN LYS 72 24.130 2.900 -9.473 541 HA LYS 72 HA LYS 72 26.585 1.384 -9.776 542 HB2 LYS 72 2HB LYS 72 25.000 2.367 -11.647 543 HB3 LYS 72 3HB LYS 72 25.913 3.836 -11.368 544 HG2 LYS 72 2HG LYS 72 27.347 2.905 -12.909 545 HG3 LYS 72 3HG LYS 72 27.989 2.088 -11.499 546 HD2 LYS 72 2HD LYS 72 25.697 0.877 -13.089 547 HD3 LYS 72 3HD LYS 72 27.358 0.650 -13.598 548 HE2 LYS 72 2HE LYS 72 26.096 -0.217 -10.962 549 HE3 LYS 72 3HE LYS 72 26.777 -1.247 -12.207 550 HZ1 LYS 72 2HZ LYS 72 28.157 0.251 -10.148 551 HZ3 LYS 72 1HZ LYS 72 28.878 0.322 -11.607 552 H LYS 73 HN LYS 73 25.346 4.080 -8.015 553 HA LYS 73 HA LYS 73 28.035 5.208 -7.753 554 HB2 LYS 73 2HB LYS 73 25.273 6.306 -7.541 555 HB3 LYS 73 3HB LYS 73 26.475 6.975 -6.457 556 HG2 LYS 73 2HG LYS 73 26.403 8.255 -8.574 557 HG3 LYS 73 3HG LYS 73 27.965 7.487 -8.372 558 HD2 LYS 73 2HD LYS 73 27.443 5.754 -9.965 559 HD3 LYS 73 3HD LYS 73 25.733 6.143 -9.948 560 HE2 LYS 73 2HE LYS 73 26.420 8.483 -10.857 561 HE3 LYS 73 3HE LYS 73 28.001 7.785 -11.152 562 HZ1 LYS 73 2HZ LYS 73 25.468 7.174 -12.481 563 HZ3 LYS 73 1HZ LYS 73 26.522 5.943 -12.319 564 H TYR 74 HN TYR 74 25.518 3.344 -6.155 565 HA TYR 74 HA TYR 74 26.416 3.844 -3.503 566 HB2 TYR 74 2HB TYR 74 24.167 2.876 -4.643 567 HB3 TYR 74 3HB TYR 74 25.007 1.340 -4.558 568 HD1 TYR 74 HD1 TYR 74 26.102 0.868 -2.121 569 HD2 TYR 74 HD2 TYR 74 22.738 3.396 -2.893 570 HE1 TYR 74 HE1 TYR 74 25.327 0.582 0.283 571 HE2 TYR 74 HE2 TYR 74 21.974 3.103 -0.487 572 HH TYR 74 HH TYR 74 23.143 0.704 1.494 573 H ILE 75 HN ILE 75 26.864 1.136 -5.878 574 HA ILE 75 HA ILE 75 29.230 0.379 -4.319 575 HB ILE 75 HB ILE 75 27.418 -1.631 -5.631 576 HG12 ILE 75 2HG1 ILE 75 27.297 -0.656 -2.761 577 HG13 ILE 75 3HG1 ILE 75 26.066 -0.420 -3.987 578 HG21 ILE 75 1HG2 ILE 75 29.809 -2.197 -5.099 579 HG22 ILE 75 2HG2 ILE 75 29.411 -1.967 -3.380 580 HG23 ILE 75 3HG2 ILE 75 28.590 -3.235 -4.321 581 HD11 ILE 75 3HD1 ILE 75 26.343 -3.129 -4.160 582 HD12 ILE 75 1HD1 ILE 75 26.769 -2.883 -2.449 583 HD13 ILE 75 2HD1 ILE 75 25.190 -2.335 -3.061 584 HA PRO 76 HA PRO 76 30.458 1.140 -8.544 585 HB2 PRO 76 2HB PRO 76 32.825 2.376 -7.967 586 HB3 PRO 76 3HB PRO 76 31.321 3.245 -8.193 587 HG2 PRO 76 2HG PRO 76 32.757 2.650 -5.679 588 HG3 PRO 76 3HG PRO 76 31.514 3.850 -5.976 589 HD2 PRO 76 2HD PRO 76 31.186 1.333 -4.641 590 HD3 PRO 76 3HD PRO 76 29.923 2.480 -5.040 591 H GLY 77 HN GLY 77 30.789 -0.839 -9.393 592 HA2 GLY 77 1HA GLY 77 32.924 -2.000 -10.076 593 HA3 GLY 77 2HA GLY 77 33.186 -2.224 -8.358 594 H THR 78 HN THR 78 29.941 -2.324 -8.375 595 HA THR 78 HA THR 78 29.822 -5.138 -8.161 596 HB THR 78 HB THR 78 28.402 -3.413 -6.938 597 HG1 THR 78 HG1 THR 78 26.409 -4.786 -7.460 598 HG21 THR 78 1HG2 THR 78 27.656 -2.763 -9.704 599 HG22 THR 78 2HG2 THR 78 26.232 -3.262 -8.760 600 HG23 THR 78 3HG2 THR 78 27.237 -1.902 -8.203 601 H LYS 79 HN LYS 79 27.779 -6.229 -9.385 602 HA LYS 79 HA LYS 79 28.262 -5.718 -12.238 603 HB2 LYS 79 2HB LYS 79 27.716 -8.317 -12.313 604 HB3 LYS 79 3HB LYS 79 29.344 -7.710 -12.086 605 HG2 LYS 79 2HG LYS 79 29.342 -8.172 -9.762 606 HG3 LYS 79 3HG LYS 79 27.592 -8.173 -9.658 607 HD2 LYS 79 2HD LYS 79 27.395 -10.349 -10.509 608 HD3 LYS 79 3HD LYS 79 28.886 -10.245 -11.426 609 HE2 LYS 79 2HE LYS 79 30.143 -10.215 -9.186 610 HE3 LYS 79 3HE LYS 79 28.617 -10.574 -8.403 611 HZ1 LYS 79 2HZ LYS 79 30.176 -12.508 -9.185 612 HZ3 LYS 79 1HZ LYS 79 29.463 -12.291 -10.632 613 H MET 80 HN MET 80 26.210 -4.625 -10.345 614 HA MET 80 HA MET 80 23.831 -6.052 -10.835 615 HB2 MET 80 2HB MET 80 24.130 -4.536 -8.884 616 HB3 MET 80 3HB MET 80 24.397 -3.169 -9.947 617 HG2 MET 80 2HG MET 80 22.142 -2.831 -9.543 618 HG3 MET 80 3HG MET 80 21.983 -3.918 -10.909 619 HE1 MET 80 3HE MET 80 21.367 -4.033 -6.687 620 HE2 MET 80 1HE MET 80 20.901 -2.891 -7.971 621 HE3 MET 80 2HE MET 80 19.768 -4.163 -7.455 622 H ILE 81 HN ILE 81 24.154 -6.295 -13.247 623 HA ILE 81 HA ILE 81 24.056 -4.024 -14.908 624 HB ILE 81 HB ILE 81 23.735 -6.972 -15.246 625 HG12 ILE 81 2HG1 ILE 81 25.596 -4.892 -16.433 626 HG13 ILE 81 3HG1 ILE 81 25.978 -6.010 -15.138 627 HG21 ILE 81 1HG2 ILE 81 23.599 -6.157 -17.822 628 HG22 ILE 81 2HG2 ILE 81 22.188 -6.629 -16.845 629 HG23 ILE 81 3HG2 ILE 81 22.603 -4.908 -17.037 630 HD11 ILE 81 3HD1 ILE 81 26.652 -7.489 -16.716 631 HD12 ILE 81 1HD1 ILE 81 24.951 -7.639 -17.218 632 HD13 ILE 81 2HD1 ILE 81 26.015 -6.457 -18.019 633 H PHE 82 HN PHE 82 22.373 -2.712 -13.924 634 HA PHE 82 HA PHE 82 19.787 -3.423 -15.014 635 HB2 PHE 82 2HB PHE 82 19.556 -4.314 -12.773 636 HB3 PHE 82 3HB PHE 82 20.553 -3.051 -12.080 637 HD1 PHE 82 HD2 PHE 82 17.411 -3.165 -14.113 638 HD2 PHE 82 HD1 PHE 82 19.404 -1.626 -10.697 639 HE1 PHE 82 HE2 PHE 82 15.347 -1.880 -13.488 640 HE2 PHE 82 HE1 PHE 82 17.340 -0.341 -10.072 641 HZ PHE 82 HZ PHE 82 15.336 -0.484 -11.476 642 H VAL 83 HN VAL 83 18.456 -1.595 -15.435 643 HA VAL 83 HA VAL 83 19.939 0.865 -15.576 644 HB VAL 83 HB VAL 83 18.036 1.653 -16.847 645 HG11 VAL 83 1HG1 VAL 83 19.557 0.472 -18.193 646 HG12 VAL 83 2HG1 VAL 83 19.079 -1.102 -17.517 647 HG13 VAL 83 3HG1 VAL 83 17.975 -0.229 -18.606 648 HG21 VAL 83 3HG2 VAL 83 16.705 -0.780 -15.702 649 HG22 VAL 83 1HG2 VAL 83 16.082 0.876 -15.901 650 HG23 VAL 83 2HG2 VAL 83 16.214 -0.201 -17.312 651 H GLY 84 HN GLY 84 19.326 2.867 -14.584 652 HA2 GLY 84 1HA GLY 84 18.266 2.526 -11.932 653 HA3 GLY 84 2HA GLY 84 18.883 3.994 -12.663 654 H ILE 85 HN ILE 85 16.508 3.909 -11.058 655 HA ILE 85 HA ILE 85 14.415 4.268 -13.083 656 HB ILE 85 HB ILE 85 13.975 3.975 -10.125 657 HG12 ILE 85 2HG1 ILE 85 14.221 1.742 -12.161 658 HG13 ILE 85 3HG1 ILE 85 15.298 2.041 -10.812 659 HG21 ILE 85 1HG2 ILE 85 12.261 3.673 -12.594 660 HG22 ILE 85 2HG2 ILE 85 11.779 3.045 -11.000 661 HG23 ILE 85 3HG2 ILE 85 12.054 4.790 -11.223 662 HD11 ILE 85 3HD1 ILE 85 13.958 0.628 -9.635 663 HD12 ILE 85 1HD1 ILE 85 12.797 1.976 -9.577 664 HD13 ILE 85 2HD1 ILE 85 12.655 0.734 -10.844 665 H LYS 86 HN LYS 86 12.971 6.144 -12.827 666 HA LYS 86 HA LYS 86 14.408 8.367 -11.552 667 HB2 LYS 86 2HB LYS 86 13.046 9.717 -13.318 668 HB3 LYS 86 3HB LYS 86 14.523 8.900 -13.787 669 HG2 LYS 86 2HG LYS 86 13.210 6.964 -14.633 670 HG3 LYS 86 3HG LYS 86 11.721 7.724 -14.111 671 HD2 LYS 86 2HD LYS 86 11.713 8.433 -16.316 672 HD3 LYS 86 3HD LYS 86 12.629 9.755 -15.621 673 HE2 LYS 86 2HE LYS 86 14.703 8.916 -16.417 674 HE3 LYS 86 3HE LYS 86 14.092 7.282 -16.586 675 HZ1 LYS 86 2HZ LYS 86 13.980 9.426 -18.479 676 HZ3 LYS 86 1HZ LYS 86 12.508 8.760 -18.264 677 H LYS 87 HN LYS 87 11.245 6.796 -12.215 678 HA LYS 87 HA LYS 87 9.772 8.696 -10.709 679 HB2 LYS 87 2HB LYS 87 9.204 6.014 -11.945 680 HB3 LYS 87 3HB LYS 87 8.054 6.717 -10.824 681 HG2 LYS 87 2HG LYS 87 9.155 8.383 -13.109 682 HG3 LYS 87 3HG LYS 87 7.848 7.253 -13.401 683 HD2 LYS 87 2HD LYS 87 7.674 9.253 -11.120 684 HD3 LYS 87 3HD LYS 87 7.261 9.732 -12.754 685 HE2 LYS 87 2HE LYS 87 6.042 7.206 -11.607 686 HE3 LYS 87 3HE LYS 87 5.392 8.762 -11.127 687 HZ1 LYS 87 2HZ LYS 87 4.259 8.723 -13.053 688 HZ3 LYS 87 1HZ LYS 87 5.047 7.407 -13.601 689 H LYS 88 HN LYS 88 8.832 8.449 -8.603 690 HA LYS 88 HA LYS 88 10.551 6.887 -6.861 691 HB2 LYS 88 2HB LYS 88 8.385 8.840 -6.058 692 HB3 LYS 88 3HB LYS 88 9.726 8.258 -5.093 693 HG2 LYS 88 2HG LYS 88 10.186 9.777 -7.690 694 HG3 LYS 88 3HG LYS 88 9.944 10.619 -6.173 695 HD2 LYS 88 2HD LYS 88 11.868 9.361 -5.173 696 HD3 LYS 88 3HD LYS 88 12.115 8.533 -6.698 697 HE2 LYS 88 2HE LYS 88 12.139 11.574 -6.509 698 HE3 LYS 88 3HE LYS 88 13.584 10.624 -6.224 699 HZ1 LYS 88 2HZ LYS 88 12.774 11.429 -8.663 700 HZ3 LYS 88 1HZ LYS 88 12.174 9.915 -8.650 701 H GLU 89 HN GLU 89 7.083 7.253 -7.790 702 HA GLU 89 HA GLU 89 6.053 5.465 -5.998 703 HB2 GLU 89 2HB GLU 89 5.181 6.128 -8.842 704 HB3 GLU 89 3HB GLU 89 4.209 5.178 -7.736 705 HG2 GLU 89 2HG GLU 89 3.977 7.019 -6.190 706 HG3 GLU 89 3HG GLU 89 5.248 7.936 -6.972 707 HE2 GLU 89 HE2 GLU 89 1.599 8.299 -7.637 708 H GLU 90 HN GLU 90 7.435 4.897 -9.292 709 HA GLU 90 HA GLU 90 6.815 2.236 -9.473 710 HB2 GLU 90 2HB GLU 90 8.881 4.044 -10.679 711 HB3 GLU 90 3HB GLU 90 9.149 2.321 -10.855 712 HG2 GLU 90 2HG GLU 90 7.864 3.047 -12.777 713 HG3 GLU 90 3HG GLU 90 6.793 2.097 -11.766 714 HE2 GLU 90 HE2 GLU 90 5.799 4.786 -13.420 715 H ARG 91 HN ARG 91 9.315 3.906 -7.593 716 HA ARG 91 HA ARG 91 10.754 1.492 -7.121 717 HB2 ARG 91 2HB ARG 91 11.006 4.387 -6.344 718 HB3 ARG 91 3HB ARG 91 11.749 3.229 -5.258 719 HG2 ARG 91 2HG ARG 91 12.679 2.213 -7.587 720 HG3 ARG 91 3HG ARG 91 12.437 3.865 -8.120 721 HD2 ARG 91 2HD ARG 91 14.068 3.046 -5.666 722 HD3 ARG 91 3HD ARG 91 14.748 3.479 -7.221 723 HE ARG 91 HE ARG 91 13.522 5.320 -5.264 724 HH11 ARG 91 2HH2 ARG 91 14.726 4.898 -8.570 725 HH12 ARG 91 1HH2 ARG 91 14.927 6.597 -8.846 726 HH22 ARG 91 HH1 ARG 91 14.369 8.143 -7.101 727 H ALA 92 HN ALA 92 8.184 3.425 -5.616 728 HA ALA 92 HA ALA 92 8.411 2.397 -3.008 729 HB1 ALA 92 3HB ALA 92 6.343 3.845 -4.641 730 HB2 ALA 92 1HB ALA 92 5.855 3.117 -3.092 731 HB3 ALA 92 2HB ALA 92 7.149 4.337 -3.133 732 H ASP 93 HN ASP 93 6.246 1.518 -5.794 733 HA ASP 93 HA ASP 93 4.999 -0.560 -4.518 734 HB2 ASP 93 2HB ASP 93 5.711 -0.210 -7.468 735 HB3 ASP 93 3HB ASP 93 4.590 -1.422 -6.880 736 HD2 ASP 93 HD2 ASP 93 1.993 0.776 -7.110 737 H LEU 94 HN LEU 94 7.804 -0.596 -6.854 738 HA LEU 94 HA LEU 94 8.339 -3.278 -6.805 739 HB2 LEU 94 2HB LEU 94 9.345 -1.752 -8.366 740 HB3 LEU 94 3HB LEU 94 10.192 -0.912 -7.082 741 HG LEU 94 HG LEU 94 11.519 -2.543 -8.546 742 HD11 LEU 94 1HD1 LEU 94 13.057 -2.931 -6.847 743 HD12 LEU 94 2HD1 LEU 94 12.135 -1.529 -6.252 744 HD13 LEU 94 3HD1 LEU 94 11.794 -3.155 -5.613 745 HD21 LEU 94 3HD2 LEU 94 10.115 -4.436 -8.661 746 HD22 LEU 94 1HD2 LEU 94 11.491 -4.913 -7.636 747 HD23 LEU 94 2HD2 LEU 94 9.927 -4.505 -6.892 748 H ILE 95 HN ILE 95 8.881 -0.825 -4.319 749 HA ILE 95 HA ILE 95 10.632 -2.584 -2.830 750 HB ILE 95 HB ILE 95 9.623 0.222 -2.493 751 HG12 ILE 95 2HG1 ILE 95 12.461 -0.820 -2.484 752 HG13 ILE 95 3HG1 ILE 95 11.615 -0.428 -3.967 753 HG21 ILE 95 1HG2 ILE 95 9.451 -0.496 -0.275 754 HG22 ILE 95 2HG2 ILE 95 10.882 -1.546 -0.401 755 HG23 ILE 95 3HG2 ILE 95 11.075 0.223 -0.376 756 HD11 ILE 95 3HD1 ILE 95 12.491 1.662 -3.589 757 HD12 ILE 95 1HD1 ILE 95 11.075 1.833 -2.523 758 HD13 ILE 95 2HD1 ILE 95 12.656 1.385 -1.839 759 H ALA 96 HN ALA 96 7.226 -1.651 -3.048 760 HA ALA 96 HA ALA 96 6.498 -2.549 -0.467 761 HB1 ALA 96 3HB ALA 96 5.318 -1.159 -2.571 762 HB2 ALA 96 1HB ALA 96 4.431 -2.703 -2.547 763 HB3 ALA 96 2HB ALA 96 4.501 -1.694 -1.082 764 H TYR 97 HN TYR 97 7.158 -4.106 -3.569 765 HA TYR 97 HA TYR 97 5.918 -6.582 -2.656 766 HB2 TYR 97 2HB TYR 97 5.497 -6.085 -4.972 767 HB3 TYR 97 3HB TYR 97 7.067 -5.336 -5.187 768 HD1 TYR 97 HD2 TYR 97 6.247 -8.730 -3.835 769 HD2 TYR 97 HD1 TYR 97 8.023 -6.467 -7.001 770 HE1 TYR 97 HE2 TYR 97 7.130 -10.873 -4.881 771 HE2 TYR 97 HE1 TYR 97 8.901 -8.617 -8.037 772 HH TYR 97 HH TYR 97 8.207 -11.760 -6.523 773 H LEU 98 HN LEU 98 9.075 -5.018 -3.113 774 HA LEU 98 HA LEU 98 10.550 -7.452 -3.012 775 HB2 LEU 98 2HB LEU 98 11.137 -4.537 -3.057 776 HB3 LEU 98 3HB LEU 98 12.375 -5.596 -2.412 777 HG LEU 98 HG LEU 98 11.182 -5.629 -5.192 778 HD11 LEU 98 1HD1 LEU 98 13.115 -4.034 -4.353 779 HD12 LEU 98 2HD1 LEU 98 14.110 -5.489 -4.603 780 HD13 LEU 98 3HD1 LEU 98 13.176 -4.806 -5.956 781 HD21 LEU 98 3HD2 LEU 98 11.433 -7.865 -5.076 782 HD22 LEU 98 1HD2 LEU 98 13.148 -7.477 -5.343 783 HD23 LEU 98 2HD2 LEU 98 12.551 -7.783 -3.695 784 H LYS 99 HN LYS 99 9.547 -4.913 -0.662 785 HA LYS 99 HA LYS 99 10.992 -6.106 1.478 786 HB2 LYS 99 2HB LYS 99 10.447 -3.688 1.329 787 HB3 LYS 99 3HB LYS 99 8.749 -4.067 1.529 788 HG2 LYS 99 2HG LYS 99 9.245 -5.138 3.735 789 HG3 LYS 99 3HG LYS 99 10.945 -4.764 3.535 790 HD2 LYS 99 2HD LYS 99 10.539 -2.382 3.639 791 HD3 LYS 99 3HD LYS 99 8.809 -2.594 3.453 792 HE2 LYS 99 2HE LYS 99 8.698 -3.744 5.664 793 HE3 LYS 99 3HE LYS 99 10.432 -3.582 5.848 794 HZ1 LYS 99 2HZ LYS 99 9.397 -1.771 6.996 795 HZ3 LYS 99 1HZ LYS 99 8.470 -1.360 5.721 796 H LYS 100 HN LYS 100 8.074 -6.855 -0.204 797 HA LYS 100 HA LYS 100 7.052 -8.320 2.116 798 HB2 LYS 100 2HB LYS 100 5.588 -6.673 0.840 799 HB3 LYS 100 3HB LYS 100 5.632 -7.794 -0.505 800 HG2 LYS 100 2HG LYS 100 4.832 -9.609 1.154 801 HG3 LYS 100 3HG LYS 100 4.538 -8.312 2.293 802 HD2 LYS 100 2HD LYS 100 3.366 -8.266 -0.519 803 HD3 LYS 100 3HD LYS 100 2.548 -9.069 0.806 804 HE2 LYS 100 2HE LYS 100 2.616 -6.904 2.113 805 HE3 LYS 100 3HE LYS 100 3.344 -6.119 0.726 806 HZ1 LYS 100 2HZ LYS 100 1.218 -7.194 -0.440 807 HZ3 LYS 100 1HZ LYS 100 1.151 -5.728 0.265 808 H ALA 101 HN ALA 101 8.889 -8.635 -0.784 809 HA ALA 101 HA ALA 101 8.086 -11.348 -1.312 810 HB1 ALA 101 3HB ALA 101 10.244 -9.503 -2.397 811 HB2 ALA 101 1HB ALA 101 10.021 -11.179 -2.953 812 HB3 ALA 101 2HB ALA 101 8.721 -9.983 -3.183 813 H THR 102 HN THR 102 10.775 -9.576 0.294 814 HA THR 102 HA THR 102 12.037 -12.120 0.968 815 HB THR 102 HB THR 102 13.946 -10.753 1.485 816 HG1 THR 102 HG1 THR 102 13.499 -8.810 2.455 817 HG21 THR 102 1HG2 THR 102 13.031 -8.698 -0.398 818 HG22 THR 102 2HG2 THR 102 14.314 -9.913 -0.611 819 HG23 THR 102 3HG2 THR 102 12.626 -10.326 -0.993 820 H ASN 103 HN ASN 103 9.339 -11.135 2.043 821 HA ASN 103 HA ASN 103 10.145 -11.366 4.835 822 HB2 ASN 103 2HB ASN 103 9.290 -9.114 4.592 823 HB3 ASN 103 3HB ASN 103 7.973 -9.641 3.562 824 HD21 ASN 103 1HD2 ASN 103 6.096 -10.298 4.408 825 HD22 ASN 103 2HD2 ASN 103 5.727 -10.384 6.099 826 H GLU 104 HN GLU 104 7.444 -11.690 2.412 827 HA GLU 104 HA GLU 104 5.653 -13.111 3.728 828 HB2 GLU 104 2HB GLU 104 6.667 -13.349 0.890 829 HB3 GLU 104 3HB GLU 104 5.411 -14.439 1.444 830 HG2 GLU 104 2HG GLU 104 5.115 -11.466 1.948 831 HG3 GLU 104 3HG GLU 104 4.773 -12.100 0.351 832 HE2 GLU 104 HE2 GLU 104 2.564 -14.123 2.928 833 HHA HEC 500 HHA HEC 500 23.329 -7.124 -5.008 834 HHB HEC 500 HHB HEC 500 17.343 -4.891 -5.349 835 HHC HEC 500 HHC HEC 500 17.714 -5.663 -11.740 836 HHD HEC 500 HHD HEC 500 22.883 -9.349 -10.941 837 HMA1 HEC 500 1HMA HEC 500 17.996 -5.044 -3.125 838 HMA2 HEC 500 2HMA HEC 500 19.452 -5.159 -2.130 839 HMA3 HEC 500 3HMA HEC 500 19.205 -3.734 -3.157 840 HAA1 HEC 500 1HAA HEC 500 22.953 -5.730 -3.150 841 HAA2 HEC 500 2HAA HEC 500 21.565 -5.513 -2.209 842 HBA1 HEC 500 1HBA HEC 500 22.430 -8.216 -3.309 843 HBA2 HEC 500 2HBA HEC 500 22.762 -7.632 -1.667 844 HMB1 HEC 500 1HMB HEC 500 14.341 -4.909 -7.653 845 HMB2 HEC 500 2HMB HEC 500 15.254 -4.968 -6.161 846 HMB3 HEC 500 3HMB HEC 500 15.220 -3.453 -7.089 847 HAB HEC 500 HAB HEC 500 16.113 -4.288 -11.261 848 HBB1 HEC 500 1HBB HEC 500 14.171 -2.954 -10.835 849 HBB2 HEC 500 2HBB HEC 500 14.269 -3.426 -9.119 850 HBB3 HEC 500 3HBB HEC 500 15.521 -2.425 -9.826 851 HMC1 HEC 500 1HMC HEC 500 18.069 -8.259 -13.707 852 HMC2 HEC 500 2HMC HEC 500 18.184 -6.493 -13.700 853 HMC3 HEC 500 3HMC HEC 500 19.393 -7.432 -14.553 854 HAC HEC 500 HAC HEC 500 21.901 -10.066 -12.658 855 HBC1 HEC 500 1HBC HEC 500 20.943 -8.555 -15.090 856 HBC2 HEC 500 2HBC HEC 500 22.465 -8.226 -14.231 857 HBC3 HEC 500 3HBC HEC 500 22.221 -9.795 -14.995 858 HMD1 HEC 500 1HMD HEC 500 24.594 -10.916 -9.085 859 HMD2 HEC 500 2HMD HEC 500 25.071 -9.598 -10.167 860 HMD3 HEC 500 3HMD HEC 500 25.879 -9.831 -8.591 861 HAD1 HEC 500 1HAD HEC 500 25.066 -8.169 -5.298 862 HAD2 HEC 500 2HAD HEC 500 25.493 -9.577 -6.174 863 HBD1 HEC 500 1HBD HEC 500 26.516 -8.001 -7.957 864 HBD2 HEC 500 2HBD HEC 500 26.220 -6.694 -6.790 Start of MODEL 8 1 H1 GLY 1 HN GLY 1 0.166 -1.050 -0.471 2 HA2 GLY 1 1HA GLY 1 2.025 0.450 -1.954 3 HA3 GLY 1 2HA GLY 1 2.898 -0.507 -0.774 4 H ASP 2 HN ASP 2 0.648 -0.628 -3.557 5 HA ASP 2 HA ASP 2 0.059 -3.189 -3.791 6 HB2 ASP 2 2HB ASP 2 1.090 -1.270 -5.920 7 HB3 ASP 2 3HB ASP 2 0.476 -2.857 -6.339 8 HD2 ASP 2 HD2 ASP 2 -2.240 -1.384 -7.084 9 H VAL 3 HN VAL 3 1.096 -5.073 -4.925 10 HA VAL 3 HA VAL 3 4.026 -4.935 -4.746 11 HB VAL 3 HB VAL 3 3.559 -7.549 -4.610 12 HG11 VAL 3 1HG1 VAL 3 4.423 -5.606 -2.880 13 HG12 VAL 3 2HG1 VAL 3 3.028 -6.277 -2.001 14 HG13 VAL 3 3HG1 VAL 3 4.356 -7.346 -2.510 15 HG21 VAL 3 3HG2 VAL 3 1.567 -8.012 -3.226 16 HG22 VAL 3 1HG2 VAL 3 1.054 -6.318 -3.413 17 HG23 VAL 3 2HG2 VAL 3 1.134 -7.386 -4.834 18 H GLU 4 HN GLU 4 1.231 -6.413 -6.520 19 HA GLU 4 HA GLU 4 2.441 -7.690 -8.481 20 HB2 GLU 4 2HB GLU 4 0.152 -5.730 -8.952 21 HB3 GLU 4 3HB GLU 4 0.524 -7.139 -9.927 22 HG2 GLU 4 2HG GLU 4 0.288 -8.463 -7.643 23 HG3 GLU 4 3HG GLU 4 -0.571 -7.035 -7.099 24 HE2 GLU 4 HE2 GLU 4 -2.481 -7.792 -10.313 25 H LYS 5 HN LYS 5 1.821 -4.107 -8.530 26 HA LYS 5 HA LYS 5 2.936 -3.512 -10.936 27 HB2 LYS 5 2HB LYS 5 2.746 -2.015 -8.333 28 HB3 LYS 5 3HB LYS 5 3.583 -1.300 -9.696 29 HG2 LYS 5 2HG LYS 5 0.775 -2.453 -9.961 30 HG3 LYS 5 3HG LYS 5 1.050 -0.795 -9.465 31 HD2 LYS 5 2HD LYS 5 2.526 -0.581 -11.603 32 HD3 LYS 5 3HD LYS 5 1.808 -2.097 -12.110 33 HE2 LYS 5 2HE LYS 5 0.336 -0.550 -13.082 34 HE3 LYS 5 3HE LYS 5 -0.492 -0.905 -11.578 35 HZ1 LYS 5 2HZ LYS 5 -0.017 1.162 -10.758 36 HZ3 LYS 5 1HZ LYS 5 0.086 1.574 -12.331 37 H GLY 6 HN GLY 6 4.620 -3.962 -7.768 38 HA2 GLY 6 1HA GLY 6 7.210 -3.443 -8.868 39 HA3 GLY 6 2HA GLY 6 6.827 -4.090 -7.286 40 H LYS 7 HN LYS 7 5.048 -6.234 -8.661 41 HA LYS 7 HA LYS 7 7.102 -8.191 -8.820 42 HB2 LYS 7 2HB LYS 7 4.920 -8.678 -7.839 43 HB3 LYS 7 3HB LYS 7 4.121 -8.335 -9.360 44 HG2 LYS 7 2HG LYS 7 4.372 -10.542 -9.847 45 HG3 LYS 7 3HG LYS 7 6.069 -10.195 -10.111 46 HD2 LYS 7 2HD LYS 7 6.319 -11.836 -8.503 47 HD3 LYS 7 3HD LYS 7 6.169 -10.459 -7.428 48 HE2 LYS 7 2HE LYS 7 4.641 -12.121 -6.592 49 HE3 LYS 7 3HE LYS 7 3.648 -10.897 -7.358 50 HZ1 LYS 7 2HZ LYS 7 4.040 -13.640 -8.144 51 HZ3 LYS 7 1HZ LYS 7 4.167 -12.611 -9.400 52 H LYS 8 HN LYS 8 5.134 -6.316 -11.147 53 HA LYS 8 HA LYS 8 6.094 -7.857 -13.372 54 HB2 LYS 8 2HB LYS 8 4.382 -5.379 -13.103 55 HB3 LYS 8 3HB LYS 8 4.895 -5.999 -14.659 56 HG2 LYS 8 2HG LYS 8 3.445 -7.701 -12.581 57 HG3 LYS 8 3HG LYS 8 2.614 -6.826 -13.851 58 HD2 LYS 8 2HD LYS 8 4.273 -8.073 -15.478 59 HD3 LYS 8 3HD LYS 8 4.549 -9.150 -14.123 60 HE2 LYS 8 2HE LYS 8 1.989 -8.679 -15.673 61 HE3 LYS 8 3HE LYS 8 2.776 -10.199 -15.296 62 HZ1 LYS 8 2HZ LYS 8 2.117 -9.956 -12.995 63 HZ3 LYS 8 1HZ LYS 8 0.783 -9.751 -13.907 64 H ILE 9 HN ILE 9 6.798 -4.717 -11.772 65 HA ILE 9 HA ILE 9 8.631 -3.876 -13.756 66 HB ILE 9 HB ILE 9 7.855 -3.018 -11.006 67 HG12 ILE 9 2HG1 ILE 9 8.039 -1.488 -13.615 68 HG13 ILE 9 3HG1 ILE 9 6.610 -2.357 -13.094 69 HG21 ILE 9 1HG2 ILE 9 9.652 -1.096 -11.629 70 HG22 ILE 9 2HG2 ILE 9 9.995 -2.474 -10.556 71 HG23 ILE 9 3HG2 ILE 9 10.488 -2.533 -12.266 72 HD11 ILE 9 3HD1 ILE 9 5.995 -0.558 -11.871 73 HD12 ILE 9 1HD1 ILE 9 7.443 -0.780 -10.859 74 HD13 ILE 9 2HD1 ILE 9 7.512 0.271 -12.293 75 H PHE 10 HN PHE 10 8.790 -5.973 -10.897 76 HA PHE 10 HA PHE 10 11.602 -5.894 -10.648 77 HB2 PHE 10 2HB PHE 10 10.274 -6.651 -8.777 78 HB3 PHE 10 3HB PHE 10 9.267 -7.664 -9.793 79 HD1 PHE 10 HD1 PHE 10 12.799 -7.372 -8.626 80 HD2 PHE 10 HD2 PHE 10 9.648 -9.946 -9.830 81 HE1 PHE 10 HE1 PHE 10 14.200 -9.367 -8.028 82 HE2 PHE 10 HE2 PHE 10 11.049 -11.942 -9.232 83 HZ PHE 10 HZ PHE 10 13.309 -11.628 -8.338 84 H ILE 11 HN ILE 11 9.457 -7.369 -12.943 85 HA ILE 11 HA ILE 11 11.257 -9.547 -13.540 86 HB ILE 11 HB ILE 11 8.593 -8.620 -14.562 87 HG12 ILE 11 2HG1 ILE 11 9.446 -11.319 -13.490 88 HG13 ILE 11 3HG1 ILE 11 8.881 -10.021 -12.456 89 HG21 ILE 11 1HG2 ILE 11 9.887 -9.228 -16.547 90 HG22 ILE 11 2HG2 ILE 11 10.306 -10.791 -15.805 91 HG23 ILE 11 3HG2 ILE 11 8.612 -10.424 -16.213 92 HD11 ILE 11 3HD1 ILE 11 7.355 -11.736 -14.347 93 HD12 ILE 11 1HD1 ILE 11 6.818 -10.931 -12.854 94 HD13 ILE 11 2HD1 ILE 11 6.912 -10.013 -14.376 95 H MET 12 HN MET 12 9.937 -6.664 -15.323 96 HA MET 12 HA MET 12 11.741 -6.933 -17.417 97 HB2 MET 12 2HB MET 12 9.873 -4.819 -16.342 98 HB3 MET 12 3HB MET 12 11.085 -4.274 -17.484 99 HG2 MET 12 2HG MET 12 10.272 -6.363 -18.920 100 HG3 MET 12 3HG MET 12 8.839 -6.261 -17.917 101 HE1 MET 12 3HE MET 12 10.456 -4.411 -21.244 102 HE2 MET 12 1HE MET 12 9.710 -5.990 -20.894 103 HE3 MET 12 2HE MET 12 8.743 -4.692 -21.636 104 H LYS 13 HN LYS 13 12.255 -5.983 -14.171 105 HA LYS 13 HA LYS 13 14.653 -4.475 -14.949 106 HB2 LYS 13 2HB LYS 13 13.037 -4.330 -12.386 107 HB3 LYS 13 3HB LYS 13 14.524 -3.456 -12.696 108 HG2 LYS 13 2HG LYS 13 13.370 -2.474 -14.783 109 HG3 LYS 13 3HG LYS 13 11.877 -3.165 -14.181 110 HD2 LYS 13 2HD LYS 13 12.454 -1.912 -11.941 111 HD3 LYS 13 3HD LYS 13 13.586 -0.994 -12.915 112 HE2 LYS 13 2HE LYS 13 10.713 -1.301 -13.844 113 HE3 LYS 13 3HE LYS 13 11.103 -0.119 -12.610 114 HZ1 LYS 13 2HZ LYS 13 11.602 1.177 -14.383 115 HZ3 LYS 13 1HZ LYS 13 11.755 -0.067 -15.423 116 H CYS 14 HN CYS 14 13.263 -7.176 -13.084 117 HA CYS 14 HA CYS 14 15.996 -8.134 -12.719 118 HB2 CYS 14 2HB CYS 14 14.057 -8.779 -10.569 119 HB3 CYS 14 3HB CYS 14 15.795 -8.566 -10.499 120 H SER 15 HN SER 15 15.401 -9.332 -14.732 121 HA SER 15 HA SER 15 13.509 -11.473 -14.143 122 HB2 SER 15 2HB SER 15 13.672 -11.616 -16.829 123 HB3 SER 15 3HB SER 15 12.529 -10.565 -16.016 124 HG SER 15 HG SER 15 15.180 -9.667 -16.728 125 H GLN 16 HN GLN 16 14.123 -13.656 -14.773 126 HA GLN 16 HA GLN 16 15.617 -15.267 -14.618 127 HB2 GLN 16 2HB GLN 16 16.993 -14.018 -17.011 128 HB3 GLN 16 3HB GLN 16 16.674 -15.713 -16.695 129 HG2 GLN 16 2HG GLN 16 14.123 -14.946 -16.751 130 HG3 GLN 16 3HG GLN 16 14.755 -13.567 -17.629 131 HE21 GLN 16 1HE2 GLN 16 14.196 -13.891 -19.657 132 HE22 GLN 16 2HE2 GLN 16 14.540 -15.292 -20.616 133 H CYS 17 HN CYS 17 16.341 -13.128 -12.869 134 HA CYS 17 HA CYS 17 19.234 -13.494 -12.906 135 HB2 CYS 17 2HB CYS 17 17.755 -10.909 -12.918 136 HB3 CYS 17 3HB CYS 17 19.150 -11.033 -11.864 137 H HIS 18 HN HIS 18 16.725 -11.734 -10.934 138 HA HIS 18 HA HIS 18 17.769 -13.068 -8.583 139 HB2 HIS 18 2HB HIS 18 15.926 -10.719 -9.029 140 HB3 HIS 18 3HB HIS 18 16.102 -11.460 -7.450 141 HD1 HIS 18 HD1 HIS 18 18.785 -11.614 -6.627 142 HD2 HIS 18 HD2 HIS 18 17.747 -8.740 -9.502 143 HE1 HIS 18 HE1 HIS 18 20.654 -9.877 -6.608 144 H THR 19 HN THR 19 16.203 -14.001 -6.971 145 HA THR 19 HA THR 19 13.979 -15.300 -8.405 146 HB THR 19 HB THR 19 14.426 -17.101 -6.567 147 HG1 THR 19 HG1 THR 19 15.982 -16.327 -5.195 148 HG21 THR 19 1HG2 THR 19 15.475 -16.884 -9.106 149 HG22 THR 19 2HG2 THR 19 16.965 -16.861 -8.133 150 HG23 THR 19 3HG2 THR 19 15.842 -18.236 -8.008 151 H VAL 20 HN VAL 20 15.013 -13.398 -5.615 152 HA VAL 20 HA VAL 20 13.896 -12.605 -3.862 153 HB VAL 20 HB VAL 20 11.761 -11.503 -4.446 154 HG11 VAL 20 1HG1 VAL 20 13.979 -11.191 -6.497 155 HG12 VAL 20 2HG1 VAL 20 12.691 -10.006 -6.172 156 HG13 VAL 20 3HG1 VAL 20 13.887 -10.390 -4.910 157 HG21 VAL 20 3HG2 VAL 20 10.933 -13.306 -5.972 158 HG22 VAL 20 1HG2 VAL 20 10.812 -11.668 -6.657 159 HG23 VAL 20 2HG2 VAL 20 12.115 -12.760 -7.187 160 H GLU 21 HN GLU 21 13.745 -15.572 -4.357 161 HA GLU 21 HA GLU 21 11.186 -16.047 -3.046 162 HB2 GLU 21 2HB GLU 21 12.849 -17.664 -4.962 163 HB3 GLU 21 3HB GLU 21 11.898 -18.536 -3.776 164 HG2 GLU 21 2HG GLU 21 9.997 -16.784 -4.611 165 HG3 GLU 21 3HG GLU 21 10.977 -16.818 -6.064 166 HE2 GLU 21 HE2 GLU 21 10.037 -19.507 -7.268 167 H LYS 22 HN LYS 22 11.136 -17.049 -1.019 168 HA LYS 22 HA LYS 22 13.398 -16.856 0.576 169 HB2 LYS 22 2HB LYS 22 11.330 -16.743 1.658 170 HB3 LYS 22 3HB LYS 22 10.712 -18.180 0.870 171 HG2 LYS 22 2HG LYS 22 12.238 -19.615 2.156 172 HG3 LYS 22 3HG LYS 22 13.046 -18.218 2.838 173 HD2 LYS 22 2HD LYS 22 11.035 -17.562 4.064 174 HD3 LYS 22 3HD LYS 22 10.071 -18.770 3.238 175 HE2 LYS 22 2HE LYS 22 10.635 -19.625 5.453 176 HE3 LYS 22 3HE LYS 22 11.501 -20.577 4.262 177 HZ1 LYS 22 2HZ LYS 22 12.718 -18.265 5.674 178 HZ3 LYS 22 1HZ LYS 22 13.495 -19.332 4.720 179 H GLY 23 HN GLY 23 12.033 -19.585 -1.313 180 HA2 GLY 23 1HA GLY 23 14.244 -21.295 -0.395 181 HA3 GLY 23 2HA GLY 23 12.766 -21.820 -1.176 182 H GLY 24 HN GLY 24 13.535 -19.063 -2.851 183 HA2 GLY 24 1HA GLY 24 14.117 -20.209 -5.247 184 HA3 GLY 24 2HA GLY 24 14.610 -18.595 -4.776 185 H LYS 25 HN LYS 25 16.268 -19.828 -6.529 186 HA LYS 25 HA LYS 25 18.511 -20.663 -4.826 187 HB2 LYS 25 2HB LYS 25 19.116 -22.352 -6.283 188 HB3 LYS 25 3HB LYS 25 17.368 -22.467 -6.300 189 HG2 LYS 25 2HG LYS 25 17.344 -21.001 -8.372 190 HG3 LYS 25 3HG LYS 25 19.097 -21.045 -8.380 191 HD2 LYS 25 2HD LYS 25 18.440 -22.779 -9.885 192 HD3 LYS 25 3HD LYS 25 18.910 -23.617 -8.421 193 HE2 LYS 25 2HE LYS 25 16.017 -22.797 -8.765 194 HE3 LYS 25 3HE LYS 25 16.607 -24.197 -9.637 195 HZ1 LYS 25 2HZ LYS 25 17.218 -25.235 -7.578 196 HZ3 LYS 25 1HZ LYS 25 15.700 -24.685 -7.366 197 H HIS 26 HN HIS 26 20.680 -20.156 -5.818 198 HA HIS 26 HA HIS 26 20.602 -17.458 -6.733 199 HB2 HIS 26 2HB HIS 26 23.084 -19.152 -6.591 200 HB3 HIS 26 3HB HIS 26 22.910 -17.427 -6.341 201 HD1 HIS 26 HD1 HIS 26 22.489 -16.613 -3.967 202 HD2 HIS 26 HD2 HIS 26 22.089 -20.770 -4.370 203 HE1 HIS 26 HE1 HIS 26 22.263 -17.543 -1.602 204 H LYS 27 HN LYS 27 20.455 -16.801 -8.815 205 HA LYS 27 HA LYS 27 21.173 -18.773 -10.866 206 HB2 LYS 27 2HB LYS 27 19.016 -16.721 -10.644 207 HB3 LYS 27 3HB LYS 27 19.692 -17.013 -12.234 208 HG2 LYS 27 2HG LYS 27 19.379 -19.598 -11.403 209 HG3 LYS 27 3HG LYS 27 18.092 -18.846 -10.482 210 HD2 LYS 27 2HD LYS 27 18.470 -18.586 -13.504 211 HD3 LYS 27 3HD LYS 27 17.314 -19.647 -12.724 212 HE2 LYS 27 2HE LYS 27 17.260 -16.657 -13.005 213 HE3 LYS 27 3HE LYS 27 15.943 -17.808 -13.130 214 HZ1 LYS 27 2HZ LYS 27 15.459 -17.370 -10.996 215 HZ3 LYS 27 1HZ LYS 27 16.706 -16.332 -10.868 216 H THR 28 HN THR 28 20.686 -15.319 -11.495 217 HA THR 28 HA THR 28 23.360 -15.180 -12.573 218 HB THR 28 HB THR 28 21.123 -13.094 -12.382 219 HG1 THR 28 HG1 THR 28 20.687 -15.236 -13.472 220 HG21 THR 28 1HG2 THR 28 22.220 -12.229 -14.474 221 HG22 THR 28 2HG2 THR 28 23.304 -12.113 -13.068 222 HG23 THR 28 3HG2 THR 28 23.527 -13.419 -14.257 223 H GLY 29 HN GLY 29 21.618 -14.139 -9.663 224 HA2 GLY 29 1HA GLY 29 24.185 -13.143 -8.620 225 HA3 GLY 29 2HA GLY 29 22.758 -12.130 -8.529 226 HA PRO 30 HA PRO 30 22.695 -14.663 -4.788 227 HB2 PRO 30 2HB PRO 30 22.294 -12.633 -3.002 228 HB3 PRO 30 3HB PRO 30 23.884 -13.249 -3.413 229 HG2 PRO 30 2HG PRO 30 22.596 -10.726 -4.263 230 HG3 PRO 30 3HG PRO 30 24.294 -11.160 -4.303 231 HD2 PRO 30 2HD PRO 30 22.487 -11.094 -6.530 232 HD3 PRO 30 3HD PRO 30 24.152 -11.638 -6.547 233 H ASN 31 HN ASN 31 20.991 -15.459 -3.508 234 HA ASN 31 HA ASN 31 18.530 -14.997 -4.767 235 HB2 ASN 31 2HB ASN 31 18.927 -17.177 -3.790 236 HB3 ASN 31 3HB ASN 31 19.379 -16.488 -2.243 237 HD21 ASN 31 1HD2 ASN 31 16.910 -17.776 -4.131 238 HD22 ASN 31 2HD2 ASN 31 15.544 -17.427 -3.125 239 H LEU 32 HN LEU 32 16.857 -13.572 -4.146 240 HA LEU 32 HA LEU 32 17.477 -11.745 -1.986 241 HB2 LEU 32 2HB LEU 32 15.679 -11.779 -4.352 242 HB3 LEU 32 3HB LEU 32 15.160 -10.838 -2.968 243 HG LEU 32 HG LEU 32 16.474 -9.646 -4.811 244 HD11 LEU 32 1HD1 LEU 32 17.818 -8.325 -3.075 245 HD12 LEU 32 2HD1 LEU 32 16.056 -8.437 -2.850 246 HD13 LEU 32 3HD1 LEU 32 17.143 -9.456 -1.877 247 HD21 LEU 32 3HD2 LEU 32 18.956 -10.618 -3.441 248 HD22 LEU 32 1HD2 LEU 32 18.235 -11.590 -4.746 249 HD23 LEU 32 2HD2 LEU 32 18.743 -9.914 -5.062 250 H HIS 33 HN HIS 33 17.270 -13.285 -0.217 251 HA HIS 33 HA HIS 33 14.453 -13.890 0.322 252 HB2 HIS 33 2HB HIS 33 15.415 -15.986 0.018 253 HB3 HIS 33 3HB HIS 33 16.940 -15.516 0.743 254 HD1 HIS 33 HD1 HIS 33 17.182 -17.030 2.728 255 HD2 HIS 33 HD2 HIS 33 13.341 -15.363 2.459 256 HE1 HIS 33 HE1 HIS 33 15.937 -17.761 4.831 257 H GLY 34 HN GLY 34 17.688 -13.350 1.893 258 HA2 GLY 34 1HA GLY 34 16.284 -12.152 4.186 259 HA3 GLY 34 2HA GLY 34 17.926 -12.762 4.163 260 H LEU 35 HN LEU 35 15.974 -10.388 2.204 261 HA LEU 35 HA LEU 35 18.277 -8.742 1.824 262 HB2 LEU 35 2HB LEU 35 16.685 -8.908 0.071 263 HB3 LEU 35 3HB LEU 35 15.357 -8.474 1.129 264 HG LEU 35 HG LEU 35 16.600 -6.210 1.414 265 HD11 LEU 35 1HD1 LEU 35 18.647 -6.283 0.457 266 HD12 LEU 35 2HD1 LEU 35 18.174 -7.517 -0.735 267 HD13 LEU 35 3HD1 LEU 35 17.731 -5.812 -0.995 268 HD21 LEU 35 3HD2 LEU 35 15.401 -5.266 -0.436 269 HD22 LEU 35 1HD2 LEU 35 15.345 -6.837 -1.270 270 HD23 LEU 35 2HD2 LEU 35 14.434 -6.600 0.240 271 H PHE 36 HN PHE 36 15.041 -7.841 3.196 272 HA PHE 36 HA PHE 36 16.161 -5.726 4.674 273 HB2 PHE 36 2HB PHE 36 13.542 -7.274 4.497 274 HB3 PHE 36 3HB PHE 36 13.738 -6.145 5.822 275 HD1 PHE 36 HD1 PHE 36 13.710 -6.410 2.130 276 HD2 PHE 36 HD2 PHE 36 13.476 -3.822 5.484 277 HE1 PHE 36 HE1 PHE 36 13.007 -4.526 0.627 278 HE2 PHE 36 HE2 PHE 36 12.773 -1.938 3.982 279 HZ PHE 36 HZ PHE 36 12.547 -2.313 1.572 280 H GLY 37 HN GLY 37 17.269 -5.782 6.567 281 HA2 GLY 37 1HA GLY 37 17.496 -6.344 8.809 282 HA3 GLY 37 2HA GLY 37 16.539 -7.792 8.564 283 H ARG 38 HN ARG 38 19.169 -6.837 6.339 284 HA ARG 38 HA ARG 38 20.956 -8.673 7.634 285 HB2 ARG 38 2HB ARG 38 19.415 -9.849 5.808 286 HB3 ARG 38 3HB ARG 38 20.479 -9.060 4.661 287 HG2 ARG 38 2HG ARG 38 22.410 -10.229 5.459 288 HG3 ARG 38 3HG ARG 38 21.624 -10.688 6.957 289 HD2 ARG 38 2HD ARG 38 21.572 -12.682 5.663 290 HD3 ARG 38 3HD ARG 38 19.953 -12.035 5.483 291 HE ARG 38 HE ARG 38 21.619 -10.972 3.399 292 HH11 ARG 38 2HH2 ARG 38 20.074 -14.008 4.374 293 HH12 ARG 38 1HH2 ARG 38 19.962 -14.615 2.756 294 HH22 ARG 38 HH1 ARG 38 20.788 -13.283 0.943 295 H LYS 39 HN LYS 39 23.207 -8.536 6.648 296 HA LYS 39 HA LYS 39 23.648 -5.819 5.724 297 HB2 LYS 39 2HB LYS 39 25.327 -7.952 7.004 298 HB3 LYS 39 3HB LYS 39 26.115 -6.690 6.076 299 HG2 LYS 39 2HG LYS 39 25.442 -4.987 7.539 300 HG3 LYS 39 3HG LYS 39 24.009 -5.851 8.063 301 HD2 LYS 39 2HD LYS 39 26.743 -6.978 8.724 302 HD3 LYS 39 3HD LYS 39 26.110 -5.650 9.676 303 HE2 LYS 39 2HE LYS 39 24.293 -6.922 10.502 304 HE3 LYS 39 3HE LYS 39 24.342 -8.054 9.165 305 HZ1 LYS 39 2HZ LYS 39 25.328 -8.767 11.434 306 HZ3 LYS 39 1HZ LYS 39 26.638 -7.899 11.010 307 H THR 40 HN THR 40 25.799 -5.835 4.150 308 HA THR 40 HA THR 40 24.804 -7.174 1.770 309 HB THR 40 HB THR 40 26.764 -5.689 0.816 310 HG1 THR 40 HG1 THR 40 27.210 -3.978 2.471 311 HG21 THR 40 1HG2 THR 40 24.701 -4.661 0.371 312 HG22 THR 40 2HG2 THR 40 24.181 -4.749 2.071 313 HG23 THR 40 3HG2 THR 40 25.357 -3.513 1.562 314 H GLY 41 HN GLY 41 25.711 -8.876 0.743 315 HA2 GLY 41 1HA GLY 41 27.176 -10.529 0.280 316 HA3 GLY 41 2HA GLY 41 28.428 -9.631 1.114 317 H GLN 42 HN GLN 42 25.269 -11.134 2.130 318 HA GLN 42 HA GLN 42 26.763 -12.342 4.319 319 HB2 GLN 42 2HB GLN 42 23.791 -11.701 4.075 320 HB3 GLN 42 3HB GLN 42 24.512 -12.524 5.443 321 HG2 GLN 42 2HG GLN 42 25.025 -9.671 4.511 322 HG3 GLN 42 3HG GLN 42 24.352 -10.191 6.044 323 HE21 GLN 42 1HE2 GLN 42 27.117 -9.314 4.352 324 HE22 GLN 42 2HE2 GLN 42 28.334 -9.762 5.500 325 H ALA 43 HN ALA 43 24.900 -12.925 1.412 326 HA ALA 43 HA ALA 43 23.718 -15.301 1.715 327 HB1 ALA 43 3HB ALA 43 24.556 -15.759 -0.673 328 HB2 ALA 43 1HB ALA 43 23.686 -14.228 -0.407 329 HB3 ALA 43 2HB ALA 43 25.462 -14.235 -0.526 330 HA PRO 44 HA PRO 44 27.167 -17.628 3.241 331 HB2 PRO 44 2HB PRO 44 25.701 -19.470 4.629 332 HB3 PRO 44 3HB PRO 44 26.254 -17.962 5.328 333 HG2 PRO 44 2HG PRO 44 23.535 -18.704 4.437 334 HG3 PRO 44 3HG PRO 44 24.024 -17.404 5.505 335 HD2 PRO 44 2HD PRO 44 23.247 -17.165 2.754 336 HD3 PRO 44 3HD PRO 44 23.846 -15.884 3.788 337 H GLY 45 HN GLY 45 26.929 -17.841 0.671 338 HA2 GLY 45 1HA GLY 45 27.408 -20.585 0.199 339 HA3 GLY 45 2HA GLY 45 25.788 -20.177 -0.329 340 H TYR 46 HN TYR 46 26.308 -17.392 -1.071 341 HA TYR 46 HA TYR 46 28.076 -17.848 -3.381 342 HB2 TYR 46 2HB TYR 46 25.450 -17.644 -3.601 343 HB3 TYR 46 3HB TYR 46 25.652 -15.977 -3.100 344 HD1 TYR 46 HD1 TYR 46 27.848 -17.960 -5.385 345 HD2 TYR 46 HD2 TYR 46 25.026 -14.765 -5.016 346 HE1 TYR 46 HE1 TYR 46 28.286 -17.285 -7.796 347 HE2 TYR 46 HE2 TYR 46 25.475 -14.100 -7.429 348 HH TYR 46 HH TYR 46 27.325 -16.123 -9.541 349 H SER 47 HN SER 47 29.822 -16.530 -3.484 350 HA SER 47 HA SER 47 29.759 -14.194 -1.763 351 HB2 SER 47 2HB SER 47 32.317 -14.247 -2.342 352 HB3 SER 47 3HB SER 47 31.675 -15.426 -1.217 353 HG SER 47 HG SER 47 33.121 -16.173 -3.091 354 H TYR 48 HN TYR 48 29.825 -12.117 -2.618 355 HA TYR 48 HA TYR 48 29.713 -11.931 -5.517 356 HB2 TYR 48 2HB TYR 48 29.533 -9.674 -3.466 357 HB3 TYR 48 3HB TYR 48 28.671 -9.807 -4.986 358 HD1 TYR 48 HD2 TYR 48 27.887 -12.837 -4.348 359 HD2 TYR 48 HD1 TYR 48 27.463 -9.121 -2.270 360 HE1 TYR 48 HE2 TYR 48 25.861 -13.749 -3.115 361 HE2 TYR 48 HE1 TYR 48 25.437 -10.046 -1.044 362 HH TYR 48 HH TYR 48 24.041 -11.691 -0.866 363 H THR 49 HN THR 49 30.654 -9.481 -6.137 364 HA THR 49 HA THR 49 33.421 -9.851 -6.224 365 HB THR 49 HB THR 49 33.266 -7.383 -7.042 366 HG1 THR 49 HG1 THR 49 30.987 -6.729 -7.224 367 HG21 THR 49 1HG2 THR 49 32.278 -9.811 -8.255 368 HG22 THR 49 2HG2 THR 49 31.128 -8.505 -8.632 369 HG23 THR 49 3HG2 THR 49 32.845 -8.335 -9.074 370 H ALA 50 HN ALA 50 34.884 -7.776 -5.577 371 HA ALA 50 HA ALA 50 34.741 -7.806 -2.678 372 HB1 ALA 50 3HB ALA 50 36.846 -6.822 -4.647 373 HB2 ALA 50 1HB ALA 50 37.030 -6.838 -2.877 374 HB3 ALA 50 2HB ALA 50 36.858 -8.370 -3.769 375 H ALA 51 HN ALA 51 33.007 -6.163 -4.770 376 HA ALA 51 HA ALA 51 33.652 -3.490 -3.791 377 HB1 ALA 51 3HB ALA 51 33.328 -3.371 -6.087 378 HB2 ALA 51 1HB ALA 51 32.093 -4.653 -6.089 379 HB3 ALA 51 2HB ALA 51 31.683 -3.024 -5.502 380 H ASN 52 HN ASN 52 30.942 -5.887 -3.978 381 HA ASN 52 HA ASN 52 29.366 -4.247 -2.254 382 HB2 ASN 52 2HB ASN 52 28.490 -5.791 -4.145 383 HB3 ASN 52 3HB ASN 52 28.842 -7.143 -3.087 384 HD21 ASN 52 1HD2 ASN 52 27.761 -7.336 -1.083 385 HD22 ASN 52 2HD2 ASN 52 26.211 -6.614 -0.809 386 H LYS 53 HN LYS 53 31.070 -7.454 -2.199 387 HA LYS 53 HA LYS 53 30.368 -8.362 0.261 388 HB2 LYS 53 2HB LYS 53 31.880 -9.372 -1.586 389 HB3 LYS 53 3HB LYS 53 33.201 -8.575 -0.753 390 HG2 LYS 53 2HG LYS 53 32.059 -9.726 1.403 391 HG3 LYS 53 3HG LYS 53 31.445 -10.836 0.194 392 HD2 LYS 53 2HD LYS 53 33.911 -10.979 -0.661 393 HD3 LYS 53 3HD LYS 53 34.350 -10.215 0.854 394 HE2 LYS 53 2HE LYS 53 32.719 -12.792 0.638 395 HE3 LYS 53 3HE LYS 53 34.446 -12.740 0.932 396 HZ1 LYS 53 2HZ LYS 53 33.784 -12.672 3.088 397 HZ3 LYS 53 1HZ LYS 53 32.284 -12.130 2.759 398 H ASN 54 HN ASN 54 33.017 -6.022 -0.531 399 HA ASN 54 HA ASN 54 33.912 -5.740 2.050 400 HB2 ASN 54 2HB ASN 54 34.828 -4.812 -0.258 401 HB3 ASN 54 3HB ASN 54 33.828 -3.413 0.086 402 HD21 ASN 54 1HD2 ASN 54 36.833 -4.661 0.356 403 HD22 ASN 54 2HD2 ASN 54 37.463 -3.764 1.698 404 H LYS 55 HN LYS 55 31.144 -4.354 0.273 405 HA LYS 55 HA LYS 55 30.597 -2.153 1.856 406 HB2 LYS 55 2HB LYS 55 29.564 -3.074 -0.393 407 HB3 LYS 55 3HB LYS 55 28.387 -3.808 0.678 408 HG2 LYS 55 2HG LYS 55 27.439 -1.691 0.188 409 HG3 LYS 55 3HG LYS 55 28.156 -1.457 1.769 410 HD2 LYS 55 2HD LYS 55 30.219 -0.514 0.652 411 HD3 LYS 55 3HD LYS 55 29.422 -0.675 -0.900 412 HE2 LYS 55 2HE LYS 55 27.697 0.923 -0.285 413 HE3 LYS 55 3HE LYS 55 28.194 0.914 1.396 414 HZ1 LYS 55 2HZ LYS 55 30.167 1.708 -0.635 415 HZ3 LYS 55 1HZ LYS 55 30.056 2.187 0.918 416 H GLY 56 HN GLY 56 29.347 -1.804 3.725 417 HA2 GLY 56 1HA GLY 56 28.398 -4.199 5.140 418 HA3 GLY 56 2HA GLY 56 29.571 -3.158 5.919 419 H ILE 57 HN ILE 57 26.283 -3.247 4.455 420 HA ILE 57 HA ILE 57 25.454 -1.282 6.422 421 HB ILE 57 HB ILE 57 24.307 0.083 4.747 422 HG12 ILE 57 2HG1 ILE 57 25.341 -0.232 2.329 423 HG13 ILE 57 3HG1 ILE 57 25.526 -1.894 2.852 424 HG21 ILE 57 1HG2 ILE 57 26.420 0.865 5.576 425 HG22 ILE 57 2HG2 ILE 57 27.308 -0.162 4.425 426 HG23 ILE 57 3HG2 ILE 57 26.334 1.204 3.830 427 HD11 ILE 57 3HD1 ILE 57 23.163 -2.142 3.260 428 HD12 ILE 57 1HD1 ILE 57 22.892 -0.388 3.126 429 HD13 ILE 57 2HD1 ILE 57 23.317 -1.337 1.681 430 H ILE 58 HN ILE 58 22.927 -1.053 6.257 431 HA ILE 58 HA ILE 58 21.919 -3.774 5.826 432 HB ILE 58 HB ILE 58 20.965 -1.582 7.670 433 HG12 ILE 58 2HG1 ILE 58 23.142 -2.949 8.147 434 HG13 ILE 58 3HG1 ILE 58 21.972 -2.673 9.422 435 HG21 ILE 58 1HG2 ILE 58 19.847 -4.323 7.068 436 HG22 ILE 58 2HG2 ILE 58 19.486 -3.439 8.570 437 HG23 ILE 58 3HG2 ILE 58 19.026 -2.746 6.997 438 HD11 ILE 58 3HD1 ILE 58 20.957 -4.903 9.003 439 HD12 ILE 58 1HD1 ILE 58 22.122 -5.183 7.687 440 HD13 ILE 58 2HD1 ILE 58 22.693 -5.046 9.366 441 H TRP 59 HN TRP 59 20.161 -4.138 4.492 442 HA TRP 59 HA TRP 59 19.557 -2.004 2.667 443 HB2 TRP 59 2HB TRP 59 18.777 -4.906 2.863 444 HB3 TRP 59 3HB TRP 59 18.044 -3.828 1.692 445 HD1 TRP 59 HD1 TRP 59 20.818 -6.187 1.873 446 HE1 TRP 59 HE1 TRP 59 22.651 -5.861 0.002 447 HE3 TRP 59 HE3 TRP 59 19.317 -1.534 0.475 448 HZ2 TRP 59 HZ2 TRP 59 23.254 -3.741 -1.810 449 HZ3 TRP 59 HZ3 TRP 59 20.581 -0.406 -1.353 450 HH2 TRP 59 HH2 TRP 59 22.489 -1.435 -2.484 451 H GLY 60 HN GLY 60 17.414 -1.111 2.334 452 HA2 GLY 60 1HA GLY 60 15.192 -1.793 3.934 453 HA3 GLY 60 2HA GLY 60 16.037 -0.442 4.664 454 H GLU 61 HN GLU 61 13.923 0.693 4.144 455 HA GLU 61 HA GLU 61 13.342 1.146 1.417 456 HB2 GLU 61 2HB GLU 61 12.280 2.063 4.063 457 HB3 GLU 61 3HB GLU 61 11.956 3.108 2.696 458 HG2 GLU 61 2HG GLU 61 11.474 0.149 2.355 459 HG3 GLU 61 3HG GLU 61 10.330 1.059 3.321 460 HE2 GLU 61 HE2 GLU 61 8.683 1.531 2.002 461 H ASP 62 HN ASP 62 15.264 2.757 3.947 462 HA ASP 62 HA ASP 62 15.467 5.210 2.622 463 HB2 ASP 62 2HB ASP 62 16.924 3.796 4.847 464 HB3 ASP 62 3HB ASP 62 17.718 5.180 4.123 465 HD2 ASP 62 HD2 ASP 62 15.797 7.517 5.489 466 H THR 63 HN THR 63 17.735 2.382 3.034 467 HA THR 63 HA THR 63 19.728 3.348 1.323 468 HB THR 63 HB THR 63 20.278 0.781 1.317 469 HG1 THR 63 HG1 THR 63 18.881 -0.138 3.173 470 HG21 THR 63 1HG2 THR 63 21.455 1.250 3.217 471 HG22 THR 63 2HG2 THR 63 20.522 2.757 3.380 472 HG23 THR 63 3HG2 THR 63 19.950 1.267 4.167 473 H LEU 64 HN LEU 64 16.944 1.129 0.685 474 HA LEU 64 HA LEU 64 17.574 0.651 -1.973 475 HB2 LEU 64 2HB LEU 64 14.949 0.676 -0.487 476 HB3 LEU 64 3HB LEU 64 15.102 0.160 -2.156 477 HG LEU 64 HG LEU 64 16.773 -1.113 0.004 478 HD11 LEU 64 1HD1 LEU 64 15.069 -2.194 0.930 479 HD12 LEU 64 2HD1 LEU 64 13.972 -1.117 0.035 480 HD13 LEU 64 3HD1 LEU 64 14.440 -2.687 -0.660 481 HD21 LEU 64 3HD2 LEU 64 17.544 -2.329 -1.679 482 HD22 LEU 64 1HD2 LEU 64 15.898 -2.914 -2.019 483 HD23 LEU 64 2HD2 LEU 64 16.501 -1.440 -2.814 484 H MET 65 HN MET 65 15.412 3.169 -0.505 485 HA MET 65 HA MET 65 14.590 4.343 -2.796 486 HB2 MET 65 2HB MET 65 15.178 5.297 0.018 487 HB3 MET 65 3HB MET 65 14.809 6.521 -1.181 488 HG2 MET 65 2HG MET 65 12.994 4.112 -1.018 489 HG3 MET 65 3HG MET 65 12.866 5.322 0.243 490 HE1 MET 65 3HE MET 65 11.272 4.069 -2.321 491 HE2 MET 65 1HE MET 65 10.541 5.346 -3.323 492 HE3 MET 65 2HE MET 65 12.149 4.704 -3.733 493 H GLU 66 HN GLU 66 17.820 4.278 -1.460 494 HA GLU 66 HA GLU 66 18.588 6.526 -3.124 495 HB2 GLU 66 2HB GLU 66 19.475 6.749 -0.926 496 HB3 GLU 66 3HB GLU 66 19.921 5.057 -0.831 497 HG2 GLU 66 2HG GLU 66 21.817 5.330 -2.208 498 HG3 GLU 66 3HG GLU 66 21.176 6.760 -2.991 499 HE2 GLU 66 HE2 GLU 66 23.119 6.788 0.449 500 H TYR 67 HN TYR 67 18.842 3.006 -2.769 501 HA TYR 67 HA TYR 67 20.997 2.699 -4.605 502 HB2 TYR 67 2HB TYR 67 19.962 1.174 -2.678 503 HB3 TYR 67 3HB TYR 67 18.762 0.724 -3.874 504 HD1 TYR 67 HD1 TYR 67 22.423 1.292 -4.385 505 HD2 TYR 67 HD2 TYR 67 19.220 -1.542 -4.288 506 HE1 TYR 67 HE1 TYR 67 23.981 -0.510 -5.275 507 HE2 TYR 67 HE2 TYR 67 20.788 -3.334 -5.179 508 HH TYR 67 HH TYR 67 24.213 -2.601 -5.768 509 H LEU 68 HN LEU 68 17.457 1.868 -4.825 510 HA LEU 68 HA LEU 68 17.369 1.138 -7.424 511 HB2 LEU 68 2HB LEU 68 15.447 2.450 -5.564 512 HB3 LEU 68 3HB LEU 68 15.012 2.357 -7.259 513 HG LEU 68 HG LEU 68 15.327 -0.110 -7.181 514 HD11 LEU 68 1HD1 LEU 68 16.935 -0.188 -5.321 515 HD12 LEU 68 2HD1 LEU 68 15.645 0.295 -4.194 516 HD13 LEU 68 3HD1 LEU 68 15.542 -1.262 -5.052 517 HD21 LEU 68 3HD2 LEU 68 13.341 -0.372 -5.381 518 HD22 LEU 68 1HD2 LEU 68 13.276 1.387 -5.651 519 HD23 LEU 68 2HD2 LEU 68 13.106 0.269 -7.026 520 H GLU 69 HN GLU 69 17.248 4.509 -6.119 521 HA GLU 69 HA GLU 69 16.813 5.800 -8.467 522 HB2 GLU 69 2HB GLU 69 16.782 6.986 -6.358 523 HB3 GLU 69 3HB GLU 69 18.462 6.601 -6.037 524 HG2 GLU 69 2HG GLU 69 18.420 8.882 -6.819 525 HG3 GLU 69 3HG GLU 69 19.093 7.923 -8.122 526 HE2 GLU 69 HE2 GLU 69 17.057 10.456 -8.115 527 H ASN 70 HN ASN 70 19.921 4.606 -7.076 528 HA ASN 70 HA ASN 70 20.998 4.399 -9.673 529 HB2 ASN 70 2HB ASN 70 21.903 6.641 -7.832 530 HB3 ASN 70 3HB ASN 70 23.072 5.890 -8.900 531 HD21 ASN 70 1HD2 ASN 70 21.017 8.389 -8.593 532 HD22 ASN 70 2HD2 ASN 70 20.661 8.761 -10.247 533 HA PRO 71 HA PRO 71 22.691 1.621 -6.522 534 HB2 PRO 71 2HB PRO 71 22.522 -0.684 -7.980 535 HB3 PRO 71 3HB PRO 71 21.250 -0.133 -6.909 536 HG2 PRO 71 2HG PRO 71 21.348 -0.056 -9.862 537 HG3 PRO 71 3HG PRO 71 19.956 0.085 -8.806 538 HD2 PRO 71 2HD PRO 71 21.281 2.218 -10.192 539 HD3 PRO 71 3HD PRO 71 19.965 2.371 -9.045 540 H LYS 72 HN LYS 72 23.742 2.907 -9.314 541 HA LYS 72 HA LYS 72 26.088 1.266 -9.579 542 HB2 LYS 72 2HB LYS 72 24.721 2.610 -11.394 543 HB3 LYS 72 3HB LYS 72 25.750 3.939 -10.900 544 HG2 LYS 72 2HG LYS 72 26.859 1.201 -11.664 545 HG3 LYS 72 3HG LYS 72 26.625 2.483 -12.835 546 HD2 LYS 72 2HD LYS 72 28.450 2.531 -10.393 547 HD3 LYS 72 3HD LYS 72 28.934 2.580 -12.077 548 HE2 LYS 72 2HE LYS 72 27.530 4.780 -12.227 549 HE3 LYS 72 3HE LYS 72 27.529 4.754 -10.475 550 HZ1 LYS 72 2HZ LYS 72 29.515 5.778 -10.683 551 HZ3 LYS 72 1HZ LYS 72 29.695 5.388 -12.254 552 H LYS 73 HN LYS 73 25.215 4.533 -8.313 553 HA LYS 73 HA LYS 73 27.872 5.198 -7.634 554 HB2 LYS 73 2HB LYS 73 26.981 7.160 -6.801 555 HB3 LYS 73 3HB LYS 73 25.788 6.704 -8.000 556 HG2 LYS 73 2HG LYS 73 24.403 5.634 -6.203 557 HG3 LYS 73 3HG LYS 73 25.593 6.111 -5.008 558 HD2 LYS 73 2HD LYS 73 24.358 8.204 -6.825 559 HD3 LYS 73 3HD LYS 73 23.473 7.638 -5.423 560 HE2 LYS 73 2HE LYS 73 24.638 9.440 -4.493 561 HE3 LYS 73 3HE LYS 73 25.738 8.126 -4.126 562 HZ1 LYS 73 2HZ LYS 73 27.236 9.385 -5.229 563 HZ3 LYS 73 1HZ LYS 73 26.115 10.324 -5.945 564 H TYR 74 HN TYR 74 25.128 3.656 -5.883 565 HA TYR 74 HA TYR 74 26.217 3.653 -3.349 566 HB2 TYR 74 2HB TYR 74 23.924 2.843 -4.495 567 HB3 TYR 74 3HB TYR 74 24.742 1.301 -4.646 568 HD1 TYR 74 HD1 TYR 74 26.211 1.056 -2.118 569 HD2 TYR 74 HD2 TYR 74 22.287 2.593 -2.857 570 HE1 TYR 74 HE1 TYR 74 25.524 0.464 0.257 571 HE2 TYR 74 HE2 TYR 74 21.613 1.996 -0.479 572 HH TYR 74 HH TYR 74 23.630 1.506 1.894 573 H ILE 75 HN ILE 75 26.377 0.984 -5.822 574 HA ILE 75 HA ILE 75 28.937 0.231 -4.611 575 HB ILE 75 HB ILE 75 26.954 -1.824 -5.539 576 HG12 ILE 75 2HG1 ILE 75 27.176 -0.701 -2.729 577 HG13 ILE 75 3HG1 ILE 75 25.823 -0.472 -3.820 578 HG21 ILE 75 1HG2 ILE 75 29.640 -1.893 -4.690 579 HG22 ILE 75 2HG2 ILE 75 28.678 -2.576 -3.358 580 HG23 ILE 75 3HG2 ILE 75 28.548 -3.266 -4.994 581 HD11 ILE 75 3HD1 ILE 75 26.035 -3.204 -3.900 582 HD12 ILE 75 1HD1 ILE 75 26.605 -2.878 -2.245 583 HD13 ILE 75 2HD1 ILE 75 24.991 -2.327 -2.757 584 HA PRO 76 HA PRO 76 29.447 0.783 -9.020 585 HB2 PRO 76 2HB PRO 76 31.855 2.069 -8.905 586 HB3 PRO 76 3HB PRO 76 30.319 2.913 -8.933 587 HG2 PRO 76 2HG PRO 76 32.152 2.476 -6.655 588 HG3 PRO 76 3HG PRO 76 30.858 3.647 -6.814 589 HD2 PRO 76 2HD PRO 76 30.792 1.210 -5.302 590 HD3 PRO 76 3HD PRO 76 29.461 2.321 -5.556 591 H GLY 77 HN GLY 77 30.260 -0.645 -10.454 592 HA2 GLY 77 1HA GLY 77 31.972 -2.033 -11.210 593 HA3 GLY 77 2HA GLY 77 32.670 -2.080 -9.604 594 H THR 78 HN THR 78 29.274 -2.371 -9.363 595 HA THR 78 HA THR 78 29.491 -5.107 -8.572 596 HB THR 78 HB THR 78 28.025 -3.417 -7.447 597 HG1 THR 78 HG1 THR 78 26.953 -5.328 -7.128 598 HG21 THR 78 1HG2 THR 78 26.791 -3.350 -10.216 599 HG22 THR 78 2HG2 THR 78 25.733 -3.171 -8.795 600 HG23 THR 78 3HG2 THR 78 27.050 -2.008 -9.075 601 H LYS 79 HN LYS 79 27.816 -6.755 -9.380 602 HA LYS 79 HA LYS 79 28.268 -6.983 -12.210 603 HB2 LYS 79 2HB LYS 79 26.784 -8.869 -10.360 604 HB3 LYS 79 3HB LYS 79 27.429 -9.229 -11.949 605 HG2 LYS 79 2HG LYS 79 29.734 -8.431 -10.894 606 HG3 LYS 79 3HG LYS 79 28.933 -8.738 -9.366 607 HD2 LYS 79 2HD LYS 79 28.319 -11.069 -10.332 608 HD3 LYS 79 3HD LYS 79 29.462 -10.724 -11.613 609 HE2 LYS 79 2HE LYS 79 30.359 -10.349 -8.751 610 HE3 LYS 79 3HE LYS 79 30.233 -11.981 -9.378 611 HZ1 LYS 79 2HZ LYS 79 32.438 -11.129 -9.807 612 HZ3 LYS 79 1HZ LYS 79 31.869 -9.800 -10.559 613 H MET 80 HN MET 80 25.792 -5.793 -10.063 614 HA MET 80 HA MET 80 23.486 -6.340 -11.273 615 HB2 MET 80 2HB MET 80 24.170 -4.687 -9.300 616 HB3 MET 80 3HB MET 80 24.172 -3.458 -10.548 617 HG2 MET 80 2HG MET 80 21.949 -3.298 -9.879 618 HG3 MET 80 3HG MET 80 21.772 -4.511 -11.132 619 HE1 MET 80 3HE MET 80 21.620 -3.356 -7.862 620 HE2 MET 80 1HE MET 80 20.329 -4.417 -7.249 621 HE3 MET 80 2HE MET 80 22.014 -4.682 -6.741 622 H ILE 81 HN ILE 81 22.293 -5.706 -13.099 623 HA ILE 81 HA ILE 81 23.780 -4.029 -14.999 624 HB ILE 81 HB ILE 81 21.865 -6.271 -15.644 625 HG12 ILE 81 2HG1 ILE 81 23.847 -7.170 -14.527 626 HG13 ILE 81 3HG1 ILE 81 23.809 -7.615 -16.222 627 HG21 ILE 81 1HG2 ILE 81 23.262 -4.214 -17.222 628 HG22 ILE 81 2HG2 ILE 81 23.432 -5.874 -17.842 629 HG23 ILE 81 3HG2 ILE 81 21.812 -5.176 -17.600 630 HD11 ILE 81 3HD1 ILE 81 25.402 -5.794 -16.766 631 HD12 ILE 81 1HD1 ILE 81 25.417 -5.294 -15.058 632 HD13 ILE 81 2HD1 ILE 81 26.079 -6.879 -15.528 633 H PHE 82 HN PHE 82 22.314 -2.708 -13.104 634 HA PHE 82 HA PHE 82 19.854 -2.039 -14.563 635 HB2 PHE 82 2HB PHE 82 19.825 -3.087 -12.145 636 HB3 PHE 82 3HB PHE 82 20.530 -1.577 -11.605 637 HD1 PHE 82 HD2 PHE 82 17.733 -2.476 -13.922 638 HD2 PHE 82 HD1 PHE 82 18.995 -0.239 -10.544 639 HE1 PHE 82 HE2 PHE 82 15.439 -1.476 -13.728 640 HE2 PHE 82 HE1 PHE 82 16.701 0.761 -10.350 641 HZ PHE 82 HZ PHE 82 14.951 0.131 -11.944 642 H VAL 83 HN VAL 83 19.295 0.208 -14.748 643 HA VAL 83 HA VAL 83 21.644 1.931 -14.524 644 HB VAL 83 HB VAL 83 20.408 3.386 -16.068 645 HG11 VAL 83 1HG1 VAL 83 21.941 1.653 -16.928 646 HG12 VAL 83 2HG1 VAL 83 20.582 0.509 -17.026 647 HG13 VAL 83 3HG1 VAL 83 20.594 1.964 -18.048 648 HG21 VAL 83 3HG2 VAL 83 18.297 2.888 -16.961 649 HG22 VAL 83 1HG2 VAL 83 18.347 1.203 -16.391 650 HG23 VAL 83 2HG2 VAL 83 18.123 2.530 -15.226 651 H GLY 84 HN GLY 84 18.326 1.406 -13.351 652 HA2 GLY 84 1HA GLY 84 18.050 2.265 -11.044 653 HA3 GLY 84 2HA GLY 84 18.625 3.807 -11.646 654 H ILE 85 HN ILE 85 16.289 4.135 -10.515 655 HA ILE 85 HA ILE 85 14.351 4.058 -12.723 656 HB ILE 85 HB ILE 85 13.752 3.838 -9.771 657 HG12 ILE 85 2HG1 ILE 85 13.477 1.612 -11.790 658 HG13 ILE 85 3HG1 ILE 85 14.970 1.862 -10.909 659 HG21 ILE 85 1HG2 ILE 85 12.059 3.928 -12.253 660 HG22 ILE 85 2HG2 ILE 85 11.503 3.050 -10.808 661 HG23 ILE 85 3HG2 ILE 85 11.861 4.790 -10.709 662 HD11 ILE 85 3HD1 ILE 85 13.106 0.259 -9.926 663 HD12 ILE 85 1HD1 ILE 85 14.009 1.338 -8.834 664 HD13 ILE 85 2HD1 ILE 85 12.370 1.782 -9.369 665 H LYS 86 HN LYS 86 13.263 5.964 -13.193 666 HA LYS 86 HA LYS 86 14.359 8.309 -11.856 667 HB2 LYS 86 2HB LYS 86 13.800 9.522 -13.784 668 HB3 LYS 86 3HB LYS 86 14.402 7.990 -14.383 669 HG2 LYS 86 2HG LYS 86 12.056 7.157 -14.624 670 HG3 LYS 86 3HG LYS 86 11.448 8.682 -14.012 671 HD2 LYS 86 2HD LYS 86 13.338 8.758 -16.363 672 HD3 LYS 86 3HD LYS 86 11.696 8.220 -16.650 673 HE2 LYS 86 2HE LYS 86 10.915 10.354 -15.424 674 HE3 LYS 86 3HE LYS 86 12.579 10.899 -15.489 675 HZ1 LYS 86 2HZ LYS 86 12.112 10.151 -18.051 676 HZ3 LYS 86 1HZ LYS 86 11.980 11.682 -17.511 677 H LYS 87 HN LYS 87 11.426 6.376 -12.201 678 HA LYS 87 HA LYS 87 9.816 8.481 -11.016 679 HB2 LYS 87 2HB LYS 87 9.150 5.725 -12.086 680 HB3 LYS 87 3HB LYS 87 7.977 6.780 -11.324 681 HG2 LYS 87 2HG LYS 87 8.777 8.586 -13.048 682 HG3 LYS 87 3HG LYS 87 9.515 7.247 -13.904 683 HD2 LYS 87 2HD LYS 87 7.431 6.214 -14.369 684 HD3 LYS 87 3HD LYS 87 6.614 7.043 -13.058 685 HE2 LYS 87 2HE LYS 87 5.836 8.192 -14.975 686 HE3 LYS 87 3HE LYS 87 7.107 9.242 -14.380 687 HZ1 LYS 87 2HZ LYS 87 8.482 7.597 -16.013 688 HZ3 LYS 87 1HZ LYS 87 7.880 9.033 -16.489 689 H LYS 88 HN LYS 88 10.091 8.783 -8.864 690 HA LYS 88 HA LYS 88 11.108 6.814 -7.159 691 HB2 LYS 88 2HB LYS 88 11.447 9.011 -6.473 692 HB3 LYS 88 3HB LYS 88 9.794 9.492 -6.797 693 HG2 LYS 88 2HG LYS 88 9.009 8.050 -4.901 694 HG3 LYS 88 3HG LYS 88 10.667 7.588 -4.571 695 HD2 LYS 88 2HD LYS 88 11.066 10.225 -4.455 696 HD3 LYS 88 3HD LYS 88 9.336 10.277 -4.180 697 HE2 LYS 88 2HE LYS 88 11.434 8.845 -2.498 698 HE3 LYS 88 3HE LYS 88 10.390 10.163 -2.004 699 HZ1 LYS 88 2HZ LYS 88 8.515 8.730 -2.031 700 HZ3 LYS 88 1HZ LYS 88 9.675 7.846 -1.308 701 H GLU 89 HN GLU 89 7.812 7.657 -8.217 702 HA GLU 89 HA GLU 89 6.463 6.323 -6.203 703 HB2 GLU 89 2HB GLU 89 5.213 7.818 -7.570 704 HB3 GLU 89 3HB GLU 89 5.768 7.074 -9.057 705 HG2 GLU 89 2HG GLU 89 4.349 5.190 -8.806 706 HG3 GLU 89 3HG GLU 89 4.178 5.422 -7.077 707 HE2 GLU 89 HE2 GLU 89 2.333 8.445 -7.741 708 H GLU 90 HN GLU 90 8.047 5.202 -9.192 709 HA GLU 90 HA GLU 90 6.822 2.646 -9.083 710 HB2 GLU 90 2HB GLU 90 8.921 3.992 -10.760 711 HB3 GLU 90 3HB GLU 90 8.911 2.240 -10.747 712 HG2 GLU 90 2HG GLU 90 7.466 3.423 -12.550 713 HG3 GLU 90 3HG GLU 90 6.722 2.109 -11.660 714 HE2 GLU 90 HE2 GLU 90 5.354 5.570 -12.014 715 H ARG 91 HN ARG 91 9.189 4.176 -7.212 716 HA ARG 91 HA ARG 91 10.798 1.826 -6.888 717 HB2 ARG 91 2HB ARG 91 10.881 4.532 -5.458 718 HB3 ARG 91 3HB ARG 91 12.079 3.268 -5.266 719 HG2 ARG 91 2HG ARG 91 12.525 3.380 -7.761 720 HG3 ARG 91 3HG ARG 91 11.412 4.730 -7.865 721 HD2 ARG 91 2HD ARG 91 12.983 5.677 -5.868 722 HD3 ARG 91 3HD ARG 91 14.155 4.617 -6.626 723 HE ARG 91 HE ARG 91 13.120 5.962 -8.788 724 HH11 ARG 91 2HH2 ARG 91 14.425 7.082 -5.691 725 HH12 ARG 91 1HH2 ARG 91 14.990 8.589 -6.332 726 HH22 ARG 91 HH1 ARG 91 14.648 9.079 -8.653 727 H ALA 92 HN ALA 92 8.213 3.668 -5.250 728 HA ALA 92 HA ALA 92 8.460 2.415 -2.734 729 HB1 ALA 92 3HB ALA 92 5.928 3.240 -2.711 730 HB2 ALA 92 1HB ALA 92 7.276 4.401 -2.646 731 HB3 ALA 92 2HB ALA 92 6.437 4.096 -4.186 732 H ASP 93 HN ASP 93 6.300 1.847 -5.597 733 HA ASP 93 HA ASP 93 4.945 -0.269 -4.483 734 HB2 ASP 93 2HB ASP 93 5.680 0.049 -7.427 735 HB3 ASP 93 3HB ASP 93 4.302 -0.823 -6.789 736 HD2 ASP 93 HD2 ASP 93 2.266 1.124 -7.228 737 H LEU 94 HN LEU 94 7.942 -0.088 -6.516 738 HA LEU 94 HA LEU 94 8.307 -2.863 -6.742 739 HB2 LEU 94 2HB LEU 94 9.282 -1.038 -8.170 740 HB3 LEU 94 3HB LEU 94 10.406 -0.698 -6.869 741 HG LEU 94 HG LEU 94 11.090 -2.232 -8.881 742 HD11 LEU 94 1HD1 LEU 94 12.463 -1.654 -6.887 743 HD12 LEU 94 2HD1 LEU 94 11.776 -3.066 -6.049 744 HD13 LEU 94 3HD1 LEU 94 12.760 -3.292 -7.515 745 HD21 LEU 94 3HD2 LEU 94 10.771 -4.623 -8.452 746 HD22 LEU 94 1HD2 LEU 94 9.730 -4.239 -7.060 747 HD23 LEU 94 2HD2 LEU 94 9.218 -3.789 -8.704 748 H ILE 95 HN ILE 95 9.233 -0.432 -4.287 749 HA ILE 95 HA ILE 95 10.884 -2.313 -2.882 750 HB ILE 95 HB ILE 95 9.961 0.503 -2.372 751 HG12 ILE 95 2HG1 ILE 95 12.772 -0.555 -2.697 752 HG13 ILE 95 3HG1 ILE 95 11.787 -0.096 -4.071 753 HG21 ILE 95 1HG2 ILE 95 11.336 -1.404 -0.498 754 HG22 ILE 95 2HG2 ILE 95 11.675 0.343 -0.429 755 HG23 ILE 95 3HG2 ILE 95 10.016 -0.253 -0.182 756 HD11 ILE 95 3HD1 ILE 95 13.182 1.610 -2.131 757 HD12 ILE 95 1HD1 ILE 95 12.524 2.025 -3.732 758 HD13 ILE 95 2HD1 ILE 95 11.468 2.059 -2.300 759 H ALA 96 HN ALA 96 7.513 -1.646 -3.176 760 HA ALA 96 HA ALA 96 6.790 -2.349 -0.510 761 HB1 ALA 96 3HB ALA 96 4.580 -2.750 -2.171 762 HB2 ALA 96 1HB ALA 96 4.997 -1.245 -1.317 763 HB3 ALA 96 2HB ALA 96 5.517 -1.486 -3.003 764 H TYR 97 HN TYR 97 7.133 -4.034 -3.669 765 HA TYR 97 HA TYR 97 6.172 -6.508 -2.524 766 HB2 TYR 97 2HB TYR 97 5.617 -6.138 -4.838 767 HB3 TYR 97 3HB TYR 97 7.151 -5.358 -5.170 768 HD1 TYR 97 HD2 TYR 97 6.433 -8.711 -3.651 769 HD2 TYR 97 HD1 TYR 97 8.124 -6.543 -6.930 770 HE1 TYR 97 HE2 TYR 97 7.330 -10.878 -4.632 771 HE2 TYR 97 HE1 TYR 97 9.015 -8.717 -7.899 772 HH TYR 97 HH TYR 97 8.109 -11.803 -6.535 773 H LEU 98 HN LEU 98 9.234 -4.842 -3.159 774 HA LEU 98 HA LEU 98 10.816 -7.210 -3.056 775 HB2 LEU 98 2HB LEU 98 11.276 -4.275 -3.204 776 HB3 LEU 98 3HB LEU 98 12.583 -5.265 -2.587 777 HG LEU 98 HG LEU 98 11.283 -5.401 -5.312 778 HD11 LEU 98 1HD1 LEU 98 13.123 -3.698 -4.707 779 HD12 LEU 98 2HD1 LEU 98 14.217 -5.103 -4.704 780 HD13 LEU 98 3HD1 LEU 98 13.320 -4.678 -6.182 781 HD21 LEU 98 3HD2 LEU 98 11.576 -7.637 -5.116 782 HD22 LEU 98 1HD2 LEU 98 13.251 -7.211 -5.539 783 HD23 LEU 98 2HD2 LEU 98 12.804 -7.482 -3.838 784 H LYS 99 HN LYS 99 9.474 -4.885 -0.732 785 HA LYS 99 HA LYS 99 11.160 -5.872 1.391 786 HB2 LYS 99 2HB LYS 99 10.622 -3.519 1.364 787 HB3 LYS 99 3HB LYS 99 8.903 -3.852 1.302 788 HG2 LYS 99 2HG LYS 99 9.037 -4.968 3.538 789 HG3 LYS 99 3HG LYS 99 10.756 -4.641 3.601 790 HD2 LYS 99 2HD LYS 99 10.225 -2.159 3.384 791 HD3 LYS 99 3HD LYS 99 8.523 -2.560 3.506 792 HE2 LYS 99 2HE LYS 99 10.541 -3.421 5.623 793 HE3 LYS 99 3HE LYS 99 9.719 -1.875 5.697 794 HZ1 LYS 99 2HZ LYS 99 8.698 -4.408 6.411 795 HZ3 LYS 99 1HZ LYS 99 7.759 -3.801 5.227 796 H LYS 100 HN LYS 100 8.285 -6.829 -0.228 797 HA LYS 100 HA LYS 100 7.408 -8.319 2.141 798 HB2 LYS 100 2HB LYS 100 5.792 -6.728 1.037 799 HB3 LYS 100 3HB LYS 100 5.839 -7.748 -0.386 800 HG2 LYS 100 2HG LYS 100 5.280 -9.705 1.309 801 HG3 LYS 100 3HG LYS 100 4.775 -8.410 2.376 802 HD2 LYS 100 2HD LYS 100 3.449 -7.583 0.188 803 HD3 LYS 100 3HD LYS 100 3.587 -9.271 -0.262 804 HE2 LYS 100 2HE LYS 100 2.597 -8.514 2.507 805 HE3 LYS 100 3HE LYS 100 1.499 -8.474 1.142 806 HZ1 LYS 100 2HZ LYS 100 1.549 -10.741 0.957 807 HZ3 LYS 100 1HZ LYS 100 1.940 -10.685 2.537 808 H ALA 101 HN ALA 101 9.113 -8.519 -0.836 809 HA ALA 101 HA ALA 101 8.357 -11.209 -1.459 810 HB1 ALA 101 3HB ALA 101 10.411 -9.221 -2.445 811 HB2 ALA 101 1HB ALA 101 10.453 -10.918 -2.980 812 HB3 ALA 101 2HB ALA 101 9.019 -9.916 -3.309 813 H THR 102 HN THR 102 11.208 -9.549 0.041 814 HA THR 102 HA THR 102 12.327 -12.143 0.739 815 HB THR 102 HB THR 102 14.299 -10.822 1.296 816 HG1 THR 102 HG1 THR 102 13.630 -8.959 2.315 817 HG21 THR 102 1HG2 THR 102 13.032 -10.545 -1.253 818 HG22 THR 102 2HG2 THR 102 13.580 -8.916 -0.791 819 HG23 THR 102 3HG2 THR 102 14.746 -10.258 -0.871 820 H ASN 103 HN ASN 103 9.721 -10.903 1.889 821 HA ASN 103 HA ASN 103 10.595 -10.904 4.662 822 HB2 ASN 103 2HB ASN 103 9.284 -8.919 4.057 823 HB3 ASN 103 3HB ASN 103 8.040 -9.901 3.309 824 HD21 ASN 103 1HD2 ASN 103 7.157 -8.184 5.057 825 HD22 ASN 103 2HD2 ASN 103 6.710 -8.898 6.570 826 H GLU 104 HN GLU 104 8.292 -12.276 2.243 827 HA GLU 104 HA GLU 104 6.940 -13.915 4.055 828 HB2 GLU 104 2HB GLU 104 7.278 -14.075 1.031 829 HB3 GLU 104 3HB GLU 104 6.199 -15.120 1.934 830 HG2 GLU 104 2HG GLU 104 6.015 -12.109 2.268 831 HG3 GLU 104 3HG GLU 104 5.267 -12.881 0.883 832 HE2 GLU 104 HE2 GLU 104 5.114 -13.009 4.463 833 HHA HEC 500 HHA HEC 500 23.760 -7.751 -5.373 834 HHB HEC 500 HHB HEC 500 17.783 -5.474 -5.329 835 HHC HEC 500 HHC HEC 500 17.779 -6.136 -11.743 836 HHD HEC 500 HHD HEC 500 22.958 -9.870 -11.306 837 HMA1 HEC 500 1HMA HEC 500 18.562 -5.670 -3.149 838 HMA2 HEC 500 2HMA HEC 500 20.072 -5.810 -2.243 839 HMA3 HEC 500 3HMA HEC 500 19.777 -4.367 -3.228 840 HAA1 HEC 500 1HAA HEC 500 23.531 -6.493 -3.514 841 HAA2 HEC 500 2HAA HEC 500 22.244 -6.093 -2.491 842 HBA1 HEC 500 1HBA HEC 500 23.272 -8.811 -3.215 843 HBA2 HEC 500 2HBA HEC 500 22.755 -8.185 -1.638 844 HMB1 HEC 500 1HMB HEC 500 14.653 -5.432 -7.455 845 HMB2 HEC 500 2HMB HEC 500 15.650 -5.523 -6.020 846 HMB3 HEC 500 3HMB HEC 500 15.573 -3.992 -6.918 847 HAB HEC 500 HAB HEC 500 16.219 -4.760 -11.149 848 HBB1 HEC 500 1HBB HEC 500 14.639 -3.212 -10.702 849 HBB2 HEC 500 2HBB HEC 500 14.209 -3.999 -9.160 850 HBB3 HEC 500 3HBB HEC 500 15.680 -3.055 -9.283 851 HMC1 HEC 500 1HMC HEC 500 18.000 -8.700 -13.771 852 HMC2 HEC 500 2HMC HEC 500 18.128 -6.936 -13.741 853 HMC3 HEC 500 3HMC HEC 500 19.279 -7.866 -14.677 854 HAC HEC 500 HAC HEC 500 21.873 -10.550 -12.976 855 HBC1 HEC 500 1HBC HEC 500 20.786 -8.996 -15.325 856 HBC2 HEC 500 2HBC HEC 500 22.354 -8.682 -14.548 857 HBC3 HEC 500 3HBC HEC 500 22.064 -10.239 -15.321 858 HMD1 HEC 500 1HMD HEC 500 24.760 -11.480 -9.580 859 HMD2 HEC 500 2HMD HEC 500 25.184 -10.146 -10.666 860 HMD3 HEC 500 3HMD HEC 500 26.080 -10.412 -9.143 861 HAD1 HEC 500 1HAD HEC 500 25.433 -8.971 -5.743 862 HAD2 HEC 500 2HAD HEC 500 25.937 -10.172 -6.853 863 HBD1 HEC 500 1HBD HEC 500 27.255 -8.664 -8.074 864 HBD2 HEC 500 2HBD HEC 500 26.154 -7.312 -7.735 Start of MODEL 9 1 H1 GLY 1 HN GLY 1 0.641 0.003 0.139 2 HA2 GLY 1 1HA GLY 1 1.891 0.720 -1.712 3 HA3 GLY 1 2HA GLY 1 3.346 0.048 -1.006 4 H ASP 2 HN ASP 2 0.901 -0.437 -3.314 5 HA ASP 2 HA ASP 2 0.298 -3.039 -3.290 6 HB2 ASP 2 2HB ASP 2 0.628 -2.787 -5.933 7 HB3 ASP 2 3HB ASP 2 -0.654 -1.936 -5.093 8 HD2 ASP 2 HD2 ASP 2 0.562 0.773 -6.863 9 H VAL 3 HN VAL 3 1.274 -4.964 -4.407 10 HA VAL 3 HA VAL 3 4.203 -4.761 -4.489 11 HB VAL 3 HB VAL 3 3.826 -6.237 -2.802 12 HG11 VAL 3 1HG1 VAL 3 1.342 -7.218 -4.250 13 HG12 VAL 3 2HG1 VAL 3 1.932 -7.834 -2.688 14 HG13 VAL 3 3HG1 VAL 3 1.394 -6.143 -2.832 15 HG21 VAL 3 3HG2 VAL 3 4.746 -7.352 -5.113 16 HG22 VAL 3 1HG2 VAL 3 4.703 -8.184 -3.540 17 HG23 VAL 3 2HG2 VAL 3 3.398 -8.448 -4.722 18 H GLU 4 HN GLU 4 1.233 -6.003 -6.085 19 HA GLU 4 HA GLU 4 2.389 -7.422 -8.090 20 HB2 GLU 4 2HB GLU 4 -0.146 -5.763 -7.955 21 HB3 GLU 4 3HB GLU 4 0.282 -6.611 -9.428 22 HG2 GLU 4 2HG GLU 4 0.590 -8.708 -7.866 23 HG3 GLU 4 3HG GLU 4 -0.327 -7.784 -6.693 24 HE2 GLU 4 HE2 GLU 4 -1.868 -8.531 -10.282 25 H LYS 5 HN LYS 5 1.655 -3.873 -7.986 26 HA LYS 5 HA LYS 5 2.531 -3.296 -10.558 27 HB2 LYS 5 2HB LYS 5 1.956 -1.790 -8.068 28 HB3 LYS 5 3HB LYS 5 3.022 -0.990 -9.206 29 HG2 LYS 5 2HG LYS 5 0.823 -0.333 -9.867 30 HG3 LYS 5 3HG LYS 5 1.294 -1.551 -11.036 31 HD2 LYS 5 2HD LYS 5 0.066 -2.868 -8.758 32 HD3 LYS 5 3HD LYS 5 -0.984 -1.571 -9.293 33 HE2 LYS 5 2HE LYS 5 0.202 -3.673 -11.166 34 HE3 LYS 5 3HE LYS 5 -1.393 -3.797 -10.451 35 HZ1 LYS 5 2HZ LYS 5 -2.120 -1.909 -11.649 36 HZ3 LYS 5 1HZ LYS 5 -1.244 -2.733 -12.746 37 H GLY 6 HN GLY 6 4.277 -4.257 -7.700 38 HA2 GLY 6 1HA GLY 6 6.801 -3.186 -8.751 39 HA3 GLY 6 2HA GLY 6 6.516 -3.838 -7.150 40 H LYS 7 HN LYS 7 4.872 -6.128 -8.494 41 HA LYS 7 HA LYS 7 7.109 -7.895 -8.721 42 HB2 LYS 7 2HB LYS 7 4.929 -8.428 -7.578 43 HB3 LYS 7 3HB LYS 7 4.167 -8.476 -9.155 44 HG2 LYS 7 2HG LYS 7 5.270 -10.432 -9.795 45 HG3 LYS 7 3HG LYS 7 6.679 -10.094 -8.812 46 HD2 LYS 7 2HD LYS 7 5.576 -10.785 -6.789 47 HD3 LYS 7 3HD LYS 7 3.991 -10.727 -7.535 48 HE2 LYS 7 2HE LYS 7 6.151 -12.627 -8.536 49 HE3 LYS 7 3HE LYS 7 5.086 -13.068 -7.215 50 HZ1 LYS 7 2HZ LYS 7 3.729 -12.009 -9.550 51 HZ3 LYS 7 1HZ LYS 7 3.341 -13.297 -8.633 52 H LYS 8 HN LYS 8 5.076 -6.006 -10.878 53 HA LYS 8 HA LYS 8 5.738 -7.613 -13.175 54 HB2 LYS 8 2HB LYS 8 4.073 -5.175 -12.645 55 HB3 LYS 8 3HB LYS 8 4.598 -5.503 -14.284 56 HG2 LYS 8 2HG LYS 8 3.309 -7.684 -12.604 57 HG3 LYS 8 3HG LYS 8 2.323 -6.523 -13.469 58 HD2 LYS 8 2HD LYS 8 4.465 -8.274 -14.768 59 HD3 LYS 8 3HD LYS 8 2.750 -8.639 -14.773 60 HE2 LYS 8 2HE LYS 8 2.563 -6.152 -15.769 61 HE3 LYS 8 3HE LYS 8 4.229 -6.444 -16.229 62 HZ1 LYS 8 2HZ LYS 8 1.819 -7.731 -17.231 63 HZ3 LYS 8 1HZ LYS 8 3.105 -8.715 -17.054 64 H ILE 9 HN ILE 9 6.652 -4.434 -11.733 65 HA ILE 9 HA ILE 9 8.417 -3.771 -13.838 66 HB ILE 9 HB ILE 9 7.918 -2.758 -11.060 67 HG12 ILE 9 2HG1 ILE 9 7.777 -1.176 -13.610 68 HG13 ILE 9 3HG1 ILE 9 6.491 -2.302 -13.221 69 HG21 ILE 9 1HG2 ILE 9 9.573 -0.867 -12.131 70 HG22 ILE 9 2HG2 ILE 9 10.056 -2.099 -10.941 71 HG23 ILE 9 3HG2 ILE 9 10.347 -2.375 -12.675 72 HD11 ILE 9 3HD1 ILE 9 6.773 -1.041 -10.799 73 HD12 ILE 9 1HD1 ILE 9 7.215 0.274 -11.915 74 HD13 ILE 9 2HD1 ILE 9 5.630 -0.523 -12.061 75 H PHE 10 HN PHE 10 8.711 -5.547 -10.742 76 HA PHE 10 HA PHE 10 11.479 -5.604 -10.606 77 HB2 PHE 10 2HB PHE 10 10.180 -6.364 -8.724 78 HB3 PHE 10 3HB PHE 10 9.129 -7.338 -9.733 79 HD1 PHE 10 HD2 PHE 10 12.660 -7.154 -8.555 80 HD2 PHE 10 HD1 PHE 10 9.472 -9.632 -9.860 81 HE1 PHE 10 HE2 PHE 10 14.016 -9.191 -7.997 82 HE2 PHE 10 HE1 PHE 10 10.828 -11.669 -9.302 83 HZ PHE 10 HZ PHE 10 13.083 -11.424 -8.378 84 H ILE 11 HN ILE 11 9.318 -7.087 -12.887 85 HA ILE 11 HA ILE 11 11.111 -9.265 -13.487 86 HB ILE 11 HB ILE 11 8.424 -8.350 -14.424 87 HG12 ILE 11 2HG1 ILE 11 9.514 -10.976 -13.368 88 HG13 ILE 11 3HG1 ILE 11 8.574 -9.805 -12.466 89 HG21 ILE 11 1HG2 ILE 11 8.465 -10.154 -16.145 90 HG22 ILE 11 2HG2 ILE 11 9.528 -8.774 -16.512 91 HG23 ILE 11 3HG2 ILE 11 10.223 -10.293 -15.897 92 HD11 ILE 11 3HD1 ILE 11 6.771 -11.038 -13.127 93 HD12 ILE 11 1HD1 ILE 11 6.964 -10.203 -14.687 94 HD13 ILE 11 2HD1 ILE 11 7.677 -11.815 -14.447 95 H MET 12 HN MET 12 9.773 -6.413 -15.308 96 HA MET 12 HA MET 12 11.609 -6.688 -17.378 97 HB2 MET 12 2HB MET 12 9.725 -4.544 -16.354 98 HB3 MET 12 3HB MET 12 10.899 -4.076 -17.568 99 HG2 MET 12 2HG MET 12 9.025 -6.465 -17.900 100 HG3 MET 12 3HG MET 12 8.636 -4.858 -18.480 101 HE1 MET 12 3HE MET 12 10.007 -3.694 -20.694 102 HE2 MET 12 1HE MET 12 9.829 -5.009 -21.881 103 HE3 MET 12 2HE MET 12 8.549 -4.716 -20.679 104 H LYS 13 HN LYS 13 12.086 -5.713 -14.147 105 HA LYS 13 HA LYS 13 14.440 -4.134 -14.919 106 HB2 LYS 13 2HB LYS 13 12.678 -3.995 -12.461 107 HB3 LYS 13 3HB LYS 13 14.252 -3.231 -12.550 108 HG2 LYS 13 2HG LYS 13 13.465 -2.037 -14.668 109 HG3 LYS 13 3HG LYS 13 11.864 -2.685 -14.372 110 HD2 LYS 13 2HD LYS 13 12.114 -1.623 -11.978 111 HD3 LYS 13 3HD LYS 13 13.428 -0.703 -12.682 112 HE2 LYS 13 2HE LYS 13 10.675 -0.794 -13.982 113 HE3 LYS 13 3HE LYS 13 11.055 0.365 -12.724 114 HZ1 LYS 13 2HZ LYS 13 13.159 0.564 -14.470 115 HZ3 LYS 13 1HZ LYS 13 11.907 1.603 -14.386 116 H CYS 14 HN CYS 14 13.113 -6.835 -12.988 117 HA CYS 14 HA CYS 14 15.872 -7.734 -12.638 118 HB2 CYS 14 2HB CYS 14 13.912 -8.345 -10.480 119 HB3 CYS 14 3HB CYS 14 15.658 -8.206 -10.412 120 H SER 15 HN SER 15 15.232 -8.926 -14.670 121 HA SER 15 HA SER 15 13.397 -11.104 -14.051 122 HB2 SER 15 2HB SER 15 13.621 -11.286 -16.736 123 HB3 SER 15 3HB SER 15 12.436 -10.257 -15.957 124 HG SER 15 HG SER 15 13.360 -8.685 -17.082 125 H GLN 16 HN GLN 16 14.064 -13.284 -14.500 126 HA GLN 16 HA GLN 16 15.592 -14.856 -14.275 127 HB2 GLN 16 2HB GLN 16 16.195 -13.542 -16.934 128 HB3 GLN 16 3HB GLN 16 17.128 -14.932 -16.421 129 HG2 GLN 16 2HG GLN 16 15.048 -16.263 -16.153 130 HG3 GLN 16 3HG GLN 16 14.078 -14.869 -16.585 131 HE21 GLN 16 1HE2 GLN 16 13.328 -14.966 -18.547 132 HE22 GLN 16 2HE2 GLN 16 14.122 -15.593 -19.953 133 H CYS 17 HN CYS 17 16.326 -12.551 -12.727 134 HA CYS 17 HA CYS 17 19.226 -12.871 -12.828 135 HB2 CYS 17 2HB CYS 17 17.677 -10.343 -12.978 136 HB3 CYS 17 3HB CYS 17 19.063 -10.345 -11.906 137 H HIS 18 HN HIS 18 16.301 -11.714 -11.017 138 HA HIS 18 HA HIS 18 17.594 -12.709 -8.583 139 HB2 HIS 18 2HB HIS 18 15.763 -10.356 -9.045 140 HB3 HIS 18 3HB HIS 18 15.933 -11.078 -7.457 141 HD1 HIS 18 HD1 HIS 18 18.658 -11.296 -6.696 142 HD2 HIS 18 HD2 HIS 18 17.563 -8.355 -9.479 143 HE1 HIS 18 HE1 HIS 18 20.533 -9.566 -6.682 144 H THR 19 HN THR 19 16.590 -14.356 -7.505 145 HA THR 19 HA THR 19 14.175 -15.415 -8.696 146 HB THR 19 HB THR 19 14.690 -17.274 -7.015 147 HG1 THR 19 HG1 THR 19 15.782 -15.770 -5.514 148 HG21 THR 19 1HG2 THR 19 17.331 -16.632 -8.317 149 HG22 THR 19 2HG2 THR 19 16.429 -18.168 -8.291 150 HG23 THR 19 3HG2 THR 19 15.933 -16.863 -9.395 151 H VAL 20 HN VAL 20 15.172 -13.622 -5.794 152 HA VAL 20 HA VAL 20 14.022 -12.924 -4.022 153 HB VAL 20 HB VAL 20 11.928 -11.762 -4.573 154 HG11 VAL 20 1HG1 VAL 20 14.095 -10.692 -5.026 155 HG12 VAL 20 2HG1 VAL 20 14.107 -11.400 -6.659 156 HG13 VAL 20 3HG1 VAL 20 12.867 -10.201 -6.217 157 HG21 VAL 20 3HG2 VAL 20 11.055 -13.492 -6.156 158 HG22 VAL 20 1HG2 VAL 20 10.957 -11.828 -6.779 159 HG23 VAL 20 2HG2 VAL 20 12.234 -12.922 -7.360 160 H GLU 21 HN GLU 21 14.138 -15.615 -3.874 161 HA GLU 21 HA GLU 21 11.428 -16.274 -3.029 162 HB2 GLU 21 2HB GLU 21 12.019 -18.694 -3.639 163 HB3 GLU 21 3HB GLU 21 11.729 -17.606 -4.983 164 HG2 GLU 21 2HG GLU 21 14.269 -17.203 -5.062 165 HG3 GLU 21 3HG GLU 21 14.436 -18.511 -3.907 166 HE2 GLU 21 HE2 GLU 21 14.758 -19.476 -7.393 167 H LYS 22 HN LYS 22 11.740 -18.539 -1.602 168 HA LYS 22 HA LYS 22 13.321 -17.640 0.612 169 HB2 LYS 22 2HB LYS 22 11.018 -18.667 0.765 170 HB3 LYS 22 3HB LYS 22 11.736 -20.205 0.331 171 HG2 LYS 22 2HG LYS 22 13.330 -19.947 2.296 172 HG3 LYS 22 3HG LYS 22 12.458 -18.500 2.760 173 HD2 LYS 22 2HD LYS 22 11.265 -21.304 2.534 174 HD3 LYS 22 3HD LYS 22 11.645 -20.472 4.029 175 HE2 LYS 22 2HE LYS 22 10.013 -18.652 3.400 176 HE3 LYS 22 3HE LYS 22 9.600 -19.551 1.952 177 HZ1 LYS 22 2HZ LYS 22 8.882 -21.401 3.390 178 HZ3 LYS 22 1HZ LYS 22 8.047 -20.049 3.745 179 H GLY 23 HN GLY 23 15.510 -17.747 0.165 180 HA2 GLY 23 1HA GLY 23 17.491 -18.660 -0.469 181 HA3 GLY 23 2HA GLY 23 16.986 -19.926 0.634 182 H GLY 24 HN GLY 24 15.930 -18.903 -2.698 183 HA2 GLY 24 1HA GLY 24 15.806 -21.701 -3.494 184 HA3 GLY 24 2HA GLY 24 15.246 -20.305 -4.393 185 H LYS 25 HN LYS 25 16.338 -21.126 -6.314 186 HA LYS 25 HA LYS 25 19.001 -21.799 -6.450 187 HB2 LYS 25 2HB LYS 25 16.981 -20.756 -8.405 188 HB3 LYS 25 3HB LYS 25 18.658 -20.862 -8.899 189 HG2 LYS 25 2HG LYS 25 17.356 -22.944 -9.428 190 HG3 LYS 25 3HG LYS 25 18.737 -23.251 -8.392 191 HD2 LYS 25 2HD LYS 25 17.328 -23.376 -6.408 192 HD3 LYS 25 3HD LYS 25 15.933 -22.782 -7.286 193 HE2 LYS 25 2HE LYS 25 17.365 -25.410 -7.908 194 HE3 LYS 25 3HE LYS 25 15.911 -25.284 -6.939 195 HZ1 LYS 25 2HZ LYS 25 14.649 -24.911 -8.782 196 HZ3 LYS 25 1HZ LYS 25 15.875 -25.613 -9.592 197 H HIS 26 HN HIS 26 20.426 -20.215 -8.144 198 HA HIS 26 HA HIS 26 20.495 -17.614 -6.812 199 HB2 HIS 26 2HB HIS 26 22.783 -19.545 -7.222 200 HB3 HIS 26 3HB HIS 26 23.046 -17.831 -6.976 201 HD1 HIS 26 HD1 HIS 26 23.065 -16.995 -4.591 202 HD2 HIS 26 HD2 HIS 26 21.431 -20.842 -4.944 203 HE1 HIS 26 HE1 HIS 26 22.711 -17.843 -2.210 204 H LYS 27 HN LYS 27 19.231 -17.074 -8.815 205 HA LYS 27 HA LYS 27 20.207 -17.420 -11.366 206 HB2 LYS 27 2HB LYS 27 18.438 -15.316 -10.112 207 HB3 LYS 27 3HB LYS 27 18.825 -15.293 -11.821 208 HG2 LYS 27 2HG LYS 27 17.649 -17.725 -10.397 209 HG3 LYS 27 3HG LYS 27 16.674 -16.526 -11.222 210 HD2 LYS 27 2HD LYS 27 18.805 -18.319 -12.472 211 HD3 LYS 27 3HD LYS 27 17.075 -18.404 -12.741 212 HE2 LYS 27 2HE LYS 27 17.243 -15.963 -13.612 213 HE3 LYS 27 3HE LYS 27 18.979 -16.192 -13.616 214 HZ1 LYS 27 2HZ LYS 27 18.031 -18.412 -14.898 215 HZ3 LYS 27 1HZ LYS 27 18.653 -17.102 -15.638 216 H THR 28 HN THR 28 20.614 -15.030 -12.647 217 HA THR 28 HA THR 28 23.256 -14.579 -12.514 218 HB THR 28 HB THR 28 21.247 -12.326 -12.962 219 HG1 THR 28 HG1 THR 28 20.973 -13.460 -15.055 220 HG21 THR 28 1HG2 THR 28 24.000 -13.061 -13.908 221 HG22 THR 28 2HG2 THR 28 22.882 -12.457 -15.154 222 HG23 THR 28 3HG2 THR 28 23.258 -11.453 -13.733 223 H GLY 29 HN GLY 29 20.842 -13.422 -10.196 224 HA2 GLY 29 1HA GLY 29 23.009 -11.996 -8.774 225 HA3 GLY 29 2HA GLY 29 21.315 -11.550 -8.724 226 HA PRO 30 HA PRO 30 22.336 -14.631 -5.397 227 HB2 PRO 30 2HB PRO 30 22.768 -13.012 -3.239 228 HB3 PRO 30 3HB PRO 30 24.065 -13.701 -4.196 229 HG2 PRO 30 2HG PRO 30 23.055 -10.922 -4.171 230 HG3 PRO 30 3HG PRO 30 24.584 -11.530 -4.776 231 HD2 PRO 30 2HD PRO 30 22.302 -10.767 -6.337 232 HD3 PRO 30 3HD PRO 30 23.786 -11.483 -6.932 233 H ASN 31 HN ASN 31 20.892 -15.510 -3.895 234 HA ASN 31 HA ASN 31 18.310 -14.717 -4.314 235 HB2 ASN 31 2HB ASN 31 19.092 -16.940 -3.360 236 HB3 ASN 31 3HB ASN 31 19.430 -16.137 -1.839 237 HD21 ASN 31 1HD2 ASN 31 16.976 -17.189 -4.080 238 HD22 ASN 31 2HD2 ASN 31 15.604 -17.060 -3.031 239 H LEU 32 HN LEU 32 16.813 -13.451 -3.009 240 HA LEU 32 HA LEU 32 18.090 -11.892 -0.873 241 HB2 LEU 32 2HB LEU 32 16.000 -10.755 -2.705 242 HB3 LEU 32 3HB LEU 32 17.081 -9.915 -1.610 243 HG LEU 32 HG LEU 32 17.923 -11.331 -4.155 244 HD11 LEU 32 1HD1 LEU 32 18.482 -8.646 -4.454 245 HD12 LEU 32 2HD1 LEU 32 17.109 -9.520 -5.174 246 HD13 LEU 32 3HD1 LEU 32 16.898 -8.640 -3.641 247 HD21 LEU 32 3HD2 LEU 32 19.860 -11.428 -2.963 248 HD22 LEU 32 1HD2 LEU 32 20.011 -9.778 -3.615 249 HD23 LEU 32 2HD2 LEU 32 19.444 -10.027 -1.946 250 H HIS 33 HN HIS 33 17.262 -13.461 0.645 251 HA HIS 33 HA HIS 33 14.345 -13.504 0.792 252 HB2 HIS 33 2HB HIS 33 14.975 -15.705 0.805 253 HB3 HIS 33 3HB HIS 33 16.511 -15.390 1.585 254 HD1 HIS 33 HD1 HIS 33 12.809 -15.132 2.597 255 HD2 HIS 33 HD2 HIS 33 16.528 -16.291 4.152 256 HE1 HIS 33 HE1 HIS 33 12.361 -15.986 4.959 257 H GLY 34 HN GLY 34 17.363 -12.758 2.594 258 HA2 GLY 34 1HA GLY 34 15.753 -11.682 4.808 259 HA3 GLY 34 2HA GLY 34 17.459 -12.079 4.847 260 H LEU 35 HN LEU 35 16.030 -10.380 2.061 261 HA LEU 35 HA LEU 35 17.844 -8.418 1.861 262 HB2 LEU 35 2HB LEU 35 16.013 -8.937 0.285 263 HB3 LEU 35 3HB LEU 35 14.880 -8.130 1.350 264 HG LEU 35 HG LEU 35 16.493 -6.072 1.057 265 HD11 LEU 35 1HD1 LEU 35 17.221 -6.250 -1.506 266 HD12 LEU 35 2HD1 LEU 35 18.296 -6.710 -0.165 267 HD13 LEU 35 3HD1 LEU 35 17.400 -7.963 -1.055 268 HD21 LEU 35 3HD2 LEU 35 14.664 -6.921 -1.204 269 HD22 LEU 35 1HD2 LEU 35 14.118 -6.241 0.347 270 HD23 LEU 35 2HD2 LEU 35 15.123 -5.263 -0.749 271 H PHE 36 HN PHE 36 14.632 -7.817 3.457 272 HA PHE 36 HA PHE 36 15.692 -5.515 4.760 273 HB2 PHE 36 2HB PHE 36 13.124 -7.164 4.707 274 HB3 PHE 36 3HB PHE 36 13.305 -5.945 5.953 275 HD1 PHE 36 HD1 PHE 36 13.507 -3.551 5.323 276 HD2 PHE 36 HD2 PHE 36 12.667 -6.553 2.442 277 HE1 PHE 36 HE1 PHE 36 12.710 -1.791 3.720 278 HE2 PHE 36 HE2 PHE 36 11.871 -4.793 0.840 279 HZ PHE 36 HZ PHE 36 11.903 -2.433 1.498 280 H GLY 37 HN GLY 37 17.356 -6.047 6.202 281 HA2 GLY 37 1HA GLY 37 17.529 -6.346 8.608 282 HA3 GLY 37 2HA GLY 37 16.537 -7.783 8.455 283 H ARG 38 HN ARG 38 19.065 -6.869 6.085 284 HA ARG 38 HA ARG 38 20.842 -8.803 7.266 285 HB2 ARG 38 2HB ARG 38 19.511 -10.141 5.665 286 HB3 ARG 38 3HB ARG 38 19.809 -8.976 4.391 287 HG2 ARG 38 2HG ARG 38 22.277 -9.448 4.567 288 HG3 ARG 38 3HG ARG 38 21.943 -10.651 5.797 289 HD2 ARG 38 2HD ARG 38 20.757 -10.747 2.982 290 HD3 ARG 38 3HD ARG 38 22.223 -11.590 3.443 291 HE ARG 38 HE ARG 38 19.524 -12.419 4.040 292 HH11 ARG 38 2HH2 ARG 38 22.782 -12.398 5.433 293 HH12 ARG 38 1HH2 ARG 38 22.500 -13.786 6.429 294 HH22 ARG 38 HH1 ARG 38 20.358 -14.859 6.366 295 H LYS 39 HN LYS 39 23.047 -8.310 6.856 296 HA LYS 39 HA LYS 39 23.519 -5.698 5.797 297 HB2 LYS 39 2HB LYS 39 25.073 -7.781 7.254 298 HB3 LYS 39 3HB LYS 39 25.988 -6.656 6.273 299 HG2 LYS 39 2HG LYS 39 25.812 -5.662 8.462 300 HG3 LYS 39 3HG LYS 39 24.738 -4.751 7.420 301 HD2 LYS 39 2HD LYS 39 23.431 -5.153 9.362 302 HD3 LYS 39 3HD LYS 39 22.854 -6.348 8.217 303 HE2 LYS 39 2HE LYS 39 24.326 -8.074 9.239 304 HE3 LYS 39 3HE LYS 39 24.975 -6.885 10.351 305 HZ1 LYS 39 2HZ LYS 39 22.874 -6.692 11.418 306 HZ3 LYS 39 1HZ LYS 39 23.082 -8.296 11.223 307 H THR 40 HN THR 40 25.862 -5.774 4.416 308 HA THR 40 HA THR 40 25.035 -7.162 1.973 309 HB THR 40 HB THR 40 26.840 -5.507 1.045 310 HG1 THR 40 HG1 THR 40 27.586 -5.233 3.385 311 HG21 THR 40 1HG2 THR 40 25.218 -3.457 1.837 312 HG22 THR 40 2HG2 THR 40 24.757 -4.593 0.547 313 HG23 THR 40 3HG2 THR 40 24.149 -4.833 2.202 314 H GLY 41 HN GLY 41 26.013 -8.950 1.269 315 HA2 GLY 41 1HA GLY 41 27.804 -10.311 0.794 316 HA3 GLY 41 2HA GLY 41 28.828 -9.373 1.862 317 H GLN 42 HN GLN 42 25.832 -11.434 2.062 318 HA GLN 42 HA GLN 42 27.060 -12.644 4.416 319 HB2 GLN 42 2HB GLN 42 24.096 -12.081 3.965 320 HB3 GLN 42 3HB GLN 42 24.758 -12.933 5.346 321 HG2 GLN 42 2HG GLN 42 25.481 -10.066 4.575 322 HG3 GLN 42 3HG GLN 42 24.310 -10.496 5.804 323 HE21 GLN 42 1HE2 GLN 42 27.493 -9.767 5.163 324 HE22 GLN 42 2HE2 GLN 42 28.247 -10.309 6.626 325 H ALA 43 HN ALA 43 24.883 -13.005 1.571 326 HA ALA 43 HA ALA 43 24.102 -15.558 1.691 327 HB1 ALA 43 3HB ALA 43 25.332 -14.183 -0.732 328 HB2 ALA 43 1HB ALA 43 24.202 -15.557 -0.766 329 HB3 ALA 43 2HB ALA 43 23.660 -13.973 -0.164 330 HA PRO 44 HA PRO 44 28.060 -17.493 2.165 331 HB2 PRO 44 2HB PRO 44 27.158 -19.714 3.477 332 HB3 PRO 44 3HB PRO 44 27.643 -18.245 4.301 333 HG2 PRO 44 2HG PRO 44 24.918 -19.281 3.810 334 HG3 PRO 44 3HG PRO 44 25.442 -18.076 4.969 335 HD2 PRO 44 2HD PRO 44 24.097 -17.595 2.481 336 HD3 PRO 44 3HD PRO 44 24.724 -16.387 3.584 337 H GLY 45 HN GLY 45 25.250 -18.395 0.530 338 HA2 GLY 45 1HA GLY 45 26.310 -20.826 -0.582 339 HA3 GLY 45 2HA GLY 45 24.839 -19.989 -1.035 340 H TYR 46 HN TYR 46 25.705 -17.441 -1.766 341 HA TYR 46 HA TYR 46 27.753 -17.940 -3.807 342 HB2 TYR 46 2HB TYR 46 25.442 -18.132 -4.777 343 HB3 TYR 46 3HB TYR 46 24.968 -16.636 -3.997 344 HD1 TYR 46 HD1 TYR 46 27.994 -17.525 -6.035 345 HD2 TYR 46 HD2 TYR 46 24.518 -15.061 -5.646 346 HE1 TYR 46 HE1 TYR 46 28.678 -16.222 -8.108 347 HE2 TYR 46 HE2 TYR 46 25.213 -13.766 -7.719 348 HH TYR 46 HH TYR 46 27.232 -14.824 -9.912 349 H SER 47 HN SER 47 29.315 -16.739 -2.638 350 HA SER 47 HA SER 47 28.733 -14.282 -1.478 351 HB2 SER 47 2HB SER 47 31.234 -14.003 -1.438 352 HB3 SER 47 3HB SER 47 30.690 -15.537 -0.789 353 HG SER 47 HG SER 47 32.541 -15.653 -2.312 354 H TYR 48 HN TYR 48 29.133 -12.110 -2.212 355 HA TYR 48 HA TYR 48 28.945 -11.847 -5.091 356 HB2 TYR 48 2HB TYR 48 29.132 -9.629 -2.997 357 HB3 TYR 48 3HB TYR 48 28.180 -9.631 -4.470 358 HD1 TYR 48 HD2 TYR 48 27.097 -12.569 -3.835 359 HD2 TYR 48 HD1 TYR 48 27.203 -8.874 -1.682 360 HE1 TYR 48 HE2 TYR 48 25.049 -13.276 -2.506 361 HE2 TYR 48 HE1 TYR 48 25.154 -9.593 -0.360 362 HH TYR 48 HH TYR 48 23.650 -11.107 -0.059 363 H THR 49 HN THR 49 30.119 -9.491 -5.710 364 HA THR 49 HA THR 49 32.799 -10.154 -6.021 365 HB THR 49 HB THR 49 32.942 -7.774 -6.831 366 HG1 THR 49 HG1 THR 49 30.771 -6.645 -6.546 367 HG21 THR 49 1HG2 THR 49 30.516 -7.911 -8.103 368 HG22 THR 49 2HG2 THR 49 31.938 -8.844 -8.631 369 HG23 THR 49 3HG2 THR 49 30.701 -9.611 -7.606 370 H ALA 50 HN ALA 50 34.603 -8.441 -5.352 371 HA ALA 50 HA ALA 50 34.678 -8.652 -2.472 372 HB1 ALA 50 3HB ALA 50 36.921 -8.721 -2.780 373 HB2 ALA 50 1HB ALA 50 36.529 -8.935 -4.503 374 HB3 ALA 50 2HB ALA 50 36.905 -7.314 -3.870 375 H ALA 51 HN ALA 51 33.722 -6.360 -4.872 376 HA ALA 51 HA ALA 51 34.424 -4.042 -3.319 377 HB1 ALA 51 3HB ALA 51 33.248 -2.846 -5.135 378 HB2 ALA 51 1HB ALA 51 34.428 -4.008 -5.786 379 HB3 ALA 51 2HB ALA 51 32.691 -4.401 -5.798 380 H ASN 52 HN ASN 52 31.730 -6.304 -3.678 381 HA ASN 52 HA ASN 52 29.918 -4.503 -2.385 382 HB2 ASN 52 2HB ASN 52 29.395 -6.365 -4.193 383 HB3 ASN 52 3HB ASN 52 29.440 -7.477 -2.840 384 HD21 ASN 52 1HD2 ASN 52 27.999 -7.178 -1.075 385 HD22 ASN 52 2HD2 ASN 52 26.471 -6.387 -1.281 386 H LYS 53 HN LYS 53 31.449 -7.757 -1.786 387 HA LYS 53 HA LYS 53 30.507 -8.354 0.659 388 HB2 LYS 53 2HB LYS 53 32.302 -9.477 -0.925 389 HB3 LYS 53 3HB LYS 53 33.442 -8.701 0.155 390 HG2 LYS 53 2HG LYS 53 31.807 -9.750 2.033 391 HG3 LYS 53 3HG LYS 53 31.448 -10.879 0.743 392 HD2 LYS 53 2HD LYS 53 34.013 -11.150 0.468 393 HD3 LYS 53 3HD LYS 53 34.166 -10.290 1.988 394 HE2 LYS 53 2HE LYS 53 32.707 -12.931 1.519 395 HE3 LYS 53 3HE LYS 53 34.172 -12.692 2.451 396 HZ1 LYS 53 2HZ LYS 53 32.542 -12.673 4.082 397 HZ3 LYS 53 1HZ LYS 53 31.426 -11.921 3.164 398 H ASN 54 HN ASN 54 32.740 -5.735 -0.201 399 HA ASN 54 HA ASN 54 33.725 -5.275 2.346 400 HB2 ASN 54 2HB ASN 54 33.395 -3.623 -0.175 401 HB3 ASN 54 3HB ASN 54 33.863 -2.796 1.298 402 HD21 ASN 54 1HD2 ASN 54 34.640 -6.128 0.455 403 HD22 ASN 54 2HD2 ASN 54 36.356 -5.940 0.300 404 H LYS 55 HN LYS 55 30.995 -3.776 0.454 405 HA LYS 55 HA LYS 55 30.104 -1.897 2.143 406 HB2 LYS 55 2HB LYS 55 29.192 -2.838 -0.139 407 HB3 LYS 55 3HB LYS 55 28.104 -3.752 0.885 408 HG2 LYS 55 2HG LYS 55 26.923 -1.734 0.447 409 HG3 LYS 55 3HG LYS 55 27.561 -1.510 2.064 410 HD2 LYS 55 2HD LYS 55 29.428 -0.162 1.207 411 HD3 LYS 55 3HD LYS 55 28.975 -0.510 -0.450 412 HE2 LYS 55 2HE LYS 55 27.016 0.841 -0.339 413 HE3 LYS 55 3HE LYS 55 26.972 0.804 1.412 414 HZ1 LYS 55 2HZ LYS 55 28.463 2.567 -0.307 415 HZ3 LYS 55 1HZ LYS 55 29.378 1.956 0.893 416 H GLY 56 HN GLY 56 28.902 -1.721 4.044 417 HA2 GLY 56 1HA GLY 56 28.115 -4.226 5.364 418 HA3 GLY 56 2HA GLY 56 29.236 -3.153 6.177 419 H ILE 57 HN ILE 57 26.068 -2.994 4.392 420 HA ILE 57 HA ILE 57 25.079 -1.330 6.586 421 HB ILE 57 HB ILE 57 23.873 0.043 4.876 422 HG12 ILE 57 2HG1 ILE 57 25.333 0.023 2.628 423 HG13 ILE 57 3HG1 ILE 57 25.496 -1.670 3.049 424 HG21 ILE 57 1HG2 ILE 57 26.504 0.844 4.156 425 HG22 ILE 57 2HG2 ILE 57 25.439 1.516 5.413 426 HG23 ILE 57 3HG2 ILE 57 26.566 0.198 5.813 427 HD11 ILE 57 3HD1 ILE 57 22.770 -0.338 3.103 428 HD12 ILE 57 1HD1 ILE 57 23.459 -0.948 1.579 429 HD13 ILE 57 2HD1 ILE 57 23.161 -2.066 2.933 430 H ILE 58 HN ILE 58 22.608 -1.247 6.556 431 HA ILE 58 HA ILE 58 21.689 -3.945 5.979 432 HB ILE 58 HB ILE 58 20.782 -1.717 7.762 433 HG12 ILE 58 2HG1 ILE 58 22.487 -3.619 8.328 434 HG13 ILE 58 3HG1 ILE 58 21.272 -3.138 9.496 435 HG21 ILE 58 1HG2 ILE 58 18.747 -2.967 8.295 436 HG22 ILE 58 2HG2 ILE 58 18.763 -2.440 6.595 437 HG23 ILE 58 3HG2 ILE 58 19.120 -4.135 7.004 438 HD11 ILE 58 3HD1 ILE 58 21.336 -5.586 9.346 439 HD12 ILE 58 1HD1 ILE 58 19.788 -5.001 8.691 440 HD13 ILE 58 2HD1 ILE 58 21.085 -5.513 7.585 441 H TRP 59 HN TRP 59 20.038 -4.440 4.541 442 HA TRP 59 HA TRP 59 19.544 -2.426 2.547 443 HB2 TRP 59 2HB TRP 59 18.894 -5.348 2.829 444 HB3 TRP 59 3HB TRP 59 18.166 -4.375 1.566 445 HD1 TRP 59 HD1 TRP 59 20.909 -6.655 1.822 446 HE1 TRP 59 HE1 TRP 59 22.883 -6.256 0.117 447 HE3 TRP 59 HE3 TRP 59 19.579 -1.906 0.584 448 HZ2 TRP 59 HZ2 TRP 59 23.648 -4.049 -1.523 449 HZ3 TRP 59 HZ3 TRP 59 20.994 -0.699 -1.077 450 HH2 TRP 59 HH2 TRP 59 22.967 -1.696 -2.120 451 H GLY 60 HN GLY 60 18.157 -0.823 3.295 452 HA2 GLY 60 1HA GLY 60 15.625 -1.741 4.518 453 HA3 GLY 60 2HA GLY 60 16.415 -0.217 4.868 454 H GLU 61 HN GLU 61 14.162 0.601 4.247 455 HA GLU 61 HA GLU 61 13.471 0.424 1.509 456 HB2 GLU 61 2HB GLU 61 12.399 1.893 3.921 457 HB3 GLU 61 3HB GLU 61 11.845 2.366 2.326 458 HG2 GLU 61 2HG GLU 61 11.540 -0.306 2.050 459 HG3 GLU 61 3HG GLU 61 11.417 -0.227 3.797 460 HE2 GLU 61 HE2 GLU 61 9.455 2.641 2.414 461 H ASP 62 HN ASP 62 14.699 3.066 3.678 462 HA ASP 62 HA ASP 62 14.804 5.044 1.828 463 HB2 ASP 62 2HB ASP 62 15.386 5.024 4.375 464 HB3 ASP 62 3HB ASP 62 17.007 4.586 3.879 465 HD2 ASP 62 HD2 ASP 62 16.063 7.743 4.807 466 H THR 63 HN THR 63 17.316 2.565 2.713 467 HA THR 63 HA THR 63 19.311 3.428 0.974 468 HB THR 63 HB THR 63 20.219 1.155 1.391 469 HG1 THR 63 HG1 THR 63 18.605 -0.358 1.454 470 HG21 THR 63 1HG2 THR 63 20.623 1.821 3.539 471 HG22 THR 63 2HG2 THR 63 19.181 2.863 3.519 472 HG23 THR 63 3HG2 THR 63 19.037 1.153 3.993 473 H LEU 64 HN LEU 64 17.089 0.605 0.439 474 HA LEU 64 HA LEU 64 17.746 0.102 -2.130 475 HB2 LEU 64 2HB LEU 64 15.056 -0.028 -0.771 476 HB3 LEU 64 3HB LEU 64 15.361 -0.685 -2.366 477 HG LEU 64 HG LEU 64 16.963 -1.535 0.051 478 HD11 LEU 64 1HD1 LEU 64 15.488 -3.346 0.452 479 HD12 LEU 64 2HD1 LEU 64 14.483 -1.879 0.380 480 HD13 LEU 64 3HD1 LEU 64 14.534 -2.990 -1.009 481 HD21 LEU 64 3HD2 LEU 64 16.742 -3.637 -1.761 482 HD22 LEU 64 1HD2 LEU 64 16.968 -2.195 -2.781 483 HD23 LEU 64 2HD2 LEU 64 18.153 -2.582 -1.510 484 H MET 65 HN MET 65 15.544 2.674 -0.904 485 HA MET 65 HA MET 65 14.469 3.506 -3.234 486 HB2 MET 65 2HB MET 65 14.342 4.375 -0.702 487 HB3 MET 65 3HB MET 65 15.555 5.523 -1.230 488 HG2 MET 65 2HG MET 65 13.640 6.747 -1.730 489 HG3 MET 65 3HG MET 65 13.846 5.914 -3.258 490 HE1 MET 65 3HE MET 65 12.550 4.771 -4.305 491 HE2 MET 65 1HE MET 65 11.392 3.535 -3.758 492 HE3 MET 65 2HE MET 65 10.847 5.208 -4.028 493 H GLU 66 HN GLU 66 17.569 4.738 -1.774 494 HA GLU 66 HA GLU 66 18.152 6.279 -4.048 495 HB2 GLU 66 2HB GLU 66 19.028 6.856 -1.825 496 HB3 GLU 66 3HB GLU 66 19.904 5.342 -1.735 497 HG2 GLU 66 2HG GLU 66 21.447 5.984 -3.443 498 HG3 GLU 66 3HG GLU 66 20.401 7.259 -4.036 499 HE2 GLU 66 HE2 GLU 66 20.217 8.687 -1.132 500 H TYR 67 HN TYR 67 19.649 3.241 -2.707 501 HA TYR 67 HA TYR 67 21.462 2.694 -4.617 502 HB2 TYR 67 2HB TYR 67 20.996 1.298 -2.615 503 HB3 TYR 67 3HB TYR 67 19.370 0.960 -3.174 504 HD1 TYR 67 HD1 TYR 67 22.938 0.473 -4.226 505 HD2 TYR 67 HD2 TYR 67 18.944 -1.061 -4.253 506 HE1 TYR 67 HE1 TYR 67 23.757 -1.661 -5.340 507 HE2 TYR 67 HE2 TYR 67 19.777 -3.189 -5.367 508 HH TYR 67 HH TYR 67 23.169 -3.847 -5.687 509 H LEU 68 HN LEU 68 17.913 2.483 -4.921 510 HA LEU 68 HA LEU 68 17.969 0.958 -7.312 511 HB2 LEU 68 2HB LEU 68 15.893 2.572 -5.857 512 HB3 LEU 68 3HB LEU 68 15.567 1.898 -7.442 513 HG LEU 68 HG LEU 68 16.599 0.086 -5.286 514 HD11 LEU 68 1HD1 LEU 68 13.811 -0.127 -5.176 515 HD12 LEU 68 2HD1 LEU 68 14.901 0.503 -3.918 516 HD13 LEU 68 3HD1 LEU 68 14.151 1.617 -5.086 517 HD21 LEU 68 3HD2 LEU 68 15.405 -0.159 -7.931 518 HD22 LEU 68 1HD2 LEU 68 16.321 -1.344 -6.969 519 HD23 LEU 68 2HD2 LEU 68 14.569 -1.156 -6.716 520 H GLU 69 HN GLU 69 17.564 4.481 -6.560 521 HA GLU 69 HA GLU 69 17.207 5.352 -9.103 522 HB2 GLU 69 2HB GLU 69 16.938 6.907 -7.317 523 HB3 GLU 69 3HB GLU 69 18.544 6.604 -6.685 524 HG2 GLU 69 2HG GLU 69 19.606 7.823 -8.438 525 HG3 GLU 69 3HG GLU 69 18.200 7.735 -9.481 526 HE2 GLU 69 HE2 GLU 69 16.474 10.157 -7.456 527 H ASN 70 HN ASN 70 20.179 4.242 -7.497 528 HA ASN 70 HA ASN 70 21.449 4.005 -9.993 529 HB2 ASN 70 2HB ASN 70 22.153 6.317 -8.186 530 HB3 ASN 70 3HB ASN 70 23.488 5.474 -8.945 531 HD21 ASN 70 1HD2 ASN 70 22.322 8.182 -9.310 532 HD22 ASN 70 2HD2 ASN 70 21.995 8.352 -11.002 533 HA PRO 71 HA PRO 71 22.860 1.227 -6.714 534 HB2 PRO 71 2HB PRO 71 22.816 -1.075 -8.186 535 HB3 PRO 71 3HB PRO 71 21.453 -0.520 -7.234 536 HG2 PRO 71 2HG PRO 71 21.821 -0.439 -10.166 537 HG3 PRO 71 3HG PRO 71 20.340 -0.295 -9.241 538 HD2 PRO 71 2HD PRO 71 21.794 1.836 -10.496 539 HD3 PRO 71 3HD PRO 71 20.379 1.993 -9.476 540 H LYS 72 HN LYS 72 23.950 1.318 -10.041 541 HA LYS 72 HA LYS 72 26.369 0.079 -9.722 542 HB2 LYS 72 2HB LYS 72 25.112 1.155 -11.793 543 HB3 LYS 72 3HB LYS 72 26.168 2.512 -11.459 544 HG2 LYS 72 2HG LYS 72 27.991 0.486 -11.291 545 HG3 LYS 72 3HG LYS 72 26.858 -0.247 -12.409 546 HD2 LYS 72 2HD LYS 72 28.430 0.931 -13.782 547 HD3 LYS 72 3HD LYS 72 26.980 1.915 -13.790 548 HE2 LYS 72 2HE LYS 72 28.924 2.516 -11.595 549 HE3 LYS 72 3HE LYS 72 29.480 2.889 -13.215 550 HZ1 LYS 72 2HZ LYS 72 27.507 4.250 -11.671 551 HZ3 LYS 72 1HZ LYS 72 26.896 3.838 -13.124 552 H LYS 73 HN LYS 73 25.556 3.574 -9.200 553 HA LYS 73 HA LYS 73 28.138 4.316 -8.440 554 HB2 LYS 73 2HB LYS 73 25.403 5.500 -7.935 555 HB3 LYS 73 3HB LYS 73 26.869 6.254 -7.339 556 HG2 LYS 73 2HG LYS 73 27.646 6.783 -9.483 557 HG3 LYS 73 3HG LYS 73 26.821 5.433 -10.237 558 HD2 LYS 73 2HD LYS 73 24.682 6.550 -10.138 559 HD3 LYS 73 3HD LYS 73 25.282 7.768 -9.031 560 HE2 LYS 73 2HE LYS 73 26.116 7.416 -11.948 561 HE3 LYS 73 3HE LYS 73 25.122 8.708 -11.305 562 HZ1 LYS 73 2HZ LYS 73 26.960 9.606 -10.153 563 HZ3 LYS 73 1HZ LYS 73 27.600 9.184 -11.590 564 H TYR 74 HN TYR 74 25.243 3.392 -6.453 565 HA TYR 74 HA TYR 74 26.319 3.671 -3.970 566 HB2 TYR 74 2HB TYR 74 24.002 2.781 -5.034 567 HB3 TYR 74 3HB TYR 74 24.737 1.201 -4.844 568 HD1 TYR 74 HD1 TYR 74 25.673 0.661 -2.432 569 HD2 TYR 74 HD2 TYR 74 22.765 3.684 -3.274 570 HE1 TYR 74 HE1 TYR 74 24.896 0.598 -0.011 571 HE2 TYR 74 HE2 TYR 74 21.997 3.610 -0.852 572 HH TYR 74 HH TYR 74 23.513 1.366 1.453 573 H ILE 75 HN ILE 75 27.062 1.212 -6.423 574 HA ILE 75 HA ILE 75 29.206 0.273 -4.723 575 HB ILE 75 HB ILE 75 27.279 -1.723 -5.893 576 HG12 ILE 75 2HG1 ILE 75 27.337 -0.651 -3.056 577 HG13 ILE 75 3HG1 ILE 75 26.071 -0.374 -4.235 578 HG21 ILE 75 1HG2 ILE 75 29.073 -2.311 -3.592 579 HG22 ILE 75 2HG2 ILE 75 28.561 -3.342 -4.951 580 HG23 ILE 75 3HG2 ILE 75 29.829 -2.116 -5.191 581 HD11 ILE 75 3HD1 ILE 75 26.482 -2.676 -2.501 582 HD12 ILE 75 1HD1 ILE 75 25.076 -2.276 -3.518 583 HD13 ILE 75 2HD1 ILE 75 26.441 -3.188 -4.206 584 HA PRO 76 HA PRO 76 30.467 0.744 -8.969 585 HB2 PRO 76 2HB PRO 76 32.934 1.798 -8.445 586 HB3 PRO 76 3HB PRO 76 31.504 2.781 -8.689 587 HG2 PRO 76 2HG PRO 76 32.907 2.146 -6.166 588 HG3 PRO 76 3HG PRO 76 31.766 3.434 -6.493 589 HD2 PRO 76 2HD PRO 76 31.241 0.995 -5.076 590 HD3 PRO 76 3HD PRO 76 30.074 2.231 -5.505 591 H GLY 77 HN GLY 77 31.018 -0.981 -10.126 592 HA2 GLY 77 1HA GLY 77 32.777 -2.468 -10.717 593 HA3 GLY 77 2HA GLY 77 33.265 -2.552 -9.037 594 H THR 78 HN THR 78 29.882 -2.490 -9.082 595 HA THR 78 HA THR 78 29.721 -5.228 -8.317 596 HB THR 78 HB THR 78 28.360 -3.164 -7.491 597 HG1 THR 78 HG1 THR 78 26.950 -5.515 -8.534 598 HG21 THR 78 1HG2 THR 78 27.640 -2.567 -9.934 599 HG22 THR 78 2HG2 THR 78 26.558 -3.976 -9.813 600 HG23 THR 78 3HG2 THR 78 26.361 -2.603 -8.696 601 H LYS 79 HN LYS 79 28.198 -6.815 -9.286 602 HA LYS 79 HA LYS 79 28.735 -6.930 -12.115 603 HB2 LYS 79 2HB LYS 79 27.145 -8.990 -10.620 604 HB3 LYS 79 3HB LYS 79 28.251 -9.194 -11.962 605 HG2 LYS 79 2HG LYS 79 30.066 -8.278 -10.251 606 HG3 LYS 79 3HG LYS 79 28.893 -8.745 -9.036 607 HD2 LYS 79 2HD LYS 79 29.654 -10.709 -11.218 608 HD3 LYS 79 3HD LYS 79 30.717 -10.487 -9.843 609 HE2 LYS 79 2HE LYS 79 27.771 -10.948 -9.335 610 HE3 LYS 79 3HE LYS 79 28.769 -12.315 -9.784 611 HZ1 LYS 79 2HZ LYS 79 30.068 -12.064 -7.865 612 HZ3 LYS 79 1HZ LYS 79 28.581 -11.716 -7.302 613 H MET 80 HN MET 80 25.952 -6.526 -9.881 614 HA MET 80 HA MET 80 23.886 -6.880 -11.544 615 HB2 MET 80 2HB MET 80 23.652 -6.251 -9.164 616 HB3 MET 80 3HB MET 80 24.358 -4.676 -9.465 617 HG2 MET 80 2HG MET 80 22.428 -3.848 -10.515 618 HG3 MET 80 3HG MET 80 21.906 -5.433 -11.052 619 HE1 MET 80 3HE MET 80 21.562 -2.672 -8.936 620 HE2 MET 80 1HE MET 80 19.883 -3.174 -9.247 621 HE3 MET 80 2HE MET 80 20.505 -3.133 -7.579 622 H ILE 81 HN ILE 81 23.009 -5.922 -13.352 623 HA ILE 81 HA ILE 81 24.294 -3.427 -14.216 624 HB ILE 81 HB ILE 81 22.958 -5.542 -15.906 625 HG12 ILE 81 2HG1 ILE 81 25.840 -5.152 -15.110 626 HG13 ILE 81 3HG1 ILE 81 24.867 -6.607 -15.036 627 HG21 ILE 81 1HG2 ILE 81 23.416 -4.297 -17.743 628 HG22 ILE 81 2HG2 ILE 81 23.256 -2.966 -16.571 629 HG23 ILE 81 3HG2 ILE 81 24.870 -3.561 -17.026 630 HD11 ILE 81 3HD1 ILE 81 24.735 -5.931 -17.743 631 HD12 ILE 81 1HD1 ILE 81 26.401 -5.496 -17.293 632 HD13 ILE 81 2HD1 ILE 81 25.814 -7.155 -17.030 633 H PHE 82 HN PHE 82 23.071 -1.618 -14.250 634 HA PHE 82 HA PHE 82 20.255 -1.837 -14.800 635 HB2 PHE 82 2HB PHE 82 20.882 -2.146 -12.211 636 HB3 PHE 82 3HB PHE 82 21.206 -0.424 -12.260 637 HD1 PHE 82 HD1 PHE 82 18.492 -2.522 -13.746 638 HD2 PHE 82 HD2 PHE 82 19.511 0.711 -11.193 639 HE1 PHE 82 HE1 PHE 82 16.055 -2.051 -13.368 640 HE2 PHE 82 HE2 PHE 82 17.075 1.182 -10.815 641 HZ PHE 82 HZ PHE 82 15.377 -0.204 -11.908 642 H VAL 83 HN VAL 83 19.275 0.570 -14.495 643 HA VAL 83 HA VAL 83 21.321 2.411 -15.526 644 HB VAL 83 HB VAL 83 19.473 3.378 -16.904 645 HG11 VAL 83 1HG1 VAL 83 19.691 1.781 -18.690 646 HG12 VAL 83 2HG1 VAL 83 21.222 1.809 -17.782 647 HG13 VAL 83 3HG1 VAL 83 20.070 0.473 -17.544 648 HG21 VAL 83 3HG2 VAL 83 17.527 1.878 -17.391 649 HG22 VAL 83 1HG2 VAL 83 18.024 0.865 -16.015 650 HG23 VAL 83 2HG2 VAL 83 17.529 2.554 -15.745 651 H GLY 84 HN GLY 84 18.154 2.005 -13.830 652 HA2 GLY 84 1HA GLY 84 18.125 3.137 -11.627 653 HA3 GLY 84 2HA GLY 84 18.698 4.570 -12.457 654 H ILE 85 HN ILE 85 16.081 3.778 -10.953 655 HA ILE 85 HA ILE 85 14.154 4.174 -13.096 656 HB ILE 85 HB ILE 85 13.670 3.738 -10.151 657 HG12 ILE 85 2HG1 ILE 85 13.634 1.603 -12.292 658 HG13 ILE 85 3HG1 ILE 85 15.049 1.926 -11.309 659 HG21 ILE 85 1HG2 ILE 85 11.443 3.100 -10.813 660 HG22 ILE 85 2HG2 ILE 85 11.806 4.714 -11.467 661 HG23 ILE 85 3HG2 ILE 85 11.855 3.290 -12.534 662 HD11 ILE 85 3HD1 ILE 85 12.322 1.408 -10.058 663 HD12 ILE 85 1HD1 ILE 85 13.449 0.090 -10.462 664 HD13 ILE 85 2HD1 ILE 85 13.921 1.333 -9.278 665 H LYS 86 HN LYS 86 12.759 5.985 -13.221 666 HA LYS 86 HA LYS 86 13.874 8.329 -11.891 667 HB2 LYS 86 2HB LYS 86 13.553 8.131 -14.431 668 HB3 LYS 86 3HB LYS 86 11.837 8.295 -14.123 669 HG2 LYS 86 2HG LYS 86 13.747 10.288 -12.877 670 HG3 LYS 86 3HG LYS 86 13.342 10.447 -14.575 671 HD2 LYS 86 2HD LYS 86 11.044 10.017 -12.689 672 HD3 LYS 86 3HD LYS 86 11.857 11.566 -12.586 673 HE2 LYS 86 2HE LYS 86 10.386 12.122 -14.272 674 HE3 LYS 86 3HE LYS 86 11.627 11.417 -15.288 675 HZ1 LYS 86 2HZ LYS 86 9.873 10.142 -15.956 676 HZ3 LYS 86 1HZ LYS 86 9.026 10.322 -14.576 677 H LYS 87 HN LYS 87 10.578 7.057 -12.766 678 HA LYS 87 HA LYS 87 9.226 8.664 -10.957 679 HB2 LYS 87 2HB LYS 87 8.589 6.087 -12.376 680 HB3 LYS 87 3HB LYS 87 7.471 6.742 -11.196 681 HG2 LYS 87 2HG LYS 87 8.584 8.502 -13.410 682 HG3 LYS 87 3HG LYS 87 7.213 7.452 -13.711 683 HD2 LYS 87 2HD LYS 87 7.159 9.254 -11.281 684 HD3 LYS 87 3HD LYS 87 6.854 9.956 -12.858 685 HE2 LYS 87 2HE LYS 87 5.357 7.509 -11.810 686 HE3 LYS 87 3HE LYS 87 4.777 9.149 -11.594 687 HZ1 LYS 87 2HZ LYS 87 3.821 8.781 -13.602 688 HZ3 LYS 87 1HZ LYS 87 4.809 7.550 -14.003 689 H LYS 88 HN LYS 88 9.552 8.789 -8.804 690 HA LYS 88 HA LYS 88 10.780 6.709 -7.359 691 HB2 LYS 88 2HB LYS 88 10.936 8.242 -5.713 692 HB3 LYS 88 3HB LYS 88 10.492 9.362 -6.984 693 HG2 LYS 88 2HG LYS 88 8.535 8.019 -5.058 694 HG3 LYS 88 3HG LYS 88 9.099 9.673 -4.932 695 HD2 LYS 88 2HD LYS 88 8.034 9.070 -7.617 696 HD3 LYS 88 3HD LYS 88 6.845 8.793 -6.361 697 HE2 LYS 88 2HE LYS 88 8.369 11.303 -5.969 698 HE3 LYS 88 3HE LYS 88 7.482 11.274 -7.480 699 HZ1 LYS 88 2HZ LYS 88 6.019 12.092 -5.792 700 HZ3 LYS 88 1HZ LYS 88 6.346 10.867 -4.770 701 H GLU 89 HN GLU 89 7.494 7.338 -8.364 702 HA GLU 89 HA GLU 89 6.196 6.040 -6.275 703 HB2 GLU 89 2HB GLU 89 5.488 6.730 -9.132 704 HB3 GLU 89 3HB GLU 89 4.406 5.708 -8.207 705 HG2 GLU 89 2HG GLU 89 4.663 7.582 -6.343 706 HG3 GLU 89 3HG GLU 89 5.204 8.582 -7.676 707 HE2 GLU 89 HE2 GLU 89 1.938 9.381 -7.748 708 H GLU 90 HN GLU 90 7.877 4.897 -9.192 709 HA GLU 90 HA GLU 90 6.758 2.295 -9.033 710 HB2 GLU 90 2HB GLU 90 8.909 3.632 -10.676 711 HB3 GLU 90 3HB GLU 90 8.824 1.881 -10.665 712 HG2 GLU 90 2HG GLU 90 6.345 2.083 -11.265 713 HG3 GLU 90 3HG GLU 90 6.594 3.805 -11.467 714 HE2 GLU 90 HE2 GLU 90 7.060 3.917 -14.171 715 H ARG 91 HN ARG 91 9.597 4.001 -7.746 716 HA ARG 91 HA ARG 91 10.986 1.648 -7.079 717 HB2 ARG 91 2HB ARG 91 11.238 4.540 -6.117 718 HB3 ARG 91 3HB ARG 91 12.345 3.275 -5.622 719 HG2 ARG 91 2HG ARG 91 12.579 2.838 -8.234 720 HG3 ARG 91 3HG ARG 91 11.946 4.465 -8.379 721 HD2 ARG 91 2HD ARG 91 14.412 3.682 -6.748 722 HD3 ARG 91 3HD ARG 91 14.449 4.432 -8.331 723 HE ARG 91 HE ARG 91 13.891 5.758 -5.793 724 HH11 ARG 91 2HH2 ARG 91 13.313 5.923 -9.286 725 HH12 ARG 91 1HH2 ARG 91 13.028 7.632 -9.283 726 HH22 ARG 91 HH1 ARG 91 13.151 8.840 -7.217 727 H ALA 92 HN ALA 92 8.348 3.480 -5.683 728 HA ALA 92 HA ALA 92 8.791 2.624 -2.987 729 HB1 ALA 92 3HB ALA 92 6.161 3.450 -3.168 730 HB2 ALA 92 1HB ALA 92 7.551 4.514 -2.844 731 HB3 ALA 92 2HB ALA 92 6.931 4.341 -4.503 732 H ASP 93 HN ASP 93 6.640 1.706 -5.746 733 HA ASP 93 HA ASP 93 5.284 -0.247 -4.293 734 HB2 ASP 93 2HB ASP 93 5.788 -0.192 -7.303 735 HB3 ASP 93 3HB ASP 93 4.466 -1.001 -6.485 736 HD2 ASP 93 HD2 ASP 93 3.448 1.899 -8.145 737 H LEU 94 HN LEU 94 7.999 -0.344 -6.719 738 HA LEU 94 HA LEU 94 8.413 -3.028 -6.861 739 HB2 LEU 94 2HB LEU 94 9.541 -1.422 -8.254 740 HB3 LEU 94 3HB LEU 94 10.405 -0.760 -6.880 741 HG LEU 94 HG LEU 94 11.556 -2.968 -6.601 742 HD11 LEU 94 1HD1 LEU 94 9.979 -3.611 -9.087 743 HD12 LEU 94 2HD1 LEU 94 11.521 -4.423 -8.723 744 HD13 LEU 94 3HD1 LEU 94 10.156 -4.554 -7.588 745 HD21 LEU 94 3HD2 LEU 94 13.248 -2.288 -7.923 746 HD22 LEU 94 1HD2 LEU 94 12.223 -2.189 -9.375 747 HD23 LEU 94 2HD2 LEU 94 12.205 -0.869 -8.181 748 H ILE 95 HN ILE 95 9.359 -0.753 -4.254 749 HA ILE 95 HA ILE 95 10.841 -2.775 -2.866 750 HB ILE 95 HB ILE 95 9.969 0.027 -2.176 751 HG12 ILE 95 2HG1 ILE 95 12.754 -1.040 -2.686 752 HG13 ILE 95 3HG1 ILE 95 11.739 -0.400 -3.963 753 HG21 ILE 95 1HG2 ILE 95 10.068 -1.334 -0.129 754 HG22 ILE 95 2HG2 ILE 95 11.730 -1.820 -0.542 755 HG23 ILE 95 3HG2 ILE 95 11.363 -0.113 -0.191 756 HD11 ILE 95 3HD1 ILE 95 12.529 1.653 -3.408 757 HD12 ILE 95 1HD1 ILE 95 11.544 1.535 -1.929 758 HD13 ILE 95 2HD1 ILE 95 13.253 1.035 -1.904 759 H ALA 96 HN ALA 96 7.586 -1.243 -2.665 760 HA ALA 96 HA ALA 96 6.753 -2.336 -0.287 761 HB1 ALA 96 3HB ALA 96 5.666 -0.864 -2.412 762 HB2 ALA 96 1HB ALA 96 4.664 -2.332 -2.330 763 HB3 ALA 96 2HB ALA 96 4.848 -1.298 -0.893 764 H TYR 97 HN TYR 97 7.490 -3.894 -3.335 765 HA TYR 97 HA TYR 97 5.972 -6.271 -2.614 766 HB2 TYR 97 2HB TYR 97 5.890 -5.721 -4.955 767 HB3 TYR 97 3HB TYR 97 7.531 -5.106 -4.956 768 HD1 TYR 97 HD2 TYR 97 6.703 -8.392 -3.496 769 HD2 TYR 97 HD1 TYR 97 8.181 -6.335 -6.943 770 HE1 TYR 97 HE2 TYR 97 7.531 -10.593 -4.463 771 HE2 TYR 97 HE1 TYR 97 9.004 -8.542 -7.899 772 HH TYR 97 HH TYR 97 8.343 -11.590 -6.221 773 H LEU 98 HN LEU 98 9.391 -5.377 -3.483 774 HA LEU 98 HA LEU 98 10.509 -7.824 -2.890 775 HB2 LEU 98 2HB LEU 98 11.540 -5.006 -2.917 776 HB3 LEU 98 3HB LEU 98 12.578 -6.324 -2.409 777 HG LEU 98 HG LEU 98 11.322 -5.875 -5.117 778 HD11 LEU 98 1HD1 LEU 98 13.308 -4.737 -5.145 779 HD12 LEU 98 2HD1 LEU 98 14.090 -5.839 -3.986 780 HD13 LEU 98 3HD1 LEU 98 13.857 -6.344 -5.677 781 HD21 LEU 98 3HD2 LEU 98 10.942 -8.162 -4.888 782 HD22 LEU 98 1HD2 LEU 98 12.520 -8.081 -5.707 783 HD23 LEU 98 2HD2 LEU 98 12.439 -8.422 -3.962 784 H LYS 99 HN LYS 99 9.198 -5.351 -0.771 785 HA LYS 99 HA LYS 99 10.643 -6.230 1.535 786 HB2 LYS 99 2HB LYS 99 9.654 -4.474 2.616 787 HB3 LYS 99 3HB LYS 99 9.560 -3.900 0.963 788 HG2 LYS 99 2HG LYS 99 7.223 -4.906 0.818 789 HG3 LYS 99 3HG LYS 99 7.331 -5.285 2.525 790 HD2 LYS 99 2HD LYS 99 7.512 -2.935 3.126 791 HD3 LYS 99 3HD LYS 99 7.739 -2.459 1.455 792 HE2 LYS 99 2HE LYS 99 5.454 -1.969 1.838 793 HE3 LYS 99 3HE LYS 99 5.389 -3.520 1.025 794 HZ1 LYS 99 2HZ LYS 99 5.330 -4.542 3.314 795 HZ3 LYS 99 1HZ LYS 99 4.007 -3.665 2.949 796 H LYS 100 HN LYS 100 7.581 -7.001 -0.107 797 HA LYS 100 HA LYS 100 6.756 -8.647 2.140 798 HB2 LYS 100 2HB LYS 100 5.235 -7.085 0.735 799 HB3 LYS 100 3HB LYS 100 5.295 -8.344 -0.481 800 HG2 LYS 100 2HG LYS 100 4.509 -10.010 1.243 801 HG3 LYS 100 3HG LYS 100 4.386 -8.711 2.413 802 HD2 LYS 100 2HD LYS 100 2.898 -7.577 0.477 803 HD3 LYS 100 3HD LYS 100 2.683 -9.244 -0.019 804 HE2 LYS 100 2HE LYS 100 2.025 -9.757 2.425 805 HE3 LYS 100 3HE LYS 100 1.989 -8.025 2.691 806 HZ1 LYS 100 2HZ LYS 100 -0.107 -9.429 1.773 807 HZ3 LYS 100 1HZ LYS 100 0.508 -8.903 0.360 808 H ALA 101 HN ALA 101 8.670 -8.845 -0.708 809 HA ALA 101 HA ALA 101 8.058 -11.611 -1.240 810 HB1 ALA 101 3HB ALA 101 10.520 -10.456 -2.381 811 HB2 ALA 101 1HB ALA 101 9.124 -11.201 -3.196 812 HB3 ALA 101 2HB ALA 101 9.060 -9.490 -2.709 813 H THR 102 HN THR 102 10.771 -9.662 0.165 814 HA THR 102 HA THR 102 12.175 -12.075 0.909 815 HB THR 102 HB THR 102 13.889 -10.481 1.631 816 HG1 THR 102 HG1 THR 102 13.002 -8.663 2.528 817 HG21 THR 102 1HG2 THR 102 13.209 -8.633 -0.434 818 HG22 THR 102 2HG2 THR 102 14.327 -10.012 -0.563 819 HG23 THR 102 3HG2 THR 102 12.610 -10.217 -0.984 820 H ASN 103 HN ASN 103 9.394 -10.815 2.045 821 HA ASN 103 HA ASN 103 10.172 -11.126 4.824 822 HB2 ASN 103 2HB ASN 103 8.898 -9.091 4.415 823 HB3 ASN 103 3HB ASN 103 7.705 -9.948 3.458 824 HD21 ASN 103 1HD2 ASN 103 9.252 -10.477 6.628 825 HD22 ASN 103 2HD2 ASN 103 7.799 -10.659 7.553 826 H GLU 104 HN GLU 104 7.375 -11.916 2.606 827 HA GLU 104 HA GLU 104 6.310 -13.883 4.191 828 HB2 GLU 104 2HB GLU 104 5.036 -14.543 2.216 829 HB3 GLU 104 3HB GLU 104 5.171 -12.797 2.253 830 HG2 GLU 104 2HG GLU 104 5.773 -13.156 0.043 831 HG3 GLU 104 3HG GLU 104 7.361 -13.260 0.777 832 HE2 GLU 104 HE2 GLU 104 4.801 -15.832 -0.136 833 HHA HEC 500 HHA HEC 500 23.593 -7.533 -5.229 834 HHB HEC 500 HHB HEC 500 17.627 -5.221 -5.196 835 HHC HEC 500 HHC HEC 500 17.717 -5.663 -11.629 836 HHD HEC 500 HHD HEC 500 22.867 -9.442 -11.243 837 HMA1 HEC 500 1HMA HEC 500 18.372 -5.496 -3.013 838 HMA2 HEC 500 2HMA HEC 500 19.869 -5.677 -2.090 839 HMA3 HEC 500 3HMA HEC 500 19.596 -4.198 -3.030 840 HAA1 HEC 500 1HAA HEC 500 23.363 -6.590 -3.404 841 HAA2 HEC 500 2HAA HEC 500 22.224 -5.808 -2.429 842 HBA1 HEC 500 1HBA HEC 500 22.146 -8.786 -3.052 843 HBA2 HEC 500 2HBA HEC 500 22.787 -8.067 -1.563 844 HMB1 HEC 500 1HMB HEC 500 14.530 -5.086 -7.366 845 HMB2 HEC 500 2HMB HEC 500 15.505 -5.233 -5.920 846 HMB3 HEC 500 3HMB HEC 500 15.450 -3.671 -6.767 847 HAB HEC 500 HAB HEC 500 16.155 -4.299 -11.011 848 HBB1 HEC 500 1HBB HEC 500 15.168 -2.494 -10.367 849 HBB2 HEC 500 2HBB HEC 500 13.885 -3.509 -9.658 850 HBB3 HEC 500 3HBB HEC 500 15.239 -2.992 -8.673 851 HMC1 HEC 500 1HMC HEC 500 17.953 -8.158 -13.740 852 HMC2 HEC 500 2HMC HEC 500 18.092 -6.396 -13.647 853 HMC3 HEC 500 3HMC HEC 500 19.251 -7.302 -14.599 854 HAC HEC 500 HAC HEC 500 21.803 -10.058 -12.951 855 HBC1 HEC 500 1HBC HEC 500 22.348 -8.164 -14.470 856 HBC2 HEC 500 2HBC HEC 500 21.973 -9.696 -15.290 857 HBC3 HEC 500 3HBC HEC 500 20.769 -8.409 -15.260 858 HMD1 HEC 500 1HMD HEC 500 24.633 -11.122 -9.546 859 HMD2 HEC 500 2HMD HEC 500 25.081 -9.754 -10.579 860 HMD3 HEC 500 3HMD HEC 500 25.953 -10.077 -9.054 861 HAD1 HEC 500 1HAD HEC 500 25.323 -8.514 -5.667 862 HAD2 HEC 500 2HAD HEC 500 25.632 -9.948 -6.549 863 HBD1 HEC 500 1HBD HEC 500 27.153 -8.889 -7.972 864 HBD2 HEC 500 2HBD HEC 500 26.235 -7.368 -7.943 Start of MODEL 10 1 H1 GLY 1 HN GLY 1 0.790 -0.271 0.380 2 HA2 GLY 1 1HA GLY 1 2.146 0.804 -2.020 3 HA3 GLY 1 2HA GLY 1 2.953 0.004 -0.687 4 H ASP 2 HN ASP 2 0.772 -0.441 -3.484 5 HA ASP 2 HA ASP 2 0.159 -3.058 -3.235 6 HB2 ASP 2 2HB ASP 2 0.904 -1.447 -5.715 7 HB3 ASP 2 3HB ASP 2 0.240 -3.066 -5.812 8 HD2 ASP 2 HD2 ASP 2 -2.451 -1.143 -3.859 9 H VAL 3 HN VAL 3 1.146 -4.956 -4.589 10 HA VAL 3 HA VAL 3 4.077 -4.759 -4.492 11 HB VAL 3 HB VAL 3 3.666 -7.385 -4.316 12 HG11 VAL 3 1HG1 VAL 3 4.584 -7.140 -2.275 13 HG12 VAL 3 2HG1 VAL 3 4.569 -5.399 -2.644 14 HG13 VAL 3 3HG1 VAL 3 3.249 -6.118 -1.691 15 HG21 VAL 3 3HG2 VAL 3 1.188 -6.162 -3.057 16 HG22 VAL 3 1HG2 VAL 3 1.250 -7.319 -4.409 17 HG23 VAL 3 2HG2 VAL 3 1.754 -7.827 -2.779 18 H GLU 4 HN GLU 4 1.269 -6.386 -6.119 19 HA GLU 4 HA GLU 4 2.489 -7.600 -8.132 20 HB2 GLU 4 2HB GLU 4 -0.089 -6.006 -8.072 21 HB3 GLU 4 3HB GLU 4 0.412 -6.818 -9.542 22 HG2 GLU 4 2HG GLU 4 0.707 -8.941 -8.038 23 HG3 GLU 4 3HG GLU 4 -0.226 -8.063 -6.842 24 HE2 GLU 4 HE2 GLU 4 -2.843 -7.482 -8.963 25 H LYS 5 HN LYS 5 1.629 -4.074 -8.077 26 HA LYS 5 HA LYS 5 2.505 -3.402 -10.580 27 HB2 LYS 5 2HB LYS 5 2.202 -1.962 -7.980 28 HB3 LYS 5 3HB LYS 5 3.095 -1.157 -9.255 29 HG2 LYS 5 2HG LYS 5 0.940 -0.468 -9.796 30 HG3 LYS 5 3HG LYS 5 1.035 -1.920 -10.771 31 HD2 LYS 5 2HD LYS 5 -0.095 -3.225 -8.980 32 HD3 LYS 5 3HD LYS 5 -0.142 -1.805 -7.954 33 HE2 LYS 5 2HE LYS 5 -1.365 -1.672 -10.724 34 HE3 LYS 5 3HE LYS 5 -2.254 -2.453 -9.431 35 HZ1 LYS 5 2HZ LYS 5 -2.477 -0.465 -8.299 36 HZ3 LYS 5 1HZ LYS 5 -2.455 0.123 -9.817 37 H GLY 6 HN GLY 6 4.398 -3.787 -7.534 38 HA2 GLY 6 1HA GLY 6 6.870 -3.035 -8.803 39 HA3 GLY 6 2HA GLY 6 6.639 -3.656 -7.181 40 H LYS 7 HN LYS 7 4.928 -5.950 -8.483 41 HA LYS 7 HA LYS 7 7.135 -7.752 -8.697 42 HB2 LYS 7 2HB LYS 7 4.935 -8.237 -7.564 43 HB3 LYS 7 3HB LYS 7 4.189 -8.292 -9.148 44 HG2 LYS 7 2HG LYS 7 5.250 -10.279 -9.746 45 HG3 LYS 7 3HG LYS 7 6.673 -9.939 -8.781 46 HD2 LYS 7 2HD LYS 7 5.163 -11.826 -7.916 47 HD3 LYS 7 3HD LYS 7 5.598 -10.599 -6.742 48 HE2 LYS 7 2HE LYS 7 3.159 -11.169 -6.660 49 HE3 LYS 7 3HE LYS 7 3.432 -9.475 -7.017 50 HZ1 LYS 7 2HZ LYS 7 3.210 -11.284 -9.306 51 HZ3 LYS 7 1HZ LYS 7 2.701 -9.744 -9.166 52 H LYS 8 HN LYS 8 5.271 -5.761 -10.866 53 HA LYS 8 HA LYS 8 5.939 -7.418 -13.154 54 HB2 LYS 8 2HB LYS 8 4.348 -4.852 -12.882 55 HB3 LYS 8 3HB LYS 8 4.638 -5.676 -14.400 56 HG2 LYS 8 2HG LYS 8 3.364 -7.054 -11.994 57 HG3 LYS 8 3HG LYS 8 2.422 -6.235 -13.224 58 HD2 LYS 8 2HD LYS 8 3.644 -7.724 -14.954 59 HD3 LYS 8 3HD LYS 8 4.244 -8.652 -13.595 60 HE2 LYS 8 2HE LYS 8 2.299 -9.848 -14.046 61 HE3 LYS 8 3HE LYS 8 1.665 -8.700 -12.884 62 HZ1 LYS 8 2HZ LYS 8 1.489 -7.410 -15.310 63 HZ3 LYS 8 1HZ LYS 8 0.249 -8.092 -14.505 64 H ILE 9 HN ILE 9 7.004 -4.526 -11.411 65 HA ILE 9 HA ILE 9 8.709 -3.711 -13.596 66 HB ILE 9 HB ILE 9 8.100 -2.645 -10.854 67 HG12 ILE 9 2HG1 ILE 9 7.899 -1.105 -13.416 68 HG13 ILE 9 3HG1 ILE 9 6.689 -2.326 -13.076 69 HG21 ILE 9 1HG2 ILE 9 10.487 -2.141 -12.531 70 HG22 ILE 9 2HG2 ILE 9 9.653 -0.699 -11.904 71 HG23 ILE 9 3HG2 ILE 9 10.242 -1.946 -10.778 72 HD11 ILE 9 3HD1 ILE 9 5.634 -0.783 -11.795 73 HD12 ILE 9 1HD1 ILE 9 6.972 -0.947 -10.632 74 HD13 ILE 9 2HD1 ILE 9 7.027 0.321 -11.880 75 H PHE 10 HN PHE 10 8.771 -5.872 -10.880 76 HA PHE 10 HA PHE 10 11.593 -5.719 -10.466 77 HB2 PHE 10 2HB PHE 10 10.271 -6.460 -8.605 78 HB3 PHE 10 3HB PHE 10 9.207 -7.409 -9.623 79 HD1 PHE 10 HD1 PHE 10 12.806 -7.327 -8.617 80 HD2 PHE 10 HD2 PHE 10 9.409 -9.701 -9.525 81 HE1 PHE 10 HE1 PHE 10 14.099 -9.398 -8.037 82 HE2 PHE 10 HE2 PHE 10 10.701 -11.773 -8.944 83 HZ PHE 10 HZ PHE 10 13.031 -11.597 -8.207 84 H ILE 11 HN ILE 11 9.395 -7.436 -12.626 85 HA ILE 11 HA ILE 11 11.311 -9.501 -13.216 86 HB ILE 11 HB ILE 11 8.561 -8.780 -14.172 87 HG12 ILE 11 2HG1 ILE 11 9.673 -11.321 -12.948 88 HG13 ILE 11 3HG1 ILE 11 8.914 -10.034 -12.033 89 HG21 ILE 11 1HG2 ILE 11 8.768 -10.903 -15.602 90 HG22 ILE 11 2HG2 ILE 11 9.495 -9.401 -16.223 91 HG23 ILE 11 3HG2 ILE 11 10.526 -10.650 -15.485 92 HD11 ILE 11 3HD1 ILE 11 7.624 -12.189 -13.351 93 HD12 ILE 11 1HD1 ILE 11 6.849 -10.794 -12.564 94 HD13 ILE 11 2HD1 ILE 11 7.229 -10.737 -14.301 95 H MET 12 HN MET 12 9.597 -7.186 -15.422 96 HA MET 12 HA MET 12 11.206 -7.307 -17.504 97 HB2 MET 12 2HB MET 12 9.673 -5.071 -16.181 98 HB3 MET 12 3HB MET 12 10.764 -4.596 -17.467 99 HG2 MET 12 2HG MET 12 8.681 -6.809 -17.785 100 HG3 MET 12 3HG MET 12 8.371 -5.137 -18.206 101 HE1 MET 12 3HE MET 12 10.858 -3.942 -19.917 102 HE2 MET 12 1HE MET 12 9.995 -4.461 -21.385 103 HE3 MET 12 2HE MET 12 9.078 -3.934 -19.953 104 H LYS 13 HN LYS 13 12.019 -5.839 -14.379 105 HA LYS 13 HA LYS 13 14.498 -4.787 -15.513 106 HB2 LYS 13 2HB LYS 13 13.183 -4.327 -12.818 107 HB3 LYS 13 3HB LYS 13 14.701 -3.618 -13.330 108 HG2 LYS 13 2HG LYS 13 13.482 -2.613 -15.328 109 HG3 LYS 13 3HG LYS 13 11.979 -3.209 -14.652 110 HD2 LYS 13 2HD LYS 13 12.695 -1.929 -12.473 111 HD3 LYS 13 3HD LYS 13 13.846 -1.103 -13.506 112 HE2 LYS 13 2HE LYS 13 10.981 -1.264 -14.442 113 HE3 LYS 13 3HE LYS 13 11.353 -0.159 -13.134 114 HZ1 LYS 13 2HZ LYS 13 13.323 0.412 -14.862 115 HZ3 LYS 13 1HZ LYS 13 11.899 1.204 -14.853 116 H CYS 14 HN CYS 14 13.465 -6.534 -12.492 117 HA CYS 14 HA CYS 14 16.071 -7.800 -12.473 118 HB2 CYS 14 2HB CYS 14 14.079 -8.435 -10.374 119 HB3 CYS 14 3HB CYS 14 15.801 -8.137 -10.249 120 H SER 15 HN SER 15 15.123 -8.823 -14.649 121 HA SER 15 HA SER 15 13.448 -11.094 -13.972 122 HB2 SER 15 2HB SER 15 12.453 -10.246 -15.860 123 HB3 SER 15 3HB SER 15 13.920 -9.465 -16.416 124 HG SER 15 HG SER 15 14.207 -11.104 -17.749 125 H GLN 16 HN GLN 16 14.081 -13.272 -14.710 126 HA GLN 16 HA GLN 16 15.585 -14.874 -14.546 127 HB2 GLN 16 2HB GLN 16 16.694 -13.331 -16.933 128 HB3 GLN 16 3HB GLN 16 17.083 -14.999 -16.564 129 HG2 GLN 16 2HG GLN 16 14.184 -14.137 -16.829 130 HG3 GLN 16 3HG GLN 16 15.135 -14.470 -18.263 131 HE21 GLN 16 1HE2 GLN 16 16.663 -16.531 -17.751 132 HE22 GLN 16 2HE2 GLN 16 15.778 -17.949 -17.295 133 H CYS 17 HN CYS 17 16.221 -12.556 -12.831 134 HA CYS 17 HA CYS 17 19.103 -13.012 -12.668 135 HB2 CYS 17 2HB CYS 17 17.657 -10.415 -12.808 136 HB3 CYS 17 3HB CYS 17 18.984 -10.530 -11.669 137 H HIS 18 HN HIS 18 16.528 -11.180 -10.856 138 HA HIS 18 HA HIS 18 17.404 -12.541 -8.446 139 HB2 HIS 18 2HB HIS 18 15.733 -10.084 -8.980 140 HB3 HIS 18 3HB HIS 18 15.792 -10.827 -7.394 141 HD1 HIS 18 HD1 HIS 18 18.543 -11.276 -6.636 142 HD2 HIS 18 HD2 HIS 18 17.571 -8.092 -9.188 143 HE1 HIS 18 HE1 HIS 18 20.480 -9.622 -6.485 144 H THR 19 HN THR 19 15.791 -13.486 -6.954 145 HA THR 19 HA THR 19 13.449 -14.493 -8.434 146 HB THR 19 HB THR 19 13.784 -16.577 -7.056 147 HG1 THR 19 HG1 THR 19 16.037 -16.490 -5.996 148 HG21 THR 19 1HG2 THR 19 16.501 -15.909 -8.239 149 HG22 THR 19 2HG2 THR 19 15.622 -17.457 -8.270 150 HG23 THR 19 3HG2 THR 19 15.099 -16.116 -9.316 151 H VAL 20 HN VAL 20 14.778 -13.234 -5.366 152 HA VAL 20 HA VAL 20 13.782 -12.558 -3.502 153 HB VAL 20 HB VAL 20 12.021 -10.979 -3.790 154 HG11 VAL 20 1HG1 VAL 20 13.891 -9.922 -4.593 155 HG12 VAL 20 2HG1 VAL 20 14.138 -11.105 -5.900 156 HG13 VAL 20 3HG1 VAL 20 12.873 -9.862 -6.052 157 HG21 VAL 20 3HG2 VAL 20 11.543 -11.901 -6.627 158 HG22 VAL 20 1HG2 VAL 20 10.640 -12.589 -5.255 159 HG23 VAL 20 2HG2 VAL 20 10.537 -10.847 -5.604 160 H GLU 21 HN GLU 21 13.242 -15.357 -4.441 161 HA GLU 21 HA GLU 21 10.832 -15.715 -2.850 162 HB2 GLU 21 2HB GLU 21 10.297 -17.702 -4.379 163 HB3 GLU 21 3HB GLU 21 10.039 -16.109 -5.065 164 HG2 GLU 21 2HG GLU 21 11.857 -16.275 -6.519 165 HG3 GLU 21 3HG GLU 21 12.761 -17.329 -5.449 166 HE2 GLU 21 HE2 GLU 21 10.410 -18.837 -8.237 167 H LYS 22 HN LYS 22 10.708 -17.914 -1.812 168 HA LYS 22 HA LYS 22 13.387 -18.722 -1.037 169 HB2 LYS 22 2HB LYS 22 10.889 -19.857 0.169 170 HB3 LYS 22 3HB LYS 22 12.446 -19.543 0.910 171 HG2 LYS 22 2HG LYS 22 11.932 -17.014 0.438 172 HG3 LYS 22 3HG LYS 22 10.280 -17.537 0.180 173 HD2 LYS 22 2HD LYS 22 11.900 -18.075 2.715 174 HD3 LYS 22 3HD LYS 22 10.709 -16.801 2.543 175 HE2 LYS 22 2HE LYS 22 10.034 -19.740 2.077 176 HE3 LYS 22 3HE LYS 22 9.898 -18.984 3.652 177 HZ1 LYS 22 2HZ LYS 22 8.536 -17.232 2.196 178 HZ3 LYS 22 1HZ LYS 22 7.818 -18.539 2.849 179 H GLY 23 HN GLY 23 13.374 -19.456 -3.526 180 HA2 GLY 23 1HA GLY 23 13.403 -22.292 -3.466 181 HA3 GLY 23 2HA GLY 23 12.001 -21.719 -4.345 182 H GLY 24 HN GLY 24 13.152 -19.255 -5.400 183 HA2 GLY 24 1HA GLY 24 14.385 -20.281 -7.731 184 HA3 GLY 24 2HA GLY 24 14.181 -18.597 -7.292 185 H LYS 25 HN LYS 25 16.269 -21.486 -6.905 186 HA LYS 25 HA LYS 25 18.221 -20.616 -5.279 187 HB2 LYS 25 2HB LYS 25 19.555 -22.264 -6.192 188 HB3 LYS 25 3HB LYS 25 17.955 -22.804 -6.657 189 HG2 LYS 25 2HG LYS 25 18.259 -21.653 -8.890 190 HG3 LYS 25 3HG LYS 25 19.894 -21.231 -8.419 191 HD2 LYS 25 2HD LYS 25 20.630 -23.487 -8.448 192 HD3 LYS 25 3HD LYS 25 19.008 -24.126 -8.277 193 HE2 LYS 25 2HE LYS 25 19.996 -24.369 -10.609 194 HE3 LYS 25 3HE LYS 25 18.438 -23.570 -10.562 195 HZ1 LYS 25 2HZ LYS 25 19.362 -21.665 -11.314 196 HZ3 LYS 25 1HZ LYS 25 20.678 -22.540 -11.709 197 H HIS 26 HN HIS 26 20.433 -19.704 -5.746 198 HA HIS 26 HA HIS 26 20.134 -17.179 -6.910 199 HB2 HIS 26 2HB HIS 26 22.664 -18.668 -6.156 200 HB3 HIS 26 3HB HIS 26 22.544 -16.948 -6.472 201 HD1 HIS 26 HD1 HIS 26 23.283 -16.303 -4.073 202 HD2 HIS 26 HD2 HIS 26 19.813 -18.657 -4.215 203 HE1 HIS 26 HE1 HIS 26 22.269 -16.224 -1.732 204 H LYS 27 HN LYS 27 20.513 -16.407 -8.954 205 HA LYS 27 HA LYS 27 21.611 -18.357 -10.859 206 HB2 LYS 27 2HB LYS 27 19.082 -17.042 -10.840 207 HB3 LYS 27 3HB LYS 27 20.012 -16.367 -12.163 208 HG2 LYS 27 2HG LYS 27 20.011 -19.367 -11.767 209 HG3 LYS 27 3HG LYS 27 18.604 -18.612 -12.489 210 HD2 LYS 27 2HD LYS 27 21.405 -18.026 -13.523 211 HD3 LYS 27 3HD LYS 27 20.512 -19.429 -14.075 212 HE2 LYS 27 2HE LYS 27 18.643 -17.962 -14.833 213 HE3 LYS 27 3HE LYS 27 19.498 -16.550 -14.243 214 HZ1 LYS 27 2HZ LYS 27 21.098 -16.751 -15.916 215 HZ3 LYS 27 1HZ LYS 27 19.757 -17.215 -16.715 216 H THR 28 HN THR 28 20.856 -14.865 -11.264 217 HA THR 28 HA THR 28 23.604 -14.462 -12.123 218 HB THR 28 HB THR 28 22.706 -12.437 -13.107 219 HG1 THR 28 HG1 THR 28 21.495 -11.774 -11.205 220 HG21 THR 28 1HG2 THR 28 20.408 -14.462 -13.113 221 HG22 THR 28 2HG2 THR 28 20.675 -13.167 -14.304 222 HG23 THR 28 3HG2 THR 28 21.808 -14.535 -14.209 223 H GLY 29 HN GLY 29 21.406 -13.607 -9.448 224 HA2 GLY 29 1HA GLY 29 23.746 -12.464 -8.061 225 HA3 GLY 29 2HA GLY 29 22.225 -11.595 -8.110 226 HA PRO 30 HA PRO 30 22.142 -14.484 -4.556 227 HB2 PRO 30 2HB PRO 30 22.071 -12.660 -2.522 228 HB3 PRO 30 3HB PRO 30 23.548 -13.429 -3.068 229 HG2 PRO 30 2HG PRO 30 22.608 -10.669 -3.553 230 HG3 PRO 30 3HG PRO 30 24.227 -11.322 -3.712 231 HD2 PRO 30 2HD PRO 30 22.398 -10.730 -5.840 232 HD3 PRO 30 3HD PRO 30 23.970 -11.489 -5.991 233 H ASN 31 HN ASN 31 20.341 -15.306 -3.542 234 HA ASN 31 HA ASN 31 17.965 -14.543 -4.587 235 HB2 ASN 31 2HB ASN 31 18.560 -16.642 -3.189 236 HB3 ASN 31 3HB ASN 31 18.299 -15.662 -1.760 237 HD21 ASN 31 1HD2 ASN 31 16.899 -17.555 -4.186 238 HD22 ASN 31 2HD2 ASN 31 15.223 -17.289 -3.839 239 H LEU 32 HN LEU 32 16.020 -13.555 -3.349 240 HA LEU 32 HA LEU 32 16.955 -11.440 -1.535 241 HB2 LEU 32 2HB LEU 32 15.285 -11.329 -3.983 242 HB3 LEU 32 3HB LEU 32 14.760 -10.341 -2.633 243 HG LEU 32 HG LEU 32 16.244 -9.225 -4.354 244 HD11 LEU 32 1HD1 LEU 32 16.577 -7.714 -2.764 245 HD12 LEU 32 2HD1 LEU 32 16.104 -8.935 -1.556 246 HD13 LEU 32 3HD1 LEU 32 17.817 -8.732 -1.993 247 HD21 LEU 32 3HD2 LEU 32 17.801 -11.336 -4.347 248 HD22 LEU 32 1HD2 LEU 32 18.478 -9.709 -4.593 249 HD23 LEU 32 2HD2 LEU 32 18.598 -10.490 -2.999 250 H HIS 33 HN HIS 33 16.523 -13.184 0.108 251 HA HIS 33 HA HIS 33 13.648 -13.249 0.672 252 HB2 HIS 33 2HB HIS 33 13.963 -15.464 0.287 253 HB3 HIS 33 3HB HIS 33 15.680 -15.405 0.637 254 HD1 HIS 33 HD1 HIS 33 12.316 -15.706 2.360 255 HD2 HIS 33 HD2 HIS 33 16.397 -16.043 3.265 256 HE1 HIS 33 HE1 HIS 33 12.448 -16.720 4.697 257 H GLY 34 HN GLY 34 16.994 -13.327 2.053 258 HA2 GLY 34 1HA GLY 34 15.912 -12.290 4.586 259 HA3 GLY 34 2HA GLY 34 17.475 -13.045 4.344 260 H LEU 35 HN LEU 35 16.330 -10.744 1.917 261 HA LEU 35 HA LEU 35 18.560 -9.170 1.994 262 HB2 LEU 35 2HB LEU 35 17.200 -9.031 0.120 263 HB3 LEU 35 3HB LEU 35 15.748 -8.743 1.057 264 HG LEU 35 HG LEU 35 16.886 -6.493 1.713 265 HD11 LEU 35 1HD1 LEU 35 18.314 -5.648 -0.225 266 HD12 LEU 35 2HD1 LEU 35 19.085 -6.761 0.931 267 HD13 LEU 35 3HD1 LEU 35 18.544 -7.359 -0.655 268 HD21 LEU 35 3HD2 LEU 35 15.123 -7.289 -0.351 269 HD22 LEU 35 1HD2 LEU 35 15.274 -5.691 0.421 270 HD23 LEU 35 2HD2 LEU 35 16.214 -6.064 -1.044 271 H PHE 36 HN PHE 36 15.355 -7.962 3.190 272 HA PHE 36 HA PHE 36 16.411 -5.899 4.663 273 HB2 PHE 36 2HB PHE 36 13.912 -7.622 4.641 274 HB3 PHE 36 3HB PHE 36 14.116 -6.558 6.019 275 HD1 PHE 36 HD1 PHE 36 14.291 -6.423 2.289 276 HD2 PHE 36 HD2 PHE 36 13.225 -4.437 5.885 277 HE1 PHE 36 HE1 PHE 36 13.351 -4.515 0.957 278 HE2 PHE 36 HE2 PHE 36 12.285 -2.528 4.552 279 HZ PHE 36 HZ PHE 36 12.359 -2.590 2.105 280 H GLY 37 HN GLY 37 17.329 -5.668 6.675 281 HA2 GLY 37 1HA GLY 37 17.955 -6.196 8.791 282 HA3 GLY 37 2HA GLY 37 16.986 -7.654 8.721 283 H ARG 38 HN ARG 38 19.467 -6.771 6.282 284 HA ARG 38 HA ARG 38 21.284 -8.649 7.491 285 HB2 ARG 38 2HB ARG 38 19.936 -10.032 5.930 286 HB3 ARG 38 3HB ARG 38 20.247 -8.907 4.624 287 HG2 ARG 38 2HG ARG 38 22.480 -9.573 4.379 288 HG3 ARG 38 3HG ARG 38 22.631 -10.071 6.052 289 HD2 ARG 38 2HD ARG 38 22.575 -12.129 4.862 290 HD3 ARG 38 3HD ARG 38 20.942 -11.965 5.476 291 HE ARG 38 HE ARG 38 20.807 -10.721 3.005 292 HH11 ARG 38 2HH2 ARG 38 21.900 -13.919 4.069 293 HH12 ARG 38 1HH2 ARG 38 21.489 -14.694 2.576 294 HH22 ARG 38 HH1 ARG 38 20.530 -13.394 0.805 295 H LYS 39 HN LYS 39 23.460 -8.072 7.114 296 HA LYS 39 HA LYS 39 23.887 -5.503 5.969 297 HB2 LYS 39 2HB LYS 39 25.492 -7.539 7.438 298 HB3 LYS 39 3HB LYS 39 26.376 -6.415 6.426 299 HG2 LYS 39 2HG LYS 39 25.654 -4.526 7.650 300 HG3 LYS 39 3HG LYS 39 24.234 -5.341 8.274 301 HD2 LYS 39 2HD LYS 39 27.063 -6.184 9.039 302 HD3 LYS 39 3HD LYS 39 26.173 -4.970 9.936 303 HE2 LYS 39 2HE LYS 39 24.810 -7.608 9.386 304 HE3 LYS 39 3HE LYS 39 26.065 -7.570 10.607 305 HZ1 LYS 39 2HZ LYS 39 24.396 -6.852 11.936 306 HZ3 LYS 39 1HZ LYS 39 23.426 -6.408 10.704 307 H THR 40 HN THR 40 26.126 -5.474 4.508 308 HA THR 40 HA THR 40 25.296 -6.892 2.102 309 HB THR 40 HB THR 40 27.158 -5.296 1.175 310 HG1 THR 40 HG1 THR 40 28.088 -4.913 3.314 311 HG21 THR 40 1HG2 THR 40 24.994 -4.441 0.735 312 HG22 THR 40 2HG2 THR 40 24.550 -4.421 2.458 313 HG23 THR 40 3HG2 THR 40 25.657 -3.188 1.810 314 H GLY 41 HN GLY 41 26.521 -8.374 0.969 315 HA2 GLY 41 1HA GLY 41 28.048 -9.995 0.667 316 HA3 GLY 41 2HA GLY 41 29.202 -8.982 1.513 317 H GLN 42 HN GLN 42 26.183 -10.822 2.398 318 HA GLN 42 HA GLN 42 27.723 -11.880 4.639 319 HB2 GLN 42 2HB GLN 42 24.731 -11.325 4.440 320 HB3 GLN 42 3HB GLN 42 25.491 -12.135 5.795 321 HG2 GLN 42 2HG GLN 42 26.089 -9.296 4.840 322 HG3 GLN 42 3HG GLN 42 25.190 -9.727 6.280 323 HE21 GLN 42 1HE2 GLN 42 28.089 -8.733 5.167 324 HE22 GLN 42 2HE2 GLN 42 29.154 -9.290 6.415 325 H ALA 43 HN ALA 43 25.260 -12.541 2.096 326 HA ALA 43 HA ALA 43 24.552 -15.077 2.546 327 HB1 ALA 43 3HB ALA 43 23.741 -13.907 0.627 328 HB2 ALA 43 1HB ALA 43 25.381 -13.709 -0.035 329 HB3 ALA 43 2HB ALA 43 24.625 -15.320 0.002 330 HA PRO 44 HA PRO 44 28.578 -16.915 2.768 331 HB2 PRO 44 2HB PRO 44 27.869 -19.007 4.377 332 HB3 PRO 44 3HB PRO 44 28.409 -17.460 4.998 333 HG2 PRO 44 2HG PRO 44 25.670 -18.567 4.911 334 HG3 PRO 44 3HG PRO 44 26.291 -17.248 5.884 335 HD2 PRO 44 2HD PRO 44 24.675 -17.028 3.524 336 HD3 PRO 44 3HD PRO 44 25.391 -15.710 4.431 337 H GLY 45 HN GLY 45 25.840 -17.670 1.183 338 HA2 GLY 45 1HA GLY 45 26.777 -20.299 0.294 339 HA3 GLY 45 2HA GLY 45 25.228 -19.551 -0.041 340 H TYR 46 HN TYR 46 25.963 -17.001 -0.994 341 HA TYR 46 HA TYR 46 27.628 -17.667 -3.326 342 HB2 TYR 46 2HB TYR 46 25.126 -17.595 -3.767 343 HB3 TYR 46 3HB TYR 46 25.047 -16.006 -3.033 344 HD1 TYR 46 HD1 TYR 46 27.235 -17.602 -5.646 345 HD2 TYR 46 HD2 TYR 46 24.693 -14.328 -4.585 346 HE1 TYR 46 HE1 TYR 46 27.659 -16.528 -7.911 347 HE2 TYR 46 HE2 TYR 46 25.127 -13.266 -6.853 348 HH TYR 46 HH TYR 46 26.183 -14.815 -9.395 349 H SER 47 HN SER 47 29.434 -16.683 -2.135 350 HA SER 47 HA SER 47 29.341 -14.172 -1.055 351 HB2 SER 47 2HB SER 47 31.209 -15.944 -0.950 352 HB3 SER 47 3HB SER 47 31.751 -15.338 -2.503 353 HG SER 47 HG SER 47 32.283 -13.358 -1.602 354 H TYR 48 HN TYR 48 29.679 -12.055 -1.868 355 HA TYR 48 HA TYR 48 29.272 -11.812 -4.736 356 HB2 TYR 48 2HB TYR 48 29.535 -9.651 -2.572 357 HB3 TYR 48 3HB TYR 48 28.639 -9.530 -4.073 358 HD1 TYR 48 HD2 TYR 48 27.514 -12.528 -3.530 359 HD2 TYR 48 HD1 TYR 48 27.496 -8.818 -1.402 360 HE1 TYR 48 HE2 TYR 48 25.392 -13.226 -2.316 361 HE2 TYR 48 HE1 TYR 48 25.375 -9.527 -0.195 362 HH TYR 48 HH TYR 48 23.372 -11.384 -1.018 363 H THR 49 HN THR 49 30.405 -9.483 -5.462 364 HA THR 49 HA THR 49 33.114 -10.159 -5.780 365 HB THR 49 HB THR 49 33.118 -7.732 -6.728 366 HG1 THR 49 HG1 THR 49 30.731 -7.076 -6.892 367 HG21 THR 49 1HG2 THR 49 30.948 -9.698 -7.635 368 HG22 THR 49 2HG2 THR 49 31.478 -8.279 -8.571 369 HG23 THR 49 3HG2 THR 49 32.612 -9.614 -8.259 370 H ALA 50 HN ALA 50 35.003 -8.788 -5.186 371 HA ALA 50 HA ALA 50 35.144 -8.578 -2.399 372 HB1 ALA 50 3HB ALA 50 37.251 -8.864 -3.182 373 HB2 ALA 50 1HB ALA 50 36.863 -8.138 -4.759 374 HB3 ALA 50 2HB ALA 50 37.261 -7.096 -3.373 375 H ALA 51 HN ALA 51 34.008 -6.400 -4.903 376 HA ALA 51 HA ALA 51 34.464 -3.984 -3.504 377 HB1 ALA 51 3HB ALA 51 32.536 -3.282 -5.165 378 HB2 ALA 51 1HB ALA 51 34.143 -3.712 -5.794 379 HB3 ALA 51 2HB ALA 51 32.817 -4.897 -5.856 380 H ASN 52 HN ASN 52 31.302 -5.623 -4.236 381 HA ASN 52 HA ASN 52 29.806 -4.245 -2.489 382 HB2 ASN 52 2HB ASN 52 29.130 -6.114 -4.168 383 HB3 ASN 52 3HB ASN 52 29.489 -7.258 -2.890 384 HD21 ASN 52 1HD2 ASN 52 28.442 -6.849 -0.766 385 HD22 ASN 52 2HD2 ASN 52 26.798 -6.307 -0.744 386 H LYS 53 HN LYS 53 31.846 -7.174 -1.916 387 HA LYS 53 HA LYS 53 31.072 -7.860 0.604 388 HB2 LYS 53 2HB LYS 53 32.827 -8.879 -1.038 389 HB3 LYS 53 3HB LYS 53 33.976 -7.864 -0.190 390 HG2 LYS 53 2HG LYS 53 32.812 -8.908 1.984 391 HG3 LYS 53 3HG LYS 53 32.347 -10.177 0.870 392 HD2 LYS 53 2HD LYS 53 34.891 -10.153 0.158 393 HD3 LYS 53 3HD LYS 53 35.141 -9.303 1.669 394 HE2 LYS 53 2HE LYS 53 33.502 -11.845 1.697 395 HE3 LYS 53 3HE LYS 53 35.244 -11.973 1.562 396 HZ1 LYS 53 2HZ LYS 53 35.015 -11.883 3.833 397 HZ3 LYS 53 1HZ LYS 53 33.668 -10.968 3.811 398 H ASN 54 HN ASN 54 33.507 -5.354 -0.355 399 HA ASN 54 HA ASN 54 34.351 -4.624 2.085 400 HB2 ASN 54 2HB ASN 54 33.613 -2.661 -0.148 401 HB3 ASN 54 3HB ASN 54 34.811 -2.395 1.104 402 HD21 ASN 54 1HD2 ASN 54 36.109 -4.777 1.249 403 HD22 ASN 54 2HD2 ASN 54 36.956 -5.123 -0.222 404 H LYS 55 HN LYS 55 31.523 -3.236 0.241 405 HA LYS 55 HA LYS 55 30.606 -1.426 2.017 406 HB2 LYS 55 2HB LYS 55 29.724 -2.031 -0.292 407 HB3 LYS 55 3HB LYS 55 28.794 -3.300 0.479 408 HG2 LYS 55 2HG LYS 55 27.295 -1.456 0.409 409 HG3 LYS 55 3HG LYS 55 27.875 -1.464 2.062 410 HD2 LYS 55 2HD LYS 55 28.166 0.790 1.537 411 HD3 LYS 55 3HD LYS 55 29.751 0.168 1.123 412 HE2 LYS 55 2HE LYS 55 28.699 -0.218 -1.276 413 HE3 LYS 55 3HE LYS 55 27.474 0.916 -0.739 414 HZ1 LYS 55 2HZ LYS 55 29.778 2.160 -0.034 415 HZ3 LYS 55 1HZ LYS 55 28.962 2.463 -1.410 416 H GLY 56 HN GLY 56 29.460 -1.371 3.941 417 HA2 GLY 56 1HA GLY 56 28.625 -3.946 5.089 418 HA3 GLY 56 2HA GLY 56 29.769 -2.952 5.968 419 H ILE 57 HN ILE 57 26.616 -2.572 4.188 420 HA ILE 57 HA ILE 57 25.715 -0.944 6.460 421 HB ILE 57 HB ILE 57 24.528 0.498 4.953 422 HG12 ILE 57 2HG1 ILE 57 25.247 0.192 2.409 423 HG13 ILE 57 3HG1 ILE 57 25.380 -1.489 2.886 424 HG21 ILE 57 1HG2 ILE 57 27.250 0.480 5.334 425 HG22 ILE 57 2HG2 ILE 57 27.106 0.629 3.565 426 HG23 ILE 57 3HG2 ILE 57 26.305 1.812 4.626 427 HD11 ILE 57 3HD1 ILE 57 23.123 -1.743 2.992 428 HD12 ILE 57 1HD1 ILE 57 22.925 -0.247 3.937 429 HD13 ILE 57 2HD1 ILE 57 23.022 -0.173 2.161 430 H ILE 58 HN ILE 58 23.240 -0.880 6.581 431 HA ILE 58 HA ILE 58 22.326 -3.613 6.192 432 HB ILE 58 HB ILE 58 21.285 -1.292 7.814 433 HG12 ILE 58 2HG1 ILE 58 23.395 -2.685 8.471 434 HG13 ILE 58 3HG1 ILE 58 22.177 -2.307 9.674 435 HG21 ILE 58 1HG2 ILE 58 19.337 -2.440 7.130 436 HG22 ILE 58 2HG2 ILE 58 20.101 -4.034 7.347 437 HG23 ILE 58 3HG2 ILE 58 19.707 -3.034 8.767 438 HD11 ILE 58 3HD1 ILE 58 22.881 -4.711 9.739 439 HD12 ILE 58 1HD1 ILE 58 21.143 -4.522 9.404 440 HD13 ILE 58 2HD1 ILE 58 22.267 -4.909 8.080 441 H TRP 59 HN TRP 59 20.493 -4.177 4.977 442 HA TRP 59 HA TRP 59 19.876 -2.269 2.892 443 HB2 TRP 59 2HB TRP 59 19.352 -5.195 3.327 444 HB3 TRP 59 3HB TRP 59 18.480 -4.301 2.098 445 HD1 TRP 59 HD1 TRP 59 21.330 -6.459 2.200 446 HE1 TRP 59 HE1 TRP 59 23.134 -6.051 0.317 447 HE3 TRP 59 HE3 TRP 59 19.698 -1.819 0.907 448 HZ2 TRP 59 HZ2 TRP 59 23.663 -3.883 -1.461 449 HZ3 TRP 59 HZ3 TRP 59 20.914 -0.626 -0.912 450 HH2 TRP 59 HH2 TRP 59 22.833 -1.584 -2.083 451 H GLY 60 HN GLY 60 17.647 -1.637 2.394 452 HA2 GLY 60 1HA GLY 60 15.433 -2.304 3.965 453 HA3 GLY 60 2HA GLY 60 16.168 -0.875 4.665 454 H GLU 61 HN GLU 61 13.548 -1.270 3.183 455 HA GLU 61 HA GLU 61 13.470 -0.452 0.668 456 HB2 GLU 61 2HB GLU 61 11.374 0.942 1.444 457 HB3 GLU 61 3HB GLU 61 11.377 -0.799 1.641 458 HG2 GLU 61 2HG GLU 61 11.643 -0.688 3.959 459 HG3 GLU 61 3HG GLU 61 12.512 0.832 3.900 460 HE2 GLU 61 HE2 GLU 61 9.425 2.011 5.096 461 H ASP 62 HN ASP 62 14.531 1.468 3.451 462 HA ASP 62 HA ASP 62 14.269 3.969 2.267 463 HB2 ASP 62 2HB ASP 62 16.529 3.354 4.175 464 HB3 ASP 62 3HB ASP 62 15.495 4.768 4.120 465 HD2 ASP 62 HD2 ASP 62 14.004 4.644 6.020 466 H THR 63 HN THR 63 17.233 1.918 2.876 467 HA THR 63 HA THR 63 18.950 3.436 1.277 468 HB THR 63 HB THR 63 20.323 1.257 1.420 469 HG1 THR 63 HG1 THR 63 19.094 -0.234 3.002 470 HG21 THR 63 1HG2 THR 63 19.894 3.091 3.398 471 HG22 THR 63 2HG2 THR 63 19.159 1.661 4.162 472 HG23 THR 63 3HG2 THR 63 20.865 1.622 3.655 473 H LEU 64 HN LEU 64 16.486 1.068 0.444 474 HA LEU 64 HA LEU 64 17.584 0.470 -2.112 475 HB2 LEU 64 2HB LEU 64 14.915 0.017 -0.797 476 HB3 LEU 64 3HB LEU 64 15.209 -0.410 -2.471 477 HG LEU 64 HG LEU 64 16.840 -1.471 -0.150 478 HD11 LEU 64 1HD1 LEU 64 14.267 -2.399 -1.340 479 HD12 LEU 64 2HD1 LEU 64 15.478 -3.628 -0.897 480 HD13 LEU 64 3HD1 LEU 64 14.866 -2.498 0.334 481 HD21 LEU 64 3HD2 LEU 64 17.433 -1.425 -2.854 482 HD22 LEU 64 1HD2 LEU 64 18.139 -2.510 -1.631 483 HD23 LEU 64 2HD2 LEU 64 16.748 -3.049 -2.602 484 H MET 65 HN MET 65 15.170 2.794 -0.798 485 HA MET 65 HA MET 65 14.277 3.703 -3.252 486 HB2 MET 65 2HB MET 65 13.059 4.255 -1.224 487 HB3 MET 65 3HB MET 65 14.483 4.935 -0.462 488 HG2 MET 65 2HG MET 65 12.871 6.690 -1.289 489 HG3 MET 65 3HG MET 65 14.474 6.855 -1.975 490 HE1 MET 65 3HE MET 65 11.086 5.410 -2.204 491 HE2 MET 65 1HE MET 65 10.621 5.478 -3.920 492 HE3 MET 65 2HE MET 65 11.580 4.108 -3.312 493 H GLU 66 HN GLU 66 17.338 4.110 -1.668 494 HA GLU 66 HA GLU 66 17.888 6.438 -3.329 495 HB2 GLU 66 2HB GLU 66 18.381 6.974 -1.062 496 HB3 GLU 66 3HB GLU 66 19.108 5.410 -0.750 497 HG2 GLU 66 2HG GLU 66 21.090 5.942 -1.958 498 HG3 GLU 66 3HG GLU 66 20.320 7.248 -2.838 499 HE2 GLU 66 HE2 GLU 66 21.509 7.930 0.947 500 H TYR 67 HN TYR 67 18.653 3.052 -2.688 501 HA TYR 67 HA TYR 67 21.039 3.127 -4.328 502 HB2 TYR 67 2HB TYR 67 20.820 1.693 -2.277 503 HB3 TYR 67 3HB TYR 67 19.350 0.978 -2.906 504 HD1 TYR 67 HD2 TYR 67 22.410 1.603 -4.918 505 HD2 TYR 67 HD1 TYR 67 20.033 -1.309 -2.876 506 HE1 TYR 67 HE2 TYR 67 23.768 -0.263 -5.982 507 HE2 TYR 67 HE1 TYR 67 21.399 -3.165 -3.947 508 HH TYR 67 HH TYR 67 23.189 -2.806 -6.560 509 H LEU 68 HN LEU 68 17.657 2.945 -4.825 510 HA LEU 68 HA LEU 68 17.823 1.133 -7.065 511 HB2 LEU 68 2HB LEU 68 15.660 2.594 -5.613 512 HB3 LEU 68 3HB LEU 68 15.357 2.051 -7.251 513 HG LEU 68 HG LEU 68 16.033 0.354 -4.840 514 HD11 LEU 68 1HD1 LEU 68 13.621 1.296 -5.605 515 HD12 LEU 68 2HD1 LEU 68 13.680 -0.214 -6.545 516 HD13 LEU 68 3HD1 LEU 68 13.864 -0.259 -4.776 517 HD21 LEU 68 3HD2 LEU 68 17.215 -0.840 -6.390 518 HD22 LEU 68 1HD2 LEU 68 15.593 -1.532 -6.636 519 HD23 LEU 68 2HD2 LEU 68 16.211 -0.291 -7.753 520 H GLU 69 HN GLU 69 17.647 4.646 -6.390 521 HA GLU 69 HA GLU 69 17.023 5.546 -8.871 522 HB2 GLU 69 2HB GLU 69 17.147 7.135 -7.114 523 HB3 GLU 69 3HB GLU 69 18.772 6.658 -6.663 524 HG2 GLU 69 2HG GLU 69 19.729 7.684 -8.636 525 HG3 GLU 69 3HG GLU 69 18.156 7.887 -9.382 526 HE2 GLU 69 HE2 GLU 69 19.433 10.293 -6.462 527 H ASN 70 HN ASN 70 20.122 4.261 -7.641 528 HA ASN 70 HA ASN 70 20.990 3.765 -10.255 529 HB2 ASN 70 2HB ASN 70 22.156 6.142 -8.766 530 HB3 ASN 70 3HB ASN 70 23.200 5.203 -9.814 531 HD21 ASN 70 1HD2 ASN 70 21.990 4.581 -11.968 532 HD22 ASN 70 2HD2 ASN 70 21.289 5.914 -12.825 533 HA PRO 71 HA PRO 71 22.788 1.294 -6.893 534 HB2 PRO 71 2HB PRO 71 22.229 -1.168 -7.937 535 HB3 PRO 71 3HB PRO 71 21.163 -0.336 -6.823 536 HG2 PRO 71 2HG PRO 71 20.872 -0.703 -9.742 537 HG3 PRO 71 3HG PRO 71 19.651 -0.264 -8.563 538 HD2 PRO 71 2HD PRO 71 20.957 1.493 -10.417 539 HD3 PRO 71 3HD PRO 71 19.823 1.949 -9.161 540 H LYS 72 HN LYS 72 23.567 2.049 -9.951 541 HA LYS 72 HA LYS 72 25.740 0.161 -10.177 542 HB2 LYS 72 2HB LYS 72 24.241 1.136 -12.074 543 HB3 LYS 72 3HB LYS 72 25.287 2.539 -11.971 544 HG2 LYS 72 2HG LYS 72 27.266 1.210 -12.459 545 HG3 LYS 72 3HG LYS 72 26.381 -0.291 -12.275 546 HD2 LYS 72 2HD LYS 72 25.436 1.712 -14.337 547 HD3 LYS 72 3HD LYS 72 26.842 0.730 -14.697 548 HE2 LYS 72 2HE LYS 72 25.590 -1.329 -14.458 549 HE3 LYS 72 3HE LYS 72 24.234 -0.505 -13.715 550 HZ1 LYS 72 2HZ LYS 72 25.097 0.126 -16.478 551 HZ3 LYS 72 1HZ LYS 72 23.679 0.507 -15.776 552 H LYS 73 HN LYS 73 25.093 3.242 -8.720 553 HA LYS 73 HA LYS 73 27.916 3.961 -8.763 554 HB2 LYS 73 2HB LYS 73 25.566 5.511 -7.640 555 HB3 LYS 73 3HB LYS 73 27.194 6.104 -7.904 556 HG2 LYS 73 2HG LYS 73 26.974 5.879 -10.321 557 HG3 LYS 73 3HG LYS 73 25.466 5.001 -10.163 558 HD2 LYS 73 2HD LYS 73 24.272 6.947 -9.425 559 HD3 LYS 73 3HD LYS 73 25.747 7.820 -9.058 560 HE2 LYS 73 2HE LYS 73 25.194 6.912 -11.903 561 HE3 LYS 73 3HE LYS 73 24.436 8.367 -11.286 562 HZ1 LYS 73 2HZ LYS 73 26.661 9.229 -10.757 563 HZ3 LYS 73 1HZ LYS 73 26.570 8.863 -12.341 564 H TYR 74 HN TYR 74 25.208 3.361 -6.422 565 HA TYR 74 HA TYR 74 26.467 3.620 -4.072 566 HB2 TYR 74 2HB TYR 74 24.094 2.686 -4.889 567 HB3 TYR 74 3HB TYR 74 24.866 1.114 -4.820 568 HD1 TYR 74 HD2 TYR 74 26.177 0.673 -2.493 569 HD2 TYR 74 HD1 TYR 74 22.896 3.367 -3.025 570 HE1 TYR 74 HE2 TYR 74 25.646 0.529 -0.010 571 HE2 TYR 74 HE1 TYR 74 22.376 3.213 -0.541 572 HH TYR 74 HH TYR 74 22.737 1.950 1.296 573 H ILE 75 HN ILE 75 27.090 1.126 -6.519 574 HA ILE 75 HA ILE 75 29.335 0.236 -4.905 575 HB ILE 75 HB ILE 75 27.326 -1.700 -6.058 576 HG12 ILE 75 2HG1 ILE 75 27.711 -0.662 -3.249 577 HG13 ILE 75 3HG1 ILE 75 26.242 -0.712 -4.204 578 HG21 ILE 75 1HG2 ILE 75 28.639 -3.433 -5.208 579 HG22 ILE 75 2HG2 ILE 75 29.820 -2.315 -5.931 580 HG23 ILE 75 3HG2 ILE 75 29.583 -2.340 -4.167 581 HD11 ILE 75 3HD1 ILE 75 27.755 -3.198 -3.282 582 HD12 ILE 75 1HD1 ILE 75 26.345 -2.508 -2.443 583 HD13 ILE 75 2HD1 ILE 75 26.170 -3.158 -4.090 584 HA PRO 76 HA PRO 76 30.517 0.888 -9.150 585 HB2 PRO 76 2HB PRO 76 32.962 1.987 -8.625 586 HB3 PRO 76 3HB PRO 76 31.505 2.939 -8.814 587 HG2 PRO 76 2HG PRO 76 32.963 2.254 -6.335 588 HG3 PRO 76 3HG PRO 76 31.783 3.523 -6.599 589 HD2 PRO 76 2HD PRO 76 31.345 1.023 -5.263 590 HD3 PRO 76 3HD PRO 76 30.140 2.240 -5.630 591 H GLY 77 HN GLY 77 31.026 -0.836 -10.328 592 HA2 GLY 77 1HA GLY 77 32.715 -2.305 -11.050 593 HA3 GLY 77 2HA GLY 77 33.424 -2.296 -9.448 594 H THR 78 HN THR 78 29.958 -2.430 -9.392 595 HA THR 78 HA THR 78 30.074 -5.142 -8.409 596 HB THR 78 HB THR 78 28.742 -3.183 -7.396 597 HG1 THR 78 HG1 THR 78 26.933 -4.732 -7.073 598 HG21 THR 78 1HG2 THR 78 27.110 -3.758 -9.915 599 HG22 THR 78 2HG2 THR 78 26.377 -3.070 -8.446 600 HG23 THR 78 3HG2 THR 78 27.652 -2.174 -9.308 601 H LYS 79 HN LYS 79 28.068 -6.577 -9.120 602 HA LYS 79 HA LYS 79 28.401 -6.830 -12.006 603 HB2 LYS 79 2HB LYS 79 27.066 -8.879 -10.262 604 HB3 LYS 79 3HB LYS 79 27.952 -9.099 -11.757 605 HG2 LYS 79 2HG LYS 79 29.977 -8.086 -10.307 606 HG3 LYS 79 3HG LYS 79 29.015 -8.671 -8.965 607 HD2 LYS 79 2HD LYS 79 29.472 -10.531 -11.299 608 HD3 LYS 79 3HD LYS 79 30.805 -10.249 -10.197 609 HE2 LYS 79 2HE LYS 79 29.706 -11.246 -8.378 610 HE3 LYS 79 3HE LYS 79 28.109 -10.880 -8.998 611 HZ1 LYS 79 2HZ LYS 79 28.476 -12.577 -10.733 612 HZ3 LYS 79 1HZ LYS 79 28.598 -13.236 -9.250 613 H MET 80 HN MET 80 26.212 -5.638 -9.624 614 HA MET 80 HA MET 80 23.778 -6.312 -10.617 615 HB2 MET 80 2HB MET 80 24.198 -4.994 -8.529 616 HB3 MET 80 3HB MET 80 24.744 -3.628 -9.482 617 HG2 MET 80 2HG MET 80 22.542 -2.970 -9.179 618 HG3 MET 80 3HG MET 80 22.324 -3.919 -10.636 619 HE1 MET 80 3HE MET 80 21.082 -2.938 -7.758 620 HE2 MET 80 1HE MET 80 19.855 -4.139 -7.290 621 HE3 MET 80 2HE MET 80 21.456 -4.154 -6.513 622 H ILE 81 HN ILE 81 23.086 -6.226 -12.715 623 HA ILE 81 HA ILE 81 24.043 -4.037 -14.377 624 HB ILE 81 HB ILE 81 22.422 -6.454 -15.169 625 HG12 ILE 81 2HG1 ILE 81 24.395 -7.329 -14.160 626 HG13 ILE 81 3HG1 ILE 81 24.608 -7.424 -15.897 627 HG21 ILE 81 1HG2 ILE 81 23.464 -4.129 -16.577 628 HG22 ILE 81 2HG2 ILE 81 24.049 -5.658 -17.274 629 HG23 ILE 81 3HG2 ILE 81 22.301 -5.367 -17.107 630 HD11 ILE 81 3HD1 ILE 81 26.665 -6.573 -14.864 631 HD12 ILE 81 1HD1 ILE 81 25.920 -5.282 -15.836 632 HD13 ILE 81 2HD1 ILE 81 25.756 -5.269 -14.063 633 H PHE 82 HN PHE 82 22.727 -2.534 -12.929 634 HA PHE 82 HA PHE 82 20.136 -2.216 -14.197 635 HB2 PHE 82 2HB PHE 82 20.051 -3.561 -11.939 636 HB3 PHE 82 3HB PHE 82 20.581 -2.081 -11.162 637 HD1 PHE 82 HD2 PHE 82 18.160 -2.433 -13.961 638 HD2 PHE 82 HD1 PHE 82 18.732 -1.490 -9.863 639 HE1 PHE 82 HE2 PHE 82 15.776 -1.661 -13.806 640 HE2 PHE 82 HE1 PHE 82 16.349 -0.716 -9.708 641 HZ PHE 82 HZ PHE 82 14.900 -0.812 -11.681 642 H VAL 83 HN VAL 83 19.787 -0.096 -14.718 643 HA VAL 83 HA VAL 83 21.745 1.815 -13.769 644 HB VAL 83 HB VAL 83 20.730 3.270 -15.469 645 HG11 VAL 83 1HG1 VAL 83 21.223 1.654 -17.469 646 HG12 VAL 83 2HG1 VAL 83 22.527 2.089 -16.340 647 HG13 VAL 83 3HG1 VAL 83 21.707 0.517 -16.187 648 HG21 VAL 83 3HG2 VAL 83 18.584 1.331 -15.310 649 HG22 VAL 83 1HG2 VAL 83 18.612 2.931 -16.090 650 HG23 VAL 83 2HG2 VAL 83 19.160 1.494 -16.986 651 H GLY 84 HN GLY 84 18.597 0.670 -12.946 652 HA2 GLY 84 1HA GLY 84 17.536 1.348 -10.978 653 HA3 GLY 84 2HA GLY 84 18.276 2.931 -11.104 654 H ILE 85 HN ILE 85 15.561 2.803 -10.597 655 HA ILE 85 HA ILE 85 14.278 3.221 -13.190 656 HB ILE 85 HB ILE 85 12.979 3.053 -10.475 657 HG12 ILE 85 2HG1 ILE 85 12.435 0.647 -11.543 658 HG13 ILE 85 3HG1 ILE 85 14.019 0.895 -12.251 659 HG21 ILE 85 1HG2 ILE 85 11.128 2.165 -12.172 660 HG22 ILE 85 2HG2 ILE 85 11.337 3.893 -11.806 661 HG23 ILE 85 3HG2 ILE 85 12.030 3.209 -13.295 662 HD11 ILE 85 3HD1 ILE 85 15.107 0.770 -10.221 663 HD12 ILE 85 1HD1 ILE 85 13.778 1.566 -9.344 664 HD13 ILE 85 2HD1 ILE 85 13.655 -0.157 -9.771 665 H LYS 86 HN LYS 86 12.607 5.100 -13.178 666 HA LYS 86 HA LYS 86 13.993 7.414 -12.029 667 HB2 LYS 86 2HB LYS 86 13.656 7.072 -14.588 668 HB3 LYS 86 3HB LYS 86 11.995 7.535 -14.281 669 HG2 LYS 86 2HG LYS 86 14.204 9.249 -13.131 670 HG3 LYS 86 3HG LYS 86 13.855 9.373 -14.844 671 HD2 LYS 86 2HD LYS 86 11.649 10.161 -14.478 672 HD3 LYS 86 3HD LYS 86 11.574 9.504 -12.855 673 HE2 LYS 86 2HE LYS 86 11.915 11.758 -12.360 674 HE3 LYS 86 3HE LYS 86 13.576 11.202 -12.387 675 HZ1 LYS 86 2HZ LYS 86 12.234 12.343 -14.776 676 HZ3 LYS 86 1HZ LYS 86 13.824 12.029 -14.614 677 H LYS 87 HN LYS 87 10.614 6.449 -12.971 678 HA LYS 87 HA LYS 87 9.288 8.225 -11.399 679 HB2 LYS 87 2HB LYS 87 8.651 5.481 -12.430 680 HB3 LYS 87 3HB LYS 87 7.539 6.244 -11.311 681 HG2 LYS 87 2HG LYS 87 8.561 7.847 -13.665 682 HG3 LYS 87 3HG LYS 87 7.318 6.643 -13.942 683 HD2 LYS 87 2HD LYS 87 5.758 7.736 -12.499 684 HD3 LYS 87 3HD LYS 87 7.007 8.676 -11.706 685 HE2 LYS 87 2HE LYS 87 5.734 10.107 -13.262 686 HE3 LYS 87 3HE LYS 87 7.394 9.965 -13.804 687 HZ1 LYS 87 2HZ LYS 87 6.181 9.521 -15.724 688 HZ3 LYS 87 1HZ LYS 87 5.001 8.698 -14.961 689 H LYS 88 HN LYS 88 8.927 8.545 -9.251 690 HA LYS 88 HA LYS 88 10.420 6.940 -7.425 691 HB2 LYS 88 2HB LYS 88 8.422 9.087 -6.705 692 HB3 LYS 88 3HB LYS 88 9.827 8.558 -5.803 693 HG2 LYS 88 2HG LYS 88 11.212 9.323 -7.891 694 HG3 LYS 88 3HG LYS 88 9.757 10.169 -8.381 695 HD2 LYS 88 2HD LYS 88 10.734 11.857 -7.133 696 HD3 LYS 88 3HD LYS 88 9.836 11.071 -5.850 697 HE2 LYS 88 2HE LYS 88 12.671 10.188 -6.501 698 HE3 LYS 88 3HE LYS 88 12.390 11.587 -5.483 699 HZ1 LYS 88 2HZ LYS 88 11.904 8.788 -4.887 700 HZ3 LYS 88 1HZ LYS 88 10.746 9.800 -4.352 701 H GLU 89 HN GLU 89 7.031 7.216 -8.502 702 HA GLU 89 HA GLU 89 5.910 5.812 -6.394 703 HB2 GLU 89 2HB GLU 89 4.851 7.184 -8.401 704 HB3 GLU 89 3HB GLU 89 4.811 5.627 -9.205 705 HG2 GLU 89 2HG GLU 89 3.363 4.674 -7.555 706 HG3 GLU 89 3HG GLU 89 3.711 5.936 -6.389 707 HE2 GLU 89 HE2 GLU 89 0.737 6.030 -7.143 708 H GLU 90 HN GLU 90 7.315 4.749 -9.541 709 HA GLU 90 HA GLU 90 6.557 2.086 -9.271 710 HB2 GLU 90 2HB GLU 90 8.921 3.274 -10.793 711 HB3 GLU 90 3HB GLU 90 8.260 1.671 -11.043 712 HG2 GLU 90 2HG GLU 90 7.003 4.354 -11.679 713 HG3 GLU 90 3HG GLU 90 7.220 2.971 -12.734 714 HE2 GLU 90 HE2 GLU 90 4.362 1.349 -11.619 715 H ARG 91 HN ARG 91 9.309 3.988 -8.035 716 HA ARG 91 HA ARG 91 10.848 1.748 -7.345 717 HB2 ARG 91 2HB ARG 91 10.890 4.702 -6.732 718 HB3 ARG 91 3HB ARG 91 11.837 3.656 -5.692 719 HG2 ARG 91 2HG ARG 91 12.652 2.639 -8.049 720 HG3 ARG 91 3HG ARG 91 12.173 4.220 -8.636 721 HD2 ARG 91 2HD ARG 91 14.080 3.778 -6.287 722 HD3 ARG 91 3HD ARG 91 14.605 4.085 -7.931 723 HE ARG 91 HE ARG 91 13.589 6.050 -6.055 724 HH11 ARG 91 2HH2 ARG 91 13.736 5.283 -9.511 725 HH12 ARG 91 1HH2 ARG 91 13.573 6.932 -10.010 726 HH22 ARG 91 HH1 ARG 91 13.361 8.647 -8.349 727 H ALA 92 HN ALA 92 8.361 3.755 -5.714 728 HA ALA 92 HA ALA 92 8.782 2.827 -3.111 729 HB1 ALA 92 3HB ALA 92 6.851 4.420 -4.611 730 HB2 ALA 92 1HB ALA 92 6.049 3.405 -3.389 731 HB3 ALA 92 2HB ALA 92 7.333 4.536 -2.901 732 H ASP 93 HN ASP 93 6.233 1.850 -5.523 733 HA ASP 93 HA ASP 93 5.223 -0.212 -4.097 734 HB2 ASP 93 2HB ASP 93 5.599 0.185 -7.090 735 HB3 ASP 93 3HB ASP 93 4.765 -1.225 -6.469 736 HD2 ASP 93 HD2 ASP 93 3.026 1.347 -7.799 737 H LEU 94 HN LEU 94 7.840 -0.288 -6.636 738 HA LEU 94 HA LEU 94 8.419 -2.948 -6.608 739 HB2 LEU 94 2HB LEU 94 9.343 -1.334 -8.170 740 HB3 LEU 94 3HB LEU 94 10.294 -0.596 -6.897 741 HG LEU 94 HG LEU 94 11.527 -2.762 -6.630 742 HD11 LEU 94 1HD1 LEU 94 9.782 -4.234 -7.566 743 HD12 LEU 94 2HD1 LEU 94 10.095 -3.554 -9.180 744 HD13 LEU 94 3HD1 LEU 94 11.368 -4.471 -8.339 745 HD21 LEU 94 3HD2 LEU 94 12.071 -2.207 -9.438 746 HD22 LEU 94 1HD2 LEU 94 11.875 -0.722 -8.477 747 HD23 LEU 94 2HD2 LEU 94 13.080 -1.941 -7.996 748 H ILE 95 HN ILE 95 9.403 -0.411 -4.264 749 HA ILE 95 HA ILE 95 11.092 -2.210 -2.823 750 HB ILE 95 HB ILE 95 10.085 0.587 -2.396 751 HG12 ILE 95 2HG1 ILE 95 12.874 -0.544 -2.774 752 HG13 ILE 95 3HG1 ILE 95 11.896 0.166 -4.043 753 HG21 ILE 95 1HG2 ILE 95 11.896 0.398 -0.438 754 HG22 ILE 95 2HG2 ILE 95 10.159 0.105 -0.181 755 HG23 ILE 95 3HG2 ILE 95 11.269 -1.269 -0.396 756 HD11 ILE 95 3HD1 ILE 95 11.715 2.222 -2.367 757 HD12 ILE 95 1HD1 ILE 95 13.186 1.506 -1.665 758 HD13 ILE 95 2HD1 ILE 95 13.168 2.011 -3.372 759 H ALA 96 HN ALA 96 7.678 -1.259 -2.817 760 HA ALA 96 HA ALA 96 7.089 -2.146 -0.210 761 HB1 ALA 96 3HB ALA 96 5.787 -0.782 -2.216 762 HB2 ALA 96 1HB ALA 96 4.965 -2.360 -2.257 763 HB3 ALA 96 2HB ALA 96 5.009 -1.418 -0.747 764 H TYR 97 HN TYR 97 7.438 -3.746 -3.379 765 HA TYR 97 HA TYR 97 6.360 -6.224 -2.320 766 HB2 TYR 97 2HB TYR 97 5.802 -5.758 -4.618 767 HB3 TYR 97 3HB TYR 97 7.362 -5.026 -4.938 768 HD1 TYR 97 HD2 TYR 97 6.630 -8.381 -3.451 769 HD2 TYR 97 HD1 TYR 97 8.176 -6.205 -6.795 770 HE1 TYR 97 HE2 TYR 97 7.439 -10.551 -4.498 771 HE2 TYR 97 HE1 TYR 97 8.979 -8.384 -7.831 772 HH TYR 97 HH TYR 97 7.888 -11.241 -7.088 773 H LEU 98 HN LEU 98 9.485 -4.707 -3.207 774 HA LEU 98 HA LEU 98 10.998 -7.069 -3.124 775 HB2 LEU 98 2HB LEU 98 11.614 -4.138 -2.922 776 HB3 LEU 98 3HB LEU 98 12.870 -5.331 -2.667 777 HG LEU 98 HG LEU 98 11.181 -5.169 -5.176 778 HD11 LEU 98 1HD1 LEU 98 13.019 -4.060 -6.260 779 HD12 LEU 98 2HD1 LEU 98 12.553 -3.126 -4.819 780 HD13 LEU 98 3HD1 LEU 98 14.007 -4.151 -4.782 781 HD21 LEU 98 3HD2 LEU 98 11.976 -7.257 -5.408 782 HD22 LEU 98 1HD2 LEU 98 13.485 -6.436 -5.871 783 HD23 LEU 98 2HD2 LEU 98 13.265 -7.018 -4.203 784 H LYS 99 HN LYS 99 9.427 -5.196 -0.662 785 HA LYS 99 HA LYS 99 11.213 -6.240 1.394 786 HB2 LYS 99 2HB LYS 99 10.711 -3.895 1.574 787 HB3 LYS 99 3HB LYS 99 8.989 -4.186 1.444 788 HG2 LYS 99 2HG LYS 99 9.376 -5.744 3.567 789 HG3 LYS 99 3HG LYS 99 10.840 -4.800 3.759 790 HD2 LYS 99 2HD LYS 99 9.555 -2.709 3.853 791 HD3 LYS 99 3HD LYS 99 8.070 -3.553 3.460 792 HE2 LYS 99 2HE LYS 99 9.738 -4.085 5.966 793 HE3 LYS 99 3HE LYS 99 8.321 -3.055 5.925 794 HZ1 LYS 99 2HZ LYS 99 6.935 -4.877 5.561 795 HZ3 LYS 99 1HZ LYS 99 8.047 -5.544 6.545 796 H LYS 100 HN LYS 100 7.695 -6.175 0.501 797 HA LYS 100 HA LYS 100 6.963 -8.038 2.470 798 HB2 LYS 100 2HB LYS 100 5.479 -6.380 1.258 799 HB3 LYS 100 3HB LYS 100 5.525 -7.449 -0.130 800 HG2 LYS 100 2HG LYS 100 4.639 -9.318 1.305 801 HG3 LYS 100 3HG LYS 100 4.551 -8.215 2.664 802 HD2 LYS 100 2HD LYS 100 3.040 -6.721 1.213 803 HD3 LYS 100 3HD LYS 100 2.992 -8.029 0.049 804 HE2 LYS 100 2HE LYS 100 2.247 -9.529 2.069 805 HE3 LYS 100 3HE LYS 100 1.928 -8.018 2.898 806 HZ1 LYS 100 2HZ LYS 100 0.431 -7.397 1.076 807 HZ3 LYS 100 1HZ LYS 100 -0.042 -8.819 1.711 808 H ALA 101 HN ALA 101 8.760 -8.347 -0.452 809 HA ALA 101 HA ALA 101 7.922 -11.027 -1.032 810 HB1 ALA 101 3HB ALA 101 8.634 -9.772 -2.899 811 HB2 ALA 101 1HB ALA 101 10.059 -9.134 -2.043 812 HB3 ALA 101 2HB ALA 101 10.017 -10.839 -2.554 813 H THR 102 HN THR 102 10.976 -9.482 0.207 814 HA THR 102 HA THR 102 12.066 -12.008 0.959 815 HB THR 102 HB THR 102 13.906 -10.602 1.778 816 HG1 THR 102 HG1 THR 102 13.287 -8.646 2.610 817 HG21 THR 102 1HG2 THR 102 14.401 -10.143 -0.409 818 HG22 THR 102 2HG2 THR 102 12.674 -10.099 -0.839 819 HG23 THR 102 3HG2 THR 102 13.475 -8.634 -0.220 820 H ASN 103 HN ASN 103 9.797 -9.797 2.403 821 HA ASN 103 HA ASN 103 10.378 -10.288 5.060 822 HB2 ASN 103 2HB ASN 103 8.843 -8.486 4.326 823 HB3 ASN 103 3HB ASN 103 7.720 -9.661 3.671 824 HD21 ASN 103 1HD2 ASN 103 6.111 -10.302 4.887 825 HD22 ASN 103 2HD2 ASN 103 5.979 -10.159 6.608 826 H GLU 104 HN GLU 104 7.627 -11.596 3.041 827 HA GLU 104 HA GLU 104 6.714 -13.460 4.721 828 HB2 GLU 104 2HB GLU 104 6.044 -14.756 2.623 829 HB3 GLU 104 3HB GLU 104 5.561 -13.072 2.662 830 HG2 GLU 104 2HG GLU 104 7.403 -12.423 1.204 831 HG3 GLU 104 3HG GLU 104 8.141 -14.007 1.331 832 HE2 GLU 104 HE2 GLU 104 4.908 -12.785 -0.043 833 HHA HEC 500 HHA HEC 500 23.505 -7.254 -5.047 834 HHB HEC 500 HHB HEC 500 17.512 -5.017 -5.151 835 HHC HEC 500 HHC HEC 500 17.664 -5.701 -11.561 836 HHD HEC 500 HHD HEC 500 22.856 -9.399 -10.990 837 HMA1 HEC 500 1HMA HEC 500 18.241 -5.200 -2.954 838 HMA2 HEC 500 2HMA HEC 500 19.731 -5.327 -2.012 839 HMA3 HEC 500 3HMA HEC 500 19.449 -3.888 -3.009 840 HAA1 HEC 500 1HAA HEC 500 23.178 -5.836 -3.137 841 HAA2 HEC 500 2HAA HEC 500 21.809 -5.725 -2.149 842 HBA1 HEC 500 1HBA HEC 500 22.928 -8.292 -3.331 843 HBA2 HEC 500 2HBA HEC 500 22.960 -7.799 -1.627 844 HMB1 HEC 500 1HMB HEC 500 14.434 -5.004 -7.351 845 HMB2 HEC 500 2HMB HEC 500 15.397 -5.083 -5.892 846 HMB3 HEC 500 3HMB HEC 500 15.331 -3.555 -6.798 847 HAB HEC 500 HAB HEC 500 16.081 -4.335 -11.010 848 HBB1 HEC 500 1HBB HEC 500 14.001 -3.510 -9.062 849 HBB2 HEC 500 2HBB HEC 500 15.576 -2.686 -9.192 850 HBB3 HEC 500 3HBB HEC 500 14.506 -2.755 -10.577 851 HMC1 HEC 500 1HMC HEC 500 17.951 -8.271 -13.575 852 HMC2 HEC 500 2HMC HEC 500 18.066 -6.505 -13.548 853 HMC3 HEC 500 3HMC HEC 500 19.245 -7.432 -14.454 854 HAC HEC 500 HAC HEC 500 21.816 -10.092 -12.682 855 HBC1 HEC 500 1HBC HEC 500 22.355 -8.254 -14.267 856 HBC2 HEC 500 2HBC HEC 500 21.996 -9.817 -15.034 857 HBC3 HEC 500 3HBC HEC 500 20.784 -8.539 -15.058 858 HMD1 HEC 500 1HMD HEC 500 24.628 -10.991 -9.215 859 HMD2 HEC 500 2HMD HEC 500 25.069 -9.657 -10.296 860 HMD3 HEC 500 3HMD HEC 500 25.930 -9.912 -8.752 861 HAD1 HEC 500 1HAD HEC 500 25.246 -8.246 -5.427 862 HAD2 HEC 500 2HAD HEC 500 25.597 -9.692 -6.273 863 HBD1 HEC 500 1HBD HEC 500 26.496 -8.057 -8.167 864 HBD2 HEC 500 2HBD HEC 500 26.480 -6.864 -6.850 Start of MODEL 11 1 H1 GLY 1 HN GLY 1 0.794 0.524 0.144 2 HA2 GLY 1 1HA GLY 1 1.698 0.722 -1.913 3 HA3 GLY 1 2HA GLY 1 3.110 -0.008 -1.176 4 H ASP 2 HN ASP 2 0.771 -0.333 -3.621 5 HA ASP 2 HA ASP 2 0.081 -2.876 -3.811 6 HB2 ASP 2 2HB ASP 2 1.208 -1.032 -5.956 7 HB3 ASP 2 3HB ASP 2 0.557 -2.607 -6.360 8 HD2 ASP 2 HD2 ASP 2 -1.935 0.234 -5.022 9 H VAL 3 HN VAL 3 1.064 -4.805 -4.943 10 HA VAL 3 HA VAL 3 3.993 -4.783 -4.701 11 HB VAL 3 HB VAL 3 3.382 -7.385 -4.563 12 HG11 VAL 3 1HG1 VAL 3 4.352 -5.445 -2.844 13 HG12 VAL 3 2HG1 VAL 3 2.981 -6.134 -1.941 14 HG13 VAL 3 3HG1 VAL 3 4.288 -7.194 -2.520 15 HG21 VAL 3 3HG2 VAL 3 0.980 -7.118 -4.734 16 HG22 VAL 3 1HG2 VAL 3 1.391 -7.671 -3.093 17 HG23 VAL 3 2HG2 VAL 3 0.973 -5.964 -3.379 18 H GLU 4 HN GLU 4 1.200 -6.279 -6.476 19 HA GLU 4 HA GLU 4 2.438 -7.566 -8.415 20 HB2 GLU 4 2HB GLU 4 0.500 -6.439 -9.932 21 HB3 GLU 4 3HB GLU 4 0.169 -7.670 -8.729 22 HG2 GLU 4 2HG GLU 4 -0.867 -6.193 -7.299 23 HG3 GLU 4 3HG GLU 4 0.271 -4.903 -7.637 24 HE2 GLU 4 HE2 GLU 4 -3.010 -4.102 -9.117 25 H LYS 5 HN LYS 5 1.696 -4.005 -8.585 26 HA LYS 5 HA LYS 5 2.832 -3.432 -10.973 27 HB2 LYS 5 2HB LYS 5 2.497 -1.909 -8.414 28 HB3 LYS 5 3HB LYS 5 3.454 -1.191 -9.695 29 HG2 LYS 5 2HG LYS 5 1.027 -0.557 -9.823 30 HG3 LYS 5 3HG LYS 5 1.597 -1.354 -11.277 31 HD2 LYS 5 2HD LYS 5 0.618 -3.498 -10.541 32 HD3 LYS 5 3HD LYS 5 0.158 -2.799 -9.002 33 HE2 LYS 5 2HE LYS 5 -1.789 -2.867 -10.522 34 HE3 LYS 5 3HE LYS 5 -1.367 -1.206 -10.156 35 HZ1 LYS 5 2HZ LYS 5 -1.309 -0.960 -12.386 36 HZ3 LYS 5 1HZ LYS 5 -1.261 -2.559 -12.687 37 H GLY 6 HN GLY 6 4.496 -3.835 -7.795 38 HA2 GLY 6 1HA GLY 6 7.082 -3.225 -8.845 39 HA3 GLY 6 2HA GLY 6 6.697 -3.925 -7.285 40 H LYS 7 HN LYS 7 5.028 -6.120 -8.622 41 HA LYS 7 HA LYS 7 7.198 -7.948 -8.934 42 HB2 LYS 7 2HB LYS 7 4.988 -8.408 -7.785 43 HB3 LYS 7 3HB LYS 7 4.244 -8.448 -9.370 44 HG2 LYS 7 2HG LYS 7 5.292 -10.438 -9.977 45 HG3 LYS 7 3HG LYS 7 6.719 -10.112 -9.014 46 HD2 LYS 7 2HD LYS 7 5.240 -11.994 -8.136 47 HD3 LYS 7 3HD LYS 7 5.615 -10.745 -6.965 48 HE2 LYS 7 2HE LYS 7 3.133 -11.536 -7.161 49 HE3 LYS 7 3HE LYS 7 3.440 -9.814 -7.051 50 HZ1 LYS 7 2HZ LYS 7 2.104 -9.868 -8.900 51 HZ3 LYS 7 1HZ LYS 7 2.563 -11.356 -9.375 52 H LYS 8 HN LYS 8 5.345 -5.860 -11.016 53 HA LYS 8 HA LYS 8 6.007 -7.463 -13.356 54 HB2 LYS 8 2HB LYS 8 4.281 -5.004 -12.967 55 HB3 LYS 8 3HB LYS 8 4.629 -5.705 -14.534 56 HG2 LYS 8 2HG LYS 8 3.556 -7.465 -12.309 57 HG3 LYS 8 3HG LYS 8 2.455 -6.444 -13.212 58 HD2 LYS 8 2HD LYS 8 3.547 -7.481 -15.351 59 HD3 LYS 8 3HD LYS 8 4.213 -8.690 -14.271 60 HE2 LYS 8 2HE LYS 8 1.924 -9.279 -13.484 61 HE3 LYS 8 3HE LYS 8 1.236 -8.034 -14.509 62 HZ1 LYS 8 2HZ LYS 8 2.429 -9.294 -16.398 63 HZ3 LYS 8 1HZ LYS 8 1.083 -9.977 -15.786 64 H ILE 9 HN ILE 9 7.183 -4.824 -11.427 65 HA ILE 9 HA ILE 9 8.787 -3.829 -13.656 66 HB ILE 9 HB ILE 9 8.216 -2.752 -10.897 67 HG12 ILE 9 2HG1 ILE 9 7.605 -1.325 -13.459 68 HG13 ILE 9 3HG1 ILE 9 6.562 -2.647 -12.972 69 HG21 ILE 9 1HG2 ILE 9 10.423 -2.176 -12.729 70 HG22 ILE 9 2HG2 ILE 9 9.469 -0.735 -12.302 71 HG23 ILE 9 3HG2 ILE 9 10.196 -1.732 -11.020 72 HD11 ILE 9 3HD1 ILE 9 5.486 -1.040 -11.750 73 HD12 ILE 9 1HD1 ILE 9 6.809 -1.291 -10.586 74 HD13 ILE 9 2HD1 ILE 9 6.898 0.045 -11.758 75 H PHE 10 HN PHE 10 8.857 -6.043 -11.021 76 HA PHE 10 HA PHE 10 11.685 -5.764 -10.554 77 HB2 PHE 10 2HB PHE 10 10.391 -6.438 -8.650 78 HB3 PHE 10 3HB PHE 10 9.329 -7.443 -9.615 79 HD1 PHE 10 HD2 PHE 10 12.935 -7.278 -8.645 80 HD2 PHE 10 HD1 PHE 10 9.557 -9.727 -9.420 81 HE1 PHE 10 HE2 PHE 10 14.255 -9.307 -7.985 82 HE2 PHE 10 HE1 PHE 10 10.877 -11.757 -8.760 83 HZ PHE 10 HZ PHE 10 13.211 -11.523 -8.051 84 H ILE 11 HN ILE 11 9.465 -7.705 -12.529 85 HA ILE 11 HA ILE 11 11.465 -9.697 -13.087 86 HB ILE 11 HB ILE 11 8.680 -9.187 -14.126 87 HG12 ILE 11 2HG1 ILE 11 9.786 -11.336 -12.293 88 HG13 ILE 11 3HG1 ILE 11 8.865 -9.938 -11.777 89 HG21 ILE 11 1HG2 ILE 11 9.035 -11.627 -14.995 90 HG22 ILE 11 2HG2 ILE 11 9.596 -10.240 -15.960 91 HG23 ILE 11 3HG2 ILE 11 10.757 -11.174 -14.985 92 HD11 ILE 11 3HD1 ILE 11 7.936 -12.430 -13.096 93 HD12 ILE 11 1HD1 ILE 11 7.059 -11.317 -12.018 94 HD13 ILE 11 2HD1 ILE 11 7.217 -10.938 -13.750 95 H MET 12 HN MET 12 9.557 -7.472 -15.240 96 HA MET 12 HA MET 12 10.960 -7.671 -17.458 97 HB2 MET 12 2HB MET 12 9.681 -5.311 -16.047 98 HB3 MET 12 3HB MET 12 10.558 -4.991 -17.530 99 HG2 MET 12 2HG MET 12 8.531 -7.245 -17.470 100 HG3 MET 12 3HG MET 12 7.968 -5.592 -17.614 101 HE1 MET 12 3HE MET 12 7.631 -8.001 -19.241 102 HE2 MET 12 1HE MET 12 7.625 -7.362 -20.903 103 HE3 MET 12 2HE MET 12 8.922 -8.461 -20.376 104 H LYS 13 HN LYS 13 12.090 -6.142 -14.461 105 HA LYS 13 HA LYS 13 14.506 -5.248 -15.855 106 HB2 LYS 13 2HB LYS 13 13.031 -4.330 -13.427 107 HB3 LYS 13 3HB LYS 13 14.775 -4.168 -13.420 108 HG2 LYS 13 2HG LYS 13 14.789 -2.643 -15.194 109 HG3 LYS 13 3HG LYS 13 13.325 -3.287 -15.907 110 HD2 LYS 13 2HD LYS 13 12.867 -1.072 -14.941 111 HD3 LYS 13 3HD LYS 13 11.974 -2.293 -14.058 112 HE2 LYS 13 2HE LYS 13 14.731 -1.552 -13.069 113 HE3 LYS 13 3HE LYS 13 13.419 -0.427 -12.780 114 HZ1 LYS 13 2HZ LYS 13 13.411 -1.885 -10.942 115 HZ3 LYS 13 1HZ LYS 13 13.610 -3.227 -11.842 116 H CYS 14 HN CYS 14 13.656 -6.610 -12.591 117 HA CYS 14 HA CYS 14 16.208 -7.933 -12.550 118 HB2 CYS 14 2HB CYS 14 14.212 -8.503 -10.441 119 HB3 CYS 14 3HB CYS 14 15.925 -8.159 -10.316 120 H SER 15 HN SER 15 15.230 -9.036 -14.700 121 HA SER 15 HA SER 15 13.613 -11.314 -13.918 122 HB2 SER 15 2HB SER 15 13.847 -11.542 -16.630 123 HB3 SER 15 3HB SER 15 12.575 -10.638 -15.833 124 HG SER 15 HG SER 15 13.323 -8.952 -16.914 125 H GLN 16 HN GLN 16 14.273 -13.507 -14.616 126 HA GLN 16 HA GLN 16 15.796 -15.084 -14.425 127 HB2 GLN 16 2HB GLN 16 16.421 -13.547 -16.927 128 HB3 GLN 16 3HB GLN 16 17.566 -14.788 -16.456 129 HG2 GLN 16 2HG GLN 16 15.368 -16.270 -16.134 130 HG3 GLN 16 3HG GLN 16 14.652 -15.086 -17.209 131 HE21 GLN 16 1HE2 GLN 16 14.395 -16.928 -18.622 132 HE22 GLN 16 2HE2 GLN 16 15.685 -17.413 -19.672 133 H CYS 17 HN CYS 17 16.380 -12.759 -12.721 134 HA CYS 17 HA CYS 17 19.260 -13.181 -12.507 135 HB2 CYS 17 2HB CYS 17 17.815 -10.570 -12.688 136 HB3 CYS 17 3HB CYS 17 19.201 -10.688 -11.623 137 H HIS 18 HN HIS 18 16.567 -11.367 -10.847 138 HA HIS 18 HA HIS 18 17.423 -12.612 -8.358 139 HB2 HIS 18 2HB HIS 18 15.764 -10.178 -9.017 140 HB3 HIS 18 3HB HIS 18 15.772 -10.871 -7.408 141 HD1 HIS 18 HD1 HIS 18 18.494 -11.292 -6.543 142 HD2 HIS 18 HD2 HIS 18 17.612 -8.194 -9.230 143 HE1 HIS 18 HE1 HIS 18 20.427 -9.633 -6.383 144 H THR 19 HN THR 19 15.861 -13.633 -6.927 145 HA THR 19 HA THR 19 13.521 -14.644 -8.407 146 HB THR 19 HB THR 19 13.869 -16.662 -6.837 147 HG1 THR 19 HG1 THR 19 15.257 -15.674 -5.291 148 HG21 THR 19 1HG2 THR 19 16.493 -16.539 -8.167 149 HG22 THR 19 2HG2 THR 19 15.133 -17.645 -8.476 150 HG23 THR 19 3HG2 THR 19 15.180 -16.049 -9.265 151 H VAL 20 HN VAL 20 14.782 -13.201 -5.416 152 HA VAL 20 HA VAL 20 13.766 -12.486 -3.578 153 HB VAL 20 HB VAL 20 11.893 -11.039 -3.933 154 HG11 VAL 20 1HG1 VAL 20 12.682 -9.799 -6.028 155 HG12 VAL 20 2HG1 VAL 20 13.893 -10.082 -4.756 156 HG13 VAL 20 3HG1 VAL 20 13.882 -11.102 -6.214 157 HG21 VAL 20 3HG2 VAL 20 11.516 -12.114 -6.731 158 HG22 VAL 20 1HG2 VAL 20 10.634 -12.789 -5.341 159 HG23 VAL 20 2HG2 VAL 20 10.434 -11.075 -5.776 160 H GLU 21 HN GLU 21 13.381 -15.357 -4.350 161 HA GLU 21 HA GLU 21 10.810 -15.770 -3.036 162 HB2 GLU 21 2HB GLU 21 12.340 -17.387 -5.088 163 HB3 GLU 21 3HB GLU 21 11.184 -18.185 -4.040 164 HG2 GLU 21 2HG GLU 21 10.355 -15.658 -5.488 165 HG3 GLU 21 3HG GLU 21 10.407 -17.169 -6.375 166 HE2 GLU 21 HE2 GLU 21 7.190 -17.477 -5.383 167 H LYS 22 HN LYS 22 10.688 -17.550 -1.432 168 HA LYS 22 HA LYS 22 12.908 -17.477 0.312 169 HB2 LYS 22 2HB LYS 22 10.674 -19.473 0.547 170 HB3 LYS 22 3HB LYS 22 11.550 -18.633 1.811 171 HG2 LYS 22 2HG LYS 22 10.515 -16.452 0.695 172 HG3 LYS 22 3HG LYS 22 9.363 -17.575 0.002 173 HD2 LYS 22 2HD LYS 22 9.962 -17.630 2.980 174 HD3 LYS 22 3HD LYS 22 8.823 -16.470 2.327 175 HE2 LYS 22 2HE LYS 22 7.652 -18.521 3.084 176 HE3 LYS 22 3HE LYS 22 7.462 -18.302 1.356 177 HZ1 LYS 22 2HZ LYS 22 8.173 -20.460 1.364 178 HZ3 LYS 22 1HZ LYS 22 8.987 -20.342 2.770 179 H GLY 23 HN GLY 23 11.425 -20.144 -1.662 180 HA2 GLY 23 1HA GLY 23 13.634 -21.904 -1.118 181 HA3 GLY 23 2HA GLY 23 12.271 -22.186 -2.182 182 H GLY 24 HN GLY 24 12.967 -19.320 -3.374 183 HA2 GLY 24 1HA GLY 24 14.012 -19.986 -5.749 184 HA3 GLY 24 2HA GLY 24 14.327 -18.449 -4.966 185 H LYS 25 HN LYS 25 16.131 -19.938 -6.754 186 HA LYS 25 HA LYS 25 18.283 -20.515 -4.839 187 HB2 LYS 25 2HB LYS 25 19.087 -22.217 -6.201 188 HB3 LYS 25 3HB LYS 25 17.350 -22.436 -6.279 189 HG2 LYS 25 2HG LYS 25 18.974 -20.881 -8.347 190 HG3 LYS 25 3HG LYS 25 18.499 -22.558 -8.531 191 HD2 LYS 25 2HD LYS 25 16.058 -21.513 -7.968 192 HD3 LYS 25 3HD LYS 25 16.802 -20.077 -8.642 193 HE2 LYS 25 2HE LYS 25 17.480 -21.462 -10.671 194 HE3 LYS 25 3HE LYS 25 16.563 -22.799 -10.008 195 HZ1 LYS 25 2HZ LYS 25 14.558 -21.516 -10.170 196 HZ3 LYS 25 1HZ LYS 25 15.306 -21.359 -11.609 197 H HIS 26 HN HIS 26 20.516 -20.006 -5.737 198 HA HIS 26 HA HIS 26 20.457 -17.327 -6.666 199 HB2 HIS 26 2HB HIS 26 22.948 -19.002 -6.542 200 HB3 HIS 26 3HB HIS 26 22.745 -17.292 -6.221 201 HD1 HIS 26 HD1 HIS 26 22.320 -16.590 -3.819 202 HD2 HIS 26 HD2 HIS 26 21.927 -20.725 -4.405 203 HE1 HIS 26 HE1 HIS 26 22.078 -17.621 -1.497 204 H LYS 27 HN LYS 27 20.398 -16.617 -8.738 205 HA LYS 27 HA LYS 27 21.123 -18.570 -10.807 206 HB2 LYS 27 2HB LYS 27 18.966 -16.503 -10.612 207 HB3 LYS 27 3HB LYS 27 19.644 -16.851 -12.191 208 HG2 LYS 27 2HG LYS 27 19.298 -19.399 -11.386 209 HG3 LYS 27 3HG LYS 27 18.093 -18.664 -10.346 210 HD2 LYS 27 2HD LYS 27 18.230 -18.409 -13.388 211 HD3 LYS 27 3HD LYS 27 17.077 -19.376 -12.488 212 HE2 LYS 27 2HE LYS 27 16.197 -17.298 -11.392 213 HE3 LYS 27 3HE LYS 27 17.342 -16.335 -12.304 214 HZ1 LYS 27 2HZ LYS 27 15.034 -17.852 -13.350 215 HZ3 LYS 27 1HZ LYS 27 16.253 -17.436 -14.346 216 H THR 28 HN THR 28 20.596 -15.189 -11.587 217 HA THR 28 HA THR 28 23.280 -14.991 -12.568 218 HB THR 28 HB THR 28 21.236 -12.744 -12.349 219 HG1 THR 28 HG1 THR 28 20.520 -13.848 -14.460 220 HG21 THR 28 1HG2 THR 28 22.328 -11.861 -14.192 221 HG22 THR 28 2HG2 THR 28 23.693 -12.833 -13.591 222 HG23 THR 28 3HG2 THR 28 22.650 -13.467 -14.886 223 H GLY 29 HN GLY 29 21.559 -14.068 -9.624 224 HA2 GLY 29 1HA GLY 29 24.106 -13.053 -8.571 225 HA3 GLY 29 2HA GLY 29 22.686 -12.031 -8.482 226 HA PRO 30 HA PRO 30 22.605 -14.631 -4.775 227 HB2 PRO 30 2HB PRO 30 22.326 -12.626 -2.938 228 HB3 PRO 30 3HB PRO 30 23.878 -13.305 -3.389 229 HG2 PRO 30 2HG PRO 30 22.697 -10.707 -4.161 230 HG3 PRO 30 3HG PRO 30 24.371 -11.218 -4.238 231 HD2 PRO 30 2HD PRO 30 22.536 -11.017 -6.434 232 HD3 PRO 30 3HD PRO 30 24.174 -11.638 -6.490 233 H ASN 31 HN ASN 31 20.891 -15.329 -3.422 234 HA ASN 31 HA ASN 31 18.426 -14.707 -4.646 235 HB2 ASN 31 2HB ASN 31 18.833 -16.963 -3.757 236 HB3 ASN 31 3HB ASN 31 19.170 -16.327 -2.159 237 HD21 ASN 31 1HD2 ASN 31 16.882 -17.676 -4.150 238 HD22 ASN 31 2HD2 ASN 31 15.432 -17.298 -3.280 239 H LEU 32 HN LEU 32 16.774 -13.321 -3.846 240 HA LEU 32 HA LEU 32 17.551 -11.659 -1.583 241 HB2 LEU 32 2HB LEU 32 15.460 -11.345 -3.739 242 HB3 LEU 32 3HB LEU 32 15.650 -10.238 -2.394 243 HG LEU 32 HG LEU 32 17.362 -10.627 -4.805 244 HD11 LEU 32 1HD1 LEU 32 17.470 -7.996 -3.796 245 HD12 LEU 32 2HD1 LEU 32 16.555 -8.601 -5.198 246 HD13 LEU 32 3HD1 LEU 32 15.790 -8.546 -3.593 247 HD21 LEU 32 3HD2 LEU 32 18.994 -11.141 -3.143 248 HD22 LEU 32 1HD2 LEU 32 19.260 -9.458 -3.655 249 HD23 LEU 32 2HD2 LEU 32 18.452 -9.800 -2.105 250 H HIS 33 HN HIS 33 17.180 -13.311 0.050 251 HA HIS 33 HA HIS 33 14.349 -13.963 0.373 252 HB2 HIS 33 2HB HIS 33 15.790 -15.899 0.250 253 HB3 HIS 33 3HB HIS 33 16.854 -15.253 1.484 254 HD1 HIS 33 HD1 HIS 33 13.028 -15.547 1.550 255 HD2 HIS 33 HD2 HIS 33 16.415 -16.905 3.619 256 HE1 HIS 33 HE1 HIS 33 12.160 -16.855 3.562 257 H GLY 34 HN GLY 34 17.280 -13.069 2.339 258 HA2 GLY 34 1HA GLY 34 15.474 -11.838 4.310 259 HA3 GLY 34 2HA GLY 34 17.136 -12.330 4.572 260 H LEU 35 HN LEU 35 15.875 -10.509 1.726 261 HA LEU 35 HA LEU 35 17.869 -8.727 1.506 262 HB2 LEU 35 2HB LEU 35 16.069 -8.980 -0.090 263 HB3 LEU 35 3HB LEU 35 14.919 -8.285 1.035 264 HG LEU 35 HG LEU 35 16.301 -6.151 0.956 265 HD11 LEU 35 1HD1 LEU 35 17.403 -6.649 -1.667 266 HD12 LEU 35 2HD1 LEU 35 18.191 -6.023 -0.200 267 HD13 LEU 35 3HD1 LEU 35 18.085 -7.779 -0.472 268 HD21 LEU 35 3HD2 LEU 35 14.701 -7.247 -1.334 269 HD22 LEU 35 1HD2 LEU 35 14.278 -5.992 -0.144 270 HD23 LEU 35 2HD2 LEU 35 15.433 -5.629 -1.449 271 H PHE 36 HN PHE 36 14.874 -8.232 3.502 272 HA PHE 36 HA PHE 36 16.093 -5.901 4.692 273 HB2 PHE 36 2HB PHE 36 13.443 -7.385 4.665 274 HB3 PHE 36 3HB PHE 36 13.752 -6.351 6.046 275 HD1 PHE 36 HD2 PHE 36 13.185 -6.426 2.427 276 HD2 PHE 36 HD1 PHE 36 13.799 -3.945 5.814 277 HE1 PHE 36 HE2 PHE 36 12.419 -4.433 1.106 278 HE2 PHE 36 HE1 PHE 36 13.033 -1.953 4.494 279 HZ PHE 36 HZ PHE 36 12.353 -2.220 2.156 280 H GLY 37 HN GLY 37 17.653 -6.273 6.218 281 HA2 GLY 37 1HA GLY 37 17.978 -6.745 8.532 282 HA3 GLY 37 2HA GLY 37 16.957 -8.162 8.378 283 H ARG 38 HN ARG 38 19.314 -7.312 5.845 284 HA ARG 38 HA ARG 38 21.101 -9.328 6.910 285 HB2 ARG 38 2HB ARG 38 19.669 -10.459 5.219 286 HB3 ARG 38 3HB ARG 38 20.056 -9.226 4.034 287 HG2 ARG 38 2HG ARG 38 22.557 -9.894 4.453 288 HG3 ARG 38 3HG ARG 38 21.905 -11.328 5.221 289 HD2 ARG 38 2HD ARG 38 21.077 -10.481 2.410 290 HD3 ARG 38 3HD ARG 38 22.465 -11.512 2.700 291 HE ARG 38 HE ARG 38 20.000 -12.431 4.015 292 HH11 ARG 38 2HH2 ARG 38 21.980 -12.604 1.082 293 HH12 ARG 38 1HH2 ARG 38 21.303 -14.113 0.566 294 HH22 ARG 38 HH1 ARG 38 19.616 -15.162 1.905 295 H LYS 39 HN LYS 39 23.211 -8.588 6.876 296 HA LYS 39 HA LYS 39 23.793 -6.028 5.915 297 HB2 LYS 39 2HB LYS 39 25.251 -8.264 7.199 298 HB3 LYS 39 3HB LYS 39 26.240 -7.182 6.241 299 HG2 LYS 39 2HG LYS 39 25.379 -5.224 7.487 300 HG3 LYS 39 3HG LYS 39 24.278 -6.248 8.387 301 HD2 LYS 39 2HD LYS 39 26.081 -6.029 9.885 302 HD3 LYS 39 3HD LYS 39 26.426 -7.567 9.118 303 HE2 LYS 39 2HE LYS 39 27.727 -5.940 7.369 304 HE3 LYS 39 3HE LYS 39 27.824 -4.926 8.795 305 HZ1 LYS 39 2HZ LYS 39 28.952 -7.619 8.412 306 HZ3 LYS 39 1HZ LYS 39 28.627 -7.110 9.924 307 H THR 40 HN THR 40 26.136 -6.040 4.513 308 HA THR 40 HA THR 40 25.229 -7.076 1.935 309 HB THR 40 HB THR 40 27.121 -5.470 1.174 310 HG1 THR 40 HG1 THR 40 28.223 -5.381 3.223 311 HG21 THR 40 1HG2 THR 40 25.605 -3.548 2.675 312 HG22 THR 40 2HG2 THR 40 25.398 -3.986 0.963 313 HG23 THR 40 3HG2 THR 40 24.480 -4.850 2.220 314 H GLY 41 HN GLY 41 25.865 -9.054 1.364 315 HA2 GLY 41 1HA GLY 41 27.460 -10.562 0.673 316 HA3 GLY 41 2HA GLY 41 28.697 -9.695 1.561 317 H GLN 42 HN GLN 42 25.577 -11.432 2.283 318 HA GLN 42 HA GLN 42 26.975 -12.592 4.566 319 HB2 GLN 42 2HB GLN 42 23.971 -12.215 4.190 320 HB3 GLN 42 3HB GLN 42 24.756 -12.845 5.625 321 HG2 GLN 42 2HG GLN 42 24.932 -10.020 4.499 322 HG3 GLN 42 3HG GLN 42 24.295 -10.514 6.056 323 HE21 GLN 42 1HE2 GLN 42 26.909 -9.278 4.431 324 HE22 GLN 42 2HE2 GLN 42 28.167 -9.537 5.594 325 H ALA 43 HN ALA 43 24.794 -13.180 1.772 326 HA ALA 43 HA ALA 43 24.045 -15.728 2.059 327 HB1 ALA 43 3HB ALA 43 25.278 -14.522 -0.451 328 HB2 ALA 43 1HB ALA 43 24.138 -15.888 -0.386 329 HB3 ALA 43 2HB ALA 43 23.606 -14.260 0.100 330 HA PRO 44 HA PRO 44 28.024 -17.578 2.678 331 HB2 PRO 44 2HB PRO 44 27.142 -19.717 4.132 332 HB3 PRO 44 3HB PRO 44 27.605 -18.190 4.858 333 HG2 PRO 44 2HG PRO 44 24.897 -19.292 4.426 334 HG3 PRO 44 3HG PRO 44 25.399 -18.004 5.504 335 HD2 PRO 44 2HD PRO 44 24.061 -17.708 2.983 336 HD3 PRO 44 3HD PRO 44 24.668 -16.421 4.006 337 H GLY 45 HN GLY 45 25.467 -18.299 0.790 338 HA2 GLY 45 1HA GLY 45 26.629 -20.842 -0.129 339 HA3 GLY 45 2HA GLY 45 25.020 -20.240 -0.470 340 H TYR 46 HN TYR 46 26.530 -17.433 -0.815 341 HA TYR 46 HA TYR 46 27.877 -17.925 -3.331 342 HB2 TYR 46 2HB TYR 46 25.299 -17.737 -3.661 343 HB3 TYR 46 3HB TYR 46 25.404 -16.117 -2.999 344 HD1 TYR 46 HD1 TYR 46 27.672 -17.852 -5.427 345 HD2 TYR 46 HD2 TYR 46 24.881 -14.679 -4.764 346 HE1 TYR 46 HE1 TYR 46 28.158 -16.931 -7.746 347 HE2 TYR 46 HE2 TYR 46 25.376 -13.768 -7.086 348 HH TYR 46 HH TYR 46 26.409 -14.087 -8.959 349 H SER 47 HN SER 47 29.659 -16.655 -3.325 350 HA SER 47 HA SER 47 29.611 -14.363 -1.564 351 HB2 SER 47 2HB SER 47 32.162 -14.396 -2.319 352 HB3 SER 47 3HB SER 47 31.569 -15.518 -1.110 353 HG SER 47 HG SER 47 32.207 -17.089 -2.403 354 H TYR 48 HN TYR 48 29.903 -12.218 -2.299 355 HA TYR 48 HA TYR 48 29.598 -11.896 -5.187 356 HB2 TYR 48 2HB TYR 48 29.523 -9.744 -3.019 357 HB3 TYR 48 3HB TYR 48 28.614 -9.783 -4.516 358 HD1 TYR 48 HD2 TYR 48 27.798 -12.831 -4.009 359 HD2 TYR 48 HD1 TYR 48 27.498 -9.219 -1.736 360 HE1 TYR 48 HE2 TYR 48 25.792 -13.773 -2.763 361 HE2 TYR 48 HE1 TYR 48 25.494 -10.174 -0.497 362 HH TYR 48 HH TYR 48 23.865 -11.780 -0.682 363 H THR 49 HN THR 49 30.556 -9.420 -5.702 364 HA THR 49 HA THR 49 33.327 -9.839 -5.870 365 HB THR 49 HB THR 49 33.227 -7.427 -6.722 366 HG1 THR 49 HG1 THR 49 30.854 -6.740 -6.804 367 HG21 THR 49 1HG2 THR 49 30.907 -8.238 -8.162 368 HG22 THR 49 2HG2 THR 49 32.600 -8.440 -8.673 369 HG23 THR 49 3HG2 THR 49 31.779 -9.741 -7.779 370 H ALA 50 HN ALA 50 34.876 -7.901 -5.184 371 HA ALA 50 HA ALA 50 34.835 -8.005 -2.311 372 HB1 ALA 50 3HB ALA 50 36.812 -8.113 -4.153 373 HB2 ALA 50 1HB ALA 50 36.841 -6.369 -3.799 374 HB3 ALA 50 2HB ALA 50 37.073 -7.548 -2.485 375 H ALA 51 HN ALA 51 33.621 -5.933 -4.795 376 HA ALA 51 HA ALA 51 33.915 -3.475 -3.389 377 HB1 ALA 51 3HB ALA 51 33.680 -3.706 -5.869 378 HB2 ALA 51 1HB ALA 51 32.004 -4.254 -5.628 379 HB3 ALA 51 2HB ALA 51 32.476 -2.604 -5.156 380 H ASN 52 HN ASN 52 31.182 -5.801 -3.947 381 HA ASN 52 HA ASN 52 29.457 -4.348 -2.276 382 HB2 ASN 52 2HB ASN 52 28.900 -6.093 -4.150 383 HB3 ASN 52 3HB ASN 52 29.212 -7.319 -2.937 384 HD21 ASN 52 1HD2 ASN 52 27.950 -7.371 -1.023 385 HD22 ASN 52 2HD2 ASN 52 26.338 -6.738 -0.981 386 H LYS 53 HN LYS 53 31.307 -7.472 -1.976 387 HA LYS 53 HA LYS 53 30.557 -8.227 0.525 388 HB2 LYS 53 2HB LYS 53 32.059 -9.413 -1.156 389 HB3 LYS 53 3HB LYS 53 33.385 -8.455 -0.530 390 HG2 LYS 53 2HG LYS 53 32.544 -9.318 1.835 391 HG3 LYS 53 3HG LYS 53 31.737 -10.560 0.898 392 HD2 LYS 53 2HD LYS 53 34.101 -10.854 -0.266 393 HD3 LYS 53 3HD LYS 53 34.710 -10.017 1.148 394 HE2 LYS 53 2HE LYS 53 33.282 -11.776 2.510 395 HE3 LYS 53 3HE LYS 53 33.279 -12.691 1.015 396 HZ1 LYS 53 2HZ LYS 53 35.907 -11.792 1.541 397 HZ3 LYS 53 1HZ LYS 53 35.374 -13.328 1.448 398 H ASN 54 HN ASN 54 33.023 -5.772 -0.416 399 HA ASN 54 HA ASN 54 33.997 -5.339 2.121 400 HB2 ASN 54 2HB ASN 54 33.877 -3.778 -0.454 401 HB3 ASN 54 3HB ASN 54 34.277 -2.868 0.989 402 HD21 ASN 54 1HD2 ASN 54 34.980 -6.267 0.334 403 HD22 ASN 54 2HD2 ASN 54 36.707 -6.149 0.315 404 H LYS 55 HN LYS 55 31.133 -4.102 0.343 405 HA LYS 55 HA LYS 55 30.438 -1.923 1.809 406 HB2 LYS 55 2HB LYS 55 29.337 -3.158 -0.249 407 HB3 LYS 55 3HB LYS 55 28.322 -3.882 0.981 408 HG2 LYS 55 2HG LYS 55 27.101 -1.948 0.472 409 HG3 LYS 55 3HG LYS 55 28.030 -1.405 1.855 410 HD2 LYS 55 2HD LYS 55 29.821 -0.756 -0.053 411 HD3 LYS 55 3HD LYS 55 28.388 -0.722 -1.060 412 HE2 LYS 55 2HE LYS 55 28.504 1.498 -0.263 413 HE3 LYS 55 3HE LYS 55 27.336 0.768 0.820 414 HZ1 LYS 55 2HZ LYS 55 29.153 0.408 2.425 415 HZ3 LYS 55 1HZ LYS 55 29.018 1.991 2.066 416 H GLY 56 HN GLY 56 29.250 -1.507 3.718 417 HA2 GLY 56 1HA GLY 56 28.687 -3.823 5.437 418 HA3 GLY 56 2HA GLY 56 29.777 -2.580 6.015 419 H ILE 57 HN ILE 57 26.502 -2.921 4.473 420 HA ILE 57 HA ILE 57 25.475 -1.095 6.488 421 HB ILE 57 HB ILE 57 24.299 0.240 4.798 422 HG12 ILE 57 2HG1 ILE 57 25.308 0.143 2.431 423 HG13 ILE 57 3HG1 ILE 57 25.890 -1.451 2.867 424 HG21 ILE 57 1HG2 ILE 57 26.022 1.733 4.501 425 HG22 ILE 57 2HG2 ILE 57 26.671 0.715 5.808 426 HG23 ILE 57 3HG2 ILE 57 27.212 0.462 4.132 427 HD11 ILE 57 3HD1 ILE 57 23.746 -2.363 3.003 428 HD12 ILE 57 1HD1 ILE 57 22.996 -0.801 3.411 429 HD13 ILE 57 2HD1 ILE 57 23.497 -1.136 1.737 430 H ILE 58 HN ILE 58 22.992 -1.078 6.396 431 HA ILE 58 HA ILE 58 22.164 -3.825 5.848 432 HB ILE 58 HB ILE 58 20.872 -1.681 7.538 433 HG12 ILE 58 2HG1 ILE 58 23.189 -2.678 8.217 434 HG13 ILE 58 3HG1 ILE 58 21.912 -2.525 9.407 435 HG21 ILE 58 1HG2 ILE 58 19.537 -3.564 8.442 436 HG22 ILE 58 2HG2 ILE 58 19.219 -3.235 6.722 437 HG23 ILE 58 3HG2 ILE 58 20.232 -4.622 7.190 438 HD11 ILE 58 3HD1 ILE 58 21.366 -4.857 9.296 439 HD12 ILE 58 1HD1 ILE 58 22.289 -5.076 7.790 440 HD13 ILE 58 2HD1 ILE 58 23.145 -4.788 9.324 441 H TRP 59 HN TRP 59 20.018 -4.201 4.866 442 HA TRP 59 HA TRP 59 19.559 -2.208 2.781 443 HB2 TRP 59 2HB TRP 59 18.907 -5.137 3.043 444 HB3 TRP 59 3HB TRP 59 18.161 -4.128 1.819 445 HD1 TRP 59 HD1 TRP 59 20.921 -6.430 2.020 446 HE1 TRP 59 HE1 TRP 59 22.831 -6.048 0.240 447 HE3 TRP 59 HE3 TRP 59 19.517 -1.710 0.750 448 HZ2 TRP 59 HZ2 TRP 59 23.525 -3.864 -1.462 449 HZ3 TRP 59 HZ3 TRP 59 20.865 -0.523 -0.979 450 HH2 TRP 59 HH2 TRP 59 22.807 -1.525 -2.073 451 H GLY 60 HN GLY 60 17.476 -1.277 2.472 452 HA2 GLY 60 1HA GLY 60 15.255 -2.061 4.123 453 HA3 GLY 60 2HA GLY 60 16.001 -0.564 4.645 454 H GLU 61 HN GLU 61 14.093 0.656 4.066 455 HA GLU 61 HA GLU 61 13.344 0.604 1.293 456 HB2 GLU 61 2HB GLU 61 12.265 2.147 3.691 457 HB3 GLU 61 3HB GLU 61 11.612 2.301 2.072 458 HG2 GLU 61 2HG GLU 61 11.181 -0.188 2.045 459 HG3 GLU 61 3HG GLU 61 11.761 -0.284 3.696 460 HE2 GLU 61 HE2 GLU 61 9.061 2.446 3.499 461 H ASP 62 HN ASP 62 15.004 2.716 3.667 462 HA ASP 62 HA ASP 62 15.105 4.929 1.941 463 HB2 ASP 62 2HB ASP 62 15.400 4.825 4.522 464 HB3 ASP 62 3HB ASP 62 17.044 4.307 4.206 465 HD2 ASP 62 HD2 ASP 62 16.382 7.837 2.571 466 H THR 63 HN THR 63 17.441 2.345 2.989 467 HA THR 63 HA THR 63 19.605 3.225 1.441 468 HB THR 63 HB THR 63 20.284 0.737 1.823 469 HG1 THR 63 HG1 THR 63 18.664 -0.127 3.506 470 HG21 THR 63 1HG2 THR 63 21.133 2.054 3.577 471 HG22 THR 63 2HG2 THR 63 19.532 2.715 3.985 472 HG23 THR 63 3HG2 THR 63 19.960 1.057 4.471 473 H LEU 64 HN LEU 64 16.663 1.467 0.600 474 HA LEU 64 HA LEU 64 17.786 0.587 -1.910 475 HB2 LEU 64 2HB LEU 64 15.160 0.278 -0.498 476 HB3 LEU 64 3HB LEU 64 15.277 -0.059 -2.213 477 HG LEU 64 HG LEU 64 16.811 -1.425 0.014 478 HD11 LEU 64 1HD1 LEU 64 14.923 -2.621 0.128 479 HD12 LEU 64 2HD1 LEU 64 14.321 -2.008 -1.431 480 HD13 LEU 64 3HD1 LEU 64 15.476 -3.363 -1.394 481 HD21 LEU 64 3HD2 LEU 64 17.247 -2.910 -2.263 482 HD22 LEU 64 1HD2 LEU 64 17.376 -1.236 -2.855 483 HD23 LEU 64 2HD2 LEU 64 18.404 -1.786 -1.510 484 H MET 65 HN MET 65 15.589 3.121 -0.626 485 HA MET 65 HA MET 65 14.596 4.036 -2.992 486 HB2 MET 65 2HB MET 65 15.237 5.238 -0.290 487 HB3 MET 65 3HB MET 65 14.810 6.353 -1.571 488 HG2 MET 65 2HG MET 65 13.056 3.927 -1.170 489 HG3 MET 65 3HG MET 65 12.934 5.229 -0.003 490 HE1 MET 65 3HE MET 65 11.006 4.964 -3.977 491 HE2 MET 65 1HE MET 65 12.131 3.800 -3.235 492 HE3 MET 65 2HE MET 65 10.602 4.205 -2.418 493 H GLU 66 HN GLU 66 17.869 4.216 -1.754 494 HA GLU 66 HA GLU 66 18.502 6.330 -3.633 495 HB2 GLU 66 2HB GLU 66 19.420 6.690 -1.432 496 HB3 GLU 66 3HB GLU 66 20.042 5.054 -1.341 497 HG2 GLU 66 2HG GLU 66 21.824 5.491 -2.812 498 HG3 GLU 66 3HG GLU 66 20.984 6.806 -3.612 499 HE2 GLU 66 HE2 GLU 66 22.767 6.185 -0.550 500 H TYR 67 HN TYR 67 19.426 2.945 -2.735 501 HA TYR 67 HA TYR 67 21.357 2.507 -4.632 502 HB2 TYR 67 2HB TYR 67 20.610 0.981 -2.761 503 HB3 TYR 67 3HB TYR 67 19.063 0.754 -3.551 504 HD1 TYR 67 HD1 TYR 67 22.644 0.534 -4.685 505 HD2 TYR 67 HD2 TYR 67 18.828 -1.381 -4.408 506 HE1 TYR 67 HE1 TYR 67 23.563 -1.491 -5.917 507 HE2 TYR 67 HE2 TYR 67 19.760 -3.400 -5.640 508 HH TYR 67 HH TYR 67 23.002 -3.945 -6.012 509 H LEU 68 HN LEU 68 17.769 2.343 -4.958 510 HA LEU 68 HA LEU 68 17.889 1.326 -7.607 511 HB2 LEU 68 2HB LEU 68 15.668 2.609 -6.013 512 HB3 LEU 68 3HB LEU 68 15.462 1.905 -7.605 513 HG LEU 68 HG LEU 68 16.100 0.514 -5.008 514 HD11 LEU 68 1HD1 LEU 68 14.052 -0.458 -6.934 515 HD12 LEU 68 2HD1 LEU 68 14.039 -0.420 -5.154 516 HD13 LEU 68 3HD1 LEU 68 13.712 1.065 -6.078 517 HD21 LEU 68 3HD2 LEU 68 16.450 -0.580 -7.807 518 HD22 LEU 68 1HD2 LEU 68 17.670 -0.457 -6.516 519 HD23 LEU 68 2HD2 LEU 68 16.312 -1.595 -6.352 520 H GLU 69 HN GLU 69 17.531 4.581 -6.102 521 HA GLU 69 HA GLU 69 16.941 5.990 -8.350 522 HB2 GLU 69 2HB GLU 69 16.948 6.933 -6.064 523 HB3 GLU 69 3HB GLU 69 18.695 6.821 -5.997 524 HG2 GLU 69 2HG GLU 69 18.904 8.414 -7.885 525 HG3 GLU 69 3HG GLU 69 17.161 8.477 -8.056 526 HE2 GLU 69 HE2 GLU 69 18.062 11.336 -6.120 527 H ASN 70 HN ASN 70 20.111 4.776 -7.183 528 HA ASN 70 HA ASN 70 21.139 4.869 -9.786 529 HB2 ASN 70 2HB ASN 70 21.919 7.053 -7.836 530 HB3 ASN 70 3HB ASN 70 23.157 6.417 -8.899 531 HD21 ASN 70 1HD2 ASN 70 22.176 6.006 -11.237 532 HD22 ASN 70 2HD2 ASN 70 21.413 7.389 -11.950 533 HA PRO 71 HA PRO 71 23.062 2.011 -6.822 534 HB2 PRO 71 2HB PRO 71 22.824 -0.259 -8.326 535 HB3 PRO 71 3HB PRO 71 21.628 0.238 -7.147 536 HG2 PRO 71 2HG PRO 71 21.498 0.394 -10.096 537 HG3 PRO 71 3HG PRO 71 20.189 0.478 -8.933 538 HD2 PRO 71 2HD PRO 71 21.364 2.673 -10.357 539 HD3 PRO 71 3HD PRO 71 20.137 2.769 -9.110 540 H LYS 72 HN LYS 72 23.874 3.398 -9.640 541 HA LYS 72 HA LYS 72 26.216 1.811 -10.145 542 HB2 LYS 72 2HB LYS 72 24.969 2.862 -11.977 543 HB3 LYS 72 3HB LYS 72 25.277 4.451 -11.306 544 HG2 LYS 72 2HG LYS 72 27.044 4.352 -12.803 545 HG3 LYS 72 3HG LYS 72 27.833 3.633 -11.412 546 HD2 LYS 72 2HD LYS 72 26.391 1.998 -13.550 547 HD3 LYS 72 3HD LYS 72 28.108 2.347 -13.603 548 HE2 LYS 72 2HE LYS 72 28.031 1.374 -11.093 549 HE3 LYS 72 3HE LYS 72 26.586 0.579 -11.687 550 HZ1 LYS 72 2HZ LYS 72 27.968 -0.918 -12.606 551 HZ3 LYS 72 1HZ LYS 72 29.299 -0.038 -12.280 552 H LYS 73 HN LYS 73 25.292 4.697 -8.298 553 HA LYS 73 HA LYS 73 28.065 5.406 -7.868 554 HB2 LYS 73 2HB LYS 73 27.280 7.399 -7.003 555 HB3 LYS 73 3HB LYS 73 26.058 7.018 -8.199 556 HG2 LYS 73 2HG LYS 73 24.771 5.839 -6.267 557 HG3 LYS 73 3HG LYS 73 25.887 6.645 -5.182 558 HD2 LYS 73 2HD LYS 73 25.211 8.830 -6.512 559 HD3 LYS 73 3HD LYS 73 23.831 7.886 -7.038 560 HE2 LYS 73 2HE LYS 73 23.227 9.141 -5.016 561 HE3 LYS 73 3HE LYS 73 23.234 7.427 -4.649 562 HZ1 LYS 73 2HZ LYS 73 24.601 8.056 -2.974 563 HZ3 LYS 73 1HZ LYS 73 24.988 9.488 -3.645 564 H TYR 74 HN TYR 74 25.344 3.764 -6.243 565 HA TYR 74 HA TYR 74 26.375 3.750 -3.660 566 HB2 TYR 74 2HB TYR 74 24.118 2.924 -4.960 567 HB3 TYR 74 3HB TYR 74 24.947 1.380 -4.938 568 HD1 TYR 74 HD2 TYR 74 25.985 0.786 -2.492 569 HD2 TYR 74 HD1 TYR 74 22.630 3.336 -3.235 570 HE1 TYR 74 HE2 TYR 74 25.139 0.374 -0.131 571 HE2 TYR 74 HE1 TYR 74 21.797 2.915 -0.870 572 HH TYR 74 HH TYR 74 23.556 1.903 1.506 573 H ILE 75 HN ILE 75 26.630 1.218 -6.261 574 HA ILE 75 HA ILE 75 29.153 0.409 -5.020 575 HB ILE 75 HB ILE 75 27.061 -1.559 -5.938 576 HG12 ILE 75 2HG1 ILE 75 27.553 -0.369 -3.215 577 HG13 ILE 75 3HG1 ILE 75 26.037 -0.582 -4.069 578 HG21 ILE 75 1HG2 ILE 75 29.494 -2.031 -4.207 579 HG22 ILE 75 2HG2 ILE 75 28.450 -3.232 -5.006 580 HG23 ILE 75 3HG2 ILE 75 29.514 -2.189 -5.980 581 HD11 ILE 75 3HD1 ILE 75 26.123 -2.282 -2.356 582 HD12 ILE 75 1HD1 ILE 75 26.401 -3.107 -3.909 583 HD13 ILE 75 2HD1 ILE 75 27.771 -2.759 -2.828 584 HA PRO 76 HA PRO 76 29.633 1.058 -9.430 585 HB2 PRO 76 2HB PRO 76 31.968 2.473 -9.301 586 HB3 PRO 76 3HB PRO 76 30.389 3.231 -9.332 587 HG2 PRO 76 2HG PRO 76 32.233 2.887 -7.049 588 HG3 PRO 76 3HG PRO 76 30.878 3.985 -7.209 589 HD2 PRO 76 2HD PRO 76 30.939 1.543 -5.706 590 HD3 PRO 76 3HD PRO 76 29.552 2.583 -5.961 591 H GLY 77 HN GLY 77 30.035 -0.861 -10.342 592 HA2 GLY 77 1HA GLY 77 32.050 -1.974 -11.261 593 HA3 GLY 77 2HA GLY 77 32.657 -2.028 -9.619 594 H THR 78 HN THR 78 29.482 -2.366 -8.999 595 HA THR 78 HA THR 78 29.602 -5.066 -8.386 596 HB THR 78 HB THR 78 28.037 -3.459 -7.347 597 HG1 THR 78 HG1 THR 78 26.090 -4.865 -7.780 598 HG21 THR 78 1HG2 THR 78 26.138 -2.544 -8.532 599 HG22 THR 78 2HG2 THR 78 27.551 -2.185 -9.553 600 HG23 THR 78 3HG2 THR 78 26.473 -3.539 -9.969 601 H LYS 79 HN LYS 79 28.255 -6.863 -9.239 602 HA LYS 79 HA LYS 79 28.739 -7.064 -12.056 603 HB2 LYS 79 2HB LYS 79 27.267 -9.146 -10.479 604 HB3 LYS 79 3HB LYS 79 28.418 -9.340 -11.786 605 HG2 LYS 79 2HG LYS 79 30.155 -8.272 -10.125 606 HG3 LYS 79 3HG LYS 79 28.975 -8.641 -8.883 607 HD2 LYS 79 2HD LYS 79 29.745 -10.816 -10.837 608 HD3 LYS 79 3HD LYS 79 30.865 -10.409 -9.551 609 HE2 LYS 79 2HE LYS 79 29.003 -10.749 -7.873 610 HE3 LYS 79 3HE LYS 79 27.949 -11.246 -9.181 611 HZ1 LYS 79 2HZ LYS 79 28.834 -13.248 -8.420 612 HZ3 LYS 79 1HZ LYS 79 30.323 -12.649 -8.144 613 H MET 80 HN MET 80 26.116 -6.111 -9.960 614 HA MET 80 HA MET 80 24.001 -6.863 -11.602 615 HB2 MET 80 2HB MET 80 23.794 -6.162 -9.202 616 HB3 MET 80 3HB MET 80 24.300 -4.537 -9.621 617 HG2 MET 80 2HG MET 80 22.277 -4.048 -10.756 618 HG3 MET 80 3HG MET 80 21.907 -5.737 -11.039 619 HE1 MET 80 3HE MET 80 21.298 -2.698 -8.751 620 HE2 MET 80 1HE MET 80 20.115 -3.354 -9.909 621 HE3 MET 80 2HE MET 80 19.775 -3.408 -8.163 622 H ILE 81 HN ILE 81 23.405 -6.121 -13.590 623 HA ILE 81 HA ILE 81 24.564 -3.590 -14.465 624 HB ILE 81 HB ILE 81 23.276 -5.871 -15.967 625 HG12 ILE 81 2HG1 ILE 81 25.566 -6.235 -14.965 626 HG13 ILE 81 3HG1 ILE 81 25.444 -6.454 -16.699 627 HG21 ILE 81 1HG2 ILE 81 24.372 -4.505 -17.938 628 HG22 ILE 81 2HG2 ILE 81 22.732 -4.133 -17.356 629 HG23 ILE 81 3HG2 ILE 81 24.109 -3.133 -16.836 630 HD11 ILE 81 3HD1 ILE 81 27.011 -4.860 -17.047 631 HD12 ILE 81 1HD1 ILE 81 26.031 -3.668 -16.162 632 HD13 ILE 81 2HD1 ILE 81 27.190 -4.695 -15.284 633 H PHE 82 HN PHE 82 23.378 -1.775 -14.286 634 HA PHE 82 HA PHE 82 20.727 -1.660 -15.193 635 HB2 PHE 82 2HB PHE 82 20.555 -2.870 -12.899 636 HB3 PHE 82 3HB PHE 82 21.199 -1.415 -12.162 637 HD1 PHE 82 HD2 PHE 82 18.609 -1.938 -14.805 638 HD2 PHE 82 HD1 PHE 82 19.523 -0.385 -10.964 639 HE1 PHE 82 HE2 PHE 82 16.288 -0.997 -14.634 640 HE2 PHE 82 HE1 PHE 82 17.202 0.556 -10.791 641 HZ PHE 82 HZ PHE 82 15.613 0.238 -12.629 642 H VAL 83 HN VAL 83 19.741 0.574 -14.706 643 HA VAL 83 HA VAL 83 21.951 2.495 -14.456 644 HB VAL 83 HB VAL 83 20.669 3.946 -15.909 645 HG11 VAL 83 1HG1 VAL 83 21.163 1.136 -16.912 646 HG12 VAL 83 2HG1 VAL 83 20.652 2.453 -17.994 647 HG13 VAL 83 3HG1 VAL 83 22.184 2.581 -17.096 648 HG21 VAL 83 3HG2 VAL 83 18.628 2.997 -17.083 649 HG22 VAL 83 1HG2 VAL 83 18.604 1.729 -15.834 650 HG23 VAL 83 2HG2 VAL 83 18.406 3.437 -15.373 651 H GLY 84 HN GLY 84 18.406 1.993 -13.858 652 HA2 GLY 84 1HA GLY 84 18.066 2.414 -11.320 653 HA3 GLY 84 2HA GLY 84 18.529 4.046 -11.760 654 H ILE 85 HN ILE 85 16.083 3.918 -10.693 655 HA ILE 85 HA ILE 85 14.248 3.831 -12.985 656 HB ILE 85 HB ILE 85 13.571 3.600 -10.052 657 HG12 ILE 85 2HG1 ILE 85 13.974 1.419 -12.118 658 HG13 ILE 85 3HG1 ILE 85 14.948 1.700 -10.688 659 HG21 ILE 85 1HG2 ILE 85 11.797 4.476 -11.570 660 HG22 ILE 85 2HG2 ILE 85 11.900 2.958 -12.495 661 HG23 ILE 85 3HG2 ILE 85 11.390 2.927 -10.790 662 HD11 ILE 85 3HD1 ILE 85 13.529 0.084 -9.833 663 HD12 ILE 85 1HD1 ILE 85 12.543 1.520 -9.473 664 HD13 ILE 85 2HD1 ILE 85 12.190 0.538 -10.914 665 H LYS 86 HN LYS 86 12.786 5.587 -13.296 666 HA LYS 86 HA LYS 86 13.830 8.061 -12.175 667 HB2 LYS 86 2HB LYS 86 13.364 7.505 -14.708 668 HB3 LYS 86 3HB LYS 86 11.712 7.919 -14.299 669 HG2 LYS 86 2HG LYS 86 12.520 10.024 -14.889 670 HG3 LYS 86 3HG LYS 86 12.829 10.054 -13.163 671 HD2 LYS 86 2HD LYS 86 14.973 8.919 -14.958 672 HD3 LYS 86 3HD LYS 86 14.747 10.656 -14.952 673 HE2 LYS 86 2HE LYS 86 14.776 10.347 -12.297 674 HE3 LYS 86 3HE LYS 86 15.600 8.848 -12.680 675 HZ1 LYS 86 2HZ LYS 86 16.730 10.937 -14.212 676 HZ3 LYS 86 1HZ LYS 86 17.458 10.020 -13.080 677 H LYS 87 HN LYS 87 10.647 6.391 -12.698 678 HA LYS 87 HA LYS 87 9.232 8.209 -11.084 679 HB2 LYS 87 2HB LYS 87 8.698 5.568 -12.372 680 HB3 LYS 87 3HB LYS 87 7.629 6.066 -11.076 681 HG2 LYS 87 2HG LYS 87 7.541 8.374 -12.356 682 HG3 LYS 87 3HG LYS 87 8.163 7.462 -13.717 683 HD2 LYS 87 2HD LYS 87 5.792 6.340 -12.221 684 HD3 LYS 87 3HD LYS 87 5.524 7.708 -13.283 685 HE2 LYS 87 2HE LYS 87 6.970 5.174 -14.182 686 HE3 LYS 87 3HE LYS 87 5.241 5.396 -14.360 687 HZ1 LYS 87 2HZ LYS 87 5.566 6.793 -16.091 688 HZ3 LYS 87 1HZ LYS 87 7.098 6.243 -16.151 689 H LYS 88 HN LYS 88 9.512 8.535 -8.949 690 HA LYS 88 HA LYS 88 10.859 6.609 -7.355 691 HB2 LYS 88 2HB LYS 88 10.902 8.242 -5.723 692 HB3 LYS 88 3HB LYS 88 10.836 9.200 -7.189 693 HG2 LYS 88 2HG LYS 88 8.390 9.484 -6.939 694 HG3 LYS 88 3HG LYS 88 8.383 8.430 -5.538 695 HD2 LYS 88 2HD LYS 88 8.382 10.669 -4.668 696 HD3 LYS 88 3HD LYS 88 10.004 10.062 -4.413 697 HE2 LYS 88 2HE LYS 88 10.023 12.378 -5.340 698 HE3 LYS 88 3HE LYS 88 10.821 11.246 -6.414 699 HZ1 LYS 88 2HZ LYS 88 9.391 12.396 -7.828 700 HZ3 LYS 88 1HZ LYS 88 8.176 12.499 -6.750 701 H GLU 89 HN GLU 89 7.526 7.236 -8.255 702 HA GLU 89 HA GLU 89 6.353 6.077 -5.996 703 HB2 GLU 89 2HB GLU 89 4.983 7.485 -7.352 704 HB3 GLU 89 3HB GLU 89 5.403 6.632 -8.825 705 HG2 GLU 89 2HG GLU 89 3.957 4.848 -8.382 706 HG3 GLU 89 3HG GLU 89 4.079 5.034 -6.644 707 HE2 GLU 89 HE2 GLU 89 1.733 5.585 -6.169 708 H GLU 90 HN GLU 90 7.412 4.805 -9.200 709 HA GLU 90 HA GLU 90 6.312 2.278 -8.866 710 HB2 GLU 90 2HB GLU 90 8.736 3.163 -10.494 711 HB3 GLU 90 3HB GLU 90 7.932 1.617 -10.673 712 HG2 GLU 90 2HG GLU 90 6.433 4.256 -10.943 713 HG3 GLU 90 3HG GLU 90 7.231 3.497 -12.307 714 HE2 GLU 90 HE2 GLU 90 3.921 2.696 -12.442 715 H ARG 91 HN ARG 91 9.138 3.834 -7.486 716 HA ARG 91 HA ARG 91 10.553 1.464 -6.971 717 HB2 ARG 91 2HB ARG 91 10.721 4.345 -6.081 718 HB3 ARG 91 3HB ARG 91 11.599 3.157 -5.139 719 HG2 ARG 91 2HG ARG 91 12.715 2.344 -7.249 720 HG3 ARG 91 3HG ARG 91 11.875 3.590 -8.152 721 HD2 ARG 91 2HD ARG 91 13.497 4.411 -5.733 722 HD3 ARG 91 3HD ARG 91 14.347 4.004 -7.211 723 HE ARG 91 HE ARG 91 12.430 5.722 -8.144 724 HH11 ARG 91 2HH2 ARG 91 14.688 5.979 -5.426 725 HH12 ARG 91 1HH2 ARG 91 14.786 7.706 -5.509 726 HH22 ARG 91 HH1 ARG 91 13.525 8.874 -7.179 727 H ALA 92 HN ALA 92 8.082 3.410 -5.266 728 HA ALA 92 HA ALA 92 8.391 2.247 -2.732 729 HB1 ALA 92 3HB ALA 92 5.860 3.036 -2.650 730 HB2 ALA 92 1HB ALA 92 7.181 4.226 -2.721 731 HB3 ALA 92 2HB ALA 92 6.278 3.810 -4.198 732 H ASP 93 HN ASP 93 6.648 1.288 -5.704 733 HA ASP 93 HA ASP 93 5.182 -0.736 -4.397 734 HB2 ASP 93 2HB ASP 93 5.878 -0.387 -7.352 735 HB3 ASP 93 3HB ASP 93 4.654 -1.477 -6.732 736 HD2 ASP 93 HD2 ASP 93 2.471 1.227 -5.964 737 H LEU 94 HN LEU 94 8.012 -0.643 -6.695 738 HA LEU 94 HA LEU 94 8.523 -3.365 -6.709 739 HB2 LEU 94 2HB LEU 94 9.465 -1.993 -8.371 740 HB3 LEU 94 3HB LEU 94 10.218 -0.930 -7.201 741 HG LEU 94 HG LEU 94 11.693 -2.877 -6.522 742 HD11 LEU 94 1HD1 LEU 94 10.311 -4.690 -7.403 743 HD12 LEU 94 2HD1 LEU 94 10.580 -4.104 -9.061 744 HD13 LEU 94 3HD1 LEU 94 11.945 -4.726 -8.104 745 HD21 LEU 94 3HD2 LEU 94 12.183 -0.939 -8.206 746 HD22 LEU 94 1HD2 LEU 94 13.304 -2.314 -8.069 747 HD23 LEU 94 2HD2 LEU 94 12.146 -2.241 -9.418 748 H ILE 95 HN ILE 95 9.264 -0.837 -4.329 749 HA ILE 95 HA ILE 95 11.077 -2.571 -2.901 750 HB ILE 95 HB ILE 95 10.018 0.210 -2.414 751 HG12 ILE 95 2HG1 ILE 95 12.860 -0.652 -2.969 752 HG13 ILE 95 3HG1 ILE 95 11.731 -0.297 -4.262 753 HG21 ILE 95 1HG2 ILE 95 11.983 0.120 -0.654 754 HG22 ILE 95 2HG2 ILE 95 10.335 -0.403 -0.232 755 HG23 ILE 95 3HG2 ILE 95 11.578 -1.613 -0.629 756 HD11 ILE 95 3HD1 ILE 95 12.988 1.554 -2.269 757 HD12 ILE 95 1HD1 ILE 95 12.589 1.828 -3.982 758 HD13 ILE 95 2HD1 ILE 95 11.311 1.913 -2.747 759 H ALA 96 HN ALA 96 7.689 -1.421 -2.748 760 HA ALA 96 HA ALA 96 7.146 -2.391 -0.175 761 HB1 ALA 96 3HB ALA 96 4.730 -2.416 -1.273 762 HB2 ALA 96 1HB ALA 96 5.574 -0.879 -0.965 763 HB3 ALA 96 2HB ALA 96 5.566 -1.577 -2.602 764 H TYR 97 HN TYR 97 7.340 -3.911 -3.387 765 HA TYR 97 HA TYR 97 6.094 -6.340 -2.441 766 HB2 TYR 97 2HB TYR 97 5.697 -5.822 -4.752 767 HB3 TYR 97 3HB TYR 97 7.292 -5.127 -4.960 768 HD1 TYR 97 HD2 TYR 97 6.463 -8.498 -3.585 769 HD2 TYR 97 HD1 TYR 97 8.099 -6.275 -6.854 770 HE1 TYR 97 HE2 TYR 97 7.268 -10.657 -4.659 771 HE2 TYR 97 HE1 TYR 97 8.900 -8.441 -7.917 772 HH TYR 97 HH TYR 97 8.485 -10.716 -7.894 773 H LEU 98 HN LEU 98 9.348 -4.984 -2.964 774 HA LEU 98 HA LEU 98 10.631 -7.533 -2.783 775 HB2 LEU 98 2HB LEU 98 11.491 -4.676 -2.977 776 HB3 LEU 98 3HB LEU 98 12.649 -5.877 -2.440 777 HG LEU 98 HG LEU 98 11.226 -5.728 -5.102 778 HD11 LEU 98 1HD1 LEU 98 14.159 -6.092 -4.891 779 HD12 LEU 98 2HD1 LEU 98 13.196 -5.086 -5.998 780 HD13 LEU 98 3HD1 LEU 98 13.517 -4.527 -4.339 781 HD21 LEU 98 3HD2 LEU 98 11.148 -7.974 -5.032 782 HD22 LEU 98 1HD2 LEU 98 12.885 -7.853 -5.398 783 HD23 LEU 98 2HD2 LEU 98 12.344 -8.086 -3.718 784 H LYS 99 HN LYS 99 9.467 -5.044 -0.571 785 HA LYS 99 HA LYS 99 11.101 -5.951 1.605 786 HB2 LYS 99 2HB LYS 99 10.283 -4.150 2.756 787 HB3 LYS 99 3HB LYS 99 10.082 -3.577 1.113 788 HG2 LYS 99 2HG LYS 99 7.710 -4.272 1.117 789 HG3 LYS 99 3HG LYS 99 7.889 -4.984 2.708 790 HD2 LYS 99 2HD LYS 99 8.652 -2.607 3.483 791 HD3 LYS 99 3HD LYS 99 8.002 -2.037 1.958 792 HE2 LYS 99 2HE LYS 99 6.419 -3.636 4.027 793 HE3 LYS 99 3HE LYS 99 6.342 -1.895 3.846 794 HZ1 LYS 99 2HZ LYS 99 4.825 -2.221 2.244 795 HZ3 LYS 99 1HZ LYS 99 4.967 -3.840 2.344 796 H LYS 100 HN LYS 100 7.894 -6.616 0.228 797 HA LYS 100 HA LYS 100 7.172 -8.185 2.562 798 HB2 LYS 100 2HB LYS 100 5.646 -6.588 1.121 799 HB3 LYS 100 3HB LYS 100 5.503 -7.988 0.075 800 HG2 LYS 100 2HG LYS 100 4.946 -9.324 2.252 801 HG3 LYS 100 3HG LYS 100 4.720 -7.759 3.006 802 HD2 LYS 100 2HD LYS 100 2.935 -7.169 1.477 803 HD3 LYS 100 3HD LYS 100 3.302 -8.515 0.417 804 HE2 LYS 100 2HE LYS 100 2.806 -10.003 2.554 805 HE3 LYS 100 3HE LYS 100 1.994 -8.571 3.154 806 HZ1 LYS 100 2HZ LYS 100 0.301 -8.896 1.716 807 HZ3 LYS 100 1HZ LYS 100 0.887 -10.394 1.465 808 H ALA 101 HN ALA 101 8.557 -8.505 -0.656 809 HA ALA 101 HA ALA 101 7.898 -11.226 -1.036 810 HB1 ALA 101 3HB ALA 101 9.961 -9.327 -2.192 811 HB2 ALA 101 1HB ALA 101 9.855 -11.030 -2.697 812 HB3 ALA 101 2HB ALA 101 8.471 -9.940 -2.949 813 H THR 102 HN THR 102 10.802 -9.490 0.263 814 HA THR 102 HA THR 102 12.040 -12.012 0.952 815 HB THR 102 HB THR 102 13.917 -10.562 1.574 816 HG1 THR 102 HG1 THR 102 13.310 -8.601 2.397 817 HG21 THR 102 1HG2 THR 102 14.285 -10.165 -0.647 818 HG22 THR 102 2HG2 THR 102 12.538 -10.212 -0.983 819 HG23 THR 102 3HG2 THR 102 13.307 -8.686 -0.485 820 H ASN 103 HN ASN 103 9.417 -10.591 2.194 821 HA ASN 103 HA ASN 103 10.291 -10.739 4.941 822 HB2 ASN 103 2HB ASN 103 8.867 -8.836 4.462 823 HB3 ASN 103 3HB ASN 103 7.722 -9.821 3.573 824 HD21 ASN 103 1HD2 ASN 103 5.905 -10.090 4.598 825 HD22 ASN 103 2HD2 ASN 103 5.672 -10.306 6.300 826 H GLU 104 HN GLU 104 7.753 -12.055 2.684 827 HA GLU 104 HA GLU 104 6.414 -13.723 4.228 828 HB2 GLU 104 2HB GLU 104 7.476 -14.156 1.415 829 HB3 GLU 104 3HB GLU 104 6.396 -15.313 2.168 830 HG2 GLU 104 2HG GLU 104 4.877 -13.220 2.676 831 HG3 GLU 104 3HG GLU 104 5.846 -12.412 1.459 832 HE2 GLU 104 HE2 GLU 104 4.626 -14.458 -1.142 833 HHA HEC 500 HHA HEC 500 23.496 -7.361 -5.065 834 HHB HEC 500 HHB HEC 500 17.536 -5.049 -5.302 835 HHC HEC 500 HHC HEC 500 17.787 -5.824 -11.699 836 HHD HEC 500 HHD HEC 500 22.919 -9.579 -10.989 837 HMA1 HEC 500 1HMA HEC 500 18.226 -5.212 -3.089 838 HMA2 HEC 500 2HMA HEC 500 19.698 -5.346 -2.120 839 HMA3 HEC 500 3HMA HEC 500 19.451 -3.917 -3.142 840 HAA1 HEC 500 1HAA HEC 500 23.222 -6.248 -3.283 841 HAA2 HEC 500 2HAA HEC 500 22.003 -5.533 -2.354 842 HBA1 HEC 500 1HBA HEC 500 22.051 -8.510 -2.983 843 HBA2 HEC 500 2HBA HEC 500 22.718 -7.787 -1.507 844 HMB1 HEC 500 1HMB HEC 500 14.495 -5.027 -7.553 845 HMB2 HEC 500 2HMB HEC 500 15.433 -5.099 -6.077 846 HMB3 HEC 500 3HMB HEC 500 15.402 -3.582 -7.004 847 HAB HEC 500 HAB HEC 500 16.214 -4.428 -11.192 848 HBB1 HEC 500 1HBB HEC 500 15.207 -2.594 -10.669 849 HBB2 HEC 500 2HBB HEC 500 13.910 -3.571 -9.933 850 HBB3 HEC 500 3HBB HEC 500 15.244 -2.999 -8.950 851 HMC1 HEC 500 1HMC HEC 500 18.074 -8.423 -13.672 852 HMC2 HEC 500 2HMC HEC 500 18.212 -6.659 -13.666 853 HMC3 HEC 500 3HMC HEC 500 19.393 -7.613 -14.540 854 HAC HEC 500 HAC HEC 500 21.899 -10.282 -12.689 855 HBC1 HEC 500 1HBC HEC 500 22.179 -10.020 -15.028 856 HBC2 HEC 500 2HBC HEC 500 20.903 -8.785 -15.102 857 HBC3 HEC 500 3HBC HEC 500 22.428 -8.413 -14.300 858 HMD1 HEC 500 1HMD HEC 500 24.640 -11.169 -9.164 859 HMD2 HEC 500 2HMD HEC 500 25.117 -9.856 -10.254 860 HMD3 HEC 500 3HMD HEC 500 25.948 -10.101 -8.692 861 HAD1 HEC 500 1HAD HEC 500 25.186 -8.540 -5.356 862 HAD2 HEC 500 2HAD HEC 500 25.679 -9.832 -6.366 863 HBD1 HEC 500 1HBD HEC 500 26.969 -8.382 -7.776 864 HBD2 HEC 500 2HBD HEC 500 26.059 -6.954 -7.235 Start of MODEL 12 1 H1 GLY 1 HN GLY 1 0.600 0.207 -0.243 2 HA2 GLY 1 1HA GLY 1 2.448 0.866 -2.278 3 HA3 GLY 1 2HA GLY 1 3.314 0.443 -0.814 4 H ASP 2 HN ASP 2 1.133 -0.715 -3.372 5 HA ASP 2 HA ASP 2 0.699 -3.243 -2.278 6 HB2 ASP 2 2HB ASP 2 0.821 -2.684 -5.260 7 HB3 ASP 2 3HB ASP 2 -0.232 -3.799 -4.412 8 HD2 ASP 2 HD2 ASP 2 -0.169 -0.731 -5.747 9 H VAL 3 HN VAL 3 1.476 -5.269 -3.821 10 HA VAL 3 HA VAL 3 4.382 -4.948 -4.106 11 HB VAL 3 HB VAL 3 4.201 -6.495 -2.455 12 HG11 VAL 3 1HG1 VAL 3 1.590 -7.389 -3.712 13 HG12 VAL 3 2HG1 VAL 3 2.357 -8.219 -2.337 14 HG13 VAL 3 3HG1 VAL 3 1.828 -6.528 -2.172 15 HG21 VAL 3 3HG2 VAL 3 5.168 -7.493 -4.660 16 HG22 VAL 3 1HG2 VAL 3 4.826 -8.577 -3.290 17 HG23 VAL 3 2HG2 VAL 3 3.691 -8.486 -4.658 18 H GLU 4 HN GLU 4 1.373 -6.369 -5.494 19 HA GLU 4 HA GLU 4 2.489 -7.591 -7.656 20 HB2 GLU 4 2HB GLU 4 -0.196 -6.265 -7.193 21 HB3 GLU 4 3HB GLU 4 0.177 -6.976 -8.751 22 HG2 GLU 4 2HG GLU 4 -0.993 -8.582 -7.225 23 HG3 GLU 4 3HG GLU 4 0.579 -9.167 -7.735 24 HE2 GLU 4 HE2 GLU 4 -1.220 -8.528 -4.923 25 H LYS 5 HN LYS 5 1.882 -4.138 -7.045 26 HA LYS 5 HA LYS 5 2.187 -3.317 -9.737 27 HB2 LYS 5 2HB LYS 5 2.016 -2.004 -7.061 28 HB3 LYS 5 3HB LYS 5 2.721 -1.079 -8.370 29 HG2 LYS 5 2HG LYS 5 0.055 -2.532 -8.648 30 HG3 LYS 5 3HG LYS 5 0.168 -0.881 -8.071 31 HD2 LYS 5 2HD LYS 5 1.246 -0.166 -10.171 32 HD3 LYS 5 3HD LYS 5 1.314 -1.822 -10.741 33 HE2 LYS 5 2HE LYS 5 -0.604 -0.543 -11.734 34 HE3 LYS 5 3HE LYS 5 -1.131 -1.961 -10.847 35 HZ1 LYS 5 2HZ LYS 5 -2.496 -0.372 -9.935 36 HZ3 LYS 5 1HZ LYS 5 -1.444 0.856 -10.120 37 H GLY 6 HN GLY 6 4.383 -4.183 -7.112 38 HA2 GLY 6 1HA GLY 6 6.666 -3.040 -8.564 39 HA3 GLY 6 2HA GLY 6 6.652 -3.630 -6.914 40 H LYS 7 HN LYS 7 4.870 -5.982 -8.215 41 HA LYS 7 HA LYS 7 7.089 -7.757 -8.431 42 HB2 LYS 7 2HB LYS 7 4.904 -8.323 -7.359 43 HB3 LYS 7 3HB LYS 7 4.144 -8.267 -8.937 44 HG2 LYS 7 2HG LYS 7 5.153 -10.232 -9.659 45 HG3 LYS 7 3HG LYS 7 6.611 -9.961 -8.725 46 HD2 LYS 7 2HD LYS 7 5.539 -10.666 -6.667 47 HD3 LYS 7 3HD LYS 7 3.948 -10.628 -7.401 48 HE2 LYS 7 2HE LYS 7 5.061 -12.953 -7.137 49 HE3 LYS 7 3HE LYS 7 4.354 -12.586 -8.698 50 HZ1 LYS 7 2HZ LYS 7 6.371 -12.900 -9.597 51 HZ3 LYS 7 1HZ LYS 7 7.042 -13.182 -8.140 52 H LYS 8 HN LYS 8 4.864 -6.069 -10.661 53 HA LYS 8 HA LYS 8 5.633 -7.563 -12.939 54 HB2 LYS 8 2HB LYS 8 4.107 -5.028 -12.427 55 HB3 LYS 8 3HB LYS 8 4.629 -5.395 -14.059 56 HG2 LYS 8 2HG LYS 8 2.496 -6.412 -13.944 57 HG3 LYS 8 3HG LYS 8 3.587 -7.756 -13.673 58 HD2 LYS 8 2HD LYS 8 3.320 -7.283 -11.141 59 HD3 LYS 8 3HD LYS 8 2.007 -6.206 -11.577 60 HE2 LYS 8 2HE LYS 8 0.839 -8.206 -11.220 61 HE3 LYS 8 3HE LYS 8 1.098 -8.281 -12.951 62 HZ1 LYS 8 2HZ LYS 8 2.565 -9.745 -10.848 63 HZ3 LYS 8 1HZ LYS 8 3.237 -9.543 -12.318 64 H ILE 9 HN ILE 9 6.721 -4.471 -11.438 65 HA ILE 9 HA ILE 9 8.508 -3.814 -13.503 66 HB ILE 9 HB ILE 9 8.392 -3.020 -10.593 67 HG12 ILE 9 2HG1 ILE 9 7.603 -1.309 -12.939 68 HG13 ILE 9 3HG1 ILE 9 6.480 -2.493 -12.302 69 HG21 ILE 9 1HG2 ILE 9 10.518 -2.649 -12.432 70 HG22 ILE 9 2HG2 ILE 9 9.704 -1.078 -12.237 71 HG23 ILE 9 3HG2 ILE 9 10.317 -1.946 -10.809 72 HD11 ILE 9 3HD1 ILE 9 7.828 -0.274 -10.693 73 HD12 ILE 9 1HD1 ILE 9 6.125 -0.308 -11.213 74 HD13 ILE 9 2HD1 ILE 9 6.716 -1.492 -10.022 75 H PHE 10 HN PHE 10 8.681 -5.961 -10.671 76 HA PHE 10 HA PHE 10 11.504 -6.216 -10.741 77 HB2 PHE 10 2HB PHE 10 10.171 -6.696 -8.719 78 HB3 PHE 10 3HB PHE 10 9.135 -7.800 -9.601 79 HD1 PHE 10 HD1 PHE 10 12.700 -7.371 -8.596 80 HD2 PHE 10 HD2 PHE 10 9.558 -10.077 -9.496 81 HE1 PHE 10 HE1 PHE 10 14.156 -9.293 -7.900 82 HE2 PHE 10 HE2 PHE 10 11.014 -12.000 -8.799 83 HZ PHE 10 HZ PHE 10 13.296 -11.584 -8.009 84 H ILE 11 HN ILE 11 8.838 -7.603 -12.559 85 HA ILE 11 HA ILE 11 10.538 -9.793 -13.470 86 HB ILE 11 HB ILE 11 7.595 -9.215 -13.801 87 HG12 ILE 11 2HG1 ILE 11 8.848 -11.559 -12.376 88 HG13 ILE 11 3HG1 ILE 11 8.600 -10.030 -11.555 89 HG21 ILE 11 1HG2 ILE 11 8.301 -10.275 -15.821 90 HG22 ILE 11 2HG2 ILE 11 9.278 -11.465 -14.928 91 HG23 ILE 11 3HG2 ILE 11 7.503 -11.505 -14.814 92 HD11 ILE 11 3HD1 ILE 11 6.646 -11.403 -11.141 93 HD12 ILE 11 1HD1 ILE 11 6.159 -10.121 -12.276 94 HD13 ILE 11 2HD1 ILE 11 6.470 -11.768 -12.874 95 H MET 12 HN MET 12 9.800 -6.560 -14.200 96 HA MET 12 HA MET 12 10.231 -7.037 -17.039 97 HB2 MET 12 2HB MET 12 8.909 -4.878 -15.382 98 HB3 MET 12 3HB MET 12 9.639 -4.379 -16.894 99 HG2 MET 12 2HG MET 12 7.752 -6.764 -16.794 100 HG3 MET 12 3HG MET 12 7.126 -5.131 -16.910 101 HE1 MET 12 3HE MET 12 6.239 -6.879 -18.628 102 HE2 MET 12 1HE MET 12 6.250 -5.815 -20.055 103 HE3 MET 12 2HE MET 12 7.091 -7.383 -20.107 104 H LYS 13 HN LYS 13 11.911 -6.307 -14.206 105 HA LYS 13 HA LYS 13 14.031 -5.042 -15.776 106 HB2 LYS 13 2HB LYS 13 12.835 -4.050 -13.193 107 HB3 LYS 13 3HB LYS 13 14.507 -3.709 -13.595 108 HG2 LYS 13 2HG LYS 13 13.889 -2.544 -15.623 109 HG3 LYS 13 3HG LYS 13 12.243 -3.139 -15.552 110 HD2 LYS 13 2HD LYS 13 12.301 -1.892 -13.150 111 HD3 LYS 13 3HD LYS 13 13.547 -0.951 -13.946 112 HE2 LYS 13 2HE LYS 13 11.946 -0.509 -15.853 113 HE3 LYS 13 3HE LYS 13 10.701 -1.378 -14.977 114 HZ1 LYS 13 2HZ LYS 13 10.379 0.387 -13.621 115 HZ3 LYS 13 1HZ LYS 13 11.219 1.273 -14.699 116 H CYS 14 HN CYS 14 13.372 -6.248 -12.407 117 HA CYS 14 HA CYS 14 15.946 -7.550 -12.463 118 HB2 CYS 14 2HB CYS 14 14.180 -7.974 -10.142 119 HB3 CYS 14 3HB CYS 14 15.878 -7.543 -10.214 120 H SER 15 HN SER 15 14.633 -8.740 -14.448 121 HA SER 15 HA SER 15 13.322 -11.056 -13.262 122 HB2 SER 15 2HB SER 15 12.251 -9.486 -15.132 123 HB3 SER 15 3HB SER 15 13.239 -10.441 -16.219 124 HG SER 15 HG SER 15 11.485 -11.715 -16.153 125 H GLN 16 HN GLN 16 13.841 -13.211 -14.255 126 HA GLN 16 HA GLN 16 15.345 -14.740 -14.654 127 HB2 GLN 16 2HB GLN 16 16.077 -12.835 -16.922 128 HB3 GLN 16 3HB GLN 16 16.573 -14.514 -16.844 129 HG2 GLN 16 2HG GLN 16 13.667 -13.569 -16.827 130 HG3 GLN 16 3HG GLN 16 14.512 -14.148 -18.249 131 HE21 GLN 16 1HE2 GLN 16 14.384 -16.207 -18.720 132 HE22 GLN 16 2HE2 GLN 16 13.931 -17.498 -17.658 133 H CYS 17 HN CYS 17 16.150 -12.450 -12.837 134 HA CYS 17 HA CYS 17 19.029 -12.931 -13.020 135 HB2 CYS 17 2HB CYS 17 17.589 -10.332 -12.804 136 HB3 CYS 17 3HB CYS 17 19.050 -10.526 -11.856 137 H HIS 18 HN HIS 18 16.606 -11.302 -10.834 138 HA HIS 18 HA HIS 18 17.834 -12.618 -8.582 139 HB2 HIS 18 2HB HIS 18 15.738 -10.475 -8.909 140 HB3 HIS 18 3HB HIS 18 16.010 -11.243 -7.358 141 HD1 HIS 18 HD1 HIS 18 18.377 -10.847 -6.213 142 HD2 HIS 18 HD2 HIS 18 17.669 -8.605 -9.687 143 HE1 HIS 18 HE1 HIS 18 20.147 -9.009 -6.251 144 H THR 19 HN THR 19 16.183 -13.502 -6.845 145 HA THR 19 HA THR 19 14.188 -15.134 -8.275 146 HB THR 19 HB THR 19 14.825 -16.938 -6.613 147 HG1 THR 19 HG1 THR 19 15.716 -15.407 -5.035 148 HG21 THR 19 1HG2 THR 19 17.425 -15.993 -7.851 149 HG22 THR 19 2HG2 THR 19 16.777 -17.648 -7.735 150 HG23 THR 19 3HG2 THR 19 16.102 -16.508 -8.924 151 H VAL 20 HN VAL 20 15.139 -13.467 -5.237 152 HA VAL 20 HA VAL 20 13.933 -12.824 -3.488 153 HB VAL 20 HB VAL 20 12.024 -11.488 -3.993 154 HG11 VAL 20 1HG1 VAL 20 12.867 -10.208 -6.030 155 HG12 VAL 20 2HG1 VAL 20 14.030 -10.441 -4.703 156 HG13 VAL 20 3HG1 VAL 20 14.133 -11.451 -6.164 157 HG21 VAL 20 3HG2 VAL 20 11.883 -12.599 -6.798 158 HG22 VAL 20 1HG2 VAL 20 10.963 -13.326 -5.459 159 HG23 VAL 20 2HG2 VAL 20 10.681 -11.629 -5.914 160 H GLU 21 HN GLU 21 13.808 -15.711 -4.269 161 HA GLU 21 HA GLU 21 11.308 -16.273 -2.883 162 HB2 GLU 21 2HB GLU 21 11.214 -18.425 -4.271 163 HB3 GLU 21 3HB GLU 21 10.837 -16.941 -5.124 164 HG2 GLU 21 2HG GLU 21 12.847 -16.949 -6.331 165 HG3 GLU 21 3HG GLU 21 13.715 -17.841 -5.096 166 HE2 GLU 21 HE2 GLU 21 12.714 -20.914 -6.022 167 H LYS 22 HN LYS 22 11.364 -18.549 -1.836 168 HA LYS 22 HA LYS 22 14.087 -18.988 -0.831 169 HB2 LYS 22 2HB LYS 22 11.484 -19.662 0.563 170 HB3 LYS 22 3HB LYS 22 13.100 -19.722 1.237 171 HG2 LYS 22 2HG LYS 22 13.338 -17.319 1.154 172 HG3 LYS 22 3HG LYS 22 11.935 -17.139 0.120 173 HD2 LYS 22 2HD LYS 22 11.659 -18.383 2.878 174 HD3 LYS 22 3HD LYS 22 11.695 -16.641 2.692 175 HE2 LYS 22 2HE LYS 22 9.664 -16.580 1.498 176 HE3 LYS 22 3HE LYS 22 9.825 -18.228 0.927 177 HZ1 LYS 22 2HZ LYS 22 8.209 -18.304 2.628 178 HZ3 LYS 22 1HZ LYS 22 9.052 -17.349 3.644 179 H GLY 23 HN GLY 23 14.899 -20.520 -2.237 180 HA2 GLY 23 1HA GLY 23 14.771 -23.088 -2.005 181 HA3 GLY 23 2HA GLY 23 13.218 -22.872 -2.788 182 H GLY 24 HN GLY 24 14.404 -20.401 -4.269 183 HA2 GLY 24 1HA GLY 24 15.188 -21.826 -6.617 184 HA3 GLY 24 2HA GLY 24 15.100 -20.089 -6.396 185 H LYS 25 HN LYS 25 17.221 -21.743 -7.716 186 HA LYS 25 HA LYS 25 19.456 -21.773 -5.953 187 HB2 LYS 25 2HB LYS 25 20.597 -22.748 -7.694 188 HB3 LYS 25 3HB LYS 25 18.949 -23.196 -8.085 189 HG2 LYS 25 2HG LYS 25 18.926 -20.943 -9.469 190 HG3 LYS 25 3HG LYS 25 20.672 -21.050 -9.362 191 HD2 LYS 25 2HD LYS 25 20.704 -23.201 -10.488 192 HD3 LYS 25 3HD LYS 25 18.965 -23.375 -10.350 193 HE2 LYS 25 2HE LYS 25 18.596 -21.491 -11.892 194 HE3 LYS 25 3HE LYS 25 20.312 -21.135 -11.932 195 HZ1 LYS 25 2HZ LYS 25 20.442 -22.578 -13.630 196 HZ3 LYS 25 1HZ LYS 25 18.896 -23.060 -13.457 197 H HIS 26 HN HIS 26 21.562 -20.558 -6.797 198 HA HIS 26 HA HIS 26 20.818 -17.771 -6.739 199 HB2 HIS 26 2HB HIS 26 23.446 -19.235 -6.433 200 HB3 HIS 26 3HB HIS 26 23.334 -17.487 -6.480 201 HD1 HIS 26 HD1 HIS 26 22.140 -16.292 -4.445 202 HD2 HIS 26 HD2 HIS 26 22.636 -20.436 -4.027 203 HE1 HIS 26 HE1 HIS 26 21.722 -16.817 -1.983 204 H LYS 27 HN LYS 27 19.910 -17.567 -8.883 205 HA LYS 27 HA LYS 27 21.389 -18.295 -11.170 206 HB2 LYS 27 2HB LYS 27 18.852 -16.948 -10.538 207 HB3 LYS 27 3HB LYS 27 19.622 -16.341 -11.990 208 HG2 LYS 27 2HG LYS 27 19.957 -18.884 -12.600 209 HG3 LYS 27 3HG LYS 27 18.736 -19.179 -11.378 210 HD2 LYS 27 2HD LYS 27 18.453 -17.537 -13.927 211 HD3 LYS 27 3HD LYS 27 17.576 -18.990 -13.490 212 HE2 LYS 27 2HE LYS 27 16.626 -17.672 -11.486 213 HE3 LYS 27 3HE LYS 27 17.320 -16.233 -12.208 214 HZ1 LYS 27 2HZ LYS 27 15.013 -16.553 -12.913 215 HZ3 LYS 27 1HZ LYS 27 15.355 -18.012 -13.551 216 H THR 28 HN THR 28 21.349 -16.006 -12.814 217 HA THR 28 HA THR 28 23.789 -14.936 -12.522 218 HB THR 28 HB THR 28 22.594 -12.865 -13.698 219 HG1 THR 28 HG1 THR 28 20.418 -13.718 -14.393 220 HG21 THR 28 1HG2 THR 28 23.383 -15.440 -14.638 221 HG22 THR 28 2HG2 THR 28 21.757 -15.158 -15.308 222 HG23 THR 28 3HG2 THR 28 23.067 -13.995 -15.628 223 H GLY 29 HN GLY 29 20.853 -13.921 -10.743 224 HA2 GLY 29 1HA GLY 29 22.523 -11.974 -9.276 225 HA3 GLY 29 2HA GLY 29 20.782 -11.897 -9.464 226 HA PRO 30 HA PRO 30 22.018 -14.359 -5.690 227 HB2 PRO 30 2HB PRO 30 22.195 -12.464 -3.729 228 HB3 PRO 30 3HB PRO 30 23.594 -13.127 -4.551 229 HG2 PRO 30 2HG PRO 30 22.325 -10.479 -4.896 230 HG3 PRO 30 3HG PRO 30 23.929 -10.998 -5.372 231 HD2 PRO 30 2HD PRO 30 21.657 -10.654 -7.089 232 HD3 PRO 30 3HD PRO 30 23.229 -11.283 -7.543 233 H ASN 31 HN ASN 31 20.634 -15.119 -4.026 234 HA ASN 31 HA ASN 31 17.978 -14.530 -4.654 235 HB2 ASN 31 2HB ASN 31 19.057 -16.675 -3.562 236 HB3 ASN 31 3HB ASN 31 18.894 -15.816 -2.044 237 HD21 ASN 31 1HD2 ASN 31 17.329 -17.554 -4.545 238 HD22 ASN 31 2HD2 ASN 31 15.714 -17.550 -3.919 239 H LEU 32 HN LEU 32 16.364 -13.920 -2.730 240 HA LEU 32 HA LEU 32 17.580 -12.019 -0.889 241 HB2 LEU 32 2HB LEU 32 15.197 -11.222 -2.543 242 HB3 LEU 32 3HB LEU 32 16.186 -10.224 -1.494 243 HG LEU 32 HG LEU 32 18.078 -10.986 -3.259 244 HD11 LEU 32 1HD1 LEU 32 17.235 -12.013 -5.040 245 HD12 LEU 32 2HD1 LEU 32 15.564 -11.709 -4.508 246 HD13 LEU 32 3HD1 LEU 32 16.432 -10.482 -5.461 247 HD21 LEU 32 3HD2 LEU 32 16.645 -8.764 -4.417 248 HD22 LEU 32 1HD2 LEU 32 16.643 -8.651 -2.641 249 HD23 LEU 32 2HD2 LEU 32 18.183 -8.785 -3.522 250 H HIS 33 HN HIS 33 17.026 -12.895 1.039 251 HA HIS 33 HA HIS 33 14.256 -13.825 1.273 252 HB2 HIS 33 2HB HIS 33 15.902 -15.646 1.418 253 HB3 HIS 33 3HB HIS 33 16.724 -14.819 2.726 254 HD1 HIS 33 HD1 HIS 33 14.886 -17.655 2.529 255 HD2 HIS 33 HD2 HIS 33 14.188 -14.122 4.680 256 HE1 HIS 33 HE1 HIS 33 13.319 -18.281 4.443 257 H GLY 34 HN GLY 34 17.009 -12.748 3.400 258 HA2 GLY 34 1HA GLY 34 15.052 -11.235 4.994 259 HA3 GLY 34 2HA GLY 34 16.642 -11.763 5.510 260 H LEU 35 HN LEU 35 15.933 -10.270 2.320 261 HA LEU 35 HA LEU 35 18.010 -8.581 2.225 262 HB2 LEU 35 2HB LEU 35 16.552 -8.940 0.368 263 HB3 LEU 35 3HB LEU 35 15.198 -8.205 1.203 264 HG LEU 35 HG LEU 35 16.877 -6.105 1.237 265 HD11 LEU 35 1HD1 LEU 35 17.637 -6.440 -1.427 266 HD12 LEU 35 2HD1 LEU 35 18.697 -6.423 0.002 267 HD13 LEU 35 3HD1 LEU 35 18.083 -7.969 -0.631 268 HD21 LEU 35 3HD2 LEU 35 14.637 -5.966 0.420 269 HD22 LEU 35 1HD2 LEU 35 15.717 -5.322 -0.841 270 HD23 LEU 35 2HD2 LEU 35 15.030 -6.956 -1.005 271 H PHE 36 HN PHE 36 14.923 -8.072 3.991 272 HA PHE 36 HA PHE 36 15.847 -5.467 4.861 273 HB2 PHE 36 2HB PHE 36 13.347 -7.184 4.926 274 HB3 PHE 36 3HB PHE 36 13.498 -5.983 6.192 275 HD1 PHE 36 HD1 PHE 36 13.402 -6.414 2.515 276 HD2 PHE 36 HD2 PHE 36 13.041 -3.709 5.766 277 HE1 PHE 36 HE1 PHE 36 12.522 -4.656 0.955 278 HE2 PHE 36 HE2 PHE 36 12.161 -1.952 4.205 279 HZ PHE 36 HZ PHE 36 11.912 -2.446 1.819 280 H GLY 37 HN GLY 37 17.591 -5.834 6.278 281 HA2 GLY 37 1HA GLY 37 17.766 -5.870 8.733 282 HA3 GLY 37 2HA GLY 37 16.917 -7.402 8.697 283 H ARG 38 HN ARG 38 18.841 -7.234 5.908 284 HA ARG 38 HA ARG 38 20.863 -8.817 7.262 285 HB2 ARG 38 2HB ARG 38 21.323 -9.795 5.019 286 HB3 ARG 38 3HB ARG 38 19.631 -9.970 5.439 287 HG2 ARG 38 2HG ARG 38 18.950 -8.225 3.956 288 HG3 ARG 38 3HG ARG 38 20.568 -7.559 3.848 289 HD2 ARG 38 2HD ARG 38 19.954 -8.810 1.778 290 HD3 ARG 38 3HD ARG 38 21.345 -9.525 2.570 291 HE ARG 38 HE ARG 38 19.003 -10.795 3.596 292 HH11 ARG 38 2HH2 ARG 38 20.830 -10.586 0.568 293 HH12 ARG 38 1HH2 ARG 38 20.336 -12.152 0.018 294 HH22 ARG 38 HH1 ARG 38 18.878 -13.472 1.387 295 H LYS 39 HN LYS 39 23.144 -8.664 6.161 296 HA LYS 39 HA LYS 39 23.710 -5.824 5.811 297 HB2 LYS 39 2HB LYS 39 25.171 -8.168 6.896 298 HB3 LYS 39 3HB LYS 39 26.141 -7.018 5.999 299 HG2 LYS 39 2HG LYS 39 25.965 -6.503 8.472 300 HG3 LYS 39 3HG LYS 39 25.464 -5.183 7.435 301 HD2 LYS 39 2HD LYS 39 23.755 -5.308 9.089 302 HD3 LYS 39 3HD LYS 39 23.051 -6.082 7.683 303 HE2 LYS 39 2HE LYS 39 24.464 -7.626 9.908 304 HE3 LYS 39 3HE LYS 39 22.735 -7.340 9.886 305 HZ1 LYS 39 2HZ LYS 39 22.659 -9.207 8.643 306 HZ3 LYS 39 1HZ LYS 39 24.256 -9.206 8.320 307 H THR 40 HN THR 40 25.942 -5.707 4.316 308 HA THR 40 HA THR 40 24.960 -6.603 1.721 309 HB THR 40 HB THR 40 26.904 -4.990 1.029 310 HG1 THR 40 HG1 THR 40 27.239 -3.541 3.037 311 HG21 THR 40 1HG2 THR 40 24.427 -4.303 1.165 312 HG22 THR 40 2HG2 THR 40 24.756 -3.765 2.829 313 HG23 THR 40 3HG2 THR 40 25.589 -2.987 1.462 314 H GLY 41 HN GLY 41 25.528 -8.577 1.053 315 HA2 GLY 41 1HA GLY 41 27.103 -10.032 0.186 316 HA3 GLY 41 2HA GLY 41 28.365 -9.263 1.128 317 H GLN 42 HN GLN 42 25.142 -10.490 2.234 318 HA GLN 42 HA GLN 42 26.573 -12.037 4.213 319 HB2 GLN 42 2HB GLN 42 23.749 -11.005 3.936 320 HB3 GLN 42 3HB GLN 42 24.043 -12.379 4.984 321 HG2 GLN 42 2HG GLN 42 25.370 -9.637 5.176 322 HG3 GLN 42 3HG GLN 42 24.195 -10.303 6.291 323 HE21 GLN 42 1HE2 GLN 42 27.476 -10.225 5.267 324 HE22 GLN 42 2HE2 GLN 42 28.169 -11.231 6.495 325 H ALA 43 HN ALA 43 24.500 -12.355 1.340 326 HA ALA 43 HA ALA 43 23.472 -14.817 1.485 327 HB1 ALA 43 3HB ALA 43 24.061 -14.954 -1.016 328 HB2 ALA 43 1HB ALA 43 23.151 -13.521 -0.481 329 HB3 ALA 43 2HB ALA 43 24.901 -13.403 -0.786 330 HA PRO 44 HA PRO 44 27.175 -17.090 2.354 331 HB2 PRO 44 2HB PRO 44 25.963 -19.158 3.665 332 HB3 PRO 44 3HB PRO 44 26.520 -17.707 4.473 333 HG2 PRO 44 2HG PRO 44 23.756 -18.506 3.795 334 HG3 PRO 44 3HG PRO 44 24.300 -17.305 4.950 335 HD2 PRO 44 2HD PRO 44 23.209 -16.809 2.344 336 HD3 PRO 44 3HD PRO 44 23.859 -15.618 3.452 337 H GLY 45 HN GLY 45 24.449 -17.771 0.501 338 HA2 GLY 45 1HA GLY 45 25.472 -20.312 -0.468 339 HA3 GLY 45 2HA GLY 45 23.995 -19.497 -0.944 340 H TYR 46 HN TYR 46 26.125 -17.000 -1.026 341 HA TYR 46 HA TYR 46 27.676 -17.588 -3.318 342 HB2 TYR 46 2HB TYR 46 25.268 -17.481 -4.214 343 HB3 TYR 46 3HB TYR 46 25.133 -15.861 -3.557 344 HD1 TYR 46 HD1 TYR 46 28.135 -17.237 -5.273 345 HD2 TYR 46 HD2 TYR 46 24.738 -14.653 -5.567 346 HE1 TYR 46 HE1 TYR 46 29.044 -16.276 -7.444 347 HE2 TYR 46 HE2 TYR 46 25.659 -13.701 -7.737 348 HH TYR 46 HH TYR 46 28.714 -14.921 -9.087 349 H SER 47 HN SER 47 29.446 -16.401 -2.804 350 HA SER 47 HA SER 47 29.096 -14.009 -1.284 351 HB2 SER 47 2HB SER 47 31.569 -15.411 -2.387 352 HB3 SER 47 3HB SER 47 31.641 -13.954 -1.417 353 HG SER 47 HG SER 47 30.890 -15.044 0.378 354 H TYR 48 HN TYR 48 29.233 -11.896 -2.053 355 HA TYR 48 HA TYR 48 29.261 -11.591 -4.926 356 HB2 TYR 48 2HB TYR 48 29.142 -9.525 -2.649 357 HB3 TYR 48 3HB TYR 48 28.532 -9.305 -4.277 358 HD1 TYR 48 HD2 TYR 48 27.451 -12.418 -3.993 359 HD2 TYR 48 HD1 TYR 48 26.835 -8.700 -1.970 360 HE1 TYR 48 HE2 TYR 48 25.154 -13.202 -3.237 361 HE2 TYR 48 HE1 TYR 48 24.540 -9.496 -1.219 362 HH TYR 48 HH TYR 48 22.910 -11.024 -1.740 363 H THR 49 HN THR 49 30.415 -9.334 -5.606 364 HA THR 49 HA THR 49 33.166 -9.873 -5.491 365 HB THR 49 HB THR 49 33.253 -7.587 -6.626 366 HG1 THR 49 HG1 THR 49 30.975 -6.748 -6.942 367 HG21 THR 49 1HG2 THR 49 31.738 -9.933 -7.513 368 HG22 THR 49 2HG2 THR 49 30.998 -8.440 -8.135 369 HG23 THR 49 3HG2 THR 49 32.706 -8.799 -8.486 370 H ALA 50 HN ALA 50 34.696 -7.818 -4.944 371 HA ALA 50 HA ALA 50 34.409 -7.592 -2.072 372 HB1 ALA 50 3HB ALA 50 36.696 -6.217 -3.207 373 HB2 ALA 50 1HB ALA 50 36.655 -7.652 -2.155 374 HB3 ALA 50 2HB ALA 50 36.542 -7.841 -3.921 375 H ALA 51 HN ALA 51 32.867 -6.064 -4.440 376 HA ALA 51 HA ALA 51 33.464 -3.349 -3.550 377 HB1 ALA 51 3HB ALA 51 31.487 -4.138 -5.698 378 HB2 ALA 51 1HB ALA 51 32.434 -2.639 -5.539 379 HB3 ALA 51 2HB ALA 51 33.236 -4.153 -6.024 380 H ASN 52 HN ASN 52 31.046 -5.951 -3.396 381 HA ASN 52 HA ASN 52 29.215 -4.123 -2.095 382 HB2 ASN 52 2HB ASN 52 28.508 -5.825 -3.937 383 HB3 ASN 52 3HB ASN 52 28.750 -7.075 -2.733 384 HD21 ASN 52 1HD2 ASN 52 27.681 -6.641 -0.577 385 HD22 ASN 52 2HD2 ASN 52 26.055 -6.045 -0.596 386 H LYS 53 HN LYS 53 31.125 -7.157 -1.679 387 HA LYS 53 HA LYS 53 30.178 -7.850 0.849 388 HB2 LYS 53 2HB LYS 53 31.536 -9.232 -0.814 389 HB3 LYS 53 3HB LYS 53 32.956 -8.399 -0.214 390 HG2 LYS 53 2HG LYS 53 32.046 -9.103 2.172 391 HG3 LYS 53 3HG LYS 53 31.097 -10.274 1.278 392 HD2 LYS 53 2HD LYS 53 33.431 -10.824 0.106 393 HD3 LYS 53 3HD LYS 53 34.104 -10.076 1.540 394 HE2 LYS 53 2HE LYS 53 33.198 -11.719 2.991 395 HE3 LYS 53 3HE LYS 53 31.957 -12.191 1.848 396 HZ1 LYS 53 2HZ LYS 53 33.351 -13.705 0.976 397 HZ3 LYS 53 1HZ LYS 53 34.425 -13.390 2.161 398 H ASN 54 HN ASN 54 32.849 -5.683 -0.226 399 HA ASN 54 HA ASN 54 33.892 -5.250 2.291 400 HB2 ASN 54 2HB ASN 54 34.932 -3.233 1.276 401 HB3 ASN 54 3HB ASN 54 35.020 -4.583 0.161 402 HD21 ASN 54 1HD2 ASN 54 35.364 -2.371 -1.050 403 HD22 ASN 54 2HD2 ASN 54 33.978 -1.777 -1.901 404 H LYS 55 HN LYS 55 30.878 -4.336 0.853 405 HA LYS 55 HA LYS 55 30.533 -1.848 2.193 406 HB2 LYS 55 2HB LYS 55 29.413 -2.793 0.023 407 HB3 LYS 55 3HB LYS 55 28.283 -3.540 1.134 408 HG2 LYS 55 2HG LYS 55 27.261 -1.460 0.700 409 HG3 LYS 55 3HG LYS 55 28.083 -1.163 2.219 410 HD2 LYS 55 2HD LYS 55 30.055 -0.243 0.894 411 HD3 LYS 55 3HD LYS 55 29.096 -0.410 -0.562 412 HE2 LYS 55 2HE LYS 55 27.291 0.996 0.799 413 HE3 LYS 55 3HE LYS 55 28.665 1.462 1.781 414 HZ1 LYS 55 2HZ LYS 55 27.990 2.666 -0.535 415 HZ3 LYS 55 1HZ LYS 55 29.152 1.655 -1.063 416 H GLY 56 HN GLY 56 29.110 -1.403 3.990 417 HA2 GLY 56 1HA GLY 56 28.363 -3.740 5.608 418 HA3 GLY 56 2HA GLY 56 29.431 -2.535 6.297 419 H ILE 57 HN ILE 57 26.217 -2.929 4.679 420 HA ILE 57 HA ILE 57 25.146 -0.985 6.550 421 HB ILE 57 HB ILE 57 24.063 0.318 4.834 422 HG12 ILE 57 2HG1 ILE 57 24.985 -0.033 2.415 423 HG13 ILE 57 3HG1 ILE 57 25.342 -1.661 2.959 424 HG21 ILE 57 1HG2 ILE 57 26.425 0.819 5.674 425 HG22 ILE 57 2HG2 ILE 57 26.988 0.209 4.098 426 HG23 ILE 57 3HG2 ILE 57 25.901 1.617 4.171 427 HD11 ILE 57 3HD1 ILE 57 23.126 -2.262 3.072 428 HD12 ILE 57 1HD1 ILE 57 22.619 -0.663 3.665 429 HD13 ILE 57 2HD1 ILE 57 22.925 -0.911 1.930 430 H ILE 58 HN ILE 58 22.857 -1.225 6.880 431 HA ILE 58 HA ILE 58 21.999 -3.916 6.307 432 HB ILE 58 HB ILE 58 21.109 -1.684 8.078 433 HG12 ILE 58 2HG1 ILE 58 22.802 -3.614 8.598 434 HG13 ILE 58 3HG1 ILE 58 21.635 -3.105 9.802 435 HG21 ILE 58 1HG2 ILE 58 19.107 -3.064 8.701 436 HG22 ILE 58 2HG2 ILE 58 19.019 -2.284 7.103 437 HG23 ILE 58 3HG2 ILE 58 19.387 -4.021 7.226 438 HD11 ILE 58 3HD1 ILE 58 20.140 -4.958 9.240 439 HD12 ILE 58 1HD1 ILE 58 21.170 -5.417 7.863 440 HD13 ILE 58 2HD1 ILE 58 21.773 -5.608 9.527 441 H TRP 59 HN TRP 59 20.737 -4.517 4.629 442 HA TRP 59 HA TRP 59 19.954 -2.616 2.704 443 HB2 TRP 59 2HB TRP 59 19.636 -5.551 3.105 444 HB3 TRP 59 3HB TRP 59 18.559 -4.761 1.970 445 HD1 TRP 59 HD1 TRP 59 21.545 -6.639 1.698 446 HE1 TRP 59 HE1 TRP 59 23.144 -6.000 -0.301 447 HE3 TRP 59 HE3 TRP 59 19.496 -2.067 0.829 448 HZ2 TRP 59 HZ2 TRP 59 23.368 -3.707 -1.985 449 HZ3 TRP 59 HZ3 TRP 59 20.464 -0.691 -1.010 450 HH2 TRP 59 HH2 TRP 59 22.333 -1.443 -2.393 451 H GLY 60 HN GLY 60 18.498 -1.048 3.379 452 HA2 GLY 60 1HA GLY 60 16.025 -2.019 4.684 453 HA3 GLY 60 2HA GLY 60 16.750 -0.444 4.948 454 H GLU 61 HN GLU 61 14.641 0.481 4.311 455 HA GLU 61 HA GLU 61 13.938 0.103 1.546 456 HB2 GLU 61 2HB GLU 61 12.346 0.332 3.664 457 HB3 GLU 61 3HB GLU 61 12.544 2.051 3.387 458 HG2 GLU 61 2HG GLU 61 11.977 1.404 0.859 459 HG3 GLU 61 3HG GLU 61 11.271 -0.025 1.591 460 HE2 GLU 61 HE2 GLU 61 9.059 1.772 3.566 461 H ASP 62 HN ASP 62 14.727 2.864 3.781 462 HA ASP 62 HA ASP 62 14.758 4.821 1.899 463 HB2 ASP 62 2HB ASP 62 16.375 4.397 4.438 464 HB3 ASP 62 3HB ASP 62 16.582 5.852 3.482 465 HD2 ASP 62 HD2 ASP 62 14.877 6.102 6.298 466 H THR 63 HN THR 63 16.925 2.119 2.388 467 HA THR 63 HA THR 63 19.202 3.345 1.107 468 HB THR 63 HB THR 63 20.117 1.001 1.412 469 HG1 THR 63 HG1 THR 63 18.447 -0.452 1.505 470 HG21 THR 63 1HG2 THR 63 20.588 1.945 3.469 471 HG22 THR 63 2HG2 THR 63 18.959 2.646 3.619 472 HG23 THR 63 3HG2 THR 63 19.235 0.937 4.033 473 H LEU 64 HN LEU 64 16.878 0.685 0.275 474 HA LEU 64 HA LEU 64 17.844 0.263 -2.276 475 HB2 LEU 64 2HB LEU 64 15.041 -0.035 -1.189 476 HB3 LEU 64 3HB LEU 64 15.597 -0.689 -2.718 477 HG LEU 64 HG LEU 64 17.010 -1.422 -0.163 478 HD11 LEU 64 1HD1 LEU 64 14.345 -1.762 -0.256 479 HD12 LEU 64 2HD1 LEU 64 14.862 -3.241 -1.102 480 HD13 LEU 64 3HD1 LEU 64 15.455 -2.903 0.541 481 HD21 LEU 64 3HD2 LEU 64 16.547 -3.305 -2.427 482 HD22 LEU 64 1HD2 LEU 64 17.690 -1.963 -2.678 483 HD23 LEU 64 2HD2 LEU 64 17.952 -3.120 -1.351 484 H MET 65 HN MET 65 16.161 2.999 -0.940 485 HA MET 65 HA MET 65 14.871 3.853 -3.253 486 HB2 MET 65 2HB MET 65 15.752 5.023 -0.620 487 HB3 MET 65 3HB MET 65 15.401 6.182 -1.886 488 HG2 MET 65 2HG MET 65 13.414 3.956 -1.399 489 HG3 MET 65 3HG MET 65 13.470 5.282 -0.256 490 HE1 MET 65 3HE MET 65 12.388 4.706 -4.368 491 HE2 MET 65 1HE MET 65 12.079 3.783 -2.879 492 HE3 MET 65 2HE MET 65 10.888 4.975 -3.449 493 H GLU 66 HN GLU 66 17.911 5.164 -1.729 494 HA GLU 66 HA GLU 66 18.559 6.638 -4.007 495 HB2 GLU 66 2HB GLU 66 19.372 7.194 -1.735 496 HB3 GLU 66 3HB GLU 66 20.311 5.715 -1.687 497 HG2 GLU 66 2HG GLU 66 22.032 6.811 -2.672 498 HG3 GLU 66 3HG GLU 66 21.057 6.996 -4.116 499 HE2 GLU 66 HE2 GLU 66 22.521 9.214 -1.788 500 H TYR 67 HN TYR 67 19.193 3.304 -2.970 501 HA TYR 67 HA TYR 67 21.381 2.759 -4.619 502 HB2 TYR 67 2HB TYR 67 20.345 1.412 -2.680 503 HB3 TYR 67 3HB TYR 67 18.993 1.025 -3.727 504 HD1 TYR 67 HD1 TYR 67 22.644 1.076 -4.552 505 HD2 TYR 67 HD2 TYR 67 19.127 -1.298 -4.010 506 HE1 TYR 67 HE1 TYR 67 23.887 -0.971 -5.406 507 HE2 TYR 67 HE2 TYR 67 20.382 -3.338 -4.866 508 HH TYR 67 HH TYR 67 22.200 -3.989 -5.989 509 H LEU 68 HN LEU 68 17.865 1.966 -5.132 510 HA LEU 68 HA LEU 68 18.213 1.057 -7.735 511 HB2 LEU 68 2HB LEU 68 15.921 1.988 -6.070 512 HB3 LEU 68 3HB LEU 68 15.672 1.812 -7.796 513 HG LEU 68 HG LEU 68 16.254 -0.535 -7.710 514 HD11 LEU 68 1HD1 LEU 68 16.969 -1.701 -5.784 515 HD12 LEU 68 2HD1 LEU 68 17.979 -0.239 -5.876 516 HD13 LEU 68 3HD1 LEU 68 16.628 -0.314 -4.720 517 HD21 LEU 68 3HD2 LEU 68 14.100 0.596 -6.049 518 HD22 LEU 68 1HD2 LEU 68 14.040 -0.611 -7.356 519 HD23 LEU 68 2HD2 LEU 68 14.494 -1.106 -5.708 520 H GLU 69 HN GLU 69 18.039 4.312 -6.369 521 HA GLU 69 HA GLU 69 17.322 5.608 -8.732 522 HB2 GLU 69 2HB GLU 69 17.119 6.677 -6.529 523 HB3 GLU 69 3HB GLU 69 18.853 6.591 -6.284 524 HG2 GLU 69 2HG GLU 69 18.049 8.861 -7.050 525 HG3 GLU 69 3HG GLU 69 19.276 8.163 -8.089 526 HE2 GLU 69 HE2 GLU 69 15.913 9.427 -9.124 527 H ASN 70 HN ASN 70 20.461 4.597 -7.308 528 HA ASN 70 HA ASN 70 21.643 4.686 -9.864 529 HB2 ASN 70 2HB ASN 70 22.240 6.866 -7.849 530 HB3 ASN 70 3HB ASN 70 23.574 6.252 -8.807 531 HD21 ASN 70 1HD2 ASN 70 22.949 5.925 -11.213 532 HD22 ASN 70 2HD2 ASN 70 22.176 7.268 -11.985 533 HA PRO 71 HA PRO 71 23.399 1.834 -6.782 534 HB2 PRO 71 2HB PRO 71 23.227 -0.447 -8.278 535 HB3 PRO 71 3HB PRO 71 21.980 0.061 -7.156 536 HG2 PRO 71 2HG PRO 71 21.981 0.191 -10.109 537 HG3 PRO 71 3HG PRO 71 20.622 0.286 -9.007 538 HD2 PRO 71 2HD PRO 71 21.862 2.469 -10.395 539 HD3 PRO 71 3HD PRO 71 20.580 2.576 -9.205 540 H LYS 72 HN LYS 72 24.311 3.130 -9.644 541 HA LYS 72 HA LYS 72 26.686 1.559 -9.985 542 HB2 LYS 72 2HB LYS 72 27.150 3.024 -11.826 543 HB3 LYS 72 3HB LYS 72 25.450 2.600 -11.872 544 HG2 LYS 72 2HG LYS 72 25.238 4.889 -12.148 545 HG3 LYS 72 3HG LYS 72 25.204 4.835 -10.397 546 HD2 LYS 72 2HD LYS 72 26.795 6.564 -11.258 547 HD3 LYS 72 3HD LYS 72 27.598 5.360 -10.271 548 HE2 LYS 72 2HE LYS 72 28.699 6.029 -12.551 549 HE3 LYS 72 3HE LYS 72 28.643 4.330 -12.123 550 HZ1 LYS 72 2HZ LYS 72 26.606 5.653 -13.834 551 HZ3 LYS 72 1HZ LYS 72 26.702 4.057 -13.524 552 H LYS 73 HN LYS 73 25.643 4.139 -7.934 553 HA LYS 73 HA LYS 73 28.420 4.957 -7.486 554 HB2 LYS 73 2HB LYS 73 27.643 7.006 -6.752 555 HB3 LYS 73 3HB LYS 73 26.509 6.624 -8.033 556 HG2 LYS 73 2HG LYS 73 25.156 5.466 -6.014 557 HG3 LYS 73 3HG LYS 73 26.083 6.596 -5.047 558 HD2 LYS 73 2HD LYS 73 24.660 7.604 -7.522 559 HD3 LYS 73 3HD LYS 73 23.728 7.307 -6.068 560 HE2 LYS 73 2HE LYS 73 24.417 9.632 -6.015 561 HE3 LYS 73 3HE LYS 73 25.342 8.790 -4.788 562 HZ1 LYS 73 2HZ LYS 73 27.160 9.560 -5.836 563 HZ3 LYS 73 1HZ LYS 73 26.309 10.127 -7.102 564 H TYR 74 HN TYR 74 25.506 3.503 -6.010 565 HA TYR 74 HA TYR 74 26.405 3.528 -3.362 566 HB2 TYR 74 2HB TYR 74 24.118 2.921 -4.656 567 HB3 TYR 74 3HB TYR 74 24.789 1.302 -4.705 568 HD1 TYR 74 HD2 TYR 74 25.827 0.600 -2.237 569 HD2 TYR 74 HD1 TYR 74 22.584 3.292 -2.967 570 HE1 TYR 74 HE2 TYR 74 24.929 0.163 0.101 571 HE2 TYR 74 HE1 TYR 74 21.697 2.846 -0.628 572 HH TYR 74 HH TYR 74 23.254 1.856 1.730 573 H ILE 75 HN ILE 75 26.788 1.112 -6.027 574 HA ILE 75 HA ILE 75 29.036 0.011 -4.540 575 HB ILE 75 HB ILE 75 26.946 -1.805 -5.714 576 HG12 ILE 75 2HG1 ILE 75 27.160 -0.909 -2.825 577 HG13 ILE 75 3HG1 ILE 75 25.893 -0.444 -3.942 578 HG21 ILE 75 1HG2 ILE 75 28.119 -3.313 -3.915 579 HG22 ILE 75 2HG2 ILE 75 28.866 -3.049 -5.509 580 HG23 ILE 75 3HG2 ILE 75 29.444 -2.137 -4.094 581 HD11 ILE 75 3HD1 ILE 75 24.789 -2.270 -3.134 582 HD12 ILE 75 1HD1 ILE 75 25.863 -3.200 -4.206 583 HD13 ILE 75 2HD1 ILE 75 26.280 -2.996 -2.488 584 HA PRO 76 HA PRO 76 30.045 0.664 -8.840 585 HB2 PRO 76 2HB PRO 76 32.555 1.664 -8.427 586 HB3 PRO 76 3HB PRO 76 31.129 2.675 -8.554 587 HG2 PRO 76 2HG PRO 76 32.668 1.933 -6.140 588 HG3 PRO 76 3HG PRO 76 31.529 3.249 -6.356 589 HD2 PRO 76 2HD PRO 76 31.050 0.771 -4.994 590 HD3 PRO 76 3HD PRO 76 29.880 2.036 -5.310 591 H GLY 77 HN GLY 77 30.669 -0.904 -10.191 592 HA2 GLY 77 1HA GLY 77 32.187 -2.486 -10.929 593 HA3 GLY 77 2HA GLY 77 32.959 -2.512 -9.356 594 H THR 78 HN THR 78 29.417 -2.637 -9.601 595 HA THR 78 HA THR 78 29.479 -5.274 -8.389 596 HB THR 78 HB THR 78 28.066 -3.427 -7.462 597 HG1 THR 78 HG1 THR 78 26.534 -5.016 -7.128 598 HG21 THR 78 1HG2 THR 78 27.043 -3.431 -10.297 599 HG22 THR 78 2HG2 THR 78 25.840 -3.241 -8.999 600 HG23 THR 78 3HG2 THR 78 27.177 -2.076 -9.151 601 H LYS 79 HN LYS 79 27.955 -6.984 -9.149 602 HA LYS 79 HA LYS 79 28.230 -7.172 -12.041 603 HB2 LYS 79 2HB LYS 79 27.274 -9.423 -10.309 604 HB3 LYS 79 3HB LYS 79 28.214 -9.471 -11.787 605 HG2 LYS 79 2HG LYS 79 30.061 -8.219 -10.387 606 HG3 LYS 79 3HG LYS 79 29.148 -8.750 -8.988 607 HD2 LYS 79 2HD LYS 79 29.998 -10.706 -11.160 608 HD3 LYS 79 3HD LYS 79 31.069 -10.291 -9.838 609 HE2 LYS 79 2HE LYS 79 29.937 -12.244 -9.077 610 HE3 LYS 79 3HE LYS 79 29.125 -10.931 -8.248 611 HZ1 LYS 79 2HZ LYS 79 27.557 -12.504 -9.294 612 HZ3 LYS 79 1HZ LYS 79 28.141 -12.152 -10.772 613 H MET 80 HN MET 80 26.270 -5.331 -10.818 614 HA MET 80 HA MET 80 23.838 -6.706 -11.664 615 HB2 MET 80 2HB MET 80 23.790 -5.974 -9.289 616 HB3 MET 80 3HB MET 80 24.282 -4.355 -9.743 617 HG2 MET 80 2HG MET 80 22.179 -3.808 -10.639 618 HG3 MET 80 3HG MET 80 21.786 -5.472 -11.023 619 HE1 MET 80 3HE MET 80 21.014 -2.723 -9.408 620 HE2 MET 80 1HE MET 80 19.841 -3.232 -8.170 621 HE3 MET 80 2HE MET 80 21.511 -2.832 -7.702 622 H ILE 81 HN ILE 81 24.479 -6.165 -13.928 623 HA ILE 81 HA ILE 81 24.963 -3.617 -14.836 624 HB ILE 81 HB ILE 81 24.864 -6.050 -15.938 625 HG12 ILE 81 2HG1 ILE 81 25.183 -4.922 -18.127 626 HG13 ILE 81 3HG1 ILE 81 24.634 -3.415 -17.421 627 HG21 ILE 81 1HG2 ILE 81 23.098 -6.240 -17.567 628 HG22 ILE 81 2HG2 ILE 81 22.383 -6.077 -15.945 629 HG23 ILE 81 3HG2 ILE 81 22.400 -4.685 -17.054 630 HD11 ILE 81 3HD1 ILE 81 27.245 -4.091 -17.512 631 HD12 ILE 81 1HD1 ILE 81 26.570 -3.114 -16.185 632 HD13 ILE 81 2HD1 ILE 81 26.824 -4.860 -15.962 633 H PHE 82 HN PHE 82 23.814 -1.781 -14.618 634 HA PHE 82 HA PHE 82 21.110 -1.671 -15.394 635 HB2 PHE 82 2HB PHE 82 21.336 -2.711 -12.903 636 HB3 PHE 82 3HB PHE 82 21.610 -1.039 -12.452 637 HD1 PHE 82 HD2 PHE 82 19.236 -2.731 -14.797 638 HD2 PHE 82 HD1 PHE 82 19.738 -0.114 -11.496 639 HE1 PHE 82 HE2 PHE 82 16.756 -2.344 -14.727 640 HE2 PHE 82 HE1 PHE 82 17.259 0.275 -11.425 641 HZ PHE 82 HZ PHE 82 15.798 -0.846 -13.042 642 H VAL 83 HN VAL 83 20.212 0.582 -15.122 643 HA VAL 83 HA VAL 83 22.444 2.489 -15.022 644 HB VAL 83 HB VAL 83 21.157 3.853 -16.545 645 HG11 VAL 83 1HG1 VAL 83 21.334 2.500 -18.536 646 HG12 VAL 83 2HG1 VAL 83 22.656 2.058 -17.429 647 HG13 VAL 83 3HG1 VAL 83 21.231 1.001 -17.583 648 HG21 VAL 83 3HG2 VAL 83 19.078 1.644 -16.621 649 HG22 VAL 83 1HG2 VAL 83 18.902 3.151 -15.689 650 HG23 VAL 83 2HG2 VAL 83 19.031 3.211 -17.464 651 H GLY 84 HN GLY 84 19.197 1.612 -13.858 652 HA2 GLY 84 1HA GLY 84 18.801 2.320 -11.542 653 HA3 GLY 84 2HA GLY 84 19.326 3.924 -12.013 654 H ILE 85 HN ILE 85 16.769 3.406 -10.843 655 HA ILE 85 HA ILE 85 14.936 3.583 -13.111 656 HB ILE 85 HB ILE 85 14.449 3.163 -10.160 657 HG12 ILE 85 2HG1 ILE 85 13.863 1.141 -12.297 658 HG13 ILE 85 3HG1 ILE 85 15.513 1.326 -11.735 659 HG21 ILE 85 1HG2 ILE 85 12.646 4.430 -11.381 660 HG22 ILE 85 2HG2 ILE 85 12.425 2.988 -12.401 661 HG23 ILE 85 3HG2 ILE 85 12.140 2.890 -10.647 662 HD11 ILE 85 3HD1 ILE 85 13.469 1.218 -9.568 663 HD12 ILE 85 1HD1 ILE 85 13.656 -0.277 -10.515 664 HD13 ILE 85 2HD1 ILE 85 15.059 0.425 -9.675 665 H LYS 86 HN LYS 86 13.575 5.385 -13.431 666 HA LYS 86 HA LYS 86 14.580 7.793 -12.118 667 HB2 LYS 86 2HB LYS 86 13.126 7.284 -14.717 668 HB3 LYS 86 3HB LYS 86 13.249 8.892 -14.029 669 HG2 LYS 86 2HG LYS 86 15.100 8.569 -15.593 670 HG3 LYS 86 3HG LYS 86 15.750 8.661 -13.969 671 HD2 LYS 86 2HD LYS 86 16.108 6.290 -13.849 672 HD3 LYS 86 3HD LYS 86 15.066 5.976 -15.222 673 HE2 LYS 86 2HE LYS 86 17.496 7.731 -15.629 674 HE3 LYS 86 3HE LYS 86 17.729 5.999 -15.490 675 HZ1 LYS 86 2HZ LYS 86 15.911 7.305 -17.446 676 HZ3 LYS 86 1HZ LYS 86 16.139 5.698 -17.320 677 H LYS 87 HN LYS 87 11.540 6.002 -12.900 678 HA LYS 87 HA LYS 87 9.821 7.809 -11.652 679 HB2 LYS 87 2HB LYS 87 9.644 4.891 -12.387 680 HB3 LYS 87 3HB LYS 87 8.344 5.674 -11.509 681 HG2 LYS 87 2HG LYS 87 9.437 7.049 -13.966 682 HG3 LYS 87 3HG LYS 87 8.400 5.655 -14.190 683 HD2 LYS 87 2HD LYS 87 6.791 7.338 -14.131 684 HD3 LYS 87 3HD LYS 87 6.832 6.907 -12.433 685 HE2 LYS 87 2HE LYS 87 7.981 8.848 -11.814 686 HE3 LYS 87 3HE LYS 87 8.786 9.002 -13.363 687 HZ1 LYS 87 2HZ LYS 87 6.757 9.797 -14.344 688 HZ3 LYS 87 1HZ LYS 87 6.965 10.655 -12.976 689 H LYS 88 HN LYS 88 9.001 7.982 -9.552 690 HA LYS 88 HA LYS 88 10.717 6.783 -7.544 691 HB2 LYS 88 2HB LYS 88 8.495 8.753 -7.024 692 HB3 LYS 88 3HB LYS 88 9.948 8.459 -6.089 693 HG2 LYS 88 2HG LYS 88 9.958 9.582 -8.930 694 HG3 LYS 88 3HG LYS 88 10.010 10.579 -7.490 695 HD2 LYS 88 2HD LYS 88 12.095 9.242 -6.781 696 HD3 LYS 88 3HD LYS 88 12.086 8.532 -8.383 697 HE2 LYS 88 2HE LYS 88 13.518 10.357 -8.714 698 HE3 LYS 88 3HE LYS 88 11.986 11.042 -9.222 699 HZ1 LYS 88 2HZ LYS 88 12.569 12.620 -7.704 700 HZ3 LYS 88 1HZ LYS 88 13.535 11.639 -6.834 701 H GLU 89 HN GLU 89 7.190 7.052 -8.350 702 HA GLU 89 HA GLU 89 6.272 5.483 -6.324 703 HB2 GLU 89 2HB GLU 89 4.906 6.833 -7.967 704 HB3 GLU 89 3HB GLU 89 5.168 5.583 -9.166 705 HG2 GLU 89 2HG GLU 89 4.168 3.915 -7.475 706 HG3 GLU 89 3HG GLU 89 3.702 5.301 -6.506 707 HE2 GLU 89 HE2 GLU 89 1.515 4.283 -9.605 708 H GLU 90 HN GLU 90 7.765 4.560 -9.442 709 HA GLU 90 HA GLU 90 7.030 1.898 -9.407 710 HB2 GLU 90 2HB GLU 90 9.505 3.244 -10.577 711 HB3 GLU 90 3HB GLU 90 9.020 1.599 -10.940 712 HG2 GLU 90 2HG GLU 90 7.219 4.022 -11.394 713 HG3 GLU 90 3HG GLU 90 8.253 3.341 -12.635 714 HE2 GLU 90 HE2 GLU 90 4.764 1.836 -11.793 715 H ARG 91 HN ARG 91 9.495 3.704 -7.620 716 HA ARG 91 HA ARG 91 10.844 1.301 -6.855 717 HB2 ARG 91 2HB ARG 91 11.185 4.208 -5.960 718 HB3 ARG 91 3HB ARG 91 12.230 2.898 -5.446 719 HG2 ARG 91 2HG ARG 91 12.435 2.474 -8.092 720 HG3 ARG 91 3HG ARG 91 11.973 4.163 -8.174 721 HD2 ARG 91 2HD ARG 91 14.284 3.131 -6.461 722 HD3 ARG 91 3HD ARG 91 14.488 3.751 -8.086 723 HE ARG 91 HE ARG 91 13.906 5.320 -5.673 724 HH11 ARG 91 2HH2 ARG 91 13.837 5.301 -9.215 725 HH12 ARG 91 1HH2 ARG 91 13.849 7.028 -9.348 726 HH22 ARG 91 HH1 ARG 91 13.899 8.358 -7.355 727 H ALA 92 HN ALA 92 8.388 3.563 -5.633 728 HA ALA 92 HA ALA 92 8.542 2.731 -2.921 729 HB1 ALA 92 3HB ALA 92 7.666 4.926 -3.629 730 HB2 ALA 92 1HB ALA 92 6.336 4.122 -4.496 731 HB3 ALA 92 2HB ALA 92 6.437 4.011 -2.722 732 H ASP 93 HN ASP 93 7.352 1.299 -5.833 733 HA ASP 93 HA ASP 93 5.522 -0.356 -4.298 734 HB2 ASP 93 2HB ASP 93 5.837 0.301 -7.238 735 HB3 ASP 93 3HB ASP 93 5.024 -1.182 -6.781 736 HD2 ASP 93 HD2 ASP 93 2.262 -0.224 -6.174 737 H LEU 94 HN LEU 94 8.297 -0.356 -6.622 738 HA LEU 94 HA LEU 94 8.583 -3.111 -6.864 739 HB2 LEU 94 2HB LEU 94 9.617 -1.584 -8.387 740 HB3 LEU 94 3HB LEU 94 10.546 -0.834 -7.105 741 HG LEU 94 HG LEU 94 11.719 -2.481 -8.706 742 HD11 LEU 94 1HD1 LEU 94 13.361 -2.882 -7.132 743 HD12 LEU 94 2HD1 LEU 94 12.475 -1.522 -6.400 744 HD13 LEU 94 3HD1 LEU 94 12.191 -3.182 -5.824 745 HD21 LEU 94 3HD2 LEU 94 11.382 -4.716 -8.581 746 HD22 LEU 94 1HD2 LEU 94 10.947 -4.673 -6.855 747 HD23 LEU 94 2HD2 LEU 94 9.752 -4.197 -8.086 748 H ILE 95 HN ILE 95 9.471 -0.842 -4.286 749 HA ILE 95 HA ILE 95 11.133 -2.822 -2.992 750 HB ILE 95 HB ILE 95 10.378 0.031 -2.441 751 HG12 ILE 95 2HG1 ILE 95 13.146 -1.141 -2.592 752 HG13 ILE 95 3HG1 ILE 95 12.253 -0.793 -4.059 753 HG21 ILE 95 1HG2 ILE 95 12.043 -0.297 -0.448 754 HG22 ILE 95 2HG2 ILE 95 10.316 -0.683 -0.253 755 HG23 ILE 95 3HG2 ILE 95 11.494 -1.988 -0.526 756 HD11 ILE 95 3HD1 ILE 95 11.814 1.557 -2.864 757 HD12 ILE 95 1HD1 ILE 95 13.281 1.111 -1.961 758 HD13 ILE 95 2HD1 ILE 95 13.335 1.245 -3.735 759 H ALA 96 HN ALA 96 7.898 -1.281 -2.645 760 HA ALA 96 HA ALA 96 7.211 -2.330 -0.192 761 HB1 ALA 96 3HB ALA 96 5.430 -1.076 -0.734 762 HB2 ALA 96 1HB ALA 96 5.953 -1.022 -2.435 763 HB3 ALA 96 2HB ALA 96 4.909 -2.345 -1.867 764 H TYR 97 HN TYR 97 7.770 -3.928 -3.247 765 HA TYR 97 HA TYR 97 6.243 -6.270 -2.443 766 HB2 TYR 97 2HB TYR 97 6.092 -5.724 -4.787 767 HB3 TYR 97 3HB TYR 97 7.754 -5.172 -4.852 768 HD1 TYR 97 HD2 TYR 97 6.818 -8.413 -3.341 769 HD2 TYR 97 HD1 TYR 97 8.325 -6.441 -6.827 770 HE1 TYR 97 HE2 TYR 97 7.530 -10.654 -4.311 771 HE2 TYR 97 HE1 TYR 97 9.031 -8.689 -7.784 772 HH TYR 97 HH TYR 97 7.888 -11.546 -6.703 773 H LEU 98 HN LEU 98 9.629 -5.558 -3.577 774 HA LEU 98 HA LEU 98 10.714 -7.982 -2.943 775 HB2 LEU 98 2HB LEU 98 11.747 -5.205 -3.218 776 HB3 LEU 98 3HB LEU 98 12.810 -6.397 -2.499 777 HG LEU 98 HG LEU 98 11.548 -6.517 -5.251 778 HD11 LEU 98 1HD1 LEU 98 14.399 -6.740 -5.253 779 HD12 LEU 98 2HD1 LEU 98 13.368 -5.481 -5.974 780 HD13 LEU 98 3HD1 LEU 98 13.936 -5.311 -4.295 781 HD21 LEU 98 3HD2 LEU 98 12.542 -8.655 -3.564 782 HD22 LEU 98 1HD2 LEU 98 11.725 -8.729 -5.143 783 HD23 LEU 98 2HD2 LEU 98 13.490 -8.517 -5.064 784 H LYS 99 HN LYS 99 9.702 -5.346 -0.811 785 HA LYS 99 HA LYS 99 11.188 -6.256 1.435 786 HB2 LYS 99 2HB LYS 99 10.297 -4.453 2.532 787 HB3 LYS 99 3HB LYS 99 10.150 -3.908 0.873 788 HG2 LYS 99 2HG LYS 99 7.783 -4.744 0.817 789 HG3 LYS 99 3HG LYS 99 7.933 -5.260 2.484 790 HD2 LYS 99 2HD LYS 99 8.307 -2.945 3.228 791 HD3 LYS 99 3HD LYS 99 8.356 -2.377 1.571 792 HE2 LYS 99 2HE LYS 99 6.140 -1.877 2.179 793 HE3 LYS 99 3HE LYS 99 5.945 -3.424 1.379 794 HZ1 LYS 99 2HZ LYS 99 4.834 -3.257 3.601 795 HZ3 LYS 99 1HZ LYS 99 6.296 -3.180 4.316 796 H LYS 100 HN LYS 100 7.961 -6.897 0.035 797 HA LYS 100 HA LYS 100 7.217 -8.474 2.343 798 HB2 LYS 100 2HB LYS 100 5.680 -6.932 0.944 799 HB3 LYS 100 3HB LYS 100 5.670 -8.227 -0.236 800 HG2 LYS 100 2HG LYS 100 4.895 -9.823 1.547 801 HG3 LYS 100 3HG LYS 100 4.866 -8.503 2.699 802 HD2 LYS 100 2HD LYS 100 3.260 -7.292 1.077 803 HD3 LYS 100 3HD LYS 100 3.149 -8.804 0.198 804 HE2 LYS 100 2HE LYS 100 2.412 -8.366 3.131 805 HE3 LYS 100 3HE LYS 100 1.289 -8.628 1.811 806 HZ1 LYS 100 2HZ LYS 100 2.790 -10.796 1.545 807 HZ3 LYS 100 1HZ LYS 100 1.508 -10.770 2.549 808 H ALA 101 HN ALA 101 8.997 -8.842 -0.581 809 HA ALA 101 HA ALA 101 8.335 -11.655 -0.848 810 HB1 ALA 101 3HB ALA 101 8.783 -9.881 -2.736 811 HB2 ALA 101 1HB ALA 101 10.496 -10.201 -2.374 812 HB3 ALA 101 2HB ALA 101 9.436 -11.528 -2.906 813 H THR 102 HN THR 102 10.490 -9.603 0.909 814 HA THR 102 HA THR 102 12.231 -11.922 1.436 815 HB THR 102 HB THR 102 14.060 -10.277 1.730 816 HG1 THR 102 HG1 THR 102 13.001 -8.406 2.425 817 HG21 THR 102 1HG2 THR 102 12.489 -10.374 -0.807 818 HG22 THR 102 2HG2 THR 102 13.539 -8.946 -0.639 819 HG23 THR 102 3HG2 THR 102 14.239 -10.580 -0.554 820 H ASN 103 HN ASN 103 9.714 -11.470 2.736 821 HA ASN 103 HA ASN 103 10.764 -10.809 5.373 822 HB2 ASN 103 2HB ASN 103 9.133 -9.071 4.492 823 HB3 ASN 103 3HB ASN 103 7.912 -10.322 4.364 824 HD21 ASN 103 1HD2 ASN 103 7.310 -8.215 5.843 825 HD22 ASN 103 2HD2 ASN 103 7.327 -8.558 7.541 826 H GLU 104 HN GLU 104 8.250 -12.523 3.393 827 HA GLU 104 HA GLU 104 7.094 -14.057 5.268 828 HB2 GLU 104 2HB GLU 104 7.897 -15.095 2.519 829 HB3 GLU 104 3HB GLU 104 6.521 -15.605 3.477 830 HG2 GLU 104 2HG GLU 104 5.895 -13.001 3.373 831 HG3 GLU 104 3HG GLU 104 6.924 -13.026 1.955 832 HE2 GLU 104 HE2 GLU 104 3.291 -14.079 1.572 833 HHA HEC 500 HHA HEC 500 23.472 -7.569 -5.237 834 HHB HEC 500 HHB HEC 500 17.622 -4.978 -5.268 835 HHC HEC 500 HHC HEC 500 17.735 -5.486 -11.696 836 HHD HEC 500 HHD HEC 500 22.697 -9.498 -11.238 837 HMA1 HEC 500 1HMA HEC 500 18.339 -5.268 -3.077 838 HMA2 HEC 500 2HMA HEC 500 19.818 -5.511 -2.142 839 HMA3 HEC 500 3HMA HEC 500 19.622 -4.030 -3.097 840 HAA1 HEC 500 1HAA HEC 500 23.229 -6.192 -3.288 841 HAA2 HEC 500 2HAA HEC 500 21.870 -6.024 -2.296 842 HBA1 HEC 500 1HBA HEC 500 22.721 -8.641 -3.596 843 HBA2 HEC 500 2HBA HEC 500 22.990 -8.190 -1.902 844 HMB1 HEC 500 1HMB HEC 500 14.550 -4.719 -7.462 845 HMB2 HEC 500 2HMB HEC 500 15.507 -4.898 -6.007 846 HMB3 HEC 500 3HMB HEC 500 15.531 -3.343 -6.869 847 HAB HEC 500 HAB HEC 500 16.235 -4.043 -11.102 848 HBB1 HEC 500 1HBB HEC 500 15.803 -2.172 -9.807 849 HBB2 HEC 500 2HBB HEC 500 14.268 -2.780 -10.481 850 HBB3 HEC 500 3HBB HEC 500 14.639 -3.021 -8.785 851 HMC1 HEC 500 1HMC HEC 500 17.868 -8.008 -13.782 852 HMC2 HEC 500 2HMC HEC 500 18.089 -6.254 -13.705 853 HMC3 HEC 500 3HMC HEC 500 19.210 -7.222 -14.639 854 HAC HEC 500 HAC HEC 500 21.618 -10.080 -12.948 855 HBC1 HEC 500 1HBC HEC 500 22.261 -8.227 -14.480 856 HBC2 HEC 500 2HBC HEC 500 21.822 -9.748 -15.289 857 HBC3 HEC 500 3HBC HEC 500 20.679 -8.407 -15.281 858 HMD1 HEC 500 1HMD HEC 500 24.373 -11.244 -9.515 859 HMD2 HEC 500 2HMD HEC 500 24.891 -9.908 -10.556 860 HMD3 HEC 500 3HMD HEC 500 25.735 -10.258 -9.021 861 HAD1 HEC 500 1HAD HEC 500 25.070 -8.944 -5.594 862 HAD2 HEC 500 2HAD HEC 500 25.599 -10.044 -6.794 863 HBD1 HEC 500 1HBD HEC 500 26.978 -8.455 -7.817 864 HBD2 HEC 500 2HBD HEC 500 25.863 -7.127 -7.427 Start of MODEL 13 1 H1 GLY 1 HN GLY 1 0.614 -0.494 0.038 2 HA2 GLY 1 1HA GLY 1 2.031 0.598 -1.651 3 HA3 GLY 1 2HA GLY 1 3.414 -0.116 -0.845 4 H ASP 2 HN ASP 2 0.983 -0.546 -3.254 5 HA ASP 2 HA ASP 2 0.428 -3.128 -3.373 6 HB2 ASP 2 2HB ASP 2 1.460 -1.470 -5.723 7 HB3 ASP 2 3HB ASP 2 0.483 -2.918 -5.865 8 HD2 ASP 2 HD2 ASP 2 -1.591 -2.382 -4.118 9 H VAL 3 HN VAL 3 1.457 -5.021 -4.508 10 HA VAL 3 HA VAL 3 4.389 -4.807 -4.500 11 HB VAL 3 HB VAL 3 4.030 -6.216 -2.757 12 HG11 VAL 3 1HG1 VAL 3 1.588 -7.385 -4.133 13 HG12 VAL 3 2HG1 VAL 3 2.147 -7.737 -2.480 14 HG13 VAL 3 3HG1 VAL 3 1.559 -6.108 -2.894 15 HG21 VAL 3 3HG2 VAL 3 4.958 -7.422 -5.013 16 HG22 VAL 3 1HG2 VAL 3 4.909 -8.195 -3.411 17 HG23 VAL 3 2HG2 VAL 3 3.612 -8.506 -4.589 18 H GLU 4 HN GLU 4 1.556 -6.588 -5.910 19 HA GLU 4 HA GLU 4 2.689 -7.932 -7.869 20 HB2 GLU 4 2HB GLU 4 0.565 -7.004 -9.273 21 HB3 GLU 4 3HB GLU 4 0.411 -8.173 -7.976 22 HG2 GLU 4 2HG GLU 4 -0.564 -6.662 -6.536 23 HG3 GLU 4 3HG GLU 4 0.445 -5.333 -7.073 24 HE2 GLU 4 HE2 GLU 4 -2.679 -5.075 -7.130 25 H LYS 5 HN LYS 5 1.740 -4.432 -8.192 26 HA LYS 5 HA LYS 5 2.650 -3.981 -10.711 27 HB2 LYS 5 2HB LYS 5 2.698 -2.160 -8.290 28 HB3 LYS 5 3HB LYS 5 2.998 -1.613 -9.927 29 HG2 LYS 5 2HG LYS 5 0.457 -3.038 -9.006 30 HG3 LYS 5 3HG LYS 5 0.607 -1.306 -9.227 31 HD2 LYS 5 2HD LYS 5 1.452 -2.010 -11.668 32 HD3 LYS 5 3HD LYS 5 0.584 -3.491 -11.316 33 HE2 LYS 5 2HE LYS 5 -0.888 -1.869 -12.477 34 HE3 LYS 5 3HE LYS 5 -1.491 -2.208 -10.867 35 HZ1 LYS 5 2HZ LYS 5 -1.318 0.234 -11.574 36 HZ3 LYS 5 1HZ LYS 5 0.288 0.107 -11.341 37 H GLY 6 HN GLY 6 4.555 -3.962 -7.638 38 HA2 GLY 6 1HA GLY 6 7.011 -3.297 -8.926 39 HA3 GLY 6 2HA GLY 6 6.784 -3.876 -7.288 40 H LYS 7 HN LYS 7 5.162 -6.270 -8.403 41 HA LYS 7 HA LYS 7 7.389 -8.023 -8.583 42 HB2 LYS 7 2HB LYS 7 5.178 -8.516 -7.480 43 HB3 LYS 7 3HB LYS 7 4.460 -8.626 -9.075 44 HG2 LYS 7 2HG LYS 7 5.560 -10.612 -9.597 45 HG3 LYS 7 3HG LYS 7 6.964 -10.222 -8.625 46 HD2 LYS 7 2HD LYS 7 5.969 -10.960 -6.625 47 HD3 LYS 7 3HD LYS 7 4.339 -10.684 -7.207 48 HE2 LYS 7 2HE LYS 7 6.193 -12.873 -8.264 49 HE3 LYS 7 3HE LYS 7 4.954 -13.132 -7.051 50 HZ1 LYS 7 2HZ LYS 7 3.773 -11.810 -9.231 51 HZ3 LYS 7 1HZ LYS 7 3.469 -13.322 -8.706 52 H LYS 8 HN LYS 8 5.451 -6.194 -10.862 53 HA LYS 8 HA LYS 8 6.251 -7.888 -13.073 54 HB2 LYS 8 2HB LYS 8 4.532 -5.398 -12.901 55 HB3 LYS 8 3HB LYS 8 4.910 -6.222 -14.400 56 HG2 LYS 8 2HG LYS 8 3.776 -7.810 -12.081 57 HG3 LYS 8 3HG LYS 8 2.699 -6.834 -13.060 58 HD2 LYS 8 2HD LYS 8 4.648 -8.765 -14.368 59 HD3 LYS 8 3HD LYS 8 3.113 -9.336 -13.746 60 HE2 LYS 8 2HE LYS 8 2.474 -8.814 -15.922 61 HE3 LYS 8 3HE LYS 8 2.129 -7.280 -15.145 62 HZ1 LYS 8 2HZ LYS 8 4.859 -7.450 -16.007 63 HZ3 LYS 8 1HZ LYS 8 3.757 -6.297 -16.333 64 H ILE 9 HN ILE 9 6.942 -4.675 -11.625 65 HA ILE 9 HA ILE 9 8.695 -3.919 -13.737 66 HB ILE 9 HB ILE 9 8.153 -2.836 -10.977 67 HG12 ILE 9 2HG1 ILE 9 7.541 -1.480 -13.591 68 HG13 ILE 9 3HG1 ILE 9 6.470 -2.727 -12.983 69 HG21 ILE 9 1HG2 ILE 9 9.449 -0.883 -12.558 70 HG22 ILE 9 2HG2 ILE 9 10.026 -1.655 -11.061 71 HG23 ILE 9 3HG2 ILE 9 10.441 -2.359 -12.644 72 HD11 ILE 9 3HD1 ILE 9 5.875 -0.349 -12.276 73 HD12 ILE 9 1HD1 ILE 9 6.052 -1.506 -10.935 74 HD13 ILE 9 2HD1 ILE 9 7.358 -0.351 -11.291 75 H PHE 10 HN PHE 10 8.936 -5.770 -10.729 76 HA PHE 10 HA PHE 10 11.725 -5.536 -10.432 77 HB2 PHE 10 2HB PHE 10 10.443 -6.307 -8.552 78 HB3 PHE 10 3HB PHE 10 9.455 -7.360 -9.545 79 HD1 PHE 10 HD1 PHE 10 12.864 -6.983 -8.131 80 HD2 PHE 10 HD2 PHE 10 9.988 -9.636 -9.774 81 HE1 PHE 10 HE1 PHE 10 14.297 -8.939 -7.482 82 HE2 PHE 10 HE2 PHE 10 11.420 -11.592 -9.125 83 HZ PHE 10 HZ PHE 10 13.559 -11.220 -7.987 84 H ILE 11 HN ILE 11 9.681 -7.360 -12.618 85 HA ILE 11 HA ILE 11 11.725 -9.339 -13.131 86 HB ILE 11 HB ILE 11 8.968 -8.834 -14.236 87 HG12 ILE 11 2HG1 ILE 11 10.013 -11.184 -12.640 88 HG13 ILE 11 3HG1 ILE 11 9.280 -9.775 -11.899 89 HG21 ILE 11 1HG2 ILE 11 10.721 -11.190 -14.947 90 HG22 ILE 11 2HG2 ILE 11 9.157 -10.713 -15.651 91 HG23 ILE 11 3HG2 ILE 11 10.609 -9.729 -15.957 92 HD11 ILE 11 3HD1 ILE 11 7.645 -10.760 -14.127 93 HD12 ILE 11 1HD1 ILE 11 7.925 -12.024 -12.906 94 HD13 ILE 11 2HD1 ILE 11 7.187 -10.475 -12.431 95 H MET 12 HN MET 12 9.920 -6.905 -15.146 96 HA MET 12 HA MET 12 11.557 -7.055 -17.309 97 HB2 MET 12 2HB MET 12 9.758 -4.958 -16.085 98 HB3 MET 12 3HB MET 12 10.802 -4.428 -17.388 99 HG2 MET 12 2HG MET 12 8.783 -5.120 -18.471 100 HG3 MET 12 3HG MET 12 9.909 -6.433 -18.752 101 HE1 MET 12 3HE MET 12 6.180 -7.732 -18.153 102 HE2 MET 12 1HE MET 12 7.077 -6.606 -19.200 103 HE3 MET 12 2HE MET 12 7.591 -8.306 -19.075 104 H LYS 13 HN LYS 13 12.259 -5.741 -14.161 105 HA LYS 13 HA LYS 13 14.566 -4.300 -15.258 106 HB2 LYS 13 2HB LYS 13 13.153 -4.015 -12.590 107 HB3 LYS 13 3HB LYS 13 14.607 -3.152 -13.049 108 HG2 LYS 13 2HG LYS 13 13.271 -2.352 -15.138 109 HG3 LYS 13 3HG LYS 13 11.845 -2.946 -14.312 110 HD2 LYS 13 2HD LYS 13 12.701 -1.505 -12.278 111 HD3 LYS 13 3HD LYS 13 13.712 -0.706 -13.465 112 HE2 LYS 13 2HE LYS 13 10.785 -1.043 -14.115 113 HE3 LYS 13 3HE LYS 13 11.222 0.160 -12.918 114 HZ1 LYS 13 2HZ LYS 13 11.406 1.346 -14.883 115 HZ3 LYS 13 1HZ LYS 13 11.945 0.088 -15.765 116 H CYS 14 HN CYS 14 13.464 -6.723 -12.831 117 HA CYS 14 HA CYS 14 16.242 -7.646 -12.750 118 HB2 CYS 14 2HB CYS 14 14.548 -8.159 -10.375 119 HB3 CYS 14 3HB CYS 14 16.271 -7.859 -10.496 120 H SER 15 HN SER 15 15.439 -9.001 -14.613 121 HA SER 15 HA SER 15 13.752 -11.166 -13.626 122 HB2 SER 15 2HB SER 15 12.489 -10.349 -15.392 123 HB3 SER 15 3HB SER 15 13.885 -9.737 -16.256 124 HG SER 15 HG SER 15 12.565 -12.013 -16.724 125 H GLN 16 HN GLN 16 14.339 -13.369 -14.341 126 HA GLN 16 HA GLN 16 15.844 -14.954 -14.408 127 HB2 GLN 16 2HB GLN 16 16.566 -13.302 -16.853 128 HB3 GLN 16 3HB GLN 16 17.355 -14.831 -16.524 129 HG2 GLN 16 2HG GLN 16 15.142 -15.979 -16.482 130 HG3 GLN 16 3HG GLN 16 14.332 -14.452 -16.767 131 HE21 GLN 16 1HE2 GLN 16 15.881 -17.137 -18.128 132 HE22 GLN 16 2HE2 GLN 16 15.910 -16.651 -19.791 133 H CYS 17 HN CYS 17 16.556 -12.759 -12.624 134 HA CYS 17 HA CYS 17 19.435 -13.201 -12.620 135 HB2 CYS 17 2HB CYS 17 18.052 -10.567 -12.756 136 HB3 CYS 17 3HB CYS 17 19.429 -10.698 -11.681 137 H HIS 18 HN HIS 18 16.694 -11.566 -10.856 138 HA HIS 18 HA HIS 18 17.748 -12.736 -8.397 139 HB2 HIS 18 2HB HIS 18 16.017 -10.338 -8.981 140 HB3 HIS 18 3HB HIS 18 16.056 -11.051 -7.380 141 HD1 HIS 18 HD1 HIS 18 18.626 -11.260 -6.324 142 HD2 HIS 18 HD2 HIS 18 17.996 -8.496 -9.417 143 HE1 HIS 18 HE1 HIS 18 20.576 -9.618 -6.224 144 H THR 19 HN THR 19 16.649 -14.334 -7.334 145 HA THR 19 HA THR 19 14.179 -15.248 -8.588 146 HB THR 19 HB THR 19 14.692 -17.249 -7.028 147 HG1 THR 19 HG1 THR 19 16.524 -16.963 -5.772 148 HG21 THR 19 1HG2 THR 19 16.016 -18.161 -8.671 149 HG22 THR 19 2HG2 THR 19 15.830 -16.599 -9.505 150 HG23 THR 19 3HG2 THR 19 17.253 -16.894 -8.477 151 H VAL 20 HN VAL 20 15.378 -13.680 -5.652 152 HA VAL 20 HA VAL 20 14.355 -13.072 -3.772 153 HB VAL 20 HB VAL 20 12.247 -11.858 -4.117 154 HG11 VAL 20 1HG1 VAL 20 14.419 -11.457 -6.194 155 HG12 VAL 20 2HG1 VAL 20 13.099 -10.297 -5.912 156 HG13 VAL 20 3HG1 VAL 20 14.257 -10.661 -4.610 157 HG21 VAL 20 3HG2 VAL 20 12.347 -12.832 -6.989 158 HG22 VAL 20 1HG2 VAL 20 11.272 -13.513 -5.743 159 HG23 VAL 20 2HG2 VAL 20 11.107 -11.807 -6.227 160 H GLU 21 HN GLU 21 14.187 -15.952 -4.487 161 HA GLU 21 HA GLU 21 11.569 -16.624 -3.454 162 HB2 GLU 21 2HB GLU 21 13.800 -18.335 -4.632 163 HB3 GLU 21 3HB GLU 21 12.300 -18.994 -4.011 164 HG2 GLU 21 2HG GLU 21 11.240 -17.124 -5.655 165 HG3 GLU 21 3HG GLU 21 12.771 -17.339 -6.482 166 HE2 GLU 21 HE2 GLU 21 12.224 -18.744 -8.159 167 H LYS 22 HN LYS 22 11.970 -18.958 -2.056 168 HA LYS 22 HA LYS 22 13.593 -18.011 0.194 169 HB2 LYS 22 2HB LYS 22 12.138 -19.275 1.624 170 HB3 LYS 22 3HB LYS 22 11.156 -18.267 0.581 171 HG2 LYS 22 2HG LYS 22 10.713 -20.190 -0.920 172 HG3 LYS 22 3HG LYS 22 11.777 -21.207 0.029 173 HD2 LYS 22 2HD LYS 22 10.263 -20.726 2.049 174 HD3 LYS 22 3HD LYS 22 9.147 -19.957 0.938 175 HE2 LYS 22 2HE LYS 22 8.758 -22.015 -0.263 176 HE3 LYS 22 3HE LYS 22 10.140 -22.799 0.477 177 HZ1 LYS 22 2HZ LYS 22 7.681 -21.964 1.922 178 HZ3 LYS 22 1HZ LYS 22 8.972 -22.659 2.631 179 H GLY 23 HN GLY 23 13.207 -20.484 -2.268 180 HA2 GLY 23 1HA GLY 23 15.574 -21.853 -1.165 181 HA3 GLY 23 2HA GLY 23 14.154 -22.774 -1.616 182 H GLY 24 HN GLY 24 14.579 -19.910 -3.528 183 HA2 GLY 24 1HA GLY 24 14.929 -21.379 -5.919 184 HA3 GLY 24 2HA GLY 24 15.014 -19.640 -5.720 185 H LYS 25 HN LYS 25 16.751 -21.945 -7.059 186 HA LYS 25 HA LYS 25 19.205 -22.075 -5.839 187 HB2 LYS 25 2HB LYS 25 20.017 -22.879 -7.884 188 HB3 LYS 25 3HB LYS 25 18.322 -23.323 -7.881 189 HG2 LYS 25 2HG LYS 25 19.319 -20.745 -9.167 190 HG3 LYS 25 3HG LYS 25 19.243 -22.258 -10.049 191 HD2 LYS 25 2HD LYS 25 16.881 -20.879 -8.687 192 HD3 LYS 25 3HD LYS 25 17.194 -20.894 -10.411 193 HE2 LYS 25 2HE LYS 25 17.232 -23.564 -10.012 194 HE3 LYS 25 3HE LYS 25 16.242 -23.134 -8.632 195 HZ1 LYS 25 2HZ LYS 25 15.651 -22.315 -11.428 196 HZ3 LYS 25 1HZ LYS 25 14.713 -21.993 -10.136 197 H HIS 26 HN HIS 26 21.282 -21.022 -7.027 198 HA HIS 26 HA HIS 26 20.823 -18.159 -6.739 199 HB2 HIS 26 2HB HIS 26 23.315 -19.864 -6.537 200 HB3 HIS 26 3HB HIS 26 23.350 -18.112 -6.529 201 HD1 HIS 26 HD1 HIS 26 22.716 -16.909 -4.355 202 HD2 HIS 26 HD2 HIS 26 22.069 -21.051 -4.216 203 HE1 HIS 26 HE1 HIS 26 22.211 -17.472 -1.918 204 H LYS 27 HN LYS 27 19.817 -18.030 -8.904 205 HA LYS 27 HA LYS 27 21.242 -18.793 -11.202 206 HB2 LYS 27 2HB LYS 27 18.771 -17.332 -10.542 207 HB3 LYS 27 3HB LYS 27 19.536 -16.799 -12.024 208 HG2 LYS 27 2HG LYS 27 19.763 -19.507 -12.348 209 HG3 LYS 27 3HG LYS 27 18.315 -19.454 -11.362 210 HD2 LYS 27 2HD LYS 27 17.502 -19.323 -13.596 211 HD3 LYS 27 3HD LYS 27 17.423 -17.671 -13.014 212 HE2 LYS 27 2HE LYS 27 19.145 -16.945 -14.389 213 HE3 LYS 27 3HE LYS 27 20.008 -18.468 -14.300 214 HZ1 LYS 27 2HZ LYS 27 17.531 -18.019 -15.880 215 HZ3 LYS 27 1HZ LYS 27 18.331 -19.435 -15.796 216 H THR 28 HN THR 28 21.267 -16.524 -12.864 217 HA THR 28 HA THR 28 23.744 -15.532 -12.605 218 HB THR 28 HB THR 28 22.599 -13.433 -13.790 219 HG1 THR 28 HG1 THR 28 20.402 -14.259 -14.478 220 HG21 THR 28 1HG2 THR 28 22.033 -16.187 -14.987 221 HG22 THR 28 2HG2 THR 28 22.363 -14.669 -15.856 222 HG23 THR 28 3HG2 THR 28 23.668 -15.486 -14.961 223 H GLY 29 HN GLY 29 20.890 -14.494 -10.741 224 HA2 GLY 29 1HA GLY 29 22.640 -12.584 -9.312 225 HA3 GLY 29 2HA GLY 29 20.911 -12.396 -9.523 226 HA PRO 30 HA PRO 30 21.942 -14.927 -5.729 227 HB2 PRO 30 2HB PRO 30 22.253 -13.045 -3.771 228 HB3 PRO 30 3HB PRO 30 23.602 -13.815 -4.584 229 HG2 PRO 30 2HG PRO 30 22.539 -11.079 -4.942 230 HG3 PRO 30 3HG PRO 30 24.103 -11.719 -5.407 231 HD2 PRO 30 2HD PRO 30 21.873 -11.208 -7.137 232 HD3 PRO 30 3HD PRO 30 23.395 -11.955 -7.581 233 H ASN 31 HN ASN 31 20.509 -15.551 -4.039 234 HA ASN 31 HA ASN 31 17.905 -14.688 -4.681 235 HB2 ASN 31 2HB ASN 31 18.793 -17.002 -3.718 236 HB3 ASN 31 3HB ASN 31 18.622 -16.226 -2.157 237 HD21 ASN 31 1HD2 ASN 31 17.196 -18.478 -3.425 238 HD22 ASN 31 2HD2 ASN 31 15.506 -18.098 -3.363 239 H LEU 32 HN LEU 32 16.349 -13.865 -2.898 240 HA LEU 32 HA LEU 32 17.762 -12.286 -0.876 241 HB2 LEU 32 2HB LEU 32 15.451 -11.150 -2.420 242 HB3 LEU 32 3HB LEU 32 16.594 -10.325 -1.378 243 HG LEU 32 HG LEU 32 18.346 -11.118 -3.200 244 HD11 LEU 32 1HD1 LEU 32 17.491 -12.124 -4.982 245 HD12 LEU 32 2HD1 LEU 32 15.833 -11.873 -4.387 246 HD13 LEU 32 3HD1 LEU 32 16.624 -10.620 -5.373 247 HD21 LEU 32 3HD2 LEU 32 18.131 -8.970 -4.291 248 HD22 LEU 32 1HD2 LEU 32 16.462 -8.797 -3.696 249 HD23 LEU 32 2HD2 LEU 32 17.821 -8.793 -2.547 250 H HIS 33 HN HIS 33 17.159 -13.370 0.947 251 HA HIS 33 HA HIS 33 14.293 -13.935 1.191 252 HB2 HIS 33 2HB HIS 33 15.522 -15.988 1.160 253 HB3 HIS 33 3HB HIS 33 16.702 -15.386 2.306 254 HD1 HIS 33 HD1 HIS 33 13.718 -17.411 2.143 255 HD2 HIS 33 HD2 HIS 33 15.391 -14.806 4.973 256 HE1 HIS 33 HE1 HIS 33 12.617 -17.977 4.375 257 H GLY 34 HN GLY 34 17.275 -13.122 3.106 258 HA2 GLY 34 1HA GLY 34 15.550 -11.766 5.067 259 HA3 GLY 34 2HA GLY 34 17.199 -12.304 5.315 260 H LEU 35 HN LEU 35 16.146 -10.639 2.330 261 HA LEU 35 HA LEU 35 18.170 -8.876 2.182 262 HB2 LEU 35 2HB LEU 35 16.749 -9.089 0.352 263 HB3 LEU 35 3HB LEU 35 15.310 -8.743 1.290 264 HG LEU 35 HG LEU 35 16.223 -6.371 1.568 265 HD11 LEU 35 1HD1 LEU 35 17.707 -5.958 -0.663 266 HD12 LEU 35 2HD1 LEU 35 18.383 -6.178 0.968 267 HD13 LEU 35 3HD1 LEU 35 18.309 -7.554 -0.158 268 HD21 LEU 35 3HD2 LEU 35 15.440 -7.359 -1.189 269 HD22 LEU 35 1HD2 LEU 35 14.339 -6.883 0.126 270 HD23 LEU 35 2HD2 LEU 35 15.388 -5.666 -0.640 271 H PHE 36 HN PHE 36 14.919 -7.705 3.279 272 HA PHE 36 HA PHE 36 16.022 -5.471 4.552 273 HB2 PHE 36 2HB PHE 36 13.388 -7.039 4.732 274 HB3 PHE 36 3HB PHE 36 13.616 -5.546 5.620 275 HD1 PHE 36 HD1 PHE 36 13.248 -7.020 2.281 276 HD2 PHE 36 HD2 PHE 36 13.618 -3.415 4.489 277 HE1 PHE 36 HE1 PHE 36 12.521 -5.710 0.267 278 HE2 PHE 36 HE2 PHE 36 12.892 -2.106 2.474 279 HZ PHE 36 HZ PHE 36 12.352 -3.270 0.387 280 H GLY 37 HN GLY 37 17.263 -5.445 6.362 281 HA2 GLY 37 1HA GLY 37 17.440 -5.696 8.683 282 HA3 GLY 37 2HA GLY 37 16.425 -7.123 8.621 283 H ARG 38 HN ARG 38 19.051 -6.587 6.265 284 HA ARG 38 HA ARG 38 20.772 -8.327 7.777 285 HB2 ARG 38 2HB ARG 38 19.411 -9.872 6.370 286 HB3 ARG 38 3HB ARG 38 19.838 -8.966 4.933 287 HG2 ARG 38 2HG ARG 38 22.186 -9.580 5.139 288 HG3 ARG 38 3HG ARG 38 21.933 -10.254 6.737 289 HD2 ARG 38 2HD ARG 38 22.029 -12.116 5.185 290 HD3 ARG 38 3HD ARG 38 20.362 -11.967 5.705 291 HE ARG 38 HE ARG 38 20.710 -10.369 3.358 292 HH11 ARG 38 2HH2 ARG 38 20.640 -13.782 4.310 293 HH12 ARG 38 1HH2 ARG 38 20.092 -14.330 2.761 294 HH22 ARG 38 HH1 ARG 38 19.716 -12.733 1.015 295 H LYS 39 HN LYS 39 23.033 -8.301 6.927 296 HA LYS 39 HA LYS 39 23.617 -5.745 5.741 297 HB2 LYS 39 2HB LYS 39 25.126 -7.877 7.177 298 HB3 LYS 39 3HB LYS 39 26.032 -6.881 6.056 299 HG2 LYS 39 2HG LYS 39 25.552 -4.877 7.238 300 HG3 LYS 39 3HG LYS 39 24.153 -5.565 8.038 301 HD2 LYS 39 2HD LYS 39 26.950 -6.651 8.547 302 HD3 LYS 39 3HD LYS 39 26.343 -5.264 9.430 303 HE2 LYS 39 2HE LYS 39 24.586 -6.524 10.452 304 HE3 LYS 39 3HE LYS 39 24.704 -7.818 9.276 305 HZ1 LYS 39 2HZ LYS 39 26.655 -8.615 10.269 306 HZ3 LYS 39 1HZ LYS 39 25.790 -8.158 11.572 307 H THR 40 HN THR 40 25.560 -5.829 4.037 308 HA THR 40 HA THR 40 24.471 -7.332 1.809 309 HB THR 40 HB THR 40 25.921 -5.840 0.503 310 HG1 THR 40 HG1 THR 40 27.794 -5.319 1.555 311 HG21 THR 40 1HG2 THR 40 25.333 -3.580 1.421 312 HG22 THR 40 2HG2 THR 40 23.924 -4.669 1.427 313 HG23 THR 40 3HG2 THR 40 24.809 -4.350 2.938 314 H GLY 41 HN GLY 41 25.630 -8.800 0.496 315 HA2 GLY 41 1HA GLY 41 27.047 -10.500 0.108 316 HA3 GLY 41 2HA GLY 41 28.265 -9.617 1.007 317 H GLN 42 HN GLN 42 25.059 -10.938 2.079 318 HA GLN 42 HA GLN 42 26.492 -12.244 4.231 319 HB2 GLN 42 2HB GLN 42 23.574 -11.511 3.802 320 HB3 GLN 42 3HB GLN 42 24.065 -12.589 5.092 321 HG2 GLN 42 2HG GLN 42 25.007 -9.715 4.678 322 HG3 GLN 42 3HG GLN 42 23.942 -10.287 5.946 323 HE21 GLN 42 1HE2 GLN 42 27.115 -9.691 5.000 324 HE22 GLN 42 2HE2 GLN 42 27.968 -10.429 6.314 325 H ALA 43 HN ALA 43 24.423 -12.864 1.386 326 HA ALA 43 HA ALA 43 23.546 -15.365 1.715 327 HB1 ALA 43 3HB ALA 43 24.808 -13.970 -0.654 328 HB2 ALA 43 1HB ALA 43 24.173 -15.626 -0.796 329 HB3 ALA 43 2HB ALA 43 23.088 -14.294 -0.331 330 HA PRO 44 HA PRO 44 27.391 -17.355 2.658 331 HB2 PRO 44 2HB PRO 44 26.326 -19.399 4.126 332 HB3 PRO 44 3HB PRO 44 26.808 -17.866 4.825 333 HG2 PRO 44 2HG PRO 44 24.085 -18.869 4.257 334 HG3 PRO 44 3HG PRO 44 24.575 -17.563 5.319 335 HD2 PRO 44 2HD PRO 44 23.415 -17.308 2.708 336 HD3 PRO 44 3HD PRO 44 24.011 -16.009 3.721 337 H GLY 45 HN GLY 45 24.937 -18.035 0.626 338 HA2 GLY 45 1HA GLY 45 25.975 -20.684 -0.095 339 HA3 GLY 45 2HA GLY 45 24.480 -19.949 -0.638 340 H TYR 46 HN TYR 46 25.993 -17.278 -1.061 341 HA TYR 46 HA TYR 46 27.815 -17.929 -3.202 342 HB2 TYR 46 2HB TYR 46 25.448 -18.081 -4.152 343 HB3 TYR 46 3HB TYR 46 25.123 -16.465 -3.555 344 HD1 TYR 46 HD1 TYR 46 28.179 -17.739 -5.302 345 HD2 TYR 46 HD2 TYR 46 24.744 -15.195 -5.488 346 HE1 TYR 46 HE1 TYR 46 29.016 -16.755 -7.492 347 HE2 TYR 46 HE2 TYR 46 25.594 -14.219 -7.676 348 HH TYR 46 HH TYR 46 27.799 -15.634 -9.542 349 H SER 47 HN SER 47 29.481 -16.585 -2.722 350 HA SER 47 HA SER 47 28.992 -14.183 -1.309 351 HB2 SER 47 2HB SER 47 31.529 -13.871 -1.762 352 HB3 SER 47 3HB SER 47 31.037 -15.226 -0.766 353 HG SER 47 HG SER 47 31.985 -16.514 -2.175 354 H TYR 48 HN TYR 48 29.140 -12.018 -2.074 355 HA TYR 48 HA TYR 48 28.776 -11.769 -4.947 356 HB2 TYR 48 2HB TYR 48 28.746 -9.682 -2.688 357 HB3 TYR 48 3HB TYR 48 27.963 -9.529 -4.248 358 HD1 TYR 48 HD2 TYR 48 27.118 -12.695 -3.839 359 HD2 TYR 48 HD1 TYR 48 26.477 -9.003 -1.775 360 HE1 TYR 48 HE2 TYR 48 24.966 -13.616 -2.845 361 HE2 TYR 48 HE1 TYR 48 24.328 -9.936 -0.789 362 HH TYR 48 HH TYR 48 23.336 -12.026 -0.295 363 H THR 49 HN THR 49 29.683 -9.347 -5.641 364 HA THR 49 HA THR 49 32.400 -9.707 -6.025 365 HB THR 49 HB THR 49 32.200 -7.171 -6.628 366 HG1 THR 49 HG1 THR 49 29.777 -6.684 -6.658 367 HG21 THR 49 1HG2 THR 49 29.869 -8.540 -7.916 368 HG22 THR 49 2HG2 THR 49 31.256 -7.719 -8.673 369 HG23 THR 49 3HG2 THR 49 31.428 -9.385 -8.067 370 H ALA 50 HN ALA 50 34.056 -7.851 -5.403 371 HA ALA 50 HA ALA 50 34.313 -8.098 -2.557 372 HB1 ALA 50 3HB ALA 50 35.980 -7.342 -4.892 373 HB2 ALA 50 1HB ALA 50 36.377 -6.499 -3.375 374 HB3 ALA 50 2HB ALA 50 36.403 -8.277 -3.438 375 H ALA 51 HN ALA 51 32.855 -5.883 -4.774 376 HA ALA 51 HA ALA 51 33.266 -3.561 -3.121 377 HB1 ALA 51 3HB ALA 51 33.165 -3.261 -5.512 378 HB2 ALA 51 1HB ALA 51 31.617 -4.135 -5.611 379 HB3 ALA 51 2HB ALA 51 31.690 -2.543 -4.818 380 H ASN 52 HN ASN 52 30.395 -5.530 -4.187 381 HA ASN 52 HA ASN 52 28.613 -4.324 -2.506 382 HB2 ASN 52 2HB ASN 52 28.299 -6.126 -4.417 383 HB3 ASN 52 3HB ASN 52 28.491 -7.303 -3.133 384 HD21 ASN 52 1HD2 ASN 52 27.140 -6.915 -1.153 385 HD22 ASN 52 2HD2 ASN 52 25.491 -6.434 -1.378 386 H LYS 53 HN LYS 53 30.914 -7.049 -2.020 387 HA LYS 53 HA LYS 53 29.902 -7.877 0.473 388 HB2 LYS 53 2HB LYS 53 31.358 -9.196 -1.115 389 HB3 LYS 53 3HB LYS 53 32.716 -8.218 -0.594 390 HG2 LYS 53 2HG LYS 53 31.875 -8.906 1.851 391 HG3 LYS 53 3HG LYS 53 31.105 -10.226 0.993 392 HD2 LYS 53 2HD LYS 53 33.450 -10.592 -0.129 393 HD3 LYS 53 3HD LYS 53 34.069 -9.573 1.156 394 HE2 LYS 53 2HE LYS 53 34.149 -12.057 1.673 395 HE3 LYS 53 3HE LYS 53 33.298 -11.103 2.873 396 HZ1 LYS 53 2HZ LYS 53 31.239 -11.889 2.117 397 HZ3 LYS 53 1HZ LYS 53 32.166 -13.221 1.977 398 H ASN 54 HN ASN 54 32.102 -5.295 -0.586 399 HA ASN 54 HA ASN 54 32.910 -4.815 2.126 400 HB2 ASN 54 2HB ASN 54 33.581 -3.599 -0.581 401 HB3 ASN 54 3HB ASN 54 34.025 -2.746 0.884 402 HD21 ASN 54 1HD2 ASN 54 33.841 -6.242 0.402 403 HD22 ASN 54 2HD2 ASN 54 35.521 -6.596 0.631 404 H LYS 55 HN LYS 55 30.040 -4.473 0.853 405 HA LYS 55 HA LYS 55 29.690 -1.618 1.402 406 HB2 LYS 55 2HB LYS 55 28.945 -2.663 -0.808 407 HB3 LYS 55 3HB LYS 55 27.698 -3.488 0.104 408 HG2 LYS 55 2HG LYS 55 26.616 -1.506 -0.603 409 HG3 LYS 55 3HG LYS 55 27.077 -1.136 1.047 410 HD2 LYS 55 2HD LYS 55 29.327 -0.264 -0.166 411 HD3 LYS 55 3HD LYS 55 28.239 -0.095 -1.530 412 HE2 LYS 55 2HE LYS 55 27.916 1.984 -0.545 413 HE3 LYS 55 3HE LYS 55 26.661 1.087 0.287 414 HZ1 LYS 55 2HZ LYS 55 28.859 2.351 1.443 415 HZ3 LYS 55 1HZ LYS 55 29.092 0.758 1.682 416 H GLY 56 HN GLY 56 30.275 -3.002 3.672 417 HA2 GLY 56 1HA GLY 56 28.214 -4.321 4.983 418 HA3 GLY 56 2HA GLY 56 29.506 -3.414 5.742 419 H ILE 57 HN ILE 57 26.193 -3.220 4.393 420 HA ILE 57 HA ILE 57 25.622 -1.100 6.267 421 HB ILE 57 HB ILE 57 24.713 0.413 4.621 422 HG12 ILE 57 2HG1 ILE 57 25.580 -0.149 2.152 423 HG13 ILE 57 3HG1 ILE 57 25.383 -1.794 2.725 424 HG21 ILE 57 1HG2 ILE 57 26.760 1.304 3.758 425 HG22 ILE 57 2HG2 ILE 57 27.094 0.593 5.354 426 HG23 ILE 57 3HG2 ILE 57 27.564 -0.279 3.876 427 HD11 ILE 57 3HD1 ILE 57 23.349 -0.243 1.689 428 HD12 ILE 57 1HD1 ILE 57 23.101 -1.647 2.754 429 HD13 ILE 57 2HD1 ILE 57 23.123 -0.004 3.438 430 H ILE 58 HN ILE 58 23.501 -1.186 6.986 431 HA ILE 58 HA ILE 58 22.092 -3.565 6.349 432 HB ILE 58 HB ILE 58 21.375 -1.158 8.025 433 HG12 ILE 58 2HG1 ILE 58 23.392 -2.641 8.636 434 HG13 ILE 58 3HG1 ILE 58 22.200 -2.298 9.874 435 HG21 ILE 58 1HG2 ILE 58 19.337 -2.242 7.314 436 HG22 ILE 58 2HG2 ILE 58 19.980 -3.836 7.774 437 HG23 ILE 58 3HG2 ILE 58 19.645 -2.616 9.026 438 HD11 ILE 58 3HD1 ILE 58 21.123 -4.474 9.531 439 HD12 ILE 58 1HD1 ILE 58 22.187 -4.815 8.145 440 HD13 ILE 58 2HD1 ILE 58 22.866 -4.721 9.788 441 H TRP 59 HN TRP 59 20.334 -3.904 5.023 442 HA TRP 59 HA TRP 59 19.877 -1.911 3.027 443 HB2 TRP 59 2HB TRP 59 18.873 -4.696 3.535 444 HB3 TRP 59 3HB TRP 59 18.122 -3.684 2.318 445 HD1 TRP 59 HD1 TRP 59 20.631 -6.264 2.428 446 HE1 TRP 59 HE1 TRP 59 22.383 -6.209 0.456 447 HE3 TRP 59 HE3 TRP 59 19.608 -1.507 0.954 448 HZ2 TRP 59 HZ2 TRP 59 23.127 -4.227 -1.457 449 HZ3 TRP 59 HZ3 TRP 59 20.893 -0.588 -0.973 450 HH2 TRP 59 HH2 TRP 59 22.600 -1.865 -2.168 451 H GLY 60 HN GLY 60 17.539 -1.257 2.478 452 HA2 GLY 60 1HA GLY 60 15.418 -1.404 4.229 453 HA3 GLY 60 2HA GLY 60 16.370 -0.037 4.774 454 H GLU 61 HN GLU 61 13.922 0.666 3.966 455 HA GLU 61 HA GLU 61 13.548 0.989 1.249 456 HB2 GLU 61 2HB GLU 61 12.480 2.528 3.650 457 HB3 GLU 61 3HB GLU 61 11.939 2.850 2.014 458 HG2 GLU 61 2HG GLU 61 11.388 0.339 1.827 459 HG3 GLU 61 3HG GLU 61 11.686 0.228 3.550 460 HE2 GLU 61 HE2 GLU 61 10.437 2.353 4.584 461 H ASP 62 HN ASP 62 15.427 2.840 3.630 462 HA ASP 62 HA ASP 62 15.649 5.149 2.050 463 HB2 ASP 62 2HB ASP 62 17.305 4.022 4.349 464 HB3 ASP 62 3HB ASP 62 17.667 5.571 3.611 465 HD2 ASP 62 HD2 ASP 62 16.131 7.315 5.371 466 H THR 63 HN THR 63 18.105 2.623 3.026 467 HA THR 63 HA THR 63 20.056 3.349 1.199 468 HB THR 63 HB THR 63 21.005 1.155 1.781 469 HG1 THR 63 HG1 THR 63 18.328 0.683 2.877 470 HG21 THR 63 1HG2 THR 63 19.974 2.946 3.775 471 HG22 THR 63 2HG2 THR 63 19.609 1.294 4.324 472 HG23 THR 63 3HG2 THR 63 21.288 1.760 3.964 473 H LEU 64 HN LEU 64 17.066 1.518 0.732 474 HA LEU 64 HA LEU 64 17.904 0.429 -1.770 475 HB2 LEU 64 2HB LEU 64 15.285 0.599 -0.297 476 HB3 LEU 64 3HB LEU 64 15.387 -0.036 -1.928 477 HG LEU 64 HG LEU 64 17.134 -1.164 0.250 478 HD11 LEU 64 1HD1 LEU 64 14.270 -1.200 0.269 479 HD12 LEU 64 2HD1 LEU 64 14.871 -2.843 -0.061 480 HD13 LEU 64 3HD1 LEU 64 15.415 -1.972 1.393 481 HD21 LEU 64 3HD2 LEU 64 15.908 -2.723 -1.994 482 HD22 LEU 64 1HD2 LEU 64 17.281 -1.642 -2.328 483 HD23 LEU 64 2HD2 LEU 64 17.454 -2.959 -1.144 484 H MET 65 HN MET 65 15.837 3.191 -0.680 485 HA MET 65 HA MET 65 14.888 4.033 -3.035 486 HB2 MET 65 2HB MET 65 15.818 5.373 -0.499 487 HB3 MET 65 3HB MET 65 15.516 6.438 -1.857 488 HG2 MET 65 2HG MET 65 13.453 4.341 -1.106 489 HG3 MET 65 3HG MET 65 13.538 5.839 -0.202 490 HE1 MET 65 3HE MET 65 11.168 5.239 -3.815 491 HE2 MET 65 1HE MET 65 12.352 4.032 -3.260 492 HE3 MET 65 2HE MET 65 11.109 4.641 -2.140 493 H GLU 66 HN GLU 66 18.058 5.125 -1.607 494 HA GLU 66 HA GLU 66 18.780 6.513 -3.920 495 HB2 GLU 66 2HB GLU 66 19.714 7.008 -1.681 496 HB3 GLU 66 3HB GLU 66 20.494 5.439 -1.636 497 HG2 GLU 66 2HG GLU 66 22.291 6.330 -2.689 498 HG3 GLU 66 3HG GLU 66 21.297 6.618 -4.103 499 HE2 GLU 66 HE2 GLU 66 22.331 9.425 -1.526 500 H TYR 67 HN TYR 67 20.039 3.388 -2.531 501 HA TYR 67 HA TYR 67 21.761 2.631 -4.434 502 HB2 TYR 67 2HB TYR 67 21.175 1.301 -2.429 503 HB3 TYR 67 3HB TYR 67 19.512 1.141 -2.959 504 HD1 TYR 67 HD2 TYR 67 22.988 0.248 -4.053 505 HD2 TYR 67 HD1 TYR 67 18.847 -0.827 -4.016 506 HE1 TYR 67 HE2 TYR 67 23.547 -1.974 -5.156 507 HE2 TYR 67 HE1 TYR 67 19.421 -3.045 -5.119 508 HH TYR 67 HH TYR 67 22.414 -4.308 -5.175 509 H LEU 68 HN LEU 68 18.216 2.794 -4.752 510 HA LEU 68 HA LEU 68 18.222 1.302 -7.206 511 HB2 LEU 68 2HB LEU 68 16.146 2.795 -5.622 512 HB3 LEU 68 3HB LEU 68 15.806 2.183 -7.229 513 HG LEU 68 HG LEU 68 16.911 0.311 -5.158 514 HD11 LEU 68 1HD1 LEU 68 14.010 1.173 -5.338 515 HD12 LEU 68 2HD1 LEU 68 14.621 -0.216 -4.408 516 HD13 LEU 68 3HD1 LEU 68 15.121 1.436 -3.972 517 HD21 LEU 68 3HD2 LEU 68 16.750 -0.538 -7.401 518 HD22 LEU 68 1HD2 LEU 68 15.494 -1.312 -6.404 519 HD23 LEU 68 2HD2 LEU 68 15.056 -0.006 -7.532 520 H GLU 69 HN GLU 69 17.909 4.756 -6.180 521 HA GLU 69 HA GLU 69 17.394 5.853 -8.594 522 HB2 GLU 69 2HB GLU 69 17.422 7.145 -6.514 523 HB3 GLU 69 3HB GLU 69 19.149 6.912 -6.338 524 HG2 GLU 69 2HG GLU 69 19.662 8.335 -8.181 525 HG3 GLU 69 3HG GLU 69 18.043 8.220 -8.844 526 HE2 GLU 69 HE2 GLU 69 19.189 11.059 -6.611 527 H ASN 70 HN ASN 70 20.399 4.400 -7.421 528 HA ASN 70 HA ASN 70 21.433 4.309 -10.006 529 HB2 ASN 70 2HB ASN 70 22.386 6.525 -8.193 530 HB3 ASN 70 3HB ASN 70 23.614 5.675 -9.110 531 HD21 ASN 70 1HD2 ASN 70 22.321 8.420 -9.210 532 HD22 ASN 70 2HD2 ASN 70 21.901 8.669 -10.872 533 HA PRO 71 HA PRO 71 23.091 1.341 -7.031 534 HB2 PRO 71 2HB PRO 71 22.889 -0.869 -8.624 535 HB3 PRO 71 3HB PRO 71 21.618 -0.356 -7.531 536 HG2 PRO 71 2HG PRO 71 21.745 -0.109 -10.474 537 HG3 PRO 71 3HG PRO 71 20.347 -0.001 -9.423 538 HD2 PRO 71 2HD PRO 71 21.727 2.182 -10.671 539 HD3 PRO 71 3HD PRO 71 20.404 2.295 -9.528 540 H LYS 72 HN LYS 72 24.147 2.659 -9.854 541 HA LYS 72 HA LYS 72 26.563 1.056 -9.931 542 HB2 LYS 72 2HB LYS 72 25.255 1.827 -11.986 543 HB3 LYS 72 3HB LYS 72 25.864 3.438 -11.660 544 HG2 LYS 72 2HG LYS 72 27.503 2.610 -13.121 545 HG3 LYS 72 3HG LYS 72 28.228 2.273 -11.562 546 HD2 LYS 72 2HD LYS 72 28.474 0.229 -12.740 547 HD3 LYS 72 3HD LYS 72 27.084 -0.057 -11.711 548 HE2 LYS 72 2HE LYS 72 25.545 0.119 -13.504 549 HE3 LYS 72 3HE LYS 72 26.646 1.055 -14.494 550 HZ1 LYS 72 2HZ LYS 72 26.973 -0.970 -15.457 551 HZ3 LYS 72 1HZ LYS 72 26.527 -1.829 -14.148 552 H LYS 73 HN LYS 73 25.300 3.916 -8.432 553 HA LYS 73 HA LYS 73 27.994 4.975 -8.037 554 HB2 LYS 73 2HB LYS 73 25.223 6.123 -7.817 555 HB3 LYS 73 3HB LYS 73 26.543 6.863 -6.933 556 HG2 LYS 73 2HG LYS 73 26.092 7.777 -9.303 557 HG3 LYS 73 3HG LYS 73 27.757 7.380 -8.921 558 HD2 LYS 73 2HD LYS 73 27.617 5.263 -10.117 559 HD3 LYS 73 3HD LYS 73 25.879 5.406 -10.291 560 HE2 LYS 73 2HE LYS 73 27.627 7.603 -11.416 561 HE3 LYS 73 3HE LYS 73 27.521 6.087 -12.290 562 HZ1 LYS 73 2HZ LYS 73 24.966 6.458 -11.946 563 HZ3 LYS 73 1HZ LYS 73 25.730 7.257 -13.142 564 H TYR 74 HN TYR 74 25.406 3.166 -6.508 565 HA TYR 74 HA TYR 74 26.339 3.712 -3.837 566 HB2 TYR 74 2HB TYR 74 23.945 3.077 -4.901 567 HB3 TYR 74 3HB TYR 74 24.543 1.432 -4.813 568 HD1 TYR 74 HD2 TYR 74 25.382 0.612 -2.478 569 HD2 TYR 74 HD1 TYR 74 22.889 4.042 -3.044 570 HE1 TYR 74 HE2 TYR 74 24.633 0.477 -0.052 571 HE2 TYR 74 HE1 TYR 74 22.148 3.895 -0.616 572 HH TYR 74 HH TYR 74 23.628 2.568 1.639 573 H ILE 75 HN ILE 75 26.761 1.240 -6.377 574 HA ILE 75 HA ILE 75 28.802 0.021 -4.688 575 HB ILE 75 HB ILE 75 26.778 -1.642 -6.176 576 HG12 ILE 75 2HG1 ILE 75 26.737 -0.648 -3.328 577 HG13 ILE 75 3HG1 ILE 75 25.458 -0.604 -4.526 578 HG21 ILE 75 1HG2 ILE 75 28.748 -2.405 -4.005 579 HG22 ILE 75 2HG2 ILE 75 27.708 -3.489 -4.959 580 HG23 ILE 75 3HG2 ILE 75 29.037 -2.607 -5.750 581 HD11 ILE 75 3HD1 ILE 75 26.576 -3.080 -3.140 582 HD12 ILE 75 1HD1 ILE 75 24.947 -2.386 -2.958 583 HD13 ILE 75 2HD1 ILE 75 25.425 -3.145 -4.495 584 HA PRO 76 HA PRO 76 30.377 0.815 -8.782 585 HB2 PRO 76 2HB PRO 76 32.868 1.630 -8.005 586 HB3 PRO 76 3HB PRO 76 31.528 2.735 -8.239 587 HG2 PRO 76 2HG PRO 76 32.708 1.764 -5.709 588 HG3 PRO 76 3HG PRO 76 31.682 3.158 -5.978 589 HD2 PRO 76 2HD PRO 76 30.898 0.642 -4.844 590 HD3 PRO 76 3HD PRO 76 29.849 1.995 -5.219 591 H GLY 77 HN GLY 77 30.896 -0.825 -10.072 592 HA2 GLY 77 1HA GLY 77 32.378 -2.464 -10.768 593 HA3 GLY 77 2HA GLY 77 33.082 -2.540 -9.165 594 H THR 78 HN THR 78 29.549 -2.544 -9.731 595 HA THR 78 HA THR 78 29.475 -5.248 -8.598 596 HB THR 78 HB THR 78 28.252 -3.361 -7.451 597 HG1 THR 78 HG1 THR 78 26.514 -4.796 -7.187 598 HG21 THR 78 1HG2 THR 78 26.693 -3.368 -10.088 599 HG22 THR 78 2HG2 THR 78 26.079 -2.652 -8.577 600 HG23 THR 78 3HG2 THR 78 27.533 -1.981 -9.354 601 H LYS 79 HN LYS 79 27.655 -6.683 -9.428 602 HA LYS 79 HA LYS 79 28.010 -6.845 -12.282 603 HB2 LYS 79 2HB LYS 79 26.352 -8.696 -10.565 604 HB3 LYS 79 3HB LYS 79 27.141 -9.035 -12.093 605 HG2 LYS 79 2HG LYS 79 29.362 -8.408 -10.788 606 HG3 LYS 79 3HG LYS 79 28.397 -8.701 -9.354 607 HD2 LYS 79 2HD LYS 79 27.735 -10.958 -10.576 608 HD3 LYS 79 3HD LYS 79 29.162 -10.652 -11.547 609 HE2 LYS 79 2HE LYS 79 29.372 -10.482 -8.530 610 HE3 LYS 79 3HE LYS 79 29.343 -12.059 -9.293 611 HZ1 LYS 79 2HZ LYS 79 31.141 -10.509 -10.748 612 HZ3 LYS 79 1HZ LYS 79 31.503 -11.752 -9.762 613 H MET 80 HN MET 80 25.756 -5.472 -10.031 614 HA MET 80 HA MET 80 23.362 -5.809 -11.219 615 HB2 MET 80 2HB MET 80 24.600 -3.298 -9.967 616 HB3 MET 80 3HB MET 80 22.888 -3.441 -10.309 617 HG2 MET 80 2HG MET 80 24.303 -5.553 -8.640 618 HG3 MET 80 3HG MET 80 23.755 -4.061 -7.902 619 HE1 MET 80 3HE MET 80 21.549 -3.122 -8.053 620 HE2 MET 80 1HE MET 80 20.818 -3.526 -9.624 621 HE3 MET 80 2HE MET 80 20.031 -4.048 -8.115 622 H ILE 81 HN ILE 81 22.901 -5.698 -13.384 623 HA ILE 81 HA ILE 81 24.069 -3.457 -14.870 624 HB ILE 81 HB ILE 81 23.270 -6.243 -15.589 625 HG12 ILE 81 2HG1 ILE 81 25.660 -4.499 -16.255 626 HG13 ILE 81 3HG1 ILE 81 25.604 -5.750 -15.029 627 HG21 ILE 81 1HG2 ILE 81 23.734 -5.184 -18.041 628 HG22 ILE 81 2HG2 ILE 81 22.116 -5.465 -17.356 629 HG23 ILE 81 3HG2 ILE 81 22.852 -3.848 -17.267 630 HD11 ILE 81 3HD1 ILE 81 26.021 -6.012 -17.907 631 HD12 ILE 81 1HD1 ILE 81 26.258 -7.221 -16.623 632 HD13 ILE 81 2HD1 ILE 81 24.656 -7.019 -17.371 633 H PHE 82 HN PHE 82 22.605 -1.818 -14.276 634 HA PHE 82 HA PHE 82 20.271 -1.714 -15.813 635 HB2 PHE 82 2HB PHE 82 19.301 -3.234 -14.169 636 HB3 PHE 82 3HB PHE 82 20.124 -2.439 -12.842 637 HD1 PHE 82 HD2 PHE 82 17.465 -1.907 -15.383 638 HD2 PHE 82 HD1 PHE 82 19.041 -0.774 -11.609 639 HE1 PHE 82 HE2 PHE 82 15.420 -0.518 -14.944 640 HE2 PHE 82 HE1 PHE 82 16.996 0.614 -11.171 641 HZ PHE 82 HZ PHE 82 15.210 0.725 -12.845 642 H VAL 83 HN VAL 83 19.328 0.399 -15.779 643 HA VAL 83 HA VAL 83 21.044 2.342 -14.452 644 HB VAL 83 HB VAL 83 19.922 3.939 -15.960 645 HG11 VAL 83 1HG1 VAL 83 21.969 2.377 -16.537 646 HG12 VAL 83 2HG1 VAL 83 20.832 1.685 -17.718 647 HG13 VAL 83 3HG1 VAL 83 21.236 3.417 -17.781 648 HG21 VAL 83 3HG2 VAL 83 18.676 1.678 -17.486 649 HG22 VAL 83 1HG2 VAL 83 17.819 2.339 -16.072 650 HG23 VAL 83 2HG2 VAL 83 18.238 3.403 -17.436 651 H GLY 84 HN GLY 84 20.341 3.735 -12.851 652 HA2 GLY 84 1HA GLY 84 18.397 3.036 -11.097 653 HA3 GLY 84 2HA GLY 84 18.957 4.679 -11.337 654 H ILE 85 HN ILE 85 16.267 3.989 -10.573 655 HA ILE 85 HA ILE 85 14.693 4.255 -12.989 656 HB ILE 85 HB ILE 85 13.932 3.994 -10.079 657 HG12 ILE 85 2HG1 ILE 85 13.686 1.940 -12.289 658 HG13 ILE 85 3HG1 ILE 85 15.071 2.029 -11.219 659 HG21 ILE 85 1HG2 ILE 85 12.184 5.198 -11.176 660 HG22 ILE 85 2HG2 ILE 85 12.218 4.095 -12.573 661 HG23 ILE 85 3HG2 ILE 85 11.650 3.510 -10.991 662 HD11 ILE 85 3HD1 ILE 85 13.419 0.402 -10.365 663 HD12 ILE 85 1HD1 ILE 85 13.569 1.774 -9.242 664 HD13 ILE 85 2HD1 ILE 85 12.169 1.668 -10.337 665 H LYS 86 HN LYS 86 13.092 6.013 -13.231 666 HA LYS 86 HA LYS 86 14.261 8.505 -12.266 667 HB2 LYS 86 2HB LYS 86 12.407 7.834 -14.561 668 HB3 LYS 86 3HB LYS 86 12.724 9.481 -14.055 669 HG2 LYS 86 2HG LYS 86 15.283 8.690 -14.212 670 HG3 LYS 86 3HG LYS 86 14.617 7.478 -15.288 671 HD2 LYS 86 2HD LYS 86 13.691 9.175 -16.767 672 HD3 LYS 86 3HD LYS 86 14.031 10.453 -15.618 673 HE2 LYS 86 2HE LYS 86 16.053 8.809 -17.201 674 HE3 LYS 86 3HE LYS 86 15.756 10.531 -17.326 675 HZ1 LYS 86 2HZ LYS 86 17.443 10.674 -15.846 676 HZ3 LYS 86 1HZ LYS 86 17.343 9.118 -15.377 677 H LYS 87 HN LYS 87 11.110 6.742 -12.505 678 HA LYS 87 HA LYS 87 9.699 8.694 -11.036 679 HB2 LYS 87 2HB LYS 87 9.179 5.916 -12.018 680 HB3 LYS 87 3HB LYS 87 8.130 6.560 -10.771 681 HG2 LYS 87 2HG LYS 87 7.689 8.578 -12.188 682 HG3 LYS 87 3HG LYS 87 8.734 7.930 -13.436 683 HD2 LYS 87 2HD LYS 87 6.230 6.527 -12.386 684 HD3 LYS 87 3HD LYS 87 6.283 7.490 -13.850 685 HE2 LYS 87 2HE LYS 87 8.324 5.866 -14.463 686 HE3 LYS 87 3HE LYS 87 7.556 4.804 -13.300 687 HZ1 LYS 87 2HZ LYS 87 5.458 5.614 -14.803 688 HZ3 LYS 87 1HZ LYS 87 6.276 4.229 -15.061 689 H LYS 88 HN LYS 88 9.027 8.701 -8.839 690 HA LYS 88 HA LYS 88 10.935 7.355 -7.116 691 HB2 LYS 88 2HB LYS 88 8.823 9.263 -6.156 692 HB3 LYS 88 3HB LYS 88 10.425 8.961 -5.513 693 HG2 LYS 88 2HG LYS 88 11.258 9.875 -7.856 694 HG3 LYS 88 3HG LYS 88 9.649 10.558 -7.971 695 HD2 LYS 88 2HD LYS 88 11.470 11.005 -5.564 696 HD3 LYS 88 3HD LYS 88 11.431 12.087 -6.942 697 HE2 LYS 88 2HE LYS 88 8.960 11.361 -5.299 698 HE3 LYS 88 3HE LYS 88 9.938 12.785 -4.999 699 HZ1 LYS 88 2HZ LYS 88 8.007 13.205 -6.485 700 HZ3 LYS 88 1HZ LYS 88 8.646 12.220 -7.614 701 H GLU 89 HN GLU 89 7.433 7.456 -7.883 702 HA GLU 89 HA GLU 89 6.654 5.849 -5.750 703 HB2 GLU 89 2HB GLU 89 5.151 7.291 -7.183 704 HB3 GLU 89 3HB GLU 89 5.318 6.123 -8.478 705 HG2 GLU 89 2HG GLU 89 4.397 4.339 -6.954 706 HG3 GLU 89 3HG GLU 89 4.175 5.548 -5.704 707 HE2 GLU 89 HE2 GLU 89 1.656 5.383 -8.796 708 H GLU 90 HN GLU 90 7.542 5.102 -9.179 709 HA GLU 90 HA GLU 90 6.927 2.475 -9.225 710 HB2 GLU 90 2HB GLU 90 8.028 4.110 -11.004 711 HB3 GLU 90 3HB GLU 90 9.533 3.412 -10.440 712 HG2 GLU 90 2HG GLU 90 8.732 1.139 -10.978 713 HG3 GLU 90 3HG GLU 90 7.154 1.763 -11.415 714 HE2 GLU 90 HE2 GLU 90 7.736 1.297 -14.143 715 H ARG 91 HN ARG 91 9.494 4.095 -7.431 716 HA ARG 91 HA ARG 91 10.913 1.657 -7.000 717 HB2 ARG 91 2HB ARG 91 11.259 4.553 -6.263 718 HB3 ARG 91 3HB ARG 91 12.016 3.387 -5.196 719 HG2 ARG 91 2HG ARG 91 13.211 2.363 -7.121 720 HG3 ARG 91 3HG ARG 91 12.413 3.466 -8.225 721 HD2 ARG 91 2HD ARG 91 14.015 4.568 -5.892 722 HD3 ARG 91 3HD ARG 91 14.842 4.036 -7.342 723 HE ARG 91 HE ARG 91 12.883 5.648 -8.383 724 HH11 ARG 91 2HH2 ARG 91 15.225 6.163 -5.776 725 HH12 ARG 91 1HH2 ARG 91 15.313 7.873 -6.024 726 HH22 ARG 91 HH1 ARG 91 13.995 8.877 -7.756 727 H ALA 92 HN ALA 92 8.449 3.673 -5.424 728 HA ALA 92 HA ALA 92 8.746 2.630 -2.820 729 HB1 ALA 92 3HB ALA 92 7.589 4.638 -2.883 730 HB2 ALA 92 1HB ALA 92 6.692 4.200 -4.356 731 HB3 ALA 92 2HB ALA 92 6.233 3.489 -2.791 732 H ASP 93 HN ASP 93 6.762 1.726 -5.694 733 HA ASP 93 HA ASP 93 5.345 -0.259 -4.319 734 HB2 ASP 93 2HB ASP 93 5.890 0.327 -7.253 735 HB3 ASP 93 3HB ASP 93 4.980 -1.095 -6.783 736 HD2 ASP 93 HD2 ASP 93 2.794 1.005 -4.966 737 H LEU 94 HN LEU 94 8.072 -0.316 -6.743 738 HA LEU 94 HA LEU 94 8.530 -2.985 -6.878 739 HB2 LEU 94 2HB LEU 94 9.643 -1.360 -8.261 740 HB3 LEU 94 3HB LEU 94 10.496 -0.695 -6.882 741 HG LEU 94 HG LEU 94 11.759 -2.778 -6.620 742 HD11 LEU 94 1HD1 LEU 94 10.483 -4.558 -7.300 743 HD12 LEU 94 2HD1 LEU 94 9.909 -3.734 -8.770 744 HD13 LEU 94 3HD1 LEU 94 11.567 -4.379 -8.700 745 HD21 LEU 94 3HD2 LEU 94 13.301 -2.054 -8.057 746 HD22 LEU 94 1HD2 LEU 94 12.269 -2.388 -9.468 747 HD23 LEU 94 2HD2 LEU 94 12.093 -0.856 -8.580 748 H ILE 95 HN ILE 95 9.650 -0.682 -4.333 749 HA ILE 95 HA ILE 95 11.105 -2.667 -2.932 750 HB ILE 95 HB ILE 95 10.146 0.111 -2.309 751 HG12 ILE 95 2HG1 ILE 95 12.950 -1.009 -2.553 752 HG13 ILE 95 3HG1 ILE 95 12.065 -0.313 -3.896 753 HG21 ILE 95 1HG2 ILE 95 10.956 -1.963 -0.409 754 HG22 ILE 95 2HG2 ILE 95 11.955 -0.492 -0.317 755 HG23 ILE 95 3HG2 ILE 95 10.188 -0.381 -0.133 756 HD11 ILE 95 3HD1 ILE 95 13.466 1.037 -1.716 757 HD12 ILE 95 1HD1 ILE 95 12.832 1.714 -3.236 758 HD13 ILE 95 2HD1 ILE 95 11.771 1.575 -1.813 759 H ALA 96 HN ALA 96 7.856 -1.127 -2.458 760 HA ALA 96 HA ALA 96 7.038 -2.302 -0.194 761 HB1 ALA 96 3HB ALA 96 4.810 -1.986 -0.990 762 HB2 ALA 96 1HB ALA 96 5.793 -0.739 -1.792 763 HB3 ALA 96 2HB ALA 96 5.306 -2.198 -2.686 764 H TYR 97 HN TYR 97 7.210 -3.839 -3.455 765 HA TYR 97 HA TYR 97 6.060 -6.280 -2.609 766 HB2 TYR 97 2HB TYR 97 6.079 -5.767 -4.964 767 HB3 TYR 97 3HB TYR 97 7.713 -5.137 -4.901 768 HD1 TYR 97 HD2 TYR 97 6.899 -8.389 -3.377 769 HD2 TYR 97 HD1 TYR 97 8.410 -6.414 -6.859 770 HE1 TYR 97 HE2 TYR 97 7.791 -10.602 -4.255 771 HE2 TYR 97 HE1 TYR 97 9.296 -8.634 -7.725 772 HH TYR 97 HH TYR 97 8.346 -11.346 -7.027 773 H LEU 98 HN LEU 98 9.489 -5.526 -3.576 774 HA LEU 98 HA LEU 98 10.664 -7.825 -2.866 775 HB2 LEU 98 2HB LEU 98 11.532 -4.974 -2.804 776 HB3 LEU 98 3HB LEU 98 12.590 -6.174 -2.087 777 HG LEU 98 HG LEU 98 11.650 -6.031 -4.959 778 HD11 LEU 98 1HD1 LEU 98 14.516 -6.262 -4.378 779 HD12 LEU 98 2HD1 LEU 98 13.643 -5.154 -5.464 780 HD13 LEU 98 3HD1 LEU 98 13.765 -4.786 -3.727 781 HD21 LEU 98 3HD2 LEU 98 12.571 -8.345 -3.404 782 HD22 LEU 98 1HD2 LEU 98 11.734 -8.266 -4.973 783 HD23 LEU 98 2HD2 LEU 98 13.499 -8.056 -4.896 784 H LYS 99 HN LYS 99 9.255 -5.403 -0.699 785 HA LYS 99 HA LYS 99 10.533 -6.288 1.648 786 HB2 LYS 99 2HB LYS 99 8.233 -4.529 0.945 787 HB3 LYS 99 3HB LYS 99 8.272 -5.166 2.576 788 HG2 LYS 99 2HG LYS 99 10.789 -4.395 2.581 789 HG3 LYS 99 3HG LYS 99 10.342 -3.430 1.188 790 HD2 LYS 99 2HD LYS 99 8.539 -2.327 2.516 791 HD3 LYS 99 3HD LYS 99 8.953 -3.308 3.907 792 HE2 LYS 99 2HE LYS 99 10.981 -1.487 2.537 793 HE3 LYS 99 3HE LYS 99 9.952 -0.929 3.841 794 HZ1 LYS 99 2HZ LYS 99 10.997 -2.347 5.351 795 HZ3 LYS 99 1HZ LYS 99 12.258 -1.924 4.411 796 H LYS 100 HN LYS 100 7.254 -6.979 0.246 797 HA LYS 100 HA LYS 100 6.719 -8.950 2.222 798 HB2 LYS 100 2HB LYS 100 5.120 -7.458 0.746 799 HB3 LYS 100 3HB LYS 100 5.251 -8.784 -0.391 800 HG2 LYS 100 2HG LYS 100 4.525 -10.390 1.372 801 HG3 LYS 100 3HG LYS 100 4.432 -9.084 2.537 802 HD2 LYS 100 2HD LYS 100 2.767 -7.945 0.906 803 HD3 LYS 100 3HD LYS 100 2.715 -9.473 0.051 804 HE2 LYS 100 2HE LYS 100 2.234 -10.485 2.469 805 HE3 LYS 100 3HE LYS 100 1.764 -8.841 2.856 806 HZ1 LYS 100 2HZ LYS 100 0.612 -10.490 0.670 807 HZ3 LYS 100 1HZ LYS 100 0.220 -8.932 0.931 808 H ALA 101 HN ALA 101 8.675 -8.844 -0.609 809 HA ALA 101 HA ALA 101 8.321 -11.562 -1.389 810 HB1 ALA 101 3HB ALA 101 9.978 -11.083 -2.994 811 HB2 ALA 101 1HB ALA 101 9.167 -9.517 -2.753 812 HB3 ALA 101 2HB ALA 101 10.736 -9.836 -1.977 813 H THR 102 HN THR 102 10.982 -9.746 0.303 814 HA THR 102 HA THR 102 12.228 -12.218 1.082 815 HB THR 102 HB THR 102 13.933 -10.726 1.965 816 HG1 THR 102 HG1 THR 102 12.863 -9.109 3.078 817 HG21 THR 102 1HG2 THR 102 14.521 -9.950 -0.099 818 HG22 THR 102 2HG2 THR 102 12.875 -10.299 -0.680 819 HG23 THR 102 3HG2 THR 102 13.257 -8.701 0.005 820 H ASN 103 HN ASN 103 9.420 -10.813 2.086 821 HA ASN 103 HA ASN 103 9.841 -10.877 4.872 822 HB2 ASN 103 2HB ASN 103 8.039 -9.497 3.980 823 HB3 ASN 103 3HB ASN 103 7.342 -10.850 3.113 824 HD21 ASN 103 1HD2 ASN 103 5.393 -10.998 4.007 825 HD22 ASN 103 2HD2 ASN 103 5.059 -11.301 5.679 826 H GLU 104 HN GLU 104 8.846 -13.147 2.308 827 HA GLU 104 HA GLU 104 8.004 -15.091 4.267 828 HB2 GLU 104 2HB GLU 104 8.115 -15.462 1.250 829 HB3 GLU 104 3HB GLU 104 7.153 -16.364 2.405 830 HG2 GLU 104 2HG GLU 104 6.805 -13.360 2.041 831 HG3 GLU 104 3HG GLU 104 5.952 -14.511 1.031 832 HE2 GLU 104 HE2 GLU 104 5.661 -13.555 4.671 833 HHA HEC 500 HHA HEC 500 23.792 -7.897 -4.931 834 HHB HEC 500 HHB HEC 500 18.020 -5.153 -5.218 835 HHC HEC 500 HHC HEC 500 18.338 -5.798 -11.626 836 HHD HEC 500 HHD HEC 500 23.171 -9.931 -10.917 837 HMA1 HEC 500 1HMA HEC 500 18.653 -5.415 -2.998 838 HMA2 HEC 500 2HMA HEC 500 20.092 -5.678 -2.007 839 HMA3 HEC 500 3HMA HEC 500 19.970 -4.213 -2.998 840 HAA1 HEC 500 1HAA HEC 500 23.547 -6.989 -3.158 841 HAA2 HEC 500 2HAA HEC 500 22.528 -5.954 -2.292 842 HBA1 HEC 500 1HBA HEC 500 22.875 -8.510 -1.560 843 HBA2 HEC 500 2HBA HEC 500 21.338 -7.672 -1.276 844 HMB1 HEC 500 1HMB HEC 500 15.033 -4.858 -7.522 845 HMB2 HEC 500 2HMB HEC 500 15.934 -5.031 -6.032 846 HMB3 HEC 500 3HMB HEC 500 16.031 -3.497 -6.923 847 HAB HEC 500 HAB HEC 500 16.860 -4.304 -11.115 848 HBB1 HEC 500 1HBB HEC 500 14.989 -2.848 -10.628 849 HBB2 HEC 500 2HBB HEC 500 15.143 -3.325 -8.917 850 HBB3 HEC 500 3HBB HEC 500 16.425 -2.417 -9.693 851 HMC1 HEC 500 1HMC HEC 500 18.474 -8.367 -13.656 852 HMC2 HEC 500 2HMC HEC 500 18.740 -6.618 -13.606 853 HMC3 HEC 500 3HMC HEC 500 19.866 -7.635 -14.481 854 HAC HEC 500 HAC HEC 500 22.136 -10.520 -12.651 855 HBC1 HEC 500 1HBC HEC 500 22.880 -8.716 -14.197 856 HBC2 HEC 500 2HBC HEC 500 22.429 -10.242 -14.988 857 HBC3 HEC 500 3HBC HEC 500 21.322 -8.872 -15.048 858 HMD1 HEC 500 1HMD HEC 500 24.737 -11.685 -9.099 859 HMD2 HEC 500 2HMD HEC 500 25.327 -10.385 -10.150 860 HMD3 HEC 500 3HMD HEC 500 26.109 -10.725 -8.579 861 HAD1 HEC 500 1HAD HEC 500 25.425 -9.103 -5.240 862 HAD2 HEC 500 2HAD HEC 500 25.758 -10.497 -6.178 863 HBD1 HEC 500 1HBD HEC 500 27.716 -9.188 -6.433 864 HBD2 HEC 500 2HBD HEC 500 26.799 -8.801 -7.905 Start of MODEL 14 1 H1 GLY 1 HN GLY 1 1.629 -0.015 0.602 2 HA2 GLY 1 1HA GLY 1 3.612 0.854 -1.239 3 HA3 GLY 1 2HA GLY 1 4.341 -0.062 0.064 4 H ASP 2 HN ASP 2 2.023 -0.156 -2.649 5 HA ASP 2 HA ASP 2 1.046 -2.679 -2.313 6 HB2 ASP 2 2HB ASP 2 1.821 -1.635 -5.053 7 HB3 ASP 2 3HB ASP 2 0.405 -2.568 -4.608 8 HD2 ASP 2 HD2 ASP 2 1.572 0.473 -5.121 9 H VAL 3 HN VAL 3 1.644 -4.647 -3.813 10 HA VAL 3 HA VAL 3 4.572 -4.820 -4.009 11 HB VAL 3 HB VAL 3 3.854 -7.381 -3.771 12 HG11 VAL 3 1HG1 VAL 3 5.171 -5.506 -2.217 13 HG12 VAL 3 2HG1 VAL 3 3.926 -6.141 -1.116 14 HG13 VAL 3 3HG1 VAL 3 5.077 -7.254 -1.894 15 HG21 VAL 3 3HG2 VAL 3 1.480 -7.034 -3.562 16 HG22 VAL 3 1HG2 VAL 3 2.108 -7.557 -1.982 17 HG23 VAL 3 2HG2 VAL 3 1.717 -5.843 -2.260 18 H GLU 4 HN GLU 4 1.433 -6.120 -5.292 19 HA GLU 4 HA GLU 4 2.296 -7.434 -7.432 20 HB2 GLU 4 2HB GLU 4 -0.099 -5.575 -7.170 21 HB3 GLU 4 3HB GLU 4 0.141 -6.591 -8.577 22 HG2 GLU 4 2HG GLU 4 0.344 -8.584 -6.947 23 HG3 GLU 4 3HG GLU 4 -0.213 -7.499 -5.688 24 HE2 GLU 4 HE2 GLU 4 -2.309 -7.513 -8.926 25 H LYS 5 HN LYS 5 1.776 -3.848 -7.261 26 HA LYS 5 HA LYS 5 2.415 -3.258 -9.872 27 HB2 LYS 5 2HB LYS 5 2.407 -1.790 -7.280 28 HB3 LYS 5 3HB LYS 5 3.288 -1.052 -8.604 29 HG2 LYS 5 2HG LYS 5 0.917 -0.306 -8.574 30 HG3 LYS 5 3HG LYS 5 1.293 -1.164 -10.054 31 HD2 LYS 5 2HD LYS 5 -0.831 -2.014 -9.279 32 HD3 LYS 5 3HD LYS 5 0.350 -3.277 -8.998 33 HE2 LYS 5 2HE LYS 5 0.594 -2.379 -6.604 34 HE3 LYS 5 3HE LYS 5 -0.773 -1.333 -6.930 35 HZ1 LYS 5 2HZ LYS 5 -1.413 -3.977 -7.709 36 HZ3 LYS 5 1HZ LYS 5 -2.139 -3.062 -6.574 37 H GLY 6 HN GLY 6 4.545 -3.819 -7.027 38 HA2 GLY 6 1HA GLY 6 6.936 -3.212 -8.526 39 HA3 GLY 6 2HA GLY 6 6.818 -3.804 -6.880 40 H LYS 7 HN LYS 7 4.813 -5.955 -8.092 41 HA LYS 7 HA LYS 7 6.846 -7.938 -8.407 42 HB2 LYS 7 2HB LYS 7 4.817 -8.415 -7.153 43 HB3 LYS 7 3HB LYS 7 3.821 -8.071 -8.553 44 HG2 LYS 7 2HG LYS 7 3.979 -10.408 -8.670 45 HG3 LYS 7 3HG LYS 7 5.274 -9.925 -9.747 46 HD2 LYS 7 2HD LYS 7 6.964 -10.461 -8.189 47 HD3 LYS 7 3HD LYS 7 5.897 -10.291 -6.810 48 HE2 LYS 7 2HE LYS 7 5.267 -12.449 -8.825 49 HE3 LYS 7 3HE LYS 7 6.617 -12.710 -7.738 50 HZ1 LYS 7 2HZ LYS 7 3.843 -12.835 -7.145 51 HZ3 LYS 7 1HZ LYS 7 4.557 -11.763 -6.149 52 H LYS 8 HN LYS 8 4.356 -6.376 -10.515 53 HA LYS 8 HA LYS 8 5.032 -7.877 -12.794 54 HB2 LYS 8 2HB LYS 8 3.616 -5.222 -12.444 55 HB3 LYS 8 3HB LYS 8 3.774 -6.042 -13.984 56 HG2 LYS 8 2HG LYS 8 2.710 -7.612 -11.633 57 HG3 LYS 8 3HG LYS 8 1.648 -6.447 -12.399 58 HD2 LYS 8 2HD LYS 8 1.167 -8.293 -13.719 59 HD3 LYS 8 3HD LYS 8 2.502 -7.638 -14.646 60 HE2 LYS 8 2HE LYS 8 4.013 -9.280 -13.907 61 HE3 LYS 8 3HE LYS 8 3.148 -9.559 -12.409 62 HZ1 LYS 8 2HZ LYS 8 2.065 -10.329 -15.066 63 HZ3 LYS 8 1HZ LYS 8 1.440 -10.730 -13.617 64 H ILE 9 HN ILE 9 6.255 -4.830 -11.363 65 HA ILE 9 HA ILE 9 7.782 -4.078 -13.606 66 HB ILE 9 HB ILE 9 7.819 -3.360 -10.687 67 HG12 ILE 9 2HG1 ILE 9 7.167 -1.648 -13.094 68 HG13 ILE 9 3HG1 ILE 9 5.962 -2.618 -12.270 69 HG21 ILE 9 1HG2 ILE 9 9.490 -1.688 -11.093 70 HG22 ILE 9 2HG2 ILE 9 10.138 -3.265 -11.604 71 HG23 ILE 9 3HG2 ILE 9 9.561 -2.103 -12.822 72 HD11 ILE 9 3HD1 ILE 9 7.589 -1.054 -10.378 73 HD12 ILE 9 1HD1 ILE 9 6.745 -0.029 -11.563 74 HD13 ILE 9 2HD1 ILE 9 5.818 -1.152 -10.538 75 H PHE 10 HN PHE 10 8.571 -5.882 -10.563 76 HA PHE 10 HA PHE 10 11.261 -6.249 -11.142 77 HB2 PHE 10 2HB PHE 10 10.299 -6.678 -8.927 78 HB3 PHE 10 3HB PHE 10 9.104 -7.776 -9.589 79 HD1 PHE 10 HD1 PHE 10 12.674 -7.399 -8.757 80 HD2 PHE 10 HD2 PHE 10 9.606 -10.082 -9.937 81 HE1 PHE 10 HE1 PHE 10 14.182 -9.343 -8.257 82 HE2 PHE 10 HE2 PHE 10 11.113 -12.026 -9.437 83 HZ PHE 10 HZ PHE 10 13.383 -11.633 -8.604 84 H ILE 11 HN ILE 11 8.339 -8.145 -12.054 85 HA ILE 11 HA ILE 11 9.867 -10.268 -13.181 86 HB ILE 11 HB ILE 11 6.954 -9.501 -13.370 87 HG12 ILE 11 2HG1 ILE 11 8.221 -11.767 -11.817 88 HG13 ILE 11 3HG1 ILE 11 7.956 -10.180 -11.124 89 HG21 ILE 11 1HG2 ILE 11 7.524 -10.757 -15.350 90 HG22 ILE 11 2HG2 ILE 11 8.365 -11.987 -14.375 91 HG23 ILE 11 3HG2 ILE 11 6.601 -11.794 -14.237 92 HD11 ILE 11 3HD1 ILE 11 5.817 -12.014 -12.298 93 HD12 ILE 11 1HD1 ILE 11 6.053 -11.617 -10.578 94 HD13 ILE 11 2HD1 ILE 11 5.513 -10.359 -11.716 95 H MET 12 HN MET 12 9.279 -7.046 -14.103 96 HA MET 12 HA MET 12 9.640 -7.776 -16.905 97 HB2 MET 12 2HB MET 12 8.146 -5.587 -15.467 98 HB3 MET 12 3HB MET 12 8.915 -5.126 -16.973 99 HG2 MET 12 2HG MET 12 7.766 -7.332 -17.918 100 HG3 MET 12 3HG MET 12 6.721 -7.169 -16.520 101 HE1 MET 12 3HE MET 12 5.042 -7.253 -18.414 102 HE2 MET 12 1HE MET 12 4.297 -6.090 -17.291 103 HE3 MET 12 2HE MET 12 4.306 -5.758 -19.040 104 H LYS 13 HN LYS 13 11.288 -6.750 -14.171 105 HA LYS 13 HA LYS 13 13.234 -5.302 -15.829 106 HB2 LYS 13 2HB LYS 13 12.113 -4.628 -13.130 107 HB3 LYS 13 3HB LYS 13 13.780 -4.218 -13.479 108 HG2 LYS 13 2HG LYS 13 13.129 -2.895 -15.427 109 HG3 LYS 13 3HG LYS 13 11.474 -3.464 -15.329 110 HD2 LYS 13 2HD LYS 13 11.569 -2.430 -12.875 111 HD3 LYS 13 3HD LYS 13 12.913 -1.510 -13.521 112 HE2 LYS 13 2HE LYS 13 10.135 -1.616 -14.789 113 HE3 LYS 13 3HE LYS 13 10.692 -0.329 -13.738 114 HZ1 LYS 13 2HZ LYS 13 11.557 -0.945 -16.472 115 HZ3 LYS 13 1HZ LYS 13 12.652 -0.264 -15.477 116 H CYS 14 HN CYS 14 12.789 -7.127 -12.716 117 HA CYS 14 HA CYS 14 15.355 -8.408 -13.328 118 HB2 CYS 14 2HB CYS 14 14.502 -8.367 -10.507 119 HB3 CYS 14 3HB CYS 14 16.095 -8.184 -11.215 120 H SER 15 HN SER 15 13.961 -9.966 -14.563 121 HA SER 15 HA SER 15 12.636 -11.780 -12.703 122 HB2 SER 15 2HB SER 15 11.288 -10.371 -14.586 123 HB3 SER 15 3HB SER 15 11.776 -11.730 -15.578 124 HG SER 15 HG SER 15 10.855 -13.126 -13.814 125 H GLN 16 HN GLN 16 15.393 -11.351 -14.343 126 HA GLN 16 HA GLN 16 15.444 -14.107 -15.304 127 HB2 GLN 16 2HB GLN 16 15.763 -12.602 -17.176 128 HB3 GLN 16 3HB GLN 16 16.939 -11.647 -16.295 129 HG2 GLN 16 2HG GLN 16 18.482 -13.615 -16.217 130 HG3 GLN 16 3HG GLN 16 17.306 -14.574 -17.091 131 HE21 GLN 16 1HE2 GLN 16 20.031 -13.843 -17.795 132 HE22 GLN 16 2HE2 GLN 16 19.976 -13.024 -19.320 133 H CYS 17 HN CYS 17 17.053 -11.517 -13.435 134 HA CYS 17 HA CYS 17 19.158 -13.370 -12.678 135 HB2 CYS 17 2HB CYS 17 18.769 -10.408 -12.244 136 HB3 CYS 17 3HB CYS 17 20.034 -11.322 -11.447 137 H HIS 18 HN HIS 18 17.470 -10.812 -10.751 138 HA HIS 18 HA HIS 18 17.465 -12.397 -8.445 139 HB2 HIS 18 2HB HIS 18 15.936 -9.880 -9.155 140 HB3 HIS 18 3HB HIS 18 15.971 -10.589 -7.553 141 HD1 HIS 18 HD1 HIS 18 18.646 -10.965 -6.651 142 HD2 HIS 18 HD2 HIS 18 17.849 -7.968 -9.476 143 HE1 HIS 18 HE1 HIS 18 20.604 -9.334 -6.535 144 H THR 19 HN THR 19 15.797 -13.558 -7.395 145 HA THR 19 HA THR 19 13.485 -14.136 -9.130 146 HB THR 19 HB THR 19 13.601 -16.425 -8.052 147 HG1 THR 19 HG1 THR 19 15.831 -16.650 -6.948 148 HG21 THR 19 1HG2 THR 19 14.983 -15.795 -10.198 149 HG22 THR 19 2HG2 THR 19 16.379 -15.731 -9.095 150 HG23 THR 19 3HG2 THR 19 15.471 -17.250 -9.295 151 H VAL 20 HN VAL 20 14.689 -13.381 -5.866 152 HA VAL 20 HA VAL 20 13.629 -12.909 -3.974 153 HB VAL 20 HB VAL 20 11.932 -11.248 -4.128 154 HG11 VAL 20 1HG1 VAL 20 13.732 -10.039 -4.757 155 HG12 VAL 20 2HG1 VAL 20 14.203 -11.200 -6.021 156 HG13 VAL 20 3HG1 VAL 20 12.928 -10.002 -6.344 157 HG21 VAL 20 3HG2 VAL 20 10.507 -10.857 -5.948 158 HG22 VAL 20 1HG2 VAL 20 11.524 -11.791 -7.070 159 HG23 VAL 20 2HG2 VAL 20 10.565 -12.631 -5.829 160 H GLU 21 HN GLU 21 13.080 -15.556 -5.250 161 HA GLU 21 HA GLU 21 10.589 -16.037 -3.827 162 HB2 GLU 21 2HB GLU 21 9.813 -17.568 -5.554 163 HB3 GLU 21 3HB GLU 21 10.154 -16.017 -6.294 164 HG2 GLU 21 2HG GLU 21 12.614 -17.251 -6.527 165 HG3 GLU 21 3HG GLU 21 11.542 -18.632 -6.649 166 HE2 GLU 21 HE2 GLU 21 10.832 -18.105 -9.798 167 H LYS 22 HN LYS 22 10.578 -17.908 -2.544 168 HA LYS 22 HA LYS 22 13.078 -18.962 -1.847 169 HB2 LYS 22 2HB LYS 22 11.855 -20.341 -0.313 170 HB3 LYS 22 3HB LYS 22 11.118 -18.751 -0.335 171 HG2 LYS 22 2HG LYS 22 9.556 -19.801 -2.211 172 HG3 LYS 22 3HG LYS 22 10.084 -21.332 -1.541 173 HD2 LYS 22 2HD LYS 22 9.449 -20.144 0.786 174 HD3 LYS 22 3HD LYS 22 8.430 -19.163 -0.249 175 HE2 LYS 22 2HE LYS 22 7.306 -21.179 -1.131 176 HE3 LYS 22 3HE LYS 22 8.395 -22.219 -0.233 177 HZ1 LYS 22 2HZ LYS 22 7.509 -20.983 1.816 178 HZ3 LYS 22 1HZ LYS 22 6.489 -22.039 1.110 179 H GLY 23 HN GLY 23 10.439 -20.096 -4.005 180 HA2 GLY 23 1HA GLY 23 11.400 -22.687 -4.454 181 HA3 GLY 23 2HA GLY 23 10.364 -21.756 -5.517 182 H GLY 24 HN GLY 24 12.758 -19.611 -5.298 183 HA2 GLY 24 1HA GLY 24 14.137 -20.681 -7.657 184 HA3 GLY 24 2HA GLY 24 14.073 -19.009 -7.132 185 H LYS 25 HN LYS 25 16.542 -19.976 -7.802 186 HA LYS 25 HA LYS 25 17.816 -20.190 -5.174 187 HB2 LYS 25 2HB LYS 25 19.429 -21.802 -6.080 188 HB3 LYS 25 3HB LYS 25 17.796 -22.436 -6.091 189 HG2 LYS 25 2HG LYS 25 17.584 -21.787 -8.515 190 HG3 LYS 25 3HG LYS 25 19.240 -21.215 -8.492 191 HD2 LYS 25 2HD LYS 25 18.715 -24.029 -7.543 192 HD3 LYS 25 3HD LYS 25 18.611 -23.719 -9.264 193 HE2 LYS 25 2HE LYS 25 20.947 -22.446 -8.812 194 HE3 LYS 25 3HE LYS 25 21.007 -23.538 -7.443 195 HZ1 LYS 25 2HZ LYS 25 20.624 -25.391 -9.045 196 HZ3 LYS 25 1HZ LYS 25 22.017 -24.600 -9.342 197 H HIS 26 HN HIS 26 20.450 -20.001 -5.877 198 HA HIS 26 HA HIS 26 20.511 -17.307 -6.890 199 HB2 HIS 26 2HB HIS 26 22.781 -19.026 -5.858 200 HB3 HIS 26 3HB HIS 26 22.811 -17.293 -6.114 201 HD1 HIS 26 HD1 HIS 26 23.041 -16.390 -3.776 202 HD2 HIS 26 HD2 HIS 26 20.010 -19.274 -4.090 203 HE1 HIS 26 HE1 HIS 26 21.851 -16.426 -1.519 204 H LYS 27 HN LYS 27 21.145 -16.690 -8.914 205 HA LYS 27 HA LYS 27 22.516 -18.710 -10.535 206 HB2 LYS 27 2HB LYS 27 19.910 -17.356 -11.076 207 HB3 LYS 27 3HB LYS 27 21.005 -17.567 -12.428 208 HG2 LYS 27 2HG LYS 27 21.213 -20.055 -11.442 209 HG3 LYS 27 3HG LYS 27 19.662 -19.669 -10.725 210 HD2 LYS 27 2HD LYS 27 20.379 -19.649 -13.688 211 HD3 LYS 27 3HD LYS 27 19.242 -20.711 -12.880 212 HE2 LYS 27 2HE LYS 27 18.913 -17.678 -13.075 213 HE3 LYS 27 3HE LYS 27 18.141 -18.822 -14.155 214 HZ1 LYS 27 2HZ LYS 27 17.678 -18.536 -11.244 215 HZ3 LYS 27 1HZ LYS 27 17.174 -19.853 -12.057 216 H THR 28 HN THR 28 21.321 -15.624 -11.791 217 HA THR 28 HA THR 28 23.972 -14.819 -12.437 218 HB THR 28 HB THR 28 21.445 -13.112 -12.510 219 HG1 THR 28 HG1 THR 28 22.433 -15.199 -14.323 220 HG21 THR 28 1HG2 THR 28 23.915 -13.442 -14.289 221 HG22 THR 28 2HG2 THR 28 22.464 -12.539 -14.787 222 HG23 THR 28 3HG2 THR 28 23.425 -11.981 -13.397 223 H GLY 29 HN GLY 29 21.704 -14.119 -9.785 224 HA2 GLY 29 1HA GLY 29 23.880 -12.646 -8.466 225 HA3 GLY 29 2HA GLY 29 22.309 -11.888 -8.626 226 HA PRO 30 HA PRO 30 22.237 -14.410 -4.831 227 HB2 PRO 30 2HB PRO 30 21.704 -12.414 -3.042 228 HB3 PRO 30 3HB PRO 30 23.323 -12.996 -3.375 229 HG2 PRO 30 2HG PRO 30 22.038 -10.485 -4.259 230 HG3 PRO 30 3HG PRO 30 23.742 -10.888 -4.212 231 HD2 PRO 30 2HD PRO 30 22.058 -10.821 -6.533 232 HD3 PRO 30 3HD PRO 30 23.731 -11.335 -6.467 233 H ASN 31 HN ASN 31 20.483 -15.263 -3.666 234 HA ASN 31 HA ASN 31 18.063 -14.685 -5.025 235 HB2 ASN 31 2HB ASN 31 18.837 -16.979 -4.106 236 HB3 ASN 31 3HB ASN 31 18.438 -16.383 -2.506 237 HD21 ASN 31 1HD2 ASN 31 17.240 -17.375 -5.613 238 HD22 ASN 31 2HD2 ASN 31 15.561 -17.508 -5.211 239 H LEU 32 HN LEU 32 16.667 -13.032 -4.398 240 HA LEU 32 HA LEU 32 17.126 -11.552 -2.049 241 HB2 LEU 32 2HB LEU 32 15.178 -11.557 -4.287 242 HB3 LEU 32 3HB LEU 32 14.670 -10.769 -2.805 243 HG LEU 32 HG LEU 32 17.085 -9.621 -3.054 244 HD11 LEU 32 1HD1 LEU 32 16.745 -9.173 -5.806 245 HD12 LEU 32 2HD1 LEU 32 18.081 -10.024 -4.995 246 HD13 LEU 32 3HD1 LEU 32 16.674 -10.938 -5.589 247 HD21 LEU 32 3HD2 LEU 32 14.961 -8.449 -4.789 248 HD22 LEU 32 1HD2 LEU 32 14.580 -8.737 -3.075 249 HD23 LEU 32 2HD2 LEU 32 15.955 -7.698 -3.518 250 H HIS 33 HN HIS 33 17.179 -13.378 -0.482 251 HA HIS 33 HA HIS 33 14.462 -14.220 0.215 252 HB2 HIS 33 2HB HIS 33 15.857 -16.099 -0.329 253 HB3 HIS 33 3HB HIS 33 17.148 -15.524 0.707 254 HD1 HIS 33 HD1 HIS 33 13.655 -17.016 0.903 255 HD2 HIS 33 HD2 HIS 33 16.956 -16.266 3.382 256 HE1 HIS 33 HE1 HIS 33 13.181 -18.211 3.107 257 H GLY 34 HN GLY 34 17.648 -13.713 1.900 258 HA2 GLY 34 1HA GLY 34 16.160 -12.486 4.122 259 HA3 GLY 34 2HA GLY 34 17.765 -13.186 4.194 260 H LEU 35 HN LEU 35 16.851 -11.149 1.435 261 HA LEU 35 HA LEU 35 18.982 -9.525 1.463 262 HB2 LEU 35 2HB LEU 35 17.651 -9.336 -0.383 263 HB3 LEU 35 3HB LEU 35 16.168 -9.215 0.542 264 HG LEU 35 HG LEU 35 16.769 -6.900 1.191 265 HD11 LEU 35 1HD1 LEU 35 19.320 -7.656 0.017 266 HD12 LEU 35 2HD1 LEU 35 18.691 -6.141 -0.673 267 HD13 LEU 35 3HD1 LEU 35 18.907 -6.295 1.087 268 HD21 LEU 35 3HD2 LEU 35 15.374 -6.586 -0.527 269 HD22 LEU 35 1HD2 LEU 35 16.835 -6.174 -1.458 270 HD23 LEU 35 2HD2 LEU 35 16.170 -7.824 -1.527 271 H PHE 36 HN PHE 36 15.828 -8.230 2.697 272 HA PHE 36 HA PHE 36 17.101 -6.233 4.188 273 HB2 PHE 36 2HB PHE 36 14.368 -7.541 3.948 274 HB3 PHE 36 3HB PHE 36 14.624 -6.478 5.319 275 HD1 PHE 36 HD2 PHE 36 14.841 -6.575 1.608 276 HD2 PHE 36 HD1 PHE 36 14.390 -4.168 5.074 277 HE1 PHE 36 HE2 PHE 36 14.336 -4.588 0.162 278 HE2 PHE 36 HE1 PHE 36 13.885 -2.181 3.627 279 HZ PHE 36 HZ PHE 36 13.863 -2.413 1.188 280 H GLY 37 HN GLY 37 17.072 -5.941 6.565 281 HA2 GLY 37 1HA GLY 37 17.275 -6.640 8.709 282 HA3 GLY 37 2HA GLY 37 16.641 -8.211 8.260 283 H ARG 38 HN ARG 38 19.074 -7.553 6.035 284 HA ARG 38 HA ARG 38 21.057 -8.788 7.774 285 HB2 ARG 38 2HB ARG 38 19.910 -10.181 5.804 286 HB3 ARG 38 3HB ARG 38 21.017 -9.286 4.782 287 HG2 ARG 38 2HG ARG 38 22.949 -10.187 5.882 288 HG3 ARG 38 3HG ARG 38 22.018 -10.731 7.263 289 HD2 ARG 38 2HD ARG 38 21.803 -11.862 4.429 290 HD3 ARG 38 3HD ARG 38 22.630 -12.633 5.769 291 HE ARG 38 HE ARG 38 19.722 -12.467 5.364 292 HH11 ARG 38 2HH2 ARG 38 22.310 -13.072 7.707 293 HH12 ARG 38 1HH2 ARG 38 21.293 -13.966 8.788 294 HH22 ARG 38 HH1 ARG 38 18.985 -14.291 8.228 295 H LYS 39 HN LYS 39 23.384 -8.428 6.928 296 HA LYS 39 HA LYS 39 23.614 -5.649 6.181 297 HB2 LYS 39 2HB LYS 39 25.387 -7.736 7.365 298 HB3 LYS 39 3HB LYS 39 26.159 -6.455 6.454 299 HG2 LYS 39 2HG LYS 39 26.030 -5.697 8.744 300 HG3 LYS 39 3HG LYS 39 24.852 -4.767 7.839 301 HD2 LYS 39 2HD LYS 39 23.651 -5.434 9.769 302 HD3 LYS 39 3HD LYS 39 23.121 -6.576 8.550 303 HE2 LYS 39 2HE LYS 39 23.622 -7.957 10.413 304 HE3 LYS 39 3HE LYS 39 25.042 -8.119 9.399 305 HZ1 LYS 39 2HZ LYS 39 25.349 -7.553 11.893 306 HZ3 LYS 39 1HZ LYS 39 24.985 -6.023 11.471 307 H THR 40 HN THR 40 25.717 -5.302 4.623 308 HA THR 40 HA THR 40 24.858 -6.488 2.122 309 HB THR 40 HB THR 40 26.674 -4.786 1.313 310 HG1 THR 40 HG1 THR 40 27.558 -4.825 3.612 311 HG21 THR 40 1HG2 THR 40 25.201 -2.909 1.540 312 HG22 THR 40 2HG2 THR 40 24.107 -4.312 1.554 313 HG23 THR 40 3HG2 THR 40 24.544 -3.510 3.080 314 H GLY 41 HN GLY 41 25.637 -8.339 1.353 315 HA2 GLY 41 1HA GLY 41 27.239 -9.802 0.659 316 HA3 GLY 41 2HA GLY 41 28.478 -8.845 1.446 317 H GLN 42 HN GLN 42 25.474 -10.570 2.579 318 HA GLN 42 HA GLN 42 27.155 -11.727 4.660 319 HB2 GLN 42 2HB GLN 42 24.144 -11.241 4.607 320 HB3 GLN 42 3HB GLN 42 24.992 -12.046 5.913 321 HG2 GLN 42 2HG GLN 42 25.243 -9.149 5.024 322 HG3 GLN 42 3HG GLN 42 24.777 -9.757 6.599 323 HE21 GLN 42 1HE2 GLN 42 27.190 -8.363 4.903 324 HE22 GLN 42 2HE2 GLN 42 28.581 -8.839 5.819 325 H ALA 43 HN ALA 43 24.874 -12.350 2.004 326 HA ALA 43 HA ALA 43 24.019 -14.852 2.384 327 HB1 ALA 43 3HB ALA 43 25.170 -13.521 -0.088 328 HB2 ALA 43 1HB ALA 43 24.388 -15.118 -0.142 329 HB3 ALA 43 2HB ALA 43 23.462 -13.690 0.380 330 HA PRO 44 HA PRO 44 27.918 -16.846 3.059 331 HB2 PRO 44 2HB PRO 44 26.952 -18.894 4.590 332 HB3 PRO 44 3HB PRO 44 27.482 -17.363 5.260 333 HG2 PRO 44 2HG PRO 44 24.727 -18.363 4.872 334 HG3 PRO 44 3HG PRO 44 25.287 -17.062 5.903 335 HD2 PRO 44 2HD PRO 44 23.955 -16.798 3.377 336 HD3 PRO 44 3HD PRO 44 24.618 -15.502 4.353 337 H GLY 45 HN GLY 45 25.336 -17.515 1.193 338 HA2 GLY 45 1HA GLY 45 26.313 -20.166 0.400 339 HA3 GLY 45 2HA GLY 45 24.793 -19.419 -0.049 340 H TYR 46 HN TYR 46 25.778 -16.809 -0.830 341 HA TYR 46 HA TYR 46 27.518 -17.510 -3.093 342 HB2 TYR 46 2HB TYR 46 25.070 -17.335 -3.717 343 HB3 TYR 46 3HB TYR 46 24.975 -15.776 -2.923 344 HD1 TYR 46 HD1 TYR 46 27.718 -16.980 -5.147 345 HD2 TYR 46 HD2 TYR 46 24.361 -14.364 -4.714 346 HE1 TYR 46 HE1 TYR 46 28.327 -15.826 -7.328 347 HE2 TYR 46 HE2 TYR 46 24.982 -13.218 -6.896 348 HH TYR 46 HH TYR 46 26.255 -13.276 -8.658 349 H SER 47 HN SER 47 29.317 -16.611 -1.890 350 HA SER 47 HA SER 47 29.232 -14.109 -0.731 351 HB2 SER 47 2HB SER 47 31.382 -15.971 -1.697 352 HB3 SER 47 3HB SER 47 31.856 -14.314 -1.374 353 HG SER 47 HG SER 47 31.945 -15.954 0.461 354 H TYR 48 HN TYR 48 29.148 -12.070 -1.611 355 HA TYR 48 HA TYR 48 29.220 -11.809 -4.469 356 HB2 TYR 48 2HB TYR 48 29.182 -9.653 -2.281 357 HB3 TYR 48 3HB TYR 48 28.465 -9.539 -3.877 358 HD1 TYR 48 HD2 TYR 48 27.368 -12.575 -3.478 359 HD2 TYR 48 HD1 TYR 48 26.994 -8.875 -1.363 360 HE1 TYR 48 HE2 TYR 48 25.137 -13.338 -2.526 361 HE2 TYR 48 HE1 TYR 48 24.764 -9.649 -0.419 362 HH TYR 48 HH TYR 48 23.428 -11.368 -0.142 363 H THR 49 HN THR 49 30.342 -9.412 -5.041 364 HA THR 49 HA THR 49 33.111 -10.022 -5.015 365 HB THR 49 HB THR 49 33.157 -7.688 -6.133 366 HG1 THR 49 HG1 THR 49 31.038 -6.770 -6.361 367 HG21 THR 49 1HG2 THR 49 30.979 -9.536 -7.226 368 HG22 THR 49 2HG2 THR 49 31.994 -8.402 -8.148 369 HG23 THR 49 3HG2 THR 49 32.715 -9.865 -7.435 370 H ALA 50 HN ALA 50 34.558 -7.804 -4.566 371 HA ALA 50 HA ALA 50 34.329 -7.584 -1.676 372 HB1 ALA 50 3HB ALA 50 36.541 -7.933 -1.971 373 HB2 ALA 50 1HB ALA 50 36.459 -7.529 -3.703 374 HB3 ALA 50 2HB ALA 50 36.617 -6.233 -2.493 375 H ALA 51 HN ALA 51 32.665 -6.150 -3.959 376 HA ALA 51 HA ALA 51 33.299 -3.394 -3.235 377 HB1 ALA 51 3HB ALA 51 33.024 -4.025 -5.630 378 HB2 ALA 51 1HB ALA 51 31.352 -4.527 -5.284 379 HB3 ALA 51 2HB ALA 51 31.825 -2.821 -5.102 380 H ASN 52 HN ASN 52 30.434 -5.625 -3.459 381 HA ASN 52 HA ASN 52 28.915 -3.865 -1.836 382 HB2 ASN 52 2HB ASN 52 28.058 -5.506 -3.672 383 HB3 ASN 52 3HB ASN 52 28.271 -6.781 -2.490 384 HD21 ASN 52 1HD2 ASN 52 27.223 -6.479 -0.370 385 HD22 ASN 52 2HD2 ASN 52 25.659 -5.740 -0.303 386 H LYS 53 HN LYS 53 30.958 -6.755 -1.465 387 HA LYS 53 HA LYS 53 29.972 -7.547 1.065 388 HB2 LYS 53 2HB LYS 53 31.220 -8.977 -0.599 389 HB3 LYS 53 3HB LYS 53 32.685 -8.125 -0.154 390 HG2 LYS 53 2HG LYS 53 31.843 -8.761 2.338 391 HG3 LYS 53 3HG LYS 53 31.036 -10.050 1.470 392 HD2 LYS 53 2HD LYS 53 33.395 -10.399 0.313 393 HD3 LYS 53 3HD LYS 53 34.007 -9.488 1.679 394 HE2 LYS 53 2HE LYS 53 34.136 -11.796 2.334 395 HE3 LYS 53 3HE LYS 53 32.768 -11.135 3.210 396 HZ1 LYS 53 2HZ LYS 53 32.512 -13.343 1.859 397 HZ3 LYS 53 1HZ LYS 53 32.271 -12.358 0.584 398 H ASN 54 HN ASN 54 31.868 -4.876 -0.025 399 HA ASN 54 HA ASN 54 33.450 -4.627 2.290 400 HB2 ASN 54 2HB ASN 54 32.783 -2.936 -0.115 401 HB3 ASN 54 3HB ASN 54 33.409 -2.090 1.286 402 HD21 ASN 54 1HD2 ASN 54 34.941 -1.870 -0.766 403 HD22 ASN 54 2HD2 ASN 54 36.342 -2.888 -0.730 404 H LYS 55 HN LYS 55 30.351 -3.229 1.044 405 HA LYS 55 HA LYS 55 29.891 -1.304 2.929 406 HB2 LYS 55 2HB LYS 55 28.197 -2.998 1.158 407 HB3 LYS 55 3HB LYS 55 27.381 -2.156 2.460 408 HG2 LYS 55 2HG LYS 55 29.180 -0.879 0.347 409 HG3 LYS 55 3HG LYS 55 27.434 -0.754 0.424 410 HD2 LYS 55 2HD LYS 55 27.939 0.166 2.895 411 HD3 LYS 55 3HD LYS 55 29.510 0.525 2.207 412 HE2 LYS 55 2HE LYS 55 26.797 1.568 1.297 413 HE3 LYS 55 3HE LYS 55 28.163 2.500 1.881 414 HZ1 LYS 55 2HZ LYS 55 27.999 1.046 -0.700 415 HZ3 LYS 55 1HZ LYS 55 29.396 1.663 -0.135 416 H GLY 56 HN GLY 56 28.418 -1.307 4.838 417 HA2 GLY 56 1HA GLY 56 28.299 -3.896 6.226 418 HA3 GLY 56 2HA GLY 56 29.150 -2.563 6.982 419 H ILE 57 HN ILE 57 26.534 -1.556 4.923 420 HA ILE 57 HA ILE 57 25.008 -0.847 7.296 421 HB ILE 57 HB ILE 57 23.851 0.695 5.860 422 HG12 ILE 57 2HG1 ILE 57 24.893 0.877 3.429 423 HG13 ILE 57 3HG1 ILE 57 25.205 -0.831 3.665 424 HG21 ILE 57 1HG2 ILE 57 26.653 0.742 6.399 425 HG22 ILE 57 2HG2 ILE 57 26.367 1.521 4.824 426 HG23 ILE 57 3HG2 ILE 57 25.511 2.102 6.272 427 HD11 ILE 57 3HD1 ILE 57 22.901 -1.357 3.912 428 HD12 ILE 57 1HD1 ILE 57 22.464 0.333 4.257 429 HD13 ILE 57 2HD1 ILE 57 22.927 -0.147 2.606 430 H ILE 58 HN ILE 58 22.543 -1.022 7.097 431 HA ILE 58 HA ILE 58 21.979 -3.735 6.224 432 HB ILE 58 HB ILE 58 20.642 -1.765 8.053 433 HG12 ILE 58 2HG1 ILE 58 22.580 -3.414 8.670 434 HG13 ILE 58 3HG1 ILE 58 21.223 -3.188 9.756 435 HG21 ILE 58 1HG2 ILE 58 19.449 -4.289 6.887 436 HG22 ILE 58 2HG2 ILE 58 18.861 -3.514 8.378 437 HG23 ILE 58 3HG2 ILE 58 18.795 -2.634 6.832 438 HD11 ILE 58 3HD1 ILE 58 21.553 -5.456 7.739 439 HD12 ILE 58 1HD1 ILE 58 21.672 -5.584 9.510 440 HD13 ILE 58 2HD1 ILE 58 20.108 -5.206 8.749 441 H TRP 59 HN TRP 59 20.339 -4.281 4.732 442 HA TRP 59 HA TRP 59 19.910 -2.260 2.741 443 HB2 TRP 59 2HB TRP 59 19.459 -5.195 2.991 444 HB3 TRP 59 3HB TRP 59 18.486 -4.315 1.829 445 HD1 TRP 59 HD1 TRP 59 21.412 -6.298 1.659 446 HE1 TRP 59 HE1 TRP 59 23.154 -5.642 -0.212 447 HE3 TRP 59 HE3 TRP 59 19.589 -1.618 0.865 448 HZ2 TRP 59 HZ2 TRP 59 23.565 -3.292 -1.778 449 HZ3 TRP 59 HZ3 TRP 59 20.719 -0.208 -0.853 450 HH2 TRP 59 HH2 TRP 59 22.642 -0.975 -2.151 451 H GLY 60 HN GLY 60 18.271 -0.793 2.883 452 HA2 GLY 60 1HA GLY 60 15.752 -1.684 4.147 453 HA3 GLY 60 2HA GLY 60 16.495 -0.151 4.559 454 H GLU 61 HN GLU 61 14.127 0.392 3.719 455 HA GLU 61 HA GLU 61 13.797 0.327 0.922 456 HB2 GLU 61 2HB GLU 61 12.329 2.017 2.995 457 HB3 GLU 61 3HB GLU 61 11.778 1.680 1.365 458 HG2 GLU 61 2HG GLU 61 11.641 -0.739 1.871 459 HG3 GLU 61 3HG GLU 61 12.305 -0.470 3.470 460 HE2 GLU 61 HE2 GLU 61 10.767 0.308 5.048 461 H ASP 62 HN ASP 62 15.344 2.501 3.218 462 HA ASP 62 HA ASP 62 15.191 4.802 1.627 463 HB2 ASP 62 2HB ASP 62 15.657 4.993 4.004 464 HB3 ASP 62 3HB ASP 62 17.041 3.925 3.883 465 HD2 ASP 62 HD2 ASP 62 17.207 7.765 3.500 466 H THR 63 HN THR 63 18.093 2.796 2.571 467 HA THR 63 HA THR 63 19.861 3.730 0.725 468 HB THR 63 HB THR 63 21.037 1.590 1.143 469 HG1 THR 63 HG1 THR 63 18.309 0.945 1.996 470 HG21 THR 63 1HG2 THR 63 19.816 1.479 3.751 471 HG22 THR 63 2HG2 THR 63 21.373 2.223 3.310 472 HG23 THR 63 3HG2 THR 63 19.879 3.190 3.261 473 H LEU 64 HN LEU 64 17.358 1.189 0.236 474 HA LEU 64 HA LEU 64 18.210 0.546 -2.365 475 HB2 LEU 64 2HB LEU 64 15.633 0.170 -0.853 476 HB3 LEU 64 3HB LEU 64 15.826 -0.362 -2.511 477 HG LEU 64 HG LEU 64 17.700 -1.256 -0.317 478 HD11 LEU 64 1HD1 LEU 64 16.044 -3.404 -0.777 479 HD12 LEU 64 2HD1 LEU 64 15.976 -2.316 0.629 480 HD13 LEU 64 3HD1 LEU 64 14.911 -2.031 -0.768 481 HD21 LEU 64 3HD2 LEU 64 18.787 -2.154 -2.033 482 HD22 LEU 64 1HD2 LEU 64 17.398 -3.245 -2.258 483 HD23 LEU 64 2HD2 LEU 64 17.488 -1.719 -3.170 484 H MET 65 HN MET 65 15.516 2.663 -1.153 485 HA MET 65 HA MET 65 14.563 3.498 -3.520 486 HB2 MET 65 2HB MET 65 13.524 4.206 -1.446 487 HB3 MET 65 3HB MET 65 15.002 4.947 -0.866 488 HG2 MET 65 2HG MET 65 13.272 6.608 -1.696 489 HG3 MET 65 3HG MET 65 14.835 6.762 -2.473 490 HE1 MET 65 3HE MET 65 10.830 5.709 -3.890 491 HE2 MET 65 1HE MET 65 11.586 4.105 -3.750 492 HE3 MET 65 2HE MET 65 11.565 5.204 -2.350 493 H GLU 66 HN GLU 66 17.670 4.318 -2.041 494 HA GLU 66 HA GLU 66 18.049 6.446 -3.964 495 HB2 GLU 66 2HB GLU 66 18.750 7.031 -1.743 496 HB3 GLU 66 3HB GLU 66 19.607 5.518 -1.525 497 HG2 GLU 66 2HG GLU 66 21.298 6.153 -3.177 498 HG3 GLU 66 3HG GLU 66 20.381 7.572 -3.646 499 HE2 GLU 66 HE2 GLU 66 21.578 6.297 -0.533 500 H TYR 67 HN TYR 67 18.815 3.079 -3.369 501 HA TYR 67 HA TYR 67 21.176 2.985 -4.954 502 HB2 TYR 67 2HB TYR 67 20.341 1.383 -3.103 503 HB3 TYR 67 3HB TYR 67 19.067 0.869 -4.193 504 HD1 TYR 67 HD2 TYR 67 22.731 1.461 -4.767 505 HD2 TYR 67 HD1 TYR 67 19.489 -1.330 -4.816 506 HE1 TYR 67 HE2 TYR 67 24.268 -0.318 -5.734 507 HE2 TYR 67 HE1 TYR 67 21.038 -3.100 -5.783 508 HH TYR 67 HH TYR 67 24.043 -2.347 -7.084 509 H LEU 68 HN LEU 68 17.758 1.861 -5.507 510 HA LEU 68 HA LEU 68 18.042 0.964 -8.055 511 HB2 LEU 68 2HB LEU 68 15.827 2.131 -6.458 512 HB3 LEU 68 3HB LEU 68 15.578 2.015 -8.189 513 HG LEU 68 HG LEU 68 14.650 0.080 -7.068 514 HD11 LEU 68 1HD1 LEU 68 16.774 -1.468 -8.204 515 HD12 LEU 68 2HD1 LEU 68 15.158 -1.114 -8.863 516 HD13 LEU 68 3HD1 LEU 68 16.517 -0.013 -9.198 517 HD21 LEU 68 3HD2 LEU 68 15.891 -1.447 -5.732 518 HD22 LEU 68 1HD2 LEU 68 17.429 -0.632 -6.108 519 HD23 LEU 68 2HD2 LEU 68 16.212 0.185 -5.098 520 H GLU 69 HN GLU 69 17.716 4.356 -6.910 521 HA GLU 69 HA GLU 69 17.309 5.547 -9.327 522 HB2 GLU 69 2HB GLU 69 17.196 6.711 -7.143 523 HB3 GLU 69 3HB GLU 69 18.932 6.568 -6.955 524 HG2 GLU 69 2HG GLU 69 18.115 8.823 -7.837 525 HG3 GLU 69 3HG GLU 69 19.370 8.058 -8.791 526 HE2 GLU 69 HE2 GLU 69 17.283 8.631 -11.479 527 H ASN 70 HN ASN 70 20.417 4.606 -7.733 528 HA ASN 70 HA ASN 70 21.608 4.362 -10.299 529 HB2 ASN 70 2HB ASN 70 22.419 6.589 -8.383 530 HB3 ASN 70 3HB ASN 70 23.601 5.898 -9.477 531 HD21 ASN 70 1HD2 ASN 70 22.937 5.741 -11.790 532 HD22 ASN 70 2HD2 ASN 70 22.069 7.068 -12.488 533 HA PRO 71 HA PRO 71 23.170 1.670 -6.972 534 HB2 PRO 71 2HB PRO 71 22.841 -0.716 -8.264 535 HB3 PRO 71 3HB PRO 71 21.635 -0.033 -7.193 536 HG2 PRO 71 2HG PRO 71 21.632 -0.158 -10.145 537 HG3 PRO 71 3HG PRO 71 20.287 0.120 -9.057 538 HD2 PRO 71 2HD PRO 71 21.661 2.089 -10.628 539 HD3 PRO 71 3HD PRO 71 20.394 2.383 -9.453 540 H LYS 72 HN LYS 72 24.185 2.723 -9.869 541 HA LYS 72 HA LYS 72 26.475 0.965 -10.021 542 HB2 LYS 72 2HB LYS 72 25.147 1.899 -12.008 543 HB3 LYS 72 3HB LYS 72 25.937 3.429 -11.688 544 HG2 LYS 72 2HG LYS 72 28.135 2.490 -12.062 545 HG3 LYS 72 3HG LYS 72 27.522 0.848 -12.018 546 HD2 LYS 72 2HD LYS 72 26.456 2.780 -14.096 547 HD3 LYS 72 3HD LYS 72 28.014 2.019 -14.348 548 HE2 LYS 72 2HE LYS 72 25.675 0.273 -13.556 549 HE3 LYS 72 3HE LYS 72 25.756 0.861 -15.206 550 HZ1 LYS 72 2HZ LYS 72 27.102 -0.924 -15.487 551 HZ3 LYS 72 1HZ LYS 72 27.443 -1.091 -13.903 552 H LYS 73 HN LYS 73 25.511 3.938 -8.486 553 HA LYS 73 HA LYS 73 28.289 4.769 -8.177 554 HB2 LYS 73 2HB LYS 73 27.508 6.875 -7.720 555 HB3 LYS 73 3HB LYS 73 26.246 6.299 -8.790 556 HG2 LYS 73 2HG LYS 73 24.958 5.537 -6.706 557 HG3 LYS 73 3HG LYS 73 26.161 6.369 -5.741 558 HD2 LYS 73 2HD LYS 73 25.642 8.488 -7.088 559 HD3 LYS 73 3HD LYS 73 24.303 7.619 -7.812 560 HE2 LYS 73 2HE LYS 73 23.344 8.804 -5.967 561 HE3 LYS 73 3HE LYS 73 23.467 7.143 -5.422 562 HZ1 LYS 73 2HZ LYS 73 24.452 9.194 -4.034 563 HZ3 LYS 73 1HZ LYS 73 25.793 8.805 -4.874 564 H TYR 74 HN TYR 74 25.411 3.661 -6.312 565 HA TYR 74 HA TYR 74 26.352 3.957 -3.768 566 HB2 TYR 74 2HB TYR 74 24.135 2.985 -4.871 567 HB3 TYR 74 3HB TYR 74 24.975 1.448 -4.881 568 HD1 TYR 74 HD1 TYR 74 26.229 1.065 -2.404 569 HD2 TYR 74 HD2 TYR 74 22.589 3.180 -3.164 570 HE1 TYR 74 HE1 TYR 74 25.477 0.645 -0.012 571 HE2 TYR 74 HE2 TYR 74 21.849 2.752 -0.769 572 HH TYR 74 HH TYR 74 23.115 2.326 1.455 573 H ILE 75 HN ILE 75 27.059 1.306 -6.119 574 HA ILE 75 HA ILE 75 29.337 0.605 -4.431 575 HB ILE 75 HB ILE 75 27.541 -1.494 -5.628 576 HG12 ILE 75 2HG1 ILE 75 27.493 -0.455 -2.779 577 HG13 ILE 75 3HG1 ILE 75 26.255 -0.165 -3.985 578 HG21 ILE 75 1HG2 ILE 75 28.900 -3.034 -4.679 579 HG22 ILE 75 2HG2 ILE 75 30.099 -1.729 -4.849 580 HG23 ILE 75 3HG2 ILE 75 29.293 -1.999 -3.285 581 HD11 ILE 75 3HD1 ILE 75 26.643 -2.963 -4.045 582 HD12 ILE 75 1HD1 ILE 75 26.688 -2.527 -2.320 583 HD13 ILE 75 2HD1 ILE 75 25.275 -2.094 -3.311 584 HA PRO 76 HA PRO 76 30.641 1.129 -8.659 585 HB2 PRO 76 2HB PRO 76 33.032 2.328 -8.100 586 HB3 PRO 76 3HB PRO 76 31.552 3.225 -8.376 587 HG2 PRO 76 2HG PRO 76 32.945 2.689 -5.825 588 HG3 PRO 76 3HG PRO 76 31.735 3.906 -6.180 589 HD2 PRO 76 2HD PRO 76 31.330 1.450 -4.757 590 HD3 PRO 76 3HD PRO 76 30.101 2.612 -5.213 591 H GLY 77 HN GLY 77 31.033 -0.801 -9.551 592 HA2 GLY 77 1HA GLY 77 32.958 -2.142 -10.193 593 HA3 GLY 77 2HA GLY 77 33.461 -2.141 -8.515 594 H THR 78 HN THR 78 30.041 -2.246 -8.704 595 HA THR 78 HA THR 78 30.025 -4.965 -7.784 596 HB THR 78 HB THR 78 28.578 -3.099 -6.874 597 HG1 THR 78 HG1 THR 78 26.778 -4.579 -6.816 598 HG21 THR 78 1HG2 THR 78 27.983 -1.960 -9.018 599 HG22 THR 78 2HG2 THR 78 27.170 -3.441 -9.576 600 HG23 THR 78 3HG2 THR 78 26.520 -2.538 -8.186 601 H LYS 79 HN LYS 79 28.437 -6.584 -8.700 602 HA LYS 79 HA LYS 79 28.988 -6.757 -11.538 603 HB2 LYS 79 2HB LYS 79 27.609 -8.835 -9.836 604 HB3 LYS 79 3HB LYS 79 28.483 -9.059 -11.337 605 HG2 LYS 79 2HG LYS 79 30.537 -8.062 -9.993 606 HG3 LYS 79 3HG LYS 79 29.594 -8.478 -8.575 607 HD2 LYS 79 2HD LYS 79 30.110 -10.507 -10.787 608 HD3 LYS 79 3HD LYS 79 31.262 -10.260 -9.489 609 HE2 LYS 79 2HE LYS 79 29.589 -10.863 -7.799 610 HE3 LYS 79 3HE LYS 79 28.317 -10.907 -9.002 611 HZ1 LYS 79 2HZ LYS 79 30.246 -12.930 -8.382 612 HZ3 LYS 79 1HZ LYS 79 30.203 -12.630 -9.982 613 H MET 80 HN MET 80 26.502 -5.660 -9.419 614 HA MET 80 HA MET 80 24.197 -6.414 -10.525 615 HB2 MET 80 2HB MET 80 24.417 -4.832 -8.615 616 HB3 MET 80 3HB MET 80 25.065 -3.596 -9.674 617 HG2 MET 80 2HG MET 80 22.850 -2.905 -9.650 618 HG3 MET 80 3HG MET 80 22.761 -4.014 -11.004 619 HE1 MET 80 3HE MET 80 19.732 -3.775 -9.446 620 HE2 MET 80 1HE MET 80 20.105 -3.879 -7.709 621 HE3 MET 80 2HE MET 80 20.977 -2.718 -8.738 622 H ILE 81 HN ILE 81 22.883 -5.884 -12.318 623 HA ILE 81 HA ILE 81 24.162 -4.149 -14.311 624 HB ILE 81 HB ILE 81 22.650 -6.689 -14.912 625 HG12 ILE 81 2HG1 ILE 81 24.767 -7.142 -13.685 626 HG13 ILE 81 3HG1 ILE 81 24.735 -7.790 -15.313 627 HG21 ILE 81 1HG2 ILE 81 22.507 -5.735 -16.925 628 HG22 ILE 81 2HG2 ILE 81 23.693 -4.472 -16.516 629 HG23 ILE 81 3HG2 ILE 81 24.249 -6.071 -17.067 630 HD11 ILE 81 3HD1 ILE 81 26.831 -6.380 -14.396 631 HD12 ILE 81 1HD1 ILE 81 26.330 -6.297 -16.102 632 HD13 ILE 81 2HD1 ILE 81 25.843 -5.015 -14.968 633 H PHE 82 HN PHE 82 22.955 -2.322 -14.329 634 HA PHE 82 HA PHE 82 20.264 -2.463 -15.139 635 HB2 PHE 82 2HB PHE 82 20.294 -3.054 -12.578 636 HB3 PHE 82 3HB PHE 82 20.822 -1.404 -12.310 637 HD1 PHE 82 HD1 PHE 82 18.189 -2.975 -14.457 638 HD2 PHE 82 HD2 PHE 82 19.125 -0.097 -11.482 639 HE1 PHE 82 HE1 PHE 82 15.798 -2.212 -14.442 640 HE2 PHE 82 HE2 PHE 82 16.733 0.666 -11.467 641 HZ PHE 82 HZ PHE 82 15.099 -0.402 -12.947 642 H VAL 83 HN VAL 83 19.231 -0.091 -14.825 643 HA VAL 83 HA VAL 83 21.418 1.794 -15.380 644 HB VAL 83 HB VAL 83 19.904 2.916 -16.906 645 HG11 VAL 83 1HG1 VAL 83 20.044 1.394 -18.702 646 HG12 VAL 83 2HG1 VAL 83 21.357 0.914 -17.599 647 HG13 VAL 83 3HG1 VAL 83 19.841 -0.018 -17.638 648 HG21 VAL 83 3HG2 VAL 83 17.744 1.766 -17.549 649 HG22 VAL 83 1HG2 VAL 83 17.931 0.763 -16.090 650 HG23 VAL 83 2HG2 VAL 83 17.756 2.527 -15.940 651 H GLY 84 HN GLY 84 17.989 1.507 -14.214 652 HA2 GLY 84 1HA GLY 84 17.886 2.397 -11.826 653 HA3 GLY 84 2HA GLY 84 18.465 3.889 -12.539 654 H ILE 85 HN ILE 85 15.911 3.500 -11.164 655 HA ILE 85 HA ILE 85 14.003 3.634 -13.373 656 HB ILE 85 HB ILE 85 13.641 3.323 -10.392 657 HG12 ILE 85 2HG1 ILE 85 12.790 1.304 -12.434 658 HG13 ILE 85 3HG1 ILE 85 14.489 1.407 -12.021 659 HG21 ILE 85 1HG2 ILE 85 11.224 2.854 -11.092 660 HG22 ILE 85 2HG2 ILE 85 11.759 4.551 -11.062 661 HG23 ILE 85 3HG2 ILE 85 11.630 3.686 -12.612 662 HD11 ILE 85 3HD1 ILE 85 12.314 1.211 -9.897 663 HD12 ILE 85 1HD1 ILE 85 13.097 -0.219 -10.611 664 HD13 ILE 85 2HD1 ILE 85 14.064 0.958 -9.692 665 H LYS 86 HN LYS 86 12.498 5.426 -13.526 666 HA LYS 86 HA LYS 86 13.768 7.892 -12.646 667 HB2 LYS 86 2HB LYS 86 12.916 7.261 -15.067 668 HB3 LYS 86 3HB LYS 86 11.365 7.785 -14.439 669 HG2 LYS 86 2HG LYS 86 12.299 9.771 -15.342 670 HG3 LYS 86 3HG LYS 86 12.596 9.923 -13.622 671 HD2 LYS 86 2HD LYS 86 14.902 8.796 -14.104 672 HD3 LYS 86 3HD LYS 86 14.574 9.125 -15.793 673 HE2 LYS 86 2HE LYS 86 14.988 11.103 -13.531 674 HE3 LYS 86 3HE LYS 86 15.806 11.028 -15.079 675 HZ1 LYS 86 2HZ LYS 86 14.311 12.616 -15.643 676 HZ3 LYS 86 1HZ LYS 86 13.274 12.263 -14.439 677 H LYS 87 HN LYS 87 10.337 6.711 -12.910 678 HA LYS 87 HA LYS 87 9.219 8.489 -11.197 679 HB2 LYS 87 2HB LYS 87 8.572 5.678 -12.001 680 HB3 LYS 87 3HB LYS 87 7.656 6.397 -10.692 681 HG2 LYS 87 2HG LYS 87 7.017 8.305 -12.119 682 HG3 LYS 87 3HG LYS 87 8.049 7.729 -13.413 683 HD2 LYS 87 2HD LYS 87 5.900 6.965 -14.051 684 HD3 LYS 87 3HD LYS 87 6.636 5.542 -13.340 685 HE2 LYS 87 2HE LYS 87 5.339 5.677 -11.374 686 HE3 LYS 87 3HE LYS 87 5.061 7.398 -11.546 687 HZ1 LYS 87 2HZ LYS 87 3.838 6.540 -13.733 688 HZ3 LYS 87 1HZ LYS 87 3.062 6.616 -12.303 689 H LYS 88 HN LYS 88 8.663 8.492 -8.933 690 HA LYS 88 HA LYS 88 10.787 7.324 -7.347 691 HB2 LYS 88 2HB LYS 88 8.566 9.141 -6.393 692 HB3 LYS 88 3HB LYS 88 10.122 8.845 -5.644 693 HG2 LYS 88 2HG LYS 88 9.599 10.303 -8.271 694 HG3 LYS 88 3HG LYS 88 10.222 10.997 -6.788 695 HD2 LYS 88 2HD LYS 88 12.253 9.513 -6.978 696 HD3 LYS 88 3HD LYS 88 11.637 8.897 -8.498 697 HE2 LYS 88 2HE LYS 88 12.262 11.837 -7.940 698 HE3 LYS 88 3HE LYS 88 13.318 10.741 -8.807 699 HZ1 LYS 88 2HZ LYS 88 10.743 11.848 -9.679 700 HZ3 LYS 88 1HZ LYS 88 11.178 10.391 -10.262 701 H GLU 89 HN GLU 89 7.154 7.437 -7.321 702 HA GLU 89 HA GLU 89 6.858 5.595 -5.310 703 HB2 GLU 89 2HB GLU 89 4.968 6.906 -5.969 704 HB3 GLU 89 3HB GLU 89 5.090 6.403 -7.643 705 HG2 GLU 89 2HG GLU 89 4.274 4.203 -7.172 706 HG3 GLU 89 3HG GLU 89 4.590 4.355 -5.455 707 HE2 GLU 89 HE2 GLU 89 1.225 4.647 -6.742 708 H GLU 90 HN GLU 90 7.415 5.172 -8.818 709 HA GLU 90 HA GLU 90 6.694 2.545 -9.049 710 HB2 GLU 90 2HB GLU 90 7.586 4.355 -10.788 711 HB3 GLU 90 3HB GLU 90 9.133 3.586 -10.494 712 HG2 GLU 90 2HG GLU 90 8.106 1.355 -11.060 713 HG3 GLU 90 3HG GLU 90 6.590 2.163 -11.411 714 HE2 GLU 90 HE2 GLU 90 9.568 1.512 -13.475 715 H ARG 91 HN ARG 91 9.274 3.961 -7.217 716 HA ARG 91 HA ARG 91 10.736 1.467 -7.220 717 HB2 ARG 91 2HB ARG 91 11.364 4.235 -6.090 718 HB3 ARG 91 3HB ARG 91 12.391 2.845 -5.800 719 HG2 ARG 91 2HG ARG 91 12.339 2.575 -8.433 720 HG3 ARG 91 3HG ARG 91 11.812 4.247 -8.427 721 HD2 ARG 91 2HD ARG 91 14.291 3.360 -6.892 722 HD3 ARG 91 3HD ARG 91 14.374 3.789 -8.589 723 HE ARG 91 HE ARG 91 14.048 5.625 -6.356 724 HH11 ARG 91 2HH2 ARG 91 13.312 5.188 -9.794 725 HH12 ARG 91 1HH2 ARG 91 13.192 6.886 -10.112 726 HH22 ARG 91 HH1 ARG 91 13.537 8.442 -8.323 727 H ALA 92 HN ALA 92 8.667 3.575 -5.240 728 HA ALA 92 HA ALA 92 9.275 2.407 -2.743 729 HB1 ALA 92 3HB ALA 92 6.608 3.439 -2.799 730 HB2 ALA 92 1HB ALA 92 8.072 4.200 -2.133 731 HB3 ALA 92 2HB ALA 92 7.614 4.483 -3.830 732 H ASP 93 HN ASP 93 7.535 1.316 -5.541 733 HA ASP 93 HA ASP 93 5.872 -0.442 -3.993 734 HB2 ASP 93 2HB ASP 93 6.269 -0.053 -6.995 735 HB3 ASP 93 3HB ASP 93 5.161 -1.234 -6.324 736 HD2 ASP 93 HD2 ASP 93 2.839 0.988 -6.901 737 H LEU 94 HN LEU 94 8.435 -0.617 -6.583 738 HA LEU 94 HA LEU 94 8.735 -3.392 -6.493 739 HB2 LEU 94 2HB LEU 94 9.465 -2.195 -8.390 740 HB3 LEU 94 3HB LEU 94 10.481 -1.131 -7.439 741 HG LEU 94 HG LEU 94 11.835 -3.248 -6.846 742 HD11 LEU 94 1HD1 LEU 94 11.753 -5.028 -8.571 743 HD12 LEU 94 2HD1 LEU 94 10.278 -4.935 -7.580 744 HD13 LEU 94 3HD1 LEU 94 10.281 -4.277 -9.235 745 HD21 LEU 94 3HD2 LEU 94 12.007 -2.496 -9.755 746 HD22 LEU 94 1HD2 LEU 94 12.393 -1.322 -8.474 747 HD23 LEU 94 2HD2 LEU 94 13.313 -2.841 -8.595 748 H ILE 95 HN ILE 95 9.974 -0.761 -4.463 749 HA ILE 95 HA ILE 95 11.922 -2.483 -3.217 750 HB ILE 95 HB ILE 95 11.030 0.347 -2.660 751 HG12 ILE 95 2HG1 ILE 95 13.644 -0.582 -3.860 752 HG13 ILE 95 3HG1 ILE 95 12.244 -0.215 -4.847 753 HG21 ILE 95 1HG2 ILE 95 13.531 -0.011 -1.521 754 HG22 ILE 95 2HG2 ILE 95 11.977 0.098 -0.659 755 HG23 ILE 95 3HG2 ILE 95 12.650 -1.495 -1.083 756 HD11 ILE 95 3HD1 ILE 95 13.688 1.772 -4.661 757 HD12 ILE 95 1HD1 ILE 95 12.139 2.075 -3.838 758 HD13 ILE 95 2HD1 ILE 95 13.593 1.697 -2.885 759 H ALA 96 HN ALA 96 8.545 -1.931 -3.018 760 HA ALA 96 HA ALA 96 8.392 -2.480 -0.181 761 HB1 ALA 96 3HB ALA 96 6.653 -1.459 -2.319 762 HB2 ALA 96 1HB ALA 96 5.832 -2.628 -1.256 763 HB3 ALA 96 2HB ALA 96 6.589 -1.174 -0.563 764 H TYR 97 HN TYR 97 7.924 -4.096 -3.351 765 HA TYR 97 HA TYR 97 6.907 -6.486 -2.118 766 HB2 TYR 97 2HB TYR 97 6.129 -6.028 -4.345 767 HB3 TYR 97 3HB TYR 97 7.678 -5.378 -4.846 768 HD1 TYR 97 HD2 TYR 97 6.954 -8.685 -3.253 769 HD2 TYR 97 HD1 TYR 97 8.215 -6.604 -6.772 770 HE1 TYR 97 HE2 TYR 97 7.530 -10.898 -4.365 771 HE2 TYR 97 HE1 TYR 97 8.787 -8.824 -7.872 772 HH TYR 97 HH TYR 97 8.084 -11.881 -6.231 773 H LEU 98 HN LEU 98 10.027 -5.230 -3.353 774 HA LEU 98 HA LEU 98 11.307 -7.767 -3.273 775 HB2 LEU 98 2HB LEU 98 12.190 -4.921 -3.617 776 HB3 LEU 98 3HB LEU 98 13.373 -6.189 -3.362 777 HG LEU 98 HG LEU 98 11.395 -5.975 -5.645 778 HD11 LEU 98 1HD1 LEU 98 13.217 -5.516 -7.043 779 HD12 LEU 98 2HD1 LEU 98 13.506 -4.526 -5.592 780 HD13 LEU 98 3HD1 LEU 98 14.404 -6.046 -5.827 781 HD21 LEU 98 3HD2 LEU 98 12.742 -8.314 -4.555 782 HD22 LEU 98 1HD2 LEU 98 11.466 -8.195 -5.791 783 HD23 LEU 98 2HD2 LEU 98 13.176 -8.019 -6.257 784 H LYS 99 HN LYS 99 10.747 -5.082 -0.997 785 HA LYS 99 HA LYS 99 12.642 -6.071 0.902 786 HB2 LYS 99 2HB LYS 99 11.916 -4.268 2.278 787 HB3 LYS 99 3HB LYS 99 12.006 -3.665 0.636 788 HG2 LYS 99 2HG LYS 99 9.536 -4.017 0.378 789 HG3 LYS 99 3HG LYS 99 9.451 -4.604 2.027 790 HD2 LYS 99 2HD LYS 99 10.620 -2.291 2.619 791 HD3 LYS 99 3HD LYS 99 10.026 -1.796 1.046 792 HE2 LYS 99 2HE LYS 99 8.363 -1.201 2.744 793 HE3 LYS 99 3HE LYS 99 7.702 -2.463 1.723 794 HZ1 LYS 99 2HZ LYS 99 7.343 -2.976 4.065 795 HZ3 LYS 99 1HZ LYS 99 8.938 -2.908 4.389 796 H LYS 100 HN LYS 100 9.187 -6.507 0.166 797 HA LYS 100 HA LYS 100 8.765 -7.918 2.656 798 HB2 LYS 100 2HB LYS 100 7.086 -6.346 1.576 799 HB3 LYS 100 3HB LYS 100 6.843 -7.567 0.344 800 HG2 LYS 100 2HG LYS 100 6.539 -9.169 2.486 801 HG3 LYS 100 3HG LYS 100 6.135 -7.658 3.275 802 HD2 LYS 100 2HD LYS 100 4.025 -8.227 2.498 803 HD3 LYS 100 3HD LYS 100 4.589 -7.321 1.108 804 HE2 LYS 100 2HE LYS 100 3.768 -9.317 0.137 805 HE3 LYS 100 3HE LYS 100 5.496 -9.603 0.215 806 HZ1 LYS 100 2HZ LYS 100 4.164 -10.413 2.624 807 HZ3 LYS 100 1HZ LYS 100 5.172 -11.273 1.677 808 H ALA 101 HN ALA 101 9.721 -8.533 -0.656 809 HA ALA 101 HA ALA 101 8.841 -11.222 -0.768 810 HB1 ALA 101 3HB ALA 101 10.858 -9.552 -2.301 811 HB2 ALA 101 1HB ALA 101 10.562 -11.267 -2.675 812 HB3 ALA 101 2HB ALA 101 9.241 -10.082 -2.820 813 H THR 102 HN THR 102 11.612 -9.524 0.637 814 HA THR 102 HA THR 102 12.896 -12.116 1.172 815 HB THR 102 HB THR 102 14.935 -10.794 1.442 816 HG1 THR 102 HG1 THR 102 14.031 -8.965 2.528 817 HG21 THR 102 1HG2 THR 102 13.319 -10.548 -0.973 818 HG22 THR 102 2HG2 THR 102 14.213 -9.034 -0.696 819 HG23 THR 102 3HG2 THR 102 15.093 -10.575 -0.827 820 H ASN 103 HN ASN 103 10.474 -10.601 2.513 821 HA ASN 103 HA ASN 103 11.641 -10.514 5.170 822 HB2 ASN 103 2HB ASN 103 10.331 -8.519 4.546 823 HB3 ASN 103 3HB ASN 103 8.969 -9.511 4.062 824 HD21 ASN 103 1HD2 ASN 103 7.440 -8.905 5.440 825 HD22 ASN 103 2HD2 ASN 103 7.514 -9.025 7.166 826 H GLU 104 HN GLU 104 8.870 -11.806 3.209 827 HA GLU 104 HA GLU 104 7.465 -13.171 4.976 828 HB2 GLU 104 2HB GLU 104 8.363 -13.990 2.192 829 HB3 GLU 104 3HB GLU 104 7.236 -14.973 3.105 830 HG2 GLU 104 2HG GLU 104 6.726 -12.000 2.783 831 HG3 GLU 104 3HG GLU 104 6.317 -13.100 1.482 832 HE2 GLU 104 HE2 GLU 104 4.597 -14.916 4.250 833 HHA HEC 500 HHA HEC 500 23.508 -6.850 -5.019 834 HHB HEC 500 HHB HEC 500 17.582 -4.590 -5.863 835 HHC HEC 500 HHC HEC 500 18.282 -5.881 -12.142 836 HHD HEC 500 HHD HEC 500 23.347 -9.545 -10.768 837 HMA1 HEC 500 1HMA HEC 500 18.115 -4.568 -3.601 838 HMA2 HEC 500 2HMA HEC 500 19.515 -4.616 -2.524 839 HMA3 HEC 500 3HMA HEC 500 19.343 -3.277 -3.673 840 HAA1 HEC 500 1HAA HEC 500 23.017 -5.204 -3.270 841 HAA2 HEC 500 2HAA HEC 500 21.558 -5.083 -2.423 842 HBA1 HEC 500 1HBA HEC 500 22.252 -7.810 -3.476 843 HBA2 HEC 500 2HBA HEC 500 23.181 -7.176 -2.103 844 HMB1 HEC 500 1HMB HEC 500 14.708 -4.763 -8.317 845 HMB2 HEC 500 2HMB HEC 500 15.539 -4.711 -6.778 846 HMB3 HEC 500 3HMB HEC 500 15.575 -3.275 -7.826 847 HAB HEC 500 HAB HEC 500 16.679 -4.457 -11.862 848 HBB1 HEC 500 1HBB HEC 500 14.358 -3.460 -10.373 849 HBB2 HEC 500 2HBB HEC 500 15.952 -2.713 -10.089 850 HBB3 HEC 500 3HBB HEC 500 15.271 -2.740 -11.702 851 HMC1 HEC 500 1HMC HEC 500 18.703 -8.632 -13.871 852 HMC2 HEC 500 2HMC HEC 500 18.844 -6.872 -14.000 853 HMC3 HEC 500 3HMC HEC 500 20.082 -7.890 -14.707 854 HAC HEC 500 HAC HEC 500 22.448 -10.387 -12.473 855 HBC1 HEC 500 1HBC HEC 500 21.637 -9.110 -15.082 856 HBC2 HEC 500 2HBC HEC 500 23.090 -8.657 -14.164 857 HBC3 HEC 500 3HBC HEC 500 22.930 -10.299 -14.782 858 HMD1 HEC 500 1HMD HEC 500 24.932 -10.974 -8.703 859 HMD2 HEC 500 2HMD HEC 500 25.486 -9.751 -9.860 860 HMD3 HEC 500 3HMD HEC 500 26.205 -9.865 -8.229 861 HAD1 HEC 500 1HAD HEC 500 25.187 -8.163 -5.066 862 HAD2 HEC 500 2HAD HEC 500 25.857 -9.388 -6.057 863 HBD1 HEC 500 1HBD HEC 500 26.567 -7.311 -7.602 864 HBD2 HEC 500 2HBD HEC 500 26.312 -6.414 -6.089 Start of MODEL 15 1 H1 GLY 1 HN GLY 1 0.619 1.096 -1.299 2 HA2 GLY 1 1HA GLY 1 2.094 1.405 -3.759 3 HA3 GLY 1 2HA GLY 1 3.107 1.082 -2.366 4 H ASP 2 HN ASP 2 1.054 -0.288 -4.773 5 HA ASP 2 HA ASP 2 0.297 -2.584 -3.326 6 HB2 ASP 2 2HB ASP 2 -0.647 -1.504 -5.562 7 HB3 ASP 2 3HB ASP 2 0.574 -2.488 -6.344 8 HD2 ASP 2 HD2 ASP 2 -2.002 -2.981 -3.971 9 H VAL 3 HN VAL 3 0.960 -4.828 -4.716 10 HA VAL 3 HA VAL 3 3.897 -4.790 -4.746 11 HB VAL 3 HB VAL 3 3.426 -6.212 -3.043 12 HG11 VAL 3 1HG1 VAL 3 0.886 -7.068 -4.472 13 HG12 VAL 3 2HG1 VAL 3 1.427 -7.656 -2.881 14 HG13 VAL 3 3HG1 VAL 3 1.002 -5.940 -3.099 15 HG21 VAL 3 3HG2 VAL 3 3.939 -8.372 -3.706 16 HG22 VAL 3 1HG2 VAL 3 2.892 -8.297 -5.143 17 HG23 VAL 3 2HG2 VAL 3 4.447 -7.430 -5.128 18 H GLU 4 HN GLU 4 0.954 -6.280 -6.259 19 HA GLU 4 HA GLU 4 2.154 -7.621 -8.258 20 HB2 GLU 4 2HB GLU 4 -0.486 -6.191 -8.010 21 HB3 GLU 4 3HB GLU 4 -0.042 -6.829 -9.580 22 HG2 GLU 4 2HG GLU 4 0.207 -8.587 -7.121 23 HG3 GLU 4 3HG GLU 4 -1.363 -8.356 -7.867 24 HE2 GLU 4 HE2 GLU 4 -1.293 -10.638 -8.746 25 H LYS 5 HN LYS 5 1.553 -4.097 -8.010 26 HA LYS 5 HA LYS 5 2.183 -3.492 -10.680 27 HB2 LYS 5 2HB LYS 5 2.013 -1.925 -8.116 28 HB3 LYS 5 3HB LYS 5 2.643 -1.171 -9.567 29 HG2 LYS 5 2HG LYS 5 0.147 -0.871 -9.248 30 HG3 LYS 5 3HG LYS 5 0.591 -1.577 -10.789 31 HD2 LYS 5 2HD LYS 5 0.082 -3.848 -9.935 32 HD3 LYS 5 3HD LYS 5 -0.268 -3.198 -8.345 33 HE2 LYS 5 2HE LYS 5 -1.826 -2.714 -10.922 34 HE3 LYS 5 3HE LYS 5 -2.390 -3.533 -9.478 35 HZ1 LYS 5 2HZ LYS 5 -3.141 -1.522 -8.843 36 HZ3 LYS 5 1HZ LYS 5 -2.335 -0.728 -10.015 37 H GLY 6 HN GLY 6 4.122 -4.032 -7.733 38 HA2 GLY 6 1HA GLY 6 6.562 -3.168 -9.080 39 HA3 GLY 6 2HA GLY 6 6.380 -3.664 -7.410 40 H LYS 7 HN LYS 7 4.622 -6.010 -8.790 41 HA LYS 7 HA LYS 7 6.787 -7.875 -8.702 42 HB2 LYS 7 2HB LYS 7 4.431 -8.235 -7.823 43 HB3 LYS 7 3HB LYS 7 3.911 -8.391 -9.489 44 HG2 LYS 7 2HG LYS 7 4.987 -10.428 -9.790 45 HG3 LYS 7 3HG LYS 7 6.298 -10.025 -8.701 46 HD2 LYS 7 2HD LYS 7 5.096 -10.652 -6.782 47 HD3 LYS 7 3HD LYS 7 3.537 -10.356 -7.527 48 HE2 LYS 7 2HE LYS 7 4.232 -12.352 -9.138 49 HE3 LYS 7 3HE LYS 7 5.370 -12.746 -7.866 50 HZ1 LYS 7 2HZ LYS 7 3.626 -13.117 -6.354 51 HZ3 LYS 7 1HZ LYS 7 3.029 -13.756 -7.727 52 H LYS 8 HN LYS 8 5.199 -5.927 -11.127 53 HA LYS 8 HA LYS 8 6.158 -7.661 -13.261 54 HB2 LYS 8 2HB LYS 8 4.483 -5.135 -13.367 55 HB3 LYS 8 3HB LYS 8 4.881 -6.160 -14.731 56 HG2 LYS 8 2HG LYS 8 3.303 -7.025 -12.261 57 HG3 LYS 8 3HG LYS 8 2.621 -6.684 -13.838 58 HD2 LYS 8 2HD LYS 8 4.287 -8.514 -14.720 59 HD3 LYS 8 3HD LYS 8 4.440 -8.983 -13.038 60 HE2 LYS 8 2HE LYS 8 1.896 -8.954 -14.720 61 HE3 LYS 8 3HE LYS 8 2.690 -10.351 -14.021 62 HZ1 LYS 8 2HZ LYS 8 1.982 -9.753 -11.885 63 HZ3 LYS 8 1HZ LYS 8 0.687 -9.335 -12.780 64 H ILE 9 HN ILE 9 7.016 -4.824 -11.411 65 HA ILE 9 HA ILE 9 8.852 -3.912 -13.470 66 HB ILE 9 HB ILE 9 8.025 -2.827 -10.783 67 HG12 ILE 9 2HG1 ILE 9 7.722 -1.351 -13.361 68 HG13 ILE 9 3HG1 ILE 9 6.643 -2.702 -13.070 69 HG21 ILE 9 1HG2 ILE 9 10.032 -1.849 -10.687 70 HG22 ILE 9 2HG2 ILE 9 10.419 -2.258 -12.376 71 HG23 ILE 9 3HG2 ILE 9 9.441 -0.816 -12.010 72 HD11 ILE 9 3HD1 ILE 9 5.383 -1.190 -11.916 73 HD12 ILE 9 1HD1 ILE 9 6.580 -1.413 -10.617 74 HD13 ILE 9 2HD1 ILE 9 6.742 -0.051 -11.752 75 H PHE 10 HN PHE 10 8.719 -6.085 -10.789 76 HA PHE 10 HA PHE 10 11.509 -5.804 -10.132 77 HB2 PHE 10 2HB PHE 10 10.008 -6.420 -8.336 78 HB3 PHE 10 3HB PHE 10 9.113 -7.530 -9.354 79 HD1 PHE 10 HD1 PHE 10 12.222 -7.076 -7.435 80 HD2 PHE 10 HD2 PHE 10 9.810 -9.805 -9.613 81 HE1 PHE 10 HE1 PHE 10 13.579 -8.989 -6.542 82 HE2 PHE 10 HE2 PHE 10 11.168 -11.717 -8.720 83 HZ PHE 10 HZ PHE 10 13.036 -11.286 -7.196 84 H ILE 11 HN ILE 11 9.441 -7.746 -12.253 85 HA ILE 11 HA ILE 11 11.480 -9.754 -12.623 86 HB ILE 11 HB ILE 11 8.735 -9.292 -13.774 87 HG12 ILE 11 2HG1 ILE 11 9.893 -11.373 -11.899 88 HG13 ILE 11 3HG1 ILE 11 8.759 -10.102 -11.488 89 HG21 ILE 11 1HG2 ILE 11 10.308 -10.241 -15.487 90 HG22 ILE 11 2HG2 ILE 11 10.537 -11.638 -14.408 91 HG23 ILE 11 3HG2 ILE 11 8.925 -11.280 -15.071 92 HD11 ILE 11 3HD1 ILE 11 8.293 -12.656 -12.994 93 HD12 ILE 11 1HD1 ILE 11 7.249 -11.823 -11.817 94 HD13 ILE 11 2HD1 ILE 11 7.346 -11.235 -13.495 95 H MET 12 HN MET 12 9.686 -7.585 -14.927 96 HA MET 12 HA MET 12 11.210 -7.816 -17.058 97 HB2 MET 12 2HB MET 12 9.836 -5.449 -15.761 98 HB3 MET 12 3HB MET 12 10.816 -5.127 -17.178 99 HG2 MET 12 2HG MET 12 8.597 -7.229 -17.087 100 HG3 MET 12 3HG MET 12 8.374 -5.600 -17.692 101 HE1 MET 12 3HE MET 12 9.441 -5.518 -21.064 102 HE2 MET 12 1HE MET 12 8.918 -4.707 -19.569 103 HE3 MET 12 2HE MET 12 10.651 -4.837 -19.950 104 H LYS 13 HN LYS 13 12.171 -6.227 -14.032 105 HA LYS 13 HA LYS 13 14.651 -5.336 -15.305 106 HB2 LYS 13 2HB LYS 13 13.049 -4.427 -12.958 107 HB3 LYS 13 3HB LYS 13 14.790 -4.269 -12.847 108 HG2 LYS 13 2HG LYS 13 14.917 -2.760 -14.642 109 HG3 LYS 13 3HG LYS 13 13.456 -3.367 -15.398 110 HD2 LYS 13 2HD LYS 13 12.750 -1.292 -14.526 111 HD3 LYS 13 3HD LYS 13 12.212 -2.420 -13.296 112 HE2 LYS 13 2HE LYS 13 13.298 -0.893 -11.926 113 HE3 LYS 13 3HE LYS 13 14.651 -1.951 -12.272 114 HZ1 LYS 13 2HZ LYS 13 14.058 0.667 -13.508 115 HZ3 LYS 13 1HZ LYS 13 15.061 -0.382 -14.247 116 H CYS 14 HN CYS 14 13.532 -6.883 -12.207 117 HA CYS 14 HA CYS 14 16.110 -8.236 -12.123 118 HB2 CYS 14 2HB CYS 14 14.140 -8.431 -9.894 119 HB3 CYS 14 3HB CYS 14 15.892 -8.416 -9.850 120 H SER 15 HN SER 15 15.113 -9.485 -14.093 121 HA SER 15 HA SER 15 13.292 -11.530 -13.113 122 HB2 SER 15 2HB SER 15 12.273 -10.748 -15.036 123 HB3 SER 15 3HB SER 15 13.783 -10.257 -15.775 124 HG SER 15 HG SER 15 12.479 -12.780 -15.817 125 H GLN 16 HN GLN 16 13.816 -13.783 -13.398 126 HA GLN 16 HA GLN 16 15.273 -15.409 -13.105 127 HB2 GLN 16 2HB GLN 16 15.998 -14.395 -15.884 128 HB3 GLN 16 3HB GLN 16 16.567 -15.926 -15.253 129 HG2 GLN 16 2HG GLN 16 14.200 -16.662 -14.901 130 HG3 GLN 16 3HG GLN 16 13.631 -15.129 -15.532 131 HE21 GLN 16 1HE2 GLN 16 12.500 -16.328 -17.118 132 HE22 GLN 16 2HE2 GLN 16 13.287 -16.926 -18.540 133 H CYS 17 HN CYS 17 16.206 -12.937 -11.888 134 HA CYS 17 HA CYS 17 19.074 -13.467 -12.059 135 HB2 CYS 17 2HB CYS 17 17.668 -10.866 -12.403 136 HB3 CYS 17 3HB CYS 17 19.140 -10.860 -11.451 137 H HIS 18 HN HIS 18 16.764 -11.325 -10.224 138 HA HIS 18 HA HIS 18 17.943 -12.366 -7.772 139 HB2 HIS 18 2HB HIS 18 16.517 -9.844 -8.533 140 HB3 HIS 18 3HB HIS 18 16.443 -10.378 -6.866 141 HD1 HIS 18 HD1 HIS 18 18.966 -10.894 -5.771 142 HD2 HIS 18 HD2 HIS 18 18.740 -8.357 -9.104 143 HE1 HIS 18 HE1 HIS 18 21.143 -9.563 -5.805 144 H THR 19 HN THR 19 16.934 -14.090 -6.877 145 HA THR 19 HA THR 19 14.122 -14.525 -7.478 146 HB THR 19 HB THR 19 14.749 -16.686 -6.107 147 HG1 THR 19 HG1 THR 19 17.228 -16.823 -6.316 148 HG21 THR 19 1HG2 THR 19 14.905 -16.200 -8.790 149 HG22 THR 19 2HG2 THR 19 16.632 -16.449 -8.438 150 HG23 THR 19 3HG2 THR 19 15.455 -17.730 -8.065 151 H VAL 20 HN VAL 20 12.628 -15.202 -5.691 152 HA VAL 20 HA VAL 20 13.262 -13.821 -3.193 153 HB VAL 20 HB VAL 20 11.345 -12.536 -3.197 154 HG11 VAL 20 1HG1 VAL 20 11.663 -11.092 -4.946 155 HG12 VAL 20 2HG1 VAL 20 13.125 -12.090 -5.131 156 HG13 VAL 20 3HG1 VAL 20 11.706 -12.392 -6.162 157 HG21 VAL 20 3HG2 VAL 20 9.629 -12.914 -5.197 158 HG22 VAL 20 1HG2 VAL 20 10.293 -14.564 -5.128 159 HG23 VAL 20 2HG2 VAL 20 9.531 -13.851 -3.686 160 H GLU 21 HN GLU 21 12.969 -16.687 -4.434 161 HA GLU 21 HA GLU 21 10.766 -17.624 -2.821 162 HB2 GLU 21 2HB GLU 21 12.614 -19.085 -4.759 163 HB3 GLU 21 3HB GLU 21 11.272 -19.834 -3.917 164 HG2 GLU 21 2HG GLU 21 10.743 -17.318 -5.505 165 HG3 GLU 21 3HG GLU 21 10.976 -18.818 -6.380 166 HE2 GLU 21 HE2 GLU 21 8.187 -20.362 -4.924 167 H LYS 22 HN LYS 22 10.995 -19.007 -1.013 168 HA LYS 22 HA LYS 22 13.256 -18.649 0.544 169 HB2 LYS 22 2HB LYS 22 10.862 -19.323 1.198 170 HB3 LYS 22 3HB LYS 22 11.339 -20.967 0.822 171 HG2 LYS 22 2HG LYS 22 13.050 -19.262 2.664 172 HG3 LYS 22 3HG LYS 22 11.628 -20.077 3.285 173 HD2 LYS 22 2HD LYS 22 12.697 -22.193 2.026 174 HD3 LYS 22 3HD LYS 22 14.179 -21.272 2.194 175 HE2 LYS 22 2HE LYS 22 12.373 -22.355 4.380 176 HE3 LYS 22 3HE LYS 22 14.095 -22.600 4.170 177 HZ1 LYS 22 2HZ LYS 22 14.477 -20.294 4.767 178 HZ3 LYS 22 1HZ LYS 22 13.557 -20.964 5.933 179 H GLY 23 HN GLY 23 12.202 -21.643 -1.233 180 HA2 GLY 23 1HA GLY 23 14.733 -22.917 -0.802 181 HA3 GLY 23 2HA GLY 23 13.399 -23.485 -1.787 182 H GLY 24 HN GLY 24 13.602 -20.476 -2.970 183 HA2 GLY 24 1HA GLY 24 14.576 -21.011 -5.427 184 HA3 GLY 24 2HA GLY 24 14.691 -19.438 -4.661 185 H LYS 25 HN LYS 25 16.565 -21.035 -6.511 186 HA LYS 25 HA LYS 25 18.897 -21.094 -4.733 187 HB2 LYS 25 2HB LYS 25 19.833 -22.743 -6.060 188 HB3 LYS 25 3HB LYS 25 18.134 -23.172 -6.082 189 HG2 LYS 25 2HG LYS 25 17.881 -21.911 -8.259 190 HG3 LYS 25 3HG LYS 25 19.604 -21.591 -8.245 191 HD2 LYS 25 2HD LYS 25 20.046 -24.068 -8.213 192 HD3 LYS 25 3HD LYS 25 18.320 -24.363 -8.283 193 HE2 LYS 25 2HE LYS 25 18.128 -23.464 -10.491 194 HE3 LYS 25 3HE LYS 25 19.666 -22.629 -10.384 195 HZ1 LYS 25 2HZ LYS 25 20.793 -24.522 -10.911 196 HZ3 LYS 25 1HZ LYS 25 19.381 -25.011 -11.558 197 H HIS 26 HN HIS 26 20.984 -20.325 -5.790 198 HA HIS 26 HA HIS 26 20.507 -17.715 -6.785 199 HB2 HIS 26 2HB HIS 26 23.064 -19.298 -6.415 200 HB3 HIS 26 3HB HIS 26 23.000 -17.602 -6.854 201 HD1 HIS 26 HD1 HIS 26 21.110 -16.324 -4.948 202 HD2 HIS 26 HD2 HIS 26 23.654 -19.442 -3.765 203 HE1 HIS 26 HE1 HIS 26 21.343 -16.133 -2.415 204 H LYS 27 HN LYS 27 20.199 -17.101 -8.864 205 HA LYS 27 HA LYS 27 20.895 -19.056 -10.926 206 HB2 LYS 27 2HB LYS 27 18.783 -16.960 -10.639 207 HB3 LYS 27 3HB LYS 27 19.371 -17.312 -12.251 208 HG2 LYS 27 2HG LYS 27 18.574 -19.511 -12.226 209 HG3 LYS 27 3HG LYS 27 18.714 -19.660 -10.486 210 HD2 LYS 27 2HD LYS 27 16.341 -19.558 -11.094 211 HD3 LYS 27 3HD LYS 27 16.765 -18.114 -10.198 212 HE2 LYS 27 2HE LYS 27 15.486 -17.321 -12.056 213 HE3 LYS 27 3HE LYS 27 17.150 -16.959 -12.473 214 HZ1 LYS 27 2HZ LYS 27 15.557 -18.265 -14.123 215 HZ3 LYS 27 1HZ LYS 27 16.130 -19.563 -13.326 216 H THR 28 HN THR 28 20.397 -15.660 -11.707 217 HA THR 28 HA THR 28 23.112 -15.555 -12.726 218 HB THR 28 HB THR 28 20.892 -13.463 -12.898 219 HG1 THR 28 HG1 THR 28 19.994 -15.382 -13.735 220 HG21 THR 28 1HG2 THR 28 22.302 -13.878 -15.343 221 HG22 THR 28 2HG2 THR 28 22.396 -12.449 -14.287 222 HG23 THR 28 3HG2 THR 28 23.546 -13.792 -14.074 223 H GLY 29 HN GLY 29 21.448 -14.741 -9.835 224 HA2 GLY 29 1HA GLY 29 23.812 -13.400 -8.844 225 HA3 GLY 29 2HA GLY 29 22.397 -12.373 -8.969 226 HA PRO 30 HA PRO 30 22.105 -14.574 -5.002 227 HB2 PRO 30 2HB PRO 30 21.948 -12.390 -3.366 228 HB3 PRO 30 3HB PRO 30 23.449 -13.227 -3.707 229 HG2 PRO 30 2HG PRO 30 22.497 -10.630 -4.750 230 HG3 PRO 30 3HG PRO 30 24.127 -11.274 -4.730 231 HD2 PRO 30 2HD PRO 30 22.361 -11.139 -6.987 232 HD3 PRO 30 3HD PRO 30 23.945 -11.887 -6.939 233 H ASN 31 HN ASN 31 20.298 -15.098 -3.744 234 HA ASN 31 HA ASN 31 17.930 -14.164 -5.027 235 HB2 ASN 31 2HB ASN 31 17.958 -16.505 -4.428 236 HB3 ASN 31 3HB ASN 31 18.526 -16.166 -2.804 237 HD21 ASN 31 1HD2 ASN 31 15.953 -17.134 -4.499 238 HD22 ASN 31 2HD2 ASN 31 14.639 -16.596 -3.508 239 H LEU 32 HN LEU 32 16.545 -12.568 -4.187 240 HA LEU 32 HA LEU 32 17.388 -11.299 -1.719 241 HB2 LEU 32 2HB LEU 32 15.777 -10.553 -4.098 242 HB3 LEU 32 3HB LEU 32 15.335 -9.800 -2.579 243 HG LEU 32 HG LEU 32 17.282 -8.588 -2.431 244 HD11 LEU 32 1HD1 LEU 32 19.302 -9.319 -4.013 245 HD12 LEU 32 2HD1 LEU 32 19.063 -9.998 -2.384 246 HD13 LEU 32 3HD1 LEU 32 18.528 -10.910 -3.816 247 HD21 LEU 32 3HD2 LEU 32 17.889 -8.301 -5.143 248 HD22 LEU 32 1HD2 LEU 32 16.174 -8.781 -5.103 249 HD23 LEU 32 2HD2 LEU 32 16.721 -7.353 -4.190 250 H HIS 33 HN HIS 33 16.787 -13.036 -0.260 251 HA HIS 33 HA HIS 33 13.892 -13.387 -0.051 252 HB2 HIS 33 2HB HIS 33 14.973 -15.479 -0.328 253 HB3 HIS 33 3HB HIS 33 16.231 -15.082 0.826 254 HD1 HIS 33 HD1 HIS 33 12.872 -16.602 0.559 255 HD2 HIS 33 HD2 HIS 33 15.324 -15.079 3.603 256 HE1 HIS 33 HE1 HIS 33 11.903 -17.464 2.756 257 H GLY 34 HN GLY 34 16.885 -12.908 1.952 258 HA2 GLY 34 1HA GLY 34 15.188 -11.798 4.087 259 HA3 GLY 34 2HA GLY 34 16.829 -12.392 4.251 260 H LEU 35 HN LEU 35 15.743 -10.304 1.548 261 HA LEU 35 HA LEU 35 17.796 -8.583 1.557 262 HB2 LEU 35 2HB LEU 35 16.000 -8.690 -0.106 263 HB3 LEU 35 3HB LEU 35 14.898 -7.920 1.018 264 HG LEU 35 HG LEU 35 16.328 -5.891 1.011 265 HD11 LEU 35 1HD1 LEU 35 18.444 -6.075 0.359 266 HD12 LEU 35 2HD1 LEU 35 18.147 -7.661 -0.393 267 HD13 LEU 35 3HD1 LEU 35 17.847 -6.168 -1.315 268 HD21 LEU 35 3HD2 LEU 35 15.921 -5.926 -1.813 269 HD22 LEU 35 1HD2 LEU 35 14.610 -6.852 -1.043 270 HD23 LEU 35 2HD2 LEU 35 14.925 -5.172 -0.545 271 H PHE 36 HN PHE 36 14.654 -7.509 3.012 272 HA PHE 36 HA PHE 36 15.843 -5.491 4.503 273 HB2 PHE 36 2HB PHE 36 13.263 -7.134 4.621 274 HB3 PHE 36 3HB PHE 36 13.553 -5.894 5.825 275 HD1 PHE 36 HD2 PHE 36 13.268 -6.431 2.163 276 HD2 PHE 36 HD1 PHE 36 13.068 -3.649 5.361 277 HE1 PHE 36 HE2 PHE 36 12.351 -4.697 0.596 278 HE2 PHE 36 HE1 PHE 36 12.151 -1.915 3.795 279 HZ PHE 36 HZ PHE 36 11.803 -2.459 1.432 280 H GLY 37 HN GLY 37 17.368 -5.771 6.069 281 HA2 GLY 37 1HA GLY 37 17.845 -6.301 8.297 282 HA3 GLY 37 2HA GLY 37 16.747 -7.665 8.224 283 H ARG 38 HN ARG 38 19.256 -6.793 5.782 284 HA ARG 38 HA ARG 38 20.891 -8.951 6.752 285 HB2 ARG 38 2HB ARG 38 19.462 -10.120 5.147 286 HB3 ARG 38 3HB ARG 38 19.675 -8.859 3.949 287 HG2 ARG 38 2HG ARG 38 21.962 -9.455 3.551 288 HG3 ARG 38 3HG ARG 38 22.069 -10.386 5.031 289 HD2 ARG 38 2HD ARG 38 20.553 -11.111 2.489 290 HD3 ARG 38 3HD ARG 38 21.883 -11.982 3.224 291 HE ARG 38 HE ARG 38 19.086 -12.197 3.945 292 HH11 ARG 38 2HH2 ARG 38 22.349 -12.359 5.318 293 HH12 ARG 38 1HH2 ARG 38 21.879 -13.386 6.631 294 HH22 ARG 38 HH1 ARG 38 19.592 -14.076 6.821 295 H LYS 39 HN LYS 39 23.097 -8.524 6.404 296 HA LYS 39 HA LYS 39 23.737 -5.925 5.422 297 HB2 LYS 39 2HB LYS 39 25.152 -8.162 6.784 298 HB3 LYS 39 3HB LYS 39 26.139 -7.081 5.822 299 HG2 LYS 39 2HG LYS 39 25.512 -5.162 7.101 300 HG3 LYS 39 3HG LYS 39 24.105 -5.958 7.778 301 HD2 LYS 39 2HD LYS 39 26.939 -6.929 8.340 302 HD3 LYS 39 3HD LYS 39 26.163 -5.707 9.327 303 HE2 LYS 39 2HE LYS 39 24.172 -7.548 9.350 304 HE3 LYS 39 3HE LYS 39 25.516 -8.636 9.068 305 HZ1 LYS 39 2HZ LYS 39 25.392 -6.680 11.302 306 HZ3 LYS 39 1HZ LYS 39 26.600 -7.742 11.051 307 H THR 40 HN THR 40 25.644 -5.681 3.809 308 HA THR 40 HA THR 40 24.829 -7.042 1.403 309 HB THR 40 HB THR 40 26.649 -5.442 0.476 310 HG1 THR 40 HG1 THR 40 27.106 -3.800 2.278 311 HG21 THR 40 1HG2 THR 40 24.458 -4.500 0.330 312 HG22 THR 40 2HG2 THR 40 24.255 -4.486 2.099 313 HG23 THR 40 3HG2 THR 40 25.345 -3.314 1.320 314 H GLY 41 HN GLY 41 25.699 -8.805 0.504 315 HA2 GLY 41 1HA GLY 41 27.287 -10.330 -0.053 316 HA3 GLY 41 2HA GLY 41 28.484 -9.429 0.856 317 H GLN 42 HN GLN 42 25.305 -10.675 2.041 318 HA GLN 42 HA GLN 42 26.826 -12.186 4.006 319 HB2 GLN 42 2HB GLN 42 23.885 -11.384 4.092 320 HB3 GLN 42 3HB GLN 42 24.805 -12.102 5.400 321 HG2 GLN 42 2HG GLN 42 25.649 -9.469 4.122 322 HG3 GLN 42 3HG GLN 42 24.483 -9.520 5.429 323 HE21 GLN 42 1HE2 GLN 42 27.709 -9.363 4.604 324 HE22 GLN 42 2HE2 GLN 42 28.445 -9.728 6.128 325 H ALA 43 HN ALA 43 24.753 -12.439 1.214 326 HA ALA 43 HA ALA 43 23.297 -14.660 1.507 327 HB1 ALA 43 3HB ALA 43 24.994 -13.611 -0.757 328 HB2 ALA 43 1HB ALA 43 24.104 -15.141 -0.949 329 HB3 ALA 43 2HB ALA 43 23.221 -13.638 -0.592 330 HA PRO 44 HA PRO 44 26.495 -17.447 2.789 331 HB2 PRO 44 2HB PRO 44 24.876 -19.143 4.194 332 HB3 PRO 44 3HB PRO 44 25.645 -17.740 4.909 333 HG2 PRO 44 2HG PRO 44 22.816 -18.109 4.133 334 HG3 PRO 44 3HG PRO 44 23.513 -16.918 5.213 335 HD2 PRO 44 2HD PRO 44 22.646 -16.488 2.513 336 HD3 PRO 44 3HD PRO 44 23.447 -15.327 3.554 337 H GLY 45 HN GLY 45 26.122 -17.541 0.231 338 HA2 GLY 45 1HA GLY 45 26.119 -20.347 -0.301 339 HA3 GLY 45 2HA GLY 45 24.645 -19.585 -0.863 340 H TYR 46 HN TYR 46 25.707 -16.973 -1.534 341 HA TYR 46 HA TYR 46 27.619 -17.666 -3.657 342 HB2 TYR 46 2HB TYR 46 25.102 -17.408 -4.300 343 HB3 TYR 46 3HB TYR 46 25.211 -15.747 -3.752 344 HD1 TYR 46 HD1 TYR 46 27.835 -17.597 -5.644 345 HD2 TYR 46 HD2 TYR 46 24.788 -14.596 -5.781 346 HE1 TYR 46 HE1 TYR 46 28.632 -16.883 -7.949 347 HE2 TYR 46 HE2 TYR 46 25.596 -13.893 -8.087 348 HH TYR 46 HH TYR 46 26.822 -15.047 -9.992 349 H SER 47 HN SER 47 29.434 -16.450 -3.532 350 HA SER 47 HA SER 47 29.350 -14.131 -1.840 351 HB2 SER 47 2HB SER 47 31.548 -15.738 -3.168 352 HB3 SER 47 3HB SER 47 31.901 -14.154 -2.507 353 HG SER 47 HG SER 47 32.296 -15.777 -0.918 354 H TYR 48 HN TYR 48 29.735 -11.976 -2.540 355 HA TYR 48 HA TYR 48 29.368 -11.593 -5.408 356 HB2 TYR 48 2HB TYR 48 29.463 -9.583 -3.084 357 HB3 TYR 48 3HB TYR 48 28.690 -9.339 -4.638 358 HD1 TYR 48 HD2 TYR 48 27.627 -12.441 -4.334 359 HD2 TYR 48 HD1 TYR 48 27.257 -8.795 -2.126 360 HE1 TYR 48 HE2 TYR 48 25.421 -13.245 -3.361 361 HE2 TYR 48 HE1 TYR 48 25.051 -9.612 -1.161 362 HH TYR 48 HH TYR 48 23.738 -11.351 -0.901 363 H THR 49 HN THR 49 30.443 -9.103 -5.837 364 HA THR 49 HA THR 49 33.166 -9.696 -6.199 365 HB THR 49 HB THR 49 33.169 -7.213 -6.890 366 HG1 THR 49 HG1 THR 49 30.940 -6.322 -6.789 367 HG21 THR 49 1HG2 THR 49 32.021 -7.630 -8.883 368 HG22 THR 49 2HG2 THR 49 32.182 -9.306 -8.305 369 HG23 THR 49 3HG2 THR 49 30.660 -8.419 -8.049 370 H ALA 50 HN ALA 50 34.948 -8.084 -5.479 371 HA ALA 50 HA ALA 50 34.997 -8.255 -2.621 372 HB1 ALA 50 3HB ALA 50 36.894 -7.514 -4.836 373 HB2 ALA 50 1HB ALA 50 37.282 -7.027 -3.169 374 HB3 ALA 50 2HB ALA 50 37.060 -8.748 -3.564 375 H ALA 51 HN ALA 51 33.881 -5.978 -4.960 376 HA ALA 51 HA ALA 51 34.348 -3.704 -3.206 377 HB1 ALA 51 3HB ALA 51 33.273 -4.066 -6.021 378 HB2 ALA 51 1HB ALA 51 33.200 -2.508 -5.165 379 HB3 ALA 51 2HB ALA 51 34.776 -3.263 -5.507 380 H ASN 52 HN ASN 52 32.023 -6.189 -3.804 381 HA ASN 52 HA ASN 52 29.878 -4.513 -2.816 382 HB2 ASN 52 2HB ASN 52 29.699 -6.205 -4.830 383 HB3 ASN 52 3HB ASN 52 29.650 -7.451 -3.599 384 HD21 ASN 52 1HD2 ASN 52 28.116 -6.902 -1.715 385 HD22 ASN 52 2HD2 ASN 52 26.529 -6.360 -2.148 386 H LYS 53 HN LYS 53 32.054 -7.224 -2.037 387 HA LYS 53 HA LYS 53 30.618 -8.256 0.146 388 HB2 LYS 53 2HB LYS 53 32.647 -9.181 -1.272 389 HB3 LYS 53 3HB LYS 53 33.608 -8.407 -0.029 390 HG2 LYS 53 2HG LYS 53 32.007 -9.636 1.662 391 HG3 LYS 53 3HG LYS 53 31.565 -10.631 0.289 392 HD2 LYS 53 2HD LYS 53 34.190 -10.884 -0.029 393 HD3 LYS 53 3HD LYS 53 34.263 -10.372 1.645 394 HE2 LYS 53 2HE LYS 53 32.641 -12.226 2.239 395 HE3 LYS 53 3HE LYS 53 32.698 -12.769 0.575 396 HZ1 LYS 53 2HZ LYS 53 35.066 -12.590 2.361 397 HZ3 LYS 53 1HZ LYS 53 35.092 -13.135 0.826 398 H ASN 54 HN ASN 54 33.593 -6.159 0.102 399 HA ASN 54 HA ASN 54 33.833 -5.635 2.671 400 HB2 ASN 54 2HB ASN 54 34.863 -3.512 2.065 401 HB3 ASN 54 3HB ASN 54 35.173 -4.623 0.747 402 HD21 ASN 54 1HD2 ASN 54 34.285 -4.313 -1.231 403 HD22 ASN 54 2HD2 ASN 54 33.379 -2.911 -1.696 404 H LYS 55 HN LYS 55 31.280 -4.464 0.466 405 HA LYS 55 HA LYS 55 30.243 -2.312 1.680 406 HB2 LYS 55 2HB LYS 55 29.450 -3.780 -0.354 407 HB3 LYS 55 3HB LYS 55 28.381 -4.510 0.827 408 HG2 LYS 55 2HG LYS 55 27.002 -2.765 0.234 409 HG3 LYS 55 3HG LYS 55 27.934 -1.904 1.442 410 HD2 LYS 55 2HD LYS 55 29.044 -1.976 -1.356 411 HD3 LYS 55 3HD LYS 55 27.629 -0.979 -1.084 412 HE2 LYS 55 2HE LYS 55 29.220 0.592 -0.511 413 HE3 LYS 55 3HE LYS 55 29.083 -0.176 1.058 414 HZ1 LYS 55 2HZ LYS 55 31.402 0.058 -0.214 415 HZ3 LYS 55 1HZ LYS 55 30.974 -1.403 -0.792 416 H GLY 56 HN GLY 56 29.797 -1.810 3.750 417 HA2 GLY 56 1HA GLY 56 28.798 -3.992 5.485 418 HA3 GLY 56 2HA GLY 56 29.899 -2.738 6.021 419 H ILE 57 HN ILE 57 26.610 -3.254 4.601 420 HA ILE 57 HA ILE 57 25.634 -1.150 6.350 421 HB ILE 57 HB ILE 57 24.344 -0.149 4.466 422 HG12 ILE 57 2HG1 ILE 57 26.309 -1.258 2.511 423 HG13 ILE 57 3HG1 ILE 57 24.990 -2.300 3.005 424 HG21 ILE 57 1HG2 ILE 57 27.247 0.209 3.838 425 HG22 ILE 57 2HG2 ILE 57 25.961 1.419 4.057 426 HG23 ILE 57 3HG2 ILE 57 26.663 0.601 5.473 427 HD11 ILE 57 3HD1 ILE 57 24.342 -0.999 1.015 428 HD12 ILE 57 1HD1 ILE 57 23.350 -0.506 2.409 429 HD13 ILE 57 2HD1 ILE 57 24.701 0.520 1.871 430 H ILE 58 HN ILE 58 23.025 -1.076 5.830 431 HA ILE 58 HA ILE 58 22.194 -3.883 5.628 432 HB ILE 58 HB ILE 58 21.695 -1.901 7.802 433 HG12 ILE 58 2HG1 ILE 58 23.362 -3.840 7.890 434 HG13 ILE 58 3HG1 ILE 58 22.254 -3.657 9.236 435 HG21 ILE 58 1HG2 ILE 58 19.723 -3.261 8.526 436 HG22 ILE 58 2HG2 ILE 58 19.454 -2.283 7.063 437 HG23 ILE 58 3HG2 ILE 58 19.737 -4.035 6.923 438 HD11 ILE 58 3HD1 ILE 58 20.715 -5.345 8.097 439 HD12 ILE 58 1HD1 ILE 58 22.020 -5.627 6.920 440 HD13 ILE 58 2HD1 ILE 58 22.276 -6.002 8.641 441 H TRP 59 HN TRP 59 20.819 -4.145 3.961 442 HA TRP 59 HA TRP 59 19.818 -1.981 2.509 443 HB2 TRP 59 2HB TRP 59 19.018 -4.894 2.558 444 HB3 TRP 59 3HB TRP 59 18.415 -3.729 1.397 445 HD1 TRP 59 HD1 TRP 59 21.027 -6.253 1.610 446 HE1 TRP 59 HE1 TRP 59 22.990 -5.947 -0.127 447 HE3 TRP 59 HE3 TRP 59 19.903 -1.446 0.391 448 HZ2 TRP 59 HZ2 TRP 59 23.833 -3.778 -1.779 449 HZ3 TRP 59 HZ3 TRP 59 21.346 -0.307 -1.292 450 HH2 TRP 59 HH2 TRP 59 23.253 -1.395 -2.365 451 H GLY 60 HN GLY 60 17.580 -1.234 2.303 452 HA2 GLY 60 1HA GLY 60 15.579 -2.093 4.154 453 HA3 GLY 60 2HA GLY 60 16.324 -0.588 4.657 454 H GLU 61 HN GLU 61 14.344 0.594 4.295 455 HA GLU 61 HA GLU 61 13.322 0.592 1.613 456 HB2 GLU 61 2HB GLU 61 12.040 0.793 3.955 457 HB3 GLU 61 3HB GLU 61 12.360 2.502 3.738 458 HG2 GLU 61 2HG GLU 61 11.441 1.963 1.247 459 HG3 GLU 61 3HG GLU 61 10.623 0.670 2.101 460 HE2 GLU 61 HE2 GLU 61 9.140 1.331 3.738 461 H ASP 62 HN ASP 62 15.529 2.421 3.637 462 HA ASP 62 HA ASP 62 15.332 4.736 1.946 463 HB2 ASP 62 2HB ASP 62 17.011 4.026 4.388 464 HB3 ASP 62 3HB ASP 62 17.277 5.507 3.488 465 HD2 ASP 62 HD2 ASP 62 16.251 6.975 5.372 466 H THR 63 HN THR 63 17.924 2.456 3.142 467 HA THR 63 HA THR 63 19.963 3.214 1.484 468 HB THR 63 HB THR 63 20.840 0.943 1.971 469 HG1 THR 63 HG1 THR 63 18.113 0.524 2.959 470 HG21 THR 63 1HG2 THR 63 21.070 1.513 4.169 471 HG22 THR 63 2HG2 THR 63 19.745 2.689 3.995 472 HG23 THR 63 3HG2 THR 63 19.389 1.010 4.471 473 H LEU 64 HN LEU 64 17.028 1.415 0.665 474 HA LEU 64 HA LEU 64 18.121 0.628 -1.889 475 HB2 LEU 64 2HB LEU 64 15.478 0.244 -0.503 476 HB3 LEU 64 3HB LEU 64 15.706 -0.174 -2.190 477 HG LEU 64 HG LEU 64 17.413 -1.301 0.041 478 HD11 LEU 64 1HD1 LEU 64 15.830 -2.749 0.607 479 HD12 LEU 64 2HD1 LEU 64 14.688 -1.816 -0.390 480 HD13 LEU 64 3HD1 LEU 64 15.558 -3.201 -1.093 481 HD21 LEU 64 3HD2 LEU 64 18.023 -1.252 -2.561 482 HD22 LEU 64 1HD2 LEU 64 18.434 -2.619 -1.496 483 HD23 LEU 64 2HD2 LEU 64 16.999 -2.708 -2.547 484 H MET 65 HN MET 65 15.950 3.098 -0.473 485 HA MET 65 HA MET 65 14.843 4.022 -2.802 486 HB2 MET 65 2HB MET 65 15.483 5.146 -0.072 487 HB3 MET 65 3HB MET 65 15.041 6.309 -1.307 488 HG2 MET 65 2HG MET 65 13.304 3.862 -1.052 489 HG3 MET 65 3HG MET 65 13.194 5.053 0.229 490 HE1 MET 65 3HE MET 65 10.992 4.122 -2.334 491 HE2 MET 65 1HE MET 65 11.227 5.173 -3.752 492 HE3 MET 65 2HE MET 65 12.501 4.025 -3.273 493 H GLU 66 HN GLU 66 18.145 4.113 -1.780 494 HA GLU 66 HA GLU 66 18.670 6.343 -3.573 495 HB2 GLU 66 2HB GLU 66 19.662 6.773 -1.452 496 HB3 GLU 66 3HB GLU 66 20.221 5.122 -1.272 497 HG2 GLU 66 2HG GLU 66 21.900 5.414 -3.018 498 HG3 GLU 66 3HG GLU 66 21.239 6.972 -3.474 499 HE2 GLU 66 HE2 GLU 66 22.579 7.320 0.229 500 H TYR 67 HN TYR 67 20.184 3.173 -2.603 501 HA TYR 67 HA TYR 67 21.912 2.781 -4.593 502 HB2 TYR 67 2HB TYR 67 21.262 1.222 -2.689 503 HB3 TYR 67 3HB TYR 67 19.757 0.860 -3.510 504 HD1 TYR 67 HD1 TYR 67 23.358 0.962 -4.592 505 HD2 TYR 67 HD2 TYR 67 19.736 -1.300 -4.340 506 HE1 TYR 67 HE1 TYR 67 24.477 -0.977 -5.797 507 HE2 TYR 67 HE2 TYR 67 20.867 -3.232 -5.545 508 HH TYR 67 HH TYR 67 24.306 -3.079 -6.365 509 H LEU 68 HN LEU 68 18.439 1.711 -4.829 510 HA LEU 68 HA LEU 68 18.619 1.018 -7.522 511 HB2 LEU 68 2HB LEU 68 16.342 1.683 -5.676 512 HB3 LEU 68 3HB LEU 68 16.065 1.320 -7.368 513 HG LEU 68 HG LEU 68 17.691 -0.775 -6.498 514 HD11 LEU 68 1HD1 LEU 68 16.557 -1.658 -4.504 515 HD12 LEU 68 2HD1 LEU 68 17.395 -0.122 -4.174 516 HD13 LEU 68 3HD1 LEU 68 15.626 -0.148 -4.370 517 HD21 LEU 68 3HD2 LEU 68 16.125 -1.618 -7.846 518 HD22 LEU 68 1HD2 LEU 68 15.129 -1.787 -6.381 519 HD23 LEU 68 2HD2 LEU 68 14.946 -0.354 -7.421 520 H GLU 69 HN GLU 69 17.821 4.101 -5.861 521 HA GLU 69 HA GLU 69 16.914 5.439 -8.094 522 HB2 GLU 69 2HB GLU 69 16.616 6.291 -5.812 523 HB3 GLU 69 3HB GLU 69 18.346 6.479 -5.612 524 HG2 GLU 69 2HG GLU 69 18.436 8.220 -7.320 525 HG3 GLU 69 3HG GLU 69 16.776 7.918 -7.796 526 HE2 GLU 69 HE2 GLU 69 15.585 9.639 -6.966 527 H ASN 70 HN ASN 70 20.177 4.575 -7.030 528 HA ASN 70 HA ASN 70 21.257 5.079 -9.509 529 HB2 ASN 70 2HB ASN 70 20.921 7.509 -8.456 530 HB3 ASN 70 3HB ASN 70 22.340 7.099 -7.513 531 HD21 ASN 70 1HD2 ASN 70 22.260 9.192 -9.325 532 HD22 ASN 70 2HD2 ASN 70 23.332 8.879 -10.650 533 HA PRO 71 HA PRO 71 23.673 2.547 -6.645 534 HB2 PRO 71 2HB PRO 71 24.139 0.467 -8.355 535 HB3 PRO 71 3HB PRO 71 22.766 0.524 -7.268 536 HG2 PRO 71 2HG PRO 71 22.837 0.963 -10.191 537 HG3 PRO 71 3HG PRO 71 21.461 0.598 -9.168 538 HD2 PRO 71 2HD PRO 71 22.150 3.156 -10.268 539 HD3 PRO 71 3HD PRO 71 20.842 2.812 -9.153 540 H LYS 72 HN LYS 72 24.313 3.938 -9.667 541 HA LYS 72 HA LYS 72 27.000 3.176 -9.901 542 HB2 LYS 72 2HB LYS 72 25.683 4.058 -11.762 543 HB3 LYS 72 3HB LYS 72 25.522 5.605 -10.955 544 HG2 LYS 72 2HG LYS 72 27.338 5.684 -12.636 545 HG3 LYS 72 3HG LYS 72 27.978 5.935 -11.024 546 HD2 LYS 72 2HD LYS 72 29.400 4.354 -12.297 547 HD3 LYS 72 3HD LYS 72 28.694 3.567 -10.899 548 HE2 LYS 72 2HE LYS 72 28.504 2.095 -12.866 549 HE3 LYS 72 3HE LYS 72 26.907 2.585 -12.338 550 HZ1 LYS 72 2HZ LYS 72 28.377 3.977 -14.510 551 HZ3 LYS 72 1HZ LYS 72 26.818 4.203 -14.098 552 H LYS 73 HN LYS 73 25.345 5.256 -7.676 553 HA LYS 73 HA LYS 73 27.900 6.520 -6.971 554 HB2 LYS 73 2HB LYS 73 25.045 7.429 -6.814 555 HB3 LYS 73 3HB LYS 73 26.191 8.035 -5.635 556 HG2 LYS 73 2HG LYS 73 26.258 9.599 -7.451 557 HG3 LYS 73 3HG LYS 73 27.728 8.655 -7.596 558 HD2 LYS 73 2HD LYS 73 26.735 7.259 -9.352 559 HD3 LYS 73 3HD LYS 73 25.165 8.002 -9.120 560 HE2 LYS 73 2HE LYS 73 26.042 10.190 -9.877 561 HE3 LYS 73 3HE LYS 73 27.660 9.529 -10.006 562 HZ1 LYS 73 2HZ LYS 73 26.127 7.831 -11.515 563 HZ3 LYS 73 1HZ LYS 73 27.079 9.012 -12.106 564 H TYR 74 HN TYR 74 26.279 3.791 -6.317 565 HA TYR 74 HA TYR 74 26.632 4.027 -3.408 566 HB2 TYR 74 2HB TYR 74 24.442 3.277 -4.876 567 HB3 TYR 74 3HB TYR 74 25.277 1.736 -4.884 568 HD1 TYR 74 HD2 TYR 74 26.106 0.914 -2.479 569 HD2 TYR 74 HD1 TYR 74 22.943 3.714 -3.154 570 HE1 TYR 74 HE2 TYR 74 25.141 0.388 -0.186 571 HE2 TYR 74 HE1 TYR 74 21.988 3.178 -0.860 572 HH TYR 74 HH TYR 74 23.345 2.144 1.457 573 H ILE 75 HN ILE 75 26.844 1.499 -6.022 574 HA ILE 75 HA ILE 75 29.370 0.665 -4.781 575 HB ILE 75 HB ILE 75 27.431 -1.282 -5.991 576 HG12 ILE 75 2HG1 ILE 75 27.511 -0.406 -3.088 577 HG13 ILE 75 3HG1 ILE 75 26.213 -0.087 -4.221 578 HG21 ILE 75 1HG2 ILE 75 29.279 -1.967 -3.768 579 HG22 ILE 75 2HG2 ILE 75 28.801 -2.903 -5.204 580 HG23 ILE 75 3HG2 ILE 75 30.013 -1.608 -5.349 581 HD11 ILE 75 3HD1 ILE 75 25.447 -2.011 -3.098 582 HD12 ILE 75 1HD1 ILE 75 26.182 -2.699 -4.566 583 HD13 ILE 75 2HD1 ILE 75 27.073 -2.734 -3.025 584 HA PRO 76 HA PRO 76 30.102 1.601 -9.098 585 HB2 PRO 76 2HB PRO 76 32.474 2.911 -8.747 586 HB3 PRO 76 3HB PRO 76 30.925 3.728 -8.795 587 HG2 PRO 76 2HG PRO 76 32.639 3.141 -6.459 588 HG3 PRO 76 3HG PRO 76 31.332 4.300 -6.598 589 HD2 PRO 76 2HD PRO 76 31.233 1.750 -5.289 590 HD3 PRO 76 3HD PRO 76 29.897 2.858 -5.528 591 H GLY 77 HN GLY 77 30.655 -0.062 -10.341 592 HA2 GLY 77 1HA GLY 77 32.645 -1.211 -11.161 593 HA3 GLY 77 2HA GLY 77 33.119 -1.469 -9.494 594 H THR 78 HN THR 78 30.017 -1.818 -8.932 595 HA THR 78 HA THR 78 29.958 -4.526 -8.667 596 HB THR 78 HB THR 78 28.348 -2.827 -7.714 597 HG1 THR 78 HG1 THR 78 26.467 -4.337 -8.253 598 HG21 THR 78 1HG2 THR 78 26.811 -1.700 -9.011 599 HG22 THR 78 2HG2 THR 78 27.941 -2.027 -10.346 600 HG23 THR 78 3HG2 THR 78 26.552 -3.105 -10.072 601 H LYS 79 HN LYS 79 28.750 -6.234 -9.793 602 HA LYS 79 HA LYS 79 29.036 -5.859 -12.690 603 HB2 LYS 79 2HB LYS 79 29.016 -8.506 -12.486 604 HB3 LYS 79 3HB LYS 79 30.482 -7.568 -12.289 605 HG2 LYS 79 2HG LYS 79 30.249 -7.608 -9.841 606 HG3 LYS 79 3HG LYS 79 28.681 -8.380 -9.962 607 HD2 LYS 79 2HD LYS 79 30.124 -10.182 -11.391 608 HD3 LYS 79 3HD LYS 79 31.417 -9.553 -10.389 609 HE2 LYS 79 2HE LYS 79 30.491 -10.380 -8.415 610 HE3 LYS 79 3HE LYS 79 28.843 -10.233 -8.993 611 HZ1 LYS 79 2HZ LYS 79 28.966 -12.260 -10.051 612 HZ3 LYS 79 1HZ LYS 79 30.031 -12.569 -8.858 613 H MET 80 HN MET 80 26.753 -4.807 -11.359 614 HA MET 80 HA MET 80 24.741 -6.796 -12.069 615 HB2 MET 80 2HB MET 80 24.452 -6.115 -9.769 616 HB3 MET 80 3HB MET 80 24.800 -4.436 -10.134 617 HG2 MET 80 2HG MET 80 22.661 -4.037 -11.032 618 HG3 MET 80 3HG MET 80 22.414 -5.713 -11.476 619 HE1 MET 80 3HE MET 80 21.779 -2.998 -8.784 620 HE2 MET 80 1HE MET 80 20.570 -3.570 -9.957 621 HE3 MET 80 2HE MET 80 20.335 -3.870 -8.218 622 H ILE 81 HN ILE 81 24.203 -6.470 -14.207 623 HA ILE 81 HA ILE 81 24.381 -3.986 -15.481 624 HB ILE 81 HB ILE 81 23.093 -6.618 -16.119 625 HG12 ILE 81 2HG1 ILE 81 25.642 -6.036 -16.224 626 HG13 ILE 81 3HG1 ILE 81 24.892 -6.972 -17.501 627 HG21 ILE 81 1HG2 ILE 81 22.933 -4.093 -17.786 628 HG22 ILE 81 2HG2 ILE 81 22.575 -5.732 -18.380 629 HG23 ILE 81 3HG2 ILE 81 21.579 -5.016 -17.091 630 HD11 ILE 81 3HD1 ILE 81 26.411 -4.965 -18.183 631 HD12 ILE 81 1HD1 ILE 81 24.841 -5.133 -19.003 632 HD13 ILE 81 2HD1 ILE 81 25.037 -3.945 -17.693 633 H PHE 82 HN PHE 82 23.153 -2.203 -15.248 634 HA PHE 82 HA PHE 82 20.349 -2.335 -15.234 635 HB2 PHE 82 2HB PHE 82 21.099 -3.086 -12.835 636 HB3 PHE 82 3HB PHE 82 21.713 -1.458 -12.624 637 HD1 PHE 82 HD2 PHE 82 18.552 -2.680 -14.189 638 HD2 PHE 82 HD1 PHE 82 20.345 -0.412 -11.083 639 HE1 PHE 82 HE2 PHE 82 16.282 -1.920 -13.432 640 HE2 PHE 82 HE1 PHE 82 18.075 0.347 -10.326 641 HZ PHE 82 HZ PHE 82 16.071 -0.417 -11.511 642 H VAL 83 HN VAL 83 19.484 0.012 -14.408 643 HA VAL 83 HA VAL 83 21.463 1.996 -15.271 644 HB VAL 83 HB VAL 83 19.710 3.118 -16.557 645 HG11 VAL 83 1HG1 VAL 83 19.573 1.475 -18.430 646 HG12 VAL 83 2HG1 VAL 83 21.210 1.650 -17.755 647 HG13 VAL 83 3HG1 VAL 83 20.222 0.230 -17.337 648 HG21 VAL 83 3HG2 VAL 83 18.035 0.705 -15.800 649 HG22 VAL 83 1HG2 VAL 83 17.708 2.418 -15.439 650 HG23 VAL 83 2HG2 VAL 83 17.621 1.828 -17.117 651 H GLY 84 HN GLY 84 18.210 1.418 -13.770 652 HA2 GLY 84 1HA GLY 84 18.305 2.209 -11.349 653 HA3 GLY 84 2HA GLY 84 18.692 3.767 -12.052 654 H ILE 85 HN ILE 85 16.478 3.805 -10.537 655 HA ILE 85 HA ILE 85 14.307 3.766 -12.514 656 HB ILE 85 HB ILE 85 14.075 3.112 -9.575 657 HG12 ILE 85 2HG1 ILE 85 13.522 1.078 -11.680 658 HG13 ILE 85 3HG1 ILE 85 15.205 1.455 -11.372 659 HG21 ILE 85 1HG2 ILE 85 11.778 2.536 -10.072 660 HG22 ILE 85 2HG2 ILE 85 12.096 4.219 -10.557 661 HG23 ILE 85 3HG2 ILE 85 12.014 2.937 -11.791 662 HD11 ILE 85 3HD1 ILE 85 15.142 0.151 -9.526 663 HD12 ILE 85 1HD1 ILE 85 13.932 1.245 -8.813 664 HD13 ILE 85 2HD1 ILE 85 13.408 -0.150 -9.784 665 H LYS 86 HN LYS 86 14.372 5.925 -13.093 666 HA LYS 86 HA LYS 86 14.842 7.970 -11.206 667 HB2 LYS 86 2HB LYS 86 15.227 7.991 -13.737 668 HB3 LYS 86 3HB LYS 86 13.506 8.281 -13.901 669 HG2 LYS 86 2HG LYS 86 13.618 10.399 -12.872 670 HG3 LYS 86 3HG LYS 86 15.081 10.012 -11.988 671 HD2 LYS 86 2HD LYS 86 16.095 11.272 -13.617 672 HD3 LYS 86 3HD LYS 86 16.036 9.780 -14.535 673 HE2 LYS 86 2HE LYS 86 13.603 11.557 -14.624 674 HE3 LYS 86 3HE LYS 86 15.025 12.095 -15.494 675 HZ1 LYS 86 2HZ LYS 86 13.455 9.641 -15.947 676 HZ3 LYS 86 1HZ LYS 86 15.005 9.702 -16.444 677 H LYS 87 HN LYS 87 12.039 6.075 -12.120 678 HA LYS 87 HA LYS 87 10.148 8.018 -11.193 679 HB2 LYS 87 2HB LYS 87 9.838 5.088 -11.915 680 HB3 LYS 87 3HB LYS 87 8.519 6.185 -11.558 681 HG2 LYS 87 2HG LYS 87 8.643 6.257 -13.919 682 HG3 LYS 87 3HG LYS 87 9.506 7.703 -13.436 683 HD2 LYS 87 2HD LYS 87 11.625 6.775 -13.929 684 HD3 LYS 87 3HD LYS 87 11.053 5.125 -13.784 685 HE2 LYS 87 2HE LYS 87 11.499 6.032 -16.181 686 HE3 LYS 87 3HE LYS 87 10.004 5.156 -15.915 687 HZ1 LYS 87 2HZ LYS 87 8.774 7.115 -15.991 688 HZ3 LYS 87 1HZ LYS 87 9.936 7.468 -17.075 689 H LYS 88 HN LYS 88 10.028 8.549 -9.079 690 HA LYS 88 HA LYS 88 11.052 6.866 -7.062 691 HB2 LYS 88 2HB LYS 88 10.597 8.609 -5.620 692 HB3 LYS 88 3HB LYS 88 10.782 9.449 -7.147 693 HG2 LYS 88 2HG LYS 88 8.276 9.373 -7.454 694 HG3 LYS 88 3HG LYS 88 8.129 8.616 -5.880 695 HD2 LYS 88 2HD LYS 88 9.619 11.245 -6.162 696 HD3 LYS 88 3HD LYS 88 7.868 11.237 -6.094 697 HE2 LYS 88 2HE LYS 88 8.065 9.842 -3.941 698 HE3 LYS 88 3HE LYS 88 9.788 10.157 -3.982 699 HZ1 LYS 88 2HZ LYS 88 9.399 12.478 -3.737 700 HZ3 LYS 88 1HZ LYS 88 8.403 11.782 -2.653 701 H GLU 89 HN GLU 89 7.833 7.374 -8.518 702 HA GLU 89 HA GLU 89 6.342 6.173 -6.543 703 HB2 GLU 89 2HB GLU 89 5.597 7.463 -8.668 704 HB3 GLU 89 3HB GLU 89 5.738 5.935 -9.513 705 HG2 GLU 89 2HG GLU 89 3.486 5.886 -8.862 706 HG3 GLU 89 3HG GLU 89 4.235 4.990 -7.557 707 HE2 GLU 89 HE2 GLU 89 4.259 7.976 -5.534 708 H GLU 90 HN GLU 90 7.564 4.692 -9.640 709 HA GLU 90 HA GLU 90 6.794 2.128 -8.960 710 HB2 GLU 90 2HB GLU 90 9.058 3.026 -10.797 711 HB3 GLU 90 3HB GLU 90 8.348 1.424 -10.785 712 HG2 GLU 90 2HG GLU 90 6.061 2.734 -11.132 713 HG3 GLU 90 3HG GLU 90 7.099 4.040 -11.669 714 HE2 GLU 90 HE2 GLU 90 6.422 3.821 -13.720 715 H ARG 91 HN ARG 91 9.443 4.114 -7.850 716 HA ARG 91 HA ARG 91 11.103 1.926 -7.151 717 HB2 ARG 91 2HB ARG 91 11.196 4.882 -7.018 718 HB3 ARG 91 3HB ARG 91 11.932 4.131 -5.617 719 HG2 ARG 91 2HG ARG 91 12.898 2.589 -7.759 720 HG3 ARG 91 3HG ARG 91 12.883 4.217 -8.408 721 HD2 ARG 91 2HD ARG 91 15.036 3.513 -7.184 722 HD3 ARG 91 3HD ARG 91 14.341 5.043 -6.688 723 HE ARG 91 HE ARG 91 13.989 4.134 -4.572 724 HH11 ARG 91 2HH2 ARG 91 14.196 1.468 -6.897 725 HH12 ARG 91 1HH2 ARG 91 14.095 0.237 -5.682 726 HH22 ARG 91 HH1 ARG 91 13.894 0.873 -3.380 727 H ALA 92 HN ALA 92 8.570 3.923 -5.628 728 HA ALA 92 HA ALA 92 9.129 2.837 -3.003 729 HB1 ALA 92 3HB ALA 92 8.193 4.783 -2.389 730 HB2 ALA 92 1HB ALA 92 7.873 5.167 -4.098 731 HB3 ALA 92 2HB ALA 92 6.657 4.287 -3.141 732 H ASP 93 HN ASP 93 7.572 1.826 -5.840 733 HA ASP 93 HA ASP 93 5.466 0.470 -4.408 734 HB2 ASP 93 2HB ASP 93 6.178 0.861 -7.332 735 HB3 ASP 93 3HB ASP 93 5.043 -0.394 -6.875 736 HD2 ASP 93 HD2 ASP 93 4.149 1.797 -8.441 737 H LEU 94 HN LEU 94 8.379 -0.127 -6.484 738 HA LEU 94 HA LEU 94 8.246 -2.880 -6.602 739 HB2 LEU 94 2HB LEU 94 9.802 -1.073 -7.711 740 HB3 LEU 94 3HB LEU 94 10.869 -1.464 -6.377 741 HG LEU 94 HG LEU 94 9.782 -3.473 -8.370 742 HD11 LEU 94 1HD1 LEU 94 11.574 -1.577 -9.003 743 HD12 LEU 94 2HD1 LEU 94 12.672 -2.790 -8.302 744 HD13 LEU 94 3HD1 LEU 94 11.619 -3.228 -9.668 745 HD21 LEU 94 3HD2 LEU 94 11.577 -3.708 -5.973 746 HD22 LEU 94 1HD2 LEU 94 10.217 -4.737 -6.486 747 HD23 LEU 94 2HD2 LEU 94 11.769 -4.816 -7.354 748 H ILE 95 HN ILE 95 9.592 -0.707 -4.065 749 HA ILE 95 HA ILE 95 10.750 -2.734 -2.530 750 HB ILE 95 HB ILE 95 9.657 -0.041 -1.706 751 HG12 ILE 95 2HG1 ILE 95 12.503 -0.770 -2.435 752 HG13 ILE 95 3HG1 ILE 95 11.368 -0.081 -3.578 753 HG21 ILE 95 1HG2 ILE 95 11.915 -1.308 -0.254 754 HG22 ILE 95 2HG2 ILE 95 10.591 -0.276 0.341 755 HG23 ILE 95 3HG2 ILE 95 10.297 -2.002 0.016 756 HD11 ILE 95 3HD1 ILE 95 11.821 1.987 -2.787 757 HD12 ILE 95 1HD1 ILE 95 11.230 1.502 -1.180 758 HD13 ILE 95 2HD1 ILE 95 12.946 1.284 -1.600 759 H ALA 96 HN ALA 96 7.436 -1.330 -2.618 760 HA ALA 96 HA ALA 96 6.381 -2.433 -0.364 761 HB1 ALA 96 3HB ALA 96 4.375 -1.809 -1.278 762 HB2 ALA 96 1HB ALA 96 5.438 -0.986 -2.445 763 HB3 ALA 96 2HB ALA 96 4.731 -2.570 -2.848 764 H TYR 97 HN TYR 97 6.697 -3.968 -3.637 765 HA TYR 97 HA TYR 97 5.616 -6.438 -2.762 766 HB2 TYR 97 2HB TYR 97 5.581 -5.789 -5.122 767 HB3 TYR 97 3HB TYR 97 7.275 -5.340 -5.095 768 HD1 TYR 97 HD2 TYR 97 5.984 -8.505 -3.661 769 HD2 TYR 97 HD1 TYR 97 7.948 -6.661 -6.984 770 HE1 TYR 97 HE2 TYR 97 6.609 -10.795 -4.571 771 HE2 TYR 97 HE1 TYR 97 8.566 -8.958 -7.883 772 HH TYR 97 HH TYR 97 7.119 -11.679 -7.019 773 H LEU 98 HN LEU 98 8.999 -5.490 -3.725 774 HA LEU 98 HA LEU 98 10.300 -7.758 -3.143 775 HB2 LEU 98 2HB LEU 98 11.011 -4.872 -2.898 776 HB3 LEU 98 3HB LEU 98 12.132 -6.060 -2.262 777 HG LEU 98 HG LEU 98 11.126 -5.923 -5.119 778 HD11 LEU 98 1HD1 LEU 98 13.950 -5.436 -4.181 779 HD12 LEU 98 2HD1 LEU 98 13.200 -5.036 -5.746 780 HD13 LEU 98 3HD1 LEU 98 12.748 -4.127 -4.284 781 HD21 LEU 98 3HD2 LEU 98 13.377 -7.558 -5.029 782 HD22 LEU 98 1HD2 LEU 98 12.405 -8.064 -3.626 783 HD23 LEU 98 2HD2 LEU 98 11.687 -8.070 -5.256 784 H LYS 99 HN LYS 99 8.905 -5.439 -0.814 785 HA LYS 99 HA LYS 99 10.175 -6.462 1.462 786 HB2 LYS 99 2HB LYS 99 9.116 -4.271 1.413 787 HB3 LYS 99 3HB LYS 99 7.545 -4.992 1.126 788 HG2 LYS 99 2HG LYS 99 7.412 -5.907 3.310 789 HG3 LYS 99 3HG LYS 99 9.147 -5.850 3.550 790 HD2 LYS 99 2HD LYS 99 8.884 -3.248 3.370 791 HD3 LYS 99 3HD LYS 99 7.172 -3.539 3.607 792 HE2 LYS 99 2HE LYS 99 9.451 -3.922 5.533 793 HE3 LYS 99 3HE LYS 99 7.851 -3.267 5.823 794 HZ1 LYS 99 2HZ LYS 99 6.932 -5.463 5.795 795 HZ3 LYS 99 1HZ LYS 99 8.243 -5.551 6.756 796 H LYS 100 HN LYS 100 6.918 -7.154 0.015 797 HA LYS 100 HA LYS 100 6.410 -9.229 1.887 798 HB2 LYS 100 2HB LYS 100 4.743 -7.749 0.586 799 HB3 LYS 100 3HB LYS 100 5.007 -8.842 -0.758 800 HG2 LYS 100 2HG LYS 100 4.493 -10.765 0.925 801 HG3 LYS 100 3HG LYS 100 3.894 -9.514 1.995 802 HD2 LYS 100 2HD LYS 100 2.897 -9.512 -0.851 803 HD3 LYS 100 3HD LYS 100 2.290 -10.758 0.222 804 HE2 LYS 100 2HE LYS 100 2.284 -7.836 1.069 805 HE3 LYS 100 3HE LYS 100 0.987 -8.489 0.087 806 HZ1 LYS 100 2HZ LYS 100 0.112 -9.349 1.950 807 HZ3 LYS 100 1HZ LYS 100 1.340 -8.780 2.856 808 H ALA 101 HN ALA 101 8.416 -8.948 -0.889 809 HA ALA 101 HA ALA 101 8.177 -11.735 -1.621 810 HB1 ALA 101 3HB ALA 101 10.250 -9.755 -2.600 811 HB2 ALA 101 1HB ALA 101 9.566 -11.165 -3.445 812 HB3 ALA 101 2HB ALA 101 8.572 -9.711 -3.190 813 H THR 102 HN THR 102 10.220 -9.564 0.325 814 HA THR 102 HA THR 102 11.936 -11.879 0.947 815 HB THR 102 HB THR 102 13.728 -10.278 1.279 816 HG1 THR 102 HG1 THR 102 12.927 -8.402 2.150 817 HG21 THR 102 1HG2 THR 102 12.749 -8.616 -0.884 818 HG22 THR 102 2HG2 THR 102 13.995 -9.885 -0.954 819 HG23 THR 102 3HG2 THR 102 12.284 -10.302 -1.215 820 H ASN 103 HN ASN 103 9.258 -11.298 2.077 821 HA ASN 103 HA ASN 103 10.136 -10.713 4.795 822 HB2 ASN 103 2HB ASN 103 8.481 -9.069 4.169 823 HB3 ASN 103 3HB ASN 103 7.482 -10.263 3.363 824 HD21 ASN 103 1HD2 ASN 103 5.641 -9.987 4.475 825 HD22 ASN 103 2HD2 ASN 103 5.428 -10.320 6.161 826 H GLU 104 HN GLU 104 8.036 -12.705 2.625 827 HA GLU 104 HA GLU 104 6.784 -14.310 4.336 828 HB2 GLU 104 2HB GLU 104 8.150 -15.044 1.715 829 HB3 GLU 104 3HB GLU 104 7.056 -16.128 2.550 830 HG2 GLU 104 2HG GLU 104 6.392 -13.344 1.485 831 HG3 GLU 104 3HG GLU 104 5.814 -14.870 0.844 832 HE2 GLU 104 HE2 GLU 104 4.858 -12.432 2.700 833 HHA HEC 500 HHA HEC 500 24.349 -7.454 -5.602 834 HHB HEC 500 HHB HEC 500 18.493 -4.893 -5.345 835 HHC HEC 500 HHC HEC 500 17.982 -6.117 -11.655 836 HHD HEC 500 HHD HEC 500 23.016 -10.046 -11.245 837 HMA1 HEC 500 1HMA HEC 500 19.424 -4.933 -3.216 838 HMA2 HEC 500 2HMA HEC 500 20.991 -5.068 -2.410 839 HMA3 HEC 500 3HMA HEC 500 20.684 -3.703 -3.501 840 HAA1 HEC 500 1HAA HEC 500 24.309 -6.384 -3.900 841 HAA2 HEC 500 2HAA HEC 500 23.369 -5.311 -2.991 842 HBA1 HEC 500 1HBA HEC 500 23.753 -7.399 -1.724 843 HBA2 HEC 500 2HBA HEC 500 22.022 -7.189 -2.053 844 HMB1 HEC 500 1HMB HEC 500 15.219 -4.885 -7.240 845 HMB2 HEC 500 2HMB HEC 500 16.315 -4.898 -5.876 846 HMB3 HEC 500 3HMB HEC 500 16.236 -3.450 -6.903 847 HAB HEC 500 HAB HEC 500 16.530 -4.620 -11.081 848 HBB1 HEC 500 1HBB HEC 500 16.261 -2.645 -9.734 849 HBB2 HEC 500 2HBB HEC 500 14.779 -3.189 -10.563 850 HBB3 HEC 500 3HBB HEC 500 14.950 -3.417 -8.835 851 HMC1 HEC 500 1HMC HEC 500 17.942 -8.857 -13.451 852 HMC2 HEC 500 2HMC HEC 500 18.148 -7.105 -13.591 853 HMC3 HEC 500 3HMC HEC 500 19.183 -8.170 -14.518 854 HAC HEC 500 HAC HEC 500 21.782 -10.817 -12.765 855 HBC1 HEC 500 1HBC HEC 500 22.249 -9.149 -14.550 856 HBC2 HEC 500 2HBC HEC 500 21.749 -10.749 -15.138 857 HBC3 HEC 500 3HBC HEC 500 20.598 -9.415 -15.164 858 HMD1 HEC 500 1HMD HEC 500 24.873 -11.585 -9.511 859 HMD2 HEC 500 2HMD HEC 500 25.270 -10.374 -10.742 860 HMD3 HEC 500 3HMD HEC 500 26.265 -10.548 -9.267 861 HAD1 HEC 500 1HAD HEC 500 25.929 -8.818 -5.967 862 HAD2 HEC 500 2HAD HEC 500 26.322 -10.095 -7.037 863 HBD1 HEC 500 1HBD HEC 500 28.048 -8.568 -7.485 864 HBD2 HEC 500 2HBD HEC 500 26.866 -8.105 -8.730 Start of MODEL 16 1 H1 GLY 1 HN GLY 1 -0.279 -0.044 -1.494 2 HA2 GLY 1 1HA GLY 1 1.716 0.691 -3.001 3 HA3 GLY 1 2HA GLY 1 2.649 0.026 -1.676 4 H ASP 2 HN ASP 2 0.653 -0.677 -4.471 5 HA ASP 2 HA ASP 2 0.109 -3.345 -3.884 6 HB2 ASP 2 2HB ASP 2 0.246 -1.682 -6.412 7 HB3 ASP 2 3HB ASP 2 0.034 -3.416 -6.544 8 HD2 ASP 2 HD2 ASP 2 -2.039 -1.093 -6.994 9 H VAL 3 HN VAL 3 1.371 -5.227 -4.258 10 HA VAL 3 HA VAL 3 4.159 -4.795 -4.777 11 HB VAL 3 HB VAL 3 4.462 -6.908 -3.949 12 HG11 VAL 3 1HG1 VAL 3 3.279 -7.029 -1.957 13 HG12 VAL 3 2HG1 VAL 3 3.027 -5.332 -2.431 14 HG13 VAL 3 3HG1 VAL 3 1.745 -6.535 -2.712 15 HG21 VAL 3 3HG2 VAL 3 1.742 -7.590 -5.085 16 HG22 VAL 3 1HG2 VAL 3 3.332 -8.251 -5.536 17 HG23 VAL 3 2HG2 VAL 3 2.609 -8.666 -3.963 18 H GLU 4 HN GLU 4 1.302 -6.180 -6.454 19 HA GLU 4 HA GLU 4 2.563 -7.454 -8.489 20 HB2 GLU 4 2HB GLU 4 -0.024 -5.839 -8.562 21 HB3 GLU 4 3HB GLU 4 0.467 -6.960 -9.816 22 HG2 GLU 4 2HG GLU 4 0.069 -7.707 -6.879 23 HG3 GLU 4 3HG GLU 4 -1.111 -7.984 -8.145 24 HE2 GLU 4 HE2 GLU 4 0.991 -9.955 -6.597 25 H LYS 5 HN LYS 5 1.628 -3.956 -8.278 26 HA LYS 5 HA LYS 5 2.465 -3.217 -10.805 27 HB2 LYS 5 2HB LYS 5 2.468 -1.596 -8.241 28 HB3 LYS 5 3HB LYS 5 2.576 -0.937 -9.861 29 HG2 LYS 5 2HG LYS 5 0.241 -2.461 -8.632 30 HG3 LYS 5 3HG LYS 5 0.253 -0.799 -9.189 31 HD2 LYS 5 2HD LYS 5 0.959 -1.960 -11.517 32 HD3 LYS 5 3HD LYS 5 0.152 -3.343 -10.804 33 HE2 LYS 5 2HE LYS 5 -1.056 -0.573 -11.252 34 HE3 LYS 5 3HE LYS 5 -1.465 -2.039 -12.120 35 HZ1 LYS 5 2HZ LYS 5 -2.775 -1.201 -9.936 36 HZ3 LYS 5 1HZ LYS 5 -1.729 -2.235 -9.238 37 H GLY 6 HN GLY 6 4.300 -4.177 -7.977 38 HA2 GLY 6 1HA GLY 6 6.772 -3.053 -9.103 39 HA3 GLY 6 2HA GLY 6 6.541 -3.681 -7.483 40 H LYS 7 HN LYS 7 4.893 -5.998 -8.889 41 HA LYS 7 HA LYS 7 7.012 -7.842 -8.873 42 HB2 LYS 7 2HB LYS 7 4.789 -8.506 -8.235 43 HB3 LYS 7 3HB LYS 7 4.132 -8.033 -9.788 44 HG2 LYS 7 2HG LYS 7 4.394 -10.312 -10.165 45 HG3 LYS 7 3HG LYS 7 5.951 -9.747 -10.737 46 HD2 LYS 7 2HD LYS 7 7.100 -10.543 -8.859 47 HD3 LYS 7 3HD LYS 7 5.709 -10.390 -7.805 48 HE2 LYS 7 2HE LYS 7 5.948 -12.470 -10.031 49 HE3 LYS 7 3HE LYS 7 6.315 -12.786 -8.347 50 HZ1 LYS 7 2HZ LYS 7 3.901 -11.841 -8.015 51 HZ3 LYS 7 1HZ LYS 7 4.104 -13.397 -8.453 52 H LYS 8 HN LYS 8 4.989 -6.508 -11.581 53 HA LYS 8 HA LYS 8 6.403 -7.797 -13.600 54 HB2 LYS 8 2HB LYS 8 4.727 -5.277 -13.575 55 HB3 LYS 8 3HB LYS 8 5.389 -5.967 -15.042 56 HG2 LYS 8 2HG LYS 8 3.494 -7.357 -13.090 57 HG3 LYS 8 3HG LYS 8 3.087 -6.779 -14.694 58 HD2 LYS 8 2HD LYS 8 5.061 -8.359 -15.485 59 HD3 LYS 8 3HD LYS 8 4.849 -9.125 -13.924 60 HE2 LYS 8 2HE LYS 8 2.309 -9.249 -14.538 61 HE3 LYS 8 3HE LYS 8 2.815 -8.879 -16.174 62 HZ1 LYS 8 2HZ LYS 8 4.198 -10.850 -16.178 63 HZ3 LYS 8 1HZ LYS 8 2.706 -11.301 -15.704 64 H ILE 9 HN ILE 9 6.707 -4.393 -12.360 65 HA ILE 9 HA ILE 9 8.814 -3.635 -13.935 66 HB ILE 9 HB ILE 9 7.975 -2.869 -11.150 67 HG12 ILE 9 2HG1 ILE 9 7.850 -1.226 -13.680 68 HG13 ILE 9 3HG1 ILE 9 6.588 -2.370 -13.268 69 HG21 ILE 9 1HG2 ILE 9 10.439 -2.541 -11.432 70 HG22 ILE 9 2HG2 ILE 9 10.084 -1.448 -12.791 71 HG23 ILE 9 3HG2 ILE 9 9.518 -1.044 -11.153 72 HD11 ILE 9 3HD1 ILE 9 5.692 -0.601 -12.123 73 HD12 ILE 9 1HD1 ILE 9 6.867 -1.057 -10.867 74 HD13 ILE 9 2HD1 ILE 9 7.254 0.244 -12.017 75 H PHE 10 HN PHE 10 8.836 -5.455 -10.820 76 HA PHE 10 HA PHE 10 11.614 -5.491 -10.542 77 HB2 PHE 10 2HB PHE 10 10.188 -6.081 -8.674 78 HB3 PHE 10 3HB PHE 10 9.223 -7.170 -9.652 79 HD1 PHE 10 HD2 PHE 10 12.391 -6.790 -7.836 80 HD2 PHE 10 HD1 PHE 10 9.901 -9.450 -10.010 81 HE1 PHE 10 HE2 PHE 10 13.756 -8.733 -7.020 82 HE2 PHE 10 HE1 PHE 10 11.265 -11.393 -9.195 83 HZ PHE 10 HZ PHE 10 13.176 -11.011 -7.709 84 H ILE 11 HN ILE 11 9.419 -7.278 -12.637 85 HA ILE 11 HA ILE 11 11.320 -9.398 -13.090 86 HB ILE 11 HB ILE 11 8.609 -8.730 -14.223 87 HG12 ILE 11 2HG1 ILE 11 9.340 -11.199 -12.673 88 HG13 ILE 11 3HG1 ILE 11 9.044 -9.697 -11.821 89 HG21 ILE 11 1HG2 ILE 11 10.192 -11.227 -14.847 90 HG22 ILE 11 2HG2 ILE 11 8.659 -10.675 -15.564 91 HG23 ILE 11 3HG2 ILE 11 10.170 -9.800 -15.910 92 HD11 ILE 11 3HD1 ILE 11 6.798 -9.534 -12.643 93 HD12 ILE 11 1HD1 ILE 11 7.088 -10.771 -13.890 94 HD13 ILE 11 2HD1 ILE 11 7.010 -11.239 -12.174 95 H MET 12 HN MET 12 9.661 -7.015 -15.282 96 HA MET 12 HA MET 12 11.243 -7.325 -17.418 97 HB2 MET 12 2HB MET 12 9.206 -5.667 -16.775 98 HB3 MET 12 3HB MET 12 10.502 -4.507 -16.565 99 HG2 MET 12 2HG MET 12 11.264 -5.493 -18.969 100 HG3 MET 12 3HG MET 12 9.555 -5.861 -19.084 101 HE1 MET 12 3HE MET 12 12.308 -3.636 -18.758 102 HE2 MET 12 1HE MET 12 11.824 -2.646 -20.155 103 HE3 MET 12 2HE MET 12 11.707 -1.980 -18.508 104 H LYS 13 HN LYS 13 12.111 -5.848 -14.340 105 HA LYS 13 HA LYS 13 14.577 -4.808 -15.530 106 HB2 LYS 13 2HB LYS 13 13.179 -4.194 -12.914 107 HB3 LYS 13 3HB LYS 13 14.779 -3.608 -13.320 108 HG2 LYS 13 2HG LYS 13 13.995 -2.158 -14.969 109 HG3 LYS 13 3HG LYS 13 12.627 -3.175 -15.372 110 HD2 LYS 13 2HD LYS 13 11.487 -1.511 -14.237 111 HD3 LYS 13 3HD LYS 13 11.861 -2.541 -12.870 112 HE2 LYS 13 2HE LYS 13 13.900 -0.463 -13.672 113 HE3 LYS 13 3HE LYS 13 12.449 0.084 -12.855 114 HZ1 LYS 13 2HZ LYS 13 13.313 -2.115 -11.419 115 HZ3 LYS 13 1HZ LYS 13 13.448 -0.557 -10.962 116 H CYS 14 HN CYS 14 13.197 -7.079 -13.133 117 HA CYS 14 HA CYS 14 15.856 -8.280 -12.977 118 HB2 CYS 14 2HB CYS 14 14.207 -8.517 -10.545 119 HB3 CYS 14 3HB CYS 14 15.940 -8.332 -10.727 120 H SER 15 HN SER 15 15.004 -9.722 -14.674 121 HA SER 15 HA SER 15 12.923 -11.490 -13.651 122 HB2 SER 15 2HB SER 15 12.053 -10.571 -15.638 123 HB3 SER 15 3HB SER 15 13.614 -10.543 -16.434 124 HG SER 15 HG SER 15 11.777 -12.696 -16.115 125 H GLN 16 HN GLN 16 13.402 -13.686 -13.441 126 HA GLN 16 HA GLN 16 14.742 -15.383 -13.085 127 HB2 GLN 16 2HB GLN 16 15.692 -16.392 -15.159 128 HB3 GLN 16 3HB GLN 16 14.046 -15.837 -15.384 129 HG2 GLN 16 2HG GLN 16 14.827 -13.787 -16.494 130 HG3 GLN 16 3HG GLN 16 16.497 -14.174 -16.131 131 HE21 GLN 16 1HE2 GLN 16 17.490 -15.980 -17.121 132 HE22 GLN 16 2HE2 GLN 16 16.941 -16.603 -18.641 133 H CYS 17 HN CYS 17 15.931 -12.791 -12.374 134 HA CYS 17 HA CYS 17 18.743 -13.530 -12.730 135 HB2 CYS 17 2HB CYS 17 17.606 -11.273 -13.788 136 HB3 CYS 17 3HB CYS 17 18.196 -10.679 -12.250 137 H HIS 18 HN HIS 18 16.232 -11.798 -10.769 138 HA HIS 18 HA HIS 18 17.884 -12.330 -8.412 139 HB2 HIS 18 2HB HIS 18 16.202 -10.055 -9.256 140 HB3 HIS 18 3HB HIS 18 15.977 -10.543 -7.588 141 HD1 HIS 18 HD1 HIS 18 18.542 -10.959 -6.337 142 HD2 HIS 18 HD2 HIS 18 18.172 -8.191 -9.467 143 HE1 HIS 18 HE1 HIS 18 20.531 -9.375 -6.129 144 H THR 19 HN THR 19 17.049 -13.536 -6.711 145 HA THR 19 HA THR 19 14.389 -14.693 -7.219 146 HB THR 19 HB THR 19 15.453 -16.527 -5.650 147 HG1 THR 19 HG1 THR 19 17.894 -16.330 -6.070 148 HG21 THR 19 1HG2 THR 19 17.137 -16.442 -8.106 149 HG22 THR 19 2HG2 THR 19 16.032 -17.716 -7.540 150 HG23 THR 19 3HG2 THR 19 15.390 -16.308 -8.419 151 H VAL 20 HN VAL 20 12.899 -14.931 -5.514 152 HA VAL 20 HA VAL 20 13.609 -13.469 -3.077 153 HB VAL 20 HB VAL 20 11.459 -12.346 -3.113 154 HG11 VAL 20 1HG1 VAL 20 13.233 -11.967 -5.532 155 HG12 VAL 20 2HG1 VAL 20 11.858 -10.890 -5.186 156 HG13 VAL 20 3HG1 VAL 20 13.194 -11.031 -4.019 157 HG21 VAL 20 3HG2 VAL 20 10.997 -14.102 -5.464 158 HG22 VAL 20 1HG2 VAL 20 9.855 -13.480 -4.248 159 HG23 VAL 20 2HG2 VAL 20 10.381 -12.437 -5.592 160 H GLU 21 HN GLU 21 13.165 -16.389 -4.197 161 HA GLU 21 HA GLU 21 10.874 -17.242 -2.774 162 HB2 GLU 21 2HB GLU 21 13.190 -18.785 -4.020 163 HB3 GLU 21 3HB GLU 21 11.771 -19.548 -3.333 164 HG2 GLU 21 2HG GLU 21 11.401 -17.376 -5.408 165 HG3 GLU 21 3HG GLU 21 11.881 -18.977 -5.935 166 HE2 GLU 21 HE2 GLU 21 8.292 -18.717 -5.935 167 H LYS 22 HN LYS 22 10.854 -18.685 -0.883 168 HA LYS 22 HA LYS 22 12.652 -17.796 1.109 169 HB2 LYS 22 2HB LYS 22 10.659 -20.080 1.186 170 HB3 LYS 22 3HB LYS 22 11.410 -19.312 2.570 171 HG2 LYS 22 2HG LYS 22 9.948 -17.556 0.597 172 HG3 LYS 22 3HG LYS 22 8.992 -18.549 1.680 173 HD2 LYS 22 2HD LYS 22 11.235 -16.758 2.702 174 HD3 LYS 22 3HD LYS 22 9.601 -16.162 2.490 175 HE2 LYS 22 2HE LYS 22 10.195 -18.661 4.130 176 HE3 LYS 22 3HE LYS 22 10.236 -17.059 4.841 177 HZ1 LYS 22 2HZ LYS 22 8.040 -17.728 5.157 178 HZ3 LYS 22 1HZ LYS 22 7.910 -18.477 3.718 179 H GLY 23 HN GLY 23 14.725 -18.304 0.061 180 HA2 GLY 23 1HA GLY 23 16.577 -19.654 0.536 181 HA3 GLY 23 2HA GLY 23 15.534 -21.051 0.710 182 H GLY 24 HN GLY 24 14.909 -18.864 -1.985 183 HA2 GLY 24 1HA GLY 24 14.955 -20.734 -3.966 184 HA3 GLY 24 2HA GLY 24 15.269 -19.027 -4.203 185 H LYS 25 HN LYS 25 16.546 -20.660 -5.941 186 HA LYS 25 HA LYS 25 19.183 -21.226 -4.849 187 HB2 LYS 25 2HB LYS 25 19.496 -22.656 -6.628 188 HB3 LYS 25 3HB LYS 25 17.769 -22.798 -6.368 189 HG2 LYS 25 2HG LYS 25 19.020 -20.875 -8.382 190 HG3 LYS 25 3HG LYS 25 18.453 -22.479 -8.799 191 HD2 LYS 25 2HD LYS 25 16.194 -21.680 -7.647 192 HD3 LYS 25 3HD LYS 25 16.838 -20.073 -7.918 193 HE2 LYS 25 2HE LYS 25 17.133 -20.631 -10.361 194 HE3 LYS 25 3HE LYS 25 16.418 -22.205 -10.068 195 HZ1 LYS 25 2HZ LYS 25 14.609 -20.910 -10.718 196 HZ3 LYS 25 1HZ LYS 25 15.105 -19.570 -9.937 197 H HIS 26 HN HIS 26 21.120 -20.512 -6.169 198 HA HIS 26 HA HIS 26 20.666 -17.737 -6.933 199 HB2 HIS 26 2HB HIS 26 23.341 -19.041 -6.433 200 HB3 HIS 26 3HB HIS 26 22.940 -17.335 -6.415 201 HD1 HIS 26 HD1 HIS 26 21.680 -16.407 -4.288 202 HD2 HIS 26 HD2 HIS 26 22.835 -20.431 -4.043 203 HE1 HIS 26 HE1 HIS 26 21.465 -17.064 -1.832 204 H LYS 27 HN LYS 27 21.075 -16.980 -8.995 205 HA LYS 27 HA LYS 27 22.199 -18.937 -10.871 206 HB2 LYS 27 2HB LYS 27 19.594 -17.500 -10.966 207 HB3 LYS 27 3HB LYS 27 20.491 -17.593 -12.468 208 HG2 LYS 27 2HG LYS 27 20.761 -20.129 -11.969 209 HG3 LYS 27 3HG LYS 27 19.549 -19.906 -10.723 210 HD2 LYS 27 2HD LYS 27 19.221 -19.401 -13.714 211 HD3 LYS 27 3HD LYS 27 18.424 -20.634 -12.759 212 HE2 LYS 27 2HE LYS 27 17.526 -18.564 -11.346 213 HE3 LYS 27 3HE LYS 27 17.926 -17.646 -12.784 214 HZ1 LYS 27 2HZ LYS 27 16.264 -18.655 -13.965 215 HZ3 LYS 27 1HZ LYS 27 15.599 -18.889 -12.497 216 H THR 28 HN THR 28 21.000 -15.798 -11.911 217 HA THR 28 HA THR 28 23.746 -15.012 -12.469 218 HB THR 28 HB THR 28 22.278 -13.115 -13.654 219 HG1 THR 28 HG1 THR 28 20.149 -14.284 -14.114 220 HG21 THR 28 1HG2 THR 28 21.795 -15.912 -14.729 221 HG22 THR 28 2HG2 THR 28 22.171 -14.423 -15.627 222 HG23 THR 28 3HG2 THR 28 23.449 -15.257 -14.712 223 H GLY 29 HN GLY 29 21.200 -14.399 -10.159 224 HA2 GLY 29 1HA GLY 29 22.893 -12.300 -8.976 225 HA3 GLY 29 2HA GLY 29 21.191 -11.990 -9.254 226 HA PRO 30 HA PRO 30 21.895 -14.401 -5.316 227 HB2 PRO 30 2HB PRO 30 22.218 -12.444 -3.435 228 HB3 PRO 30 3HB PRO 30 23.559 -13.322 -4.146 229 HG2 PRO 30 2HG PRO 30 22.663 -10.556 -4.680 230 HG3 PRO 30 3HG PRO 30 24.209 -11.298 -5.040 231 HD2 PRO 30 2HD PRO 30 22.091 -10.757 -6.898 232 HD3 PRO 30 3HD PRO 30 23.589 -11.603 -7.232 233 H ASN 31 HN ASN 31 20.272 -15.021 -3.901 234 HA ASN 31 HA ASN 31 17.797 -13.910 -4.618 235 HB2 ASN 31 2HB ASN 31 18.155 -16.306 -3.896 236 HB3 ASN 31 3HB ASN 31 18.516 -15.750 -2.274 237 HD21 ASN 31 1HD2 ASN 31 16.336 -17.413 -3.547 238 HD22 ASN 31 2HD2 ASN 31 14.846 -16.752 -2.961 239 H LEU 32 HN LEU 32 16.752 -12.151 -3.654 240 HA LEU 32 HA LEU 32 17.979 -11.058 -1.244 241 HB2 LEU 32 2HB LEU 32 16.373 -9.969 -3.505 242 HB3 LEU 32 3HB LEU 32 16.247 -9.174 -1.949 243 HG LEU 32 HG LEU 32 18.595 -8.669 -1.917 244 HD11 LEU 32 1HD1 LEU 32 20.211 -9.457 -3.405 245 HD12 LEU 32 2HD1 LEU 32 19.208 -10.888 -3.069 246 HD13 LEU 32 3HD1 LEU 32 18.999 -9.993 -4.594 247 HD21 LEU 32 3HD2 LEU 32 16.923 -7.899 -4.221 248 HD22 LEU 32 1HD2 LEU 32 17.798 -6.895 -3.039 249 HD23 LEU 32 2HD2 LEU 32 18.668 -7.604 -4.420 250 H HIS 33 HN HIS 33 16.625 -13.461 -0.804 251 HA HIS 33 HA HIS 33 13.917 -13.002 -0.148 252 HB2 HIS 33 2HB HIS 33 14.282 -15.219 -0.506 253 HB3 HIS 33 3HB HIS 33 15.904 -15.186 0.156 254 HD1 HIS 33 HD1 HIS 33 15.798 -16.995 1.909 255 HD2 HIS 33 HD2 HIS 33 12.596 -14.297 2.185 256 HE1 HIS 33 HE1 HIS 33 14.531 -17.604 4.038 257 H GLY 34 HN GLY 34 17.037 -12.824 1.617 258 HA2 GLY 34 1HA GLY 34 15.593 -12.036 4.057 259 HA3 GLY 34 2HA GLY 34 17.260 -12.565 3.950 260 H LEU 35 HN LEU 35 15.991 -10.332 1.508 261 HA LEU 35 HA LEU 35 17.944 -8.504 1.642 262 HB2 LEU 35 2HB LEU 35 16.165 -8.593 -0.035 263 HB3 LEU 35 3HB LEU 35 15.013 -7.977 1.132 264 HG LEU 35 HG LEU 35 16.399 -5.883 1.298 265 HD11 LEU 35 1HD1 LEU 35 18.182 -7.443 -0.353 266 HD12 LEU 35 2HD1 LEU 35 17.742 -5.923 -1.168 267 HD13 LEU 35 3HD1 LEU 35 18.455 -5.885 0.462 268 HD21 LEU 35 3HD2 LEU 35 15.231 -4.881 -0.381 269 HD22 LEU 35 1HD2 LEU 35 15.610 -6.153 -1.567 270 HD23 LEU 35 2HD2 LEU 35 14.369 -6.437 -0.321 271 H PHE 36 HN PHE 36 14.754 -7.950 3.299 272 HA PHE 36 HA PHE 36 15.918 -5.942 4.942 273 HB2 PHE 36 2HB PHE 36 13.278 -7.505 4.825 274 HB3 PHE 36 3HB PHE 36 13.549 -6.282 6.050 275 HD1 PHE 36 HD2 PHE 36 13.498 -6.767 2.364 276 HD2 PHE 36 HD1 PHE 36 13.095 -4.039 5.590 277 HE1 PHE 36 HE2 PHE 36 12.718 -4.993 0.768 278 HE2 PHE 36 HE1 PHE 36 12.313 -2.267 3.994 279 HZ PHE 36 HZ PHE 36 12.134 -2.766 1.602 280 H GLY 37 HN GLY 37 17.536 -6.713 6.309 281 HA2 GLY 37 1HA GLY 37 17.704 -7.402 8.626 282 HA3 GLY 37 2HA GLY 37 16.662 -8.761 8.257 283 H ARG 38 HN ARG 38 19.194 -7.610 6.009 284 HA ARG 38 HA ARG 38 20.939 -9.716 6.899 285 HB2 ARG 38 2HB ARG 38 19.495 -10.805 5.184 286 HB3 ARG 38 3HB ARG 38 19.873 -9.537 4.036 287 HG2 ARG 38 2HG ARG 38 22.297 -10.172 4.142 288 HG3 ARG 38 3HG ARG 38 21.908 -11.451 5.274 289 HD2 ARG 38 2HD ARG 38 21.029 -11.229 2.362 290 HD3 ARG 38 3HD ARG 38 22.048 -12.464 3.074 291 HE ARG 38 HE ARG 38 19.132 -12.356 3.160 292 HH11 ARG 38 2HH2 ARG 38 21.998 -13.596 4.835 293 HH12 ARG 38 1HH2 ARG 38 21.141 -14.890 5.605 294 HH22 ARG 38 HH1 ARG 38 18.792 -15.145 5.203 295 H LYS 39 HN LYS 39 23.021 -8.907 6.906 296 HA LYS 39 HA LYS 39 23.537 -6.322 5.936 297 HB2 LYS 39 2HB LYS 39 24.641 -7.748 7.847 298 HB3 LYS 39 3HB LYS 39 25.708 -8.301 6.572 299 HG2 LYS 39 2HG LYS 39 26.545 -6.113 6.143 300 HG3 LYS 39 3HG LYS 39 25.180 -5.333 6.918 301 HD2 LYS 39 2HD LYS 39 26.188 -6.827 9.014 302 HD3 LYS 39 3HD LYS 39 27.657 -6.462 8.132 303 HE2 LYS 39 2HE LYS 39 26.571 -3.989 8.073 304 HE3 LYS 39 3HE LYS 39 25.743 -4.577 9.501 305 HZ1 LYS 39 2HZ LYS 39 28.221 -3.554 9.547 306 HZ3 LYS 39 1HZ LYS 39 28.589 -5.137 9.446 307 H THR 40 HN THR 40 25.569 -5.935 4.447 308 HA THR 40 HA THR 40 24.876 -7.097 1.918 309 HB THR 40 HB THR 40 26.910 -5.541 1.287 310 HG1 THR 40 HG1 THR 40 27.355 -4.097 3.119 311 HG21 THR 40 1HG2 THR 40 25.364 -3.878 0.970 312 HG22 THR 40 2HG2 THR 40 24.187 -4.968 1.743 313 HG23 THR 40 3HG2 THR 40 25.050 -3.753 2.718 314 H GLY 41 HN GLY 41 25.870 -8.661 0.749 315 HA2 GLY 41 1HA GLY 41 27.315 -10.308 0.237 316 HA3 GLY 41 2HA GLY 41 28.536 -9.490 1.189 317 H GLN 42 HN GLN 42 25.383 -11.204 1.825 318 HA GLN 42 HA GLN 42 26.784 -12.558 3.998 319 HB2 GLN 42 2HB GLN 42 23.851 -11.787 3.709 320 HB3 GLN 42 3HB GLN 42 24.430 -12.873 4.956 321 HG2 GLN 42 2HG GLN 42 25.373 -9.997 4.531 322 HG3 GLN 42 3HG GLN 42 24.274 -10.531 5.787 323 HE21 GLN 42 1HE2 GLN 42 27.536 -10.395 4.665 324 HE22 GLN 42 2HE2 GLN 42 28.329 -11.017 6.074 325 H ALA 43 HN ALA 43 24.533 -12.858 1.221 326 HA ALA 43 HA ALA 43 23.645 -15.373 1.366 327 HB1 ALA 43 3HB ALA 43 24.918 -14.092 -1.086 328 HB2 ALA 43 1HB ALA 43 23.699 -15.390 -1.084 329 HB3 ALA 43 2HB ALA 43 23.271 -13.764 -0.496 330 HA PRO 44 HA PRO 44 27.519 -17.476 1.818 331 HB2 PRO 44 2HB PRO 44 26.533 -19.647 3.153 332 HB3 PRO 44 3HB PRO 44 27.089 -18.196 3.963 333 HG2 PRO 44 2HG PRO 44 24.318 -19.116 3.503 334 HG3 PRO 44 3HG PRO 44 24.904 -17.926 4.649 335 HD2 PRO 44 2HD PRO 44 23.559 -17.404 2.170 336 HD3 PRO 44 3HD PRO 44 24.247 -16.217 3.259 337 H GLY 45 HN GLY 45 24.926 -17.918 -0.093 338 HA2 GLY 45 1HA GLY 45 25.893 -20.484 -1.156 339 HA3 GLY 45 2HA GLY 45 24.346 -19.726 -1.479 340 H TYR 46 HN TYR 46 26.314 -17.109 -1.577 341 HA TYR 46 HA TYR 46 27.694 -17.508 -4.030 342 HB2 TYR 46 2HB TYR 46 25.190 -17.388 -4.656 343 HB3 TYR 46 3HB TYR 46 25.129 -15.803 -3.914 344 HD1 TYR 46 HD1 TYR 46 27.714 -17.319 -6.169 345 HD2 TYR 46 HD2 TYR 46 24.755 -14.275 -5.636 346 HE1 TYR 46 HE1 TYR 46 28.401 -16.254 -8.373 347 HE2 TYR 46 HE2 TYR 46 25.452 -13.222 -7.842 348 HH TYR 46 HH TYR 46 28.140 -13.574 -9.236 349 H SER 47 HN SER 47 29.438 -16.200 -3.839 350 HA SER 47 HA SER 47 29.199 -13.954 -2.050 351 HB2 SER 47 2HB SER 47 31.596 -15.239 -3.429 352 HB3 SER 47 3HB SER 47 31.721 -13.837 -2.384 353 HG SER 47 HG SER 47 31.493 -16.503 -1.709 354 H TYR 48 HN TYR 48 29.739 -11.763 -2.682 355 HA TYR 48 HA TYR 48 29.401 -11.329 -5.559 356 HB2 TYR 48 2HB TYR 48 29.356 -9.255 -3.316 357 HB3 TYR 48 3HB TYR 48 28.456 -9.223 -4.819 358 HD1 TYR 48 HD2 TYR 48 27.567 -12.263 -4.432 359 HD2 TYR 48 HD1 TYR 48 27.341 -8.737 -2.019 360 HE1 TYR 48 HE2 TYR 48 25.533 -13.206 -3.231 361 HE2 TYR 48 HE1 TYR 48 25.308 -9.692 -0.827 362 HH TYR 48 HH TYR 48 23.488 -11.360 -1.430 363 H THR 49 HN THR 49 30.418 -8.861 -5.980 364 HA THR 49 HA THR 49 33.212 -9.355 -6.023 365 HB THR 49 HB THR 49 33.093 -6.889 -6.928 366 HG1 THR 49 HG1 THR 49 30.818 -6.332 -7.342 367 HG21 THR 49 1HG2 THR 49 32.668 -9.284 -8.219 368 HG22 THR 49 2HG2 THR 49 31.091 -8.495 -8.470 369 HG23 THR 49 3HG2 THR 49 32.582 -7.704 -9.036 370 H ALA 50 HN ALA 50 34.924 -8.106 -5.072 371 HA ALA 50 HA ALA 50 34.639 -7.803 -2.335 372 HB1 ALA 50 3HB ALA 50 36.685 -6.468 -4.150 373 HB2 ALA 50 1HB ALA 50 36.878 -6.879 -2.428 374 HB3 ALA 50 2HB ALA 50 36.757 -8.174 -3.644 375 H ALA 51 HN ALA 51 33.821 -5.666 -5.001 376 HA ALA 51 HA ALA 51 33.988 -3.220 -3.648 377 HB1 ALA 51 3HB ALA 51 32.932 -2.356 -5.541 378 HB2 ALA 51 1HB ALA 51 33.651 -3.852 -6.182 379 HB3 ALA 51 2HB ALA 51 31.922 -3.805 -5.766 380 H ASN 52 HN ASN 52 31.228 -5.523 -4.163 381 HA ASN 52 HA ASN 52 29.512 -3.969 -2.563 382 HB2 ASN 52 2HB ASN 52 28.854 -5.657 -4.403 383 HB3 ASN 52 3HB ASN 52 29.234 -6.935 -3.266 384 HD21 ASN 52 1HD2 ASN 52 28.191 -6.750 -1.090 385 HD22 ASN 52 2HD2 ASN 52 26.530 -6.262 -1.020 386 H LYS 53 HN LYS 53 31.088 -7.242 -2.182 387 HA LYS 53 HA LYS 53 30.327 -7.911 0.299 388 HB2 LYS 53 2HB LYS 53 31.982 -9.007 -1.427 389 HB3 LYS 53 3HB LYS 53 33.218 -8.237 -0.452 390 HG2 LYS 53 2HG LYS 53 31.763 -9.314 1.560 391 HG3 LYS 53 3HG LYS 53 31.301 -10.435 0.294 392 HD2 LYS 53 2HD LYS 53 33.872 -10.612 -0.206 393 HD3 LYS 53 3HD LYS 53 34.089 -9.861 1.363 394 HE2 LYS 53 2HE LYS 53 32.760 -12.528 0.738 395 HE3 LYS 53 3HE LYS 53 34.162 -12.237 1.749 396 HZ1 LYS 53 2HZ LYS 53 32.612 -12.285 3.392 397 HZ3 LYS 53 1HZ LYS 53 31.358 -11.931 2.416 398 H ASN 54 HN ASN 54 33.224 -5.842 -0.443 399 HA ASN 54 HA ASN 54 34.087 -5.319 1.994 400 HB2 ASN 54 2HB ASN 54 33.812 -3.629 -0.487 401 HB3 ASN 54 3HB ASN 54 34.269 -2.787 0.981 402 HD21 ASN 54 1HD2 ASN 54 35.818 -4.474 2.336 403 HD22 ASN 54 2HD2 ASN 54 37.254 -4.898 1.466 404 H LYS 55 HN LYS 55 31.224 -3.836 0.349 405 HA LYS 55 HA LYS 55 30.578 -1.856 2.095 406 HB2 LYS 55 2HB LYS 55 29.478 -2.716 -0.130 407 HB3 LYS 55 3HB LYS 55 28.428 -3.615 0.947 408 HG2 LYS 55 2HG LYS 55 27.269 -1.576 0.678 409 HG3 LYS 55 3HG LYS 55 28.093 -1.349 2.207 410 HD2 LYS 55 2HD LYS 55 30.039 -0.357 0.670 411 HD3 LYS 55 3HD LYS 55 28.742 -0.145 -0.491 412 HE2 LYS 55 2HE LYS 55 27.484 0.915 1.647 413 HE3 LYS 55 3HE LYS 55 29.127 1.181 2.191 414 HZ1 LYS 55 2HZ LYS 55 28.757 3.065 0.932 415 HZ3 LYS 55 1HZ LYS 55 27.781 2.333 -0.147 416 H GLY 56 HN GLY 56 29.340 -1.667 4.016 417 HA2 GLY 56 1HA GLY 56 28.683 -4.181 5.391 418 HA3 GLY 56 2HA GLY 56 29.787 -3.056 6.156 419 H ILE 57 HN ILE 57 26.490 -3.276 4.677 420 HA ILE 57 HA ILE 57 25.471 -1.678 6.850 421 HB ILE 57 HB ILE 57 24.358 -0.073 5.351 422 HG12 ILE 57 2HG1 ILE 57 25.653 0.139 3.047 423 HG13 ILE 57 3HG1 ILE 57 25.884 -1.585 3.263 424 HG21 ILE 57 1HG2 ILE 57 27.357 0.075 5.008 425 HG22 ILE 57 2HG2 ILE 57 26.190 1.408 5.176 426 HG23 ILE 57 3HG2 ILE 57 26.543 0.355 6.567 427 HD11 ILE 57 3HD1 ILE 57 23.789 -0.967 1.976 428 HD12 ILE 57 1HD1 ILE 57 23.487 -1.975 3.411 429 HD13 ILE 57 2HD1 ILE 57 23.160 -0.226 3.468 430 H ILE 58 HN ILE 58 23.055 -1.714 6.879 431 HA ILE 58 HA ILE 58 22.165 -4.251 5.747 432 HB ILE 58 HB ILE 58 20.953 -2.512 7.899 433 HG12 ILE 58 2HG1 ILE 58 23.233 -3.589 8.358 434 HG13 ILE 58 3HG1 ILE 58 21.945 -3.872 9.512 435 HG21 ILE 58 1HG2 ILE 58 19.136 -3.699 7.177 436 HG22 ILE 58 2HG2 ILE 58 20.113 -5.072 6.603 437 HG23 ILE 58 3HG2 ILE 58 19.821 -4.855 8.346 438 HD11 ILE 58 3HD1 ILE 58 23.455 -5.869 8.427 439 HD12 ILE 58 1HD1 ILE 58 21.790 -6.110 9.008 440 HD13 ILE 58 2HD1 ILE 58 22.099 -5.844 7.275 441 H TRP 59 HN TRP 59 20.239 -4.427 4.502 442 HA TRP 59 HA TRP 59 19.711 -2.040 2.965 443 HB2 TRP 59 2HB TRP 59 18.849 -4.920 2.709 444 HB3 TRP 59 3HB TRP 59 18.245 -3.647 1.667 445 HD1 TRP 59 HD1 TRP 59 20.962 -6.124 1.760 446 HE1 TRP 59 HE1 TRP 59 22.896 -5.657 0.027 447 HE3 TRP 59 HE3 TRP 59 19.596 -1.335 0.731 448 HZ2 TRP 59 HZ2 TRP 59 23.621 -3.388 -1.545 449 HZ3 TRP 59 HZ3 TRP 59 20.970 -0.063 -0.915 450 HH2 TRP 59 HH2 TRP 59 22.922 -1.015 -2.037 451 H GLY 60 HN GLY 60 17.295 -1.559 2.467 452 HA2 GLY 60 1HA GLY 60 15.285 -2.344 4.285 453 HA3 GLY 60 2HA GLY 60 15.989 -0.831 4.823 454 H GLU 61 HN GLU 61 13.954 0.266 4.383 455 HA GLU 61 HA GLU 61 13.133 0.312 1.626 456 HB2 GLU 61 2HB GLU 61 11.976 1.205 4.247 457 HB3 GLU 61 3HB GLU 61 11.455 2.074 2.817 458 HG2 GLU 61 2HG GLU 61 10.450 0.178 1.852 459 HG3 GLU 61 3HG GLU 61 11.481 -0.945 2.716 460 HE2 GLU 61 HE2 GLU 61 8.382 0.657 3.044 461 H ASP 62 HN ASP 62 15.064 2.154 3.897 462 HA ASP 62 HA ASP 62 14.827 4.562 2.364 463 HB2 ASP 62 2HB ASP 62 15.249 4.197 4.980 464 HB3 ASP 62 3HB ASP 62 16.928 4.096 4.491 465 HD2 ASP 62 HD2 ASP 62 16.936 6.056 5.900 466 H THR 63 HN THR 63 17.514 2.350 3.477 467 HA THR 63 HA THR 63 19.542 3.336 1.929 468 HB THR 63 HB THR 63 20.392 0.899 2.144 469 HG1 THR 63 HG1 THR 63 18.804 -0.287 3.615 470 HG21 THR 63 1HG2 THR 63 20.053 0.905 4.762 471 HG22 THR 63 2HG2 THR 63 21.012 2.215 4.032 472 HG23 THR 63 3HG2 THR 63 19.317 2.504 4.495 473 H LEU 64 HN LEU 64 16.696 1.555 0.893 474 HA LEU 64 HA LEU 64 17.906 0.921 -1.657 475 HB2 LEU 64 2HB LEU 64 15.274 0.353 -0.332 476 HB3 LEU 64 3HB LEU 64 15.463 0.136 -2.060 477 HG LEU 64 HG LEU 64 17.221 -1.212 0.005 478 HD11 LEU 64 1HD1 LEU 64 15.406 -2.980 -1.401 479 HD12 LEU 64 2HD1 LEU 64 15.692 -2.788 0.345 480 HD13 LEU 64 3HD1 LEU 64 14.519 -1.737 -0.485 481 HD21 LEU 64 3HD2 LEU 64 17.688 -2.752 -1.957 482 HD22 LEU 64 1HD2 LEU 64 16.925 -1.517 -2.988 483 HD23 LEU 64 2HD2 LEU 64 18.383 -1.116 -2.049 484 H MET 65 HN MET 65 15.572 3.219 -0.192 485 HA MET 65 HA MET 65 14.562 4.263 -2.513 486 HB2 MET 65 2HB MET 65 15.006 5.218 0.318 487 HB3 MET 65 3HB MET 65 14.588 6.447 -0.860 488 HG2 MET 65 2HG MET 65 12.946 3.907 -0.789 489 HG3 MET 65 3HG MET 65 12.685 5.106 0.462 490 HE1 MET 65 3HE MET 65 12.502 5.040 -3.853 491 HE2 MET 65 1HE MET 65 12.153 3.765 -2.662 492 HE3 MET 65 2HE MET 65 10.826 4.744 -3.331 493 H GLU 66 HN GLU 66 17.789 4.455 -1.239 494 HA GLU 66 HA GLU 66 18.324 6.805 -2.863 495 HB2 GLU 66 2HB GLU 66 19.195 7.134 -0.683 496 HB3 GLU 66 3HB GLU 66 19.767 5.483 -0.552 497 HG2 GLU 66 2HG GLU 66 21.510 5.912 -2.260 498 HG3 GLU 66 3HG GLU 66 20.900 7.536 -2.511 499 HE2 GLU 66 HE2 GLU 66 21.930 8.430 0.852 500 H TYR 67 HN TYR 67 19.040 3.336 -2.442 501 HA TYR 67 HA TYR 67 21.182 3.246 -4.287 502 HB2 TYR 67 2HB TYR 67 20.470 1.594 -2.419 503 HB3 TYR 67 3HB TYR 67 19.103 1.144 -3.419 504 HD1 TYR 67 HD1 TYR 67 22.689 1.730 -4.349 505 HD2 TYR 67 HD2 TYR 67 19.460 -1.064 -4.082 506 HE1 TYR 67 HE1 TYR 67 24.109 -0.033 -5.506 507 HE2 TYR 67 HE2 TYR 67 20.891 -2.818 -5.239 508 HH TYR 67 HH TYR 67 24.218 -2.470 -5.609 509 H LEU 68 HN LEU 68 17.750 2.059 -4.557 510 HA LEU 68 HA LEU 68 17.748 1.323 -7.144 511 HB2 LEU 68 2HB LEU 68 15.589 2.763 -5.600 512 HB3 LEU 68 3HB LEU 68 15.335 1.985 -7.150 513 HG LEU 68 HG LEU 68 15.685 0.798 -4.450 514 HD11 LEU 68 1HD1 LEU 68 13.801 0.737 -6.645 515 HD12 LEU 68 2HD1 LEU 68 14.264 -0.911 -6.154 516 HD13 LEU 68 3HD1 LEU 68 13.600 0.223 -4.953 517 HD21 LEU 68 3HD2 LEU 68 17.645 -0.146 -5.398 518 HD22 LEU 68 1HD2 LEU 68 16.381 -1.397 -5.481 519 HD23 LEU 68 2HD2 LEU 68 16.825 -0.481 -6.941 520 H GLU 69 HN GLU 69 17.553 4.676 -5.852 521 HA GLU 69 HA GLU 69 16.960 5.943 -8.198 522 HB2 GLU 69 2HB GLU 69 16.896 7.224 -6.200 523 HB3 GLU 69 3HB GLU 69 18.524 6.765 -5.736 524 HG2 GLU 69 2HG GLU 69 18.589 9.061 -6.545 525 HG3 GLU 69 3HG GLU 69 19.422 8.051 -7.710 526 HE2 GLU 69 HE2 GLU 69 17.122 10.511 -7.818 527 H ASN 70 HN ASN 70 20.172 4.961 -6.856 528 HA ASN 70 HA ASN 70 21.179 4.901 -9.528 529 HB2 ASN 70 2HB ASN 70 23.292 6.253 -8.515 530 HB3 ASN 70 3HB ASN 70 21.965 7.084 -9.299 531 HD21 ASN 70 1HD2 ASN 70 21.716 8.911 -8.240 532 HD22 ASN 70 2HD2 ASN 70 21.496 9.099 -6.532 533 HA PRO 71 HA PRO 71 22.822 1.828 -6.573 534 HB2 PRO 71 2HB PRO 71 22.213 -0.419 -8.005 535 HB3 PRO 71 3HB PRO 71 21.163 0.243 -6.767 536 HG2 PRO 71 2HG PRO 71 20.868 0.364 -9.706 537 HG3 PRO 71 3HG PRO 71 19.656 0.630 -8.469 538 HD2 PRO 71 2HD PRO 71 21.000 2.638 -10.015 539 HD3 PRO 71 3HD PRO 71 19.874 2.907 -8.699 540 H LYS 72 HN LYS 72 23.551 2.950 -9.575 541 HA LYS 72 HA LYS 72 25.786 1.138 -9.938 542 HB2 LYS 72 2HB LYS 72 26.029 2.111 -12.081 543 HB3 LYS 72 3HB LYS 72 24.308 1.903 -11.830 544 HG2 LYS 72 2HG LYS 72 23.905 4.155 -11.867 545 HG3 LYS 72 3HG LYS 72 25.282 4.513 -10.844 546 HD2 LYS 72 2HD LYS 72 25.826 3.626 -13.676 547 HD3 LYS 72 3HD LYS 72 25.213 5.250 -13.432 548 HE2 LYS 72 2HE LYS 72 27.097 5.904 -12.120 549 HE3 LYS 72 3HE LYS 72 27.558 4.247 -11.784 550 HZ1 LYS 72 2HZ LYS 72 28.488 5.819 -13.864 551 HZ3 LYS 72 1HZ LYS 72 27.549 4.703 -14.588 552 H LYS 73 HN LYS 73 25.002 4.204 -8.466 553 HA LYS 73 HA LYS 73 27.790 5.039 -8.508 554 HB2 LYS 73 2HB LYS 73 27.051 7.153 -7.978 555 HB3 LYS 73 3HB LYS 73 25.705 6.549 -8.922 556 HG2 LYS 73 2HG LYS 73 24.468 7.251 -7.117 557 HG3 LYS 73 3HG LYS 73 24.915 5.688 -6.460 558 HD2 LYS 73 2HD LYS 73 27.050 6.915 -5.548 559 HD3 LYS 73 3HD LYS 73 26.171 8.394 -5.879 560 HE2 LYS 73 2HE LYS 73 24.281 7.590 -4.441 561 HE3 LYS 73 3HE LYS 73 25.167 6.116 -4.105 562 HZ1 LYS 73 2HZ LYS 73 25.402 7.998 -2.427 563 HZ3 LYS 73 1HZ LYS 73 26.341 8.769 -3.511 564 H TYR 74 HN TYR 74 25.290 3.642 -6.397 565 HA TYR 74 HA TYR 74 26.549 4.121 -3.949 566 HB2 TYR 74 2HB TYR 74 24.172 3.186 -4.711 567 HB3 TYR 74 3HB TYR 74 24.969 1.628 -4.795 568 HD1 TYR 74 HD1 TYR 74 26.594 1.355 -2.489 569 HD2 TYR 74 HD2 TYR 74 22.843 3.385 -2.829 570 HE1 TYR 74 HE1 TYR 74 26.176 1.015 -0.005 571 HE2 TYR 74 HE2 TYR 74 22.438 3.037 -0.344 572 HH TYR 74 HH TYR 74 24.836 2.201 1.773 573 H ILE 75 HN ILE 75 26.822 1.406 -6.319 574 HA ILE 75 HA ILE 75 29.333 0.696 -5.016 575 HB ILE 75 HB ILE 75 27.281 -1.384 -5.750 576 HG12 ILE 75 2HG1 ILE 75 27.823 -0.140 -3.040 577 HG13 ILE 75 3HG1 ILE 75 26.334 -0.047 -3.958 578 HG21 ILE 75 1HG2 ILE 75 28.699 -2.928 -4.646 579 HG22 ILE 75 2HG2 ILE 75 29.741 -1.965 -5.722 580 HG23 ILE 75 3HG2 ILE 75 29.715 -1.630 -3.973 581 HD11 ILE 75 3HD1 ILE 75 25.841 -1.810 -2.510 582 HD12 ILE 75 1HD1 ILE 75 26.481 -2.706 -3.907 583 HD13 ILE 75 2HD1 ILE 75 27.520 -2.403 -2.494 584 HA PRO 76 HA PRO 76 29.875 0.983 -9.428 585 HB2 PRO 76 2HB PRO 76 32.362 2.113 -9.361 586 HB3 PRO 76 3HB PRO 76 30.883 3.052 -9.413 587 HG2 PRO 76 2HG PRO 76 32.695 2.572 -7.127 588 HG3 PRO 76 3HG PRO 76 31.479 3.819 -7.321 589 HD2 PRO 76 2HD PRO 76 31.261 1.442 -5.729 590 HD3 PRO 76 3HD PRO 76 30.005 2.629 -6.016 591 H GLY 77 HN GLY 77 30.665 -0.483 -10.857 592 HA2 GLY 77 1HA GLY 77 32.153 -2.076 -11.576 593 HA3 GLY 77 2HA GLY 77 33.002 -2.005 -10.044 594 H THR 78 HN THR 78 29.582 -2.173 -9.604 595 HA THR 78 HA THR 78 29.787 -4.770 -8.450 596 HB THR 78 HB THR 78 28.332 -2.934 -7.569 597 HG1 THR 78 HG1 THR 78 27.811 -5.307 -7.422 598 HG21 THR 78 1HG2 THR 78 26.655 -3.485 -10.074 599 HG22 THR 78 2HG2 THR 78 26.231 -2.387 -8.739 600 HG23 THR 78 3HG2 THR 78 27.597 -1.998 -9.812 601 H LYS 79 HN LYS 79 28.056 -6.490 -9.000 602 HA LYS 79 HA LYS 79 28.562 -7.224 -11.713 603 HB2 LYS 79 2HB LYS 79 26.864 -8.592 -9.605 604 HB3 LYS 79 3HB LYS 79 27.419 -9.297 -11.110 605 HG2 LYS 79 2HG LYS 79 29.825 -8.523 -10.176 606 HG3 LYS 79 3HG LYS 79 29.001 -8.617 -8.633 607 HD2 LYS 79 2HD LYS 79 28.222 -10.978 -9.339 608 HD3 LYS 79 3HD LYS 79 29.345 -10.853 -10.678 609 HE2 LYS 79 2HE LYS 79 30.339 -10.276 -7.877 610 HE3 LYS 79 3HE LYS 79 30.109 -11.943 -8.367 611 HZ1 LYS 79 2HZ LYS 79 31.511 -10.405 -10.349 612 HZ3 LYS 79 1HZ LYS 79 31.924 -11.832 -9.684 613 H MET 80 HN MET 80 25.961 -5.684 -9.875 614 HA MET 80 HA MET 80 23.771 -6.224 -11.289 615 HB2 MET 80 2HB MET 80 24.353 -4.457 -9.359 616 HB3 MET 80 3HB MET 80 24.462 -3.320 -10.688 617 HG2 MET 80 2HG MET 80 22.200 -3.092 -10.221 618 HG3 MET 80 3HG MET 80 22.096 -4.416 -11.366 619 HE1 MET 80 3HE MET 80 20.437 -3.890 -7.623 620 HE2 MET 80 1HE MET 80 22.041 -4.253 -6.942 621 HE3 MET 80 2HE MET 80 21.866 -2.985 -8.179 622 H ILE 81 HN ILE 81 22.892 -5.810 -13.311 623 HA ILE 81 HA ILE 81 24.641 -4.334 -15.144 624 HB ILE 81 HB ILE 81 22.773 -6.654 -15.485 625 HG12 ILE 81 2HG1 ILE 81 25.652 -6.126 -16.276 626 HG13 ILE 81 3HG1 ILE 81 25.099 -7.148 -14.965 627 HG21 ILE 81 1HG2 ILE 81 21.989 -5.733 -17.369 628 HG22 ILE 81 2HG2 ILE 81 23.255 -4.482 -17.407 629 HG23 ILE 81 3HG2 ILE 81 23.592 -6.112 -18.041 630 HD11 ILE 81 3HD1 ILE 81 25.182 -8.840 -16.489 631 HD12 ILE 81 1HD1 ILE 81 23.665 -8.159 -17.123 632 HD13 ILE 81 2HD1 ILE 81 25.221 -7.710 -17.864 633 H PHE 82 HN PHE 82 21.450 -4.525 -13.637 634 HA PHE 82 HA PHE 82 20.027 -2.951 -15.423 635 HB2 PHE 82 2HB PHE 82 19.009 -4.222 -13.564 636 HB3 PHE 82 3HB PHE 82 19.992 -3.381 -12.382 637 HD1 PHE 82 HD1 PHE 82 17.468 -2.594 -15.023 638 HD2 PHE 82 HD2 PHE 82 18.997 -1.695 -11.169 639 HE1 PHE 82 HE1 PHE 82 15.630 -0.918 -14.685 640 HE2 PHE 82 HE2 PHE 82 17.159 -0.020 -10.830 641 HZ PHE 82 HZ PHE 82 15.498 0.349 -12.592 642 H VAL 83 HN VAL 83 19.150 -0.677 -14.866 643 HA VAL 83 HA VAL 83 21.381 0.961 -13.876 644 HB VAL 83 HB VAL 83 20.603 2.671 -15.503 645 HG11 VAL 83 1HG1 VAL 83 21.222 0.334 -17.226 646 HG12 VAL 83 2HG1 VAL 83 22.042 1.906 -17.080 647 HG13 VAL 83 3HG1 VAL 83 22.344 0.630 -15.876 648 HG21 VAL 83 3HG2 VAL 83 18.287 1.440 -15.697 649 HG22 VAL 83 1HG2 VAL 83 18.968 2.305 -17.096 650 HG23 VAL 83 2HG2 VAL 83 19.106 0.532 -16.990 651 H GLY 84 HN GLY 84 20.876 2.626 -12.443 652 HA2 GLY 84 1HA GLY 84 18.898 2.420 -10.655 653 HA3 GLY 84 2HA GLY 84 19.584 3.959 -11.137 654 H ILE 85 HN ILE 85 16.832 3.495 -10.270 655 HA ILE 85 HA ILE 85 15.236 3.546 -12.668 656 HB ILE 85 HB ILE 85 14.570 3.835 -9.739 657 HG12 ILE 85 2HG1 ILE 85 14.170 1.530 -11.668 658 HG13 ILE 85 3HG1 ILE 85 15.398 1.613 -10.420 659 HG21 ILE 85 1HG2 ILE 85 12.208 3.502 -10.482 660 HG22 ILE 85 2HG2 ILE 85 12.915 5.065 -10.955 661 HG23 ILE 85 3HG2 ILE 85 12.750 3.763 -12.157 662 HD11 ILE 85 3HD1 ILE 85 12.500 1.043 -10.180 663 HD12 ILE 85 1HD1 ILE 85 13.843 0.577 -9.109 664 HD13 ILE 85 2HD1 ILE 85 13.112 2.194 -8.969 665 H LYS 86 HN LYS 86 13.585 5.390 -12.923 666 HA LYS 86 HA LYS 86 15.029 7.907 -12.475 667 HB2 LYS 86 2HB LYS 86 14.130 8.724 -14.499 668 HB3 LYS 86 3HB LYS 86 14.707 7.108 -14.851 669 HG2 LYS 86 2HG LYS 86 12.326 6.263 -14.433 670 HG3 LYS 86 3HG LYS 86 11.816 7.936 -14.328 671 HD2 LYS 86 2HD LYS 86 13.434 7.119 -16.737 672 HD3 LYS 86 3HD LYS 86 11.769 6.579 -16.656 673 HE2 LYS 86 2HE LYS 86 10.913 8.810 -16.615 674 HE3 LYS 86 3HE LYS 86 12.457 9.493 -16.145 675 HZ1 LYS 86 2HZ LYS 86 12.583 8.073 -18.646 676 HZ3 LYS 86 1HZ LYS 86 13.110 9.573 -18.293 677 H LYS 87 HN LYS 87 11.900 6.173 -12.260 678 HA LYS 87 HA LYS 87 10.708 8.522 -11.020 679 HB2 LYS 87 2HB LYS 87 9.607 5.910 -12.067 680 HB3 LYS 87 3HB LYS 87 8.647 6.978 -11.064 681 HG2 LYS 87 2HG LYS 87 9.262 8.868 -12.720 682 HG3 LYS 87 3HG LYS 87 9.898 7.617 -13.770 683 HD2 LYS 87 2HD LYS 87 7.701 6.511 -13.875 684 HD3 LYS 87 3HD LYS 87 7.043 7.616 -12.685 685 HE2 LYS 87 2HE LYS 87 6.301 8.653 -14.636 686 HE3 LYS 87 3HE LYS 87 7.828 9.486 -14.422 687 HZ1 LYS 87 2HZ LYS 87 8.693 7.458 -15.849 688 HZ3 LYS 87 1HZ LYS 87 8.036 8.754 -16.582 689 H LYS 88 HN LYS 88 9.937 8.547 -8.867 690 HA LYS 88 HA LYS 88 11.354 6.672 -7.165 691 HB2 LYS 88 2HB LYS 88 10.938 8.230 -5.398 692 HB3 LYS 88 3HB LYS 88 11.500 9.130 -6.791 693 HG2 LYS 88 2HG LYS 88 8.908 9.361 -7.339 694 HG3 LYS 88 3HG LYS 88 8.701 8.974 -5.643 695 HD2 LYS 88 2HD LYS 88 10.176 11.343 -6.855 696 HD3 LYS 88 3HD LYS 88 8.805 11.373 -5.762 697 HE2 LYS 88 2HE LYS 88 11.553 10.277 -4.997 698 HE3 LYS 88 3HE LYS 88 11.039 11.919 -4.669 699 HZ1 LYS 88 2HZ LYS 88 10.287 10.971 -2.759 700 HZ3 LYS 88 1HZ LYS 88 10.191 9.466 -3.373 701 H GLU 89 HN GLU 89 8.038 7.661 -8.102 702 HA GLU 89 HA GLU 89 6.687 6.285 -6.149 703 HB2 GLU 89 2HB GLU 89 6.031 7.177 -8.956 704 HB3 GLU 89 3HB GLU 89 4.894 6.136 -8.123 705 HG2 GLU 89 2HG GLU 89 4.993 7.783 -6.152 706 HG3 GLU 89 3HG GLU 89 5.909 8.857 -7.189 707 HE2 GLU 89 HE2 GLU 89 3.653 9.889 -6.467 708 H GLU 90 HN GLU 90 8.491 5.129 -8.925 709 HA GLU 90 HA GLU 90 7.141 2.607 -8.957 710 HB2 GLU 90 2HB GLU 90 9.636 3.588 -10.412 711 HB3 GLU 90 3HB GLU 90 8.877 2.033 -10.690 712 HG2 GLU 90 2HG GLU 90 7.698 4.793 -11.213 713 HG3 GLU 90 3HG GLU 90 8.038 3.538 -12.388 714 HE2 GLU 90 HE2 GLU 90 4.645 3.397 -10.299 715 H ARG 91 HN ARG 91 9.840 4.124 -7.325 716 HA ARG 91 HA ARG 91 11.273 1.757 -6.848 717 HB2 ARG 91 2HB ARG 91 11.284 4.518 -5.548 718 HB3 ARG 91 3HB ARG 91 12.349 3.240 -4.998 719 HG2 ARG 91 2HG ARG 91 13.427 3.085 -7.177 720 HG3 ARG 91 3HG ARG 91 12.225 4.125 -7.914 721 HD2 ARG 91 2HD ARG 91 13.069 5.825 -5.978 722 HD3 ARG 91 3HD ARG 91 14.524 4.858 -6.113 723 HE ARG 91 HE ARG 91 13.905 5.412 -8.752 724 HH11 ARG 91 2HH2 ARG 91 14.347 7.441 -5.883 725 HH12 ARG 91 1HH2 ARG 91 14.908 8.810 -6.784 726 HH22 ARG 91 HH1 ARG 91 15.075 8.655 -9.170 727 H ALA 92 HN ALA 92 8.693 3.598 -5.169 728 HA ALA 92 HA ALA 92 8.868 2.152 -2.737 729 HB1 ALA 92 3HB ALA 92 6.287 3.179 -2.931 730 HB2 ALA 92 1HB ALA 92 7.700 4.025 -2.257 731 HB3 ALA 92 2HB ALA 92 7.244 4.273 -3.960 732 H ASP 93 HN ASP 93 6.691 1.979 -5.636 733 HA ASP 93 HA ASP 93 5.096 -0.032 -4.743 734 HB2 ASP 93 2HB ASP 93 6.113 0.221 -7.607 735 HB3 ASP 93 3HB ASP 93 4.578 -0.450 -7.095 736 HD2 ASP 93 HD2 ASP 93 4.065 2.964 -8.309 737 H LEU 94 HN LEU 94 8.200 -0.178 -6.637 738 HA LEU 94 HA LEU 94 8.291 -2.969 -6.825 739 HB2 LEU 94 2HB LEU 94 9.587 -1.019 -8.030 740 HB3 LEU 94 3HB LEU 94 10.761 -1.286 -6.756 741 HG LEU 94 HG LEU 94 9.780 -3.402 -8.693 742 HD11 LEU 94 1HD1 LEU 94 12.455 -1.982 -8.634 743 HD12 LEU 94 2HD1 LEU 94 11.909 -3.209 -9.802 744 HD13 LEU 94 3HD1 LEU 94 11.127 -1.611 -9.760 745 HD21 LEU 94 3HD2 LEU 94 11.478 -3.498 -6.267 746 HD22 LEU 94 1HD2 LEU 94 10.458 -4.750 -7.015 747 HD23 LEU 94 2HD2 LEU 94 12.071 -4.400 -7.682 748 H ILE 95 HN ILE 95 9.544 -0.632 -4.387 749 HA ILE 95 HA ILE 95 10.870 -2.647 -2.889 750 HB ILE 95 HB ILE 95 10.123 0.224 -2.410 751 HG12 ILE 95 2HG1 ILE 95 12.866 -1.037 -2.504 752 HG13 ILE 95 3HG1 ILE 95 12.029 -0.538 -3.962 753 HG21 ILE 95 1HG2 ILE 95 11.276 -1.756 -0.448 754 HG22 ILE 95 2HG2 ILE 95 11.603 -0.009 -0.330 755 HG23 ILE 95 3HG2 ILE 95 9.930 -0.611 -0.231 756 HD11 ILE 95 3HD1 ILE 95 13.491 1.096 -2.094 757 HD12 ILE 95 1HD1 ILE 95 12.695 1.593 -3.608 758 HD13 ILE 95 2HD1 ILE 95 11.789 1.616 -2.076 759 H ALA 96 HN ALA 96 7.571 -1.783 -3.356 760 HA ALA 96 HA ALA 96 6.680 -2.487 -0.730 761 HB1 ALA 96 3HB ALA 96 4.827 -1.460 -1.476 762 HB2 ALA 96 1HB ALA 96 5.646 -1.204 -3.037 763 HB3 ALA 96 2HB ALA 96 4.644 -2.654 -2.784 764 H TYR 97 HN TYR 97 7.421 -4.135 -3.772 765 HA TYR 97 HA TYR 97 6.084 -6.555 -2.835 766 HB2 TYR 97 2HB TYR 97 5.733 -5.969 -5.178 767 HB3 TYR 97 3HB TYR 97 7.402 -5.476 -5.380 768 HD1 TYR 97 HD2 TYR 97 6.014 -8.653 -3.959 769 HD2 TYR 97 HD1 TYR 97 8.244 -6.805 -7.108 770 HE1 TYR 97 HE2 TYR 97 6.580 -10.942 -4.912 771 HE2 TYR 97 HE1 TYR 97 8.803 -9.100 -8.049 772 HH TYR 97 HH TYR 97 8.652 -11.236 -7.785 773 H LEU 98 HN LEU 98 9.298 -5.104 -3.345 774 HA LEU 98 HA LEU 98 10.727 -7.536 -3.201 775 HB2 LEU 98 2HB LEU 98 11.421 -4.627 -2.955 776 HB3 LEU 98 3HB LEU 98 12.613 -5.858 -2.592 777 HG LEU 98 HG LEU 98 11.238 -5.335 -5.232 778 HD11 LEU 98 1HD1 LEU 98 13.524 -4.995 -6.049 779 HD12 LEU 98 2HD1 LEU 98 13.125 -3.878 -4.722 780 HD13 LEU 98 3HD1 LEU 98 14.155 -5.296 -4.412 781 HD21 LEU 98 3HD2 LEU 98 13.050 -7.295 -5.794 782 HD22 LEU 98 1HD2 LEU 98 12.427 -7.829 -4.213 783 HD23 LEU 98 2HD2 LEU 98 11.304 -7.552 -5.566 784 H LYS 99 HN LYS 99 8.883 -5.808 -0.907 785 HA LYS 99 HA LYS 99 10.525 -6.764 1.311 786 HB2 LYS 99 2HB LYS 99 9.932 -4.451 1.483 787 HB3 LYS 99 3HB LYS 99 8.247 -4.780 1.136 788 HG2 LYS 99 2HG LYS 99 7.937 -4.895 3.386 789 HG3 LYS 99 3HG LYS 99 8.743 -6.449 3.320 790 HD2 LYS 99 2HD LYS 99 10.961 -4.960 3.424 791 HD3 LYS 99 3HD LYS 99 9.880 -3.756 4.098 792 HE2 LYS 99 2HE LYS 99 10.165 -6.605 5.172 793 HE3 LYS 99 3HE LYS 99 10.987 -5.211 5.845 794 HZ1 LYS 99 2HZ LYS 99 8.041 -5.573 5.701 795 HZ3 LYS 99 1HZ LYS 99 8.759 -4.209 6.232 796 H LYS 100 HN LYS 100 7.077 -6.775 0.167 797 HA LYS 100 HA LYS 100 6.189 -8.641 2.016 798 HB2 LYS 100 2HB LYS 100 4.968 -7.076 0.256 799 HB3 LYS 100 3HB LYS 100 5.006 -8.521 -0.734 800 HG2 LYS 100 2HG LYS 100 4.126 -8.860 2.120 801 HG3 LYS 100 3HG LYS 100 3.023 -8.018 1.050 802 HD2 LYS 100 2HD LYS 100 2.648 -9.894 -0.286 803 HD3 LYS 100 3HD LYS 100 4.241 -10.565 0.012 804 HE2 LYS 100 2HE LYS 100 1.874 -10.554 1.940 805 HE3 LYS 100 3HE LYS 100 2.583 -11.952 1.157 806 HZ1 LYS 100 2HZ LYS 100 3.473 -10.592 3.515 807 HZ3 LYS 100 1HZ LYS 100 4.693 -10.784 2.453 808 H ALA 101 HN ALA 101 7.842 -9.012 -1.140 809 HA ALA 101 HA ALA 101 7.419 -11.805 -1.302 810 HB1 ALA 101 3HB ALA 101 8.917 -11.683 -3.168 811 HB2 ALA 101 1HB ALA 101 7.973 -10.174 -3.181 812 HB3 ALA 101 2HB ALA 101 9.647 -10.173 -2.571 813 H THR 102 HN THR 102 10.064 -9.692 -0.045 814 HA THR 102 HA THR 102 11.420 -12.093 0.946 815 HB THR 102 HB THR 102 13.378 -10.707 0.990 816 HG1 THR 102 HG1 THR 102 13.063 -8.592 1.583 817 HG21 THR 102 1HG2 THR 102 12.694 -11.013 -1.383 818 HG22 THR 102 2HG2 THR 102 11.601 -9.614 -1.255 819 HG23 THR 102 3HG2 THR 102 13.362 -9.379 -1.146 820 H ASN 103 HN ASN 103 8.959 -11.555 2.181 821 HA ASN 103 HA ASN 103 9.946 -10.623 4.760 822 HB2 ASN 103 2HB ASN 103 8.359 -8.950 4.047 823 HB3 ASN 103 3HB ASN 103 7.261 -10.149 3.394 824 HD21 ASN 103 1HD2 ASN 103 8.859 -9.216 6.433 825 HD22 ASN 103 2HD2 ASN 103 7.528 -9.537 7.493 826 H GLU 104 HN GLU 104 7.354 -12.504 3.018 827 HA GLU 104 HA GLU 104 6.276 -13.917 4.971 828 HB2 GLU 104 2HB GLU 104 7.167 -14.990 2.258 829 HB3 GLU 104 3HB GLU 104 6.016 -15.798 3.303 830 HG2 GLU 104 2HG GLU 104 4.787 -13.423 3.269 831 HG3 GLU 104 3HG GLU 104 5.705 -13.197 1.794 832 HE2 GLU 104 HE2 GLU 104 3.617 -15.254 -0.013 833 HHA HEC 500 HHA HEC 500 23.617 -7.004 -5.155 834 HHB HEC 500 HHB HEC 500 17.700 -4.632 -5.698 835 HHC HEC 500 HHC HEC 500 18.000 -6.065 -11.978 836 HHD HEC 500 HHD HEC 500 23.059 -9.811 -10.826 837 HMA1 HEC 500 1HMA HEC 500 18.365 -4.576 -3.473 838 HMA2 HEC 500 2HMA HEC 500 19.825 -4.633 -2.479 839 HMA3 HEC 500 3HMA HEC 500 19.613 -3.315 -3.644 840 HAA1 HEC 500 1HAA HEC 500 23.306 -5.443 -3.456 841 HAA2 HEC 500 2HAA HEC 500 21.942 -5.041 -2.540 842 HBA1 HEC 500 1HBA HEC 500 22.658 -7.897 -3.312 843 HBA2 HEC 500 2HBA HEC 500 23.024 -7.140 -1.749 844 HMB1 HEC 500 1HMB HEC 500 14.683 -4.792 -7.975 845 HMB2 HEC 500 2HMB HEC 500 15.604 -4.726 -6.488 846 HMB3 HEC 500 3HMB HEC 500 15.609 -3.313 -7.568 847 HAB HEC 500 HAB HEC 500 16.446 -4.600 -11.636 848 HBB1 HEC 500 1HBB HEC 500 15.346 -2.757 -11.384 849 HBB2 HEC 500 2HBB HEC 500 14.160 -3.595 -10.349 850 HBB3 HEC 500 3HBB HEC 500 15.586 -2.867 -9.638 851 HMC1 HEC 500 1HMC HEC 500 18.259 -8.859 -13.669 852 HMC2 HEC 500 2HMC HEC 500 18.430 -7.106 -13.844 853 HMC3 HEC 500 3HMC HEC 500 19.602 -8.164 -14.600 854 HAC HEC 500 HAC HEC 500 22.043 -10.669 -12.457 855 HBC1 HEC 500 1HBC HEC 500 21.111 -9.395 -15.030 856 HBC2 HEC 500 2HBC HEC 500 22.644 -9.011 -14.215 857 HBC3 HEC 500 3HBC HEC 500 22.361 -10.646 -14.806 858 HMD1 HEC 500 1HMD HEC 500 24.734 -11.233 -8.827 859 HMD2 HEC 500 2HMD HEC 500 25.244 -10.047 -10.041 860 HMD3 HEC 500 3HMD HEC 500 26.055 -10.143 -8.453 861 HAD1 HEC 500 1HAD HEC 500 25.245 -8.736 -5.256 862 HAD2 HEC 500 2HAD HEC 500 26.064 -9.469 -6.568 863 HBD1 HEC 500 1HBD HEC 500 26.923 -7.180 -5.578 864 HBD2 HEC 500 2HBD HEC 500 26.931 -7.415 -7.340 Start of MODEL 17 1 H1 GLY 1 HN GLY 1 0.830 0.604 -0.350 2 HA2 GLY 1 1HA GLY 1 2.101 1.269 -2.767 3 HA3 GLY 1 2HA GLY 1 3.322 0.771 -1.615 4 H ASP 2 HN ASP 2 1.193 -0.326 -3.988 5 HA ASP 2 HA ASP 2 0.414 -2.757 -2.812 6 HB2 ASP 2 2HB ASP 2 -0.525 -1.465 -4.908 7 HB3 ASP 2 3HB ASP 2 0.738 -2.290 -5.797 8 HD2 ASP 2 HD2 ASP 2 -2.419 -3.268 -4.144 9 H VAL 3 HN VAL 3 1.079 -4.852 -4.413 10 HA VAL 3 HA VAL 3 4.017 -4.804 -4.497 11 HB VAL 3 HB VAL 3 3.644 -6.280 -2.818 12 HG11 VAL 3 1HG1 VAL 3 1.192 -6.005 -2.810 13 HG12 VAL 3 2HG1 VAL 3 1.060 -7.187 -4.133 14 HG13 VAL 3 3HG1 VAL 3 1.671 -7.698 -2.541 15 HG21 VAL 3 3HG2 VAL 3 4.609 -7.436 -4.930 16 HG22 VAL 3 1HG2 VAL 3 4.078 -8.450 -3.568 17 HG23 VAL 3 2HG2 VAL 3 3.038 -8.270 -5.001 18 H GLU 4 HN GLU 4 1.037 -6.333 -5.897 19 HA GLU 4 HA GLU 4 2.167 -7.572 -8.000 20 HB2 GLU 4 2HB GLU 4 -0.476 -6.048 -7.965 21 HB3 GLU 4 3HB GLU 4 -0.037 -7.257 -9.156 22 HG2 GLU 4 2HG GLU 4 0.416 -8.773 -7.005 23 HG3 GLU 4 3HG GLU 4 -0.649 -7.625 -6.217 24 HE2 GLU 4 HE2 GLU 4 -3.383 -8.531 -8.324 25 H LYS 5 HN LYS 5 1.543 -4.080 -7.572 26 HA LYS 5 HA LYS 5 1.974 -3.370 -10.265 27 HB2 LYS 5 2HB LYS 5 1.740 -1.964 -7.647 28 HB3 LYS 5 3HB LYS 5 2.535 -1.098 -8.946 29 HG2 LYS 5 2HG LYS 5 -0.108 -2.509 -9.445 30 HG3 LYS 5 3HG LYS 5 -0.084 -0.925 -8.696 31 HD2 LYS 5 2HD LYS 5 -0.210 -0.286 -10.929 32 HD3 LYS 5 3HD LYS 5 1.532 -0.323 -10.739 33 HE2 LYS 5 2HE LYS 5 1.774 -2.304 -11.961 34 HE3 LYS 5 3HE LYS 5 0.182 -2.897 -11.529 35 HZ1 LYS 5 2HZ LYS 5 0.863 -1.565 -13.860 36 HZ3 LYS 5 1HZ LYS 5 -0.056 -0.504 -13.035 37 H GLY 6 HN GLY 6 4.094 -3.917 -7.440 38 HA2 GLY 6 1HA GLY 6 6.428 -2.961 -8.906 39 HA3 GLY 6 2HA GLY 6 6.355 -3.497 -7.239 40 H LYS 7 HN LYS 7 4.587 -5.864 -8.567 41 HA LYS 7 HA LYS 7 6.765 -7.690 -8.592 42 HB2 LYS 7 2HB LYS 7 4.412 -8.115 -7.740 43 HB3 LYS 7 3HB LYS 7 3.896 -8.202 -9.413 44 HG2 LYS 7 2HG LYS 7 5.022 -10.203 -9.813 45 HG3 LYS 7 3HG LYS 7 6.291 -9.852 -8.658 46 HD2 LYS 7 2HD LYS 7 5.039 -10.610 -6.825 47 HD3 LYS 7 3HD LYS 7 3.501 -10.251 -7.586 48 HE2 LYS 7 2HE LYS 7 3.900 -12.153 -9.206 49 HE3 LYS 7 3HE LYS 7 5.381 -12.537 -8.351 50 HZ1 LYS 7 2HZ LYS 7 3.003 -12.327 -6.686 51 HZ3 LYS 7 1HZ LYS 7 4.219 -13.407 -6.608 52 H LYS 8 HN LYS 8 5.182 -5.667 -10.954 53 HA LYS 8 HA LYS 8 6.033 -7.324 -13.167 54 HB2 LYS 8 2HB LYS 8 4.651 -4.625 -13.081 55 HB3 LYS 8 3HB LYS 8 4.983 -5.542 -14.537 56 HG2 LYS 8 2HG LYS 8 3.435 -6.772 -12.223 57 HG3 LYS 8 3HG LYS 8 2.629 -5.795 -13.433 58 HD2 LYS 8 2HD LYS 8 2.997 -7.348 -15.149 59 HD3 LYS 8 3HD LYS 8 4.449 -7.991 -14.407 60 HE2 LYS 8 2HE LYS 8 2.464 -9.566 -14.318 61 HE3 LYS 8 3HE LYS 8 3.174 -9.225 -12.752 62 HZ1 LYS 8 2HZ LYS 8 1.422 -7.575 -12.372 63 HZ3 LYS 8 1HZ LYS 8 0.743 -9.018 -12.707 64 H ILE 9 HN ILE 9 6.870 -4.197 -11.579 65 HA ILE 9 HA ILE 9 8.894 -3.559 -13.443 66 HB ILE 9 HB ILE 9 8.264 -2.608 -10.653 67 HG12 ILE 9 2HG1 ILE 9 8.033 -0.865 -13.048 68 HG13 ILE 9 3HG1 ILE 9 6.874 -2.174 -12.932 69 HG21 ILE 9 1HG2 ILE 9 10.639 -2.125 -12.316 70 HG22 ILE 9 2HG2 ILE 9 9.825 -0.648 -11.750 71 HG23 ILE 9 3HG2 ILE 9 10.376 -1.866 -10.575 72 HD11 ILE 9 3HD1 ILE 9 5.835 -1.285 -11.074 73 HD12 ILE 9 1HD1 ILE 9 7.351 -0.625 -10.413 74 HD13 ILE 9 2HD1 ILE 9 6.506 0.230 -11.727 75 H PHE 10 HN PHE 10 8.637 -5.964 -11.010 76 HA PHE 10 HA PHE 10 11.459 -5.980 -10.407 77 HB2 PHE 10 2HB PHE 10 10.031 -6.639 -8.595 78 HB3 PHE 10 3HB PHE 10 8.916 -7.472 -9.659 79 HD1 PHE 10 HD2 PHE 10 12.271 -7.712 -8.112 80 HD2 PHE 10 HD1 PHE 10 9.121 -9.787 -10.054 81 HE1 PHE 10 HE2 PHE 10 13.362 -9.900 -7.542 82 HE2 PHE 10 HE1 PHE 10 10.211 -11.976 -9.485 83 HZ PHE 10 HZ PHE 10 12.318 -12.006 -8.235 84 H ILE 11 HN ILE 11 9.189 -7.463 -12.661 85 HA ILE 11 HA ILE 11 10.953 -9.666 -13.242 86 HB ILE 11 HB ILE 11 8.342 -8.721 -14.420 87 HG12 ILE 11 2HG1 ILE 11 8.963 -11.182 -12.765 88 HG13 ILE 11 3HG1 ILE 11 8.352 -9.684 -12.093 89 HG21 ILE 11 1HG2 ILE 11 8.552 -10.097 -16.152 90 HG22 ILE 11 2HG2 ILE 11 10.273 -10.255 -15.731 91 HG23 ILE 11 3HG2 ILE 11 9.093 -11.435 -15.112 92 HD11 ILE 11 3HD1 ILE 11 6.263 -9.886 -13.163 93 HD12 ILE 11 1HD1 ILE 11 6.906 -10.963 -14.426 94 HD13 ILE 11 2HD1 ILE 11 6.655 -11.579 -12.775 95 H MET 12 HN MET 12 9.487 -7.100 -15.358 96 HA MET 12 HA MET 12 11.053 -7.316 -17.465 97 HB2 MET 12 2HB MET 12 9.821 -4.970 -16.018 98 HB3 MET 12 3HB MET 12 10.939 -4.579 -17.308 99 HG2 MET 12 2HG MET 12 8.667 -6.566 -17.725 100 HG3 MET 12 3HG MET 12 8.426 -4.844 -17.937 101 HE1 MET 12 3HE MET 12 9.522 -4.182 -21.368 102 HE2 MET 12 1HE MET 12 8.052 -4.448 -20.400 103 HE3 MET 12 2HE MET 12 9.360 -3.420 -19.769 104 H LYS 13 HN LYS 13 12.058 -6.093 -14.289 105 HA LYS 13 HA LYS 13 14.657 -5.351 -15.414 106 HB2 LYS 13 2HB LYS 13 13.051 -4.455 -13.078 107 HB3 LYS 13 3HB LYS 13 14.785 -4.534 -12.842 108 HG2 LYS 13 2HG LYS 13 15.212 -3.021 -14.670 109 HG3 LYS 13 3HG LYS 13 13.581 -3.181 -15.290 110 HD2 LYS 13 2HD LYS 13 12.948 -2.257 -12.834 111 HD3 LYS 13 3HD LYS 13 14.570 -1.599 -12.923 112 HE2 LYS 13 2HE LYS 13 14.060 -0.322 -14.908 113 HE3 LYS 13 3HE LYS 13 12.574 -1.207 -15.190 114 HZ1 LYS 13 2HZ LYS 13 12.494 1.105 -14.016 115 HZ3 LYS 13 1HZ LYS 13 12.862 0.275 -12.665 116 H CYS 14 HN CYS 14 13.374 -6.926 -12.395 117 HA CYS 14 HA CYS 14 15.774 -8.560 -12.383 118 HB2 CYS 14 2HB CYS 14 13.746 -8.830 -10.234 119 HB3 CYS 14 3HB CYS 14 15.497 -8.826 -10.146 120 H SER 15 HN SER 15 14.605 -9.444 -14.525 121 HA SER 15 HA SER 15 12.362 -11.066 -14.160 122 HB2 SER 15 2HB SER 15 13.243 -12.084 -16.407 123 HB3 SER 15 3HB SER 15 12.718 -10.412 -16.382 124 HG SER 15 HG SER 15 14.700 -9.780 -16.881 125 H GLN 16 HN GLN 16 15.522 -12.341 -15.363 126 HA GLN 16 HA GLN 16 15.222 -14.477 -13.398 127 HB2 GLN 16 2HB GLN 16 16.694 -15.743 -15.208 128 HB3 GLN 16 3HB GLN 16 14.956 -15.627 -15.397 129 HG2 GLN 16 2HG GLN 16 15.228 -13.645 -16.877 130 HG3 GLN 16 3HG GLN 16 16.965 -13.698 -16.655 131 HE21 GLN 16 1HE2 GLN 16 16.729 -13.779 -19.060 132 HE22 GLN 16 2HE2 GLN 16 16.659 -15.334 -19.823 133 H CYS 17 HN CYS 17 16.453 -12.385 -12.323 134 HA CYS 17 HA CYS 17 19.294 -13.061 -12.557 135 HB2 CYS 17 2HB CYS 17 17.970 -10.432 -12.757 136 HB3 CYS 17 3HB CYS 17 19.346 -10.481 -11.673 137 H HIS 18 HN HIS 18 16.753 -11.403 -10.540 138 HA HIS 18 HA HIS 18 18.131 -12.440 -8.181 139 HB2 HIS 18 2HB HIS 18 16.467 -10.018 -8.731 140 HB3 HIS 18 3HB HIS 18 16.393 -10.712 -7.123 141 HD1 HIS 18 HD1 HIS 18 18.860 -11.015 -5.911 142 HD2 HIS 18 HD2 HIS 18 18.613 -8.359 -9.148 143 HE1 HIS 18 HE1 HIS 18 20.914 -9.510 -5.759 144 H THR 19 HN THR 19 16.733 -13.265 -6.384 145 HA THR 19 HA THR 19 14.191 -14.351 -7.383 146 HB THR 19 HB THR 19 14.914 -16.490 -6.112 147 HG1 THR 19 HG1 THR 19 17.466 -15.106 -6.537 148 HG21 THR 19 1HG2 THR 19 15.172 -16.063 -8.712 149 HG22 THR 19 2HG2 THR 19 16.897 -15.850 -8.327 150 HG23 THR 19 3HG2 THR 19 16.090 -17.397 -7.971 151 H VAL 20 HN VAL 20 12.767 -15.147 -5.577 152 HA VAL 20 HA VAL 20 13.305 -13.679 -3.103 153 HB VAL 20 HB VAL 20 10.953 -12.943 -3.076 154 HG11 VAL 20 1HG1 VAL 20 11.215 -11.251 -5.017 155 HG12 VAL 20 2HG1 VAL 20 12.439 -11.256 -3.725 156 HG13 VAL 20 3HG1 VAL 20 12.792 -12.031 -5.287 157 HG21 VAL 20 3HG2 VAL 20 10.922 -14.172 -5.842 158 HG22 VAL 20 1HG2 VAL 20 9.827 -14.488 -4.475 159 HG23 VAL 20 2HG2 VAL 20 9.755 -12.929 -5.331 160 H GLU 21 HN GLU 21 11.120 -16.019 -4.816 161 HA GLU 21 HA GLU 21 9.938 -17.202 -2.766 162 HB2 GLU 21 2HB GLU 21 9.787 -19.221 -4.119 163 HB3 GLU 21 3HB GLU 21 9.697 -17.828 -5.179 164 HG2 GLU 21 2HG GLU 21 12.283 -18.098 -5.448 165 HG3 GLU 21 3HG GLU 21 12.069 -19.681 -4.728 166 HE2 GLU 21 HE2 GLU 21 10.593 -18.975 -8.397 167 H LYS 22 HN LYS 22 10.389 -18.695 -1.113 168 HA LYS 22 HA LYS 22 12.816 -18.681 0.077 169 HB2 LYS 22 2HB LYS 22 10.643 -19.481 1.029 170 HB3 LYS 22 3HB LYS 22 10.845 -20.984 0.151 171 HG2 LYS 22 2HG LYS 22 11.657 -21.066 2.554 172 HG3 LYS 22 3HG LYS 22 12.860 -21.542 1.371 173 HD2 LYS 22 2HD LYS 22 14.081 -19.521 1.594 174 HD3 LYS 22 3HD LYS 22 12.710 -18.646 2.246 175 HE2 LYS 22 2HE LYS 22 14.203 -19.060 4.099 176 HE3 LYS 22 3HE LYS 22 12.832 -20.131 4.316 177 HZ1 LYS 22 2HZ LYS 22 14.545 -21.623 4.535 178 HZ3 LYS 22 1HZ LYS 22 15.572 -20.817 3.561 179 H GLY 23 HN GLY 23 11.625 -20.972 -2.441 180 HA2 GLY 23 1HA GLY 23 14.190 -22.359 -2.445 181 HA3 GLY 23 2HA GLY 23 12.745 -22.776 -3.345 182 H GLY 24 HN GLY 24 14.237 -19.503 -3.175 183 HA2 GLY 24 1HA GLY 24 14.611 -19.625 -6.094 184 HA3 GLY 24 2HA GLY 24 14.394 -18.179 -5.129 185 H LYS 25 HN LYS 25 16.659 -20.898 -5.815 186 HA LYS 25 HA LYS 25 18.798 -20.025 -4.306 187 HB2 LYS 25 2HB LYS 25 20.147 -21.452 -5.719 188 HB3 LYS 25 3HB LYS 25 18.619 -22.236 -5.374 189 HG2 LYS 25 2HG LYS 25 18.736 -22.583 -7.675 190 HG3 LYS 25 3HG LYS 25 17.840 -21.078 -7.644 191 HD2 LYS 25 2HD LYS 25 19.656 -19.806 -8.381 192 HD3 LYS 25 3HD LYS 25 20.843 -20.879 -7.664 193 HE2 LYS 25 2HE LYS 25 19.122 -21.843 -9.974 194 HE3 LYS 25 3HE LYS 25 20.540 -20.860 -10.286 195 HZ1 LYS 25 2HZ LYS 25 21.670 -22.613 -8.719 196 HZ3 LYS 25 1HZ LYS 25 21.429 -22.982 -10.287 197 H HIS 26 HN HIS 26 21.002 -19.502 -5.828 198 HA HIS 26 HA HIS 26 20.389 -16.815 -6.714 199 HB2 HIS 26 2HB HIS 26 23.141 -18.023 -6.518 200 HB3 HIS 26 3HB HIS 26 22.671 -16.338 -6.415 201 HD1 HIS 26 HD1 HIS 26 20.489 -16.452 -4.239 202 HD2 HIS 26 HD2 HIS 26 24.124 -18.531 -4.014 203 HE1 HIS 26 HE1 HIS 26 20.901 -16.904 -1.761 204 H LYS 27 HN LYS 27 20.337 -16.184 -8.827 205 HA LYS 27 HA LYS 27 21.129 -18.222 -10.782 206 HB2 LYS 27 2HB LYS 27 18.694 -17.159 -10.510 207 HB3 LYS 27 3HB LYS 27 19.391 -15.905 -11.516 208 HG2 LYS 27 2HG LYS 27 19.626 -17.302 -13.353 209 HG3 LYS 27 3HG LYS 27 19.942 -18.721 -12.376 210 HD2 LYS 27 2HD LYS 27 17.684 -18.667 -13.622 211 HD3 LYS 27 3HD LYS 27 17.624 -19.079 -11.918 212 HE2 LYS 27 2HE LYS 27 17.413 -16.158 -12.565 213 HE3 LYS 27 3HE LYS 27 16.056 -17.150 -13.059 214 HZ1 LYS 27 2HZ LYS 27 15.484 -17.542 -10.901 215 HZ3 LYS 27 1HZ LYS 27 16.327 -16.185 -10.584 216 H THR 28 HN THR 28 20.730 -14.626 -10.948 217 HA THR 28 HA THR 28 23.386 -14.536 -12.197 218 HB THR 28 HB THR 28 21.241 -12.367 -12.193 219 HG1 THR 28 HG1 THR 28 20.579 -13.528 -14.196 220 HG21 THR 28 1HG2 THR 28 23.340 -11.643 -13.204 221 HG22 THR 28 2HG2 THR 28 23.522 -13.194 -14.059 222 HG23 THR 28 3HG2 THR 28 22.239 -12.058 -14.540 223 H GLY 29 HN GLY 29 21.613 -13.729 -9.307 224 HA2 GLY 29 1HA GLY 29 24.042 -12.564 -8.197 225 HA3 GLY 29 2HA GLY 29 22.639 -11.516 -8.258 226 HA PRO 30 HA PRO 30 22.313 -13.981 -4.449 227 HB2 PRO 30 2HB PRO 30 22.212 -11.916 -2.662 228 HB3 PRO 30 3HB PRO 30 23.693 -12.761 -3.066 229 HG2 PRO 30 2HG PRO 30 22.801 -10.075 -3.919 230 HG3 PRO 30 3HG PRO 30 24.415 -10.757 -3.951 231 HD2 PRO 30 2HD PRO 30 22.650 -10.420 -6.186 232 HD3 PRO 30 3HD PRO 30 24.215 -11.208 -6.197 233 H ASN 31 HN ASN 31 20.463 -14.707 -3.493 234 HA ASN 31 HA ASN 31 18.136 -13.609 -4.621 235 HB2 ASN 31 2HB ASN 31 18.119 -15.969 -4.119 236 HB3 ASN 31 3HB ASN 31 18.693 -15.711 -2.483 237 HD21 ASN 31 1HD2 ASN 31 16.065 -16.379 -4.351 238 HD22 ASN 31 2HD2 ASN 31 14.773 -15.930 -3.289 239 H LEU 32 HN LEU 32 16.354 -12.545 -3.425 240 HA LEU 32 HA LEU 32 17.326 -11.169 -1.024 241 HB2 LEU 32 2HB LEU 32 15.087 -10.327 -2.863 242 HB3 LEU 32 3HB LEU 32 15.819 -9.394 -1.573 243 HG LEU 32 HG LEU 32 18.015 -9.820 -3.078 244 HD11 LEU 32 1HD1 LEU 32 17.178 -11.025 -4.875 245 HD12 LEU 32 2HD1 LEU 32 15.667 -10.085 -4.939 246 HD13 LEU 32 3HD1 LEU 32 17.194 -9.355 -5.490 247 HD21 LEU 32 3HD2 LEU 32 16.810 -7.582 -4.285 248 HD22 LEU 32 1HD2 LEU 32 16.149 -7.670 -2.635 249 HD23 LEU 32 2HD2 LEU 32 17.909 -7.613 -2.887 250 H HIS 33 HN HIS 33 16.812 -12.797 0.500 251 HA HIS 33 HA HIS 33 13.939 -13.340 0.693 252 HB2 HIS 33 2HB HIS 33 15.040 -15.391 0.286 253 HB3 HIS 33 3HB HIS 33 16.350 -15.015 1.387 254 HD1 HIS 33 HD1 HIS 33 16.154 -15.942 3.713 255 HD2 HIS 33 HD2 HIS 33 12.462 -15.822 1.728 256 HE1 HIS 33 HE1 HIS 33 14.480 -17.107 5.247 257 H GLY 34 HN GLY 34 16.969 -12.919 2.656 258 HA2 GLY 34 1HA GLY 34 15.304 -11.941 4.876 259 HA3 GLY 34 2HA GLY 34 16.952 -12.526 4.980 260 H LEU 35 HN LEU 35 16.026 -10.405 2.295 261 HA LEU 35 HA LEU 35 18.020 -8.632 2.531 262 HB2 LEU 35 2HB LEU 35 16.447 -8.754 0.676 263 HB3 LEU 35 3HB LEU 35 15.177 -8.076 1.674 264 HG LEU 35 HG LEU 35 16.536 -5.984 1.900 265 HD11 LEU 35 1HD1 LEU 35 18.364 -5.620 0.250 266 HD12 LEU 35 2HD1 LEU 35 18.753 -6.822 1.505 267 HD13 LEU 35 3HD1 LEU 35 18.310 -7.357 -0.134 268 HD21 LEU 35 3HD2 LEU 35 15.174 -6.987 -0.479 269 HD22 LEU 35 1HD2 LEU 35 15.033 -5.421 0.353 270 HD23 LEU 35 2HD2 LEU 35 16.327 -5.681 -0.841 271 H PHE 36 HN PHE 36 14.720 -7.613 3.620 272 HA PHE 36 HA PHE 36 15.681 -5.588 5.243 273 HB2 PHE 36 2HB PHE 36 13.154 -7.314 5.111 274 HB3 PHE 36 3HB PHE 36 13.282 -6.048 6.316 275 HD1 PHE 36 HD1 PHE 36 13.160 -6.717 2.692 276 HD2 PHE 36 HD2 PHE 36 13.006 -3.755 5.726 277 HE1 PHE 36 HE1 PHE 36 12.353 -5.036 1.010 278 HE2 PHE 36 HE2 PHE 36 12.200 -2.074 4.045 279 HZ PHE 36 HZ PHE 36 11.883 -2.735 1.708 280 H GLY 37 HN GLY 37 17.197 -5.993 6.827 281 HA2 GLY 37 1HA GLY 37 17.365 -6.469 9.159 282 HA3 GLY 37 2HA GLY 37 16.383 -7.901 8.927 283 H ARG 38 HN ARG 38 18.897 -6.990 6.572 284 HA ARG 38 HA ARG 38 20.729 -8.847 7.783 285 HB2 ARG 38 2HB ARG 38 19.362 -10.269 6.272 286 HB3 ARG 38 3HB ARG 38 19.657 -9.175 4.936 287 HG2 ARG 38 2HG ARG 38 22.118 -9.643 5.111 288 HG3 ARG 38 3HG ARG 38 21.805 -10.758 6.426 289 HD2 ARG 38 2HD ARG 38 20.985 -11.029 3.508 290 HD3 ARG 38 3HD ARG 38 21.972 -12.124 4.458 291 HE ARG 38 HE ARG 38 19.080 -12.094 4.335 292 HH11 ARG 38 2HH2 ARG 38 21.772 -12.757 6.541 293 HH12 ARG 38 1HH2 ARG 38 20.859 -13.852 7.524 294 HH22 ARG 38 HH1 ARG 38 18.570 -14.299 6.971 295 H LYS 39 HN LYS 39 22.948 -8.569 6.975 296 HA LYS 39 HA LYS 39 23.332 -5.921 5.863 297 HB2 LYS 39 2HB LYS 39 24.958 -7.870 7.424 298 HB3 LYS 39 3HB LYS 39 25.828 -6.810 6.334 299 HG2 LYS 39 2HG LYS 39 25.210 -4.869 7.487 300 HG3 LYS 39 3HG LYS 39 23.712 -5.560 8.075 301 HD2 LYS 39 2HD LYS 39 26.438 -6.537 9.029 302 HD3 LYS 39 3HD LYS 39 25.588 -5.222 9.817 303 HE2 LYS 39 2HE LYS 39 23.658 -6.695 10.289 304 HE3 LYS 39 3HE LYS 39 24.400 -8.006 9.395 305 HZ1 LYS 39 2HZ LYS 39 25.485 -8.563 11.263 306 HZ3 LYS 39 1HZ LYS 39 24.837 -7.314 12.081 307 H THR 40 HN THR 40 25.638 -6.069 4.425 308 HA THR 40 HA THR 40 24.708 -7.409 2.035 309 HB THR 40 HB THR 40 26.657 -6.119 1.049 310 HG1 THR 40 HG1 THR 40 27.674 -4.678 2.721 311 HG21 THR 40 1HG2 THR 40 24.271 -5.033 2.075 312 HG22 THR 40 2HG2 THR 40 25.540 -4.005 2.783 313 HG23 THR 40 3HG2 THR 40 25.424 -4.185 1.016 314 H GLY 41 HN GLY 41 26.567 -8.441 0.631 315 HA2 GLY 41 1HA GLY 41 27.633 -10.433 0.407 316 HA3 GLY 41 2HA GLY 41 28.765 -9.683 1.514 317 H GLN 42 HN GLN 42 25.396 -11.006 1.909 318 HA GLN 42 HA GLN 42 26.436 -12.479 4.192 319 HB2 GLN 42 2HB GLN 42 23.628 -11.555 3.466 320 HB3 GLN 42 3HB GLN 42 23.939 -12.676 4.778 321 HG2 GLN 42 2HG GLN 42 24.944 -9.808 4.523 322 HG3 GLN 42 3HG GLN 42 23.843 -10.444 5.730 323 HE21 GLN 42 1HE2 GLN 42 26.733 -9.255 5.511 324 HE22 GLN 42 2HE2 GLN 42 27.657 -10.217 6.617 325 H ALA 43 HN ALA 43 24.331 -12.759 1.262 326 HA ALA 43 HA ALA 43 23.494 -15.296 1.373 327 HB1 ALA 43 3HB ALA 43 24.801 -14.116 -1.103 328 HB2 ALA 43 1HB ALA 43 23.428 -15.246 -1.020 329 HB3 ALA 43 2HB ALA 43 23.228 -13.562 -0.481 330 HA PRO 44 HA PRO 44 27.406 -17.318 1.856 331 HB2 PRO 44 2HB PRO 44 26.448 -19.528 3.148 332 HB3 PRO 44 3HB PRO 44 26.959 -18.075 3.984 333 HG2 PRO 44 2HG PRO 44 24.216 -19.051 3.469 334 HG3 PRO 44 3HG PRO 44 24.758 -17.864 4.639 335 HD2 PRO 44 2HD PRO 44 23.440 -17.339 2.147 336 HD3 PRO 44 3HD PRO 44 24.084 -16.151 3.261 337 H GLY 45 HN GLY 45 24.869 -17.777 -0.115 338 HA2 GLY 45 1HA GLY 45 25.863 -20.329 -1.173 339 HA3 GLY 45 2HA GLY 45 24.343 -19.546 -1.557 340 H TYR 46 HN TYR 46 26.156 -16.895 -1.615 341 HA TYR 46 HA TYR 46 27.572 -17.360 -4.101 342 HB2 TYR 46 2HB TYR 46 25.067 -16.847 -4.543 343 HB3 TYR 46 3HB TYR 46 25.296 -15.318 -3.718 344 HD1 TYR 46 HD1 TYR 46 27.360 -17.128 -6.284 345 HD2 TYR 46 HD2 TYR 46 25.182 -13.590 -5.261 346 HE1 TYR 46 HE1 TYR 46 28.074 -16.047 -8.472 347 HE2 TYR 46 HE2 TYR 46 25.904 -12.521 -7.452 348 HH TYR 46 HH TYR 46 27.004 -12.755 -9.289 349 H SER 47 HN SER 47 29.157 -15.764 -4.537 350 HA SER 47 HA SER 47 29.476 -13.885 -2.329 351 HB2 SER 47 2HB SER 47 31.643 -15.035 -4.142 352 HB3 SER 47 3HB SER 47 31.902 -13.994 -2.757 353 HG SER 47 HG SER 47 31.923 -15.743 -1.539 354 H TYR 48 HN TYR 48 29.897 -11.684 -2.817 355 HA TYR 48 HA TYR 48 29.437 -10.987 -5.623 356 HB2 TYR 48 2HB TYR 48 29.560 -9.119 -3.208 357 HB3 TYR 48 3HB TYR 48 28.577 -8.942 -4.649 358 HD1 TYR 48 HD2 TYR 48 27.651 -11.992 -4.471 359 HD2 TYR 48 HD1 TYR 48 27.631 -8.683 -1.759 360 HE1 TYR 48 HE2 TYR 48 25.670 -13.003 -3.239 361 HE2 TYR 48 HE1 TYR 48 25.650 -9.706 -0.537 362 HH TYR 48 HH TYR 48 24.031 -11.223 -0.692 363 H THR 49 HN THR 49 30.475 -8.454 -5.779 364 HA THR 49 HA THR 49 33.216 -8.971 -6.177 365 HB THR 49 HB THR 49 33.113 -6.358 -6.527 366 HG1 THR 49 HG1 THR 49 30.711 -5.847 -6.743 367 HG21 THR 49 1HG2 THR 49 32.941 -7.694 -8.531 368 HG22 THR 49 2HG2 THR 49 31.366 -8.357 -8.035 369 HG23 THR 49 3HG2 THR 49 31.496 -6.655 -8.537 370 H ALA 50 HN ALA 50 34.860 -7.160 -5.318 371 HA ALA 50 HA ALA 50 34.920 -7.651 -2.473 372 HB1 ALA 50 3HB ALA 50 36.800 -7.076 -4.641 373 HB2 ALA 50 1HB ALA 50 37.123 -6.082 -3.200 374 HB3 ALA 50 2HB ALA 50 37.085 -7.857 -3.066 375 H ALA 51 HN ALA 51 33.747 -5.242 -4.635 376 HA ALA 51 HA ALA 51 34.184 -3.060 -2.782 377 HB1 ALA 51 3HB ALA 51 34.398 -2.698 -5.209 378 HB2 ALA 51 1HB ALA 51 32.717 -3.236 -5.446 379 HB3 ALA 51 2HB ALA 51 33.054 -1.737 -4.545 380 H ASN 52 HN ASN 52 31.690 -5.398 -3.760 381 HA ASN 52 HA ASN 52 29.576 -3.970 -2.572 382 HB2 ASN 52 2HB ASN 52 29.511 -5.885 -4.370 383 HB3 ASN 52 3HB ASN 52 29.656 -6.989 -3.016 384 HD21 ASN 52 1HD2 ASN 52 28.083 -6.808 -1.271 385 HD22 ASN 52 2HD2 ASN 52 26.446 -6.366 -1.629 386 H LYS 53 HN LYS 53 31.328 -7.062 -1.722 387 HA LYS 53 HA LYS 53 30.205 -7.490 0.732 388 HB2 LYS 53 2HB LYS 53 31.938 -8.835 -0.746 389 HB3 LYS 53 3HB LYS 53 33.116 -8.071 0.301 390 HG2 LYS 53 2HG LYS 53 31.371 -8.882 2.209 391 HG3 LYS 53 3HG LYS 53 30.977 -10.074 0.987 392 HD2 LYS 53 2HD LYS 53 33.642 -10.319 0.829 393 HD3 LYS 53 3HD LYS 53 33.587 -9.643 2.444 394 HE2 LYS 53 2HE LYS 53 31.769 -11.964 1.728 395 HE3 LYS 53 3HE LYS 53 33.451 -12.268 2.115 396 HZ1 LYS 53 2HZ LYS 53 32.914 -10.803 4.184 397 HZ3 LYS 53 1HZ LYS 53 32.430 -12.357 4.185 398 H ASN 54 HN ASN 54 33.197 -5.582 -0.032 399 HA ASN 54 HA ASN 54 34.016 -4.891 2.369 400 HB2 ASN 54 2HB ASN 54 33.781 -3.367 -0.219 401 HB3 ASN 54 3HB ASN 54 34.213 -2.429 1.196 402 HD21 ASN 54 1HD2 ASN 54 34.964 -5.830 0.702 403 HD22 ASN 54 2HD2 ASN 54 36.685 -5.679 0.578 404 H LYS 55 HN LYS 55 31.080 -3.702 0.673 405 HA LYS 55 HA LYS 55 30.478 -1.593 2.411 406 HB2 LYS 55 2HB LYS 55 29.564 -2.105 0.069 407 HB3 LYS 55 3HB LYS 55 28.465 -3.223 0.853 408 HG2 LYS 55 2HG LYS 55 27.246 -1.180 0.740 409 HG3 LYS 55 3HG LYS 55 27.791 -1.267 2.403 410 HD2 LYS 55 2HD LYS 55 28.461 0.900 1.935 411 HD3 LYS 55 3HD LYS 55 29.912 0.062 1.420 412 HE2 LYS 55 2HE LYS 55 28.693 -0.082 -0.926 413 HE3 LYS 55 3HE LYS 55 27.685 1.205 -0.295 414 HZ1 LYS 55 2HZ LYS 55 30.612 1.272 -0.720 415 HZ3 LYS 55 1HZ LYS 55 29.884 2.364 0.245 416 H GLY 56 HN GLY 56 29.145 -1.452 4.250 417 HA2 GLY 56 1HA GLY 56 28.213 -4.002 5.386 418 HA3 GLY 56 2HA GLY 56 29.297 -2.987 6.315 419 H ILE 57 HN ILE 57 26.168 -2.871 4.484 420 HA ILE 57 HA ILE 57 25.137 -1.165 6.623 421 HB ILE 57 HB ILE 57 24.045 0.286 5.025 422 HG12 ILE 57 2HG1 ILE 57 25.012 0.108 2.583 423 HG13 ILE 57 3HG1 ILE 57 25.260 -1.574 3.005 424 HG21 ILE 57 1HG2 ILE 57 26.682 0.655 3.906 425 HG22 ILE 57 2HG2 ILE 57 25.810 1.630 5.113 426 HG23 ILE 57 3HG2 ILE 57 26.786 0.235 5.632 427 HD11 ILE 57 3HD1 ILE 57 22.963 -1.999 3.269 428 HD12 ILE 57 1HD1 ILE 57 22.584 -0.291 3.593 429 HD13 ILE 57 2HD1 ILE 57 22.965 -0.820 1.937 430 H ILE 58 HN ILE 58 22.783 -1.284 6.850 431 HA ILE 58 HA ILE 58 21.868 -3.933 6.112 432 HB ILE 58 HB ILE 58 20.896 -1.807 8.006 433 HG12 ILE 58 2HG1 ILE 58 22.854 -3.481 8.463 434 HG13 ILE 58 3HG1 ILE 58 21.656 -3.158 9.701 435 HG21 ILE 58 1HG2 ILE 58 18.880 -2.676 7.095 436 HG22 ILE 58 2HG2 ILE 58 19.490 -4.347 7.156 437 HG23 ILE 58 3HG2 ILE 58 19.129 -3.476 8.666 438 HD11 ILE 58 3HD1 ILE 58 21.434 -5.482 7.736 439 HD12 ILE 58 1HD1 ILE 58 22.171 -5.620 9.350 440 HD13 ILE 58 2HD1 ILE 58 20.447 -5.203 9.192 441 H TRP 59 HN TRP 59 20.357 -4.382 4.565 442 HA TRP 59 HA TRP 59 19.689 -2.309 2.745 443 HB2 TRP 59 2HB TRP 59 18.956 -5.221 2.979 444 HB3 TRP 59 3HB TRP 59 18.265 -4.187 1.744 445 HD1 TRP 59 HD1 TRP 59 20.940 -6.572 1.973 446 HE1 TRP 59 HE1 TRP 59 22.906 -6.229 0.246 447 HE3 TRP 59 HE3 TRP 59 19.732 -1.788 0.747 448 HZ2 TRP 59 HZ2 TRP 59 23.717 -4.045 -1.402 449 HZ3 TRP 59 HZ3 TRP 59 21.163 -0.622 -0.929 450 HH2 TRP 59 HH2 TRP 59 23.096 -1.674 -1.992 451 H GLY 60 HN GLY 60 17.731 -1.191 2.511 452 HA2 GLY 60 1HA GLY 60 15.467 -1.947 4.185 453 HA3 GLY 60 2HA GLY 60 16.217 -0.402 4.534 454 H GLU 61 HN GLU 61 14.326 0.781 3.878 455 HA GLU 61 HA GLU 61 13.492 0.434 1.146 456 HB2 GLU 61 2HB GLU 61 12.463 2.351 3.285 457 HB3 GLU 61 3HB GLU 61 11.700 2.042 1.738 458 HG2 GLU 61 2HG GLU 61 11.615 -0.451 2.439 459 HG3 GLU 61 3HG GLU 61 12.060 0.086 4.047 460 HE2 GLU 61 HE2 GLU 61 9.172 0.738 1.777 461 H ASP 62 HN ASP 62 15.156 2.812 3.264 462 HA ASP 62 HA ASP 62 15.240 4.798 1.268 463 HB2 ASP 62 2HB ASP 62 16.804 4.357 3.849 464 HB3 ASP 62 3HB ASP 62 17.048 5.767 2.838 465 HD2 ASP 62 HD2 ASP 62 14.804 5.590 5.704 466 H THR 63 HN THR 63 17.623 2.458 2.721 467 HA THR 63 HA THR 63 19.805 3.151 1.132 468 HB THR 63 HB THR 63 20.434 0.675 1.783 469 HG1 THR 63 HG1 THR 63 18.822 0.115 3.598 470 HG21 THR 63 1HG2 THR 63 21.259 2.466 3.223 471 HG22 THR 63 2HG2 THR 63 19.624 2.777 3.855 472 HG23 THR 63 3HG2 THR 63 20.471 1.271 4.280 473 H LEU 64 HN LEU 64 16.933 1.204 0.423 474 HA LEU 64 HA LEU 64 18.162 0.209 -2.009 475 HB2 LEU 64 2HB LEU 64 15.500 -0.250 -0.668 476 HB3 LEU 64 3HB LEU 64 15.880 -0.871 -2.261 477 HG LEU 64 HG LEU 64 17.397 -1.530 0.279 478 HD11 LEU 64 1HD1 LEU 64 14.950 -2.397 -0.126 479 HD12 LEU 64 2HD1 LEU 64 15.760 -3.525 -1.240 480 HD13 LEU 64 3HD1 LEU 64 16.218 -3.488 0.480 481 HD21 LEU 64 3HD2 LEU 64 18.362 -3.365 -1.199 482 HD22 LEU 64 1HD2 LEU 64 17.738 -2.435 -2.583 483 HD23 LEU 64 2HD2 LEU 64 18.942 -1.707 -1.492 484 H MET 65 HN MET 65 15.877 2.683 -0.851 485 HA MET 65 HA MET 65 14.870 3.252 -3.422 486 HB2 MET 65 2HB MET 65 13.522 3.878 -1.521 487 HB3 MET 65 3HB MET 65 14.873 4.643 -0.706 488 HG2 MET 65 2HG MET 65 14.738 6.593 -1.997 489 HG3 MET 65 3HG MET 65 14.067 5.763 -3.387 490 HE1 MET 65 3HE MET 65 10.856 5.503 -3.431 491 HE2 MET 65 1HE MET 65 12.101 4.289 -3.049 492 HE3 MET 65 2HE MET 65 10.746 4.559 -1.926 493 H GLU 66 HN GLU 66 17.866 3.908 -1.847 494 HA GLU 66 HA GLU 66 18.304 6.199 -3.591 495 HB2 GLU 66 2HB GLU 66 18.715 6.783 -1.290 496 HB3 GLU 66 3HB GLU 66 19.640 5.322 -1.005 497 HG2 GLU 66 2HG GLU 66 21.521 6.109 -2.193 498 HG3 GLU 66 3HG GLU 66 20.579 7.230 -3.155 499 HE2 GLU 66 HE2 GLU 66 21.989 9.547 -1.110 500 H TYR 67 HN TYR 67 19.144 2.865 -2.914 501 HA TYR 67 HA TYR 67 21.618 2.963 -4.394 502 HB2 TYR 67 2HB TYR 67 21.358 1.417 -2.496 503 HB3 TYR 67 3HB TYR 67 19.795 0.875 -3.073 504 HD1 TYR 67 HD1 TYR 67 22.890 1.227 -5.120 505 HD2 TYR 67 HD2 TYR 67 20.157 -1.460 -3.218 506 HE1 TYR 67 HE1 TYR 67 23.996 -0.739 -6.291 507 HE2 TYR 67 HE2 TYR 67 21.273 -3.417 -4.397 508 HH TYR 67 HH TYR 67 22.647 -3.982 -6.035 509 H LEU 68 HN LEU 68 18.235 1.785 -4.844 510 HA LEU 68 HA LEU 68 18.675 0.493 -7.270 511 HB2 LEU 68 2HB LEU 68 16.320 1.614 -5.823 512 HB3 LEU 68 3HB LEU 68 16.126 1.171 -7.507 513 HG LEU 68 HG LEU 68 17.094 -0.691 -5.321 514 HD11 LEU 68 1HD1 LEU 68 14.683 -1.661 -6.256 515 HD12 LEU 68 2HD1 LEU 68 14.947 -0.787 -4.727 516 HD13 LEU 68 3HD1 LEU 68 14.414 0.098 -6.177 517 HD21 LEU 68 3HD2 LEU 68 17.328 -0.866 -8.149 518 HD22 LEU 68 1HD2 LEU 68 17.746 -2.082 -6.917 519 HD23 LEU 68 2HD2 LEU 68 16.113 -2.058 -7.626 520 H GLU 69 HN GLU 69 17.759 3.905 -6.503 521 HA GLU 69 HA GLU 69 17.237 4.855 -8.930 522 HB2 GLU 69 2HB GLU 69 17.151 6.297 -7.002 523 HB3 GLU 69 3HB GLU 69 18.864 6.104 -6.686 524 HG2 GLU 69 2HG GLU 69 19.494 7.457 -8.539 525 HG3 GLU 69 3HG GLU 69 17.945 7.262 -9.334 526 HE2 GLU 69 HE2 GLU 69 16.362 9.522 -7.076 527 H ASN 70 HN ASN 70 20.380 3.734 -7.730 528 HA ASN 70 HA ASN 70 21.377 3.576 -10.328 529 HB2 ASN 70 2HB ASN 70 22.213 5.944 -8.635 530 HB3 ASN 70 3HB ASN 70 23.439 5.171 -9.620 531 HD21 ASN 70 1HD2 ASN 70 21.460 7.673 -9.570 532 HD22 ASN 70 2HD2 ASN 70 21.063 7.881 -11.243 533 HA PRO 71 HA PRO 71 23.343 0.928 -7.252 534 HB2 PRO 71 2HB PRO 71 23.394 -1.347 -8.765 535 HB3 PRO 71 3HB PRO 71 22.065 -0.935 -7.700 536 HG2 PRO 71 2HG PRO 71 22.194 -0.779 -10.650 537 HG3 PRO 71 3HG PRO 71 20.783 -0.785 -9.612 538 HD2 PRO 71 2HD PRO 71 21.935 1.488 -10.928 539 HD3 PRO 71 3HD PRO 71 20.595 1.499 -9.799 540 H LYS 72 HN LYS 72 24.316 2.372 -9.992 541 HA LYS 72 HA LYS 72 26.876 0.988 -10.058 542 HB2 LYS 72 2HB LYS 72 25.930 1.347 -12.208 543 HB3 LYS 72 3HB LYS 72 25.542 3.019 -11.855 544 HG2 LYS 72 2HG LYS 72 27.837 3.696 -11.924 545 HG3 LYS 72 3HG LYS 72 28.422 2.052 -11.758 546 HD2 LYS 72 2HD LYS 72 26.743 2.835 -14.164 547 HD3 LYS 72 3HD LYS 72 28.457 3.199 -14.132 548 HE2 LYS 72 2HE LYS 72 28.748 0.663 -13.466 549 HE3 LYS 72 3HE LYS 72 27.111 0.478 -14.065 550 HZ1 LYS 72 2HZ LYS 72 27.921 0.503 -16.144 551 HZ3 LYS 72 1HZ LYS 72 29.446 0.636 -15.585 552 H LYS 73 HN LYS 73 25.307 3.682 -8.567 553 HA LYS 73 HA LYS 73 27.819 5.115 -8.238 554 HB2 LYS 73 2HB LYS 73 25.943 6.480 -8.849 555 HB3 LYS 73 3HB LYS 73 24.944 5.796 -7.583 556 HG2 LYS 73 2HG LYS 73 26.948 6.667 -6.012 557 HG3 LYS 73 3HG LYS 73 27.222 7.760 -7.354 558 HD2 LYS 73 2HD LYS 73 25.713 8.951 -5.960 559 HD3 LYS 73 3HD LYS 73 24.686 8.306 -7.225 560 HE2 LYS 73 2HE LYS 73 23.489 7.763 -5.261 561 HE3 LYS 73 3HE LYS 73 24.320 6.265 -5.629 562 HZ1 LYS 73 2HZ LYS 73 24.844 8.146 -3.460 563 HZ3 LYS 73 1HZ LYS 73 26.150 7.410 -4.096 564 H TYR 74 HN TYR 74 25.134 3.783 -6.180 565 HA TYR 74 HA TYR 74 26.358 4.098 -3.749 566 HB2 TYR 74 2HB TYR 74 24.004 3.168 -4.630 567 HB3 TYR 74 3HB TYR 74 24.800 1.607 -4.623 568 HD1 TYR 74 HD1 TYR 74 26.000 0.966 -2.340 569 HD2 TYR 74 HD2 TYR 74 22.878 3.866 -2.715 570 HE1 TYR 74 HE1 TYR 74 25.451 0.705 0.129 571 HE2 TYR 74 HE2 TYR 74 22.340 3.596 -0.245 572 HH TYR 74 HH TYR 74 23.891 2.806 1.857 573 H ILE 75 HN ILE 75 27.084 1.792 -6.331 574 HA ILE 75 HA ILE 75 29.335 0.862 -4.770 575 HB ILE 75 HB ILE 75 27.467 -1.161 -5.985 576 HG12 ILE 75 2HG1 ILE 75 27.539 -0.209 -3.106 577 HG13 ILE 75 3HG1 ILE 75 26.225 0.027 -4.242 578 HG21 ILE 75 1HG2 ILE 75 30.038 -1.481 -5.393 579 HG22 ILE 75 2HG2 ILE 75 29.371 -1.742 -3.763 580 HG23 ILE 75 3HG2 ILE 75 28.835 -2.764 -5.119 581 HD11 ILE 75 3HD1 ILE 75 26.795 -2.761 -4.313 582 HD12 ILE 75 1HD1 ILE 75 26.813 -2.293 -2.596 583 HD13 ILE 75 2HD1 ILE 75 25.375 -1.967 -3.592 584 HA PRO 76 HA PRO 76 30.407 1.624 -9.025 585 HB2 PRO 76 2HB PRO 76 32.849 2.747 -8.531 586 HB3 PRO 76 3HB PRO 76 31.373 3.682 -8.663 587 HG2 PRO 76 2HG PRO 76 32.900 2.961 -6.237 588 HG3 PRO 76 3HG PRO 76 31.697 4.218 -6.443 589 HD2 PRO 76 2HD PRO 76 31.326 1.682 -5.156 590 HD3 PRO 76 3HD PRO 76 30.095 2.890 -5.465 591 H GLY 77 HN GLY 77 30.950 -0.034 -10.281 592 HA2 GLY 77 1HA GLY 77 32.757 -1.399 -11.031 593 HA3 GLY 77 2HA GLY 77 33.306 -1.564 -9.376 594 H THR 78 HN THR 78 29.998 -1.652 -9.081 595 HA THR 78 HA THR 78 29.832 -4.288 -8.342 596 HB THR 78 HB THR 78 28.194 -2.450 -7.828 597 HG1 THR 78 HG1 THR 78 26.328 -3.947 -8.307 598 HG21 THR 78 1HG2 THR 78 26.675 -2.980 -10.336 599 HG22 THR 78 2HG2 THR 78 26.865 -1.458 -9.432 600 HG23 THR 78 3HG2 THR 78 28.131 -1.985 -10.566 601 H LYS 79 HN LYS 79 28.067 -5.832 -9.471 602 HA LYS 79 HA LYS 79 28.869 -6.039 -12.286 603 HB2 LYS 79 2HB LYS 79 28.668 -8.623 -11.704 604 HB3 LYS 79 3HB LYS 79 30.169 -7.739 -11.521 605 HG2 LYS 79 2HG LYS 79 29.724 -7.386 -9.119 606 HG3 LYS 79 3HG LYS 79 28.142 -8.126 -9.269 607 HD2 LYS 79 2HD LYS 79 30.795 -9.546 -9.806 608 HD3 LYS 79 3HD LYS 79 29.854 -9.704 -8.337 609 HE2 LYS 79 2HE LYS 79 29.074 -11.559 -9.515 610 HE3 LYS 79 3HE LYS 79 27.888 -10.370 -10.013 611 HZ1 LYS 79 2HZ LYS 79 28.557 -11.021 -12.072 612 HZ3 LYS 79 1HZ LYS 79 30.007 -11.579 -11.583 613 H MET 80 HN MET 80 26.483 -4.865 -10.829 614 HA MET 80 HA MET 80 24.457 -6.771 -11.652 615 HB2 MET 80 2HB MET 80 24.068 -5.889 -9.436 616 HB3 MET 80 3HB MET 80 24.504 -4.261 -9.915 617 HG2 MET 80 2HG MET 80 22.431 -3.843 -10.921 618 HG3 MET 80 3HG MET 80 22.160 -5.527 -11.324 619 HE1 MET 80 3HE MET 80 21.432 -2.722 -9.496 620 HE2 MET 80 1HE MET 80 19.819 -3.468 -9.408 621 HE3 MET 80 2HE MET 80 20.731 -3.142 -7.915 622 H ILE 81 HN ILE 81 23.741 -6.600 -13.730 623 HA ILE 81 HA ILE 81 24.192 -4.245 -15.243 624 HB ILE 81 HB ILE 81 22.526 -6.694 -15.838 625 HG12 ILE 81 2HG1 ILE 81 25.451 -6.067 -16.267 626 HG13 ILE 81 3HG1 ILE 81 24.745 -7.422 -15.409 627 HG21 ILE 81 1HG2 ILE 81 22.127 -5.918 -17.904 628 HG22 ILE 81 2HG2 ILE 81 22.447 -4.322 -17.184 629 HG23 ILE 81 3HG2 ILE 81 23.740 -5.181 -18.054 630 HD11 ILE 81 3HD1 ILE 81 24.799 -6.917 -18.401 631 HD12 ILE 81 1HD1 ILE 81 25.370 -8.344 -17.504 632 HD13 ILE 81 2HD1 ILE 81 23.625 -8.045 -17.682 633 H PHE 82 HN PHE 82 23.072 -2.387 -15.065 634 HA PHE 82 HA PHE 82 20.196 -2.538 -14.959 635 HB2 PHE 82 2HB PHE 82 21.423 -2.523 -12.561 636 HB3 PHE 82 3HB PHE 82 21.702 -0.831 -12.922 637 HD1 PHE 82 HD1 PHE 82 18.985 -3.353 -12.624 638 HD2 PHE 82 HD2 PHE 82 20.046 0.753 -12.473 639 HE1 PHE 82 HE1 PHE 82 16.694 -2.793 -11.764 640 HE2 PHE 82 HE2 PHE 82 17.756 1.314 -11.614 641 HZ PHE 82 HZ PHE 82 16.107 -0.467 -11.269 642 H VAL 83 HN VAL 83 19.206 -0.301 -15.194 643 HA VAL 83 HA VAL 83 21.076 1.409 -16.685 644 HB VAL 83 HB VAL 83 19.217 2.057 -18.065 645 HG11 VAL 83 1HG1 VAL 83 19.610 -0.923 -17.735 646 HG12 VAL 83 2HG1 VAL 83 18.604 -0.238 -19.033 647 HG13 VAL 83 3HG1 VAL 83 20.333 0.172 -18.937 648 HG21 VAL 83 3HG2 VAL 83 17.554 0.295 -16.240 649 HG22 VAL 83 1HG2 VAL 83 17.380 2.043 -16.529 650 HG23 VAL 83 2HG2 VAL 83 16.997 0.884 -17.824 651 H GLY 84 HN GLY 84 18.117 1.347 -14.590 652 HA2 GLY 84 1HA GLY 84 18.567 2.891 -12.598 653 HA3 GLY 84 2HA GLY 84 18.698 4.134 -13.827 654 H ILE 85 HN ILE 85 16.758 4.457 -11.897 655 HA ILE 85 HA ILE 85 14.323 3.941 -13.446 656 HB ILE 85 HB ILE 85 14.464 3.801 -10.439 657 HG12 ILE 85 2HG1 ILE 85 14.563 1.519 -12.434 658 HG13 ILE 85 3HG1 ILE 85 15.846 2.003 -11.343 659 HG21 ILE 85 1HG2 ILE 85 12.319 4.131 -12.174 660 HG22 ILE 85 2HG2 ILE 85 12.307 2.392 -11.794 661 HG23 ILE 85 3HG2 ILE 85 12.249 3.590 -10.479 662 HD11 ILE 85 3HD1 ILE 85 13.922 0.099 -10.773 663 HD12 ILE 85 1HD1 ILE 85 14.884 0.964 -9.551 664 HD13 ILE 85 2HD1 ILE 85 13.256 1.544 -9.976 665 H LYS 86 HN LYS 86 15.880 5.842 -10.779 666 HA LYS 86 HA LYS 86 15.649 7.949 -10.160 667 HB2 LYS 86 2HB LYS 86 16.430 8.028 -12.699 668 HB3 LYS 86 3HB LYS 86 14.874 8.800 -12.923 669 HG2 LYS 86 2HG LYS 86 16.722 9.719 -10.697 670 HG3 LYS 86 3HG LYS 86 16.972 10.284 -12.338 671 HD2 LYS 86 2HD LYS 86 14.330 10.784 -12.197 672 HD3 LYS 86 3HD LYS 86 14.660 10.820 -10.476 673 HE2 LYS 86 2HE LYS 86 16.418 12.542 -10.820 674 HE3 LYS 86 3HE LYS 86 16.177 12.469 -12.554 675 HZ1 LYS 86 2HZ LYS 86 13.795 13.125 -12.078 676 HZ3 LYS 86 1HZ LYS 86 14.891 14.286 -11.754 677 H LYS 87 HN LYS 87 13.231 6.059 -10.324 678 HA LYS 87 HA LYS 87 11.165 8.146 -10.332 679 HB2 LYS 87 2HB LYS 87 11.066 5.196 -10.971 680 HB3 LYS 87 3HB LYS 87 9.620 6.090 -10.544 681 HG2 LYS 87 2HG LYS 87 11.428 7.285 -12.639 682 HG3 LYS 87 3HG LYS 87 10.472 5.889 -13.095 683 HD2 LYS 87 2HD LYS 87 9.166 8.236 -11.678 684 HD3 LYS 87 3HD LYS 87 9.453 8.299 -13.406 685 HE2 LYS 87 2HE LYS 87 7.281 7.391 -13.301 686 HE3 LYS 87 3HE LYS 87 8.267 5.953 -13.473 687 HZ1 LYS 87 2HZ LYS 87 6.883 5.481 -11.661 688 HZ3 LYS 87 1HZ LYS 87 6.986 6.974 -11.016 689 H LYS 88 HN LYS 88 9.552 8.074 -8.609 690 HA LYS 88 HA LYS 88 10.798 7.218 -6.130 691 HB2 LYS 88 2HB LYS 88 8.262 8.831 -6.490 692 HB3 LYS 88 3HB LYS 88 9.242 8.682 -5.047 693 HG2 LYS 88 2HG LYS 88 10.226 9.896 -7.673 694 HG3 LYS 88 3HG LYS 88 9.628 10.832 -6.318 695 HD2 LYS 88 2HD LYS 88 11.428 9.937 -4.864 696 HD3 LYS 88 3HD LYS 88 11.996 8.908 -6.163 697 HE2 LYS 88 2HE LYS 88 12.303 11.077 -7.552 698 HE3 LYS 88 3HE LYS 88 12.052 11.953 -6.055 699 HZ1 LYS 88 2HZ LYS 88 13.931 10.669 -5.100 700 HZ3 LYS 88 1HZ LYS 88 14.404 11.555 -6.381 701 H GLU 89 HN GLU 89 7.452 7.078 -7.556 702 HA GLU 89 HA GLU 89 6.573 5.129 -5.839 703 HB2 GLU 89 2HB GLU 89 5.719 6.084 -8.572 704 HB3 GLU 89 3HB GLU 89 4.948 4.661 -7.901 705 HG2 GLU 89 2HG GLU 89 3.639 6.631 -7.277 706 HG3 GLU 89 3HG GLU 89 4.369 5.960 -5.832 707 HE2 GLU 89 HE2 GLU 89 4.247 8.827 -7.703 708 H GLU 90 HN GLU 90 7.862 4.794 -9.222 709 HA GLU 90 HA GLU 90 7.614 2.124 -9.488 710 HB2 GLU 90 2HB GLU 90 8.945 4.217 -10.833 711 HB3 GLU 90 3HB GLU 90 10.200 3.034 -10.524 712 HG2 GLU 90 2HG GLU 90 9.420 1.960 -12.376 713 HG3 GLU 90 3HG GLU 90 8.107 1.411 -11.353 714 HE2 GLU 90 HE2 GLU 90 8.373 3.776 -14.184 715 H ARG 91 HN ARG 91 9.732 3.892 -7.323 716 HA ARG 91 HA ARG 91 11.298 1.499 -6.880 717 HB2 ARG 91 2HB ARG 91 11.681 4.434 -6.375 718 HB3 ARG 91 3HB ARG 91 12.393 3.361 -5.186 719 HG2 ARG 91 2HG ARG 91 13.238 2.084 -7.424 720 HG3 ARG 91 3HG ARG 91 13.072 3.693 -8.097 721 HD2 ARG 91 2HD ARG 91 14.724 2.954 -5.632 722 HD3 ARG 91 3HD ARG 91 15.367 3.334 -7.218 723 HE ARG 91 HE ARG 91 14.339 5.243 -5.246 724 HH11 ARG 91 2HH2 ARG 91 15.056 4.734 -8.678 725 HH12 ARG 91 1HH2 ARG 91 15.197 6.425 -9.026 726 HH22 ARG 91 HH1 ARG 91 14.880 8.017 -7.263 727 H ALA 92 HN ALA 92 8.719 3.480 -5.559 728 HA ALA 92 HA ALA 92 9.029 2.384 -2.889 729 HB1 ALA 92 3HB ALA 92 8.201 4.811 -3.807 730 HB2 ALA 92 1HB ALA 92 6.634 3.986 -3.628 731 HB3 ALA 92 2HB ALA 92 7.725 4.137 -2.231 732 H ASP 93 HN ASP 93 7.851 1.321 -5.843 733 HA ASP 93 HA ASP 93 5.633 -0.076 -4.584 734 HB2 ASP 93 2HB ASP 93 4.665 -0.285 -6.715 735 HB3 ASP 93 3HB ASP 93 5.447 1.279 -6.823 736 HD2 ASP 93 HD2 ASP 93 5.018 -0.002 -9.239 737 H LEU 94 HN LEU 94 8.833 -0.350 -6.077 738 HA LEU 94 HA LEU 94 8.658 -3.172 -6.538 739 HB2 LEU 94 2HB LEU 94 9.996 -1.778 -7.977 740 HB3 LEU 94 3HB LEU 94 10.944 -1.203 -6.619 741 HG LEU 94 HG LEU 94 11.972 -2.978 -8.156 742 HD11 LEU 94 1HD1 LEU 94 12.585 -2.257 -5.689 743 HD12 LEU 94 2HD1 LEU 94 12.076 -3.923 -5.321 744 HD13 LEU 94 3HD1 LEU 94 13.391 -3.631 -6.485 745 HD21 LEU 94 3HD2 LEU 94 10.105 -4.489 -8.351 746 HD22 LEU 94 1HD2 LEU 94 11.455 -5.327 -7.548 747 HD23 LEU 94 2HD2 LEU 94 10.073 -4.744 -6.590 748 H ILE 95 HN ILE 95 10.039 -0.959 -4.053 749 HA ILE 95 HA ILE 95 11.282 -3.018 -2.585 750 HB ILE 95 HB ILE 95 10.380 -0.254 -1.767 751 HG12 ILE 95 2HG1 ILE 95 13.136 -1.173 -2.627 752 HG13 ILE 95 3HG1 ILE 95 11.982 -0.431 -3.719 753 HG21 ILE 95 1HG2 ILE 95 11.571 -2.436 -0.250 754 HG22 ILE 95 2HG2 ILE 95 12.581 -0.971 -0.233 755 HG23 ILE 95 3HG2 ILE 95 10.886 -0.890 0.304 756 HD11 ILE 95 3HD1 ILE 95 13.262 1.408 -2.976 757 HD12 ILE 95 1HD1 ILE 95 11.832 1.476 -1.918 758 HD13 ILE 95 2HD1 ILE 95 13.357 0.790 -1.309 759 H ALA 96 HN ALA 96 8.016 -1.535 -2.566 760 HA ALA 96 HA ALA 96 7.098 -2.576 -0.183 761 HB1 ALA 96 3HB ALA 96 5.398 -2.377 -2.679 762 HB2 ALA 96 1HB ALA 96 4.960 -2.010 -0.993 763 HB3 ALA 96 2HB ALA 96 6.043 -0.919 -1.888 764 H TYR 97 HN TYR 97 6.862 -3.999 -3.521 765 HA TYR 97 HA TYR 97 5.698 -6.394 -2.692 766 HB2 TYR 97 2HB TYR 97 5.689 -5.758 -5.031 767 HB3 TYR 97 3HB TYR 97 7.390 -5.340 -5.008 768 HD1 TYR 97 HD2 TYR 97 6.075 -8.516 -3.629 769 HD2 TYR 97 HD1 TYR 97 8.004 -6.624 -6.947 770 HE1 TYR 97 HE2 TYR 97 6.652 -10.793 -4.601 771 HE2 TYR 97 HE1 TYR 97 8.574 -8.909 -7.908 772 HH TYR 97 HH TYR 97 7.711 -11.180 -7.780 773 H LEU 98 HN LEU 98 9.152 -5.760 -3.654 774 HA LEU 98 HA LEU 98 10.224 -8.161 -3.136 775 HB2 LEU 98 2HB LEU 98 11.307 -5.399 -2.614 776 HB3 LEU 98 3HB LEU 98 12.281 -6.840 -2.398 777 HG LEU 98 HG LEU 98 11.148 -5.693 -4.940 778 HD11 LEU 98 1HD1 LEU 98 13.928 -6.750 -4.553 779 HD12 LEU 98 2HD1 LEU 98 13.334 -5.464 -5.632 780 HD13 LEU 98 3HD1 LEU 98 13.478 -5.164 -3.883 781 HD21 LEU 98 3HD2 LEU 98 12.108 -7.820 -6.032 782 HD22 LEU 98 1HD2 LEU 98 11.937 -8.552 -4.418 783 HD23 LEU 98 2HD2 LEU 98 10.506 -7.912 -5.261 784 H LYS 99 HN LYS 99 9.513 -5.599 -0.677 785 HA LYS 99 HA LYS 99 10.557 -6.817 1.525 786 HB2 LYS 99 2HB LYS 99 9.711 -4.584 1.627 787 HB3 LYS 99 3HB LYS 99 8.092 -5.094 1.191 788 HG2 LYS 99 2HG LYS 99 7.634 -5.290 3.402 789 HG3 LYS 99 3HG LYS 99 8.716 -6.667 3.449 790 HD2 LYS 99 2HD LYS 99 10.605 -4.782 3.638 791 HD3 LYS 99 3HD LYS 99 9.273 -3.792 4.201 792 HE2 LYS 99 2HE LYS 99 8.811 -5.283 6.050 793 HE3 LYS 99 3HE LYS 99 9.832 -6.543 5.387 794 HZ1 LYS 99 2HZ LYS 99 11.278 -5.586 6.875 795 HZ3 LYS 99 1HZ LYS 99 10.636 -4.093 6.767 796 H LYS 100 HN LYS 100 7.291 -7.335 0.046 797 HA LYS 100 HA LYS 100 6.621 -9.336 1.956 798 HB2 LYS 100 2HB LYS 100 5.072 -7.773 0.591 799 HB3 LYS 100 3HB LYS 100 5.277 -8.925 -0.713 800 HG2 LYS 100 2HG LYS 100 4.555 -10.766 0.900 801 HG3 LYS 100 3HG LYS 100 4.195 -9.521 2.079 802 HD2 LYS 100 2HD LYS 100 3.006 -9.224 -0.676 803 HD3 LYS 100 3HD LYS 100 2.325 -10.449 0.375 804 HE2 LYS 100 2HE LYS 100 2.656 -7.504 1.125 805 HE3 LYS 100 3HE LYS 100 1.157 -8.233 0.584 806 HZ1 LYS 100 2HZ LYS 100 0.808 -9.012 2.648 807 HZ3 LYS 100 1HZ LYS 100 2.105 -8.183 3.179 808 H ALA 101 HN ALA 101 8.418 -9.207 -1.060 809 HA ALA 101 HA ALA 101 8.108 -11.993 -1.638 810 HB1 ALA 101 3HB ALA 101 9.506 -11.535 -3.493 811 HB2 ALA 101 1HB ALA 101 8.576 -10.035 -3.260 812 HB3 ALA 101 2HB ALA 101 10.259 -10.136 -2.691 813 H THR 102 HN THR 102 10.020 -10.039 0.522 814 HA THR 102 HA THR 102 11.846 -12.317 0.926 815 HB THR 102 HB THR 102 13.502 -10.653 1.617 816 HG1 THR 102 HG1 THR 102 12.622 -8.802 2.443 817 HG21 THR 102 1HG2 THR 102 12.493 -8.911 -0.516 818 HG22 THR 102 2HG2 THR 102 13.951 -9.932 -0.507 819 HG23 THR 102 3HG2 THR 102 12.385 -10.621 -0.998 820 H ASN 103 HN ASN 103 9.043 -11.850 1.978 821 HA ASN 103 HA ASN 103 9.753 -11.606 4.788 822 HB2 ASN 103 2HB ASN 103 7.975 -10.055 4.105 823 HB3 ASN 103 3HB ASN 103 7.085 -11.341 3.314 824 HD21 ASN 103 1HD2 ASN 103 5.299 -11.673 4.396 825 HD22 ASN 103 2HD2 ASN 103 5.133 -11.881 6.108 826 H GLU 104 HN GLU 104 8.872 -13.767 2.224 827 HA GLU 104 HA GLU 104 7.594 -15.665 3.957 828 HB2 GLU 104 2HB GLU 104 8.437 -16.127 1.074 829 HB3 GLU 104 3HB GLU 104 7.165 -16.938 1.965 830 HG2 GLU 104 2HG GLU 104 5.879 -14.803 2.096 831 HG3 GLU 104 3HG GLU 104 7.160 -13.971 1.234 832 HE2 GLU 104 HE2 GLU 104 5.542 -16.994 0.791 833 HHA HEC 500 HHA HEC 500 23.853 -6.958 -5.313 834 HHB HEC 500 HHB HEC 500 17.703 -5.198 -5.199 835 HHC HEC 500 HHC HEC 500 17.642 -6.005 -11.597 836 HHD HEC 500 HHD HEC 500 23.127 -9.273 -11.184 837 HMA1 HEC 500 1HMA HEC 500 18.536 -5.277 -3.032 838 HMA2 HEC 500 2HMA HEC 500 20.069 -5.268 -2.153 839 HMA3 HEC 500 3HMA HEC 500 19.633 -3.877 -3.163 840 HAA1 HEC 500 1HAA HEC 500 23.578 -5.813 -3.513 841 HAA2 HEC 500 2HAA HEC 500 22.335 -5.276 -2.502 842 HBA1 HEC 500 1HBA HEC 500 23.212 -8.110 -3.015 843 HBA2 HEC 500 2HBA HEC 500 22.935 -7.288 -1.467 844 HMB1 HEC 500 1HMB HEC 500 14.544 -5.472 -7.263 845 HMB2 HEC 500 2HMB HEC 500 15.570 -5.444 -5.847 846 HMB3 HEC 500 3HMB HEC 500 15.347 -3.946 -6.777 847 HAB HEC 500 HAB HEC 500 15.979 -4.754 -11.002 848 HBB1 HEC 500 1HBB HEC 500 14.910 -2.986 -10.382 849 HBB2 HEC 500 2HBB HEC 500 13.680 -4.076 -9.692 850 HBB3 HEC 500 3HBB HEC 500 14.961 -3.446 -8.677 851 HMC1 HEC 500 1HMC HEC 500 18.045 -8.587 -13.574 852 HMC2 HEC 500 2HMC HEC 500 18.022 -6.817 -13.583 853 HMC3 HEC 500 3HMC HEC 500 19.231 -7.668 -14.522 854 HAC HEC 500 HAC HEC 500 22.075 -10.081 -12.816 855 HBC1 HEC 500 1HBC HEC 500 20.816 -8.688 -15.179 856 HBC2 HEC 500 2HBC HEC 500 22.359 -8.210 -14.438 857 HBC3 HEC 500 3HBC HEC 500 22.205 -9.806 -15.166 858 HMD1 HEC 500 1HMD HEC 500 25.092 -10.685 -9.459 859 HMD2 HEC 500 2HMD HEC 500 25.381 -9.344 -10.581 860 HMD3 HEC 500 3HMD HEC 500 26.322 -9.498 -9.071 861 HAD1 HEC 500 1HAD HEC 500 25.614 -8.060 -5.687 862 HAD2 HEC 500 2HAD HEC 500 26.212 -9.213 -6.802 863 HBD1 HEC 500 1HBD HEC 500 27.753 -7.472 -7.091 864 HBD2 HEC 500 2HBD HEC 500 26.568 -7.060 -8.349 Start of MODEL 18 1 H1 GLY 1 HN GLY 1 1.422 0.679 -0.253 2 HA2 GLY 1 1HA GLY 1 1.794 1.126 -3.146 3 HA3 GLY 1 2HA GLY 1 3.028 0.618 -2.011 4 H ASP 2 HN ASP 2 0.706 -0.421 -4.313 5 HA ASP 2 HA ASP 2 0.003 -2.883 -3.276 6 HB2 ASP 2 2HB ASP 2 0.417 -2.035 -6.183 7 HB3 ASP 2 3HB ASP 2 -0.429 -3.487 -5.689 8 HD2 ASP 2 HD2 ASP 2 -1.996 0.121 -5.024 9 H VAL 3 HN VAL 3 0.745 -4.936 -4.945 10 HA VAL 3 HA VAL 3 3.683 -4.912 -4.842 11 HB VAL 3 HB VAL 3 3.212 -6.413 -3.209 12 HG11 VAL 3 1HG1 VAL 3 1.226 -7.824 -3.060 13 HG12 VAL 3 2HG1 VAL 3 0.760 -6.129 -3.345 14 HG13 VAL 3 3HG1 VAL 3 0.708 -7.303 -4.681 15 HG21 VAL 3 3HG2 VAL 3 4.462 -7.653 -4.861 16 HG22 VAL 3 1HG2 VAL 3 3.267 -8.741 -4.115 17 HG23 VAL 3 2HG2 VAL 3 2.972 -8.074 -5.739 18 H GLU 4 HN GLU 4 0.758 -6.350 -6.436 19 HA GLU 4 HA GLU 4 2.026 -7.555 -8.505 20 HB2 GLU 4 2HB GLU 4 -0.690 -6.234 -8.259 21 HB3 GLU 4 3HB GLU 4 -0.200 -6.962 -9.776 22 HG2 GLU 4 2HG GLU 4 -0.073 -8.464 -7.125 23 HG3 GLU 4 3HG GLU 4 -1.498 -8.479 -8.145 24 HE2 GLU 4 HE2 GLU 4 1.537 -10.309 -7.964 25 H LYS 5 HN LYS 5 1.685 -4.136 -7.845 26 HA LYS 5 HA LYS 5 2.044 -3.295 -10.554 27 HB2 LYS 5 2HB LYS 5 1.896 -1.956 -7.870 28 HB3 LYS 5 3HB LYS 5 2.542 -1.068 -9.235 29 HG2 LYS 5 2HG LYS 5 -0.125 -2.540 -9.368 30 HG3 LYS 5 3HG LYS 5 -0.002 -0.877 -8.829 31 HD2 LYS 5 2HD LYS 5 1.231 -1.718 -11.474 32 HD3 LYS 5 3HD LYS 5 -0.485 -1.374 -11.373 33 HE2 LYS 5 2HE LYS 5 1.434 0.633 -10.184 34 HE3 LYS 5 3HE LYS 5 1.304 0.554 -11.930 35 HZ1 LYS 5 2HZ LYS 5 -0.728 1.506 -11.847 36 HZ3 LYS 5 1HZ LYS 5 -0.414 1.895 -10.297 37 H GLY 6 HN GLY 6 4.097 -4.009 -7.718 38 HA2 GLY 6 1HA GLY 6 6.473 -3.053 -9.133 39 HA3 GLY 6 2HA GLY 6 6.363 -3.571 -7.462 40 H LYS 7 HN LYS 7 4.578 -5.919 -8.813 41 HA LYS 7 HA LYS 7 6.727 -7.781 -8.780 42 HB2 LYS 7 2HB LYS 7 4.601 -8.429 -7.880 43 HB3 LYS 7 3HB LYS 7 3.768 -8.023 -9.367 44 HG2 LYS 7 2HG LYS 7 4.001 -10.361 -9.548 45 HG3 LYS 7 3HG LYS 7 5.354 -9.779 -10.498 46 HD2 LYS 7 2HD LYS 7 6.941 -10.395 -8.889 47 HD3 LYS 7 3HD LYS 7 5.819 -10.222 -7.554 48 HE2 LYS 7 2HE LYS 7 5.415 -12.397 -9.640 49 HE3 LYS 7 3HE LYS 7 6.522 -12.639 -8.303 50 HZ1 LYS 7 2HZ LYS 7 3.626 -12.025 -8.066 51 HZ3 LYS 7 1HZ LYS 7 4.635 -12.095 -6.790 52 H LYS 8 HN LYS 8 5.141 -5.801 -11.201 53 HA LYS 8 HA LYS 8 6.019 -7.476 -13.378 54 HB2 LYS 8 2HB LYS 8 4.427 -4.946 -13.102 55 HB3 LYS 8 3HB LYS 8 5.150 -5.334 -14.651 56 HG2 LYS 8 2HG LYS 8 3.600 -7.477 -13.178 57 HG3 LYS 8 3HG LYS 8 2.717 -6.226 -14.030 58 HD2 LYS 8 2HD LYS 8 4.867 -7.993 -15.294 59 HD3 LYS 8 3HD LYS 8 3.142 -8.270 -15.439 60 HE2 LYS 8 2HE LYS 8 4.818 -6.068 -16.649 61 HE3 LYS 8 3HE LYS 8 3.602 -7.073 -17.412 62 HZ1 LYS 8 2HZ LYS 8 1.880 -5.845 -16.304 63 HZ3 LYS 8 1HZ LYS 8 2.880 -4.733 -16.949 64 H ILE 9 HN ILE 9 6.897 -4.347 -11.816 65 HA ILE 9 HA ILE 9 8.935 -3.739 -13.661 66 HB ILE 9 HB ILE 9 8.304 -2.819 -10.864 67 HG12 ILE 9 2HG1 ILE 9 8.195 -1.105 -13.315 68 HG13 ILE 9 3HG1 ILE 9 6.926 -2.288 -13.073 69 HG21 ILE 9 1HG2 ILE 9 9.960 -0.894 -11.794 70 HG22 ILE 9 2HG2 ILE 9 10.475 -2.233 -10.739 71 HG23 ILE 9 3HG2 ILE 9 10.722 -2.341 -12.499 72 HD11 ILE 9 3HD1 ILE 9 6.216 -1.307 -11.029 73 HD12 ILE 9 1HD1 ILE 9 7.747 -0.424 -10.820 74 HD13 ILE 9 2HD1 ILE 9 6.585 0.091 -12.067 75 H PHE 10 HN PHE 10 8.638 -6.224 -11.345 76 HA PHE 10 HA PHE 10 11.450 -6.293 -10.695 77 HB2 PHE 10 2HB PHE 10 10.052 -7.061 -8.926 78 HB3 PHE 10 3HB PHE 10 8.868 -7.732 -10.030 79 HD1 PHE 10 HD2 PHE 10 12.411 -8.300 -8.992 80 HD2 PHE 10 HD1 PHE 10 8.727 -10.028 -10.195 81 HE1 PHE 10 HE2 PHE 10 13.365 -10.592 -8.619 82 HE2 PHE 10 HE1 PHE 10 9.680 -12.320 -9.822 83 HZ PHE 10 HZ PHE 10 11.988 -12.575 -9.039 84 H ILE 11 HN ILE 11 9.181 -7.699 -13.018 85 HA ILE 11 HA ILE 11 10.948 -9.866 -13.688 86 HB ILE 11 HB ILE 11 8.342 -8.850 -14.805 87 HG12 ILE 11 2HG1 ILE 11 8.777 -11.568 -13.627 88 HG13 ILE 11 3HG1 ILE 11 8.682 -10.196 -12.541 89 HG21 ILE 11 1HG2 ILE 11 10.327 -10.451 -16.136 90 HG22 ILE 11 2HG2 ILE 11 8.870 -11.425 -15.824 91 HG23 ILE 11 3HG2 ILE 11 8.741 -9.892 -16.720 92 HD11 ILE 11 3HD1 ILE 11 6.506 -9.527 -13.641 93 HD12 ILE 11 1HD1 ILE 11 6.592 -11.018 -14.609 94 HD13 ILE 11 2HD1 ILE 11 6.439 -11.114 -12.838 95 H MET 12 HN MET 12 9.557 -7.135 -15.648 96 HA MET 12 HA MET 12 11.145 -7.283 -17.763 97 HB2 MET 12 2HB MET 12 9.896 -5.010 -16.224 98 HB3 MET 12 3HB MET 12 11.050 -4.554 -17.461 99 HG2 MET 12 2HG MET 12 8.674 -6.412 -17.959 100 HG3 MET 12 3HG MET 12 8.646 -4.689 -18.277 101 HE1 MET 12 3HE MET 12 8.894 -7.903 -19.935 102 HE2 MET 12 1HE MET 12 7.916 -6.539 -20.527 103 HE3 MET 12 2HE MET 12 9.209 -7.215 -21.546 104 H LYS 13 HN LYS 13 12.125 -6.308 -14.509 105 HA LYS 13 HA LYS 13 14.747 -5.522 -15.559 106 HB2 LYS 13 2HB LYS 13 13.094 -4.660 -13.252 107 HB3 LYS 13 3HB LYS 13 14.810 -4.819 -12.935 108 HG2 LYS 13 2HG LYS 13 15.352 -3.328 -14.820 109 HG3 LYS 13 3HG LYS 13 13.668 -3.261 -15.301 110 HD2 LYS 13 2HD LYS 13 13.342 -2.428 -12.760 111 HD3 LYS 13 3HD LYS 13 15.022 -1.962 -12.941 112 HE2 LYS 13 2HE LYS 13 14.554 -0.413 -14.665 113 HE3 LYS 13 3HE LYS 13 13.059 -1.207 -15.118 114 HZ1 LYS 13 2HZ LYS 13 12.948 0.955 -13.723 115 HZ3 LYS 13 1HZ LYS 13 13.289 0.009 -12.442 116 H CYS 14 HN CYS 14 13.515 -7.057 -12.505 117 HA CYS 14 HA CYS 14 15.845 -8.750 -12.520 118 HB2 CYS 14 2HB CYS 14 13.768 -9.176 -10.469 119 HB3 CYS 14 3HB CYS 14 15.508 -9.041 -10.311 120 H SER 15 HN SER 15 14.459 -9.343 -14.788 121 HA SER 15 HA SER 15 12.315 -11.005 -14.623 122 HB2 SER 15 2HB SER 15 12.990 -10.251 -16.776 123 HB3 SER 15 3HB SER 15 14.633 -10.822 -16.568 124 HG SER 15 HG SER 15 12.554 -12.120 -17.702 125 H GLN 16 HN GLN 16 15.545 -12.368 -15.522 126 HA GLN 16 HA GLN 16 15.001 -14.497 -13.601 127 HB2 GLN 16 2HB GLN 16 16.654 -15.003 -16.073 128 HB3 GLN 16 3HB GLN 16 15.699 -16.132 -15.132 129 HG2 GLN 16 2HG GLN 16 14.648 -13.978 -17.020 130 HG3 GLN 16 3HG GLN 16 14.550 -15.713 -17.247 131 HE21 GLN 16 1HE2 GLN 16 12.299 -14.298 -17.430 132 HE22 GLN 16 2HE2 GLN 16 11.251 -14.549 -16.073 133 H CYS 17 HN CYS 17 16.275 -12.563 -12.398 134 HA CYS 17 HA CYS 17 19.105 -13.299 -12.590 135 HB2 CYS 17 2HB CYS 17 17.835 -10.617 -12.556 136 HB3 CYS 17 3HB CYS 17 19.258 -10.814 -11.552 137 H HIS 18 HN HIS 18 16.380 -11.986 -10.591 138 HA HIS 18 HA HIS 18 17.752 -13.054 -8.236 139 HB2 HIS 18 2HB HIS 18 15.754 -10.812 -8.577 140 HB3 HIS 18 3HB HIS 18 16.092 -11.526 -7.014 141 HD1 HIS 18 HD1 HIS 18 18.823 -11.498 -6.375 142 HD2 HIS 18 HD2 HIS 18 17.420 -8.739 -9.207 143 HE1 HIS 18 HE1 HIS 18 20.579 -9.651 -6.506 144 H THR 19 HN THR 19 15.909 -13.609 -6.445 145 HA THR 19 HA THR 19 13.950 -15.314 -7.841 146 HB THR 19 HB THR 19 14.334 -16.751 -5.662 147 HG1 THR 19 HG1 THR 19 15.627 -14.949 -4.714 148 HG21 THR 19 1HG2 THR 19 16.235 -16.431 -7.999 149 HG22 THR 19 2HG2 THR 19 16.721 -17.474 -6.640 150 HG23 THR 19 3HG2 THR 19 15.236 -17.834 -7.552 151 H VAL 20 HN VAL 20 14.680 -13.179 -5.064 152 HA VAL 20 HA VAL 20 13.351 -12.262 -3.535 153 HB VAL 20 HB VAL 20 11.408 -11.090 -4.454 154 HG11 VAL 20 1HG1 VAL 20 12.590 -9.692 -5.995 155 HG12 VAL 20 2HG1 VAL 20 13.776 -10.295 -4.812 156 HG13 VAL 20 3HG1 VAL 20 13.699 -11.011 -6.440 157 HG21 VAL 20 3HG2 VAL 20 10.672 -11.378 -6.733 158 HG22 VAL 20 1HG2 VAL 20 11.947 -12.581 -7.043 159 HG23 VAL 20 2HG2 VAL 20 10.619 -12.960 -5.919 160 H GLU 21 HN GLU 21 13.201 -15.222 -3.822 161 HA GLU 21 HA GLU 21 10.585 -15.498 -2.580 162 HB2 GLU 21 2HB GLU 21 10.422 -17.792 -3.661 163 HB3 GLU 21 3HB GLU 21 10.252 -16.441 -4.764 164 HG2 GLU 21 2HG GLU 21 12.315 -16.819 -5.784 165 HG3 GLU 21 3HG GLU 21 13.037 -17.490 -4.334 166 HE2 GLU 21 HE2 GLU 21 11.706 -19.608 -3.716 167 H LYS 22 HN LYS 22 10.520 -16.904 -0.772 168 HA LYS 22 HA LYS 22 12.664 -17.113 0.819 169 HB2 LYS 22 2HB LYS 22 10.382 -17.596 1.525 170 HB3 LYS 22 3HB LYS 22 10.358 -19.067 0.574 171 HG2 LYS 22 2HG LYS 22 12.038 -20.115 1.961 172 HG3 LYS 22 3HG LYS 22 12.455 -18.598 2.732 173 HD2 LYS 22 2HD LYS 22 10.166 -18.495 3.752 174 HD3 LYS 22 3HD LYS 22 9.764 -20.023 2.994 175 HE2 LYS 22 2HE LYS 22 10.468 -20.323 5.372 176 HE3 LYS 22 3HE LYS 22 11.523 -21.183 4.268 177 HZ1 LYS 22 2HZ LYS 22 12.392 -18.484 4.789 178 HZ3 LYS 22 1HZ LYS 22 13.253 -19.865 4.839 179 H GLY 23 HN GLY 23 11.567 -19.712 -1.474 180 HA2 GLY 23 1HA GLY 23 14.066 -21.142 -1.067 181 HA3 GLY 23 2HA GLY 23 12.685 -21.642 -2.021 182 H GLY 24 HN GLY 24 14.461 -18.495 -2.160 183 HA2 GLY 24 1HA GLY 24 14.648 -18.660 -5.019 184 HA3 GLY 24 2HA GLY 24 15.257 -17.392 -3.974 185 H LYS 25 HN LYS 25 16.326 -19.409 -6.246 186 HA LYS 25 HA LYS 25 18.613 -20.482 -4.826 187 HB2 LYS 25 2HB LYS 25 17.244 -20.972 -7.387 188 HB3 LYS 25 3HB LYS 25 18.992 -21.024 -7.499 189 HG2 LYS 25 2HG LYS 25 17.748 -22.433 -5.152 190 HG3 LYS 25 3HG LYS 25 17.503 -23.161 -6.727 191 HD2 LYS 25 2HD LYS 25 20.076 -22.891 -7.060 192 HD3 LYS 25 3HD LYS 25 20.146 -22.573 -5.337 193 HE2 LYS 25 2HE LYS 25 18.983 -25.091 -6.624 194 HE3 LYS 25 3HE LYS 25 20.547 -24.982 -5.840 195 HZ1 LYS 25 2HZ LYS 25 19.499 -24.599 -3.750 196 HZ3 LYS 25 1HZ LYS 25 18.664 -25.831 -4.410 197 H HIS 26 HN HIS 26 20.646 -20.235 -6.719 198 HA HIS 26 HA HIS 26 20.964 -17.324 -6.842 199 HB2 HIS 26 2HB HIS 26 23.275 -19.217 -6.465 200 HB3 HIS 26 3HB HIS 26 23.201 -17.493 -6.159 201 HD1 HIS 26 HD1 HIS 26 22.666 -16.765 -3.802 202 HD2 HIS 26 HD2 HIS 26 21.738 -20.797 -4.496 203 HE1 HIS 26 HE1 HIS 26 22.019 -17.750 -1.538 204 H LYS 27 HN LYS 27 20.999 -16.620 -8.912 205 HA LYS 27 HA LYS 27 22.165 -18.445 -10.899 206 HB2 LYS 27 2HB LYS 27 19.526 -17.358 -10.769 207 HB3 LYS 27 3HB LYS 27 20.346 -16.605 -12.122 208 HG2 LYS 27 2HG LYS 27 21.161 -19.190 -12.487 209 HG3 LYS 27 3HG LYS 27 19.623 -19.483 -11.699 210 HD2 LYS 27 2HD LYS 27 19.823 -17.529 -14.018 211 HD3 LYS 27 3HD LYS 27 19.681 -19.250 -14.315 212 HE2 LYS 27 2HE LYS 27 17.636 -19.116 -12.637 213 HE3 LYS 27 3HE LYS 27 17.687 -17.397 -12.973 214 HZ1 LYS 27 2HZ LYS 27 16.454 -19.253 -14.537 215 HZ3 LYS 27 1HZ LYS 27 17.832 -18.987 -15.364 216 H THR 28 HN THR 28 21.067 -15.039 -11.223 217 HA THR 28 HA THR 28 23.752 -14.362 -12.126 218 HB THR 28 HB THR 28 22.649 -12.471 -13.142 219 HG1 THR 28 HG1 THR 28 21.428 -11.849 -11.241 220 HG21 THR 28 1HG2 THR 28 20.502 -14.653 -13.045 221 HG22 THR 28 2HG2 THR 28 20.682 -13.393 -14.290 222 HG23 THR 28 3HG2 THR 28 21.898 -14.686 -14.150 223 H GLY 29 HN GLY 29 21.374 -13.443 -9.579 224 HA2 GLY 29 1HA GLY 29 23.618 -12.109 -8.181 225 HA3 GLY 29 2HA GLY 29 21.988 -11.469 -8.208 226 HA PRO 30 HA PRO 30 22.474 -14.412 -4.686 227 HB2 PRO 30 2HB PRO 30 22.615 -12.661 -2.594 228 HB3 PRO 30 3HB PRO 30 24.028 -13.390 -3.330 229 HG2 PRO 30 2HG PRO 30 23.011 -10.628 -3.606 230 HG3 PRO 30 3HG PRO 30 24.608 -11.251 -3.971 231 HD2 PRO 30 2HD PRO 30 22.543 -10.613 -5.856 232 HD3 PRO 30 3HD PRO 30 24.095 -11.344 -6.211 233 H ASN 31 HN ASN 31 20.798 -15.309 -3.543 234 HA ASN 31 HA ASN 31 18.328 -14.706 -4.267 235 HB2 ASN 31 2HB ASN 31 18.692 -16.662 -2.907 236 HB3 ASN 31 3HB ASN 31 19.394 -15.729 -1.601 237 HD21 ASN 31 1HD2 ASN 31 16.699 -17.303 -2.663 238 HD22 ASN 31 2HD2 ASN 31 15.480 -16.592 -1.659 239 H LEU 32 HN LEU 32 16.509 -13.484 -3.234 240 HA LEU 32 HA LEU 32 17.446 -11.320 -1.486 241 HB2 LEU 32 2HB LEU 32 15.888 -11.195 -4.035 242 HB3 LEU 32 3HB LEU 32 15.554 -10.025 -2.774 243 HG LEU 32 HG LEU 32 18.302 -10.493 -3.963 244 HD11 LEU 32 1HD1 LEU 32 16.625 -8.080 -4.575 245 HD12 LEU 32 2HD1 LEU 32 17.987 -8.784 -5.480 246 HD13 LEU 32 3HD1 LEU 32 16.397 -9.584 -5.500 247 HD21 LEU 32 3HD2 LEU 32 18.603 -9.554 -1.836 248 HD22 LEU 32 1HD2 LEU 32 18.672 -8.171 -2.954 249 HD23 LEU 32 2HD2 LEU 32 17.195 -8.479 -2.009 250 H HIS 33 HN HIS 33 16.736 -12.817 0.241 251 HA HIS 33 HA HIS 33 13.821 -12.693 0.500 252 HB2 HIS 33 2HB HIS 33 14.075 -14.951 0.183 253 HB3 HIS 33 3HB HIS 33 15.690 -14.990 0.861 254 HD1 HIS 33 HD1 HIS 33 12.822 -13.467 2.801 255 HD2 HIS 33 HD2 HIS 33 15.053 -17.018 2.699 256 HE1 HIS 33 HE1 HIS 33 12.209 -14.757 4.916 257 H GLY 34 HN GLY 34 17.045 -12.796 2.114 258 HA2 GLY 34 1HA GLY 34 15.824 -11.694 4.552 259 HA3 GLY 34 2HA GLY 34 17.406 -12.434 4.410 260 H LEU 35 HN LEU 35 16.126 -10.081 2.033 261 HA LEU 35 HA LEU 35 18.410 -8.508 2.111 262 HB2 LEU 35 2HB LEU 35 17.016 -8.523 0.197 263 HB3 LEU 35 3HB LEU 35 15.608 -8.026 1.116 264 HG LEU 35 HG LEU 35 16.923 -5.846 1.584 265 HD11 LEU 35 1HD1 LEU 35 18.525 -6.982 -0.718 266 HD12 LEU 35 2HD1 LEU 35 18.506 -5.259 -0.274 267 HD13 LEU 35 3HD1 LEU 35 19.113 -6.467 0.882 268 HD21 LEU 35 3HD2 LEU 35 15.109 -5.416 0.303 269 HD22 LEU 35 1HD2 LEU 35 16.351 -5.151 -0.944 270 HD23 LEU 35 2HD2 LEU 35 15.484 -6.704 -0.867 271 H PHE 36 HN PHE 36 15.147 -7.933 3.601 272 HA PHE 36 HA PHE 36 16.106 -5.631 4.980 273 HB2 PHE 36 2HB PHE 36 13.623 -7.430 5.013 274 HB3 PHE 36 3HB PHE 36 13.767 -6.104 6.148 275 HD1 PHE 36 HD2 PHE 36 13.868 -6.824 2.495 276 HD2 PHE 36 HD1 PHE 36 13.043 -3.981 5.535 277 HE1 PHE 36 HE2 PHE 36 12.943 -5.251 0.772 278 HE2 PHE 36 HE1 PHE 36 12.118 -2.407 3.812 279 HZ PHE 36 HZ PHE 36 12.080 -3.061 1.451 280 H GLY 37 HN GLY 37 17.197 -5.564 6.884 281 HA2 GLY 37 1HA GLY 37 17.729 -6.112 9.030 282 HA3 GLY 37 2HA GLY 37 16.639 -7.484 8.965 283 H ARG 38 HN ARG 38 19.389 -6.635 6.761 284 HA ARG 38 HA ARG 38 20.938 -8.747 7.904 285 HB2 ARG 38 2HB ARG 38 19.492 -9.933 6.230 286 HB3 ARG 38 3HB ARG 38 20.059 -8.852 4.973 287 HG2 ARG 38 2HG ARG 38 22.278 -9.733 5.038 288 HG3 ARG 38 3HG ARG 38 22.045 -10.457 6.616 289 HD2 ARG 38 2HD ARG 38 21.813 -12.355 5.284 290 HD3 ARG 38 3HD ARG 38 20.137 -11.849 5.358 291 HE ARG 38 HE ARG 38 21.431 -10.530 3.152 292 HH11 ARG 38 2HH2 ARG 38 20.224 -13.720 4.115 293 HH12 ARG 38 1HH2 ARG 38 19.933 -14.238 2.488 294 HH22 ARG 38 HH1 ARG 38 20.423 -12.748 0.675 295 H LYS 39 HN LYS 39 23.176 -8.850 6.751 296 HA LYS 39 HA LYS 39 23.890 -6.115 6.016 297 HB2 LYS 39 2HB LYS 39 25.277 -8.381 7.367 298 HB3 LYS 39 3HB LYS 39 26.262 -7.333 6.367 299 HG2 LYS 39 2HG LYS 39 25.848 -5.434 7.691 300 HG3 LYS 39 3HG LYS 39 24.314 -6.043 8.277 301 HD2 LYS 39 2HD LYS 39 26.829 -7.549 9.011 302 HD3 LYS 39 3HD LYS 39 26.491 -6.041 9.837 303 HE2 LYS 39 2HE LYS 39 24.117 -7.001 10.287 304 HE3 LYS 39 3HE LYS 39 24.760 -8.546 9.766 305 HZ1 LYS 39 2HZ LYS 39 25.662 -6.936 12.082 306 HZ3 LYS 39 1HZ LYS 39 26.562 -8.162 11.499 307 H THR 40 HN THR 40 26.090 -6.320 4.497 308 HA THR 40 HA THR 40 25.047 -7.618 2.090 309 HB THR 40 HB THR 40 26.672 -6.060 0.973 310 HG1 THR 40 HG1 THR 40 27.971 -4.785 2.394 311 HG21 THR 40 1HG2 THR 40 25.347 -4.182 1.232 312 HG22 THR 40 2HG2 THR 40 24.314 -5.278 2.179 313 HG23 THR 40 3HG2 THR 40 25.483 -4.222 3.007 314 H GLY 41 HN GLY 41 26.269 -9.028 0.798 315 HA2 GLY 41 1HA GLY 41 27.752 -10.668 0.394 316 HA3 GLY 41 2HA GLY 41 28.911 -9.793 1.376 317 H GLN 42 HN GLN 42 25.797 -11.604 1.929 318 HA GLN 42 HA GLN 42 27.124 -12.809 4.226 319 HB2 GLN 42 2HB GLN 42 24.152 -12.443 3.646 320 HB3 GLN 42 3HB GLN 42 24.792 -13.267 5.054 321 HG2 GLN 42 2HG GLN 42 25.121 -10.329 4.319 322 HG3 GLN 42 3HG GLN 42 24.305 -10.991 5.721 323 HE21 GLN 42 1HE2 GLN 42 27.229 -9.907 4.375 324 HE22 GLN 42 2HE2 GLN 42 28.301 -10.254 5.691 325 H ALA 43 HN ALA 43 24.848 -13.478 1.482 326 HA ALA 43 HA ALA 43 24.443 -16.110 1.696 327 HB1 ALA 43 3HB ALA 43 24.099 -16.122 -0.656 328 HB2 ALA 43 1HB ALA 43 23.770 -14.448 -0.148 329 HB3 ALA 43 2HB ALA 43 25.321 -14.854 -0.922 330 HA PRO 44 HA PRO 44 28.656 -17.476 1.823 331 HB2 PRO 44 2HB PRO 44 28.190 -19.771 3.232 332 HB3 PRO 44 3HB PRO 44 28.539 -18.232 3.994 333 HG2 PRO 44 2HG PRO 44 25.951 -19.641 3.765 334 HG3 PRO 44 3HG PRO 44 26.405 -18.351 4.860 335 HD2 PRO 44 2HD PRO 44 24.790 -18.112 2.502 336 HD3 PRO 44 3HD PRO 44 25.340 -16.805 3.532 337 H GLY 45 HN GLY 45 26.048 -18.386 0.118 338 HA2 GLY 45 1HA GLY 45 27.296 -20.800 -0.980 339 HA3 GLY 45 2HA GLY 45 25.666 -20.221 -1.267 340 H TYR 46 HN TYR 46 26.820 -17.355 -1.616 341 HA TYR 46 HA TYR 46 28.187 -17.724 -4.174 342 HB2 TYR 46 2HB TYR 46 25.632 -17.514 -4.419 343 HB3 TYR 46 3HB TYR 46 25.714 -15.984 -3.568 344 HD1 TYR 46 HD1 TYR 46 28.167 -17.141 -6.114 345 HD2 TYR 46 HD2 TYR 46 24.861 -14.559 -5.275 346 HE1 TYR 46 HE1 TYR 46 28.543 -15.931 -8.319 347 HE2 TYR 46 HE2 TYR 46 25.247 -13.358 -7.482 348 HH TYR 46 HH TYR 46 27.266 -14.622 -9.891 349 H SER 47 HN SER 47 30.040 -16.567 -4.032 350 HA SER 47 HA SER 47 30.102 -14.360 -2.192 351 HB2 SER 47 2HB SER 47 32.225 -15.778 -3.849 352 HB3 SER 47 3HB SER 47 32.582 -14.333 -2.925 353 HG SER 47 HG SER 47 32.791 -16.693 -1.962 354 H TYR 48 HN TYR 48 29.846 -12.242 -2.818 355 HA TYR 48 HA TYR 48 29.541 -11.693 -5.634 356 HB2 TYR 48 2HB TYR 48 29.589 -9.696 -3.321 357 HB3 TYR 48 3HB TYR 48 28.570 -9.657 -4.745 358 HD1 TYR 48 HD2 TYR 48 27.850 -12.748 -4.392 359 HD2 TYR 48 HD1 TYR 48 27.660 -9.309 -1.854 360 HE1 TYR 48 HE2 TYR 48 25.963 -13.820 -3.068 361 HE2 TYR 48 HE1 TYR 48 25.774 -10.392 -0.539 362 HH TYR 48 HH TYR 48 24.401 -12.061 -0.409 363 H THR 49 HN THR 49 30.399 -9.083 -5.902 364 HA THR 49 HA THR 49 33.211 -9.474 -6.226 365 HB THR 49 HB THR 49 32.903 -6.982 -7.021 366 HG1 THR 49 HG1 THR 49 30.593 -6.523 -7.248 367 HG21 THR 49 1HG2 THR 49 31.384 -7.764 -8.991 368 HG22 THR 49 2HG2 THR 49 32.933 -8.617 -8.786 369 HG23 THR 49 3HG2 THR 49 31.422 -9.366 -8.217 370 H ALA 50 HN ALA 50 34.774 -7.652 -5.552 371 HA ALA 50 HA ALA 50 34.677 -7.578 -2.695 372 HB1 ALA 50 3HB ALA 50 36.626 -6.313 -4.663 373 HB2 ALA 50 1HB ALA 50 36.896 -6.573 -2.924 374 HB3 ALA 50 2HB ALA 50 36.752 -7.968 -4.020 375 H ALA 51 HN ALA 51 33.614 -5.554 -5.331 376 HA ALA 51 HA ALA 51 33.822 -3.072 -3.978 377 HB1 ALA 51 3HB ALA 51 32.496 -4.151 -6.450 378 HB2 ALA 51 1HB ALA 51 31.974 -2.568 -5.825 379 HB3 ALA 51 2HB ALA 51 33.676 -2.830 -6.277 380 H ASN 52 HN ASN 52 31.532 -5.775 -3.987 381 HA ASN 52 HA ASN 52 29.594 -4.148 -2.598 382 HB2 ASN 52 2HB ASN 52 29.015 -5.883 -4.448 383 HB3 ASN 52 3HB ASN 52 29.397 -7.124 -3.271 384 HD21 ASN 52 1HD2 ASN 52 28.324 -6.860 -1.102 385 HD22 ASN 52 2HD2 ASN 52 26.651 -6.413 -1.078 386 H LYS 53 HN LYS 53 31.391 -7.304 -2.261 387 HA LYS 53 HA LYS 53 30.666 -8.036 0.232 388 HB2 LYS 53 2HB LYS 53 32.286 -9.110 -1.494 389 HB3 LYS 53 3HB LYS 53 33.542 -8.224 -0.653 390 HG2 LYS 53 2HG LYS 53 32.325 -9.280 1.514 391 HG3 LYS 53 3HG LYS 53 31.813 -10.480 0.347 392 HD2 LYS 53 2HD LYS 53 34.328 -10.577 -0.370 393 HD3 LYS 53 3HD LYS 53 34.654 -9.720 1.124 394 HE2 LYS 53 2HE LYS 53 34.873 -12.139 1.505 395 HE3 LYS 53 3HE LYS 53 33.506 -11.529 2.416 396 HZ1 LYS 53 2HZ LYS 53 32.033 -12.623 1.062 397 HZ3 LYS 53 1HZ LYS 53 33.293 -13.628 0.830 398 H ASN 54 HN ASN 54 33.295 -5.692 -0.625 399 HA ASN 54 HA ASN 54 34.174 -5.189 1.882 400 HB2 ASN 54 2HB ASN 54 33.938 -3.511 -0.632 401 HB3 ASN 54 3HB ASN 54 34.476 -2.726 0.840 402 HD21 ASN 54 1HD2 ASN 54 35.980 -4.488 2.122 403 HD22 ASN 54 2HD2 ASN 54 37.365 -4.980 1.205 404 H LYS 55 HN LYS 55 31.333 -3.864 0.093 405 HA LYS 55 HA LYS 55 30.588 -1.772 1.623 406 HB2 LYS 55 2HB LYS 55 29.504 -2.884 -0.469 407 HB3 LYS 55 3HB LYS 55 28.547 -3.781 0.692 408 HG2 LYS 55 2HG LYS 55 27.204 -1.886 0.324 409 HG3 LYS 55 3HG LYS 55 28.066 -1.436 1.781 410 HD2 LYS 55 2HD LYS 55 29.768 -0.225 0.364 411 HD3 LYS 55 3HD LYS 55 28.833 -0.624 -1.063 412 HE2 LYS 55 2HE LYS 55 28.101 1.568 -0.502 413 HE3 LYS 55 3HE LYS 55 26.827 0.533 0.112 414 HZ1 LYS 55 2HZ LYS 55 28.953 1.872 1.667 415 HZ3 LYS 55 1HZ LYS 55 28.144 0.608 2.298 416 H GLY 56 HN GLY 56 29.513 -1.394 3.576 417 HA2 GLY 56 1HA GLY 56 28.874 -3.745 5.220 418 HA3 GLY 56 2HA GLY 56 30.031 -2.575 5.823 419 H ILE 57 HN ILE 57 26.640 -3.010 4.704 420 HA ILE 57 HA ILE 57 25.783 -1.100 6.670 421 HB ILE 57 HB ILE 57 24.572 0.318 5.084 422 HG12 ILE 57 2HG1 ILE 57 25.577 0.202 2.651 423 HG13 ILE 57 3HG1 ILE 57 25.881 -1.473 3.061 424 HG21 ILE 57 1HG2 ILE 57 26.403 1.705 4.489 425 HG22 ILE 57 2HG2 ILE 57 26.857 0.875 5.997 426 HG23 ILE 57 3HG2 ILE 57 27.527 0.325 4.443 427 HD11 ILE 57 3HD1 ILE 57 23.153 -0.200 3.504 428 HD12 ILE 57 1HD1 ILE 57 23.610 -0.943 1.952 429 HD13 ILE 57 2HD1 ILE 57 23.560 -1.931 3.432 430 H ILE 58 HN ILE 58 23.405 -1.162 6.944 431 HA ILE 58 HA ILE 58 22.466 -3.832 6.374 432 HB ILE 58 HB ILE 58 21.361 -1.560 8.023 433 HG12 ILE 58 2HG1 ILE 58 23.500 -2.904 8.690 434 HG13 ILE 58 3HG1 ILE 58 22.258 -2.571 9.881 435 HG21 ILE 58 1HG2 ILE 58 19.767 -3.256 8.908 436 HG22 ILE 58 2HG2 ILE 58 19.488 -2.821 7.204 437 HG23 ILE 58 3HG2 ILE 58 20.284 -4.360 7.611 438 HD11 ILE 58 3HD1 ILE 58 22.220 -5.129 8.237 439 HD12 ILE 58 1HD1 ILE 58 23.145 -4.999 9.753 440 HD13 ILE 58 2HD1 ILE 58 21.378 -4.790 9.767 441 H TRP 59 HN TRP 59 20.764 -4.388 5.019 442 HA TRP 59 HA TRP 59 20.179 -2.469 2.971 443 HB2 TRP 59 2HB TRP 59 19.649 -5.371 3.438 444 HB3 TRP 59 3HB TRP 59 18.643 -4.511 2.289 445 HD1 TRP 59 HD1 TRP 59 21.567 -6.579 2.157 446 HE1 TRP 59 HE1 TRP 59 23.171 -6.143 0.108 447 HE3 TRP 59 HE3 TRP 59 19.654 -2.024 0.955 448 HZ2 TRP 59 HZ2 TRP 59 23.454 -3.990 -1.744 449 HZ3 TRP 59 HZ3 TRP 59 20.651 -0.821 -0.988 450 HH2 TRP 59 HH2 TRP 59 22.487 -1.733 -2.318 451 H GLY 60 HN GLY 60 17.770 -2.200 2.294 452 HA2 GLY 60 1HA GLY 60 15.600 -2.601 3.891 453 HA3 GLY 60 2HA GLY 60 16.346 -1.165 4.566 454 H GLU 61 HN GLU 61 13.755 -1.180 3.324 455 HA GLU 61 HA GLU 61 13.739 -0.533 0.676 456 HB2 GLU 61 2HB GLU 61 11.624 0.796 1.300 457 HB3 GLU 61 3HB GLU 61 11.650 -0.898 1.748 458 HG2 GLU 61 2HG GLU 61 12.038 -0.423 4.047 459 HG3 GLU 61 3HG GLU 61 12.635 1.191 3.714 460 HE2 GLU 61 HE2 GLU 61 9.014 1.240 2.474 461 H ASP 62 HN ASP 62 14.690 1.407 3.504 462 HA ASP 62 HA ASP 62 14.547 3.887 2.247 463 HB2 ASP 62 2HB ASP 62 16.079 2.775 4.620 464 HB3 ASP 62 3HB ASP 62 16.384 4.414 4.082 465 HD2 ASP 62 HD2 ASP 62 15.201 4.800 6.518 466 H THR 63 HN THR 63 17.084 1.345 2.594 467 HA THR 63 HA THR 63 19.079 2.949 1.257 468 HB THR 63 HB THR 63 20.337 0.688 1.523 469 HG1 THR 63 HG1 THR 63 19.012 -0.612 3.185 470 HG21 THR 63 1HG2 THR 63 20.812 1.080 3.800 471 HG22 THR 63 2HG2 THR 63 20.148 2.661 3.321 472 HG23 THR 63 3HG2 THR 63 19.121 1.488 4.181 473 H LEU 64 HN LEU 64 16.473 0.837 0.352 474 HA LEU 64 HA LEU 64 17.696 0.037 -2.120 475 HB2 LEU 64 2HB LEU 64 14.955 -0.277 -0.912 476 HB3 LEU 64 3HB LEU 64 15.313 -0.774 -2.554 477 HG LEU 64 HG LEU 64 16.701 -1.822 -0.072 478 HD11 LEU 64 1HD1 LEU 64 15.157 -3.419 0.119 479 HD12 LEU 64 2HD1 LEU 64 14.142 -2.412 -0.942 480 HD13 LEU 64 3HD1 LEU 64 15.129 -3.722 -1.635 481 HD21 LEU 64 3HD2 LEU 64 17.175 -2.196 -2.985 482 HD22 LEU 64 1HD2 LEU 64 18.314 -2.216 -1.617 483 HD23 LEU 64 2HD2 LEU 64 17.292 -3.636 -1.945 484 H MET 65 HN MET 65 15.861 2.756 -0.868 485 HA MET 65 HA MET 65 14.698 3.578 -3.248 486 HB2 MET 65 2HB MET 65 14.500 4.375 -0.688 487 HB3 MET 65 3HB MET 65 15.726 5.535 -1.160 488 HG2 MET 65 2HG MET 65 13.841 6.778 -1.702 489 HG3 MET 65 3HG MET 65 14.055 5.946 -3.229 490 HE1 MET 65 3HE MET 65 12.616 3.806 -3.987 491 HE2 MET 65 1HE MET 65 10.892 4.185 -3.755 492 HE3 MET 65 2HE MET 65 12.014 5.448 -4.315 493 H GLU 66 HN GLU 66 17.685 4.861 -1.600 494 HA GLU 66 HA GLU 66 18.407 6.416 -3.793 495 HB2 GLU 66 2HB GLU 66 19.187 6.802 -1.456 496 HB3 GLU 66 3HB GLU 66 20.140 5.333 -1.528 497 HG2 GLU 66 2HG GLU 66 21.845 6.571 -2.367 498 HG3 GLU 66 3HG GLU 66 20.913 6.747 -3.841 499 HE2 GLU 66 HE2 GLU 66 20.731 9.066 -4.272 500 H TYR 67 HN TYR 67 19.145 3.053 -2.808 501 HA TYR 67 HA TYR 67 21.267 2.583 -4.547 502 HB2 TYR 67 2HB TYR 67 20.528 1.097 -2.680 503 HB3 TYR 67 3HB TYR 67 18.949 0.901 -3.414 504 HD1 TYR 67 HD2 TYR 67 22.572 0.279 -4.167 505 HD2 TYR 67 HD1 TYR 67 18.524 -1.008 -4.678 506 HE1 TYR 67 HE2 TYR 67 23.381 -1.814 -5.363 507 HE2 TYR 67 HE1 TYR 67 19.346 -3.096 -5.872 508 HH TYR 67 HH TYR 67 22.731 -3.484 -6.701 509 H LEU 68 HN LEU 68 17.819 1.499 -4.976 510 HA LEU 68 HA LEU 68 18.098 0.718 -7.595 511 HB2 LEU 68 2HB LEU 68 15.784 1.635 -5.924 512 HB3 LEU 68 3HB LEU 68 15.555 1.291 -7.628 513 HG LEU 68 HG LEU 68 16.647 -0.673 -5.594 514 HD11 LEU 68 1HD1 LEU 68 14.133 0.139 -5.535 515 HD12 LEU 68 2HD1 LEU 68 13.975 -1.001 -6.893 516 HD13 LEU 68 3HD1 LEU 68 14.565 -1.574 -5.313 517 HD21 LEU 68 3HD2 LEU 68 16.230 -0.792 -8.550 518 HD22 LEU 68 1HD2 LEU 68 17.526 -1.481 -7.543 519 HD23 LEU 68 2HD2 LEU 68 15.923 -2.255 -7.583 520 H GLU 69 HN GLU 69 17.840 3.953 -6.188 521 HA GLU 69 HA GLU 69 17.064 5.216 -8.570 522 HB2 GLU 69 2HB GLU 69 16.629 6.430 -6.590 523 HB3 GLU 69 3HB GLU 69 18.226 6.135 -5.933 524 HG2 GLU 69 2HG GLU 69 19.259 7.691 -7.463 525 HG3 GLU 69 3HG GLU 69 17.824 7.775 -8.466 526 HE2 GLU 69 HE2 GLU 69 18.367 10.054 -7.884 527 H ASN 70 HN ASN 70 20.205 4.384 -7.050 528 HA ASN 70 HA ASN 70 21.460 4.655 -9.574 529 HB2 ASN 70 2HB ASN 70 21.961 6.669 -7.359 530 HB3 ASN 70 3HB ASN 70 23.296 6.207 -8.396 531 HD21 ASN 70 1HD2 ASN 70 21.240 8.560 -7.960 532 HD22 ASN 70 2HD2 ASN 70 20.884 9.085 -9.572 533 HA PRO 71 HA PRO 71 23.209 1.642 -6.642 534 HB2 PRO 71 2HB PRO 71 23.146 -0.534 -8.293 535 HB3 PRO 71 3HB PRO 71 21.854 -0.141 -7.176 536 HG2 PRO 71 2HG PRO 71 21.931 0.192 -10.113 537 HG3 PRO 71 3HG PRO 71 20.541 0.173 -9.046 538 HD2 PRO 71 2HD PRO 71 21.751 2.480 -10.246 539 HD3 PRO 71 3HD PRO 71 20.435 2.469 -9.089 540 H LYS 72 HN LYS 72 24.167 3.181 -9.353 541 HA LYS 72 HA LYS 72 26.608 1.699 -9.708 542 HB2 LYS 72 2HB LYS 72 27.018 3.129 -11.529 543 HB3 LYS 72 3HB LYS 72 25.289 2.850 -11.548 544 HG2 LYS 72 2HG LYS 72 24.940 5.085 -11.435 545 HG3 LYS 72 3HG LYS 72 25.692 5.113 -9.853 546 HD2 LYS 72 2HD LYS 72 27.448 5.072 -12.321 547 HD3 LYS 72 3HD LYS 72 26.688 6.576 -11.838 548 HE2 LYS 72 2HE LYS 72 27.670 5.827 -9.418 549 HE3 LYS 72 3HE LYS 72 28.823 4.987 -10.436 550 HZ1 LYS 72 2HZ LYS 72 29.779 7.070 -10.279 551 HZ3 LYS 72 1HZ LYS 72 28.367 7.878 -10.215 552 H LYS 73 HN LYS 73 25.390 4.109 -7.566 553 HA LYS 73 HA LYS 73 28.109 5.049 -7.010 554 HB2 LYS 73 2HB LYS 73 27.233 7.041 -6.315 555 HB3 LYS 73 3HB LYS 73 26.028 6.597 -7.507 556 HG2 LYS 73 2HG LYS 73 24.671 5.524 -5.634 557 HG3 LYS 73 3HG LYS 73 25.831 6.171 -4.491 558 HD2 LYS 73 2HD LYS 73 24.225 7.865 -6.463 559 HD3 LYS 73 3HD LYS 73 23.792 7.629 -4.782 560 HE2 LYS 73 2HE LYS 73 24.979 9.671 -4.724 561 HE3 LYS 73 3HE LYS 73 26.198 8.509 -4.238 562 HZ1 LYS 73 2HZ LYS 73 26.392 10.229 -6.365 563 HZ3 LYS 73 1HZ LYS 73 26.109 8.796 -7.083 564 H TYR 74 HN TYR 74 25.171 3.530 -5.597 565 HA TYR 74 HA TYR 74 26.128 3.407 -2.968 566 HB2 TYR 74 2HB TYR 74 23.786 2.959 -4.221 567 HB3 TYR 74 3HB TYR 74 24.386 1.319 -4.378 568 HD1 TYR 74 HD1 TYR 74 25.485 0.472 -1.966 569 HD2 TYR 74 HD2 TYR 74 22.289 3.266 -2.487 570 HE1 TYR 74 HE1 TYR 74 24.632 -0.057 0.370 571 HE2 TYR 74 HE2 TYR 74 21.446 2.729 -0.149 572 HH TYR 74 HH TYR 74 22.941 1.677 2.103 573 H ILE 75 HN ILE 75 26.519 1.248 -5.815 574 HA ILE 75 HA ILE 75 28.534 -0.201 -4.260 575 HB ILE 75 HB ILE 75 26.515 -1.526 -6.071 576 HG12 ILE 75 2HG1 ILE 75 25.625 -0.520 -3.871 577 HG13 ILE 75 3HG1 ILE 75 25.260 -2.195 -4.236 578 HG21 ILE 75 1HG2 ILE 75 28.784 -2.575 -5.877 579 HG22 ILE 75 2HG2 ILE 75 28.480 -2.772 -4.134 580 HG23 ILE 75 3HG2 ILE 75 27.438 -3.596 -5.318 581 HD11 ILE 75 3HD1 ILE 75 26.832 -3.025 -2.667 582 HD12 ILE 75 1HD1 ILE 75 27.726 -1.486 -2.616 583 HD13 ILE 75 2HD1 ILE 75 26.128 -1.613 -1.842 584 HA PRO 76 HA PRO 76 30.295 1.248 -8.104 585 HB2 PRO 76 2HB PRO 76 32.707 2.018 -7.078 586 HB3 PRO 76 3HB PRO 76 31.343 3.106 -7.238 587 HG2 PRO 76 2HG PRO 76 32.418 1.828 -4.798 588 HG3 PRO 76 3HG PRO 76 31.358 3.217 -4.934 589 HD2 PRO 76 2HD PRO 76 30.605 0.547 -4.202 590 HD3 PRO 76 3HD PRO 76 29.530 1.909 -4.451 591 H GLY 77 HN GLY 77 30.526 -0.516 -9.352 592 HA2 GLY 77 1HA GLY 77 32.174 -1.942 -10.276 593 HA3 GLY 77 2HA GLY 77 32.899 -2.134 -8.691 594 H THR 78 HN THR 78 29.394 -2.286 -9.578 595 HA THR 78 HA THR 78 29.315 -4.948 -8.363 596 HB THR 78 HB THR 78 27.784 -3.130 -7.540 597 HG1 THR 78 HG1 THR 78 26.446 -4.881 -7.346 598 HG21 THR 78 1HG2 THR 78 26.541 -1.854 -8.972 599 HG22 THR 78 2HG2 THR 78 27.447 -2.584 -10.320 600 HG23 THR 78 3HG2 THR 78 25.914 -3.310 -9.781 601 H LYS 79 HN LYS 79 27.952 -6.635 -9.389 602 HA LYS 79 HA LYS 79 28.581 -6.676 -12.228 603 HB2 LYS 79 2HB LYS 79 27.462 -8.968 -10.617 604 HB3 LYS 79 3HB LYS 79 28.401 -9.020 -12.096 605 HG2 LYS 79 2HG LYS 79 30.299 -7.873 -10.714 606 HG3 LYS 79 3HG LYS 79 29.363 -8.310 -9.298 607 HD2 LYS 79 2HD LYS 79 30.059 -10.392 -11.403 608 HD3 LYS 79 3HD LYS 79 31.205 -9.973 -10.146 609 HE2 LYS 79 2HE LYS 79 28.416 -11.151 -9.794 610 HE3 LYS 79 3HE LYS 79 29.945 -11.876 -9.340 611 HZ1 LYS 79 2HZ LYS 79 30.011 -10.662 -7.437 612 HZ3 LYS 79 1HZ LYS 79 28.409 -10.461 -7.650 613 H MET 80 HN MET 80 25.966 -6.007 -10.069 614 HA MET 80 HA MET 80 23.878 -6.972 -11.658 615 HB2 MET 80 2HB MET 80 23.621 -6.391 -9.253 616 HB3 MET 80 3HB MET 80 24.037 -4.721 -9.579 617 HG2 MET 80 2HG MET 80 21.990 -4.327 -10.784 618 HG3 MET 80 3HG MET 80 21.658 -6.040 -10.947 619 HE1 MET 80 3HE MET 80 19.994 -3.602 -10.004 620 HE2 MET 80 1HE MET 80 19.359 -3.748 -8.347 621 HE3 MET 80 2HE MET 80 20.892 -2.891 -8.641 622 H ILE 81 HN ILE 81 23.727 -6.343 -13.793 623 HA ILE 81 HA ILE 81 24.450 -3.701 -14.589 624 HB ILE 81 HB ILE 81 23.378 -6.151 -15.935 625 HG12 ILE 81 2HG1 ILE 81 25.518 -5.428 -17.357 626 HG13 ILE 81 3HG1 ILE 81 25.935 -4.603 -15.868 627 HG21 ILE 81 1HG2 ILE 81 23.562 -4.771 -18.097 628 HG22 ILE 81 2HG2 ILE 81 22.103 -4.577 -17.097 629 HG23 ILE 81 3HG2 ILE 81 23.389 -3.348 -17.041 630 HD11 ILE 81 3HD1 ILE 81 26.027 -7.454 -16.475 631 HD12 ILE 81 1HD1 ILE 81 26.697 -6.584 -15.074 632 HD13 ILE 81 2HD1 ILE 81 25.011 -7.153 -15.045 633 H PHE 82 HN PHE 82 23.167 -2.182 -13.523 634 HA PHE 82 HA PHE 82 20.341 -2.286 -14.301 635 HB2 PHE 82 2HB PHE 82 21.126 -2.796 -11.790 636 HB3 PHE 82 3HB PHE 82 21.431 -1.072 -11.713 637 HD1 PHE 82 HD1 PHE 82 18.754 -3.550 -12.415 638 HD2 PHE 82 HD2 PHE 82 19.690 0.420 -11.243 639 HE1 PHE 82 HE1 PHE 82 16.341 -3.147 -11.854 640 HE2 PHE 82 HE2 PHE 82 17.277 0.822 -10.681 641 HZ PHE 82 HZ PHE 82 15.632 -0.966 -10.993 642 H VAL 83 HN VAL 83 19.587 -0.445 -15.273 643 HA VAL 83 HA VAL 83 21.465 1.659 -15.748 644 HB VAL 83 HB VAL 83 19.722 2.565 -17.157 645 HG11 VAL 83 1HG1 VAL 83 19.827 0.954 -18.798 646 HG12 VAL 83 2HG1 VAL 83 21.100 0.372 -17.699 647 HG13 VAL 83 3HG1 VAL 83 19.487 -0.380 -17.670 648 HG21 VAL 83 3HG2 VAL 83 17.560 1.090 -17.329 649 HG22 VAL 83 1HG2 VAL 83 17.970 0.635 -15.658 650 HG23 VAL 83 2HG2 VAL 83 17.688 2.343 -16.072 651 H GLY 84 HN GLY 84 18.543 1.116 -13.734 652 HA2 GLY 84 1HA GLY 84 18.490 2.247 -11.608 653 HA3 GLY 84 2HA GLY 84 19.137 3.678 -12.385 654 H ILE 85 HN ILE 85 16.727 3.698 -10.846 655 HA ILE 85 HA ILE 85 14.719 4.053 -12.962 656 HB ILE 85 HB ILE 85 14.045 3.723 -10.064 657 HG12 ILE 85 2HG1 ILE 85 14.558 1.443 -11.997 658 HG13 ILE 85 3HG1 ILE 85 15.557 1.854 -10.617 659 HG21 ILE 85 1HG2 ILE 85 12.605 4.055 -12.501 660 HG22 ILE 85 2HG2 ILE 85 12.258 2.429 -11.866 661 HG23 ILE 85 3HG2 ILE 85 11.977 3.862 -10.847 662 HD11 ILE 85 3HD1 ILE 85 14.031 1.037 -9.081 663 HD12 ILE 85 1HD1 ILE 85 12.627 1.484 -10.081 664 HD13 ILE 85 2HD1 ILE 85 13.572 0.026 -10.472 665 H LYS 86 HN LYS 86 13.662 6.030 -13.136 666 HA LYS 86 HA LYS 86 14.874 8.155 -11.534 667 HB2 LYS 86 2HB LYS 86 14.516 9.597 -13.314 668 HB3 LYS 86 3HB LYS 86 14.927 8.096 -14.116 669 HG2 LYS 86 2HG LYS 86 12.558 7.597 -14.534 670 HG3 LYS 86 3HG LYS 86 12.053 8.970 -13.567 671 HD2 LYS 86 2HD LYS 86 13.945 9.573 -15.814 672 HD3 LYS 86 3HD LYS 86 12.335 9.066 -16.283 673 HE2 LYS 86 2HE LYS 86 11.889 11.319 -16.045 674 HE3 LYS 86 3HE LYS 86 11.633 10.856 -14.374 675 HZ1 LYS 86 2HZ LYS 86 13.191 12.471 -14.045 676 HZ3 LYS 86 1HZ LYS 86 13.859 12.336 -15.524 677 H LYS 87 HN LYS 87 11.848 6.465 -12.283 678 HA LYS 87 HA LYS 87 10.171 8.437 -11.116 679 HB2 LYS 87 2HB LYS 87 9.852 5.638 -12.134 680 HB3 LYS 87 3HB LYS 87 8.603 6.297 -11.098 681 HG2 LYS 87 2HG LYS 87 9.620 7.978 -13.399 682 HG3 LYS 87 3HG LYS 87 8.518 6.659 -13.742 683 HD2 LYS 87 2HD LYS 87 7.901 8.726 -11.593 684 HD3 LYS 87 3HD LYS 87 7.485 9.001 -13.273 685 HE2 LYS 87 2HE LYS 87 6.028 7.058 -13.327 686 HE3 LYS 87 3HE LYS 87 6.622 6.484 -11.782 687 HZ1 LYS 87 2HZ LYS 87 4.569 8.388 -12.273 688 HZ3 LYS 87 1HZ LYS 87 5.702 9.047 -11.305 689 H LYS 88 HN LYS 88 9.460 8.680 -9.021 690 HA LYS 88 HA LYS 88 10.989 7.281 -7.032 691 HB2 LYS 88 2HB LYS 88 10.336 8.944 -5.587 692 HB3 LYS 88 3HB LYS 88 10.272 9.792 -7.119 693 HG2 LYS 88 2HG LYS 88 7.804 9.262 -7.267 694 HG3 LYS 88 3HG LYS 88 7.896 8.513 -5.686 695 HD2 LYS 88 2HD LYS 88 8.926 11.337 -6.004 696 HD3 LYS 88 3HD LYS 88 7.193 11.081 -5.958 697 HE2 LYS 88 2HE LYS 88 7.477 9.809 -3.788 698 HE3 LYS 88 3HE LYS 88 9.189 10.181 -3.825 699 HZ1 LYS 88 2HZ LYS 88 8.203 12.626 -4.105 700 HZ3 LYS 88 1HZ LYS 88 8.440 11.971 -2.633 701 H GLU 89 HN GLU 89 7.602 7.391 -8.237 702 HA GLU 89 HA GLU 89 6.630 5.712 -6.213 703 HB2 GLU 89 2HB GLU 89 5.334 7.320 -7.780 704 HB3 GLU 89 3HB GLU 89 5.412 6.044 -8.979 705 HG2 GLU 89 2HG GLU 89 4.216 4.492 -7.510 706 HG3 GLU 89 3HG GLU 89 4.305 5.615 -6.168 707 HE2 GLU 89 HE2 GLU 89 1.736 7.401 -6.851 708 H GLU 90 HN GLU 90 7.853 5.182 -9.564 709 HA GLU 90 HA GLU 90 7.141 2.597 -9.901 710 HB2 GLU 90 2HB GLU 90 8.512 4.319 -11.394 711 HB3 GLU 90 3HB GLU 90 9.906 3.490 -10.729 712 HG2 GLU 90 2HG GLU 90 9.094 1.326 -11.567 713 HG3 GLU 90 3HG GLU 90 7.583 2.044 -12.083 714 HE2 GLU 90 HE2 GLU 90 10.498 3.757 -14.129 715 H ARG 91 HN ARG 91 9.442 3.944 -7.626 716 HA ARG 91 HA ARG 91 10.612 1.337 -7.205 717 HB2 ARG 91 2HB ARG 91 11.262 4.085 -6.025 718 HB3 ARG 91 3HB ARG 91 12.120 2.619 -5.593 719 HG2 ARG 91 2HG ARG 91 12.477 2.347 -8.196 720 HG3 ARG 91 3HG ARG 91 12.061 4.047 -8.270 721 HD2 ARG 91 2HD ARG 91 14.304 2.861 -6.562 722 HD3 ARG 91 3HD ARG 91 14.532 3.696 -8.085 723 HE ARG 91 HE ARG 91 13.846 4.922 -5.494 724 HH11 ARG 91 2HH2 ARG 91 14.027 5.379 -9.003 725 HH12 ARG 91 1HH2 ARG 91 14.071 7.107 -8.900 726 HH22 ARG 91 HH1 ARG 91 13.997 8.158 -6.748 727 H ALA 92 HN ALA 92 8.684 3.913 -5.571 728 HA ALA 92 HA ALA 92 8.594 2.875 -3.028 729 HB1 ALA 92 3HB ALA 92 6.455 4.145 -2.858 730 HB2 ALA 92 1HB ALA 92 7.745 5.085 -3.647 731 HB3 ALA 92 2HB ALA 92 6.457 4.342 -4.627 732 H ASP 93 HN ASP 93 6.879 1.882 -6.001 733 HA ASP 93 HA ASP 93 5.053 0.234 -4.638 734 HB2 ASP 93 2HB ASP 93 5.081 1.234 -7.112 735 HB3 ASP 93 3HB ASP 93 5.931 -0.249 -7.496 736 HD2 ASP 93 HD2 ASP 93 3.165 0.676 -8.182 737 H LEU 94 HN LEU 94 7.921 -0.436 -6.801 738 HA LEU 94 HA LEU 94 8.091 -3.115 -6.566 739 HB2 LEU 94 2HB LEU 94 9.507 -1.542 -7.917 740 HB3 LEU 94 3HB LEU 94 10.456 -1.242 -6.476 741 HG LEU 94 HG LEU 94 11.130 -3.588 -6.381 742 HD11 LEU 94 1HD1 LEU 94 9.188 -4.697 -7.243 743 HD12 LEU 94 2HD1 LEU 94 9.382 -3.917 -8.831 744 HD13 LEU 94 3HD1 LEU 94 10.576 -5.114 -8.276 745 HD21 LEU 94 3HD2 LEU 94 12.825 -2.776 -7.574 746 HD22 LEU 94 1HD2 LEU 94 12.032 -3.482 -9.003 747 HD23 LEU 94 2HD2 LEU 94 11.747 -1.777 -8.578 748 H ILE 95 HN ILE 95 9.934 -0.847 -4.397 749 HA ILE 95 HA ILE 95 10.890 -2.619 -2.627 750 HB ILE 95 HB ILE 95 9.736 0.121 -2.107 751 HG12 ILE 95 2HG1 ILE 95 12.660 -0.503 -2.289 752 HG13 ILE 95 3HG1 ILE 95 11.732 -0.407 -3.773 753 HG21 ILE 95 1HG2 ILE 95 10.413 -1.766 -0.175 754 HG22 ILE 95 2HG2 ILE 95 11.851 -0.724 -0.303 755 HG23 ILE 95 3HG2 ILE 95 10.261 -0.007 0.050 756 HD11 ILE 95 3HD1 ILE 95 11.332 1.785 -1.747 757 HD12 ILE 95 1HD1 ILE 95 12.848 1.771 -2.678 758 HD13 ILE 95 2HD1 ILE 95 11.285 1.863 -3.525 759 H ALA 96 HN ALA 96 7.517 -1.382 -2.812 760 HA ALA 96 HA ALA 96 6.574 -2.424 -0.439 761 HB1 ALA 96 3HB ALA 96 4.817 -2.556 -2.850 762 HB2 ALA 96 1HB ALA 96 4.530 -1.799 -1.265 763 HB3 ALA 96 2HB ALA 96 5.541 -0.974 -2.475 764 H TYR 97 HN TYR 97 6.435 -3.941 -3.747 765 HA TYR 97 HA TYR 97 5.479 -6.398 -2.845 766 HB2 TYR 97 2HB TYR 97 5.375 -5.908 -5.194 767 HB3 TYR 97 3HB TYR 97 6.985 -5.219 -5.212 768 HD1 TYR 97 HD2 TYR 97 6.233 -8.528 -3.732 769 HD2 TYR 97 HD1 TYR 97 7.763 -6.438 -7.136 770 HE1 TYR 97 HE2 TYR 97 7.158 -10.705 -4.662 771 HE2 TYR 97 HE1 TYR 97 8.683 -8.623 -8.055 772 HH TYR 97 HH TYR 97 8.137 -11.677 -6.325 773 H LEU 98 HN LEU 98 8.868 -5.456 -3.789 774 HA LEU 98 HA LEU 98 10.062 -7.839 -3.147 775 HB2 LEU 98 2HB LEU 98 11.088 -5.005 -3.043 776 HB3 LEU 98 3HB LEU 98 12.115 -6.403 -2.795 777 HG LEU 98 HG LEU 98 10.759 -5.460 -5.301 778 HD11 LEU 98 1HD1 LEU 98 12.833 -4.946 -5.888 779 HD12 LEU 98 2HD1 LEU 98 13.404 -5.488 -4.291 780 HD13 LEU 98 3HD1 LEU 98 13.353 -6.632 -5.653 781 HD21 LEU 98 3HD2 LEU 98 11.642 -8.311 -4.778 782 HD22 LEU 98 1HD2 LEU 98 9.995 -7.743 -5.143 783 HD23 LEU 98 2HD2 LEU 98 11.270 -7.631 -6.381 784 H LYS 99 HN LYS 99 8.835 -5.265 -1.041 785 HA LYS 99 HA LYS 99 10.256 -6.124 1.262 786 HB2 LYS 99 2HB LYS 99 9.502 -3.844 1.082 787 HB3 LYS 99 3HB LYS 99 7.837 -4.344 0.869 788 HG2 LYS 99 2HG LYS 99 7.733 -5.236 3.141 789 HG3 LYS 99 3HG LYS 99 9.458 -5.022 3.364 790 HD2 LYS 99 2HD LYS 99 9.191 -2.550 3.155 791 HD3 LYS 99 3HD LYS 99 7.470 -2.749 2.890 792 HE2 LYS 99 2HE LYS 99 7.847 -2.174 5.242 793 HE3 LYS 99 3HE LYS 99 7.256 -3.821 5.151 794 HZ1 LYS 99 2HZ LYS 99 9.394 -4.663 5.596 795 HZ3 LYS 99 1HZ LYS 99 9.310 -3.380 6.593 796 H LYS 100 HN LYS 100 7.199 -6.998 -0.339 797 HA LYS 100 HA LYS 100 6.417 -8.615 1.939 798 HB2 LYS 100 2HB LYS 100 4.768 -7.219 0.693 799 HB3 LYS 100 3HB LYS 100 5.042 -8.200 -0.732 800 HG2 LYS 100 2HG LYS 100 4.525 -10.216 0.968 801 HG3 LYS 100 3HG LYS 100 3.699 -8.956 1.864 802 HD2 LYS 100 2HD LYS 100 2.027 -9.867 0.426 803 HD3 LYS 100 3HD LYS 100 2.489 -8.358 -0.335 804 HE2 LYS 100 2HE LYS 100 2.629 -9.746 -2.188 805 HE3 LYS 100 3HE LYS 100 4.269 -9.925 -1.596 806 HZ1 LYS 100 2HZ LYS 100 2.625 -11.783 -0.259 807 HZ3 LYS 100 1HZ LYS 100 3.860 -12.095 -1.273 808 H ALA 101 HN ALA 101 8.324 -8.840 -0.928 809 HA ALA 101 HA ALA 101 7.824 -11.641 -1.353 810 HB1 ALA 101 3HB ALA 101 9.065 -11.351 -3.269 811 HB2 ALA 101 1HB ALA 101 8.603 -9.655 -2.986 812 HB3 ALA 101 2HB ALA 101 10.210 -10.234 -2.488 813 H THR 102 HN THR 102 10.403 -9.541 0.066 814 HA THR 102 HA THR 102 11.835 -11.925 0.939 815 HB THR 102 HB THR 102 13.639 -10.366 1.354 816 HG1 THR 102 HG1 THR 102 12.836 -8.527 2.302 817 HG21 THR 102 1HG2 THR 102 12.268 -10.286 -1.167 818 HG22 THR 102 2HG2 THR 102 12.698 -8.606 -0.759 819 HG23 THR 102 3HG2 THR 102 13.966 -9.852 -0.846 820 H ASN 103 HN ASN 103 9.106 -11.203 1.990 821 HA ASN 103 HA ASN 103 9.903 -10.715 4.747 822 HB2 ASN 103 2HB ASN 103 8.240 -9.096 4.081 823 HB3 ASN 103 3HB ASN 103 7.291 -10.298 3.231 824 HD21 ASN 103 1HD2 ASN 103 8.015 -8.792 6.230 825 HD22 ASN 103 2HD2 ASN 103 6.842 -9.588 7.227 826 H GLU 104 HN GLU 104 8.352 -12.896 2.406 827 HA GLU 104 HA GLU 104 7.311 -14.591 4.472 828 HB2 GLU 104 2HB GLU 104 7.418 -15.128 1.475 829 HB3 GLU 104 3HB GLU 104 6.376 -15.906 2.650 830 HG2 GLU 104 2HG GLU 104 6.289 -12.895 2.230 831 HG3 GLU 104 3HG GLU 104 5.373 -13.977 1.201 832 HE2 GLU 104 HE2 GLU 104 3.306 -15.168 2.947 833 HHA HEC 500 HHA HEC 500 23.411 -7.252 -5.112 834 HHB HEC 500 HHB HEC 500 17.263 -5.481 -5.146 835 HHC HEC 500 HHC HEC 500 17.385 -6.181 -11.556 836 HHD HEC 500 HHD HEC 500 22.852 -9.467 -11.039 837 HMA1 HEC 500 1HMA HEC 500 18.032 -5.599 -2.957 838 HMA2 HEC 500 2HMA HEC 500 19.539 -5.608 -2.034 839 HMA3 HEC 500 3HMA HEC 500 19.136 -4.199 -3.033 840 HAA1 HEC 500 1HAA HEC 500 22.979 -5.814 -3.182 841 HAA2 HEC 500 2HAA HEC 500 21.616 -5.888 -2.184 842 HBA1 HEC 500 1HBA HEC 500 23.048 -8.263 -3.423 843 HBA2 HEC 500 2HBA HEC 500 22.966 -7.832 -1.704 844 HMB1 HEC 500 1HMB HEC 500 14.165 -5.714 -7.305 845 HMB2 HEC 500 2HMB HEC 500 15.150 -5.713 -5.859 846 HMB3 HEC 500 3HMB HEC 500 14.955 -4.199 -6.770 847 HAB HEC 500 HAB HEC 500 15.710 -4.936 -10.988 848 HBB1 HEC 500 1HBB HEC 500 15.064 -3.115 -9.642 849 HBB2 HEC 500 2HBB HEC 500 13.660 -3.870 -10.442 850 HBB3 HEC 500 3HBB HEC 500 13.924 -4.107 -8.727 851 HMC1 HEC 500 1HMC HEC 500 17.842 -8.729 -13.564 852 HMC2 HEC 500 2HMC HEC 500 17.823 -6.959 -13.543 853 HMC3 HEC 500 3HMC HEC 500 19.057 -7.797 -14.462 854 HAC HEC 500 HAC HEC 500 21.847 -10.244 -12.714 855 HBC1 HEC 500 1HBC HEC 500 22.040 -9.939 -15.054 856 HBC2 HEC 500 2HBC HEC 500 20.647 -8.834 -15.085 857 HBC3 HEC 500 3HBC HEC 500 22.148 -8.317 -14.321 858 HMD1 HEC 500 1HMD HEC 500 24.764 -10.911 -9.282 859 HMD2 HEC 500 2HMD HEC 500 25.087 -9.552 -10.373 860 HMD3 HEC 500 3HMD HEC 500 25.984 -9.733 -8.839 861 HAD1 HEC 500 1HAD HEC 500 25.219 -8.103 -5.513 862 HAD2 HEC 500 2HAD HEC 500 25.664 -9.528 -6.351 863 HBD1 HEC 500 1HBD HEC 500 27.073 -8.373 -7.815 864 HBD2 HEC 500 2HBD HEC 500 26.015 -6.945 -7.825 Start of MODEL 19 1 H1 GLY 1 HN GLY 1 0.395 0.084 -1.071 2 HA2 GLY 1 1HA GLY 1 1.785 1.019 -3.164 3 HA3 GLY 1 2HA GLY 1 3.067 0.363 -2.166 4 H ASP 2 HN ASP 2 0.782 -0.355 -4.576 5 HA ASP 2 HA ASP 2 0.047 -2.932 -3.890 6 HB2 ASP 2 2HB ASP 2 0.405 -1.510 -6.559 7 HB3 ASP 2 3HB ASP 2 -0.167 -3.165 -6.479 8 HD2 ASP 2 HD2 ASP 2 -2.187 -0.529 -4.416 9 H VAL 3 HN VAL 3 1.142 -4.929 -4.133 10 HA VAL 3 HA VAL 3 3.947 -4.787 -4.701 11 HB VAL 3 HB VAL 3 4.067 -6.871 -3.758 12 HG11 VAL 3 1HG1 VAL 3 2.650 -5.031 -2.398 13 HG12 VAL 3 2HG1 VAL 3 1.445 -6.341 -2.449 14 HG13 VAL 3 3HG1 VAL 3 3.050 -6.634 -1.735 15 HG21 VAL 3 3HG2 VAL 3 2.082 -8.455 -3.652 16 HG22 VAL 3 1HG2 VAL 3 1.262 -7.358 -4.790 17 HG23 VAL 3 2HG2 VAL 3 2.772 -8.170 -5.268 18 H GLU 4 HN GLU 4 0.970 -6.096 -6.247 19 HA GLU 4 HA GLU 4 2.026 -7.588 -8.199 20 HB2 GLU 4 2HB GLU 4 -0.329 -5.667 -8.270 21 HB3 GLU 4 3HB GLU 4 0.035 -6.729 -9.616 22 HG2 GLU 4 2HG GLU 4 -0.219 -7.834 -6.796 23 HG3 GLU 4 3HG GLU 4 -1.644 -7.558 -7.778 24 HE2 GLU 4 HE2 GLU 4 -0.197 -9.847 -10.264 25 H LYS 5 HN LYS 5 1.675 -3.986 -8.199 26 HA LYS 5 HA LYS 5 2.600 -3.554 -10.776 27 HB2 LYS 5 2HB LYS 5 2.362 -1.932 -8.277 28 HB3 LYS 5 3HB LYS 5 3.349 -1.290 -9.574 29 HG2 LYS 5 2HG LYS 5 1.130 -0.463 -9.975 30 HG3 LYS 5 3HG LYS 5 1.388 -1.726 -11.162 31 HD2 LYS 5 2HD LYS 5 0.047 -3.307 -9.939 32 HD3 LYS 5 3HD LYS 5 0.075 -2.329 -8.485 33 HE2 LYS 5 2HE LYS 5 -1.261 -0.559 -9.649 34 HE3 LYS 5 3HE LYS 5 -1.286 -1.534 -11.104 35 HZ1 LYS 5 2HZ LYS 5 -2.179 -3.024 -8.829 36 HZ3 LYS 5 1HZ LYS 5 -2.936 -2.787 -10.251 37 H GLY 6 HN GLY 6 4.317 -4.213 -7.714 38 HA2 GLY 6 1HA GLY 6 6.907 -3.667 -8.921 39 HA3 GLY 6 2HA GLY 6 6.573 -4.161 -7.273 40 H LYS 7 HN LYS 7 4.641 -6.289 -8.716 41 HA LYS 7 HA LYS 7 6.598 -8.371 -8.604 42 HB2 LYS 7 2HB LYS 7 4.130 -8.405 -7.819 43 HB3 LYS 7 3HB LYS 7 3.734 -8.674 -9.504 44 HG2 LYS 7 2HG LYS 7 4.736 -10.786 -9.559 45 HG3 LYS 7 3HG LYS 7 5.908 -10.385 -8.319 46 HD2 LYS 7 2HD LYS 7 4.166 -12.008 -7.520 47 HD3 LYS 7 3HD LYS 7 4.216 -10.542 -6.562 48 HE2 LYS 7 2HE LYS 7 1.887 -10.970 -6.985 49 HE3 LYS 7 3HE LYS 7 2.322 -9.625 -8.021 50 HZ1 LYS 7 2HZ LYS 7 1.281 -12.072 -8.829 51 HZ3 LYS 7 1HZ LYS 7 2.810 -12.055 -9.388 52 H LYS 8 HN LYS 8 4.705 -6.652 -11.135 53 HA LYS 8 HA LYS 8 5.876 -8.314 -13.186 54 HB2 LYS 8 2HB LYS 8 3.932 -5.991 -13.264 55 HB3 LYS 8 3HB LYS 8 4.515 -6.819 -14.693 56 HG2 LYS 8 2HG LYS 8 3.060 -8.163 -12.365 57 HG3 LYS 8 3HG LYS 8 2.318 -7.722 -13.890 58 HD2 LYS 8 2HD LYS 8 4.502 -9.793 -13.421 59 HD3 LYS 8 3HD LYS 8 2.885 -10.069 -14.038 60 HE2 LYS 8 2HE LYS 8 4.032 -10.058 -16.055 61 HE3 LYS 8 3HE LYS 8 3.684 -8.344 -15.942 62 HZ1 LYS 8 2HZ LYS 8 5.884 -7.977 -15.899 63 HZ3 LYS 8 1HZ LYS 8 6.208 -9.573 -15.958 64 H ILE 9 HN ILE 9 6.685 -5.497 -11.375 65 HA ILE 9 HA ILE 9 8.341 -4.436 -13.522 66 HB ILE 9 HB ILE 9 7.529 -3.432 -10.803 67 HG12 ILE 9 2HG1 ILE 9 7.137 -2.208 -13.546 68 HG13 ILE 9 3HG1 ILE 9 5.963 -3.262 -12.783 69 HG21 ILE 9 1HG2 ILE 9 8.926 -1.525 -11.051 70 HG22 ILE 9 2HG2 ILE 9 9.957 -2.958 -11.279 71 HG23 ILE 9 3HG2 ILE 9 9.421 -2.014 -12.689 72 HD11 ILE 9 3HD1 ILE 9 6.562 -0.436 -12.238 73 HD12 ILE 9 1HD1 ILE 9 5.128 -1.394 -11.796 74 HD13 ILE 9 2HD1 ILE 9 6.573 -1.424 -10.757 75 H PHE 10 HN PHE 10 8.459 -6.454 -10.652 76 HA PHE 10 HA PHE 10 11.224 -6.076 -10.141 77 HB2 PHE 10 2HB PHE 10 9.880 -6.921 -8.342 78 HB3 PHE 10 3HB PHE 10 8.965 -7.975 -9.402 79 HD1 PHE 10 HD2 PHE 10 12.507 -7.556 -8.277 80 HD2 PHE 10 HD1 PHE 10 9.344 -10.232 -9.190 81 HE1 PHE 10 HE2 PHE 10 13.952 -9.493 -7.597 82 HE2 PHE 10 HE1 PHE 10 10.788 -12.170 -8.510 83 HZ PHE 10 HZ PHE 10 13.073 -11.777 -7.722 84 H ILE 11 HN ILE 11 9.384 -7.883 -12.497 85 HA ILE 11 HA ILE 11 11.459 -9.845 -12.900 86 HB ILE 11 HB ILE 11 8.833 -9.260 -14.257 87 HG12 ILE 11 2HG1 ILE 11 9.630 -11.728 -12.713 88 HG13 ILE 11 3HG1 ILE 11 8.984 -10.313 -11.907 89 HG21 ILE 11 1HG2 ILE 11 10.671 -11.583 -14.871 90 HG22 ILE 11 2HG2 ILE 11 9.143 -11.147 -15.673 91 HG23 ILE 11 3HG2 ILE 11 10.575 -10.107 -15.861 92 HD11 ILE 11 3HD1 ILE 11 7.611 -12.293 -13.642 93 HD12 ILE 11 1HD1 ILE 11 6.953 -11.264 -12.347 94 HD13 ILE 11 2HD1 ILE 11 7.183 -10.598 -13.982 95 H MET 12 HN MET 12 9.848 -7.469 -15.132 96 HA MET 12 HA MET 12 11.727 -7.522 -17.058 97 HB2 MET 12 2HB MET 12 9.422 -6.163 -16.673 98 HB3 MET 12 3HB MET 12 10.513 -4.858 -16.253 99 HG2 MET 12 2HG MET 12 11.719 -5.654 -18.551 100 HG3 MET 12 3HG MET 12 10.094 -6.204 -18.912 101 HE1 MET 12 3HE MET 12 11.765 -2.052 -18.843 102 HE2 MET 12 1HE MET 12 12.542 -3.599 -18.428 103 HE3 MET 12 2HE MET 12 12.026 -3.283 -20.102 104 H LYS 13 HN LYS 13 11.963 -6.069 -13.859 105 HA LYS 13 HA LYS 13 14.358 -4.602 -14.656 106 HB2 LYS 13 2HB LYS 13 12.861 -4.542 -12.022 107 HB3 LYS 13 3HB LYS 13 14.159 -3.475 -12.517 108 HG2 LYS 13 2HG LYS 13 11.707 -3.698 -14.277 109 HG3 LYS 13 3HG LYS 13 11.607 -2.747 -12.808 110 HD2 LYS 13 2HD LYS 13 12.326 -1.113 -14.311 111 HD3 LYS 13 3HD LYS 13 13.869 -1.660 -13.684 112 HE2 LYS 13 2HE LYS 13 14.424 -2.816 -15.644 113 HE3 LYS 13 3HE LYS 13 12.752 -3.121 -16.071 114 HZ1 LYS 13 2HZ LYS 13 14.305 -1.114 -17.093 115 HZ3 LYS 13 1HZ LYS 13 13.346 -0.318 -16.046 116 H CYS 14 HN CYS 14 13.168 -7.339 -12.691 117 HA CYS 14 HA CYS 14 15.961 -8.130 -12.378 118 HB2 CYS 14 2HB CYS 14 14.110 -8.764 -10.140 119 HB3 CYS 14 3HB CYS 14 15.844 -8.514 -10.136 120 H SER 15 HN SER 15 15.456 -9.493 -14.272 121 HA SER 15 HA SER 15 13.617 -11.652 -13.588 122 HB2 SER 15 2HB SER 15 12.719 -10.699 -15.536 123 HB3 SER 15 3HB SER 15 14.291 -10.290 -16.193 124 HG SER 15 HG SER 15 13.998 -12.065 -17.368 125 H GLN 16 HN GLN 16 14.373 -13.803 -13.729 126 HA GLN 16 HA GLN 16 15.945 -15.309 -13.409 127 HB2 GLN 16 2HB GLN 16 16.469 -14.277 -16.212 128 HB3 GLN 16 3HB GLN 16 17.388 -15.626 -15.574 129 HG2 GLN 16 2HG GLN 16 15.573 -16.697 -16.638 130 HG3 GLN 16 3HG GLN 16 15.071 -16.671 -14.959 131 HE21 GLN 16 1HE2 GLN 16 13.185 -15.835 -14.461 132 HE22 GLN 16 2HE2 GLN 16 12.194 -14.829 -15.465 133 H CYS 17 HN CYS 17 16.675 -12.889 -12.100 134 HA CYS 17 HA CYS 17 19.579 -13.106 -12.326 135 HB2 CYS 17 2HB CYS 17 17.916 -10.661 -12.583 136 HB3 CYS 17 3HB CYS 17 19.343 -10.525 -11.576 137 H HIS 18 HN HIS 18 16.712 -11.897 -10.448 138 HA HIS 18 HA HIS 18 18.154 -12.690 -8.023 139 HB2 HIS 18 2HB HIS 18 16.233 -10.420 -8.542 140 HB3 HIS 18 3HB HIS 18 16.528 -11.017 -6.921 141 HD1 HIS 18 HD1 HIS 18 19.359 -11.178 -6.431 142 HD2 HIS 18 HD2 HIS 18 17.879 -8.340 -9.141 143 HE1 HIS 18 HE1 HIS 18 21.161 -9.384 -6.641 144 H THR 19 HN THR 19 16.664 -13.432 -6.208 145 HA THR 19 HA THR 19 14.250 -14.713 -7.289 146 HB THR 19 HB THR 19 14.942 -16.757 -5.952 147 HG1 THR 19 HG1 THR 19 17.439 -15.214 -5.901 148 HG21 THR 19 1HG2 THR 19 16.072 -17.579 -7.767 149 HG22 THR 19 2HG2 THR 19 15.972 -15.941 -8.458 150 HG23 THR 19 3HG2 THR 19 17.408 -16.428 -7.524 151 H VAL 20 HN VAL 20 12.661 -15.321 -5.627 152 HA VAL 20 HA VAL 20 12.997 -13.757 -3.172 153 HB VAL 20 HB VAL 20 10.855 -12.796 -3.371 154 HG11 VAL 20 1HG1 VAL 20 11.650 -12.448 -6.223 155 HG12 VAL 20 2HG1 VAL 20 11.295 -11.233 -4.972 156 HG13 VAL 20 3HG1 VAL 20 12.870 -12.063 -4.986 157 HG21 VAL 20 3HG2 VAL 20 10.432 -14.535 -5.825 158 HG22 VAL 20 1HG2 VAL 20 9.613 -14.690 -4.252 159 HG23 VAL 20 2HG2 VAL 20 9.324 -13.258 -5.269 160 H GLU 21 HN GLU 21 11.106 -16.256 -4.985 161 HA GLU 21 HA GLU 21 10.002 -17.324 -2.635 162 HB2 GLU 21 2HB GLU 21 9.461 -19.290 -4.216 163 HB3 GLU 21 3HB GLU 21 8.786 -17.727 -4.629 164 HG2 GLU 21 2HG GLU 21 10.247 -17.408 -6.438 165 HG3 GLU 21 3HG GLU 21 11.497 -18.427 -5.751 166 HE2 GLU 21 HE2 GLU 21 11.186 -19.920 -8.055 167 H LYS 22 HN LYS 22 10.502 -19.359 -1.571 168 HA LYS 22 HA LYS 22 13.194 -19.749 -1.090 169 HB2 LYS 22 2HB LYS 22 11.511 -20.389 0.506 170 HB3 LYS 22 3HB LYS 22 10.793 -21.531 -0.613 171 HG2 LYS 22 2HG LYS 22 12.518 -23.091 -0.364 172 HG3 LYS 22 3HG LYS 22 13.719 -21.871 0.010 173 HD2 LYS 22 2HD LYS 22 12.396 -21.480 2.217 174 HD3 LYS 22 3HD LYS 22 11.554 -22.971 1.846 175 HE2 LYS 22 2HE LYS 22 13.384 -23.618 3.252 176 HE3 LYS 22 3HE LYS 22 13.858 -24.096 1.634 177 HZ1 LYS 22 2HZ LYS 22 14.834 -21.602 1.733 178 HZ3 LYS 22 1HZ LYS 22 15.708 -22.908 2.162 179 H GLY 23 HN GLY 23 10.924 -21.630 -3.200 180 HA2 GLY 23 1HA GLY 23 12.650 -23.588 -4.068 181 HA3 GLY 23 2HA GLY 23 11.328 -22.916 -5.000 182 H GLY 24 HN GLY 24 12.430 -20.138 -5.030 183 HA2 GLY 24 1HA GLY 24 14.101 -20.428 -7.340 184 HA3 GLY 24 2HA GLY 24 13.567 -18.941 -6.581 185 H LYS 25 HN LYS 25 16.094 -21.408 -6.733 186 HA LYS 25 HA LYS 25 17.556 -20.520 -4.484 187 HB2 LYS 25 2HB LYS 25 19.107 -22.118 -5.082 188 HB3 LYS 25 3HB LYS 25 17.643 -22.766 -5.792 189 HG2 LYS 25 2HG LYS 25 19.634 -21.029 -7.325 190 HG3 LYS 25 3HG LYS 25 19.676 -22.780 -7.330 191 HD2 LYS 25 2HD LYS 25 17.303 -21.083 -8.237 192 HD3 LYS 25 3HD LYS 25 18.455 -21.855 -9.310 193 HE2 LYS 25 2HE LYS 25 17.803 -24.085 -8.127 194 HE3 LYS 25 3HE LYS 25 16.449 -23.199 -7.453 195 HZ1 LYS 25 2HZ LYS 25 16.998 -23.360 -10.367 196 HZ3 LYS 25 1HZ LYS 25 15.673 -22.713 -9.676 197 H HIS 26 HN HIS 26 19.831 -19.567 -4.694 198 HA HIS 26 HA HIS 26 19.574 -17.083 -5.995 199 HB2 HIS 26 2HB HIS 26 22.034 -18.352 -4.761 200 HB3 HIS 26 3HB HIS 26 21.820 -16.654 -5.136 201 HD1 HIS 26 HD1 HIS 26 22.265 -16.216 -2.537 202 HD2 HIS 26 HD2 HIS 26 18.731 -18.284 -3.446 203 HE1 HIS 26 HE1 HIS 26 20.822 -16.126 -0.434 204 H LYS 27 HN LYS 27 20.274 -16.385 -7.982 205 HA LYS 27 HA LYS 27 21.831 -18.333 -9.537 206 HB2 LYS 27 2HB LYS 27 19.392 -16.739 -10.244 207 HB3 LYS 27 3HB LYS 27 20.571 -17.074 -11.496 208 HG2 LYS 27 2HG LYS 27 20.437 -19.563 -10.547 209 HG3 LYS 27 3HG LYS 27 18.901 -19.026 -9.897 210 HD2 LYS 27 2HD LYS 27 19.739 -18.926 -12.833 211 HD3 LYS 27 3HD LYS 27 18.587 -20.044 -12.130 212 HE2 LYS 27 2HE LYS 27 18.252 -17.006 -12.174 213 HE3 LYS 27 3HE LYS 27 17.478 -18.111 -13.292 214 HZ1 LYS 27 2HZ LYS 27 16.199 -19.041 -11.545 215 HZ3 LYS 27 1HZ LYS 27 16.140 -17.439 -11.255 216 H THR 28 HN THR 28 20.963 -15.187 -10.836 217 HA THR 28 HA THR 28 23.707 -14.496 -11.114 218 HB THR 28 HB THR 28 21.350 -12.608 -11.475 219 HG1 THR 28 HG1 THR 28 21.131 -13.859 -13.553 220 HG21 THR 28 1HG2 THR 28 23.776 -13.300 -13.215 221 HG22 THR 28 2HG2 THR 28 22.578 -12.025 -13.542 222 HG23 THR 28 3HG2 THR 28 23.676 -11.878 -12.149 223 H GLY 29 HN GLY 29 21.144 -13.713 -8.770 224 HA2 GLY 29 1HA GLY 29 23.193 -12.316 -7.179 225 HA3 GLY 29 2HA GLY 29 21.652 -11.544 -7.491 226 HA PRO 30 HA PRO 30 21.283 -14.305 -3.824 227 HB2 PRO 30 2HB PRO 30 21.108 -12.434 -1.840 228 HB3 PRO 30 3HB PRO 30 22.599 -13.259 -2.252 229 HG2 PRO 30 2HG PRO 30 21.787 -10.484 -2.866 230 HG3 PRO 30 3HG PRO 30 23.391 -11.187 -2.884 231 HD2 PRO 30 2HD PRO 30 21.754 -10.590 -5.162 232 HD3 PRO 30 3HD PRO 30 23.308 -11.400 -5.171 233 H ASN 31 HN ASN 31 19.397 -14.956 -2.748 234 HA ASN 31 HA ASN 31 17.120 -14.084 -4.054 235 HB2 ASN 31 2HB ASN 31 17.584 -16.286 -2.702 236 HB3 ASN 31 3HB ASN 31 17.131 -15.364 -1.282 237 HD21 ASN 31 1HD2 ASN 31 16.060 -17.286 -3.777 238 HD22 ASN 31 2HD2 ASN 31 14.357 -16.973 -3.717 239 H LEU 32 HN LEU 32 15.999 -12.157 -3.729 240 HA LEU 32 HA LEU 32 16.673 -10.268 -1.873 241 HB2 LEU 32 2HB LEU 32 14.317 -10.801 -3.606 242 HB3 LEU 32 3HB LEU 32 14.123 -9.614 -2.332 243 HG LEU 32 HG LEU 32 14.855 -8.865 -4.712 244 HD11 LEU 32 1HD1 LEU 32 15.303 -6.900 -3.755 245 HD12 LEU 32 2HD1 LEU 32 15.044 -7.739 -2.206 246 HD13 LEU 32 3HD1 LEU 32 16.692 -7.549 -2.852 247 HD21 LEU 32 3HD2 LEU 32 16.754 -10.571 -4.726 248 HD22 LEU 32 1HD2 LEU 32 17.140 -8.917 -5.260 249 HD23 LEU 32 2HD2 LEU 32 17.610 -9.458 -3.631 250 H HIS 33 HN HIS 33 14.749 -13.192 -1.486 251 HA HIS 33 HA HIS 33 13.107 -12.663 0.554 252 HB2 HIS 33 2HB HIS 33 13.193 -14.843 -0.362 253 HB3 HIS 33 3HB HIS 33 14.885 -15.048 0.042 254 HD1 HIS 33 HD1 HIS 33 11.750 -16.246 1.100 255 HD2 HIS 33 HD2 HIS 33 15.095 -14.768 3.158 256 HE1 HIS 33 HE1 HIS 33 11.568 -17.126 3.488 257 H GLY 34 HN GLY 34 16.683 -12.958 0.707 258 HA2 GLY 34 1HA GLY 34 16.592 -12.357 3.587 259 HA3 GLY 34 2HA GLY 34 17.953 -13.003 2.692 260 H LEU 35 HN LEU 35 15.758 -10.174 2.054 261 HA LEU 35 HA LEU 35 18.123 -8.572 1.540 262 HB2 LEU 35 2HB LEU 35 16.282 -8.594 -0.067 263 HB3 LEU 35 3HB LEU 35 15.179 -8.007 1.161 264 HG LEU 35 HG LEU 35 16.794 -5.976 1.335 265 HD11 LEU 35 1HD1 LEU 35 18.580 -5.957 0.022 266 HD12 LEU 35 2HD1 LEU 35 18.081 -7.491 -0.733 267 HD13 LEU 35 3HD1 LEU 35 17.512 -5.943 -1.403 268 HD21 LEU 35 3HD2 LEU 35 14.918 -5.117 0.507 269 HD22 LEU 35 1HD2 LEU 35 15.631 -5.330 -1.109 270 HD23 LEU 35 2HD2 LEU 35 14.569 -6.588 -0.431 271 H PHE 36 HN PHE 36 14.995 -7.822 3.219 272 HA PHE 36 HA PHE 36 16.172 -5.898 4.859 273 HB2 PHE 36 2HB PHE 36 13.646 -7.634 4.915 274 HB3 PHE 36 3HB PHE 36 13.936 -6.461 6.184 275 HD1 PHE 36 HD1 PHE 36 13.470 -6.810 2.525 276 HD2 PHE 36 HD2 PHE 36 13.444 -4.180 5.856 277 HE1 PHE 36 HE1 PHE 36 12.447 -5.015 1.100 278 HE2 PHE 36 HE2 PHE 36 12.421 -2.385 4.430 279 HZ PHE 36 HZ PHE 36 11.934 -2.824 2.070 280 H GLY 37 HN GLY 37 17.643 -6.201 6.459 281 HA2 GLY 37 1HA GLY 37 18.203 -6.964 8.584 282 HA3 GLY 37 2HA GLY 37 17.175 -8.367 8.372 283 H ARG 38 HN ARG 38 19.647 -7.082 6.069 284 HA ARG 38 HA ARG 38 21.390 -9.248 6.780 285 HB2 ARG 38 2HB ARG 38 19.725 -10.031 4.938 286 HB3 ARG 38 3HB ARG 38 20.543 -8.912 3.867 287 HG2 ARG 38 2HG ARG 38 22.596 -10.107 3.967 288 HG3 ARG 38 3HG ARG 38 22.165 -10.919 5.460 289 HD2 ARG 38 2HD ARG 38 20.947 -11.428 2.704 290 HD3 ARG 38 3HD ARG 38 22.003 -12.510 3.591 291 HE ARG 38 HE ARG 38 19.143 -12.102 4.048 292 HH11 ARG 38 2HH2 ARG 38 22.171 -13.155 5.556 293 HH12 ARG 38 1HH2 ARG 38 21.381 -14.119 6.758 294 HH22 ARG 38 HH1 ARG 38 18.987 -14.235 6.784 295 H LYS 39 HN LYS 39 23.432 -8.359 6.870 296 HA LYS 39 HA LYS 39 23.920 -5.756 5.948 297 HB2 LYS 39 2HB LYS 39 25.490 -7.944 7.228 298 HB3 LYS 39 3HB LYS 39 26.397 -6.689 6.407 299 HG2 LYS 39 2HG LYS 39 25.592 -4.980 7.825 300 HG3 LYS 39 3HG LYS 39 24.156 -5.880 8.271 301 HD2 LYS 39 2HD LYS 39 26.844 -7.030 9.025 302 HD3 LYS 39 3HD LYS 39 26.248 -5.660 9.941 303 HE2 LYS 39 2HE LYS 39 24.154 -6.884 10.469 304 HE3 LYS 39 3HE LYS 39 24.668 -8.236 9.479 305 HZ1 LYS 39 2HZ LYS 39 26.008 -8.972 11.127 306 HZ3 LYS 39 1HZ LYS 39 25.212 -7.962 12.127 307 H THR 40 HN THR 40 26.304 -5.636 4.644 308 HA THR 40 HA THR 40 25.537 -6.572 2.010 309 HB THR 40 HB THR 40 27.693 -5.141 1.504 310 HG1 THR 40 HG1 THR 40 28.433 -5.196 3.739 311 HG21 THR 40 1HG2 THR 40 25.466 -4.146 1.129 312 HG22 THR 40 2HG2 THR 40 25.247 -3.914 2.880 313 HG23 THR 40 3HG2 THR 40 26.478 -2.973 2.004 314 H GLY 41 HN GLY 41 26.204 -8.397 1.085 315 HA2 GLY 41 1HA GLY 41 27.556 -10.119 0.534 316 HA3 GLY 41 2HA GLY 41 28.876 -9.345 1.388 317 H GLN 42 HN GLN 42 25.635 -10.739 2.303 318 HA GLN 42 HA GLN 42 27.044 -12.094 4.467 319 HB2 GLN 42 2HB GLN 42 24.075 -11.420 4.303 320 HB3 GLN 42 3HB GLN 42 24.912 -12.095 5.687 321 HG2 GLN 42 2HG GLN 42 25.476 -9.359 4.448 322 HG3 GLN 42 3HG GLN 42 24.569 -9.634 5.922 323 HE21 GLN 42 1HE2 GLN 42 27.586 -9.098 4.549 324 HE22 GLN 42 2HE2 GLN 42 28.605 -9.419 5.913 325 H ALA 43 HN ALA 43 24.737 -12.404 1.751 326 HA ALA 43 HA ALA 43 23.660 -14.831 2.059 327 HB1 ALA 43 3HB ALA 43 23.372 -13.341 0.102 328 HB2 ALA 43 1HB ALA 43 25.002 -13.779 -0.465 329 HB3 ALA 43 2HB ALA 43 23.721 -15.013 -0.394 330 HA PRO 44 HA PRO 44 27.365 -17.191 2.633 331 HB2 PRO 44 2HB PRO 44 26.226 -19.193 4.105 332 HB3 PRO 44 3HB PRO 44 26.897 -17.739 4.819 333 HG2 PRO 44 2HG PRO 44 24.061 -18.472 4.426 334 HG3 PRO 44 3HG PRO 44 24.744 -17.262 5.493 335 HD2 PRO 44 2HD PRO 44 23.425 -16.794 2.989 336 HD3 PRO 44 3HD PRO 44 24.209 -15.597 4.000 337 H GLY 45 HN GLY 45 24.710 -17.570 0.779 338 HA2 GLY 45 1HA GLY 45 25.535 -20.238 -0.157 339 HA3 GLY 45 2HA GLY 45 23.994 -19.457 -0.452 340 H TYR 46 HN TYR 46 25.936 -16.875 -0.804 341 HA TYR 46 HA TYR 46 27.098 -17.500 -3.369 342 HB2 TYR 46 2HB TYR 46 24.542 -16.998 -3.612 343 HB3 TYR 46 3HB TYR 46 24.882 -15.395 -2.991 344 HD1 TYR 46 HD1 TYR 46 26.814 -17.461 -5.449 345 HD2 TYR 46 HD2 TYR 46 24.494 -13.931 -4.771 346 HE1 TYR 46 HE1 TYR 46 27.339 -16.656 -7.803 347 HE2 TYR 46 HE2 TYR 46 25.025 -13.137 -7.127 348 HH TYR 46 HH TYR 46 26.042 -15.037 -9.480 349 H SER 47 HN SER 47 28.786 -16.113 -3.865 350 HA SER 47 HA SER 47 29.164 -13.976 -1.922 351 HB2 SER 47 2HB SER 47 31.303 -15.304 -3.636 352 HB3 SER 47 3HB SER 47 31.561 -14.219 -2.286 353 HG SER 47 HG SER 47 30.318 -16.833 -2.118 354 H TYR 48 HN TYR 48 29.800 -11.869 -2.674 355 HA TYR 48 HA TYR 48 29.229 -11.463 -5.520 356 HB2 TYR 48 2HB TYR 48 29.538 -9.352 -3.331 357 HB3 TYR 48 3HB TYR 48 28.523 -9.270 -4.758 358 HD1 TYR 48 HD2 TYR 48 27.413 -12.211 -4.246 359 HD2 TYR 48 HD1 TYR 48 27.696 -8.660 -1.876 360 HE1 TYR 48 HE2 TYR 48 25.416 -12.965 -2.865 361 HE2 TYR 48 HE1 TYR 48 25.697 -9.426 -0.503 362 HH TYR 48 HH TYR 48 23.841 -10.844 -0.669 363 H THR 49 HN THR 49 30.393 -9.066 -6.054 364 HA THR 49 HA THR 49 33.112 -9.782 -6.381 365 HB THR 49 HB THR 49 33.204 -7.523 -7.453 366 HG1 THR 49 HG1 THR 49 31.064 -6.347 -7.248 367 HG21 THR 49 1HG2 THR 49 31.947 -9.455 -8.637 368 HG22 THR 49 2HG2 THR 49 30.450 -8.726 -8.008 369 HG23 THR 49 3HG2 THR 49 31.482 -7.809 -9.132 370 H ALA 50 HN ALA 50 34.799 -7.840 -5.884 371 HA ALA 50 HA ALA 50 34.830 -7.784 -2.983 372 HB1 ALA 50 3HB ALA 50 36.864 -8.539 -3.906 373 HB2 ALA 50 1HB ALA 50 36.842 -7.311 -5.194 374 HB3 ALA 50 2HB ALA 50 37.190 -6.833 -3.516 375 H ALA 51 HN ALA 51 33.174 -6.022 -5.071 376 HA ALA 51 HA ALA 51 34.109 -3.409 -4.167 377 HB1 ALA 51 3HB ALA 51 33.675 -3.779 -6.580 378 HB2 ALA 51 1HB ALA 51 31.987 -4.201 -6.203 379 HB3 ALA 51 2HB ALA 51 32.582 -2.553 -5.893 380 H ASN 52 HN ASN 52 31.224 -5.586 -4.157 381 HA ASN 52 HA ASN 52 29.821 -3.750 -2.482 382 HB2 ASN 52 2HB ASN 52 28.753 -5.295 -4.246 383 HB3 ASN 52 3HB ASN 52 29.091 -6.640 -3.176 384 HD21 ASN 52 1HD2 ASN 52 28.293 -6.446 -0.925 385 HD22 ASN 52 2HD2 ASN 52 26.736 -5.738 -0.651 386 H LYS 53 HN LYS 53 31.315 -7.055 -2.303 387 HA LYS 53 HA LYS 53 30.637 -7.805 0.208 388 HB2 LYS 53 2HB LYS 53 32.049 -8.984 -1.607 389 HB3 LYS 53 3HB LYS 53 33.429 -8.200 -0.866 390 HG2 LYS 53 2HG LYS 53 32.379 -9.170 1.393 391 HG3 LYS 53 3HG LYS 53 31.580 -10.287 0.304 392 HD2 LYS 53 2HD LYS 53 34.005 -10.606 -0.724 393 HD3 LYS 53 3HD LYS 53 34.550 -9.929 0.798 394 HE2 LYS 53 2HE LYS 53 33.061 -12.519 0.303 395 HE3 LYS 53 3HE LYS 53 34.522 -12.254 1.235 396 HZ1 LYS 53 2HZ LYS 53 33.217 -11.158 2.938 397 HZ3 LYS 53 1HZ LYS 53 32.517 -12.597 2.633 398 H ASN 54 HN ASN 54 32.761 -5.166 -0.780 399 HA ASN 54 HA ASN 54 34.104 -4.940 1.663 400 HB2 ASN 54 2HB ASN 54 34.518 -3.845 -0.754 401 HB3 ASN 54 3HB ASN 54 33.539 -2.542 -0.110 402 HD21 ASN 54 1HD2 ASN 54 36.598 -3.910 -0.306 403 HD22 ASN 54 2HD2 ASN 54 37.431 -2.976 0.891 404 H LYS 55 HN LYS 55 31.221 -3.322 0.157 405 HA LYS 55 HA LYS 55 30.650 -1.422 1.990 406 HB2 LYS 55 2HB LYS 55 29.448 -2.198 -0.208 407 HB3 LYS 55 3HB LYS 55 28.440 -3.132 0.878 408 HG2 LYS 55 2HG LYS 55 27.434 -0.912 0.470 409 HG3 LYS 55 3HG LYS 55 27.873 -1.078 2.158 410 HD2 LYS 55 2HD LYS 55 29.696 0.403 1.981 411 HD3 LYS 55 3HD LYS 55 29.900 0.119 0.264 412 HE2 LYS 55 2HE LYS 55 27.348 1.420 1.261 413 HE3 LYS 55 3HE LYS 55 28.805 2.384 1.119 414 HZ1 LYS 55 2HZ LYS 55 28.907 1.382 -1.250 415 HZ3 LYS 55 1HZ LYS 55 27.819 2.562 -0.977 416 H GLY 56 HN GLY 56 29.369 -1.283 3.924 417 HA2 GLY 56 1HA GLY 56 28.843 -3.836 5.282 418 HA3 GLY 56 2HA GLY 56 29.908 -2.670 6.043 419 H ILE 57 HN ILE 57 26.589 -3.106 4.689 420 HA ILE 57 HA ILE 57 25.535 -1.557 6.866 421 HB ILE 57 HB ILE 57 24.336 0.031 5.427 422 HG12 ILE 57 2HG1 ILE 57 25.540 0.330 3.088 423 HG13 ILE 57 3HG1 ILE 57 25.858 -1.383 3.267 424 HG21 ILE 57 1HG2 ILE 57 26.545 0.517 6.581 425 HG22 ILE 57 2HG2 ILE 57 27.314 0.301 4.990 426 HG23 ILE 57 3HG2 ILE 57 26.103 1.584 5.226 427 HD11 ILE 57 3HD1 ILE 57 23.667 -0.734 2.071 428 HD12 ILE 57 1HD1 ILE 57 23.526 -1.926 3.385 429 HD13 ILE 57 2HD1 ILE 57 23.071 -0.229 3.670 430 H ILE 58 HN ILE 58 22.994 -1.461 6.551 431 HA ILE 58 HA ILE 58 22.259 -4.173 5.807 432 HB ILE 58 HB ILE 58 20.810 -2.025 7.357 433 HG12 ILE 58 2HG1 ILE 58 22.921 -3.259 8.295 434 HG13 ILE 58 3HG1 ILE 58 21.504 -3.031 9.300 435 HG21 ILE 58 1HG2 ILE 58 19.997 -4.839 6.612 436 HG22 ILE 58 2HG2 ILE 58 19.284 -3.951 7.980 437 HG23 ILE 58 3HG2 ILE 58 19.122 -3.316 6.326 438 HD11 ILE 58 3HD1 ILE 58 22.443 -5.377 9.370 439 HD12 ILE 58 1HD1 ILE 58 20.736 -5.305 8.872 440 HD13 ILE 58 2HD1 ILE 58 22.010 -5.549 7.653 441 H TRP 59 HN TRP 59 20.052 -4.441 4.703 442 HA TRP 59 HA TRP 59 19.936 -2.480 2.521 443 HB2 TRP 59 2HB TRP 59 19.321 -5.423 2.661 444 HB3 TRP 59 3HB TRP 59 18.696 -4.413 1.373 445 HD1 TRP 59 HD1 TRP 59 21.420 -6.686 1.774 446 HE1 TRP 59 HE1 TRP 59 23.533 -6.214 0.267 447 HE3 TRP 59 HE3 TRP 59 20.178 -1.893 0.620 448 HZ2 TRP 59 HZ2 TRP 59 24.428 -3.941 -1.207 449 HZ3 TRP 59 HZ3 TRP 59 21.726 -0.617 -0.859 450 HH2 TRP 59 HH2 TRP 59 23.788 -1.565 -1.764 451 H GLY 60 HN GLY 60 18.629 -0.993 3.813 452 HA2 GLY 60 1HA GLY 60 16.025 -1.996 4.703 453 HA3 GLY 60 2HA GLY 60 16.746 -0.438 5.061 454 H GLU 61 HN GLU 61 14.683 0.554 4.410 455 HA GLU 61 HA GLU 61 13.998 0.277 1.636 456 HB2 GLU 61 2HB GLU 61 12.732 2.093 3.729 457 HB3 GLU 61 3HB GLU 61 12.035 1.618 2.194 458 HG2 GLU 61 2HG GLU 61 10.984 0.075 3.577 459 HG3 GLU 61 3HG GLU 61 12.405 -0.854 3.142 460 HE2 GLU 61 HE2 GLU 61 13.955 -0.425 6.229 461 H ASP 62 HN ASP 62 15.120 2.844 3.934 462 HA ASP 62 HA ASP 62 15.180 4.872 2.061 463 HB2 ASP 62 2HB ASP 62 16.522 4.327 4.705 464 HB3 ASP 62 3HB ASP 62 17.141 5.656 3.747 465 HD2 ASP 62 HD2 ASP 62 14.662 7.116 3.083 466 H THR 63 HN THR 63 17.508 2.306 3.020 467 HA THR 63 HA THR 63 19.759 3.350 1.683 468 HB THR 63 HB THR 63 20.580 0.986 2.016 469 HG1 THR 63 HG1 THR 63 18.876 -0.427 1.954 470 HG21 THR 63 1HG2 THR 63 19.332 0.985 4.564 471 HG22 THR 63 2HG2 THR 63 20.927 1.670 4.172 472 HG23 THR 63 3HG2 THR 63 19.479 2.704 4.126 473 H LEU 64 HN LEU 64 17.622 0.582 0.699 474 HA LEU 64 HA LEU 64 18.672 0.396 -1.853 475 HB2 LEU 64 2HB LEU 64 15.889 -0.289 -0.898 476 HB3 LEU 64 3HB LEU 64 16.639 -0.865 -2.372 477 HG LEU 64 HG LEU 64 17.746 -1.429 0.389 478 HD11 LEU 64 1HD1 LEU 64 16.783 -3.756 -0.041 479 HD12 LEU 64 2HD1 LEU 64 15.643 -2.473 0.430 480 HD13 LEU 64 3HD1 LEU 64 15.759 -2.979 -1.273 481 HD21 LEU 64 3HD2 LEU 64 18.349 -2.594 -2.341 482 HD22 LEU 64 1HD2 LEU 64 19.429 -1.621 -1.314 483 HD23 LEU 64 2HD2 LEU 64 18.949 -3.256 -0.801 484 H MET 65 HN MET 65 16.150 2.529 -0.486 485 HA MET 65 HA MET 65 14.996 3.392 -2.791 486 HB2 MET 65 2HB MET 65 15.542 4.550 -0.057 487 HB3 MET 65 3HB MET 65 15.000 5.680 -1.281 488 HG2 MET 65 2HG MET 65 13.480 3.090 -1.043 489 HG3 MET 65 3HG MET 65 13.268 4.260 0.244 490 HE1 MET 65 3HE MET 65 12.807 3.188 -3.224 491 HE2 MET 65 1HE MET 65 11.159 3.225 -2.551 492 HE3 MET 65 2HE MET 65 11.590 4.291 -3.909 493 H GLU 66 HN GLU 66 18.272 3.852 -1.713 494 HA GLU 66 HA GLU 66 18.578 6.071 -3.572 495 HB2 GLU 66 2HB GLU 66 19.408 6.591 -1.352 496 HB3 GLU 66 3HB GLU 66 20.312 5.092 -1.268 497 HG2 GLU 66 2HG GLU 66 21.861 5.818 -2.988 498 HG3 GLU 66 3HG GLU 66 20.855 7.188 -3.414 499 HE2 GLU 66 HE2 GLU 66 23.523 6.895 -0.723 500 H TYR 67 HN TYR 67 19.983 2.883 -2.582 501 HA TYR 67 HA TYR 67 21.961 2.698 -4.486 502 HB2 TYR 67 2HB TYR 67 21.427 1.164 -2.515 503 HB3 TYR 67 3HB TYR 67 19.997 0.603 -3.360 504 HD1 TYR 67 HD2 TYR 67 23.162 1.218 -5.151 505 HD2 TYR 67 HD1 TYR 67 20.674 -1.728 -3.300 506 HE1 TYR 67 HE2 TYR 67 24.527 -0.629 -6.242 507 HE2 TYR 67 HE1 TYR 67 22.046 -3.565 -4.397 508 HH TYR 67 HH TYR 67 23.729 -4.045 -5.653 509 H LEU 68 HN LEU 68 18.623 1.256 -4.700 510 HA LEU 68 HA LEU 68 18.904 0.502 -7.370 511 HB2 LEU 68 2HB LEU 68 16.551 0.957 -5.553 512 HB3 LEU 68 3HB LEU 68 16.329 0.514 -7.234 513 HG LEU 68 HG LEU 68 18.179 -1.189 -5.638 514 HD11 LEU 68 1HD1 LEU 68 15.356 -1.971 -5.338 515 HD12 LEU 68 2HD1 LEU 68 16.710 -2.064 -4.187 516 HD13 LEU 68 3HD1 LEU 68 15.836 -0.529 -4.411 517 HD21 LEU 68 3HD2 LEU 68 17.320 -2.947 -7.008 518 HD22 LEU 68 1HD2 LEU 68 15.980 -1.926 -7.583 519 HD23 LEU 68 2HD2 LEU 68 17.653 -1.549 -8.060 520 H GLU 69 HN GLU 69 18.332 3.605 -5.848 521 HA GLU 69 HA GLU 69 17.094 4.757 -8.118 522 HB2 GLU 69 2HB GLU 69 16.730 5.622 -5.825 523 HB3 GLU 69 3HB GLU 69 18.426 6.040 -5.693 524 HG2 GLU 69 2HG GLU 69 17.273 8.070 -6.291 525 HG3 GLU 69 3HG GLU 69 18.137 7.554 -7.725 526 HE2 GLU 69 HE2 GLU 69 16.206 7.587 -9.678 527 H ASN 70 HN ASN 70 20.416 4.328 -6.908 528 HA ASN 70 HA ASN 70 21.393 5.077 -9.469 529 HB2 ASN 70 2HB ASN 70 22.569 6.603 -7.109 530 HB3 ASN 70 3HB ASN 70 22.771 6.937 -8.818 531 HD21 ASN 70 1HD2 ASN 70 20.765 7.263 -6.022 532 HD22 ASN 70 2HD2 ASN 70 19.584 8.353 -6.668 533 HA PRO 71 HA PRO 71 23.723 1.970 -7.045 534 HB2 PRO 71 2HB PRO 71 23.558 -0.099 -8.824 535 HB3 PRO 71 3HB PRO 71 22.436 0.114 -7.495 536 HG2 PRO 71 2HG PRO 71 22.019 0.636 -10.375 537 HG3 PRO 71 3HG PRO 71 20.821 0.431 -9.112 538 HD2 PRO 71 2HD PRO 71 21.651 2.903 -10.308 539 HD3 PRO 71 3HD PRO 71 20.541 2.708 -8.966 540 H LYS 72 HN LYS 72 24.124 3.757 -9.738 541 HA LYS 72 HA LYS 72 26.608 2.512 -10.531 542 HB2 LYS 72 2HB LYS 72 24.821 4.655 -11.576 543 HB3 LYS 72 3HB LYS 72 26.526 4.791 -11.960 544 HG2 LYS 72 2HG LYS 72 26.449 2.350 -12.738 545 HG3 LYS 72 3HG LYS 72 24.709 2.408 -12.539 546 HD2 LYS 72 2HD LYS 72 25.212 2.886 -14.871 547 HD3 LYS 72 3HD LYS 72 24.621 4.362 -14.134 548 HE2 LYS 72 2HE LYS 72 27.600 3.855 -14.114 549 HE3 LYS 72 3HE LYS 72 26.854 4.345 -15.622 550 HZ1 LYS 72 2HZ LYS 72 25.773 6.130 -13.972 551 HZ3 LYS 72 1HZ LYS 72 27.198 6.398 -14.714 552 H LYS 73 HN LYS 73 25.472 4.784 -8.188 553 HA LYS 73 HA LYS 73 28.169 5.916 -7.962 554 HB2 LYS 73 2HB LYS 73 27.043 7.704 -6.624 555 HB3 LYS 73 3HB LYS 73 26.571 7.648 -8.310 556 HG2 LYS 73 2HG LYS 73 24.488 6.476 -7.757 557 HG3 LYS 73 3HG LYS 73 24.983 6.287 -6.087 558 HD2 LYS 73 2HD LYS 73 23.445 8.154 -6.162 559 HD3 LYS 73 3HD LYS 73 25.041 8.817 -5.874 560 HE2 LYS 73 2HE LYS 73 24.003 8.554 -8.714 561 HE3 LYS 73 3HE LYS 73 23.498 9.908 -7.721 562 HZ1 LYS 73 2HZ LYS 73 26.075 10.097 -7.310 563 HZ3 LYS 73 1HZ LYS 73 25.425 10.729 -8.662 564 H TYR 74 HN TYR 74 25.434 4.385 -6.177 565 HA TYR 74 HA TYR 74 26.539 4.372 -3.659 566 HB2 TYR 74 2HB TYR 74 24.265 3.501 -4.872 567 HB3 TYR 74 3HB TYR 74 25.111 1.966 -4.880 568 HD1 TYR 74 HD1 TYR 74 26.245 1.396 -2.464 569 HD2 TYR 74 HD2 TYR 74 22.817 3.875 -3.105 570 HE1 TYR 74 HE1 TYR 74 25.481 0.970 -0.076 571 HE2 TYR 74 HE2 TYR 74 22.065 3.440 -0.716 572 HH TYR 74 HH TYR 74 24.078 2.179 1.605 573 H ILE 75 HN ILE 75 26.848 1.853 -6.261 574 HA ILE 75 HA ILE 75 29.373 1.077 -5.015 575 HB ILE 75 HB ILE 75 27.401 -0.995 -5.936 576 HG12 ILE 75 2HG1 ILE 75 27.703 0.070 -3.112 577 HG13 ILE 75 3HG1 ILE 75 26.317 0.324 -4.155 578 HG21 ILE 75 1HG2 ILE 75 29.830 -1.550 -5.754 579 HG22 ILE 75 2HG2 ILE 75 29.733 -1.185 -4.014 580 HG23 ILE 75 3HG2 ILE 75 28.773 -2.519 -4.700 581 HD11 ILE 75 3HD1 ILE 75 25.641 -1.532 -2.876 582 HD12 ILE 75 1HD1 ILE 75 26.281 -2.309 -4.344 583 HD13 ILE 75 2HD1 ILE 75 27.273 -2.243 -2.867 584 HA PRO 76 HA PRO 76 29.897 1.669 -9.405 585 HB2 PRO 76 2HB PRO 76 32.346 2.874 -9.268 586 HB3 PRO 76 3HB PRO 76 30.839 3.766 -9.268 587 HG2 PRO 76 2HG PRO 76 32.664 3.213 -7.010 588 HG3 PRO 76 3HG PRO 76 31.408 4.429 -7.133 589 HD2 PRO 76 2HD PRO 76 31.268 1.958 -5.683 590 HD3 PRO 76 3HD PRO 76 29.974 3.118 -5.903 591 H GLY 77 HN GLY 77 30.470 0.085 -10.752 592 HA2 GLY 77 1HA GLY 77 32.246 -1.267 -11.581 593 HA3 GLY 77 2HA GLY 77 32.874 -1.427 -9.953 594 H THR 78 HN THR 78 29.881 -1.671 -9.013 595 HA THR 78 HA THR 78 29.793 -4.364 -8.620 596 HB THR 78 HB THR 78 28.346 -2.828 -7.411 597 HG1 THR 78 HG1 THR 78 26.270 -3.944 -7.974 598 HG21 THR 78 1HG2 THR 78 26.577 -2.399 -9.817 599 HG22 THR 78 2HG2 THR 78 26.801 -1.365 -8.386 600 HG23 THR 78 3HG2 THR 78 28.028 -1.379 -9.675 601 H LYS 79 HN LYS 79 28.130 -5.970 -9.472 602 HA LYS 79 HA LYS 79 28.499 -6.047 -12.347 603 HB2 LYS 79 2HB LYS 79 27.293 -8.183 -10.578 604 HB3 LYS 79 3HB LYS 79 27.974 -8.366 -12.181 605 HG2 LYS 79 2HG LYS 79 30.159 -7.339 -11.005 606 HG3 LYS 79 3HG LYS 79 29.395 -7.950 -9.551 607 HD2 LYS 79 2HD LYS 79 29.841 -9.662 -12.037 608 HD3 LYS 79 3HD LYS 79 30.997 -9.570 -10.723 609 HE2 LYS 79 2HE LYS 79 29.776 -11.404 -9.993 610 HE3 LYS 79 3HE LYS 79 28.836 -10.136 -9.229 611 HZ1 LYS 79 2HZ LYS 79 27.413 -11.666 -10.480 612 HZ3 LYS 79 1HZ LYS 79 28.201 -11.347 -11.868 613 H MET 80 HN MET 80 26.152 -5.050 -10.030 614 HA MET 80 HA MET 80 23.796 -5.810 -11.120 615 HB2 MET 80 2HB MET 80 24.808 -3.393 -9.617 616 HB3 MET 80 3HB MET 80 23.209 -3.256 -10.322 617 HG2 MET 80 2HG MET 80 23.870 -5.743 -8.734 618 HG3 MET 80 3HG MET 80 23.549 -4.258 -7.862 619 HE1 MET 80 3HE MET 80 20.088 -3.208 -8.794 620 HE2 MET 80 1HE MET 80 20.767 -3.724 -7.232 621 HE3 MET 80 2HE MET 80 21.746 -2.743 -8.349 622 H ILE 81 HN ILE 81 23.561 -5.879 -13.363 623 HA ILE 81 HA ILE 81 24.392 -3.659 -14.965 624 HB ILE 81 HB ILE 81 22.842 -6.171 -15.608 625 HG12 ILE 81 2HG1 ILE 81 24.989 -6.836 -14.926 626 HG13 ILE 81 3HG1 ILE 81 25.058 -6.805 -16.676 627 HG21 ILE 81 1HG2 ILE 81 24.212 -4.933 -17.840 628 HG22 ILE 81 2HG2 ILE 81 22.514 -5.446 -17.682 629 HG23 ILE 81 3HG2 ILE 81 23.012 -3.829 -17.128 630 HD11 ILE 81 3HD1 ILE 81 26.169 -4.740 -14.736 631 HD12 ILE 81 1HD1 ILE 81 27.058 -5.716 -15.930 632 HD13 ILE 81 2HD1 ILE 81 25.981 -4.407 -16.475 633 H PHE 82 HN PHE 82 22.943 -2.330 -13.256 634 HA PHE 82 HA PHE 82 20.235 -2.186 -14.364 635 HB2 PHE 82 2HB PHE 82 21.059 -2.468 -11.781 636 HB3 PHE 82 3HB PHE 82 21.245 -0.729 -11.890 637 HD1 PHE 82 HD1 PHE 82 18.624 -2.984 -13.298 638 HD2 PHE 82 HD2 PHE 82 19.530 0.214 -10.660 639 HE1 PHE 82 HE1 PHE 82 16.179 -2.691 -12.813 640 HE2 PHE 82 HE2 PHE 82 17.084 0.507 -10.176 641 HZ PHE 82 HZ PHE 82 15.438 -0.949 -11.258 642 H VAL 83 HN VAL 83 19.309 -0.062 -14.814 643 HA VAL 83 HA VAL 83 21.391 1.812 -15.650 644 HB VAL 83 HB VAL 83 19.487 2.778 -16.992 645 HG11 VAL 83 1HG1 VAL 83 20.408 -0.071 -17.466 646 HG12 VAL 83 2HG1 VAL 83 19.525 0.895 -18.672 647 HG13 VAL 83 3HG1 VAL 83 21.123 1.431 -18.101 648 HG21 VAL 83 3HG2 VAL 83 17.716 1.667 -15.521 649 HG22 VAL 83 1HG2 VAL 83 17.460 1.595 -17.280 650 HG23 VAL 83 2HG2 VAL 83 18.071 0.168 -16.411 651 H GLY 84 HN GLY 84 18.653 1.333 -13.458 652 HA2 GLY 84 1HA GLY 84 18.640 2.640 -11.451 653 HA3 GLY 84 2HA GLY 84 19.153 4.036 -12.377 654 H ILE 85 HN ILE 85 16.571 2.941 -10.748 655 HA ILE 85 HA ILE 85 14.542 3.435 -12.740 656 HB ILE 85 HB ILE 85 14.363 2.851 -9.782 657 HG12 ILE 85 2HG1 ILE 85 13.913 0.991 -12.133 658 HG13 ILE 85 3HG1 ILE 85 15.398 1.058 -11.204 659 HG21 ILE 85 1HG2 ILE 85 12.086 2.795 -9.923 660 HG22 ILE 85 2HG2 ILE 85 12.426 4.082 -11.104 661 HG23 ILE 85 3HG2 ILE 85 12.084 2.427 -11.665 662 HD11 ILE 85 3HD1 ILE 85 14.431 0.118 -9.304 663 HD12 ILE 85 1HD1 ILE 85 12.814 0.759 -9.684 664 HD13 ILE 85 2HD1 ILE 85 13.442 -0.653 -10.567 665 H LYS 86 HN LYS 86 15.039 5.612 -13.366 666 HA LYS 86 HA LYS 86 15.515 7.738 -11.784 667 HB2 LYS 86 2HB LYS 86 13.812 7.573 -14.284 668 HB3 LYS 86 3HB LYS 86 14.329 9.082 -13.560 669 HG2 LYS 86 2HG LYS 86 16.341 6.907 -14.247 670 HG3 LYS 86 3HG LYS 86 15.802 8.050 -15.460 671 HD2 LYS 86 2HD LYS 86 16.717 9.919 -14.290 672 HD3 LYS 86 3HD LYS 86 16.821 9.042 -12.777 673 HE2 LYS 86 2HE LYS 86 19.052 9.357 -13.941 674 HE3 LYS 86 3HE LYS 86 18.667 7.686 -13.579 675 HZ1 LYS 86 2HZ LYS 86 19.403 7.798 -15.840 676 HZ3 LYS 86 1HZ LYS 86 18.390 9.016 -16.218 677 H LYS 87 HN LYS 87 12.218 6.502 -12.680 678 HA LYS 87 HA LYS 87 10.866 8.328 -11.044 679 HB2 LYS 87 2HB LYS 87 10.152 5.730 -12.386 680 HB3 LYS 87 3HB LYS 87 9.024 6.483 -11.276 681 HG2 LYS 87 2HG LYS 87 10.305 8.108 -13.501 682 HG3 LYS 87 3HG LYS 87 8.904 7.108 -13.828 683 HD2 LYS 87 2HD LYS 87 9.051 9.316 -11.721 684 HD3 LYS 87 3HD LYS 87 8.250 9.447 -13.273 685 HE2 LYS 87 2HE LYS 87 6.994 7.219 -12.393 686 HE3 LYS 87 3HE LYS 87 7.421 7.888 -10.830 687 HZ1 LYS 87 2HZ LYS 87 5.451 8.979 -11.225 688 HZ3 LYS 87 1HZ LYS 87 5.609 8.994 -12.845 689 H LYS 88 HN LYS 88 10.217 8.281 -8.906 690 HA LYS 88 HA LYS 88 11.604 6.329 -7.274 691 HB2 LYS 88 2HB LYS 88 10.753 7.828 -5.409 692 HB3 LYS 88 3HB LYS 88 11.905 8.536 -6.522 693 HG2 LYS 88 2HG LYS 88 9.020 8.828 -7.274 694 HG3 LYS 88 3HG LYS 88 9.531 9.718 -5.853 695 HD2 LYS 88 2HD LYS 88 11.250 9.854 -8.338 696 HD3 LYS 88 3HD LYS 88 9.762 10.780 -8.297 697 HE2 LYS 88 2HE LYS 88 10.479 12.101 -6.448 698 HE3 LYS 88 3HE LYS 88 11.701 10.941 -5.968 699 HZ1 LYS 88 2HZ LYS 88 12.065 12.000 -8.639 700 HZ3 LYS 88 1HZ LYS 88 13.167 11.797 -7.457 701 H GLU 89 HN GLU 89 8.407 7.045 -8.549 702 HA GLU 89 HA GLU 89 6.881 5.817 -6.616 703 HB2 GLU 89 2HB GLU 89 6.161 7.223 -8.666 704 HB3 GLU 89 3HB GLU 89 6.268 5.741 -9.594 705 HG2 GLU 89 2HG GLU 89 3.950 6.131 -8.781 706 HG3 GLU 89 3HG GLU 89 4.612 4.646 -8.126 707 HE2 GLU 89 HE2 GLU 89 4.950 5.542 -5.010 708 H GLU 90 HN GLU 90 7.905 4.416 -9.821 709 HA GLU 90 HA GLU 90 7.093 1.866 -9.247 710 HB2 GLU 90 2HB GLU 90 9.198 2.998 -11.110 711 HB3 GLU 90 3HB GLU 90 8.942 1.268 -11.012 712 HG2 GLU 90 2HG GLU 90 7.592 2.385 -12.830 713 HG3 GLU 90 3HG GLU 90 6.616 1.484 -11.688 714 HE2 GLU 90 HE2 GLU 90 5.549 3.792 -9.837 715 H ARG 91 HN ARG 91 9.786 3.682 -7.993 716 HA ARG 91 HA ARG 91 11.397 1.431 -7.430 717 HB2 ARG 91 2HB ARG 91 11.504 4.360 -7.041 718 HB3 ARG 91 3HB ARG 91 12.180 3.494 -5.677 719 HG2 ARG 91 2HG ARG 91 13.229 2.115 -7.884 720 HG3 ARG 91 3HG ARG 91 13.233 3.783 -8.422 721 HD2 ARG 91 2HD ARG 91 15.340 2.987 -7.164 722 HD3 ARG 91 3HD ARG 91 14.635 4.494 -6.613 723 HE ARG 91 HE ARG 91 14.201 3.475 -4.563 724 HH11 ARG 91 2HH2 ARG 91 14.464 0.936 -7.022 725 HH12 ARG 91 1HH2 ARG 91 14.303 -0.358 -5.881 726 HH22 ARG 91 HH1 ARG 91 14.025 0.155 -3.556 727 H ALA 92 HN ALA 92 8.922 3.389 -5.725 728 HA ALA 92 HA ALA 92 9.400 2.240 -3.174 729 HB1 ALA 92 3HB ALA 92 8.237 4.128 -2.762 730 HB2 ALA 92 1HB ALA 92 7.628 4.205 -4.433 731 HB3 ALA 92 2HB ALA 92 6.782 3.211 -3.223 732 H ASP 93 HN ASP 93 6.535 1.934 -5.398 733 HA ASP 93 HA ASP 93 5.255 -0.043 -4.232 734 HB2 ASP 93 2HB ASP 93 5.858 -0.077 -7.223 735 HB3 ASP 93 3HB ASP 93 4.432 -0.730 -6.441 736 HD2 ASP 93 HD2 ASP 93 3.496 2.776 -5.722 737 H LEU 94 HN LEU 94 8.065 -0.414 -6.512 738 HA LEU 94 HA LEU 94 8.226 -3.103 -6.713 739 HB2 LEU 94 2HB LEU 94 9.647 -1.568 -7.911 740 HB3 LEU 94 3HB LEU 94 10.449 -1.080 -6.431 741 HG LEU 94 HG LEU 94 11.600 -2.759 -8.055 742 HD11 LEU 94 1HD1 LEU 94 12.936 -3.572 -6.302 743 HD12 LEU 94 2HD1 LEU 94 12.303 -2.015 -5.717 744 HD13 LEU 94 3HD1 LEU 94 11.589 -3.540 -5.139 745 HD21 LEU 94 3HD2 LEU 94 11.157 -5.100 -7.645 746 HD22 LEU 94 1HD2 LEU 94 9.880 -4.690 -6.474 747 HD23 LEU 94 2HD2 LEU 94 9.668 -4.297 -8.198 748 H ILE 95 HN ILE 95 9.597 -1.069 -4.040 749 HA ILE 95 HA ILE 95 10.580 -3.267 -2.597 750 HB ILE 95 HB ILE 95 9.804 -0.510 -1.639 751 HG12 ILE 95 2HG1 ILE 95 12.598 -1.342 -2.364 752 HG13 ILE 95 3HG1 ILE 95 11.494 -0.835 -3.626 753 HG21 ILE 95 1HG2 ILE 95 10.184 -2.406 0.066 754 HG22 ILE 95 2HG2 ILE 95 11.894 -2.294 -0.411 755 HG23 ILE 95 3HG2 ILE 95 11.070 -0.877 0.279 756 HD11 ILE 95 3HD1 ILE 95 12.953 0.807 -1.755 757 HD12 ILE 95 1HD1 ILE 95 11.907 1.324 -3.098 758 HD13 ILE 95 2HD1 ILE 95 11.210 1.048 -1.483 759 H ALA 96 HN ALA 96 7.396 -1.695 -2.832 760 HA ALA 96 HA ALA 96 6.233 -2.603 -0.513 761 HB1 ALA 96 3HB ALA 96 4.708 -2.624 -3.108 762 HB2 ALA 96 1HB ALA 96 4.237 -1.974 -1.519 763 HB3 ALA 96 2HB ALA 96 5.407 -1.093 -2.530 764 H TYR 97 HN TYR 97 7.081 -4.333 -3.511 765 HA TYR 97 HA TYR 97 5.668 -6.705 -2.573 766 HB2 TYR 97 2HB TYR 97 5.475 -6.057 -4.952 767 HB3 TYR 97 3HB TYR 97 7.203 -5.791 -5.075 768 HD1 TYR 97 HD2 TYR 97 5.438 -8.727 -3.577 769 HD2 TYR 97 HD1 TYR 97 7.851 -7.262 -6.791 770 HE1 TYR 97 HE2 TYR 97 5.747 -11.100 -4.437 771 HE2 TYR 97 HE1 TYR 97 8.151 -9.639 -7.640 772 HH TYR 97 HH TYR 97 7.958 -11.789 -7.071 773 H LEU 98 HN LEU 98 8.987 -5.509 -3.353 774 HA LEU 98 HA LEU 98 10.239 -7.976 -2.823 775 HB2 LEU 98 2HB LEU 98 11.184 -5.129 -3.039 776 HB3 LEU 98 3HB LEU 98 12.280 -6.426 -2.603 777 HG LEU 98 HG LEU 98 10.733 -6.121 -5.187 778 HD11 LEU 98 1HD1 LEU 98 13.700 -6.448 -5.013 779 HD12 LEU 98 2HD1 LEU 98 12.708 -5.584 -6.212 780 HD13 LEU 98 3HD1 LEU 98 12.982 -4.872 -4.605 781 HD21 LEU 98 3HD2 LEU 98 10.682 -8.352 -5.288 782 HD22 LEU 98 1HD2 LEU 98 12.437 -8.249 -5.567 783 HD23 LEU 98 2HD2 LEU 98 11.813 -8.534 -3.925 784 H LYS 99 HN LYS 99 8.662 -5.708 -0.796 785 HA LYS 99 HA LYS 99 10.312 -6.451 1.499 786 HB2 LYS 99 2HB LYS 99 9.871 -4.060 1.146 787 HB3 LYS 99 3HB LYS 99 8.144 -4.350 1.198 788 HG2 LYS 99 2HG LYS 99 8.263 -5.101 3.522 789 HG3 LYS 99 3HG LYS 99 10.015 -5.096 3.490 790 HD2 LYS 99 2HD LYS 99 9.863 -2.569 2.957 791 HD3 LYS 99 3HD LYS 99 8.158 -2.683 3.347 792 HE2 LYS 99 2HE LYS 99 10.377 -3.562 5.254 793 HE3 LYS 99 3HE LYS 99 9.659 -1.963 5.283 794 HZ1 LYS 99 2HZ LYS 99 7.893 -2.784 6.382 795 HZ3 LYS 99 1HZ LYS 99 8.662 -4.211 6.530 796 H LYS 100 HN LYS 100 7.352 -7.203 -0.171 797 HA LYS 100 HA LYS 100 6.278 -8.473 2.235 798 HB2 LYS 100 2HB LYS 100 4.917 -6.862 0.746 799 HB3 LYS 100 3HB LYS 100 4.860 -8.174 -0.413 800 HG2 LYS 100 2HG LYS 100 3.945 -9.672 1.438 801 HG3 LYS 100 3HG LYS 100 3.858 -8.259 2.470 802 HD2 LYS 100 2HD LYS 100 2.394 -7.145 0.708 803 HD3 LYS 100 3HD LYS 100 2.388 -8.657 -0.177 804 HE2 LYS 100 2HE LYS 100 0.369 -8.371 1.305 805 HE3 LYS 100 3HE LYS 100 1.282 -9.823 1.660 806 HZ1 LYS 100 2HZ LYS 100 1.168 -8.976 3.759 807 HZ3 LYS 100 1HZ LYS 100 0.982 -7.430 3.284 808 H ALA 101 HN ALA 101 8.151 -9.074 -0.583 809 HA ALA 101 HA ALA 101 7.273 -11.834 -0.800 810 HB1 ALA 101 3HB ALA 101 7.696 -10.612 -2.858 811 HB2 ALA 101 1HB ALA 101 9.324 -10.156 -2.300 812 HB3 ALA 101 2HB ALA 101 8.953 -11.858 -2.666 813 H THR 102 HN THR 102 9.797 -9.827 0.657 814 HA THR 102 HA THR 102 11.280 -12.261 1.380 815 HB THR 102 HB THR 102 13.186 -10.783 1.626 816 HG1 THR 102 HG1 THR 102 12.773 -8.634 2.099 817 HG21 THR 102 1HG2 THR 102 12.686 -11.078 -0.777 818 HG22 THR 102 2HG2 THR 102 11.461 -9.790 -0.703 819 HG23 THR 102 3HG2 THR 102 13.183 -9.393 -0.489 820 H ASN 103 HN ASN 103 8.658 -11.265 2.548 821 HA ASN 103 HA ASN 103 9.662 -10.776 5.238 822 HB2 ASN 103 2HB ASN 103 8.091 -9.044 4.392 823 HB3 ASN 103 3HB ASN 103 6.902 -10.273 4.005 824 HD21 ASN 103 1HD2 ASN 103 5.302 -10.302 5.368 825 HD22 ASN 103 2HD2 ASN 103 5.369 -10.074 7.083 826 H GLU 104 HN GLU 104 8.168 -13.029 3.057 827 HA GLU 104 HA GLU 104 6.795 -14.457 5.139 828 HB2 GLU 104 2HB GLU 104 7.180 -15.246 2.221 829 HB3 GLU 104 3HB GLU 104 6.011 -15.918 3.340 830 HG2 GLU 104 2HG GLU 104 6.060 -12.950 2.644 831 HG3 GLU 104 3HG GLU 104 5.153 -14.112 1.695 832 HE2 GLU 104 HE2 GLU 104 3.892 -15.576 4.219 833 HHA HEC 500 HHA HEC 500 23.971 -6.962 -5.362 834 HHB HEC 500 HHB HEC 500 17.863 -5.066 -5.181 835 HHC HEC 500 HHC HEC 500 17.691 -5.947 -11.567 836 HHD HEC 500 HHD HEC 500 23.110 -9.329 -11.192 837 HMA1 HEC 500 1HMA HEC 500 18.725 -5.137 -3.025 838 HMA2 HEC 500 2HMA HEC 500 20.271 -5.152 -2.169 839 HMA3 HEC 500 3HMA HEC 500 19.850 -3.764 -3.189 840 HAA1 HEC 500 1HAA HEC 500 23.707 -5.604 -3.518 841 HAA2 HEC 500 2HAA HEC 500 22.415 -5.348 -2.459 842 HBA1 HEC 500 1HBA HEC 500 23.917 -7.552 -2.292 843 HBA2 HEC 500 2HBA HEC 500 22.189 -7.596 -1.891 844 HMB1 HEC 500 1HMB HEC 500 14.669 -5.296 -7.197 845 HMB2 HEC 500 2HMB HEC 500 15.717 -5.274 -5.795 846 HMB3 HEC 500 3HMB HEC 500 15.512 -3.782 -6.740 847 HAB HEC 500 HAB HEC 500 16.066 -4.652 -10.963 848 HBB1 HEC 500 1HBB HEC 500 14.054 -3.456 -10.343 849 HBB2 HEC 500 2HBB HEC 500 14.437 -3.822 -8.641 850 HBB3 HEC 500 3HBB HEC 500 15.494 -2.782 -9.574 851 HMC1 HEC 500 1HMC HEC 500 18.010 -8.560 -13.518 852 HMC2 HEC 500 2HMC HEC 500 18.025 -6.790 -13.549 853 HMC3 HEC 500 3HMC HEC 500 19.202 -7.679 -14.495 854 HAC HEC 500 HAC HEC 500 22.018 -10.133 -12.800 855 HBC1 HEC 500 1HBC HEC 500 22.105 -9.899 -15.157 856 HBC2 HEC 500 2HBC HEC 500 20.744 -8.755 -15.152 857 HBC3 HEC 500 3HBC HEC 500 22.294 -8.265 -14.473 858 HMD1 HEC 500 1HMD HEC 500 25.069 -10.763 -9.480 859 HMD2 HEC 500 2HMD HEC 500 25.370 -9.442 -10.622 860 HMD3 HEC 500 3HMD HEC 500 26.331 -9.599 -9.123 861 HAD1 HEC 500 1HAD HEC 500 25.745 -7.851 -5.821 862 HAD2 HEC 500 2HAD HEC 500 26.116 -9.318 -6.621 863 HBD1 HEC 500 1HBD HEC 500 27.490 -8.257 -8.187 864 HBD2 HEC 500 2HBD HEC 500 26.469 -6.802 -8.208 Start of MODEL 20 1 H1 GLY 1 HN GLY 1 -0.286 0.352 -1.765 2 HA2 GLY 1 1HA GLY 1 1.868 0.995 -3.161 3 HA3 GLY 1 2HA GLY 1 2.631 0.305 -1.743 4 H ASP 2 HN ASP 2 0.817 -0.335 -4.681 5 HA ASP 2 HA ASP 2 0.121 -2.977 -4.061 6 HB2 ASP 2 2HB ASP 2 0.396 -1.373 -6.624 7 HB3 ASP 2 3HB ASP 2 0.057 -3.091 -6.701 8 HD2 ASP 2 HD2 ASP 2 -1.329 -1.130 -4.209 9 H VAL 3 HN VAL 3 1.362 -4.879 -4.306 10 HA VAL 3 HA VAL 3 4.158 -4.543 -4.820 11 HB VAL 3 HB VAL 3 4.393 -6.652 -3.946 12 HG11 VAL 3 1HG1 VAL 3 3.350 -6.528 -1.929 13 HG12 VAL 3 2HG1 VAL 3 2.855 -4.936 -2.552 14 HG13 VAL 3 3HG1 VAL 3 1.735 -6.317 -2.650 15 HG21 VAL 3 3HG2 VAL 3 3.174 -7.960 -5.527 16 HG22 VAL 3 1HG2 VAL 3 2.522 -8.358 -3.919 17 HG23 VAL 3 2HG2 VAL 3 1.620 -7.270 -5.002 18 H GLU 4 HN GLU 4 1.309 -6.016 -6.464 19 HA GLU 4 HA GLU 4 2.528 -7.354 -8.443 20 HB2 GLU 4 2HB GLU 4 -0.005 -5.677 -8.454 21 HB3 GLU 4 3HB GLU 4 0.476 -6.604 -9.861 22 HG2 GLU 4 2HG GLU 4 0.411 -7.982 -7.169 23 HG3 GLU 4 3HG GLU 4 -1.105 -7.674 -7.992 24 HE2 GLU 4 HE2 GLU 4 -0.566 -10.080 -10.405 25 H LYS 5 HN LYS 5 1.954 -3.799 -8.241 26 HA LYS 5 HA LYS 5 2.806 -3.180 -10.819 27 HB2 LYS 5 2HB LYS 5 2.502 -1.680 -8.241 28 HB3 LYS 5 3HB LYS 5 3.354 -0.913 -9.566 29 HG2 LYS 5 2HG LYS 5 0.862 -0.447 -9.529 30 HG3 LYS 5 3HG LYS 5 1.443 -1.114 -11.041 31 HD2 LYS 5 2HD LYS 5 0.610 -3.329 -10.494 32 HD3 LYS 5 3HD LYS 5 0.299 -2.873 -8.831 33 HE2 LYS 5 2HE LYS 5 -1.849 -2.748 -9.805 34 HE3 LYS 5 3HE LYS 5 -1.325 -1.076 -9.829 35 HZ1 LYS 5 2HZ LYS 5 -1.123 -2.953 -12.126 36 HZ3 LYS 5 1HZ LYS 5 -0.611 -1.406 -12.151 37 H GLY 6 HN GLY 6 4.571 -3.852 -7.789 38 HA2 GLY 6 1HA GLY 6 7.111 -3.104 -9.023 39 HA3 GLY 6 2HA GLY 6 6.829 -3.565 -7.356 40 H LYS 7 HN LYS 7 5.024 -5.805 -8.957 41 HA LYS 7 HA LYS 7 7.062 -7.800 -8.660 42 HB2 LYS 7 2HB LYS 7 4.560 -7.956 -8.037 43 HB3 LYS 7 3HB LYS 7 4.278 -8.229 -9.744 44 HG2 LYS 7 2HG LYS 7 5.362 -10.297 -9.747 45 HG3 LYS 7 3HG LYS 7 6.451 -9.855 -8.448 46 HD2 LYS 7 2HD LYS 7 4.896 -10.361 -6.771 47 HD3 LYS 7 3HD LYS 7 3.514 -10.027 -7.796 48 HE2 LYS 7 2HE LYS 7 5.338 -12.369 -8.434 49 HE3 LYS 7 3HE LYS 7 4.109 -12.530 -7.195 50 HZ1 LYS 7 2HZ LYS 7 3.763 -12.292 -10.065 51 HZ3 LYS 7 1HZ LYS 7 2.686 -11.440 -9.190 52 H LYS 8 HN LYS 8 4.899 -6.764 -11.398 53 HA LYS 8 HA LYS 8 6.312 -8.211 -13.320 54 HB2 LYS 8 2HB LYS 8 4.490 -5.800 -13.548 55 HB3 LYS 8 3HB LYS 8 5.097 -6.697 -14.924 56 HG2 LYS 8 2HG LYS 8 3.710 -8.169 -12.663 57 HG3 LYS 8 3HG LYS 8 2.754 -7.335 -13.872 58 HD2 LYS 8 2HD LYS 8 3.795 -8.645 -15.679 59 HD3 LYS 8 3HD LYS 8 4.910 -9.390 -14.551 60 HE2 LYS 8 2HE LYS 8 1.868 -9.697 -14.493 61 HE3 LYS 8 3HE LYS 8 2.998 -10.900 -15.082 62 HZ1 LYS 8 2HZ LYS 8 4.017 -10.635 -12.708 63 HZ3 LYS 8 1HZ LYS 8 2.684 -11.551 -12.892 64 H ILE 9 HN ILE 9 6.839 -5.039 -11.815 65 HA ILE 9 HA ILE 9 8.678 -4.149 -13.794 66 HB ILE 9 HB ILE 9 7.903 -3.246 -11.036 67 HG12 ILE 9 2HG1 ILE 9 7.646 -1.904 -13.742 68 HG13 ILE 9 3HG1 ILE 9 6.383 -2.853 -12.985 69 HG21 ILE 9 1HG2 ILE 9 9.424 -1.191 -12.076 70 HG22 ILE 9 2HG2 ILE 9 9.913 -2.312 -10.783 71 HG23 ILE 9 3HG2 ILE 9 10.378 -2.642 -12.469 72 HD11 ILE 9 3HD1 ILE 9 7.111 -1.127 -10.930 73 HD12 ILE 9 1HD1 ILE 9 7.291 -0.107 -12.377 74 HD13 ILE 9 2HD1 ILE 9 5.731 -0.890 -12.028 75 H PHE 10 HN PHE 10 8.894 -5.838 -10.622 76 HA PHE 10 HA PHE 10 11.687 -5.732 -10.451 77 HB2 PHE 10 2HB PHE 10 10.373 -6.282 -8.493 78 HB3 PHE 10 3HB PHE 10 9.400 -7.445 -9.372 79 HD1 PHE 10 HD1 PHE 10 12.865 -6.884 -8.135 80 HD2 PHE 10 HD2 PHE 10 9.906 -9.716 -9.247 81 HE1 PHE 10 HE1 PHE 10 14.328 -8.743 -7.296 82 HE2 PHE 10 HE2 PHE 10 11.370 -11.574 -8.406 83 HZ PHE 10 HZ PHE 10 13.563 -11.065 -7.441 84 H ILE 11 HN ILE 11 9.556 -7.543 -12.517 85 HA ILE 11 HA ILE 11 11.427 -9.716 -12.867 86 HB ILE 11 HB ILE 11 8.726 -9.031 -13.997 87 HG12 ILE 11 2HG1 ILE 11 9.772 -11.249 -12.218 88 HG13 ILE 11 3HG1 ILE 11 8.697 -9.943 -11.761 89 HG21 ILE 11 1HG2 ILE 11 10.118 -9.979 -15.807 90 HG22 ILE 11 2HG2 ILE 11 10.437 -11.404 -14.788 91 HG23 ILE 11 3HG2 ILE 11 8.780 -11.050 -15.328 92 HD11 ILE 11 3HD1 ILE 11 7.077 -11.524 -12.171 93 HD12 ILE 11 1HD1 ILE 11 7.275 -10.968 -13.851 94 HD13 ILE 11 2HD1 ILE 11 8.110 -12.437 -13.296 95 H MET 12 HN MET 12 9.967 -7.116 -14.948 96 HA MET 12 HA MET 12 11.708 -7.590 -17.057 97 HB2 MET 12 2HB MET 12 9.930 -5.288 -16.159 98 HB3 MET 12 3HB MET 12 10.985 -5.050 -17.537 99 HG2 MET 12 2HG MET 12 9.979 -7.111 -18.614 100 HG3 MET 12 3HG MET 12 8.873 -7.244 -17.262 101 HE1 MET 12 3HE MET 12 8.830 -5.311 -20.964 102 HE2 MET 12 1HE MET 12 9.435 -3.856 -20.137 103 HE3 MET 12 2HE MET 12 10.317 -5.395 -19.989 104 H LYS 13 HN LYS 13 12.324 -6.282 -13.964 105 HA LYS 13 HA LYS 13 14.656 -4.824 -14.999 106 HB2 LYS 13 2HB LYS 13 13.010 -4.381 -12.495 107 HB3 LYS 13 3HB LYS 13 14.567 -3.628 -12.772 108 HG2 LYS 13 2HG LYS 13 13.673 -2.667 -14.935 109 HG3 LYS 13 3HG LYS 13 12.104 -3.350 -14.558 110 HD2 LYS 13 2HD LYS 13 12.310 -2.048 -12.288 111 HD3 LYS 13 3HD LYS 13 13.597 -1.155 -13.076 112 HE2 LYS 13 2HE LYS 13 10.981 -1.458 -14.552 113 HE3 LYS 13 3HE LYS 13 11.038 -0.340 -13.205 114 HZ1 LYS 13 2HZ LYS 13 12.854 0.829 -14.270 115 HZ3 LYS 13 1HZ LYS 13 11.650 0.694 -15.359 116 H CYS 14 HN CYS 14 13.380 -7.251 -12.700 117 HA CYS 14 HA CYS 14 16.143 -8.136 -12.347 118 HB2 CYS 14 2HB CYS 14 14.266 -8.497 -10.069 119 HB3 CYS 14 3HB CYS 14 16.010 -8.323 -10.079 120 H SER 15 HN SER 15 15.528 -9.604 -14.154 121 HA SER 15 HA SER 15 13.708 -11.686 -13.223 122 HB2 SER 15 2HB SER 15 13.715 -12.154 -15.869 123 HB3 SER 15 3HB SER 15 12.604 -11.018 -15.131 124 HG SER 15 HG SER 15 14.290 -10.476 -17.074 125 H GLN 16 HN GLN 16 14.366 -13.905 -13.565 126 HA GLN 16 HA GLN 16 15.901 -15.459 -13.338 127 HB2 GLN 16 2HB GLN 16 16.540 -14.249 -16.048 128 HB3 GLN 16 3HB GLN 16 17.372 -15.683 -15.480 129 HG2 GLN 16 2HG GLN 16 15.588 -16.697 -16.569 130 HG3 GLN 16 3HG GLN 16 14.886 -16.537 -14.970 131 HE21 GLN 16 1HE2 GLN 16 15.315 -14.747 -18.012 132 HE22 GLN 16 2HE2 GLN 16 13.759 -13.987 -18.046 133 H CYS 17 HN CYS 17 16.629 -12.974 -11.984 134 HA CYS 17 HA CYS 17 19.529 -13.334 -12.051 135 HB2 CYS 17 2HB CYS 17 17.989 -10.823 -12.402 136 HB3 CYS 17 3HB CYS 17 19.365 -10.741 -11.321 137 H HIS 18 HN HIS 18 17.064 -11.368 -10.226 138 HA HIS 18 HA HIS 18 18.191 -12.452 -7.772 139 HB2 HIS 18 2HB HIS 18 16.498 -10.037 -8.411 140 HB3 HIS 18 3HB HIS 18 16.687 -10.611 -6.766 141 HD1 HIS 18 HD1 HIS 18 19.134 -10.494 -5.721 142 HD2 HIS 18 HD2 HIS 18 18.685 -8.649 -9.461 143 HE1 HIS 18 HE1 HIS 18 21.189 -9.016 -6.040 144 H THR 19 HN THR 19 16.968 -13.622 -6.260 145 HA THR 19 HA THR 19 14.326 -14.469 -7.253 146 HB THR 19 HB THR 19 14.891 -16.591 -5.948 147 HG1 THR 19 HG1 THR 19 17.354 -16.588 -5.557 148 HG21 THR 19 1HG2 THR 19 17.298 -16.415 -7.633 149 HG22 THR 19 2HG2 THR 19 15.875 -17.467 -7.821 150 HG23 THR 19 3HG2 THR 19 15.857 -15.817 -8.490 151 H VAL 20 HN VAL 20 12.656 -14.895 -5.677 152 HA VAL 20 HA VAL 20 13.142 -13.620 -3.092 153 HB VAL 20 HB VAL 20 11.229 -12.254 -3.248 154 HG11 VAL 20 1HG1 VAL 20 12.535 -12.001 -5.973 155 HG12 VAL 20 2HG1 VAL 20 11.803 -10.715 -4.984 156 HG13 VAL 20 3HG1 VAL 20 13.316 -11.490 -4.457 157 HG21 VAL 20 3HG2 VAL 20 10.008 -12.304 -5.633 158 HG22 VAL 20 1HG2 VAL 20 10.525 -14.006 -5.558 159 HG23 VAL 20 2HG2 VAL 20 9.497 -13.330 -4.271 160 H GLU 21 HN GLU 21 12.641 -16.409 -4.534 161 HA GLU 21 HA GLU 21 10.307 -17.153 -2.982 162 HB2 GLU 21 2HB GLU 21 10.674 -17.743 -5.503 163 HB3 GLU 21 3HB GLU 21 11.792 -18.958 -4.917 164 HG2 GLU 21 2HG GLU 21 9.946 -19.870 -3.435 165 HG3 GLU 21 3HG GLU 21 8.843 -18.718 -4.160 166 HE2 GLU 21 HE2 GLU 21 10.329 -21.369 -6.792 167 H LYS 22 HN LYS 22 10.565 -18.117 -1.014 168 HA LYS 22 HA LYS 22 12.908 -18.478 0.253 169 HB2 LYS 22 2HB LYS 22 10.898 -18.577 1.489 170 HB3 LYS 22 3HB LYS 22 10.262 -19.902 0.535 171 HG2 LYS 22 2HG LYS 22 11.094 -20.669 2.763 172 HG3 LYS 22 3HG LYS 22 11.947 -21.444 1.442 173 HD2 LYS 22 2HD LYS 22 13.743 -19.614 1.677 174 HD3 LYS 22 3HD LYS 22 12.935 -19.120 3.152 175 HE2 LYS 22 2HE LYS 22 13.268 -21.368 4.134 176 HE3 LYS 22 3HE LYS 22 13.967 -21.949 2.637 177 HZ1 LYS 22 2HZ LYS 22 15.858 -21.346 3.772 178 HZ3 LYS 22 1HZ LYS 22 15.151 -20.143 4.612 179 H GLY 23 HN GLY 23 11.177 -20.952 -1.748 180 HA2 GLY 23 1HA GLY 23 13.270 -22.888 -1.415 181 HA3 GLY 23 2HA GLY 23 11.874 -22.986 -2.469 182 H GLY 24 HN GLY 24 12.545 -20.207 -3.625 183 HA2 GLY 24 1HA GLY 24 13.698 -20.878 -5.973 184 HA3 GLY 24 2HA GLY 24 13.833 -19.291 -5.240 185 H LYS 25 HN LYS 25 15.901 -20.174 -6.862 186 HA LYS 25 HA LYS 25 17.998 -20.689 -4.875 187 HB2 LYS 25 2HB LYS 25 19.040 -22.275 -6.189 188 HB3 LYS 25 3HB LYS 25 17.349 -22.655 -6.445 189 HG2 LYS 25 2HG LYS 25 17.386 -21.241 -8.541 190 HG3 LYS 25 3HG LYS 25 19.100 -20.972 -8.299 191 HD2 LYS 25 2HD LYS 25 18.523 -22.864 -9.912 192 HD3 LYS 25 3HD LYS 25 19.624 -23.303 -8.621 193 HE2 LYS 25 2HE LYS 25 17.736 -24.969 -9.037 194 HE3 LYS 25 3HE LYS 25 17.890 -24.429 -7.377 195 HZ1 LYS 25 2HZ LYS 25 15.648 -24.108 -7.755 196 HZ3 LYS 25 1HZ LYS 25 15.816 -23.726 -9.330 197 H HIS 26 HN HIS 26 20.172 -19.849 -5.594 198 HA HIS 26 HA HIS 26 19.758 -17.227 -6.697 199 HB2 HIS 26 2HB HIS 26 22.291 -18.533 -5.666 200 HB3 HIS 26 3HB HIS 26 22.073 -16.832 -6.023 201 HD1 HIS 26 HD1 HIS 26 22.469 -16.001 -3.628 202 HD2 HIS 26 HD2 HIS 26 19.373 -18.816 -3.930 203 HE1 HIS 26 HE1 HIS 26 21.276 -15.997 -1.372 204 H LYS 27 HN LYS 27 20.454 -16.475 -8.691 205 HA LYS 27 HA LYS 27 21.774 -18.477 -10.388 206 HB2 LYS 27 2HB LYS 27 19.221 -17.871 -10.749 207 HB3 LYS 27 3HB LYS 27 19.884 -16.460 -11.548 208 HG2 LYS 27 2HG LYS 27 21.008 -17.754 -13.197 209 HG3 LYS 27 3HG LYS 27 20.971 -19.209 -12.222 210 HD2 LYS 27 2HD LYS 27 19.320 -19.447 -13.997 211 HD3 LYS 27 3HD LYS 27 18.463 -19.286 -12.477 212 HE2 LYS 27 2HE LYS 27 18.145 -16.832 -12.937 213 HE3 LYS 27 3HE LYS 27 18.964 -17.026 -14.474 214 HZ1 LYS 27 2HZ LYS 27 16.286 -17.864 -13.731 215 HZ3 LYS 27 1HZ LYS 27 17.093 -18.933 -14.657 216 H THR 28 HN THR 28 20.872 -14.991 -10.779 217 HA THR 28 HA THR 28 23.676 -14.479 -11.455 218 HB THR 28 HB THR 28 21.350 -12.550 -11.788 219 HG1 THR 28 HG1 THR 28 21.098 -13.776 -13.875 220 HG21 THR 28 1HG2 THR 28 23.824 -13.257 -13.454 221 HG22 THR 28 2HG2 THR 28 22.587 -12.066 -13.925 222 HG23 THR 28 3HG2 THR 28 23.605 -11.774 -12.493 223 H GLY 29 HN GLY 29 21.103 -13.625 -9.130 224 HA2 GLY 29 1HA GLY 29 23.180 -12.256 -7.539 225 HA3 GLY 29 2HA GLY 29 21.610 -11.523 -7.802 226 HA PRO 30 HA PRO 30 21.459 -14.436 -4.207 227 HB2 PRO 30 2HB PRO 30 21.585 -12.687 -2.111 228 HB3 PRO 30 3HB PRO 30 22.975 -13.576 -2.702 229 HG2 PRO 30 2HG PRO 30 22.304 -10.722 -3.080 230 HG3 PRO 30 3HG PRO 30 23.850 -11.523 -3.282 231 HD2 PRO 30 2HD PRO 30 22.067 -10.681 -5.365 232 HD3 PRO 30 3HD PRO 30 23.556 -11.584 -5.562 233 H ASN 31 HN ASN 31 19.563 -15.169 -3.378 234 HA ASN 31 HA ASN 31 17.292 -14.005 -4.297 235 HB2 ASN 31 2HB ASN 31 17.705 -16.341 -3.170 236 HB3 ASN 31 3HB ASN 31 17.398 -15.522 -1.651 237 HD21 ASN 31 1HD2 ASN 31 16.044 -17.295 -4.038 238 HD22 ASN 31 2HD2 ASN 31 14.376 -16.845 -3.903 239 H LEU 32 HN LEU 32 16.233 -12.107 -3.697 240 HA LEU 32 HA LEU 32 17.187 -10.483 -1.644 241 HB2 LEU 32 2HB LEU 32 14.544 -10.452 -3.107 242 HB3 LEU 32 3HB LEU 32 15.139 -9.162 -2.080 243 HG LEU 32 HG LEU 32 16.425 -10.131 -4.648 244 HD11 LEU 32 1HD1 LEU 32 15.536 -8.312 -5.743 245 HD12 LEU 32 2HD1 LEU 32 14.207 -8.738 -4.637 246 HD13 LEU 32 3HD1 LEU 32 15.295 -7.384 -4.244 247 HD21 LEU 32 3HD2 LEU 32 18.312 -9.232 -3.903 248 HD22 LEU 32 1HD2 LEU 32 17.500 -7.648 -3.934 249 HD23 LEU 32 2HD2 LEU 32 17.511 -8.612 -2.438 250 H HIS 33 HN HIS 33 15.213 -13.315 -1.565 251 HA HIS 33 HA HIS 33 13.389 -12.945 0.341 252 HB2 HIS 33 2HB HIS 33 13.598 -15.080 -0.607 253 HB3 HIS 33 3HB HIS 33 15.286 -15.227 -0.161 254 HD1 HIS 33 HD1 HIS 33 15.731 -15.455 2.550 255 HD2 HIS 33 HD2 HIS 33 11.850 -16.243 1.167 256 HE1 HIS 33 HE1 HIS 33 14.565 -16.768 4.401 257 H GLY 34 HN GLY 34 16.941 -13.336 0.886 258 HA2 GLY 34 1HA GLY 34 16.530 -12.678 3.725 259 HA3 GLY 34 2HA GLY 34 17.951 -13.417 3.014 260 H LEU 35 HN LEU 35 16.010 -10.470 2.126 261 HA LEU 35 HA LEU 35 18.501 -9.020 1.827 262 HB2 LEU 35 2HB LEU 35 17.007 -8.773 0.030 263 HB3 LEU 35 3HB LEU 35 15.635 -8.497 1.085 264 HG LEU 35 HG LEU 35 16.825 -6.339 1.811 265 HD11 LEU 35 1HD1 LEU 35 18.531 -7.154 -0.532 266 HD12 LEU 35 2HD1 LEU 35 18.300 -5.441 -0.104 267 HD13 LEU 35 3HD1 LEU 35 19.022 -6.563 1.074 268 HD21 LEU 35 3HD2 LEU 35 16.159 -5.261 -0.510 269 HD22 LEU 35 1HD2 LEU 35 15.478 -6.880 -0.800 270 HD23 LEU 35 2HD2 LEU 35 14.934 -5.923 0.599 271 H PHE 36 HN PHE 36 15.308 -8.033 3.232 272 HA PHE 36 HA PHE 36 16.458 -6.192 4.967 273 HB2 PHE 36 2HB PHE 36 13.844 -7.759 4.753 274 HB3 PHE 36 3HB PHE 36 14.089 -6.707 6.133 275 HD1 PHE 36 HD1 PHE 36 13.708 -6.804 2.476 276 HD2 PHE 36 HD2 PHE 36 13.986 -4.323 5.908 277 HE1 PHE 36 HE1 PHE 36 12.922 -4.842 1.121 278 HE2 PHE 36 HE2 PHE 36 13.200 -2.361 4.552 279 HZ PHE 36 HZ PHE 36 12.678 -2.644 2.175 280 H GLY 37 HN GLY 37 18.088 -6.897 6.344 281 HA2 GLY 37 1HA GLY 37 18.335 -7.583 8.636 282 HA3 GLY 37 2HA GLY 37 17.269 -8.939 8.320 283 H ARG 38 HN ARG 38 19.807 -7.800 6.051 284 HA ARG 38 HA ARG 38 21.540 -9.917 6.909 285 HB2 ARG 38 2HB ARG 38 19.945 -10.938 5.204 286 HB3 ARG 38 3HB ARG 38 20.542 -9.793 4.020 287 HG2 ARG 38 2HG ARG 38 22.918 -10.713 4.603 288 HG3 ARG 38 3HG ARG 38 22.077 -12.033 5.390 289 HD2 ARG 38 2HD ARG 38 21.593 -11.225 2.483 290 HD3 ARG 38 3HD ARG 38 22.717 -12.481 2.964 291 HE ARG 38 HE ARG 38 19.847 -12.731 2.819 292 HH11 ARG 38 2HH2 ARG 38 22.620 -13.807 4.747 293 HH12 ARG 38 1HH2 ARG 38 21.844 -15.262 5.276 294 HH22 ARG 38 HH1 ARG 38 19.614 -15.739 4.541 295 H LYS 39 HN LYS 39 23.392 -8.692 7.191 296 HA LYS 39 HA LYS 39 23.960 -6.287 6.087 297 HB2 LYS 39 2HB LYS 39 25.171 -7.838 7.880 298 HB3 LYS 39 3HB LYS 39 26.216 -8.205 6.522 299 HG2 LYS 39 2HG LYS 39 27.036 -6.028 6.369 300 HG3 LYS 39 3HG LYS 39 25.556 -5.307 6.968 301 HD2 LYS 39 2HD LYS 39 27.085 -7.048 8.884 302 HD3 LYS 39 3HD LYS 39 27.806 -5.504 8.476 303 HE2 LYS 39 2HE LYS 39 25.651 -4.358 9.106 304 HE3 LYS 39 3HE LYS 39 24.979 -5.909 9.566 305 HZ1 LYS 39 2HZ LYS 39 26.067 -4.521 11.396 306 HZ3 LYS 39 1HZ LYS 39 27.506 -4.950 10.767 307 H THR 40 HN THR 40 25.822 -5.775 4.483 308 HA THR 40 HA THR 40 25.083 -7.007 1.987 309 HB THR 40 HB THR 40 26.856 -5.227 1.220 310 HG1 THR 40 HG1 THR 40 27.637 -5.274 3.584 311 HG21 THR 40 1HG2 THR 40 25.247 -3.316 2.293 312 HG22 THR 40 2HG2 THR 40 24.732 -4.310 0.909 313 HG23 THR 40 3HG2 THR 40 24.202 -4.733 2.555 314 H GLY 41 HN GLY 41 25.854 -8.947 1.429 315 HA2 GLY 41 1HA GLY 41 27.579 -10.259 0.612 316 HA3 GLY 41 2HA GLY 41 28.751 -9.315 1.509 317 H GLN 42 HN GLN 42 25.790 -11.301 2.256 318 HA GLN 42 HA GLN 42 27.385 -12.518 4.376 319 HB2 GLN 42 2HB GLN 42 24.365 -12.089 4.358 320 HB3 GLN 42 3HB GLN 42 25.295 -12.798 5.662 321 HG2 GLN 42 2HG GLN 42 25.800 -9.979 4.609 322 HG3 GLN 42 3HG GLN 42 24.709 -10.316 5.937 323 HE21 GLN 42 1HE2 GLN 42 27.856 -9.653 5.024 324 HE22 GLN 42 2HE2 GLN 42 28.694 -10.034 6.492 325 H ALA 43 HN ALA 43 24.932 -12.935 1.792 326 HA ALA 43 HA ALA 43 24.151 -15.478 2.033 327 HB1 ALA 43 3HB ALA 43 23.609 -13.865 0.188 328 HB2 ALA 43 1HB ALA 43 25.187 -14.237 -0.546 329 HB3 ALA 43 2HB ALA 43 23.956 -15.513 -0.389 330 HA PRO 44 HA PRO 44 28.124 -17.434 2.191 331 HB2 PRO 44 2HB PRO 44 27.330 -19.623 3.622 332 HB3 PRO 44 3HB PRO 44 27.894 -18.143 4.370 333 HG2 PRO 44 2HG PRO 44 25.130 -19.168 4.144 334 HG3 PRO 44 3HG PRO 44 25.762 -17.944 5.227 335 HD2 PRO 44 2HD PRO 44 24.204 -17.500 2.860 336 HD3 PRO 44 3HD PRO 44 24.934 -16.276 3.879 337 H GLY 45 HN GLY 45 25.387 -18.012 0.518 338 HA2 GLY 45 1HA GLY 45 26.357 -20.552 -0.597 339 HA3 GLY 45 2HA GLY 45 24.769 -19.841 -0.812 340 H TYR 46 HN TYR 46 26.186 -17.084 -1.212 341 HA TYR 46 HA TYR 46 27.465 -17.538 -3.784 342 HB2 TYR 46 2HB TYR 46 24.897 -17.313 -4.021 343 HB3 TYR 46 3HB TYR 46 25.018 -15.736 -3.265 344 HD1 TYR 46 HD1 TYR 46 27.050 -17.405 -5.951 345 HD2 TYR 46 HD2 TYR 46 24.576 -14.094 -4.844 346 HE1 TYR 46 HE1 TYR 46 27.446 -16.339 -8.225 347 HE2 TYR 46 HE2 TYR 46 24.981 -13.039 -7.122 348 HH TYR 46 HH TYR 46 27.326 -14.378 -9.336 349 H SER 47 HN SER 47 29.285 -16.324 -3.784 350 HA SER 47 HA SER 47 29.372 -14.088 -1.966 351 HB2 SER 47 2HB SER 47 31.516 -15.474 -3.633 352 HB3 SER 47 3HB SER 47 31.836 -14.081 -2.619 353 HG SER 47 HG SER 47 32.308 -15.862 -1.346 354 H TYR 48 HN TYR 48 29.835 -11.914 -2.637 355 HA TYR 48 HA TYR 48 29.218 -11.443 -5.460 356 HB2 TYR 48 2HB TYR 48 29.470 -9.404 -3.194 357 HB3 TYR 48 3HB TYR 48 28.434 -9.308 -4.605 358 HD1 TYR 48 HD2 TYR 48 27.497 -12.339 -4.171 359 HD2 TYR 48 HD1 TYR 48 27.584 -8.832 -1.723 360 HE1 TYR 48 HE2 TYR 48 25.553 -13.238 -2.802 361 HE2 TYR 48 HE1 TYR 48 25.639 -9.743 -0.362 362 HH TYR 48 HH TYR 48 23.675 -11.439 -0.944 363 H THR 49 HN THR 49 30.249 -8.995 -5.967 364 HA THR 49 HA THR 49 32.938 -9.523 -6.489 365 HB THR 49 HB THR 49 32.851 -6.939 -6.960 366 HG1 THR 49 HG1 THR 49 30.511 -6.292 -6.906 367 HG21 THR 49 1HG2 THR 49 32.198 -8.899 -8.615 368 HG22 THR 49 2HG2 THR 49 30.525 -8.426 -8.234 369 HG23 THR 49 3HG2 THR 49 31.634 -7.250 -8.980 370 H ALA 50 HN ALA 50 34.696 -7.763 -5.838 371 HA ALA 50 HA ALA 50 34.960 -8.108 -2.987 372 HB1 ALA 50 3HB ALA 50 37.239 -7.088 -3.479 373 HB2 ALA 50 1HB ALA 50 36.883 -8.607 -4.337 374 HB3 ALA 50 2HB ALA 50 36.763 -7.052 -5.194 375 H ALA 51 HN ALA 51 33.727 -5.751 -5.191 376 HA ALA 51 HA ALA 51 34.329 -3.522 -3.437 377 HB1 ALA 51 3HB ALA 51 32.478 -3.276 -5.770 378 HB2 ALA 51 1HB ALA 51 33.797 -2.205 -5.240 379 HB3 ALA 51 2HB ALA 51 34.169 -3.707 -6.121 380 H ASN 52 HN ASN 52 31.790 -5.871 -4.123 381 HA ASN 52 HA ASN 52 29.774 -4.277 -2.890 382 HB2 ASN 52 2HB ASN 52 29.525 -6.148 -4.741 383 HB3 ASN 52 3HB ASN 52 29.601 -7.277 -3.403 384 HD21 ASN 52 1HD2 ASN 52 28.185 -6.573 -1.467 385 HD22 ASN 52 2HD2 ASN 52 26.553 -6.126 -1.837 386 H LYS 53 HN LYS 53 31.610 -7.347 -2.204 387 HA LYS 53 HA LYS 53 30.515 -7.951 0.238 388 HB2 LYS 53 2HB LYS 53 32.233 -9.197 -1.295 389 HB3 LYS 53 3HB LYS 53 33.440 -8.380 -0.322 390 HG2 LYS 53 2HG LYS 53 31.902 -9.275 1.702 391 HG3 LYS 53 3HG LYS 53 31.424 -10.463 0.506 392 HD2 LYS 53 2HD LYS 53 34.029 -10.718 0.093 393 HD3 LYS 53 3HD LYS 53 34.180 -9.954 1.663 394 HE2 LYS 53 2HE LYS 53 32.342 -11.797 2.352 395 HE3 LYS 53 3HE LYS 53 33.001 -12.642 0.965 396 HZ1 LYS 53 2HZ LYS 53 35.254 -12.259 2.011 397 HZ3 LYS 53 1HZ LYS 53 34.294 -13.274 2.846 398 H ASN 54 HN ASN 54 32.931 -5.482 -0.652 399 HA ASN 54 HA ASN 54 33.961 -4.971 1.816 400 HB2 ASN 54 2HB ASN 54 33.380 -3.216 -0.602 401 HB3 ASN 54 3HB ASN 54 34.068 -2.500 0.843 402 HD21 ASN 54 1HD2 ASN 54 35.343 -2.558 -1.627 403 HD22 ASN 54 2HD2 ASN 54 36.770 -3.535 -1.535 404 H LYS 55 HN LYS 55 30.916 -3.855 0.228 405 HA LYS 55 HA LYS 55 30.153 -1.900 2.005 406 HB2 LYS 55 2HB LYS 55 29.134 -2.733 -0.254 407 HB3 LYS 55 3HB LYS 55 28.160 -3.780 0.759 408 HG2 LYS 55 2HG LYS 55 27.003 -1.625 0.309 409 HG3 LYS 55 3HG LYS 55 27.302 -1.842 2.022 410 HD2 LYS 55 2HD LYS 55 29.025 -0.225 2.071 411 HD3 LYS 55 3HD LYS 55 29.362 -0.379 0.358 412 HE2 LYS 55 2HE LYS 55 27.243 0.752 -0.210 413 HE3 LYS 55 3HE LYS 55 26.772 0.795 1.477 414 HZ1 LYS 55 2HZ LYS 55 29.001 2.281 0.215 415 HZ3 LYS 55 1HZ LYS 55 28.894 2.127 1.833 416 H GLY 56 HN GLY 56 29.167 -1.836 4.013 417 HA2 GLY 56 1HA GLY 56 28.450 -4.403 5.251 418 HA3 GLY 56 2HA GLY 56 29.649 -3.389 6.028 419 H ILE 57 HN ILE 57 26.266 -3.382 4.750 420 HA ILE 57 HA ILE 57 25.472 -1.833 7.056 421 HB ILE 57 HB ILE 57 24.325 -0.133 5.728 422 HG12 ILE 57 2HG1 ILE 57 25.362 0.062 3.287 423 HG13 ILE 57 3HG1 ILE 57 25.489 -1.679 3.443 424 HG21 ILE 57 1HG2 ILE 57 26.278 1.208 5.183 425 HG22 ILE 57 2HG2 ILE 57 26.541 0.308 6.697 426 HG23 ILE 57 3HG2 ILE 57 27.305 -0.246 5.188 427 HD11 ILE 57 3HD1 ILE 57 23.085 0.007 3.112 428 HD12 ILE 57 1HD1 ILE 57 23.316 -1.722 2.760 429 HD13 ILE 57 2HD1 ILE 57 22.925 -1.196 4.415 430 H ILE 58 HN ILE 58 23.075 -1.813 7.299 431 HA ILE 58 HA ILE 58 22.031 -4.320 6.283 432 HB ILE 58 HB ILE 58 20.925 -2.385 8.322 433 HG12 ILE 58 2HG1 ILE 58 23.004 -3.221 9.148 434 HG13 ILE 58 3HG1 ILE 58 21.717 -4.078 9.974 435 HG21 ILE 58 1HG2 ILE 58 20.134 -5.265 7.837 436 HG22 ILE 58 2HG2 ILE 58 19.369 -4.083 8.927 437 HG23 ILE 58 3HG2 ILE 58 19.259 -3.869 7.163 438 HD11 ILE 58 3HD1 ILE 58 23.751 -5.103 8.064 439 HD12 ILE 58 1HD1 ILE 58 22.896 -5.946 9.378 440 HD13 ILE 58 2HD1 ILE 58 22.104 -5.726 7.800 441 H TRP 59 HN TRP 59 20.622 -4.484 4.616 442 HA TRP 59 HA TRP 59 19.945 -2.155 3.155 443 HB2 TRP 59 2HB TRP 59 19.197 -5.065 2.929 444 HB3 TRP 59 3HB TRP 59 18.524 -3.846 1.864 445 HD1 TRP 59 HD1 TRP 59 21.463 -6.097 2.114 446 HE1 TRP 59 HE1 TRP 59 23.344 -5.565 0.341 447 HE3 TRP 59 HE3 TRP 59 19.626 -1.556 0.748 448 HZ2 TRP 59 HZ2 TRP 59 23.841 -3.356 -1.394 449 HZ3 TRP 59 HZ3 TRP 59 20.870 -0.277 -0.992 450 HH2 TRP 59 HH2 TRP 59 22.909 -1.106 -2.054 451 H GLY 60 HN GLY 60 17.756 -1.326 2.769 452 HA2 GLY 60 1HA GLY 60 15.612 -2.218 4.488 453 HA3 GLY 60 2HA GLY 60 16.291 -0.667 4.937 454 H GLU 61 HN GLU 61 14.243 0.366 4.391 455 HA GLU 61 HA GLU 61 13.457 0.216 1.633 456 HB2 GLU 61 2HB GLU 61 12.301 1.661 4.051 457 HB3 GLU 61 3HB GLU 61 11.625 1.818 2.442 458 HG2 GLU 61 2HG GLU 61 11.724 -0.883 2.547 459 HG3 GLU 61 3HG GLU 61 11.646 -0.574 4.270 460 HE2 GLU 61 HE2 GLU 61 9.343 1.244 4.555 461 H ASP 62 HN ASP 62 15.128 2.398 3.895 462 HA ASP 62 HA ASP 62 14.983 4.613 2.131 463 HB2 ASP 62 2HB ASP 62 16.305 5.758 3.770 464 HB3 ASP 62 3HB ASP 62 15.239 4.702 4.675 465 HD2 ASP 62 HD2 ASP 62 17.716 3.080 6.234 466 H THR 63 HN THR 63 17.506 2.245 3.255 467 HA THR 63 HA THR 63 19.594 3.244 1.668 468 HB THR 63 HB THR 63 20.527 0.896 2.177 469 HG1 THR 63 HG1 THR 63 18.942 -0.150 3.795 470 HG21 THR 63 1HG2 THR 63 20.636 1.207 4.605 471 HG22 THR 63 2HG2 THR 63 20.726 2.817 3.851 472 HG23 THR 63 3HG2 THR 63 19.199 2.257 4.577 473 H LEU 64 HN LEU 64 16.716 1.502 0.826 474 HA LEU 64 HA LEU 64 17.922 0.476 -1.608 475 HB2 LEU 64 2HB LEU 64 15.325 0.101 -0.173 476 HB3 LEU 64 3HB LEU 64 15.411 -0.246 -1.888 477 HG LEU 64 HG LEU 64 17.217 -1.499 0.198 478 HD11 LEU 64 1HD1 LEU 64 15.239 -3.219 -1.125 479 HD12 LEU 64 2HD1 LEU 64 15.728 -3.123 0.584 480 HD13 LEU 64 3HD1 LEU 64 14.529 -1.978 -0.063 481 HD21 LEU 64 3HD2 LEU 64 18.393 -2.370 -1.469 482 HD22 LEU 64 1HD2 LEU 64 16.920 -2.986 -2.256 483 HD23 LEU 64 2HD2 LEU 64 17.486 -1.332 -2.595 484 H MET 65 HN MET 65 15.400 2.828 -0.516 485 HA MET 65 HA MET 65 14.446 3.650 -2.870 486 HB2 MET 65 2HB MET 65 14.102 4.488 -0.370 487 HB3 MET 65 3HB MET 65 15.320 5.682 -0.769 488 HG2 MET 65 2HG MET 65 13.438 6.877 -1.412 489 HG3 MET 65 3HG MET 65 13.754 6.056 -2.927 490 HE1 MET 65 3HE MET 65 12.587 4.756 -4.034 491 HE2 MET 65 1HE MET 65 11.245 3.676 -3.581 492 HE3 MET 65 2HE MET 65 10.927 5.391 -3.935 493 H GLU 66 HN GLU 66 17.641 4.459 -1.453 494 HA GLU 66 HA GLU 66 18.191 6.365 -3.490 495 HB2 GLU 66 2HB GLU 66 19.172 6.670 -1.282 496 HB3 GLU 66 3HB GLU 66 19.914 5.083 -1.330 497 HG2 GLU 66 2HG GLU 66 21.298 5.805 -3.300 498 HG3 GLU 66 3HG GLU 66 20.575 7.400 -3.211 499 HE2 GLU 66 HE2 GLU 66 23.475 7.928 -1.901 500 H TYR 67 HN TYR 67 19.448 3.067 -2.612 501 HA TYR 67 HA TYR 67 21.214 2.705 -4.647 502 HB2 TYR 67 2HB TYR 67 20.689 1.154 -2.725 503 HB3 TYR 67 3HB TYR 67 19.105 0.834 -3.403 504 HD1 TYR 67 HD1 TYR 67 22.730 0.236 -3.818 505 HD2 TYR 67 HD2 TYR 67 18.803 -0.750 -5.200 506 HE1 TYR 67 HE1 TYR 67 23.672 -1.743 -5.106 507 HE2 TYR 67 HE2 TYR 67 19.759 -2.725 -6.485 508 HH TYR 67 HH TYR 67 22.907 -3.863 -5.958 509 H LEU 68 HN LEU 68 17.660 2.719 -4.794 510 HA LEU 68 HA LEU 68 17.593 1.506 -7.389 511 HB2 LEU 68 2HB LEU 68 15.620 2.631 -5.457 512 HB3 LEU 68 3HB LEU 68 15.149 2.499 -7.140 513 HG LEU 68 HG LEU 68 16.118 0.210 -5.404 514 HD11 LEU 68 1HD1 LEU 68 13.338 0.320 -6.465 515 HD12 LEU 68 2HD1 LEU 68 13.969 -0.368 -4.949 516 HD13 LEU 68 3HD1 LEU 68 13.743 1.392 -5.102 517 HD21 LEU 68 3HD2 LEU 68 16.717 -0.484 -7.514 518 HD22 LEU 68 1HD2 LEU 68 15.047 -1.091 -7.411 519 HD23 LEU 68 2HD2 LEU 68 15.395 0.407 -8.306 520 H GLU 69 HN GLU 69 17.755 4.773 -5.989 521 HA GLU 69 HA GLU 69 17.001 6.082 -8.353 522 HB2 GLU 69 2HB GLU 69 16.794 7.245 -6.249 523 HB3 GLU 69 3HB GLU 69 18.480 6.981 -5.851 524 HG2 GLU 69 2HG GLU 69 19.239 8.530 -7.522 525 HG3 GLU 69 3HG GLU 69 17.693 8.533 -8.345 526 HE2 GLU 69 HE2 GLU 69 17.137 10.219 -4.812 527 H ASN 70 HN ASN 70 20.030 4.739 -7.089 528 HA ASN 70 HA ASN 70 21.215 4.946 -9.616 529 HB2 ASN 70 2HB ASN 70 21.521 7.332 -8.687 530 HB3 ASN 70 3HB ASN 70 22.527 6.640 -7.430 531 HD21 ASN 70 1HD2 ASN 70 23.655 8.479 -8.939 532 HD22 ASN 70 2HD2 ASN 70 24.791 7.825 -10.071 533 HA PRO 71 HA PRO 71 22.810 1.778 -6.791 534 HB2 PRO 71 2HB PRO 71 22.635 -0.334 -8.516 535 HB3 PRO 71 3HB PRO 71 21.355 0.101 -7.402 536 HG2 PRO 71 2HG PRO 71 21.493 0.529 -10.323 537 HG3 PRO 71 3HG PRO 71 20.090 0.560 -9.275 538 HD2 PRO 71 2HD PRO 71 21.456 2.827 -10.379 539 HD3 PRO 71 3HD PRO 71 20.126 2.859 -9.240 540 H LYS 72 HN LYS 72 23.661 2.449 -10.100 541 HA LYS 72 HA LYS 72 26.110 1.134 -10.095 542 HB2 LYS 72 2HB LYS 72 24.887 2.008 -12.087 543 HB3 LYS 72 3HB LYS 72 25.329 3.637 -11.617 544 HG2 LYS 72 2HG LYS 72 27.106 3.189 -13.034 545 HG3 LYS 72 3HG LYS 72 27.800 2.584 -11.543 546 HD2 LYS 72 2HD LYS 72 26.206 0.789 -13.420 547 HD3 LYS 72 3HD LYS 72 27.930 1.037 -13.619 548 HE2 LYS 72 2HE LYS 72 27.938 0.429 -10.982 549 HE3 LYS 72 3HE LYS 72 26.457 -0.398 -11.418 550 HZ1 LYS 72 2HZ LYS 72 29.164 -1.086 -12.113 551 HZ3 LYS 72 1HZ LYS 72 28.162 -1.146 -13.394 552 H LYS 73 HN LYS 73 25.044 4.178 -8.636 553 HA LYS 73 HA LYS 73 27.743 5.082 -8.206 554 HB2 LYS 73 2HB LYS 73 26.056 6.738 -8.633 555 HB3 LYS 73 3HB LYS 73 25.030 6.122 -7.354 556 HG2 LYS 73 2HG LYS 73 27.244 6.588 -5.871 557 HG3 LYS 73 3HG LYS 73 27.558 7.746 -7.150 558 HD2 LYS 73 2HD LYS 73 26.281 9.092 -5.760 559 HD3 LYS 73 3HD LYS 73 24.989 8.406 -6.727 560 HE2 LYS 73 2HE LYS 73 25.933 7.179 -4.093 561 HE3 LYS 73 3HE LYS 73 24.617 8.332 -4.196 562 HZ1 LYS 73 2HZ LYS 73 23.272 6.654 -4.790 563 HZ3 LYS 73 1HZ LYS 73 24.493 5.582 -4.689 564 H TYR 74 HN TYR 74 24.978 4.048 -6.079 565 HA TYR 74 HA TYR 74 26.191 4.036 -3.684 566 HB2 TYR 74 2HB TYR 74 23.844 3.174 -4.707 567 HB3 TYR 74 3HB TYR 74 24.634 1.610 -4.708 568 HD1 TYR 74 HD2 TYR 74 25.909 1.115 -2.330 569 HD2 TYR 74 HD1 TYR 74 22.490 3.627 -2.887 570 HE1 TYR 74 HE2 TYR 74 25.270 0.797 0.110 571 HE2 TYR 74 HE1 TYR 74 21.861 3.300 -0.445 572 HH TYR 74 HH TYR 74 22.914 2.736 1.623 573 H ILE 75 HN ILE 75 26.792 1.780 -6.380 574 HA ILE 75 HA ILE 75 29.056 0.748 -4.874 575 HB ILE 75 HB ILE 75 27.064 -1.084 -6.210 576 HG12 ILE 75 2HG1 ILE 75 27.323 -0.191 -3.349 577 HG13 ILE 75 3HG1 ILE 75 25.885 -0.335 -4.340 578 HG21 ILE 75 1HG2 ILE 75 29.405 -1.861 -6.210 579 HG22 ILE 75 2HG2 ILE 75 29.447 -1.693 -4.439 580 HG23 ILE 75 3HG2 ILE 75 28.348 -2.872 -5.195 581 HD11 ILE 75 3HD1 ILE 75 26.224 -2.846 -4.379 582 HD12 ILE 75 1HD1 ILE 75 27.566 -2.627 -3.230 583 HD13 ILE 75 2HD1 ILE 75 25.907 -2.184 -2.758 584 HA PRO 76 HA PRO 76 30.216 1.793 -9.045 585 HB2 PRO 76 2HB PRO 76 32.674 2.821 -8.433 586 HB3 PRO 76 3HB PRO 76 31.221 3.798 -8.518 587 HG2 PRO 76 2HG PRO 76 32.690 2.865 -6.129 588 HG3 PRO 76 3HG PRO 76 31.519 4.162 -6.261 589 HD2 PRO 76 2HD PRO 76 31.071 1.547 -5.170 590 HD3 PRO 76 3HD PRO 76 29.872 2.803 -5.408 591 H GLY 77 HN GLY 77 30.637 0.127 -10.336 592 HA2 GLY 77 1HA GLY 77 32.423 -1.215 -11.200 593 HA3 GLY 77 2HA GLY 77 33.002 -1.465 -9.564 594 H THR 78 HN THR 78 29.768 -1.545 -9.058 595 HA THR 78 HA THR 78 29.608 -4.255 -8.584 596 HB THR 78 HB THR 78 28.079 -2.632 -7.580 597 HG1 THR 78 HG1 THR 78 26.246 -3.948 -7.970 598 HG21 THR 78 1HG2 THR 78 27.998 -1.193 -9.803 599 HG22 THR 78 2HG2 THR 78 26.689 -2.307 -10.263 600 HG23 THR 78 3HG2 THR 78 26.531 -1.304 -8.801 601 H LYS 79 HN LYS 79 27.853 -5.737 -9.634 602 HA LYS 79 HA LYS 79 28.579 -5.843 -12.459 603 HB2 LYS 79 2HB LYS 79 27.199 -8.029 -10.908 604 HB3 LYS 79 3HB LYS 79 28.168 -8.155 -12.362 605 HG2 LYS 79 2HG LYS 79 30.066 -7.097 -10.774 606 HG3 LYS 79 3HG LYS 79 29.067 -7.779 -9.506 607 HD2 LYS 79 2HD LYS 79 29.737 -9.523 -11.878 608 HD3 LYS 79 3HD LYS 79 30.996 -9.218 -10.698 609 HE2 LYS 79 2HE LYS 79 29.663 -10.153 -8.895 610 HE3 LYS 79 3HE LYS 79 28.220 -10.188 -9.888 611 HZ1 LYS 79 2HZ LYS 79 30.545 -11.682 -10.862 612 HZ3 LYS 79 1HZ LYS 79 28.963 -12.037 -11.015 613 H MET 80 HN MET 80 26.034 -4.887 -10.343 614 HA MET 80 HA MET 80 23.768 -5.648 -11.534 615 HB2 MET 80 2HB MET 80 24.619 -2.931 -10.410 616 HB3 MET 80 3HB MET 80 22.959 -3.241 -10.879 617 HG2 MET 80 2HG MET 80 24.324 -5.214 -9.037 618 HG3 MET 80 3HG MET 80 23.785 -3.686 -8.371 619 HE1 MET 80 3HE MET 80 20.917 -3.166 -10.212 620 HE2 MET 80 1HE MET 80 20.067 -3.608 -8.712 621 HE3 MET 80 2HE MET 80 21.599 -2.707 -8.633 622 H ILE 81 HN ILE 81 23.588 -5.883 -13.759 623 HA ILE 81 HA ILE 81 24.666 -4.034 -15.580 624 HB ILE 81 HB ILE 81 22.806 -6.366 -15.711 625 HG12 ILE 81 2HG1 ILE 81 24.704 -6.835 -17.535 626 HG13 ILE 81 3HG1 ILE 81 25.591 -5.690 -16.550 627 HG21 ILE 81 1HG2 ILE 81 21.751 -4.818 -17.230 628 HG22 ILE 81 2HG2 ILE 81 23.314 -4.435 -17.990 629 HG23 ILE 81 3HG2 ILE 81 22.614 -6.063 -18.164 630 HD11 ILE 81 3HD1 ILE 81 26.027 -7.354 -15.081 631 HD12 ILE 81 1HD1 ILE 81 24.287 -7.443 -14.717 632 HD13 ILE 81 2HD1 ILE 81 24.983 -8.470 -15.993 633 H PHE 82 HN PHE 82 21.839 -3.996 -13.564 634 HA PHE 82 HA PHE 82 19.963 -2.697 -14.998 635 HB2 PHE 82 2HB PHE 82 20.170 -3.406 -12.466 636 HB3 PHE 82 3HB PHE 82 20.923 -1.844 -12.210 637 HD1 PHE 82 HD1 PHE 82 17.960 -2.888 -14.235 638 HD2 PHE 82 HD2 PHE 82 19.451 -0.484 -11.073 639 HE1 PHE 82 HE1 PHE 82 15.695 -1.842 -13.963 640 HE2 PHE 82 HE2 PHE 82 17.187 0.563 -10.800 641 HZ PHE 82 HZ PHE 82 15.336 -0.128 -12.248 642 H VAL 83 HN VAL 83 19.300 -0.280 -14.774 643 HA VAL 83 HA VAL 83 21.702 1.350 -15.242 644 HB VAL 83 HB VAL 83 19.997 2.710 -16.648 645 HG11 VAL 83 1HG1 VAL 83 21.780 1.833 -17.837 646 HG12 VAL 83 2HG1 VAL 83 21.392 0.153 -17.393 647 HG13 VAL 83 3HG1 VAL 83 20.402 1.004 -18.602 648 HG21 VAL 83 3HG2 VAL 83 17.978 1.523 -15.992 649 HG22 VAL 83 1HG2 VAL 83 18.268 1.302 -17.735 650 HG23 VAL 83 2HG2 VAL 83 18.650 -0.011 -16.596 651 H GLY 84 HN GLY 84 18.316 1.226 -13.996 652 HA2 GLY 84 1HA GLY 84 18.304 2.232 -11.664 653 HA3 GLY 84 2HA GLY 84 18.875 3.685 -12.460 654 H ILE 85 HN ILE 85 16.644 4.223 -11.220 655 HA ILE 85 HA ILE 85 14.610 4.153 -13.327 656 HB ILE 85 HB ILE 85 14.008 3.775 -10.397 657 HG12 ILE 85 2HG1 ILE 85 14.262 1.697 -12.588 658 HG13 ILE 85 3HG1 ILE 85 15.245 1.831 -11.143 659 HG21 ILE 85 1HG2 ILE 85 12.276 3.457 -12.863 660 HG22 ILE 85 2HG2 ILE 85 11.777 3.191 -11.176 661 HG23 ILE 85 3HG2 ILE 85 12.229 4.824 -11.723 662 HD11 ILE 85 3HD1 ILE 85 12.305 1.086 -11.339 663 HD12 ILE 85 1HD1 ILE 85 13.639 0.144 -10.631 664 HD13 ILE 85 2HD1 ILE 85 13.039 1.600 -9.802 665 H LYS 86 HN LYS 86 13.245 6.027 -13.404 666 HA LYS 86 HA LYS 86 14.462 8.296 -12.008 667 HB2 LYS 86 2HB LYS 86 14.305 8.068 -14.614 668 HB3 LYS 86 3HB LYS 86 12.635 8.541 -14.383 669 HG2 LYS 86 2HG LYS 86 14.843 10.141 -13.056 670 HG3 LYS 86 3HG LYS 86 14.486 10.397 -14.753 671 HD2 LYS 86 2HD LYS 86 12.253 11.123 -14.302 672 HD3 LYS 86 3HD LYS 86 12.255 10.431 -12.692 673 HE2 LYS 86 2HE LYS 86 13.563 12.172 -11.789 674 HE3 LYS 86 3HE LYS 86 14.291 12.571 -13.332 675 HZ1 LYS 86 2HZ LYS 86 12.721 14.261 -12.957 676 HZ3 LYS 86 1HZ LYS 86 11.570 13.253 -12.401 677 H LYS 87 HN LYS 87 11.414 6.546 -12.691 678 HA LYS 87 HA LYS 87 9.833 8.459 -11.269 679 HB2 LYS 87 2HB LYS 87 9.293 5.739 -12.471 680 HB3 LYS 87 3HB LYS 87 8.086 6.596 -11.535 681 HG2 LYS 87 2HG LYS 87 9.507 7.742 -13.985 682 HG3 LYS 87 3HG LYS 87 7.909 7.023 -14.012 683 HD2 LYS 87 2HD LYS 87 8.789 9.578 -12.615 684 HD3 LYS 87 3HD LYS 87 7.550 9.391 -13.841 685 HE2 LYS 87 2HE LYS 87 6.219 9.531 -11.928 686 HE3 LYS 87 3HE LYS 87 6.406 7.793 -12.048 687 HZ1 LYS 87 2HZ LYS 87 6.957 8.349 -9.831 688 HZ3 LYS 87 1HZ LYS 87 7.882 9.621 -10.248 689 H LYS 88 HN LYS 88 10.109 8.730 -9.116 690 HA LYS 88 HA LYS 88 11.234 6.757 -7.472 691 HB2 LYS 88 2HB LYS 88 11.117 8.332 -5.806 692 HB3 LYS 88 3HB LYS 88 11.069 9.357 -7.226 693 HG2 LYS 88 2HG LYS 88 8.591 8.370 -5.736 694 HG3 LYS 88 3HG LYS 88 9.325 9.941 -5.491 695 HD2 LYS 88 2HD LYS 88 8.865 10.608 -7.790 696 HD3 LYS 88 3HD LYS 88 8.381 8.981 -8.228 697 HE2 LYS 88 2HE LYS 88 6.340 10.218 -7.905 698 HE3 LYS 88 3HE LYS 88 6.494 9.169 -6.510 699 HZ1 LYS 88 2HZ LYS 88 7.798 11.673 -6.068 700 HZ3 LYS 88 1HZ LYS 88 6.638 10.959 -5.174 701 H GLU 89 HN GLU 89 8.077 7.125 -8.821 702 HA GLU 89 HA GLU 89 6.628 5.995 -6.705 703 HB2 GLU 89 2HB GLU 89 5.518 7.309 -8.438 704 HB3 GLU 89 3HB GLU 89 6.054 6.207 -9.690 705 HG2 GLU 89 2HG GLU 89 4.626 4.438 -8.907 706 HG3 GLU 89 3HG GLU 89 4.350 5.229 -7.368 707 HE2 GLU 89 HE2 GLU 89 3.013 5.405 -10.743 708 H GLU 90 HN GLU 90 7.975 4.638 -9.794 709 HA GLU 90 HA GLU 90 7.093 2.066 -9.375 710 HB2 GLU 90 2HB GLU 90 9.656 2.881 -10.808 711 HB3 GLU 90 3HB GLU 90 8.723 1.424 -11.082 712 HG2 GLU 90 2HG GLU 90 7.980 4.287 -11.765 713 HG3 GLU 90 3HG GLU 90 8.067 2.904 -12.838 714 HE2 GLU 90 HE2 GLU 90 4.899 3.751 -12.571 715 H ARG 91 HN ARG 91 9.769 3.876 -7.952 716 HA ARG 91 HA ARG 91 11.266 1.648 -7.173 717 HB2 ARG 91 2HB ARG 91 11.129 4.518 -6.134 718 HB3 ARG 91 3HB ARG 91 12.278 3.351 -5.510 719 HG2 ARG 91 2HG ARG 91 12.909 2.980 -8.051 720 HG3 ARG 91 3HG ARG 91 12.110 4.520 -8.305 721 HD2 ARG 91 2HD ARG 91 14.255 4.194 -6.168 722 HD3 ARG 91 3HD ARG 91 14.678 4.542 -7.832 723 HE ARG 91 HE ARG 91 13.308 6.360 -5.949 724 HH11 ARG 91 2HH2 ARG 91 14.256 5.750 -9.308 725 HH12 ARG 91 1HH2 ARG 91 14.094 7.407 -9.785 726 HH22 ARG 91 HH1 ARG 91 13.410 9.034 -8.164 727 H ALA 92 HN ALA 92 8.637 3.594 -5.669 728 HA ALA 92 HA ALA 92 8.826 2.440 -3.110 729 HB1 ALA 92 3HB ALA 92 6.337 3.297 -3.095 730 HB2 ALA 92 1HB ALA 92 7.673 4.468 -3.195 731 HB3 ALA 92 2HB ALA 92 6.775 4.014 -4.664 732 H ASP 93 HN ASP 93 6.541 1.824 -5.874 733 HA ASP 93 HA ASP 93 5.222 -0.252 -4.709 734 HB2 ASP 93 2HB ASP 93 5.971 -0.011 -7.660 735 HB3 ASP 93 3HB ASP 93 4.625 -0.931 -7.016 736 HD2 ASP 93 HD2 ASP 93 4.615 2.302 -5.530 737 H LEU 94 HN LEU 94 8.311 -0.139 -6.568 738 HA LEU 94 HA LEU 94 8.649 -2.905 -6.842 739 HB2 LEU 94 2HB LEU 94 9.806 -1.265 -8.201 740 HB3 LEU 94 3HB LEU 94 10.644 -0.639 -6.795 741 HG LEU 94 HG LEU 94 11.921 -2.200 -8.375 742 HD11 LEU 94 1HD1 LEU 94 13.334 -2.909 -6.658 743 HD12 LEU 94 2HD1 LEU 94 12.512 -1.485 -5.975 744 HD13 LEU 94 3HD1 LEU 94 11.991 -3.122 -5.507 745 HD21 LEU 94 3HD2 LEU 94 9.864 -3.865 -8.225 746 HD22 LEU 94 1HD2 LEU 94 11.531 -4.448 -8.445 747 HD23 LEU 94 2HD2 LEU 94 10.781 -4.488 -6.833 748 H ILE 95 HN ILE 95 9.404 -0.581 -4.227 749 HA ILE 95 HA ILE 95 10.815 -2.608 -2.738 750 HB ILE 95 HB ILE 95 10.153 0.289 -2.323 751 HG12 ILE 95 2HG1 ILE 95 12.841 -1.085 -2.241 752 HG13 ILE 95 3HG1 ILE 95 12.109 -0.580 -3.750 753 HG21 ILE 95 1HG2 ILE 95 10.944 -1.732 -0.260 754 HG22 ILE 95 2HG2 ILE 95 11.619 -0.087 -0.172 755 HG23 ILE 95 3HG2 ILE 95 9.856 -0.328 -0.133 756 HD11 ILE 95 3HD1 ILE 95 12.265 1.402 -1.473 757 HD12 ILE 95 1HD1 ILE 95 13.717 1.068 -2.445 758 HD13 ILE 95 2HD1 ILE 95 12.251 1.703 -3.228 759 H ALA 96 HN ALA 96 7.552 -1.577 -3.261 760 HA ALA 96 HA ALA 96 6.566 -2.257 -0.677 761 HB1 ALA 96 3HB ALA 96 4.721 -2.349 -2.991 762 HB2 ALA 96 1HB ALA 96 4.627 -1.398 -1.490 763 HB3 ALA 96 2HB ALA 96 5.643 -0.834 -2.839 764 H TYR 97 HN TYR 97 7.409 -3.983 -3.635 765 HA TYR 97 HA TYR 97 5.950 -6.345 -2.730 766 HB2 TYR 97 2HB TYR 97 5.750 -5.743 -5.102 767 HB3 TYR 97 3HB TYR 97 7.462 -5.391 -5.222 768 HD1 TYR 97 HD2 TYR 97 5.787 -8.414 -3.786 769 HD2 TYR 97 HD1 TYR 97 8.245 -6.821 -6.904 770 HE1 TYR 97 HE2 TYR 97 6.213 -10.764 -4.660 771 HE2 TYR 97 HE1 TYR 97 8.664 -9.176 -7.767 772 HH TYR 97 HH TYR 97 7.871 -11.929 -5.945 773 H LEU 98 HN LEU 98 9.241 -5.023 -3.189 774 HA LEU 98 HA LEU 98 10.511 -7.542 -2.772 775 HB2 LEU 98 2HB LEU 98 11.455 -4.687 -2.904 776 HB3 LEU 98 3HB LEU 98 12.539 -6.001 -2.494 777 HG LEU 98 HG LEU 98 11.018 -5.630 -5.087 778 HD11 LEU 98 1HD1 LEU 98 12.973 -4.986 -6.065 779 HD12 LEU 98 2HD1 LEU 98 13.261 -4.376 -4.417 780 HD13 LEU 98 3HD1 LEU 98 13.983 -5.919 -4.934 781 HD21 LEU 98 3HD2 LEU 98 10.977 -7.881 -5.136 782 HD22 LEU 98 1HD2 LEU 98 12.686 -7.700 -5.599 783 HD23 LEU 98 2HD2 LEU 98 12.254 -8.044 -3.906 784 H LYS 99 HN LYS 99 8.926 -5.234 -0.759 785 HA LYS 99 HA LYS 99 10.490 -6.048 1.567 786 HB2 LYS 99 2HB LYS 99 10.136 -3.654 1.270 787 HB3 LYS 99 3HB LYS 99 8.400 -3.882 1.195 788 HG2 LYS 99 2HG LYS 99 8.281 -4.578 3.499 789 HG3 LYS 99 3HG LYS 99 10.013 -4.818 3.601 790 HD2 LYS 99 2HD LYS 99 10.422 -2.403 3.409 791 HD3 LYS 99 3HD LYS 99 8.725 -2.096 3.093 792 HE2 LYS 99 2HE LYS 99 9.567 -1.695 5.514 793 HE3 LYS 99 3HE LYS 99 8.080 -2.603 5.326 794 HZ1 LYS 99 2HZ LYS 99 9.152 -4.586 5.860 795 HZ3 LYS 99 1HZ LYS 99 9.955 -3.550 6.827 796 H LYS 100 HN LYS 100 7.653 -6.845 -0.220 797 HA LYS 100 HA LYS 100 6.465 -8.083 2.158 798 HB2 LYS 100 2HB LYS 100 5.154 -6.422 0.688 799 HB3 LYS 100 3HB LYS 100 5.109 -7.696 -0.513 800 HG2 LYS 100 2HG LYS 100 4.174 -9.234 1.339 801 HG3 LYS 100 3HG LYS 100 3.991 -7.796 2.323 802 HD2 LYS 100 2HD LYS 100 2.716 -6.833 0.201 803 HD3 LYS 100 3HD LYS 100 2.564 -8.519 -0.251 804 HE2 LYS 100 2HE LYS 100 0.602 -7.668 1.085 805 HE3 LYS 100 3HE LYS 100 1.385 -9.054 1.816 806 HZ1 LYS 100 2HZ LYS 100 0.905 -6.808 3.157 807 HZ3 LYS 100 1HZ LYS 100 2.409 -6.456 2.643 808 H ALA 101 HN ALA 101 8.354 -8.653 -0.666 809 HA ALA 101 HA ALA 101 7.430 -11.369 -1.010 810 HB1 ALA 101 3HB ALA 101 8.047 -10.159 -2.993 811 HB2 ALA 101 1HB ALA 101 9.606 -9.674 -2.286 812 HB3 ALA 101 2HB ALA 101 9.315 -11.377 -2.713 813 H THR 102 HN THR 102 10.321 -9.589 0.235 814 HA THR 102 HA THR 102 11.423 -12.121 1.186 815 HB THR 102 HB THR 102 13.474 -10.887 1.355 816 HG1 THR 102 HG1 THR 102 13.257 -8.823 2.125 817 HG21 THR 102 1HG2 THR 102 11.941 -9.397 -0.837 818 HG22 THR 102 2HG2 THR 102 13.704 -9.618 -0.730 819 HG23 THR 102 3HG2 THR 102 12.651 -11.014 -1.061 820 H ASN 103 HN ASN 103 8.902 -10.934 2.302 821 HA ASN 103 HA ASN 103 9.903 -10.794 5.030 822 HB2 ASN 103 2HB ASN 103 9.187 -8.506 4.270 823 HB3 ASN 103 3HB ASN 103 7.609 -9.140 3.848 824 HD21 ASN 103 1HD2 ASN 103 6.708 -7.619 5.288 825 HD22 ASN 103 2HD2 ASN 103 6.664 -7.891 6.998 826 H GLU 104 HN GLU 104 8.564 -12.797 2.984 827 HA GLU 104 HA GLU 104 6.406 -13.557 4.791 828 HB2 GLU 104 2HB GLU 104 5.292 -14.561 2.699 829 HB3 GLU 104 3HB GLU 104 5.256 -12.815 2.848 830 HG2 GLU 104 2HG GLU 104 6.937 -12.502 1.199 831 HG3 GLU 104 3HG GLU 104 7.543 -14.139 1.362 832 HE2 GLU 104 HE2 GLU 104 5.589 -13.471 -1.600 833 HHA HEC 500 HHA HEC 500 24.128 -6.764 -5.314 834 HHB HEC 500 HHB HEC 500 18.107 -4.606 -5.389 835 HHC HEC 500 HHC HEC 500 17.996 -5.955 -11.694 836 HHD HEC 500 HHD HEC 500 23.257 -9.523 -10.969 837 HMA1 HEC 500 1HMA HEC 500 18.931 -4.552 -3.218 838 HMA2 HEC 500 2HMA HEC 500 20.461 -4.565 -2.334 839 HMA3 HEC 500 3HMA HEC 500 20.117 -3.243 -3.463 840 HAA1 HEC 500 1HAA HEC 500 23.933 -5.641 -3.636 841 HAA2 HEC 500 2HAA HEC 500 22.853 -4.664 -2.775 842 HBA1 HEC 500 1HBA HEC 500 23.024 -7.684 -2.732 843 HBA2 HEC 500 2HBA HEC 500 23.155 -6.551 -1.373 844 HMB1 HEC 500 1HMB HEC 500 14.937 -4.850 -7.442 845 HMB2 HEC 500 2HMB HEC 500 15.963 -4.768 -6.027 846 HMB3 HEC 500 3HMB HEC 500 15.838 -3.344 -7.082 847 HAB HEC 500 HAB HEC 500 16.419 -4.552 -11.219 848 HBB1 HEC 500 1HBB HEC 500 15.897 -2.559 -10.175 849 HBB2 HEC 500 2HBB HEC 500 14.380 -3.363 -10.657 850 HBB3 HEC 500 3HBB HEC 500 14.862 -3.334 -8.972 851 HMC1 HEC 500 1HMC HEC 500 18.231 -8.717 -13.440 852 HMC2 HEC 500 2HMC HEC 500 18.324 -6.957 -13.602 853 HMC3 HEC 500 3HMC HEC 500 19.475 -7.962 -14.457 854 HAC HEC 500 HAC HEC 500 22.155 -10.399 -12.532 855 HBC1 HEC 500 1HBC HEC 500 22.290 -10.346 -14.898 856 HBC2 HEC 500 2HBC HEC 500 20.979 -9.149 -15.003 857 HBC3 HEC 500 3HBC HEC 500 22.538 -8.674 -14.334 858 HMD1 HEC 500 1HMD HEC 500 25.126 -10.905 -9.118 859 HMD2 HEC 500 2HMD HEC 500 25.501 -9.687 -10.349 860 HMD3 HEC 500 3HMD HEC 500 26.430 -9.771 -8.825 861 HAD1 HEC 500 1HAD HEC 500 25.873 -7.749 -5.678 862 HAD2 HEC 500 2HAD HEC 500 26.183 -9.294 -6.345 863 HBD1 HEC 500 1HBD HEC 500 28.046 -8.110 -7.119 864 HBD2 HEC 500 2HBD HEC 500 26.933 -7.852 -8.480
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