NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
591482 | 2mqj | 25036 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 9 H MET 9 1.808 0.000 0.855 2 HA MET 9 HA MET 9 1.731 0.813 -1.854 3 HB2 MET 9 2HB MET 9 3.966 -0.653 -0.444 4 HB3 MET 9 3HB MET 9 4.102 0.341 -1.889 5 HG2 MET 9 2HG MET 9 4.684 1.984 -0.515 6 HG3 MET 9 3HG MET 9 2.978 2.064 -0.082 7 HE1 MET 9 3HE MET 9 6.382 1.314 0.561 8 HE2 MET 9 1HE MET 9 6.352 2.003 2.184 9 HE3 MET 9 2HE MET 9 6.502 0.259 1.970 10 H LYS 10 H LYS 10 0.075 -0.734 -2.587 11 HA LYS 10 HA LYS 10 1.333 -3.238 -3.485 12 HB2 LYS 10 2HB LYS 10 -1.287 -2.828 -2.125 13 HB3 LYS 10 3HB LYS 10 -1.200 -4.048 -3.388 14 HG2 LYS 10 2HG LYS 10 0.433 -5.287 -2.210 15 HG3 LYS 10 3HG LYS 10 0.703 -3.972 -1.064 16 HD2 LYS 10 2HD LYS 10 -0.691 -5.185 0.235 17 HD3 LYS 10 3HD LYS 10 -1.939 -4.373 -0.712 18 HE2 LYS 10 2HE LYS 10 -2.657 -6.480 -1.074 19 HE3 LYS 10 3HE LYS 10 -1.410 -6.470 -2.319 20 HZ1 LYS 10 3HZ LYS 10 -1.067 -7.487 0.451 21 HZ2 LYS 10 1HZ LYS 10 0.115 -7.497 -0.760 22 HZ3 LYS 10 2HZ LYS 10 -1.275 -8.445 -0.928 23 H ILE 11 H ILE 11 0.850 -3.903 -5.560 24 HA ILE 11 HA ILE 11 -0.889 -2.139 -7.146 25 HB ILE 11 HB ILE 11 0.724 -2.382 -9.044 26 HG12 ILE 11 2HG1 ILE 11 2.937 -2.964 -7.168 27 HG13 ILE 11 3HG1 ILE 11 1.888 -4.323 -7.555 28 HG21 ILE 11 1HG2 ILE 11 2.233 -0.642 -8.264 29 HG22 ILE 11 2HG2 ILE 11 0.593 -0.343 -7.692 30 HG23 ILE 11 3HG2 ILE 11 1.804 -1.000 -6.592 31 HD11 ILE 11 3HD1 ILE 11 3.777 -2.830 -9.272 32 HD12 ILE 11 1HD1 ILE 11 3.418 -4.555 -9.206 33 HD13 ILE 11 2HD1 ILE 11 2.307 -3.453 -10.020 34 H LYS 12 H LYS 12 -2.033 -3.104 -8.798 35 HA LYS 12 HA LYS 12 -1.843 -6.042 -8.944 36 HB2 LYS 12 2HB LYS 12 -4.045 -4.417 -8.205 37 HB3 LYS 12 3HB LYS 12 -4.420 -5.107 -9.778 38 HG2 LYS 12 2HG LYS 12 -3.753 -7.349 -8.764 39 HG3 LYS 12 3HG LYS 12 -3.841 -6.529 -7.203 40 HD2 LYS 12 2HD LYS 12 -6.166 -5.916 -7.658 41 HD3 LYS 12 3HD LYS 12 -6.077 -6.729 -9.222 42 HE2 LYS 12 2HE LYS 12 -6.655 -8.637 -8.247 43 HE3 LYS 12 3HE LYS 12 -5.194 -8.568 -7.264 44 HZ1 LYS 12 3HZ LYS 12 -7.935 -7.922 -6.558 45 HZ2 LYS 12 1HZ LYS 12 -6.758 -6.875 -5.941 46 HZ3 LYS 12 2HZ LYS 12 -6.682 -8.529 -5.597 47 H ILE 13 H ILE 13 -1.155 -6.734 -10.849 48 HA ILE 13 HA ILE 13 -1.722 -5.095 -13.232 49 HB ILE 13 HB ILE 13 0.505 -7.109 -12.950 50 HG12 ILE 13 2HG1 ILE 13 1.700 -4.636 -13.047 51 HG13 ILE 13 3HG1 ILE 13 0.300 -4.330 -12.025 52 HG21 ILE 13 1HG2 ILE 13 0.604 -4.872 -14.879 53 HG22 ILE 13 2HG2 ILE 13 1.160 -6.537 -15.041 54 HG23 ILE 13 3HG2 ILE 13 -0.554 -6.159 -15.214 55 HD11 ILE 13 3HD1 ILE 13 1.556 -6.760 -11.207 56 HD12 ILE 13 1HD1 ILE 13 2.756 -5.472 -11.302 57 HD13 ILE 13 2HD1 ILE 13 1.317 -5.265 -10.303 58 H VAL 14 H VAL 14 -3.172 -5.919 -14.572 59 HA VAL 14 HA VAL 14 -3.710 -8.802 -14.502 60 HB VAL 14 HB VAL 14 -5.682 -7.490 -14.144 61 HG11 VAL 14 1HG1 VAL 14 -5.837 -5.435 -14.970 62 HG12 VAL 14 2HG1 VAL 14 -4.464 -5.726 -16.039 63 HG13 VAL 14 3HG1 VAL 14 -6.097 -6.126 -16.571 64 HG21 VAL 14 3HG2 VAL 14 -5.725 -8.457 -17.000 65 HG22 VAL 14 1HG2 VAL 14 -5.868 -9.499 -15.585 66 HG23 VAL 14 2HG2 VAL 14 -7.106 -8.287 -15.917 67 HA PRO 15 HA PRO 15 -1.399 -8.904 -18.359 68 HB2 PRO 15 2HB PRO 15 -1.346 -11.613 -18.519 69 HB3 PRO 15 3HB PRO 15 -0.253 -10.691 -17.480 70 HG2 PRO 15 2HG PRO 15 -2.780 -12.129 -16.767 71 HG3 PRO 15 3HG PRO 15 -1.234 -12.085 -15.899 72 HD2 PRO 15 2HD PRO 15 -3.359 -10.573 -15.169 73 HD3 PRO 15 3HD PRO 15 -1.682 -10.032 -14.950 74 H ALA 16 H ALA 16 -2.171 -8.844 -20.380 75 HA ALA 16 HA ALA 16 -4.908 -9.696 -20.865 76 HB1 ALA 16 1HB ALA 16 -4.766 -8.449 -22.913 77 HB2 ALA 16 2HB ALA 16 -4.098 -7.470 -21.606 78 HB3 ALA 16 3HB ALA 16 -3.019 -8.282 -22.740 79 H VAL 17 H VAL 17 -3.677 -11.958 -20.465 80 HA VAL 17 HA VAL 17 -2.703 -13.014 -23.015 81 HB VAL 17 HB VAL 17 -2.212 -15.081 -21.681 82 HG11 VAL 17 1HG1 VAL 17 -0.195 -14.154 -21.648 83 HG12 VAL 17 2HG1 VAL 17 -0.898 -12.535 -21.632 84 HG13 VAL 17 3HG1 VAL 17 -0.607 -13.387 -20.115 85 HG21 VAL 17 3HG2 VAL 17 -3.883 -14.666 -19.906 86 HG22 VAL 17 1HG2 VAL 17 -2.269 -14.976 -19.267 87 HG23 VAL 17 2HG2 VAL 17 -2.894 -13.328 -19.321 88 H GLY 18 H GLY 18 -5.247 -12.445 -23.385 89 HA2 GLY 18 2HA GLY 18 -7.320 -13.289 -23.906 90 HA3 GLY 18 3HA GLY 18 -6.459 -14.797 -24.177 91 H GLY 19 H GLY 19 -7.989 -12.830 -21.653 92 HA2 GLY 19 2HA GLY 19 -9.420 -13.539 -19.970 93 HA3 GLY 19 3HA GLY 19 -9.193 -15.193 -20.517 94 H GLY 20 H GLY 20 -6.387 -13.281 -19.880 95 HA2 GLY 20 2HA GLY 20 -5.289 -15.090 -18.062 96 HA3 GLY 20 3HA GLY 20 -4.763 -13.426 -18.265 97 H SER 21 H SER 21 -4.399 -14.028 -15.850 98 HA SER 21 HA SER 21 -6.752 -13.062 -14.367 99 HB2 SER 21 2HB SER 21 -5.914 -15.595 -14.115 100 HB3 SER 21 3HB SER 21 -4.825 -14.834 -12.954 101 HG SER 21 HG SER 21 -7.340 -15.501 -12.587 102 HA PRO 22 HA PRO 22 -4.072 -9.895 -12.895 103 HB2 PRO 22 2HB PRO 22 -5.441 -9.187 -10.660 104 HB3 PRO 22 3HB PRO 22 -5.983 -8.771 -12.291 105 HG2 PRO 22 2HG PRO 22 -6.884 -10.998 -10.504 106 HG3 PRO 22 3HG PRO 22 -7.855 -9.916 -11.520 107 HD2 PRO 22 2HD PRO 22 -7.223 -12.440 -12.269 108 HD3 PRO 22 3HD PRO 22 -7.416 -11.118 -13.438 109 H LEU 23 H LEU 23 -2.415 -9.591 -11.447 110 HA LEU 23 HA LEU 23 -2.165 -11.548 -9.263 111 HB2 LEU 23 2HB LEU 23 -0.640 -11.542 -11.554 112 HB3 LEU 23 3HB LEU 23 0.366 -10.663 -10.405 113 HG LEU 23 HG LEU 23 0.115 -12.625 -8.847 114 HD11 LEU 23 1HD1 LEU 23 -1.621 -13.945 -9.444 115 HD12 LEU 23 2HD1 LEU 23 -0.371 -14.754 -10.389 116 HD13 LEU 23 3HD1 LEU 23 -1.446 -13.591 -11.163 117 HD21 LEU 23 3HD2 LEU 23 1.758 -12.287 -11.152 118 HD22 LEU 23 1HD2 LEU 23 1.433 -14.006 -10.929 119 HD23 LEU 23 2HD2 LEU 23 2.146 -13.066 -9.618 120 H GLU 24 H GLU 24 -1.379 -10.795 -7.348 121 HA GLU 24 HA GLU 24 -1.017 -7.892 -7.162 122 HB2 GLU 24 2HB GLU 24 -1.520 -8.118 -4.809 123 HB3 GLU 24 3HB GLU 24 -2.755 -8.946 -5.746 124 HG2 GLU 24 2HG GLU 24 -0.899 -10.921 -5.255 125 HG3 GLU 24 3HG GLU 24 -0.915 -9.985 -3.761 126 H LEU 25 H LEU 25 0.904 -7.020 -6.734 127 HA LEU 25 HA LEU 25 2.958 -8.604 -5.392 128 HB2 LEU 25 2HB LEU 25 2.945 -7.997 -8.197 129 HB3 LEU 25 3HB LEU 25 4.306 -7.196 -7.416 130 HG LEU 25 HG LEU 25 5.052 -9.300 -8.270 131 HD11 LEU 25 1HD1 LEU 25 5.729 -8.510 -5.931 132 HD12 LEU 25 2HD1 LEU 25 6.060 -10.187 -6.362 133 HD13 LEU 25 3HD1 LEU 25 4.680 -9.798 -5.337 134 HD21 LEU 25 3HD2 LEU 25 3.440 -11.053 -6.604 135 HD22 LEU 25 1HD2 LEU 25 3.832 -11.165 -8.320 136 HD23 LEU 25 2HD2 LEU 25 2.479 -10.166 -7.789 137 H GLU 26 H GLU 26 4.784 -7.292 -4.652 138 HA GLU 26 HA GLU 26 3.883 -4.592 -3.950 139 HB2 GLU 26 2HB GLU 26 5.687 -4.722 -2.215 140 HB3 GLU 26 3HB GLU 26 4.414 -5.921 -2.034 141 HG2 GLU 26 2HG GLU 26 5.876 -7.574 -2.137 142 HG3 GLU 26 3HG GLU 26 6.520 -6.975 -3.664 143 H VAL 27 H VAL 27 4.557 -3.105 -5.358 144 HA VAL 27 HA VAL 27 7.421 -2.962 -5.949 145 HB VAL 27 HB VAL 27 5.388 -2.516 -8.127 146 HG11 VAL 27 1HG1 VAL 27 7.460 -2.890 -9.537 147 HG12 VAL 27 2HG1 VAL 27 7.416 -1.399 -8.594 148 HG13 VAL 27 3HG1 VAL 27 8.384 -2.766 -8.041 149 HG21 VAL 27 3HG2 VAL 27 6.185 -4.732 -9.020 150 HG22 VAL 27 1HG2 VAL 27 6.897 -5.027 -7.433 151 HG23 VAL 27 2HG2 VAL 27 5.153 -4.819 -7.593 152 H ALA 28 H ALA 28 8.129 -0.848 -6.634 153 HA ALA 28 HA ALA 28 6.316 1.287 -5.718 154 HB1 ALA 28 1HB ALA 28 7.944 1.964 -4.376 155 HB2 ALA 28 2HB ALA 28 8.967 0.642 -4.940 156 HB3 ALA 28 3HB ALA 28 9.003 2.199 -5.767 157 HA PRO 29 HA PRO 29 6.489 2.503 -10.024 158 HB2 PRO 29 2HB PRO 29 4.718 4.546 -9.774 159 HB3 PRO 29 3HB PRO 29 4.223 2.852 -9.869 160 HG2 PRO 29 2HG PRO 29 4.524 4.605 -7.461 161 HG3 PRO 29 3HG PRO 29 3.236 3.450 -7.850 162 HD2 PRO 29 2HD PRO 29 5.248 2.866 -6.134 163 HD3 PRO 29 3HD PRO 29 4.482 1.637 -7.161 164 H ASN 30 H ASN 30 7.399 4.241 -7.221 165 HA ASN 30 HA ASN 30 8.250 6.615 -8.652 166 HB2 ASN 30 2HB ASN 30 8.914 7.473 -6.503 167 HB3 ASN 30 3HB ASN 30 7.337 6.711 -6.321 168 HD21 ASN 30 1HD2 ASN 30 10.017 7.171 -4.714 169 HD22 ASN 30 2HD2 ASN 30 10.166 5.682 -3.850 170 H ALA 31 H ALA 31 9.410 3.673 -8.744 171 HA ALA 31 HA ALA 31 12.230 4.385 -8.342 172 HB1 ALA 31 1HB ALA 31 12.269 2.377 -7.377 173 HB2 ALA 31 2HB ALA 31 10.697 1.937 -8.048 174 HB3 ALA 31 3HB ALA 31 12.160 1.706 -9.005 175 H THR 32 H THR 32 10.716 2.106 -10.602 176 HA THR 32 HA THR 32 11.510 3.657 -12.903 177 HB THR 32 HB THR 32 12.658 1.123 -13.436 178 HG1 THR 32 HG1 THR 32 13.966 2.277 -11.214 179 HG21 THR 32 3HG2 THR 32 13.174 3.649 -14.106 180 HG22 THR 32 1HG2 THR 32 14.391 2.379 -14.228 181 HG23 THR 32 2HG2 THR 32 14.385 3.464 -12.837 182 H VAL 33 H VAL 33 10.447 3.054 -14.763 183 HA VAL 33 HA VAL 33 8.082 1.516 -14.456 184 HB VAL 33 HB VAL 33 9.386 2.535 -16.984 185 HG11 VAL 33 1HG1 VAL 33 7.050 0.880 -16.527 186 HG12 VAL 33 2HG1 VAL 33 6.652 2.370 -17.384 187 HG13 VAL 33 3HG1 VAL 33 7.875 1.277 -18.034 188 HG21 VAL 33 3HG2 VAL 33 7.170 3.713 -15.308 189 HG22 VAL 33 1HG2 VAL 33 8.827 4.312 -15.396 190 HG23 VAL 33 2HG2 VAL 33 7.790 4.374 -16.821 191 H GLY 34 H GLY 34 11.121 0.939 -16.215 192 HA2 GLY 34 2HA GLY 34 10.410 -1.561 -17.293 193 HA3 GLY 34 3HA GLY 34 12.052 -0.989 -17.040 194 H ALA 35 H ALA 35 11.732 -0.670 -14.165 195 HA ALA 35 HA ALA 35 12.522 -3.255 -13.350 196 HB1 ALA 35 1HB ALA 35 13.333 -1.264 -12.227 197 HB2 ALA 35 2HB ALA 35 11.700 -0.881 -11.681 198 HB3 ALA 35 3HB ALA 35 12.516 -2.323 -11.077 199 H VAL 36 H VAL 36 9.520 -1.424 -12.852 200 HA VAL 36 HA VAL 36 8.230 -3.412 -11.299 201 HB VAL 36 HB VAL 36 6.882 -1.318 -13.004 202 HG11 VAL 36 1HG1 VAL 36 6.009 -3.200 -10.913 203 HG12 VAL 36 2HG1 VAL 36 5.392 -1.553 -10.770 204 HG13 VAL 36 3HG1 VAL 36 5.104 -2.479 -12.244 205 HG21 VAL 36 3HG2 VAL 36 7.018 -0.456 -10.335 206 HG22 VAL 36 1HG2 VAL 36 8.644 -0.988 -10.765 207 HG23 VAL 36 2HG2 VAL 36 7.832 0.241 -11.735 208 H ARG 37 H ARG 37 8.086 -2.597 -14.753 209 HA ARG 37 HA ARG 37 6.153 -4.488 -15.488 210 HB2 ARG 37 2HB ARG 37 6.702 -2.738 -17.019 211 HB3 ARG 37 3HB ARG 37 8.397 -3.208 -17.046 212 HG2 ARG 37 2HG ARG 37 7.901 -5.198 -18.265 213 HG3 ARG 37 3HG ARG 37 6.166 -4.946 -18.069 214 HD2 ARG 37 2HD ARG 37 6.381 -4.087 -20.156 215 HD3 ARG 37 3HD ARG 37 6.788 -2.634 -19.244 216 HE ARG 37 HE ARG 37 9.128 -4.120 -19.718 217 HH11 ARG 37 1HH1 ARG 37 6.776 -2.188 -21.409 218 HH12 ARG 37 2HH1 ARG 37 7.886 -1.679 -22.638 219 HH21 ARG 37 1HH2 ARG 37 10.598 -3.457 -21.330 220 HH22 ARG 37 2HH2 ARG 37 10.060 -2.402 -22.592 221 H THR 38 H THR 38 9.664 -4.725 -15.223 222 HA THR 38 HA THR 38 9.858 -7.342 -16.323 223 HB THR 38 HB THR 38 11.781 -5.878 -14.504 224 HG1 THR 38 HG1 THR 38 12.637 -5.079 -16.330 225 HG21 THR 38 3HG2 THR 38 12.750 -7.906 -14.368 226 HG22 THR 38 1HG2 THR 38 13.271 -7.586 -16.022 227 HG23 THR 38 2HG2 THR 38 11.823 -8.548 -15.724 228 H LYS 39 H LYS 39 9.461 -6.067 -13.068 229 HA LYS 39 HA LYS 39 9.928 -8.473 -11.669 230 HB2 LYS 39 2HB LYS 39 8.744 -5.833 -11.061 231 HB3 LYS 39 3HB LYS 39 8.221 -7.157 -10.029 232 HG2 LYS 39 2HG LYS 39 11.118 -7.008 -10.474 233 HG3 LYS 39 3HG LYS 39 10.419 -5.646 -9.594 234 HD2 LYS 39 2HD LYS 39 10.746 -7.009 -7.817 235 HD3 LYS 39 3HD LYS 39 9.194 -7.675 -8.331 236 HE2 LYS 39 2HE LYS 39 10.249 -9.480 -9.458 237 HE3 LYS 39 3HE LYS 39 11.840 -8.737 -9.298 238 HZ1 LYS 39 3HZ LYS 39 12.049 -9.426 -7.173 239 HZ2 LYS 39 1HZ LYS 39 10.968 -10.628 -7.673 240 HZ3 LYS 39 2HZ LYS 39 10.400 -9.279 -6.826 241 H VAL 40 H VAL 40 6.939 -6.964 -12.849 242 HA VAL 40 HA VAL 40 5.219 -9.006 -11.875 243 HB VAL 40 HB VAL 40 4.347 -6.790 -12.364 244 HG11 VAL 40 1HG1 VAL 40 4.148 -5.933 -14.609 245 HG12 VAL 40 2HG1 VAL 40 5.841 -6.308 -14.279 246 HG13 VAL 40 3HG1 VAL 40 4.871 -7.399 -15.270 247 HG21 VAL 40 3HG2 VAL 40 3.188 -8.934 -14.141 248 HG22 VAL 40 1HG2 VAL 40 2.778 -8.626 -12.453 249 HG23 VAL 40 2HG2 VAL 40 2.366 -7.440 -13.692 250 H CYS 41 H CYS 41 6.816 -8.422 -14.969 251 HA CYS 41 HA CYS 41 5.533 -10.438 -16.445 252 HB2 CYS 41 2HB CYS 41 8.084 -8.912 -16.724 253 HB3 CYS 41 3HB CYS 41 7.849 -10.336 -17.730 254 HG CYS 41 HG CYS 41 7.108 -7.529 -18.690 255 H ALA 42 H ALA 42 8.536 -10.477 -14.558 256 HA ALA 42 HA ALA 42 9.264 -13.133 -15.149 257 HB1 ALA 42 1HB ALA 42 10.629 -12.938 -13.031 258 HB2 ALA 42 2HB ALA 42 10.932 -11.714 -14.265 259 HB3 ALA 42 3HB ALA 42 9.953 -11.319 -12.852 260 H MET 43 H MET 43 7.347 -11.737 -12.518 261 HA MET 43 HA MET 43 7.018 -14.055 -10.991 262 HB2 MET 43 2HB MET 43 5.717 -11.431 -11.195 263 HB3 MET 43 3HB MET 43 4.659 -12.709 -10.612 264 HG2 MET 43 2HG MET 43 5.744 -11.518 -8.783 265 HG3 MET 43 3HG MET 43 6.205 -13.218 -8.825 266 HE1 MET 43 3HE MET 43 9.618 -12.416 -7.712 267 HE2 MET 43 1HE MET 43 7.987 -12.931 -7.283 268 HE3 MET 43 2HE MET 43 8.904 -13.827 -8.494 269 H LYS 44 H LYS 44 5.475 -13.006 -13.929 270 HA LYS 44 HA LYS 44 3.523 -15.185 -13.767 271 HB2 LYS 44 2HB LYS 44 3.721 -13.089 -15.926 272 HB3 LYS 44 3HB LYS 44 2.345 -14.115 -15.542 273 HG2 LYS 44 2HG LYS 44 2.951 -12.677 -13.201 274 HG3 LYS 44 3HG LYS 44 3.001 -11.525 -14.538 275 HD2 LYS 44 2HD LYS 44 0.759 -11.626 -13.640 276 HD3 LYS 44 3HD LYS 44 0.775 -12.324 -15.261 277 HE2 LYS 44 2HE LYS 44 1.300 -14.317 -13.227 278 HE3 LYS 44 3HE LYS 44 -0.232 -13.490 -12.947 279 HZ1 LYS 44 3HZ LYS 44 -1.061 -14.889 -14.445 280 HZ2 LYS 44 1HZ LYS 44 0.467 -15.388 -14.973 281 HZ3 LYS 44 2HZ LYS 44 -0.239 -13.994 -15.621 282 H LYS 45 H LYS 45 6.588 -14.624 -14.930 283 HA LYS 45 HA LYS 45 7.984 -15.787 -16.298 284 HB2 LYS 45 2HB LYS 45 5.794 -17.840 -16.578 285 HB3 LYS 45 3HB LYS 45 7.528 -18.083 -16.744 286 HG2 LYS 45 2HG LYS 45 6.112 -17.366 -14.184 287 HG3 LYS 45 3HG LYS 45 6.646 -18.985 -14.641 288 HD2 LYS 45 2HD LYS 45 8.539 -16.653 -14.488 289 HD3 LYS 45 3HD LYS 45 8.169 -17.660 -13.086 290 HE2 LYS 45 2HE LYS 45 8.733 -19.535 -14.980 291 HE3 LYS 45 3HE LYS 45 9.823 -18.228 -15.442 292 HZ1 LYS 45 3HZ LYS 45 9.916 -19.974 -13.152 293 HZ2 LYS 45 1HZ LYS 45 10.146 -18.342 -12.769 294 HZ3 LYS 45 2HZ LYS 45 11.157 -19.097 -13.896 295 H LEU 46 H LEU 46 6.939 -13.771 -17.576 296 HA LEU 46 HA LEU 46 5.954 -14.829 -20.143 297 HB2 LEU 46 2HB LEU 46 5.425 -12.284 -18.678 298 HB3 LEU 46 3HB LEU 46 5.320 -12.308 -20.437 299 HG LEU 46 HG LEU 46 3.712 -14.078 -18.597 300 HD11 LEU 46 1HD1 LEU 46 2.963 -11.862 -18.231 301 HD12 LEU 46 2HD1 LEU 46 1.821 -12.600 -19.353 302 HD13 LEU 46 3HD1 LEU 46 3.041 -11.476 -19.950 303 HD21 LEU 46 3HD2 LEU 46 2.403 -14.537 -20.614 304 HD22 LEU 46 1HD2 LEU 46 4.083 -15.040 -20.803 305 HD23 LEU 46 2HD2 LEU 46 3.518 -13.551 -21.561 306 HA PRO 47 HA PRO 47 9.531 -13.384 -22.233 307 HB2 PRO 47 2HB PRO 47 8.503 -12.445 -24.563 308 HB3 PRO 47 3HB PRO 47 8.594 -14.168 -24.178 309 HG2 PRO 47 2HG PRO 47 6.265 -12.300 -23.964 310 HG3 PRO 47 3HG PRO 47 6.313 -13.962 -24.579 311 HD2 PRO 47 2HD PRO 47 5.436 -13.354 -22.091 312 HD3 PRO 47 3HD PRO 47 6.263 -14.879 -22.465 313 HA PRO 48 HA PRO 48 9.473 -9.047 -20.978 314 HB2 PRO 48 2HB PRO 48 12.175 -8.820 -20.838 315 HB3 PRO 48 3HB PRO 48 11.205 -9.554 -19.556 316 HG2 PRO 48 2HG PRO 48 12.779 -10.875 -21.732 317 HG3 PRO 48 3HG PRO 48 12.662 -11.307 -20.016 318 HD2 PRO 48 2HD PRO 48 11.269 -12.603 -21.943 319 HD3 PRO 48 3HD PRO 48 10.643 -12.384 -20.296 320 H ASP 49 H ASP 49 11.160 -10.561 -23.644 321 HA ASP 49 HA ASP 49 12.105 -8.227 -24.914 322 HB2 ASP 49 2HB ASP 49 11.767 -11.066 -25.618 323 HB3 ASP 49 3HB ASP 49 11.695 -9.959 -26.986 324 H THR 50 H THR 50 9.079 -10.033 -25.208 325 HA THR 50 HA THR 50 8.005 -7.831 -26.848 326 HB THR 50 HB THR 50 7.952 -9.832 -28.153 327 HG1 THR 50 HG1 THR 50 6.047 -8.992 -28.621 328 HG21 THR 50 3HG2 THR 50 8.191 -11.644 -26.746 329 HG22 THR 50 1HG2 THR 50 6.486 -11.774 -27.175 330 HG23 THR 50 2HG2 THR 50 6.954 -11.074 -25.626 331 H THR 51 H THR 51 7.792 -6.942 -24.531 332 HA THR 51 HA THR 51 5.054 -7.493 -23.655 333 HB THR 51 HB THR 51 6.661 -8.764 -22.181 334 HG1 THR 51 HG1 THR 51 4.899 -6.773 -21.213 335 HG21 THR 51 3HG2 THR 51 7.362 -6.074 -21.034 336 HG22 THR 51 1HG2 THR 51 8.372 -6.861 -22.246 337 HG23 THR 51 2HG2 THR 51 8.093 -7.641 -20.690 338 H ARG 52 H ARG 52 3.939 -5.714 -23.001 339 HA ARG 52 HA ARG 52 5.428 -3.191 -22.741 340 HB2 ARG 52 2HB ARG 52 3.637 -3.895 -24.828 341 HB3 ARG 52 3HB ARG 52 2.835 -2.686 -23.835 342 HG2 ARG 52 2HG ARG 52 5.029 -1.362 -24.045 343 HG3 ARG 52 3HG ARG 52 5.385 -2.458 -25.381 344 HD2 ARG 52 2HD ARG 52 3.420 -1.767 -26.558 345 HD3 ARG 52 3HD ARG 52 2.854 -0.839 -25.170 346 HE ARG 52 HE ARG 52 4.262 0.871 -25.771 347 HH11 ARG 52 1HH1 ARG 52 5.086 -2.000 -27.560 348 HH12 ARG 52 2HH1 ARG 52 6.184 -1.181 -28.621 349 HH21 ARG 52 1HH2 ARG 52 5.706 1.960 -27.161 350 HH22 ARG 52 2HH2 ARG 52 6.537 1.071 -28.393 351 H LEU 53 H LEU 53 4.093 -1.455 -21.699 352 HA LEU 53 HA LEU 53 2.070 -2.516 -19.861 353 HB2 LEU 53 2HB LEU 53 4.727 -1.640 -19.169 354 HB3 LEU 53 3HB LEU 53 3.514 -0.627 -18.389 355 HG LEU 53 HG LEU 53 4.269 -2.487 -16.964 356 HD11 LEU 53 1HD1 LEU 53 1.514 -3.316 -17.473 357 HD12 LEU 53 2HD1 LEU 53 1.726 -1.571 -17.337 358 HD13 LEU 53 3HD1 LEU 53 2.246 -2.628 -16.024 359 HD21 LEU 53 3HD2 LEU 53 4.550 -4.028 -19.013 360 HD22 LEU 53 1HD2 LEU 53 2.835 -4.374 -18.794 361 HD23 LEU 53 2HD2 LEU 53 3.978 -4.729 -17.499 362 H THR 54 H THR 54 0.392 -1.173 -19.495 363 HA THR 54 HA THR 54 0.621 1.604 -20.451 364 HB THR 54 HB THR 54 -2.084 0.741 -20.704 365 HG1 THR 54 HG1 THR 54 -1.923 -1.162 -21.612 366 HG21 THR 54 3HG2 THR 54 -1.702 1.339 -23.079 367 HG22 THR 54 1HG2 THR 54 0.023 1.471 -22.741 368 HG23 THR 54 2HG2 THR 54 -1.115 2.569 -21.960 369 H TYR 55 H TYR 55 -0.041 3.116 -19.058 370 HA TYR 55 HA TYR 55 -1.814 2.322 -16.850 371 HB2 TYR 55 2HB TYR 55 0.521 2.389 -16.039 372 HB3 TYR 55 3HB TYR 55 0.648 4.061 -16.575 373 HD1 TYR 55 HD1 TYR 55 -1.704 2.009 -14.505 374 HD2 TYR 55 HD2 TYR 55 0.469 5.643 -14.917 375 HE1 TYR 55 HE1 TYR 55 -2.567 2.764 -12.329 376 HE2 TYR 55 HE2 TYR 55 -0.387 6.409 -12.742 377 HH TYR 55 HH TYR 55 -2.963 4.944 -11.163 378 H LYS 56 H LYS 56 -3.503 3.625 -16.600 379 HA LYS 56 HA LYS 56 -4.958 5.348 -16.910 380 HB2 LYS 56 2HB LYS 56 -2.845 6.380 -15.632 381 HB3 LYS 56 3HB LYS 56 -2.754 7.334 -17.106 382 HG2 LYS 56 2HG LYS 56 -5.373 7.592 -16.542 383 HG3 LYS 56 3HG LYS 56 -4.715 7.414 -14.914 384 HD2 LYS 56 2HD LYS 56 -4.435 9.651 -15.097 385 HD3 LYS 56 3HD LYS 56 -2.953 9.172 -15.928 386 HE2 LYS 56 2HE LYS 56 -4.574 9.133 -18.019 387 HE3 LYS 56 3HE LYS 56 -5.490 10.268 -17.029 388 HZ1 LYS 56 3HZ LYS 56 -3.705 11.162 -18.631 389 HZ2 LYS 56 1HZ LYS 56 -2.601 10.665 -17.449 390 HZ3 LYS 56 2HZ LYS 56 -3.790 11.807 -17.069 391 H GLY 57 H GLY 57 -4.002 4.014 -19.264 392 HA2 GLY 57 2HA GLY 57 -4.341 4.234 -21.532 393 HA3 GLY 57 3HA GLY 57 -4.941 5.858 -21.229 394 H ARG 58 H ARG 58 -1.892 5.394 -19.878 395 HA ARG 58 HA ARG 58 -0.578 6.530 -22.256 396 HB2 ARG 58 2HB ARG 58 -0.686 7.528 -19.471 397 HB3 ARG 58 3HB ARG 58 0.886 7.602 -20.256 398 HG2 ARG 58 2HG ARG 58 -1.071 8.581 -22.072 399 HG3 ARG 58 3HG ARG 58 -1.293 9.378 -20.513 400 HD2 ARG 58 2HD ARG 58 1.481 9.113 -21.518 401 HD3 ARG 58 3HD ARG 58 0.429 10.253 -22.356 402 HE ARG 58 HE ARG 58 1.619 10.607 -19.808 403 HH11 ARG 58 1HH1 ARG 58 -1.291 11.258 -21.603 404 HH12 ARG 58 2HH1 ARG 58 -1.702 12.664 -20.678 405 HH21 ARG 58 1HH2 ARG 58 1.089 12.456 -18.583 406 HH22 ARG 58 2HH2 ARG 58 -0.348 13.345 -18.961 407 H ALA 59 H ALA 59 1.531 5.900 -22.655 408 HA ALA 59 HA ALA 59 2.376 3.484 -21.233 409 HB1 ALA 59 1HB ALA 59 3.208 2.733 -23.175 410 HB2 ALA 59 2HB ALA 59 2.202 3.988 -23.900 411 HB3 ALA 59 3HB ALA 59 3.911 4.296 -23.593 412 H LEU 60 H LEU 60 3.928 3.596 -19.759 413 HA LEU 60 HA LEU 60 5.808 5.860 -19.862 414 HB2 LEU 60 2HB LEU 60 5.294 4.239 -17.402 415 HB3 LEU 60 3HB LEU 60 5.911 5.884 -17.541 416 HG LEU 60 HG LEU 60 3.065 5.106 -18.158 417 HD11 LEU 60 1HD1 LEU 60 4.127 4.948 -15.686 418 HD12 LEU 60 2HD1 LEU 60 2.456 5.404 -16.013 419 HD13 LEU 60 3HD1 LEU 60 3.669 6.651 -15.728 420 HD21 LEU 60 3HD2 LEU 60 4.568 7.691 -17.972 421 HD22 LEU 60 1HD2 LEU 60 2.826 7.630 -17.699 422 HD23 LEU 60 2HD2 LEU 60 3.494 7.115 -19.248 423 H LYS 61 H LYS 61 8.004 5.475 -19.272 424 HA LYS 61 HA LYS 61 8.977 2.805 -18.894 425 HB2 LYS 61 2HB LYS 61 8.745 3.846 -21.576 426 HB3 LYS 61 3HB LYS 61 10.435 3.571 -21.173 427 HG2 LYS 61 2HG LYS 61 9.988 1.268 -20.647 428 HG3 LYS 61 3HG LYS 61 8.255 1.516 -20.872 429 HD2 LYS 61 2HD LYS 61 10.248 2.023 -23.066 430 HD3 LYS 61 3HD LYS 61 9.533 0.432 -22.794 431 HE2 LYS 61 2HE LYS 61 7.702 1.039 -23.892 432 HE3 LYS 61 3HE LYS 61 7.461 2.394 -22.791 433 HZ1 LYS 61 3HZ LYS 61 8.887 3.747 -24.163 434 HZ2 LYS 61 1HZ LYS 61 7.647 3.097 -25.112 435 HZ3 LYS 61 2HZ LYS 61 9.205 2.444 -25.194 436 H ASP 62 H ASP 62 10.417 5.612 -20.534 437 HA ASP 62 HA ASP 62 12.699 5.556 -18.802 438 HB2 ASP 62 2HB ASP 62 12.404 6.379 -21.321 439 HB3 ASP 62 3HB ASP 62 12.146 7.926 -20.519 440 H THR 63 H THR 63 9.629 6.737 -18.405 441 HA THR 63 HA THR 63 9.989 9.247 -17.226 442 HB THR 63 HB THR 63 7.841 8.827 -16.059 443 HG1 THR 63 HG1 THR 63 8.111 6.585 -15.666 444 HG21 THR 63 3HG2 THR 63 7.381 7.736 -18.779 445 HG22 THR 63 1HG2 THR 63 8.207 9.289 -18.664 446 HG23 THR 63 2HG2 THR 63 6.604 9.088 -17.956 447 H GLU 64 H GLU 64 10.836 6.127 -16.102 448 HA GLU 64 HA GLU 64 11.866 5.401 -14.207 449 HB2 GLU 64 2HB GLU 64 12.428 8.263 -14.284 450 HB3 GLU 64 3HB GLU 64 12.412 7.622 -12.648 451 HG2 GLU 64 2HG GLU 64 13.869 5.793 -14.202 452 HG3 GLU 64 3HG GLU 64 14.428 7.401 -14.658 453 H THR 65 H THR 65 10.434 8.305 -12.777 454 HA THR 65 HA THR 65 8.974 6.601 -10.902 455 HB THR 65 HB THR 65 10.273 8.310 -9.832 456 HG1 THR 65 HG1 THR 65 8.516 9.505 -8.812 457 HG21 THR 65 3HG2 THR 65 10.729 10.118 -11.090 458 HG22 THR 65 1HG2 THR 65 9.222 10.761 -10.438 459 HG23 THR 65 2HG2 THR 65 9.234 9.969 -12.014 460 H LEU 66 H LEU 66 6.751 7.013 -10.397 461 HA LEU 66 HA LEU 66 5.255 8.069 -12.700 462 HB2 LEU 66 2HB LEU 66 5.095 5.618 -11.417 463 HB3 LEU 66 3HB LEU 66 3.712 6.516 -10.795 464 HG LEU 66 HG LEU 66 4.294 6.003 -13.712 465 HD11 LEU 66 1HD1 LEU 66 2.415 4.695 -11.762 466 HD12 LEU 66 2HD1 LEU 66 3.675 3.939 -12.738 467 HD13 LEU 66 3HD1 LEU 66 2.225 4.579 -13.512 468 HD21 LEU 66 3HD2 LEU 66 3.019 7.867 -13.873 469 HD22 LEU 66 1HD2 LEU 66 2.319 7.663 -12.267 470 HD23 LEU 66 2HD2 LEU 66 1.714 6.707 -13.620 471 H GLU 67 H GLU 67 6.057 8.698 -9.493 472 HA GLU 67 HA GLU 67 3.722 9.807 -8.440 473 HB2 GLU 67 2HB GLU 67 6.504 10.861 -7.938 474 HB3 GLU 67 3HB GLU 67 5.119 10.930 -6.858 475 HG2 GLU 67 2HG GLU 67 5.330 8.265 -7.205 476 HG3 GLU 67 3HG GLU 67 7.018 8.747 -7.366 477 H SER 68 H SER 68 6.139 11.163 -10.604 478 HA SER 68 HA SER 68 5.290 13.847 -10.489 479 HB2 SER 68 2HB SER 68 7.306 12.433 -11.794 480 HB3 SER 68 3HB SER 68 6.317 13.084 -13.101 481 HG SER 68 HG SER 68 8.095 14.359 -11.611 482 H LEU 69 H LEU 69 4.027 11.071 -12.117 483 HA LEU 69 HA LEU 69 2.269 12.726 -13.777 484 HB2 LEU 69 2HB LEU 69 2.300 9.738 -13.826 485 HB3 LEU 69 3HB LEU 69 1.895 10.871 -15.114 486 HG LEU 69 HG LEU 69 4.647 10.177 -14.096 487 HD11 LEU 69 1HD1 LEU 69 4.598 9.803 -16.797 488 HD12 LEU 69 2HD1 LEU 69 2.974 9.302 -16.328 489 HD13 LEU 69 3HD1 LEU 69 4.380 8.535 -15.591 490 HD21 LEU 69 3HD2 LEU 69 5.504 11.720 -15.761 491 HD22 LEU 69 1HD2 LEU 69 4.477 12.573 -14.608 492 HD23 LEU 69 2HD2 LEU 69 3.861 12.177 -16.213 493 H GLY 70 H GLY 70 2.297 11.049 -10.836 494 HA2 GLY 70 2HA GLY 70 0.305 11.551 -9.435 495 HA3 GLY 70 3HA GLY 70 -0.659 11.008 -10.800 496 H VAL 71 H VAL 71 1.455 10.013 -8.196 497 HA VAL 71 HA VAL 71 1.016 7.192 -8.774 498 HB VAL 71 HB VAL 71 3.250 7.907 -8.045 499 HG11 VAL 71 1HG1 VAL 71 2.770 8.256 -5.253 500 HG12 VAL 71 2HG1 VAL 71 3.541 9.360 -6.393 501 HG13 VAL 71 3HG1 VAL 71 1.794 9.415 -6.155 502 HG21 VAL 71 3HG2 VAL 71 3.626 6.166 -6.443 503 HG22 VAL 71 1HG2 VAL 71 1.936 6.197 -5.939 504 HG23 VAL 71 2HG2 VAL 71 2.366 5.624 -7.551 505 H ALA 72 H ALA 72 -0.186 5.809 -7.535 506 HA ALA 72 HA ALA 72 -1.526 6.841 -5.152 507 HB1 ALA 72 1HB ALA 72 -3.596 5.522 -6.340 508 HB2 ALA 72 2HB ALA 72 -3.375 7.272 -6.340 509 HB3 ALA 72 3HB ALA 72 -2.830 6.315 -7.717 510 H ASP 73 H ASP 73 -2.204 5.254 -3.702 511 HA ASP 73 HA ASP 73 -0.821 2.729 -3.961 512 HB2 ASP 73 2HB ASP 73 -1.655 2.332 -1.646 513 HB3 ASP 73 3HB ASP 73 -0.750 3.834 -1.813 514 H GLY 74 H GLY 74 -1.680 0.917 -4.726 515 HA2 GLY 74 2HA GLY 74 -3.333 -0.767 -4.853 516 HA3 GLY 74 3HA GLY 74 -4.543 0.420 -4.388 517 H ASP 75 H ASP 75 -2.333 1.389 -6.820 518 HA ASP 75 HA ASP 75 -4.375 1.810 -8.724 519 HB2 ASP 75 2HB ASP 75 -1.364 1.830 -8.943 520 HB3 ASP 75 3HB ASP 75 -2.421 2.225 -10.296 521 H LYS 76 H LYS 76 -3.856 0.983 -11.108 522 HA LYS 76 HA LYS 76 -3.276 -1.886 -11.070 523 HB2 LYS 76 2HB LYS 76 -5.308 -2.261 -12.526 524 HB3 LYS 76 3HB LYS 76 -5.641 -1.902 -10.837 525 HG2 LYS 76 2HG LYS 76 -6.848 -0.125 -11.378 526 HG3 LYS 76 3HG LYS 76 -5.558 0.517 -12.397 527 HD2 LYS 76 2HD LYS 76 -7.377 0.205 -13.850 528 HD3 LYS 76 3HD LYS 76 -6.322 -1.179 -14.143 529 HE2 LYS 76 2HE LYS 76 -7.745 -2.445 -12.476 530 HE3 LYS 76 3HE LYS 76 -8.875 -1.094 -12.552 531 HZ1 LYS 76 3HZ LYS 76 -8.154 -3.015 -14.670 532 HZ2 LYS 76 1HZ LYS 76 -8.795 -1.500 -15.066 533 HZ3 LYS 76 2HZ LYS 76 -9.689 -2.573 -14.113 534 H PHE 77 H PHE 77 -2.058 -2.490 -12.744 535 HA PHE 77 HA PHE 77 -1.863 -0.655 -15.041 536 HB2 PHE 77 2HB PHE 77 0.257 -2.459 -13.858 537 HB3 PHE 77 3HB PHE 77 0.455 -1.505 -15.324 538 HD1 PHE 77 HD2 PHE 77 -0.258 -1.212 -11.694 539 HD2 PHE 77 HD1 PHE 77 1.196 0.695 -15.210 540 HE1 PHE 77 HE2 PHE 77 0.495 0.700 -10.341 541 HE2 PHE 77 HE1 PHE 77 1.952 2.610 -13.863 542 HZ PHE 77 HZ PHE 77 1.601 2.615 -11.425 543 H VAL 78 H VAL 78 -1.673 -1.541 -17.121 544 HA VAL 78 HA VAL 78 -2.764 -4.255 -17.346 545 HB VAL 78 HB VAL 78 -2.586 -2.128 -19.483 546 HG11 VAL 78 1HG1 VAL 78 -2.694 -4.428 -20.329 547 HG12 VAL 78 2HG1 VAL 78 -4.159 -4.701 -19.384 548 HG13 VAL 78 3HG1 VAL 78 -4.162 -3.525 -20.699 549 HG21 VAL 78 3HG2 VAL 78 -4.929 -1.698 -19.088 550 HG22 VAL 78 1HG2 VAL 78 -4.978 -2.936 -17.832 551 HG23 VAL 78 2HG2 VAL 78 -4.034 -1.467 -17.586 552 H LEU 79 H LEU 79 -1.487 -5.868 -17.945 553 HA LEU 79 HA LEU 79 1.084 -5.233 -19.218 554 HB2 LEU 79 2HB LEU 79 1.216 -6.415 -17.086 555 HB3 LEU 79 3HB LEU 79 0.205 -7.706 -17.732 556 HG LEU 79 HG LEU 79 2.748 -7.106 -19.147 557 HD11 LEU 79 1HD1 LEU 79 2.558 -8.025 -16.347 558 HD12 LEU 79 2HD1 LEU 79 3.869 -7.198 -17.188 559 HD13 LEU 79 3HD1 LEU 79 3.640 -8.933 -17.405 560 HD21 LEU 79 3HD2 LEU 79 2.710 -9.637 -19.242 561 HD22 LEU 79 1HD2 LEU 79 1.413 -8.803 -20.097 562 HD23 LEU 79 2HD2 LEU 79 1.100 -9.545 -18.528 563 H ILE 80 H ILE 80 1.339 -5.690 -21.294 564 HA ILE 80 HA ILE 80 -0.481 -7.645 -22.535 565 HB ILE 80 HB ILE 80 -0.658 -5.301 -23.370 566 HG12 ILE 80 2HG1 ILE 80 0.409 -6.722 -25.719 567 HG13 ILE 80 3HG1 ILE 80 -0.739 -7.651 -24.762 568 HG21 ILE 80 1HG2 ILE 80 1.720 -4.716 -23.111 569 HG22 ILE 80 2HG2 ILE 80 2.114 -5.796 -24.447 570 HG23 ILE 80 3HG2 ILE 80 1.116 -4.370 -24.731 571 HD11 ILE 80 3HD1 ILE 80 -1.436 -4.862 -25.511 572 HD12 ILE 80 1HD1 ILE 80 -1.532 -6.128 -26.736 573 HD13 ILE 80 2HD1 ILE 80 -2.480 -6.260 -25.254 574 H THR 81 H THR 81 0.330 -9.172 -23.971 575 HA THR 81 HA THR 81 3.233 -9.337 -24.301 576 HB THR 81 HB THR 81 2.778 -10.689 -22.321 577 HG1 THR 81 HG1 THR 81 4.385 -11.579 -23.525 578 HG21 THR 81 3HG2 THR 81 0.387 -11.179 -22.935 579 HG22 THR 81 1HG2 THR 81 1.297 -12.560 -22.325 580 HG23 THR 81 2HG2 THR 81 0.997 -12.397 -24.055 581 H ARG 82 H ARG 82 3.808 -9.975 -26.287 582 HA ARG 82 HA ARG 82 1.687 -10.914 -28.084 583 HB2 ARG 82 2HB ARG 82 3.759 -9.000 -28.362 584 HB3 ARG 82 3HB ARG 82 4.126 -10.322 -29.462 585 HG2 ARG 82 2HG ARG 82 1.357 -9.240 -29.419 586 HG3 ARG 82 3HG ARG 82 2.627 -8.298 -30.203 587 HD2 ARG 82 2HD ARG 82 3.207 -10.515 -31.398 588 HD3 ARG 82 3HD ARG 82 1.597 -11.025 -30.893 589 HE ARG 82 HE ARG 82 2.247 -9.155 -32.968 590 HH11 ARG 82 1HH1 ARG 82 -0.173 -10.118 -30.659 591 HH12 ARG 82 2HH1 ARG 82 -1.489 -9.442 -31.560 592 HH21 ARG 82 1HH2 ARG 82 0.523 -8.260 -34.164 593 HH22 ARG 82 2HH2 ARG 82 -1.092 -8.386 -33.554 594 H THR 83 H THR 83 2.119 -12.618 -29.586 595 HA THR 83 HA THR 83 3.840 -14.676 -28.439 596 HB THR 83 HB THR 83 2.485 -15.622 -30.763 597 HG1 THR 83 HG1 THR 83 0.627 -14.574 -28.913 598 HG21 THR 83 3HG2 THR 83 3.167 -16.676 -28.449 599 HG22 THR 83 1HG2 THR 83 1.785 -17.297 -29.350 600 HG23 THR 83 2HG2 THR 83 1.532 -16.196 -27.995 601 H VAL 84 H VAL 84 5.858 -14.832 -29.149 602 HA VAL 84 HA VAL 84 6.373 -14.732 -32.020 603 HB VAL 84 HB VAL 84 8.369 -13.302 -31.706 604 HG11 VAL 84 1HG1 VAL 84 6.340 -12.297 -32.537 605 HG12 VAL 84 2HG1 VAL 84 5.735 -12.077 -30.894 606 HG13 VAL 84 3HG1 VAL 84 7.144 -11.169 -31.445 607 HG21 VAL 84 3HG2 VAL 84 7.603 -13.583 -28.918 608 HG22 VAL 84 1HG2 VAL 84 9.139 -13.081 -29.624 609 HG23 VAL 84 2HG2 VAL 84 7.852 -11.900 -29.382 610 H GLY 85 H GLY 85 8.967 -15.090 -32.222 611 HA2 GLY 85 2HA GLY 85 10.537 -16.454 -30.528 612 HA3 GLY 85 3HA GLY 85 9.374 -17.687 -30.992 Start of MODEL 2 1 H1 MET 9 H MET 9 1.608 0.892 -1.539 2 HA MET 9 HA MET 9 3.099 0.056 -3.123 3 HB2 MET 9 2HB MET 9 4.739 -1.408 -1.962 4 HB3 MET 9 3HB MET 9 4.297 0.017 -1.030 5 HG2 MET 9 2HG MET 9 2.521 -2.081 -0.329 6 HG3 MET 9 3HG MET 9 4.168 -2.705 -0.273 7 HE1 MET 9 3HE MET 9 4.687 -3.010 2.274 8 HE2 MET 9 1HE MET 9 3.812 -2.063 3.477 9 HE3 MET 9 2HE MET 9 2.923 -3.000 2.277 10 H LYS 10 H LYS 10 0.474 -1.339 -3.174 11 HA LYS 10 HA LYS 10 1.416 -3.845 -4.394 12 HB2 LYS 10 2HB LYS 10 -0.842 -3.417 -2.472 13 HB3 LYS 10 3HB LYS 10 -0.956 -4.698 -3.673 14 HG2 LYS 10 2HG LYS 10 1.381 -5.388 -2.770 15 HG3 LYS 10 3HG LYS 10 0.915 -4.428 -1.365 16 HD2 LYS 10 2HD LYS 10 -1.267 -5.806 -1.432 17 HD3 LYS 10 3HD LYS 10 -0.355 -6.913 -2.461 18 HE2 LYS 10 2HE LYS 10 1.423 -6.717 -0.536 19 HE3 LYS 10 3HE LYS 10 0.019 -6.242 0.420 20 HZ1 LYS 10 3HZ LYS 10 -0.069 -8.681 -1.231 21 HZ2 LYS 10 1HZ LYS 10 -0.966 -8.295 0.151 22 HZ3 LYS 10 2HZ LYS 10 0.666 -8.714 0.292 23 H ILE 11 H ILE 11 0.677 -4.242 -6.399 24 HA ILE 11 HA ILE 11 -1.641 -2.737 -7.380 25 HB ILE 11 HB ILE 11 0.907 -3.002 -8.973 26 HG12 ILE 11 2HG1 ILE 11 0.738 -0.367 -8.566 27 HG13 ILE 11 3HG1 ILE 11 -0.036 -0.905 -7.080 28 HG21 ILE 11 1HG2 ILE 11 -1.808 -2.073 -9.536 29 HG22 ILE 11 2HG2 ILE 11 -0.545 -0.949 -10.033 30 HG23 ILE 11 3HG2 ILE 11 -0.538 -2.605 -10.638 31 HD11 ILE 11 3HD1 ILE 11 2.723 -0.741 -7.685 32 HD12 ILE 11 1HD1 ILE 11 1.949 -1.250 -6.184 33 HD13 ILE 11 2HD1 ILE 11 2.314 -2.439 -7.436 34 H LYS 12 H LYS 12 -2.768 -3.709 -9.090 35 HA LYS 12 HA LYS 12 -2.045 -6.524 -9.585 36 HB2 LYS 12 2HB LYS 12 -4.507 -5.316 -8.655 37 HB3 LYS 12 3HB LYS 12 -4.775 -6.223 -10.138 38 HG2 LYS 12 2HG LYS 12 -3.665 -8.176 -9.069 39 HG3 LYS 12 3HG LYS 12 -3.601 -7.254 -7.566 40 HD2 LYS 12 2HD LYS 12 -6.061 -7.037 -7.633 41 HD3 LYS 12 3HD LYS 12 -6.088 -8.037 -9.088 42 HE2 LYS 12 2HE LYS 12 -5.335 -9.937 -7.918 43 HE3 LYS 12 3HE LYS 12 -4.838 -8.980 -6.523 44 HZ1 LYS 12 3HZ LYS 12 -6.809 -9.416 -5.644 45 HZ2 LYS 12 1HZ LYS 12 -7.348 -10.171 -7.059 46 HZ3 LYS 12 2HZ LYS 12 -7.537 -8.501 -6.867 47 H ILE 13 H ILE 13 -1.485 -6.941 -11.609 48 HA ILE 13 HA ILE 13 -2.410 -5.134 -13.735 49 HB ILE 13 HB ILE 13 0.003 -5.256 -13.570 50 HG12 ILE 13 2HG1 ILE 13 -0.284 -6.936 -15.959 51 HG13 ILE 13 3HG1 ILE 13 -1.464 -5.633 -15.865 52 HG21 ILE 13 1HG2 ILE 13 -0.472 -7.959 -12.948 53 HG22 ILE 13 2HG2 ILE 13 0.482 -7.940 -14.430 54 HG23 ILE 13 3HG2 ILE 13 1.073 -7.111 -12.990 55 HD11 ILE 13 3HD1 ILE 13 0.914 -4.402 -15.214 56 HD12 ILE 13 1HD1 ILE 13 1.361 -5.542 -16.483 57 HD13 ILE 13 2HD1 ILE 13 0.096 -4.348 -16.775 58 H VAL 14 H VAL 14 -3.886 -5.842 -15.118 59 HA VAL 14 HA VAL 14 -4.443 -8.720 -15.243 60 HB VAL 14 HB VAL 14 -6.141 -6.437 -16.257 61 HG11 VAL 14 1HG1 VAL 14 -6.647 -9.390 -15.952 62 HG12 VAL 14 2HG1 VAL 14 -7.927 -8.203 -16.211 63 HG13 VAL 14 3HG1 VAL 14 -6.677 -8.434 -17.433 64 HG21 VAL 14 3HG2 VAL 14 -6.607 -6.053 -14.108 65 HG22 VAL 14 1HG2 VAL 14 -7.437 -7.609 -14.113 66 HG23 VAL 14 2HG2 VAL 14 -5.757 -7.508 -13.586 67 HA PRO 15 HA PRO 15 -2.340 -8.554 -19.209 68 HB2 PRO 15 2HB PRO 15 -2.374 -11.241 -19.600 69 HB3 PRO 15 3HB PRO 15 -1.208 -10.439 -18.541 70 HG2 PRO 15 2HG PRO 15 -3.740 -11.868 -17.831 71 HG3 PRO 15 3HG PRO 15 -2.156 -11.938 -17.038 72 HD2 PRO 15 2HD PRO 15 -4.198 -10.440 -16.081 73 HD3 PRO 15 3HD PRO 15 -2.498 -9.964 -15.898 74 H ALA 16 H ALA 16 -3.156 -8.385 -21.216 75 HA ALA 16 HA ALA 16 -5.960 -8.999 -21.627 76 HB1 ALA 16 1HB ALA 16 -4.033 -7.749 -23.576 77 HB2 ALA 16 2HB ALA 16 -5.795 -7.706 -23.628 78 HB3 ALA 16 3HB ALA 16 -4.929 -6.844 -22.357 79 H VAL 17 H VAL 17 -4.794 -11.362 -21.299 80 HA VAL 17 HA VAL 17 -4.381 -12.438 -24.011 81 HB VAL 17 HB VAL 17 -3.188 -14.290 -23.036 82 HG11 VAL 17 1HG1 VAL 17 -1.884 -12.167 -21.485 83 HG12 VAL 17 2HG1 VAL 17 -1.258 -13.162 -22.801 84 HG13 VAL 17 3HG1 VAL 17 -2.246 -11.744 -23.158 85 HG21 VAL 17 3HG2 VAL 17 -4.062 -13.090 -20.426 86 HG22 VAL 17 1HG2 VAL 17 -4.295 -14.734 -21.019 87 HG23 VAL 17 2HG2 VAL 17 -2.690 -14.192 -20.530 88 H GLY 18 H GLY 18 -4.847 -15.066 -23.661 89 HA2 GLY 18 2HA GLY 18 -7.574 -15.361 -23.917 90 HA3 GLY 18 3HA GLY 18 -6.486 -16.666 -23.470 91 H GLY 19 H GLY 19 -5.958 -16.882 -21.153 92 HA2 GLY 19 2HA GLY 19 -8.256 -17.042 -19.579 93 HA3 GLY 19 3HA GLY 19 -6.610 -17.124 -18.967 94 H GLY 20 H GLY 20 -5.723 -14.555 -19.616 95 HA2 GLY 20 2HA GLY 20 -5.631 -12.477 -18.640 96 HA3 GLY 20 3HA GLY 20 -7.357 -12.423 -18.969 97 H SER 21 H SER 21 -4.905 -13.143 -16.585 98 HA SER 21 HA SER 21 -6.982 -12.985 -14.503 99 HB2 SER 21 2HB SER 21 -5.794 -15.299 -14.974 100 HB3 SER 21 3HB SER 21 -4.498 -14.581 -14.017 101 HG SER 21 HG SER 21 -5.838 -15.618 -12.599 102 HA PRO 22 HA PRO 22 -4.538 -9.604 -13.040 103 HB2 PRO 22 2HB PRO 22 -5.744 -9.321 -10.625 104 HB3 PRO 22 3HB PRO 22 -6.492 -8.797 -12.138 105 HG2 PRO 22 2HG PRO 22 -6.954 -11.302 -10.566 106 HG3 PRO 22 3HG PRO 22 -8.136 -10.241 -11.353 107 HD2 PRO 22 2HD PRO 22 -7.306 -12.570 -12.458 108 HD3 PRO 22 3HD PRO 22 -7.763 -11.159 -13.434 109 H LEU 23 H LEU 23 -2.586 -9.574 -12.124 110 HA LEU 23 HA LEU 23 -1.980 -11.586 -10.058 111 HB2 LEU 23 2HB LEU 23 -0.011 -10.275 -11.920 112 HB3 LEU 23 3HB LEU 23 0.284 -11.627 -10.828 113 HG LEU 23 HG LEU 23 -1.788 -12.081 -12.874 114 HD11 LEU 23 1HD1 LEU 23 0.453 -12.687 -14.310 115 HD12 LEU 23 2HD1 LEU 23 0.887 -11.141 -13.582 116 HD13 LEU 23 3HD1 LEU 23 -0.570 -11.273 -14.566 117 HD21 LEU 23 3HD2 LEU 23 -0.084 -14.139 -13.029 118 HD22 LEU 23 1HD2 LEU 23 -1.346 -14.025 -11.802 119 HD23 LEU 23 2HD2 LEU 23 0.310 -13.562 -11.409 120 H GLU 24 H GLU 24 -1.435 -10.860 -8.110 121 HA GLU 24 HA GLU 24 -1.031 -7.994 -7.745 122 HB2 GLU 24 2HB GLU 24 -2.657 -9.370 -6.351 123 HB3 GLU 24 3HB GLU 24 -1.246 -10.087 -5.585 124 HG2 GLU 24 2HG GLU 24 -0.600 -8.055 -4.615 125 HG3 GLU 24 3HG GLU 24 -1.667 -7.120 -5.661 126 H LEU 25 H LEU 25 0.883 -7.100 -7.326 127 HA LEU 25 HA LEU 25 3.039 -8.728 -6.215 128 HB2 LEU 25 2HB LEU 25 3.124 -7.277 -8.841 129 HB3 LEU 25 3HB LEU 25 4.591 -7.635 -7.931 130 HG LEU 25 HG LEU 25 3.049 -10.030 -8.226 131 HD11 LEU 25 1HD1 LEU 25 2.055 -9.589 -10.198 132 HD12 LEU 25 2HD1 LEU 25 3.656 -9.942 -10.847 133 HD13 LEU 25 3HD1 LEU 25 3.160 -8.270 -10.585 134 HD21 LEU 25 3HD2 LEU 25 5.660 -9.320 -8.064 135 HD22 LEU 25 1HD2 LEU 25 5.515 -9.682 -9.784 136 HD23 LEU 25 2HD2 LEU 25 5.088 -10.905 -8.587 137 H GLU 26 H GLU 26 4.862 -7.428 -5.445 138 HA GLU 26 HA GLU 26 3.925 -4.823 -4.479 139 HB2 GLU 26 2HB GLU 26 4.586 -6.377 -2.740 140 HB3 GLU 26 3HB GLU 26 6.148 -6.625 -3.508 141 HG2 GLU 26 2HG GLU 26 6.806 -4.369 -3.028 142 HG3 GLU 26 3HG GLU 26 5.199 -3.991 -2.408 143 H VAL 27 H VAL 27 4.509 -3.198 -5.767 144 HA VAL 27 HA VAL 27 7.340 -2.942 -6.474 145 HB VAL 27 HB VAL 27 6.674 -2.079 -8.742 146 HG11 VAL 27 1HG1 VAL 27 6.131 -4.479 -9.596 147 HG12 VAL 27 2HG1 VAL 27 7.685 -4.154 -8.826 148 HG13 VAL 27 3HG1 VAL 27 6.394 -4.936 -7.914 149 HG21 VAL 27 3HG2 VAL 27 4.040 -3.308 -7.948 150 HG22 VAL 27 1HG2 VAL 27 4.351 -1.637 -8.420 151 HG23 VAL 27 2HG2 VAL 27 4.484 -2.930 -9.612 152 H ALA 28 H ALA 28 7.811 -0.700 -7.328 153 HA ALA 28 HA ALA 28 6.015 1.303 -6.138 154 HB1 ALA 28 1HB ALA 28 7.862 0.906 -4.590 155 HB2 ALA 28 2HB ALA 28 9.019 1.270 -5.872 156 HB3 ALA 28 3HB ALA 28 7.939 2.530 -5.275 157 HA PRO 29 HA PRO 29 6.510 2.864 -10.307 158 HB2 PRO 29 2HB PRO 29 4.687 4.858 -10.040 159 HB3 PRO 29 3HB PRO 29 4.233 3.171 -10.312 160 HG2 PRO 29 2HG PRO 29 4.305 4.724 -7.754 161 HG3 PRO 29 3HG PRO 29 3.075 3.590 -8.339 162 HD2 PRO 29 2HD PRO 29 4.951 2.891 -6.516 163 HD3 PRO 29 3HD PRO 29 4.294 1.741 -7.699 164 H ASN 30 H ASN 30 7.153 4.379 -7.307 165 HA ASN 30 HA ASN 30 8.076 6.871 -8.468 166 HB2 ASN 30 2HB ASN 30 6.972 6.787 -6.230 167 HB3 ASN 30 3HB ASN 30 8.356 5.882 -5.623 168 HD21 ASN 30 1HD2 ASN 30 8.589 7.613 -4.100 169 HD22 ASN 30 2HD2 ASN 30 9.395 9.068 -4.566 170 H ALA 31 H ALA 31 9.294 3.949 -8.669 171 HA ALA 31 HA ALA 31 12.065 4.713 -8.048 172 HB1 ALA 31 1HB ALA 31 12.035 2.708 -7.056 173 HB2 ALA 31 2HB ALA 31 10.588 2.194 -7.925 174 HB3 ALA 31 3HB ALA 31 12.172 2.059 -8.690 175 H THR 32 H THR 32 10.760 2.398 -10.399 176 HA THR 32 HA THR 32 11.629 3.986 -12.647 177 HB THR 32 HB THR 32 12.895 1.475 -13.082 178 HG1 THR 32 HG1 THR 32 14.423 1.514 -11.388 179 HG21 THR 32 3HG2 THR 32 14.921 2.921 -13.271 180 HG22 THR 32 1HG2 THR 32 13.955 4.273 -12.682 181 HG23 THR 32 2HG2 THR 32 13.545 3.497 -14.211 182 H VAL 33 H VAL 33 10.695 3.354 -14.564 183 HA VAL 33 HA VAL 33 8.380 1.719 -14.395 184 HB VAL 33 HB VAL 33 9.777 2.822 -16.837 185 HG11 VAL 33 1HG1 VAL 33 7.498 1.053 -16.533 186 HG12 VAL 33 2HG1 VAL 33 7.087 2.530 -17.407 187 HG13 VAL 33 3HG1 VAL 33 8.397 1.498 -17.983 188 HG21 VAL 33 3HG2 VAL 33 8.775 4.784 -16.460 189 HG22 VAL 33 1HG2 VAL 33 7.246 4.015 -16.031 190 HG23 VAL 33 2HG2 VAL 33 8.512 4.200 -14.817 191 H GLY 34 H GLY 34 11.523 1.286 -16.008 192 HA2 GLY 34 2HA GLY 34 10.942 -1.268 -17.080 193 HA3 GLY 34 3HA GLY 34 12.547 -0.588 -16.854 194 H ALA 35 H ALA 35 12.245 -0.234 -13.986 195 HA ALA 35 HA ALA 35 13.194 -2.753 -13.132 196 HB1 ALA 35 1HB ALA 35 12.159 -0.720 -11.202 197 HB2 ALA 35 2HB ALA 35 13.572 -1.770 -11.077 198 HB3 ALA 35 3HB ALA 35 13.600 -0.376 -12.158 199 H VAL 36 H VAL 36 10.100 -1.085 -12.623 200 HA VAL 36 HA VAL 36 8.949 -3.117 -11.016 201 HB VAL 36 HB VAL 36 7.585 -1.005 -12.692 202 HG11 VAL 36 1HG1 VAL 36 5.721 -2.133 -12.211 203 HG12 VAL 36 2HG1 VAL 36 6.554 -3.180 -11.060 204 HG13 VAL 36 3HG1 VAL 36 5.958 -1.601 -10.547 205 HG21 VAL 36 3HG2 VAL 36 8.025 -0.936 -9.723 206 HG22 VAL 36 1HG2 VAL 36 9.219 -0.298 -10.853 207 HG23 VAL 36 2HG2 VAL 36 7.594 0.387 -10.808 208 H ARG 37 H ARG 37 8.746 -2.378 -14.480 209 HA ARG 37 HA ARG 37 6.889 -4.365 -15.164 210 HB2 ARG 37 2HB ARG 37 8.392 -2.411 -16.515 211 HB3 ARG 37 3HB ARG 37 8.810 -3.942 -17.273 212 HG2 ARG 37 2HG ARG 37 5.939 -3.343 -16.799 213 HG3 ARG 37 3HG ARG 37 6.774 -2.501 -18.105 214 HD2 ARG 37 2HD ARG 37 6.902 -4.348 -19.377 215 HD3 ARG 37 3HD ARG 37 7.284 -5.384 -18.003 216 HE ARG 37 HE ARG 37 4.676 -4.862 -19.119 217 HH11 ARG 37 1HH1 ARG 37 6.465 -5.956 -16.340 218 HH12 ARG 37 2HH1 ARG 37 5.144 -6.864 -15.684 219 HH21 ARG 37 1HH2 ARG 37 2.929 -6.055 -18.266 220 HH22 ARG 37 2HH2 ARG 37 3.133 -6.921 -16.781 221 H THR 38 H THR 38 10.416 -4.433 -14.961 222 HA THR 38 HA THR 38 10.710 -7.064 -15.997 223 HB THR 38 HB THR 38 12.998 -6.957 -14.966 224 HG1 THR 38 HG1 THR 38 11.819 -4.845 -13.687 225 HG21 THR 38 3HG2 THR 38 11.900 -4.991 -16.896 226 HG22 THR 38 1HG2 THR 38 13.144 -6.221 -17.117 227 HG23 THR 38 2HG2 THR 38 13.535 -4.706 -16.302 228 H LYS 39 H LYS 39 10.357 -5.734 -12.753 229 HA LYS 39 HA LYS 39 10.935 -8.090 -11.319 230 HB2 LYS 39 2HB LYS 39 9.899 -5.442 -10.748 231 HB3 LYS 39 3HB LYS 39 9.065 -6.669 -9.803 232 HG2 LYS 39 2HG LYS 39 12.058 -6.372 -9.929 233 HG3 LYS 39 3HG LYS 39 11.034 -5.678 -8.669 234 HD2 LYS 39 2HD LYS 39 11.103 -8.619 -9.324 235 HD3 LYS 39 3HD LYS 39 12.120 -7.872 -8.089 236 HE2 LYS 39 2HE LYS 39 9.466 -6.996 -7.649 237 HE3 LYS 39 3HE LYS 39 9.409 -8.740 -7.900 238 HZ1 LYS 39 3HZ LYS 39 10.272 -9.075 -5.901 239 HZ2 LYS 39 1HZ LYS 39 10.122 -7.418 -5.591 240 HZ3 LYS 39 2HZ LYS 39 11.572 -8.035 -6.205 241 H VAL 40 H VAL 40 7.874 -6.736 -12.497 242 HA VAL 40 HA VAL 40 6.235 -8.788 -11.421 243 HB VAL 40 HB VAL 40 5.691 -6.920 -13.733 244 HG11 VAL 40 1HG1 VAL 40 3.299 -7.614 -12.482 245 HG12 VAL 40 2HG1 VAL 40 3.862 -8.141 -14.070 246 HG13 VAL 40 3HG1 VAL 40 4.187 -9.129 -12.645 247 HG21 VAL 40 3HG2 VAL 40 5.155 -5.320 -12.260 248 HG22 VAL 40 1HG2 VAL 40 4.337 -6.456 -11.187 249 HG23 VAL 40 2HG2 VAL 40 6.088 -6.267 -11.101 250 H CYS 41 H CYS 41 7.495 -8.204 -14.699 251 HA CYS 41 HA CYS 41 6.374 -10.408 -15.962 252 HB2 CYS 41 2HB CYS 41 7.817 -8.402 -16.874 253 HB3 CYS 41 3HB CYS 41 9.146 -9.538 -16.678 254 HG CYS 41 HG CYS 41 8.779 -10.172 -19.170 255 H ALA 42 H ALA 42 9.422 -10.145 -14.180 256 HA ALA 42 HA ALA 42 10.346 -12.756 -14.704 257 HB1 ALA 42 1HB ALA 42 10.941 -10.914 -12.392 258 HB2 ALA 42 2HB ALA 42 11.826 -12.395 -12.757 259 HB3 ALA 42 3HB ALA 42 11.849 -11.050 -13.898 260 H MET 43 H MET 43 8.425 -11.414 -12.042 261 HA MET 43 HA MET 43 8.311 -13.705 -10.446 262 HB2 MET 43 2HB MET 43 6.761 -11.204 -10.697 263 HB3 MET 43 3HB MET 43 5.906 -12.547 -9.950 264 HG2 MET 43 2HG MET 43 8.620 -12.120 -8.938 265 HG3 MET 43 3HG MET 43 7.503 -10.790 -8.641 266 HE1 MET 43 3HE MET 43 8.511 -11.563 -6.239 267 HE2 MET 43 1HE MET 43 6.898 -10.896 -5.986 268 HE3 MET 43 2HE MET 43 7.372 -12.387 -5.173 269 H LYS 44 H LYS 44 6.591 -12.847 -13.347 270 HA LYS 44 HA LYS 44 4.804 -15.150 -13.054 271 HB2 LYS 44 2HB LYS 44 4.777 -13.083 -15.253 272 HB3 LYS 44 3HB LYS 44 3.499 -14.215 -14.827 273 HG2 LYS 44 2HG LYS 44 4.462 -12.054 -12.973 274 HG3 LYS 44 3HG LYS 44 3.137 -11.833 -14.118 275 HD2 LYS 44 2HD LYS 44 1.979 -12.449 -12.230 276 HD3 LYS 44 3HD LYS 44 2.219 -14.021 -12.997 277 HE2 LYS 44 2HE LYS 44 3.672 -14.723 -11.407 278 HE3 LYS 44 3HE LYS 44 4.356 -13.116 -11.171 279 HZ1 LYS 44 3HZ LYS 44 2.015 -12.661 -10.140 280 HZ2 LYS 44 1HZ LYS 44 3.231 -13.397 -9.222 281 HZ3 LYS 44 2HZ LYS 44 2.007 -14.338 -9.913 282 H LYS 45 H LYS 45 7.774 -14.405 -14.355 283 HA LYS 45 HA LYS 45 9.186 -15.468 -15.786 284 HB2 LYS 45 2HB LYS 45 7.207 -17.582 -15.087 285 HB3 LYS 45 3HB LYS 45 8.295 -17.895 -16.434 286 HG2 LYS 45 2HG LYS 45 9.410 -18.806 -14.623 287 HG3 LYS 45 3HG LYS 45 10.166 -17.221 -14.801 288 HD2 LYS 45 2HD LYS 45 8.154 -16.598 -13.121 289 HD3 LYS 45 3HD LYS 45 8.441 -18.275 -12.649 290 HE2 LYS 45 2HE LYS 45 10.762 -17.801 -12.210 291 HE3 LYS 45 3HE LYS 45 10.584 -16.162 -12.834 292 HZ1 LYS 45 3HZ LYS 45 8.974 -17.106 -10.545 293 HZ2 LYS 45 1HZ LYS 45 9.339 -15.517 -10.999 294 HZ3 LYS 45 2HZ LYS 45 10.537 -16.499 -10.320 295 H LEU 46 H LEU 46 7.861 -13.646 -17.091 296 HA LEU 46 HA LEU 46 6.864 -14.947 -19.540 297 HB2 LEU 46 2HB LEU 46 5.942 -12.608 -18.018 298 HB3 LEU 46 3HB LEU 46 6.012 -12.380 -19.764 299 HG LEU 46 HG LEU 46 4.561 -14.400 -20.008 300 HD11 LEU 46 1HD1 LEU 46 5.175 -15.293 -17.720 301 HD12 LEU 46 2HD1 LEU 46 3.468 -15.362 -18.156 302 HD13 LEU 46 3HD1 LEU 46 4.049 -14.107 -17.062 303 HD21 LEU 46 3HD2 LEU 46 2.966 -12.873 -20.204 304 HD22 LEU 46 1HD2 LEU 46 3.883 -11.764 -19.184 305 HD23 LEU 46 2HD2 LEU 46 2.737 -12.889 -18.455 306 HA PRO 47 HA PRO 47 10.074 -13.121 -21.910 307 HB2 PRO 47 2HB PRO 47 8.788 -12.385 -24.185 308 HB3 PRO 47 3HB PRO 47 9.118 -14.072 -23.771 309 HG2 PRO 47 2HG PRO 47 6.593 -12.499 -23.439 310 HG3 PRO 47 3HG PRO 47 6.808 -14.161 -24.020 311 HD2 PRO 47 2HD PRO 47 6.024 -13.593 -21.492 312 HD3 PRO 47 3HD PRO 47 7.010 -15.015 -21.889 313 HA PRO 48 HA PRO 48 9.544 -8.790 -20.742 314 HB2 PRO 48 2HB PRO 48 12.200 -8.229 -20.763 315 HB3 PRO 48 3HB PRO 48 11.400 -9.039 -19.411 316 HG2 PRO 48 2HG PRO 48 13.005 -10.220 -21.644 317 HG3 PRO 48 3HG PRO 48 13.036 -10.612 -19.915 318 HD2 PRO 48 2HD PRO 48 11.712 -12.126 -21.728 319 HD3 PRO 48 3HD PRO 48 11.155 -11.937 -20.053 320 H ASP 49 H ASP 49 11.219 -10.174 -23.476 321 HA ASP 49 HA ASP 49 11.626 -7.676 -24.833 322 HB2 ASP 49 2HB ASP 49 12.030 -10.560 -25.492 323 HB3 ASP 49 3HB ASP 49 11.955 -9.402 -26.817 324 H THR 50 H THR 50 9.117 -10.072 -24.671 325 HA THR 50 HA THR 50 7.630 -8.643 -26.778 326 HB THR 50 HB THR 50 6.432 -10.628 -27.287 327 HG1 THR 50 HG1 THR 50 6.192 -12.217 -25.889 328 HG21 THR 50 3HG2 THR 50 9.291 -11.464 -26.796 329 HG22 THR 50 1HG2 THR 50 8.740 -10.523 -28.180 330 HG23 THR 50 2HG2 THR 50 8.171 -12.177 -27.956 331 H THR 51 H THR 51 7.636 -7.533 -24.272 332 HA THR 51 HA THR 51 4.837 -7.885 -23.497 333 HB THR 51 HB THR 51 6.325 -9.227 -21.938 334 HG1 THR 51 HG1 THR 51 5.192 -8.391 -20.082 335 HG21 THR 51 3HG2 THR 51 8.115 -7.408 -21.919 336 HG22 THR 51 1HG2 THR 51 7.701 -8.132 -20.366 337 HG23 THR 51 2HG2 THR 51 7.067 -6.543 -20.796 338 H ARG 52 H ARG 52 3.825 -6.024 -22.890 339 HA ARG 52 HA ARG 52 5.456 -3.614 -22.520 340 HB2 ARG 52 2HB ARG 52 3.004 -3.661 -24.280 341 HB3 ARG 52 3HB ARG 52 4.132 -2.332 -24.049 342 HG2 ARG 52 2HG ARG 52 4.874 -4.964 -25.303 343 HG3 ARG 52 3HG ARG 52 4.373 -3.537 -26.212 344 HD2 ARG 52 2HD ARG 52 6.288 -2.360 -25.675 345 HD3 ARG 52 3HD ARG 52 6.599 -3.326 -24.233 346 HE ARG 52 HE ARG 52 6.882 -5.093 -26.281 347 HH11 ARG 52 1HH1 ARG 52 8.276 -1.992 -25.529 348 HH12 ARG 52 2HH1 ARG 52 9.778 -2.329 -26.324 349 HH21 ARG 52 1HH2 ARG 52 8.856 -5.548 -27.330 350 HH22 ARG 52 2HH2 ARG 52 10.107 -4.352 -27.348 351 H LEU 53 H LEU 53 4.725 -2.258 -20.976 352 HA LEU 53 HA LEU 53 2.148 -2.929 -19.719 353 HB2 LEU 53 2HB LEU 53 3.624 -3.327 -18.032 354 HB3 LEU 53 3HB LEU 53 4.795 -2.156 -18.634 355 HG LEU 53 HG LEU 53 3.382 -0.334 -17.747 356 HD11 LEU 53 1HD1 LEU 53 1.523 -2.516 -17.390 357 HD12 LEU 53 2HD1 LEU 53 1.244 -0.776 -17.339 358 HD13 LEU 53 3HD1 LEU 53 1.776 -1.627 -15.888 359 HD21 LEU 53 3HD2 LEU 53 3.925 -0.687 -15.412 360 HD22 LEU 53 1HD2 LEU 53 5.237 -1.276 -16.433 361 HD23 LEU 53 2HD2 LEU 53 4.116 -2.419 -15.693 362 H THR 54 H THR 54 0.633 -1.386 -19.489 363 HA THR 54 HA THR 54 1.376 1.387 -20.153 364 HB THR 54 HB THR 54 -1.385 0.746 -20.815 365 HG1 THR 54 HG1 THR 54 -1.051 -0.754 -22.340 366 HG21 THR 54 3HG2 THR 54 0.962 2.097 -22.077 367 HG22 THR 54 1HG2 THR 54 -0.633 2.744 -21.692 368 HG23 THR 54 2HG2 THR 54 -0.428 1.669 -23.075 369 H TYR 55 H TYR 55 0.469 2.984 -18.932 370 HA TYR 55 HA TYR 55 -1.425 2.157 -16.833 371 HB2 TYR 55 2HB TYR 55 0.710 2.402 -15.759 372 HB3 TYR 55 3HB TYR 55 0.998 3.942 -16.561 373 HD1 TYR 55 HD1 TYR 55 -2.063 2.733 -14.817 374 HD2 TYR 55 HD2 TYR 55 1.179 5.488 -14.826 375 HE1 TYR 55 HE1 TYR 55 -3.066 3.910 -12.905 376 HE2 TYR 55 HE2 TYR 55 0.186 6.672 -12.913 377 HH TYR 55 HH TYR 55 -2.311 6.910 -11.992 378 H LYS 56 H LYS 56 -3.218 3.336 -16.728 379 HA LYS 56 HA LYS 56 -4.779 4.926 -17.196 380 HB2 LYS 56 2HB LYS 56 -2.779 6.170 -15.879 381 HB3 LYS 56 3HB LYS 56 -2.771 7.097 -17.374 382 HG2 LYS 56 2HG LYS 56 -5.413 6.655 -16.146 383 HG3 LYS 56 3HG LYS 56 -4.301 7.697 -15.256 384 HD2 LYS 56 2HD LYS 56 -4.895 9.362 -16.609 385 HD3 LYS 56 3HD LYS 56 -4.097 8.500 -17.927 386 HE2 LYS 56 2HE LYS 56 -6.298 7.210 -18.159 387 HE3 LYS 56 3HE LYS 56 -6.997 8.471 -17.145 388 HZ1 LYS 56 3HZ LYS 56 -6.076 8.606 -19.904 389 HZ2 LYS 56 1HZ LYS 56 -5.774 9.966 -18.945 390 HZ3 LYS 56 2HZ LYS 56 -7.358 9.411 -19.150 391 H GLY 57 H GLY 57 -3.555 3.584 -19.434 392 HA2 GLY 57 2HA GLY 57 -3.762 3.687 -21.725 393 HA3 GLY 57 3HA GLY 57 -4.538 5.251 -21.528 394 H ARG 58 H ARG 58 -1.500 5.024 -20.023 395 HA ARG 58 HA ARG 58 -0.225 6.362 -22.318 396 HB2 ARG 58 2HB ARG 58 -0.812 7.527 -19.891 397 HB3 ARG 58 3HB ARG 58 0.865 7.039 -19.687 398 HG2 ARG 58 2HG ARG 58 1.337 8.999 -20.644 399 HG3 ARG 58 3HG ARG 58 0.926 8.185 -22.155 400 HD2 ARG 58 2HD ARG 58 -0.435 10.003 -22.336 401 HD3 ARG 58 3HD ARG 58 -1.518 8.924 -21.459 402 HE ARG 58 HE ARG 58 -0.008 10.419 -19.618 403 HH11 ARG 58 1HH1 ARG 58 -2.561 10.812 -21.953 404 HH12 ARG 58 2HH1 ARG 58 -3.287 12.150 -21.127 405 HH21 ARG 58 1HH2 ARG 58 -0.956 12.180 -18.521 406 HH22 ARG 58 2HH2 ARG 58 -2.373 12.928 -19.176 407 H ALA 59 H ALA 59 2.029 6.040 -22.582 408 HA ALA 59 HA ALA 59 2.970 3.520 -21.402 409 HB1 ALA 59 1HB ALA 59 4.707 4.177 -23.459 410 HB2 ALA 59 2HB ALA 59 3.383 3.013 -23.529 411 HB3 ALA 59 3HB ALA 59 3.122 4.677 -24.052 412 H LEU 60 H LEU 60 4.416 3.656 -19.828 413 HA LEU 60 HA LEU 60 6.180 6.012 -19.730 414 HB2 LEU 60 2HB LEU 60 5.422 4.198 -17.449 415 HB3 LEU 60 3HB LEU 60 6.318 5.713 -17.351 416 HG LEU 60 HG LEU 60 3.612 5.909 -18.505 417 HD11 LEU 60 1HD1 LEU 60 2.920 4.418 -16.865 418 HD12 LEU 60 2HD1 LEU 60 2.716 5.990 -16.093 419 HD13 LEU 60 3HD1 LEU 60 4.114 4.990 -15.700 420 HD21 LEU 60 3HD2 LEU 60 5.569 7.571 -17.284 421 HD22 LEU 60 1HD2 LEU 60 4.096 7.640 -16.316 422 HD23 LEU 60 2HD2 LEU 60 4.041 8.032 -18.035 423 H LYS 61 H LYS 61 8.368 5.707 -19.067 424 HA LYS 61 HA LYS 61 9.476 3.088 -18.767 425 HB2 LYS 61 2HB LYS 61 9.213 2.960 -21.146 426 HB3 LYS 61 3HB LYS 61 9.882 4.572 -21.364 427 HG2 LYS 61 2HG LYS 61 12.045 3.870 -21.033 428 HG3 LYS 61 3HG LYS 61 11.556 2.458 -20.093 429 HD2 LYS 61 2HD LYS 61 10.971 2.755 -23.032 430 HD3 LYS 61 3HD LYS 61 12.441 1.995 -22.417 431 HE2 LYS 61 2HE LYS 61 10.775 0.562 -21.015 432 HE3 LYS 61 3HE LYS 61 9.601 1.077 -22.225 433 HZ1 LYS 61 3HZ LYS 61 11.030 0.159 -23.946 434 HZ2 LYS 61 1HZ LYS 61 10.610 -1.032 -22.819 435 HZ3 LYS 61 2HZ LYS 61 12.153 -0.339 -22.782 436 H ASP 62 H ASP 62 10.845 5.976 -20.312 437 HA ASP 62 HA ASP 62 13.048 6.006 -18.479 438 HB2 ASP 62 2HB ASP 62 12.338 7.301 -20.980 439 HB3 ASP 62 3HB ASP 62 13.064 8.436 -19.845 440 H THR 63 H THR 63 9.921 7.056 -18.217 441 HA THR 63 HA THR 63 10.107 9.582 -17.043 442 HB THR 63 HB THR 63 8.107 7.556 -16.085 443 HG1 THR 63 HG1 THR 63 7.408 7.324 -18.060 444 HG21 THR 63 3HG2 THR 63 7.252 10.230 -16.914 445 HG22 THR 63 1HG2 THR 63 8.422 10.233 -15.596 446 HG23 THR 63 2HG2 THR 63 6.909 9.341 -15.431 447 H GLU 64 H GLU 64 11.083 6.521 -15.860 448 HA GLU 64 HA GLU 64 12.085 5.867 -13.925 449 HB2 GLU 64 2HB GLU 64 12.498 8.758 -14.011 450 HB3 GLU 64 3HB GLU 64 12.484 8.118 -12.374 451 HG2 GLU 64 2HG GLU 64 14.105 6.328 -13.469 452 HG3 GLU 64 3HG GLU 64 14.411 7.666 -14.575 453 H THR 65 H THR 65 10.487 8.711 -12.558 454 HA THR 65 HA THR 65 8.964 6.922 -10.798 455 HB THR 65 HB THR 65 8.731 8.750 -9.270 456 HG1 THR 65 HG1 THR 65 10.183 10.496 -10.939 457 HG21 THR 65 3HG2 THR 65 10.916 8.943 -8.549 458 HG22 THR 65 1HG2 THR 65 11.551 9.139 -10.182 459 HG23 THR 65 2HG2 THR 65 11.032 7.549 -9.622 460 H LEU 66 H LEU 66 6.747 7.515 -10.258 461 HA LEU 66 HA LEU 66 5.378 8.816 -12.520 462 HB2 LEU 66 2HB LEU 66 4.250 6.686 -10.715 463 HB3 LEU 66 3HB LEU 66 3.515 7.347 -12.175 464 HG LEU 66 HG LEU 66 5.958 5.583 -12.022 465 HD11 LEU 66 1HD1 LEU 66 3.537 4.872 -13.567 466 HD12 LEU 66 2HD1 LEU 66 3.426 4.776 -11.810 467 HD13 LEU 66 3HD1 LEU 66 4.655 3.847 -12.668 468 HD21 LEU 66 3HD2 LEU 66 5.639 5.606 -14.562 469 HD22 LEU 66 1HD2 LEU 66 6.394 7.015 -13.818 470 HD23 LEU 66 2HD2 LEU 66 4.699 7.076 -14.302 471 H GLU 67 H GLU 67 6.126 9.100 -9.290 472 HA GLU 67 HA GLU 67 3.779 10.048 -8.113 473 HB2 GLU 67 2HB GLU 67 6.486 9.831 -7.391 474 HB3 GLU 67 3HB GLU 67 6.078 11.528 -7.186 475 HG2 GLU 67 2HG GLU 67 4.107 9.642 -6.108 476 HG3 GLU 67 3HG GLU 67 5.684 9.613 -5.321 477 H SER 68 H SER 68 6.238 11.737 -10.011 478 HA SER 68 HA SER 68 5.208 14.339 -9.660 479 HB2 SER 68 2HB SER 68 7.272 13.061 -11.249 480 HB3 SER 68 3HB SER 68 6.429 14.302 -12.176 481 HG SER 68 HG SER 68 8.003 15.375 -11.108 482 H LEU 69 H LEU 69 4.047 11.687 -11.427 483 HA LEU 69 HA LEU 69 2.484 13.374 -13.242 484 HB2 LEU 69 2HB LEU 69 3.250 10.498 -13.186 485 HB3 LEU 69 3HB LEU 69 1.767 10.959 -14.020 486 HG LEU 69 HG LEU 69 2.993 12.340 -15.556 487 HD11 LEU 69 1HD1 LEU 69 4.675 13.256 -14.113 488 HD12 LEU 69 2HD1 LEU 69 5.472 12.438 -15.457 489 HD13 LEU 69 3HD1 LEU 69 5.400 11.666 -13.873 490 HD21 LEU 69 3HD2 LEU 69 2.995 9.688 -15.628 491 HD22 LEU 69 1HD2 LEU 69 4.735 9.938 -15.486 492 HD23 LEU 69 2HD2 LEU 69 3.848 10.658 -16.830 493 H GLY 70 H GLY 70 2.228 11.757 -10.279 494 HA2 GLY 70 2HA GLY 70 0.326 12.077 -8.876 495 HA3 GLY 70 3HA GLY 70 -0.681 12.166 -10.314 496 H VAL 71 H VAL 71 1.676 9.780 -9.104 497 HA VAL 71 HA VAL 71 -0.184 7.645 -9.795 498 HB VAL 71 HB VAL 71 2.231 7.487 -10.414 499 HG11 VAL 71 1HG1 VAL 71 3.020 6.637 -7.720 500 HG12 VAL 71 2HG1 VAL 71 3.909 7.573 -8.923 501 HG13 VAL 71 3HG1 VAL 71 2.721 8.366 -7.889 502 HG21 VAL 71 3HG2 VAL 71 1.324 5.317 -8.528 503 HG22 VAL 71 1HG2 VAL 71 0.745 5.509 -10.182 504 HG23 VAL 71 2HG2 VAL 71 2.445 5.153 -9.879 505 H ALA 72 H ALA 72 -1.097 6.240 -8.350 506 HA ALA 72 HA ALA 72 -0.610 6.741 -5.491 507 HB1 ALA 72 1HB ALA 72 -3.319 6.309 -6.744 508 HB2 ALA 72 2HB ALA 72 -2.984 6.550 -5.029 509 HB3 ALA 72 3HB ALA 72 -2.688 7.856 -6.177 510 H ASP 73 H ASP 73 -0.822 4.966 -4.118 511 HA ASP 73 HA ASP 73 -0.168 2.452 -5.244 512 HB2 ASP 73 2HB ASP 73 -1.066 3.114 -2.431 513 HB3 ASP 73 3HB ASP 73 -0.301 1.610 -2.936 514 H GLY 74 H GLY 74 -1.350 0.526 -5.326 515 HA2 GLY 74 2HA GLY 74 -3.243 -0.823 -5.303 516 HA3 GLY 74 3HA GLY 74 -4.147 0.505 -4.589 517 H ASP 75 H ASP 75 -2.307 1.101 -7.453 518 HA ASP 75 HA ASP 75 -4.695 1.803 -8.894 519 HB2 ASP 75 2HB ASP 75 -1.976 2.524 -9.010 520 HB3 ASP 75 3HB ASP 75 -2.336 1.752 -10.552 521 H LYS 76 H LYS 76 -4.205 1.137 -11.480 522 HA LYS 76 HA LYS 76 -4.094 -1.804 -11.500 523 HB2 LYS 76 2HB LYS 76 -6.388 -0.221 -11.938 524 HB3 LYS 76 3HB LYS 76 -5.896 -0.819 -13.517 525 HG2 LYS 76 2HG LYS 76 -6.950 -2.705 -13.038 526 HG3 LYS 76 3HG LYS 76 -5.705 -3.024 -11.828 527 HD2 LYS 76 2HD LYS 76 -7.274 -1.361 -10.425 528 HD3 LYS 76 3HD LYS 76 -8.486 -2.069 -11.495 529 HE2 LYS 76 2HE LYS 76 -6.816 -4.159 -10.541 530 HE3 LYS 76 3HE LYS 76 -7.306 -3.180 -9.159 531 HZ1 LYS 76 3HZ LYS 76 -8.915 -4.859 -10.907 532 HZ2 LYS 76 1HZ LYS 76 -9.624 -3.405 -10.412 533 HZ3 LYS 76 2HZ LYS 76 -9.096 -4.524 -9.259 534 H PHE 77 H PHE 77 -2.797 -2.636 -13.008 535 HA PHE 77 HA PHE 77 -1.824 -0.840 -15.128 536 HB2 PHE 77 2HB PHE 77 -0.490 -3.097 -13.646 537 HB3 PHE 77 3HB PHE 77 0.137 -2.502 -15.181 538 HD1 PHE 77 HD2 PHE 77 -0.208 0.366 -14.985 539 HD2 PHE 77 HD1 PHE 77 0.984 -2.432 -12.007 540 HE1 PHE 77 HE2 PHE 77 1.003 2.149 -13.800 541 HE2 PHE 77 HE1 PHE 77 2.196 -0.653 -10.816 542 HZ PHE 77 HZ PHE 77 2.208 1.641 -11.713 543 H VAL 78 H VAL 78 -1.557 -1.650 -17.233 544 HA VAL 78 HA VAL 78 -3.189 -4.033 -17.805 545 HB VAL 78 HB VAL 78 -2.523 -1.736 -19.652 546 HG11 VAL 78 1HG1 VAL 78 -3.703 -4.371 -20.066 547 HG12 VAL 78 2HG1 VAL 78 -4.706 -3.051 -20.671 548 HG13 VAL 78 3HG1 VAL 78 -3.044 -3.227 -21.235 549 HG21 VAL 78 3HG2 VAL 78 -5.049 -1.349 -19.410 550 HG22 VAL 78 1HG2 VAL 78 -4.923 -2.339 -17.956 551 HG23 VAL 78 2HG2 VAL 78 -4.006 -0.838 -18.084 552 H LEU 79 H LEU 79 -2.180 -5.779 -18.532 553 HA LEU 79 HA LEU 79 0.545 -5.490 -19.592 554 HB2 LEU 79 2HB LEU 79 0.659 -6.923 -17.775 555 HB3 LEU 79 3HB LEU 79 -0.889 -7.678 -18.148 556 HG LEU 79 HG LEU 79 0.095 -8.955 -19.927 557 HD11 LEU 79 1HD1 LEU 79 1.802 -8.114 -21.065 558 HD12 LEU 79 2HD1 LEU 79 2.847 -8.524 -19.706 559 HD13 LEU 79 3HD1 LEU 79 2.121 -6.920 -19.806 560 HD21 LEU 79 3HD2 LEU 79 1.424 -10.425 -18.674 561 HD22 LEU 79 1HD2 LEU 79 0.375 -9.648 -17.488 562 HD23 LEU 79 2HD2 LEU 79 2.052 -9.129 -17.655 563 H ILE 80 H ILE 80 0.947 -5.908 -21.664 564 HA ILE 80 HA ILE 80 -1.012 -7.492 -23.187 565 HB ILE 80 HB ILE 80 0.417 -5.043 -24.224 566 HG12 ILE 80 2HG1 ILE 80 -2.502 -5.405 -23.514 567 HG13 ILE 80 3HG1 ILE 80 -1.334 -4.506 -22.552 568 HG21 ILE 80 1HG2 ILE 80 0.003 -6.681 -25.956 569 HG22 ILE 80 2HG2 ILE 80 -1.685 -6.812 -25.464 570 HG23 ILE 80 3HG2 ILE 80 -1.084 -5.308 -26.160 571 HD11 ILE 80 3HD1 ILE 80 -1.766 -2.692 -23.730 572 HD12 ILE 80 1HD1 ILE 80 -1.239 -3.508 -25.201 573 HD13 ILE 80 2HD1 ILE 80 -2.928 -3.596 -24.701 574 H THR 81 H THR 81 -0.127 -9.209 -24.109 575 HA THR 81 HA THR 81 2.765 -9.167 -24.682 576 HB THR 81 HB THR 81 2.888 -11.498 -24.268 577 HG1 THR 81 HG1 THR 81 0.048 -11.401 -24.296 578 HG21 THR 81 3HG2 THR 81 2.624 -11.496 -22.009 579 HG22 THR 81 1HG2 THR 81 0.975 -10.878 -22.091 580 HG23 THR 81 2HG2 THR 81 2.340 -9.778 -22.289 581 H ARG 82 H ARG 82 3.512 -10.053 -26.617 582 HA ARG 82 HA ARG 82 1.466 -10.253 -28.716 583 HB2 ARG 82 2HB ARG 82 3.856 -8.804 -28.583 584 HB3 ARG 82 3HB ARG 82 4.193 -10.134 -29.683 585 HG2 ARG 82 2HG ARG 82 2.889 -9.293 -31.297 586 HG3 ARG 82 3HG ARG 82 1.638 -8.786 -30.161 587 HD2 ARG 82 2HD ARG 82 4.214 -7.308 -30.148 588 HD3 ARG 82 3HD ARG 82 3.118 -7.042 -31.504 589 HE ARG 82 HE ARG 82 1.811 -6.835 -28.966 590 HH11 ARG 82 1HH1 ARG 82 3.756 -5.129 -31.296 591 HH12 ARG 82 2HH1 ARG 82 3.206 -3.562 -30.803 592 HH21 ARG 82 1HH2 ARG 82 1.079 -4.778 -28.308 593 HH22 ARG 82 2HH2 ARG 82 1.684 -3.364 -29.102 594 H THR 83 H THR 83 1.172 -12.087 -29.833 595 HA THR 83 HA THR 83 2.965 -14.344 -29.228 596 HB THR 83 HB THR 83 0.594 -14.618 -28.518 597 HG1 THR 83 HG1 THR 83 1.219 -16.613 -28.847 598 HG21 THR 83 3HG2 THR 83 -0.413 -15.170 -31.190 599 HG22 THR 83 1HG2 THR 83 0.006 -13.472 -30.966 600 HG23 THR 83 2HG2 THR 83 -1.145 -14.248 -29.878 601 H VAL 84 H VAL 84 3.201 -15.969 -30.971 602 HA VAL 84 HA VAL 84 2.952 -14.851 -33.672 603 HB VAL 84 HB VAL 84 5.254 -14.400 -32.873 604 HG11 VAL 84 1HG1 VAL 84 5.932 -17.285 -33.018 605 HG12 VAL 84 2HG1 VAL 84 6.681 -15.990 -32.082 606 HG13 VAL 84 3HG1 VAL 84 5.156 -16.698 -31.548 607 HG21 VAL 84 3HG2 VAL 84 4.531 -15.087 -35.296 608 HG22 VAL 84 1HG2 VAL 84 6.238 -14.912 -34.887 609 HG23 VAL 84 2HG2 VAL 84 5.509 -16.516 -34.961 610 H GLY 85 H GLY 85 2.518 -16.326 -35.256 611 HA2 GLY 85 2HA GLY 85 3.003 -18.845 -35.733 612 HA3 GLY 85 3HA GLY 85 1.968 -19.055 -34.328 Start of MODEL 3 1 H1 MET 9 H MET 9 0.965 -1.194 -0.290 2 HA MET 9 HA MET 9 2.139 0.183 -2.596 3 HB2 MET 9 2HB MET 9 4.335 -0.871 -2.113 4 HB3 MET 9 3HB MET 9 3.854 0.308 -0.901 5 HG2 MET 9 2HG MET 9 3.085 -1.544 0.540 6 HG3 MET 9 3HG MET 9 3.686 -2.686 -0.660 7 HE1 MET 9 3HE MET 9 7.168 -3.063 -0.316 8 HE2 MET 9 1HE MET 9 6.118 -3.899 0.828 9 HE3 MET 9 2HE MET 9 5.562 -3.595 -0.818 10 H LYS 10 H LYS 10 0.049 -1.395 -2.968 11 HA LYS 10 HA LYS 10 1.216 -3.856 -4.080 12 HB2 LYS 10 2HB LYS 10 -1.084 -3.542 -2.258 13 HB3 LYS 10 3HB LYS 10 -1.358 -4.606 -3.631 14 HG2 LYS 10 2HG LYS 10 0.926 -5.648 -2.891 15 HG3 LYS 10 3HG LYS 10 0.519 -4.907 -1.341 16 HD2 LYS 10 2HD LYS 10 -1.309 -6.753 -2.874 17 HD3 LYS 10 3HD LYS 10 -0.238 -7.272 -1.571 18 HE2 LYS 10 2HE LYS 10 -1.531 -5.184 -0.405 19 HE3 LYS 10 3HE LYS 10 -2.789 -5.820 -1.464 20 HZ1 LYS 10 3HZ LYS 10 -1.978 -8.075 -0.419 21 HZ2 LYS 10 1HZ LYS 10 -3.123 -7.104 0.362 22 HZ3 LYS 10 2HZ LYS 10 -1.505 -7.062 0.851 23 H ILE 11 H ILE 11 0.739 -4.254 -6.160 24 HA ILE 11 HA ILE 11 -1.430 -2.706 -7.410 25 HB ILE 11 HB ILE 11 1.293 -3.211 -8.615 26 HG12 ILE 11 2HG1 ILE 11 0.064 -0.540 -7.958 27 HG13 ILE 11 3HG1 ILE 11 1.037 -1.422 -6.786 28 HG21 ILE 11 1HG2 ILE 11 0.074 -1.367 -10.197 29 HG22 ILE 11 2HG2 ILE 11 0.135 -3.096 -10.533 30 HG23 ILE 11 3HG2 ILE 11 -1.284 -2.400 -9.751 31 HD11 ILE 11 3HD1 ILE 11 1.878 0.259 -8.924 32 HD12 ILE 11 1HD1 ILE 11 2.845 -0.519 -7.672 33 HD13 ILE 11 2HD1 ILE 11 2.508 -1.368 -9.181 34 H LYS 12 H LYS 12 -2.575 -3.719 -9.034 35 HA LYS 12 HA LYS 12 -1.970 -6.578 -9.425 36 HB2 LYS 12 2HB LYS 12 -4.715 -5.352 -9.635 37 HB3 LYS 12 3HB LYS 12 -4.293 -7.055 -9.508 38 HG2 LYS 12 2HG LYS 12 -3.225 -5.936 -7.216 39 HG3 LYS 12 3HG LYS 12 -4.765 -5.100 -7.427 40 HD2 LYS 12 2HD LYS 12 -4.381 -8.094 -7.407 41 HD3 LYS 12 3HD LYS 12 -4.998 -7.130 -6.063 42 HE2 LYS 12 2HE LYS 12 -6.679 -6.319 -7.975 43 HE3 LYS 12 3HE LYS 12 -6.306 -7.925 -8.599 44 HZ1 LYS 12 3HZ LYS 12 -7.792 -8.709 -7.176 45 HZ2 LYS 12 1HZ LYS 12 -7.991 -7.198 -6.441 46 HZ3 LYS 12 2HZ LYS 12 -6.780 -8.249 -5.901 47 H ILE 13 H ILE 13 -1.392 -7.090 -11.422 48 HA ILE 13 HA ILE 13 -2.186 -5.311 -13.624 49 HB ILE 13 HB ILE 13 0.000 -7.387 -13.690 50 HG12 ILE 13 2HG1 ILE 13 1.283 -4.974 -13.644 51 HG13 ILE 13 3HG1 ILE 13 -0.050 -4.679 -12.532 52 HG21 ILE 13 1HG2 ILE 13 0.145 -5.020 -15.408 53 HG22 ILE 13 2HG2 ILE 13 0.417 -6.720 -15.789 54 HG23 ILE 13 3HG2 ILE 13 -1.225 -6.080 -15.740 55 HD11 ILE 13 3HD1 ILE 13 0.797 -6.032 -10.957 56 HD12 ILE 13 1HD1 ILE 13 1.393 -7.206 -12.131 57 HD13 ILE 13 2HD1 ILE 13 2.312 -5.735 -11.811 58 H VAL 14 H VAL 14 -3.713 -5.994 -14.959 59 HA VAL 14 HA VAL 14 -4.333 -8.863 -15.062 60 HB VAL 14 HB VAL 14 -6.467 -8.093 -16.167 61 HG11 VAL 14 1HG1 VAL 14 -7.136 -6.873 -13.837 62 HG12 VAL 14 2HG1 VAL 14 -7.008 -8.620 -14.049 63 HG13 VAL 14 3HG1 VAL 14 -5.657 -7.711 -13.371 64 HG21 VAL 14 3HG2 VAL 14 -6.373 -5.427 -15.068 65 HG22 VAL 14 1HG2 VAL 14 -5.117 -5.657 -16.285 66 HG23 VAL 14 2HG2 VAL 14 -6.806 -5.957 -16.694 67 HA PRO 15 HA PRO 15 -2.309 -8.699 -19.073 68 HB2 PRO 15 2HB PRO 15 -2.348 -11.386 -19.457 69 HB3 PRO 15 3HB PRO 15 -1.158 -10.579 -18.429 70 HG2 PRO 15 2HG PRO 15 -3.669 -12.011 -17.653 71 HG3 PRO 15 3HG PRO 15 -2.066 -12.077 -16.899 72 HD2 PRO 15 2HD PRO 15 -4.087 -10.581 -15.896 73 HD3 PRO 15 3HD PRO 15 -2.384 -10.100 -15.757 74 H ALA 16 H ALA 16 -3.120 -8.649 -21.107 75 HA ALA 16 HA ALA 16 -5.947 -9.298 -21.434 76 HB1 ALA 16 1HB ALA 16 -4.301 -8.005 -23.564 77 HB2 ALA 16 2HB ALA 16 -6.008 -7.787 -23.174 78 HB3 ALA 16 3HB ALA 16 -4.769 -7.081 -22.136 79 H VAL 17 H VAL 17 -4.391 -11.558 -21.228 80 HA VAL 17 HA VAL 17 -4.871 -12.782 -23.811 81 HB VAL 17 HB VAL 17 -2.580 -13.882 -23.768 82 HG11 VAL 17 1HG1 VAL 17 -3.370 -12.006 -25.295 83 HG12 VAL 17 2HG1 VAL 17 -2.453 -10.919 -24.251 84 HG13 VAL 17 3HG1 VAL 17 -1.627 -12.212 -25.121 85 HG21 VAL 17 3HG2 VAL 17 -2.290 -12.742 -21.353 86 HG22 VAL 17 1HG2 VAL 17 -0.931 -13.191 -22.383 87 HG23 VAL 17 2HG2 VAL 17 -1.503 -11.523 -22.355 88 H GLY 18 H GLY 18 -5.071 -15.044 -23.719 89 HA2 GLY 18 2HA GLY 18 -5.760 -16.994 -22.716 90 HA3 GLY 18 3HA GLY 18 -4.389 -16.735 -21.647 91 H GLY 19 H GLY 19 -7.611 -15.259 -22.102 92 HA2 GLY 19 2HA GLY 19 -9.371 -15.159 -20.584 93 HA3 GLY 19 3HA GLY 19 -8.377 -16.017 -19.416 94 H GLY 20 H GLY 20 -6.244 -14.491 -18.994 95 HA2 GLY 20 2HA GLY 20 -5.499 -12.324 -18.395 96 HA3 GLY 20 3HA GLY 20 -7.154 -11.747 -18.522 97 H SER 21 H SER 21 -4.800 -13.303 -16.488 98 HA SER 21 HA SER 21 -6.691 -13.210 -14.234 99 HB2 SER 21 2HB SER 21 -5.342 -15.369 -14.979 100 HB3 SER 21 3HB SER 21 -4.064 -14.619 -14.023 101 HG SER 21 HG SER 21 -5.597 -16.097 -12.913 102 HA PRO 22 HA PRO 22 -4.388 -9.713 -12.771 103 HB2 PRO 22 2HB PRO 22 -5.612 -9.525 -10.355 104 HB3 PRO 22 3HB PRO 22 -6.371 -8.994 -11.861 105 HG2 PRO 22 2HG PRO 22 -6.752 -11.547 -10.345 106 HG3 PRO 22 3HG PRO 22 -7.968 -10.511 -11.115 107 HD2 PRO 22 2HD PRO 22 -7.052 -12.785 -12.265 108 HD3 PRO 22 3HD PRO 22 -7.554 -11.370 -13.213 109 H LEU 23 H LEU 23 -2.437 -9.644 -11.854 110 HA LEU 23 HA LEU 23 -1.781 -11.655 -9.803 111 HB2 LEU 23 2HB LEU 23 0.154 -10.316 -11.681 112 HB3 LEU 23 3HB LEU 23 0.481 -11.657 -10.585 113 HG LEU 23 HG LEU 23 -1.568 -12.080 -12.692 114 HD11 LEU 23 1HD1 LEU 23 1.093 -11.183 -13.293 115 HD12 LEU 23 2HD1 LEU 23 -0.231 -11.578 -14.388 116 HD13 LEU 23 3HD1 LEU 23 0.867 -12.844 -13.840 117 HD21 LEU 23 3HD2 LEU 23 -0.007 -14.248 -12.685 118 HD22 LEU 23 1HD2 LEU 23 -1.323 -14.012 -11.535 119 HD23 LEU 23 2HD2 LEU 23 0.338 -13.651 -11.062 120 H GLU 24 H GLU 24 -1.305 -10.897 -7.853 121 HA GLU 24 HA GLU 24 -0.917 -8.031 -7.502 122 HB2 GLU 24 2HB GLU 24 -2.318 -9.909 -6.060 123 HB3 GLU 24 3HB GLU 24 -0.859 -9.708 -5.100 124 HG2 GLU 24 2HG GLU 24 -1.251 -7.361 -4.873 125 HG3 GLU 24 3HG GLU 24 -2.598 -7.428 -6.008 126 H LEU 25 H LEU 25 0.985 -7.111 -7.084 127 HA LEU 25 HA LEU 25 3.158 -8.705 -5.959 128 HB2 LEU 25 2HB LEU 25 2.988 -7.975 -8.700 129 HB3 LEU 25 3HB LEU 25 4.286 -7.037 -7.964 130 HG LEU 25 HG LEU 25 4.601 -9.721 -7.119 131 HD11 LEU 25 1HD1 LEU 25 4.742 -9.753 -10.071 132 HD12 LEU 25 2HD1 LEU 25 3.139 -9.897 -9.350 133 HD13 LEU 25 3HD1 LEU 25 4.400 -11.057 -8.933 134 HD21 LEU 25 3HD2 LEU 25 6.065 -7.674 -8.662 135 HD22 LEU 25 1HD2 LEU 25 6.581 -9.345 -8.891 136 HD23 LEU 25 2HD2 LEU 25 6.577 -8.637 -7.276 137 H GLU 26 H GLU 26 4.967 -7.374 -5.200 138 HA GLU 26 HA GLU 26 3.991 -4.785 -4.236 139 HB2 GLU 26 2HB GLU 26 5.894 -4.969 -2.613 140 HB3 GLU 26 3HB GLU 26 4.680 -6.232 -2.464 141 HG2 GLU 26 2HG GLU 26 6.181 -7.819 -2.810 142 HG3 GLU 26 3HG GLU 26 6.760 -7.036 -4.279 143 H VAL 27 H VAL 27 4.528 -3.151 -5.534 144 HA VAL 27 HA VAL 27 7.345 -2.837 -6.269 145 HB VAL 27 HB VAL 27 6.584 -1.954 -8.528 146 HG11 VAL 27 1HG1 VAL 27 6.651 -4.803 -7.682 147 HG12 VAL 27 2HG1 VAL 27 6.172 -4.434 -9.340 148 HG13 VAL 27 3HG1 VAL 27 7.746 -3.911 -8.738 149 HG21 VAL 27 3HG2 VAL 27 4.228 -3.721 -8.421 150 HG22 VAL 27 1HG2 VAL 27 4.086 -2.199 -7.541 151 HG23 VAL 27 2HG2 VAL 27 4.463 -2.189 -9.264 152 H ALA 28 H ALA 28 7.759 -0.587 -7.135 153 HA ALA 28 HA ALA 28 5.936 1.380 -5.923 154 HB1 ALA 28 1HB ALA 28 7.461 1.928 -4.410 155 HB2 ALA 28 2HB ALA 28 8.596 0.759 -5.086 156 HB3 ALA 28 3HB ALA 28 8.551 2.407 -5.711 157 HA PRO 29 HA PRO 29 6.328 2.942 -10.102 158 HB2 PRO 29 2HB PRO 29 4.470 4.899 -9.807 159 HB3 PRO 29 3HB PRO 29 4.046 3.203 -10.068 160 HG2 PRO 29 2HG PRO 29 4.131 4.764 -7.514 161 HG3 PRO 29 3HG PRO 29 2.914 3.603 -8.076 162 HD2 PRO 29 2HD PRO 29 4.835 2.946 -6.285 163 HD3 PRO 29 3HD PRO 29 4.181 1.781 -7.454 164 H ASN 30 H ASN 30 6.996 4.474 -7.117 165 HA ASN 30 HA ASN 30 7.845 6.984 -8.297 166 HB2 ASN 30 2HB ASN 30 8.307 7.704 -6.062 167 HB3 ASN 30 3HB ASN 30 6.784 6.820 -6.016 168 HD21 ASN 30 1HD2 ASN 30 6.648 4.928 -4.893 169 HD22 ASN 30 2HD2 ASN 30 7.916 4.329 -3.883 170 H ALA 31 H ALA 31 9.118 4.091 -8.531 171 HA ALA 31 HA ALA 31 11.886 4.921 -7.976 172 HB1 ALA 31 1HB ALA 31 10.469 2.389 -7.736 173 HB2 ALA 31 2HB ALA 31 12.000 2.246 -8.601 174 HB3 ALA 31 3HB ALA 31 11.966 2.928 -6.975 175 H THR 32 H THR 32 10.586 2.535 -10.255 176 HA THR 32 HA THR 32 11.352 4.107 -12.551 177 HB THR 32 HB THR 32 12.681 1.640 -12.996 178 HG1 THR 32 HG1 THR 32 14.326 1.924 -11.311 179 HG21 THR 32 3HG2 THR 32 13.233 3.722 -14.106 180 HG22 THR 32 1HG2 THR 32 14.653 3.114 -13.257 181 HG23 THR 32 2HG2 THR 32 13.719 4.444 -12.573 182 H VAL 33 H VAL 33 10.391 3.414 -14.434 183 HA VAL 33 HA VAL 33 8.128 1.718 -14.179 184 HB VAL 33 HB VAL 33 9.434 2.822 -16.670 185 HG11 VAL 33 1HG1 VAL 33 6.811 2.458 -17.283 186 HG12 VAL 33 2HG1 VAL 33 8.103 1.329 -17.694 187 HG13 VAL 33 3HG1 VAL 33 7.124 1.063 -16.251 188 HG21 VAL 33 3HG2 VAL 33 8.374 4.755 -16.302 189 HG22 VAL 33 1HG2 VAL 33 6.883 3.943 -15.827 190 HG23 VAL 33 2HG2 VAL 33 8.167 4.189 -14.644 191 H GLY 34 H GLY 34 11.281 1.332 -15.768 192 HA2 GLY 34 2HA GLY 34 10.732 -1.258 -16.808 193 HA3 GLY 34 3HA GLY 34 12.321 -0.524 -16.643 194 H ALA 35 H ALA 35 12.059 -0.110 -13.769 195 HA ALA 35 HA ALA 35 13.127 -2.571 -12.883 196 HB1 ALA 35 1HB ALA 35 13.238 -1.558 -10.703 197 HB2 ALA 35 2HB ALA 35 13.701 -0.365 -11.917 198 HB3 ALA 35 3HB ALA 35 12.097 -0.303 -11.186 199 H VAL 36 H VAL 36 9.994 -0.997 -12.296 200 HA VAL 36 HA VAL 36 8.966 -3.075 -10.657 201 HB VAL 36 HB VAL 36 6.757 -2.017 -11.050 202 HG11 VAL 36 1HG1 VAL 36 8.540 -1.197 -9.390 203 HG12 VAL 36 2HG1 VAL 36 8.761 0.148 -10.511 204 HG13 VAL 36 3HG1 VAL 36 7.189 -0.124 -9.758 205 HG21 VAL 36 3HG2 VAL 36 8.333 -0.272 -12.937 206 HG22 VAL 36 1HG2 VAL 36 6.973 -1.323 -13.333 207 HG23 VAL 36 2HG2 VAL 36 6.717 0.115 -12.344 208 H ARG 37 H ARG 37 8.757 -2.362 -14.109 209 HA ARG 37 HA ARG 37 6.854 -4.333 -14.767 210 HB2 ARG 37 2HB ARG 37 7.530 -2.427 -16.234 211 HB3 ARG 37 3HB ARG 37 9.056 -3.250 -16.531 212 HG2 ARG 37 2HG ARG 37 7.742 -5.175 -17.440 213 HG3 ARG 37 3HG ARG 37 6.301 -4.163 -17.318 214 HD2 ARG 37 2HD ARG 37 7.135 -4.031 -19.562 215 HD3 ARG 37 3HD ARG 37 7.428 -2.486 -18.765 216 HE ARG 37 HE ARG 37 9.687 -2.849 -18.953 217 HH11 ARG 37 1HH1 ARG 37 7.975 -5.804 -19.631 218 HH12 ARG 37 2HH1 ARG 37 9.381 -6.641 -20.198 219 HH21 ARG 37 1HH2 ARG 37 11.545 -3.941 -19.698 220 HH22 ARG 37 2HH2 ARG 37 11.412 -5.581 -20.235 221 H THR 38 H THR 38 10.388 -4.395 -14.643 222 HA THR 38 HA THR 38 10.644 -7.044 -15.656 223 HB THR 38 HB THR 38 12.626 -5.514 -13.961 224 HG1 THR 38 HG1 THR 38 13.373 -4.661 -15.857 225 HG21 THR 38 3HG2 THR 38 12.761 -8.002 -15.612 226 HG22 THR 38 1HG2 THR 38 13.458 -7.669 -14.027 227 HG23 THR 38 2HG2 THR 38 14.186 -6.973 -15.475 228 H LYS 39 H LYS 39 10.425 -5.651 -12.426 229 HA LYS 39 HA LYS 39 11.070 -7.973 -10.969 230 HB2 LYS 39 2HB LYS 39 10.914 -5.578 -10.114 231 HB3 LYS 39 3HB LYS 39 9.173 -5.818 -10.047 232 HG2 LYS 39 2HG LYS 39 9.579 -6.462 -7.943 233 HG3 LYS 39 3HG LYS 39 10.037 -7.994 -8.689 234 HD2 LYS 39 2HD LYS 39 12.125 -5.896 -8.500 235 HD3 LYS 39 3HD LYS 39 11.632 -6.684 -6.999 236 HE2 LYS 39 2HE LYS 39 12.052 -8.563 -9.183 237 HE3 LYS 39 3HE LYS 39 13.496 -7.626 -8.802 238 HZ1 LYS 39 3HZ LYS 39 13.137 -8.275 -6.438 239 HZ2 LYS 39 1HZ LYS 39 13.516 -9.567 -7.463 240 HZ3 LYS 39 2HZ LYS 39 11.920 -9.331 -6.956 241 H VAL 40 H VAL 40 7.952 -6.659 -12.041 242 HA VAL 40 HA VAL 40 6.381 -8.714 -10.868 243 HB VAL 40 HB VAL 40 5.712 -6.869 -13.167 244 HG11 VAL 40 1HG1 VAL 40 3.429 -7.659 -11.681 245 HG12 VAL 40 2HG1 VAL 40 3.802 -7.980 -13.376 246 HG13 VAL 40 3HG1 VAL 40 4.316 -9.116 -12.128 247 HG21 VAL 40 3HG2 VAL 40 4.489 -6.397 -10.552 248 HG22 VAL 40 1HG2 VAL 40 6.239 -6.178 -10.576 249 HG23 VAL 40 2HG2 VAL 40 5.220 -5.260 -11.685 250 H CYS 41 H CYS 41 7.567 -8.168 -14.173 251 HA CYS 41 HA CYS 41 6.379 -10.360 -15.403 252 HB2 CYS 41 2HB CYS 41 7.722 -8.419 -16.441 253 HB3 CYS 41 3HB CYS 41 9.142 -9.408 -16.121 254 HG CYS 41 HG CYS 41 8.895 -10.158 -18.613 255 H ALA 42 H ALA 42 9.521 -10.128 -13.771 256 HA ALA 42 HA ALA 42 10.357 -12.767 -14.270 257 HB1 ALA 42 1HB ALA 42 11.092 -10.974 -11.958 258 HB2 ALA 42 2HB ALA 42 11.973 -12.410 -12.483 259 HB3 ALA 42 3HB ALA 42 11.881 -10.999 -13.536 260 H MET 43 H MET 43 8.528 -11.341 -11.595 261 HA MET 43 HA MET 43 8.456 -13.578 -9.919 262 HB2 MET 43 2HB MET 43 7.499 -11.031 -9.774 263 HB3 MET 43 3HB MET 43 6.007 -11.939 -9.980 264 HG2 MET 43 2HG MET 43 8.056 -12.615 -7.892 265 HG3 MET 43 3HG MET 43 6.727 -11.493 -7.611 266 HE1 MET 43 3HE MET 43 6.877 -13.507 -5.603 267 HE2 MET 43 1HE MET 43 5.288 -12.752 -5.730 268 HE3 MET 43 2HE MET 43 5.422 -14.505 -5.600 269 H LYS 44 H LYS 44 6.654 -12.807 -12.797 270 HA LYS 44 HA LYS 44 4.881 -15.104 -12.384 271 HB2 LYS 44 2HB LYS 44 4.781 -13.096 -14.635 272 HB3 LYS 44 3HB LYS 44 3.521 -14.221 -14.145 273 HG2 LYS 44 2HG LYS 44 4.527 -12.016 -12.368 274 HG3 LYS 44 3HG LYS 44 3.175 -11.820 -13.487 275 HD2 LYS 44 2HD LYS 44 2.064 -12.392 -11.556 276 HD3 LYS 44 3HD LYS 44 2.281 -13.980 -12.297 277 HE2 LYS 44 2HE LYS 44 3.698 -14.671 -10.692 278 HE3 LYS 44 3HE LYS 44 4.502 -13.106 -10.589 279 HZ1 LYS 44 3HZ LYS 44 3.456 -12.969 -8.633 280 HZ2 LYS 44 1HZ LYS 44 2.322 -14.163 -9.021 281 HZ3 LYS 44 2HZ LYS 44 2.086 -12.571 -9.541 282 H LYS 45 H LYS 45 7.797 -14.363 -13.826 283 HA LYS 45 HA LYS 45 9.175 -15.485 -15.246 284 HB2 LYS 45 2HB LYS 45 8.044 -17.429 -13.860 285 HB3 LYS 45 3HB LYS 45 7.285 -17.795 -15.403 286 HG2 LYS 45 2HG LYS 45 9.262 -19.130 -15.150 287 HG3 LYS 45 3HG LYS 45 9.524 -17.945 -16.432 288 HD2 LYS 45 2HD LYS 45 10.346 -16.741 -14.015 289 HD3 LYS 45 3HD LYS 45 11.027 -18.370 -14.035 290 HE2 LYS 45 2HE LYS 45 11.641 -17.727 -16.509 291 HE3 LYS 45 3HE LYS 45 11.499 -16.082 -15.889 292 HZ1 LYS 45 3HZ LYS 45 13.079 -16.777 -14.098 293 HZ2 LYS 45 1HZ LYS 45 13.745 -16.724 -15.652 294 HZ3 LYS 45 2HZ LYS 45 13.339 -18.211 -14.957 295 H LEU 46 H LEU 46 7.841 -13.669 -16.550 296 HA LEU 46 HA LEU 46 6.769 -14.996 -18.953 297 HB2 LEU 46 2HB LEU 46 6.041 -12.459 -17.570 298 HB3 LEU 46 3HB LEU 46 5.837 -12.564 -19.317 299 HG LEU 46 HG LEU 46 4.662 -14.805 -17.839 300 HD11 LEU 46 1HD1 LEU 46 4.367 -12.506 -16.498 301 HD12 LEU 46 2HD1 LEU 46 3.115 -13.744 -16.581 302 HD13 LEU 46 3HD1 LEU 46 3.042 -12.344 -17.650 303 HD21 LEU 46 3HD2 LEU 46 4.083 -14.737 -20.069 304 HD22 LEU 46 1HD2 LEU 46 3.956 -12.978 -20.094 305 HD23 LEU 46 2HD2 LEU 46 2.698 -13.942 -19.319 306 HA PRO 47 HA PRO 47 9.969 -13.286 -21.420 307 HB2 PRO 47 2HB PRO 47 8.654 -12.608 -23.696 308 HB3 PRO 47 3HB PRO 47 8.974 -14.284 -23.235 309 HG2 PRO 47 2HG PRO 47 6.470 -12.676 -22.912 310 HG3 PRO 47 3HG PRO 47 6.660 -14.357 -23.445 311 HD2 PRO 47 2HD PRO 47 5.922 -13.703 -20.923 312 HD3 PRO 47 3HD PRO 47 6.888 -15.146 -21.291 313 HA PRO 48 HA PRO 48 9.511 -8.915 -20.385 314 HB2 PRO 48 2HB PRO 48 12.171 -8.381 -20.492 315 HB3 PRO 48 3HB PRO 48 11.399 -9.141 -19.095 316 HG2 PRO 48 2HG PRO 48 12.935 -10.407 -21.331 317 HG3 PRO 48 3HG PRO 48 13.007 -10.745 -19.592 318 HD2 PRO 48 2HD PRO 48 11.622 -12.301 -21.323 319 HD3 PRO 48 3HD PRO 48 11.111 -12.055 -19.640 320 H ASP 49 H ASP 49 11.140 -10.389 -23.108 321 HA ASP 49 HA ASP 49 11.391 -7.894 -24.552 322 HB2 ASP 49 2HB ASP 49 13.120 -9.528 -24.908 323 HB3 ASP 49 3HB ASP 49 11.936 -10.763 -25.328 324 H THR 50 H THR 50 9.090 -10.430 -24.215 325 HA THR 50 HA THR 50 7.574 -9.388 -26.518 326 HB THR 50 HB THR 50 6.845 -12.012 -25.317 327 HG1 THR 50 HG1 THR 50 9.168 -11.531 -26.887 328 HG21 THR 50 3HG2 THR 50 6.006 -10.572 -27.491 329 HG22 THR 50 1HG2 THR 50 5.762 -12.303 -27.265 330 HG23 THR 50 2HG2 THR 50 7.129 -11.722 -28.217 331 H THR 51 H THR 51 7.563 -8.152 -23.941 332 HA THR 51 HA THR 51 4.708 -8.393 -23.348 333 HB THR 51 HB THR 51 5.982 -9.772 -21.675 334 HG1 THR 51 HG1 THR 51 4.626 -9.116 -20.101 335 HG21 THR 51 3HG2 THR 51 7.846 -7.893 -21.662 336 HG22 THR 51 1HG2 THR 51 7.528 -8.881 -20.237 337 HG23 THR 51 2HG2 THR 51 6.857 -7.254 -20.350 338 H ARG 52 H ARG 52 3.740 -6.504 -22.630 339 HA ARG 52 HA ARG 52 5.452 -4.134 -22.368 340 HB2 ARG 52 2HB ARG 52 3.287 -4.613 -24.355 341 HB3 ARG 52 3HB ARG 52 3.411 -3.004 -23.656 342 HG2 ARG 52 2HG ARG 52 4.889 -2.576 -25.256 343 HG3 ARG 52 3HG ARG 52 6.010 -3.591 -24.346 344 HD2 ARG 52 2HD ARG 52 5.169 -5.554 -25.620 345 HD3 ARG 52 3HD ARG 52 4.194 -4.454 -26.593 346 HE ARG 52 HE ARG 52 6.906 -3.651 -26.617 347 HH11 ARG 52 1HH1 ARG 52 4.756 -6.074 -27.894 348 HH12 ARG 52 2HH1 ARG 52 5.704 -6.350 -29.319 349 HH21 ARG 52 1HH2 ARG 52 8.162 -4.006 -28.488 350 HH22 ARG 52 2HH2 ARG 52 7.641 -5.174 -29.655 351 H LEU 53 H LEU 53 4.452 -2.351 -21.255 352 HA LEU 53 HA LEU 53 2.074 -3.079 -19.685 353 HB2 LEU 53 2HB LEU 53 3.591 -3.397 -18.025 354 HB3 LEU 53 3HB LEU 53 4.772 -2.307 -18.747 355 HG LEU 53 HG LEU 53 3.503 -0.384 -17.910 356 HD11 LEU 53 1HD1 LEU 53 1.512 -2.428 -17.411 357 HD12 LEU 53 2HD1 LEU 53 1.339 -0.675 -17.490 358 HD13 LEU 53 3HD1 LEU 53 1.827 -1.445 -15.981 359 HD21 LEU 53 3HD2 LEU 53 3.761 -1.050 -15.386 360 HD22 LEU 53 1HD2 LEU 53 5.176 -0.895 -16.427 361 HD23 LEU 53 2HD2 LEU 53 4.520 -2.491 -16.064 362 H THR 54 H THR 54 0.549 -1.558 -19.642 363 HA THR 54 HA THR 54 1.304 1.206 -20.325 364 HB THR 54 HB THR 54 -1.397 0.700 -21.128 365 HG1 THR 54 HG1 THR 54 -1.026 -0.880 -22.705 366 HG21 THR 54 3HG2 THR 54 1.112 1.763 -22.243 367 HG22 THR 54 1HG2 THR 54 -0.528 2.404 -22.329 368 HG23 THR 54 2HG2 THR 54 -0.023 1.120 -23.429 369 H TYR 55 H TYR 55 0.288 2.827 -19.211 370 HA TYR 55 HA TYR 55 -1.678 2.015 -17.174 371 HB2 TYR 55 2HB TYR 55 0.472 2.348 -16.078 372 HB3 TYR 55 3HB TYR 55 0.633 3.936 -16.821 373 HD1 TYR 55 HD2 TYR 55 -2.172 2.247 -15.012 374 HD2 TYR 55 HD1 TYR 55 0.477 5.572 -15.203 375 HE1 TYR 55 HE2 TYR 55 -3.313 3.260 -13.083 376 HE2 TYR 55 HE1 TYR 55 -0.656 6.593 -13.273 377 HH TYR 55 HH TYR 55 -2.666 6.512 -12.064 378 H LYS 56 H LYS 56 -3.485 3.188 -17.126 379 HA LYS 56 HA LYS 56 -5.054 4.735 -17.693 380 HB2 LYS 56 2HB LYS 56 -3.409 6.080 -16.260 381 HB3 LYS 56 3HB LYS 56 -2.814 6.748 -17.774 382 HG2 LYS 56 2HG LYS 56 -4.338 8.342 -17.295 383 HG3 LYS 56 3HG LYS 56 -5.417 7.213 -18.116 384 HD2 LYS 56 2HD LYS 56 -5.168 6.526 -15.332 385 HD3 LYS 56 3HD LYS 56 -5.656 8.213 -15.510 386 HE2 LYS 56 2HE LYS 56 -7.041 6.288 -17.259 387 HE3 LYS 56 3HE LYS 56 -7.372 6.126 -15.535 388 HZ1 LYS 56 3HZ LYS 56 -7.906 8.532 -15.521 389 HZ2 LYS 56 1HZ LYS 56 -8.959 7.612 -16.473 390 HZ3 LYS 56 2HZ LYS 56 -7.756 8.548 -17.206 391 H GLY 57 H GLY 57 -3.754 3.306 -19.843 392 HA2 GLY 57 2HA GLY 57 -3.918 3.294 -22.140 393 HA3 GLY 57 3HA GLY 57 -4.736 4.846 -22.033 394 H ARG 58 H ARG 58 -1.741 4.811 -20.449 395 HA ARG 58 HA ARG 58 -0.452 6.064 -22.785 396 HB2 ARG 58 2HB ARG 58 -1.044 7.698 -21.026 397 HB3 ARG 58 3HB ARG 58 -0.079 6.787 -19.873 398 HG2 ARG 58 2HG ARG 58 1.904 7.493 -20.760 399 HG3 ARG 58 3HG ARG 58 1.225 7.730 -22.371 400 HD2 ARG 58 2HD ARG 58 0.072 9.723 -21.630 401 HD3 ARG 58 3HD ARG 58 0.623 9.460 -19.976 402 HE ARG 58 HE ARG 58 2.121 10.613 -22.137 403 HH11 ARG 58 1HH1 ARG 58 2.325 8.917 -19.104 404 HH12 ARG 58 2HH1 ARG 58 3.922 9.486 -18.744 405 HH21 ARG 58 1HH2 ARG 58 4.223 11.369 -21.675 406 HH22 ARG 58 2HH2 ARG 58 4.999 10.881 -20.207 407 H ALA 59 H ALA 59 1.826 5.809 -22.980 408 HA ALA 59 HA ALA 59 2.800 3.346 -21.709 409 HB1 ALA 59 1HB ALA 59 3.120 4.542 -24.370 410 HB2 ALA 59 2HB ALA 59 4.590 3.847 -23.686 411 HB3 ALA 59 3HB ALA 59 3.147 2.850 -23.872 412 H LEU 60 H LEU 60 4.198 3.558 -20.101 413 HA LEU 60 HA LEU 60 5.967 5.915 -20.073 414 HB2 LEU 60 2HB LEU 60 5.097 4.366 -17.649 415 HB3 LEU 60 3HB LEU 60 5.896 5.936 -17.706 416 HG LEU 60 HG LEU 60 3.656 6.594 -18.982 417 HD11 LEU 60 1HD1 LEU 60 2.971 4.087 -18.587 418 HD12 LEU 60 2HD1 LEU 60 1.787 5.387 -18.454 419 HD13 LEU 60 3HD1 LEU 60 2.506 4.697 -16.999 420 HD21 LEU 60 3HD2 LEU 60 3.363 6.379 -16.039 421 HD22 LEU 60 1HD2 LEU 60 3.123 7.762 -17.106 422 HD23 LEU 60 2HD2 LEU 60 4.755 7.265 -16.660 423 H LYS 61 H LYS 61 8.096 5.624 -19.236 424 HA LYS 61 HA LYS 61 9.099 3.022 -18.602 425 HB2 LYS 61 2HB LYS 61 8.978 2.672 -20.975 426 HB3 LYS 61 3HB LYS 61 9.735 4.227 -21.297 427 HG2 LYS 61 2HG LYS 61 11.748 3.312 -21.236 428 HG3 LYS 61 3HG LYS 61 11.446 2.648 -19.629 429 HD2 LYS 61 2HD LYS 61 10.349 1.335 -22.095 430 HD3 LYS 61 3HD LYS 61 11.993 1.013 -21.538 431 HE2 LYS 61 2HE LYS 61 10.374 0.796 -19.268 432 HE3 LYS 61 3HE LYS 61 9.485 -0.015 -20.556 433 HZ1 LYS 61 3HZ LYS 61 12.297 -0.653 -20.467 434 HZ2 LYS 61 1HZ LYS 61 10.959 -1.675 -20.631 435 HZ3 LYS 61 2HZ LYS 61 11.436 -1.147 -19.097 436 H ASP 62 H ASP 62 10.519 5.835 -20.264 437 HA ASP 62 HA ASP 62 12.704 5.941 -18.414 438 HB2 ASP 62 2HB ASP 62 12.002 7.156 -20.951 439 HB3 ASP 62 3HB ASP 62 12.669 8.348 -19.837 440 H THR 63 H THR 63 9.559 6.946 -18.193 441 HA THR 63 HA THR 63 9.685 9.497 -17.076 442 HB THR 63 HB THR 63 7.737 7.448 -16.061 443 HG1 THR 63 HG1 THR 63 7.438 8.821 -18.532 444 HG21 THR 63 3HG2 THR 63 7.994 10.298 -15.977 445 HG22 THR 63 1HG2 THR 63 6.776 9.273 -15.220 446 HG23 THR 63 2HG2 THR 63 6.529 9.872 -16.861 447 H GLU 64 H GLU 64 10.730 6.488 -15.815 448 HA GLU 64 HA GLU 64 11.743 5.903 -13.863 449 HB2 GLU 64 2HB GLU 64 12.098 8.806 -14.018 450 HB3 GLU 64 3HB GLU 64 12.133 8.186 -12.374 451 HG2 GLU 64 2HG GLU 64 13.967 6.782 -12.834 452 HG3 GLU 64 3HG GLU 64 13.799 7.008 -14.574 453 H THR 65 H THR 65 10.135 8.763 -12.551 454 HA THR 65 HA THR 65 8.699 7.033 -10.679 455 HB THR 65 HB THR 65 8.312 8.991 -9.338 456 HG1 THR 65 HG1 THR 65 8.593 11.011 -10.085 457 HG21 THR 65 3HG2 THR 65 10.653 7.892 -9.478 458 HG22 THR 65 1HG2 THR 65 10.492 9.440 -8.651 459 HG23 THR 65 2HG2 THR 65 11.127 9.381 -10.295 460 H LEU 66 H LEU 66 6.445 7.512 -10.165 461 HA LEU 66 HA LEU 66 4.965 8.630 -12.453 462 HB2 LEU 66 2HB LEU 66 4.935 5.969 -11.431 463 HB3 LEU 66 3HB LEU 66 3.360 6.704 -11.136 464 HG LEU 66 HG LEU 66 3.244 5.529 -13.204 465 HD11 LEU 66 1HD1 LEU 66 2.060 7.159 -14.129 466 HD12 LEU 66 2HD1 LEU 66 3.522 8.045 -14.559 467 HD13 LEU 66 3HD1 LEU 66 2.783 8.280 -12.976 468 HD21 LEU 66 3HD2 LEU 66 5.881 5.849 -13.443 469 HD22 LEU 66 1HD2 LEU 66 5.350 7.129 -14.534 470 HD23 LEU 66 2HD2 LEU 66 4.840 5.464 -14.814 471 H GLU 67 H GLU 67 5.045 8.011 -8.988 472 HA GLU 67 HA GLU 67 2.614 9.180 -8.269 473 HB2 GLU 67 2HB GLU 67 3.465 9.290 -6.047 474 HB3 GLU 67 3HB GLU 67 4.150 7.847 -6.782 475 HG2 GLU 67 2HG GLU 67 6.007 8.688 -5.788 476 HG3 GLU 67 3HG GLU 67 6.127 9.487 -7.355 477 H SER 68 H SER 68 5.641 10.611 -9.196 478 HA SER 68 HA SER 68 5.258 13.186 -8.112 479 HB2 SER 68 2HB SER 68 7.442 12.392 -8.928 480 HB3 SER 68 3HB SER 68 6.819 12.376 -10.578 481 HG SER 68 HG SER 68 7.501 14.362 -10.614 482 H LEU 69 H LEU 69 3.696 11.573 -10.650 483 HA LEU 69 HA LEU 69 2.856 14.064 -11.940 484 HB2 LEU 69 2HB LEU 69 2.842 11.190 -12.714 485 HB3 LEU 69 3HB LEU 69 1.643 12.262 -13.434 486 HG LEU 69 HG LEU 69 3.365 13.611 -14.430 487 HD11 LEU 69 1HD1 LEU 69 5.145 12.024 -12.650 488 HD12 LEU 69 2HD1 LEU 69 5.152 13.750 -13.008 489 HD13 LEU 69 3HD1 LEU 69 5.778 12.602 -14.192 490 HD21 LEU 69 3HD2 LEU 69 3.694 12.198 -16.135 491 HD22 LEU 69 1HD2 LEU 69 2.764 11.051 -15.171 492 HD23 LEU 69 2HD2 LEU 69 4.527 11.017 -15.123 493 H GLY 70 H GLY 70 1.830 11.850 -9.600 494 HA2 GLY 70 2HA GLY 70 -0.154 12.659 -8.334 495 HA3 GLY 70 3HA GLY 70 -0.959 12.787 -9.891 496 H VAL 71 H VAL 71 1.138 10.102 -9.429 497 HA VAL 71 HA VAL 71 -1.158 8.308 -9.504 498 HB VAL 71 HB VAL 71 1.794 7.709 -9.752 499 HG11 VAL 71 1HG1 VAL 71 1.042 5.661 -9.131 500 HG12 VAL 71 2HG1 VAL 71 -0.615 5.992 -9.638 501 HG13 VAL 71 3HG1 VAL 71 0.609 5.577 -10.838 502 HG21 VAL 71 3HG2 VAL 71 0.948 7.178 -12.162 503 HG22 VAL 71 1HG2 VAL 71 -0.371 8.268 -11.733 504 HG23 VAL 71 2HG2 VAL 71 1.296 8.844 -11.699 505 H ALA 72 H ALA 72 -1.652 6.812 -7.952 506 HA ALA 72 HA ALA 72 -0.090 6.941 -5.455 507 HB1 ALA 72 1HB ALA 72 -1.997 7.017 -4.162 508 HB2 ALA 72 2HB ALA 72 -2.465 8.006 -5.545 509 HB3 ALA 72 3HB ALA 72 -3.014 6.334 -5.430 510 H ASP 73 H ASP 73 -0.491 4.999 -4.026 511 HA ASP 73 HA ASP 73 0.078 2.632 -5.528 512 HB2 ASP 73 2HB ASP 73 -0.248 3.206 -2.588 513 HB3 ASP 73 3HB ASP 73 -0.002 1.568 -3.189 514 H GLY 74 H GLY 74 -1.128 0.727 -5.667 515 HA2 GLY 74 2HA GLY 74 -3.039 -0.622 -5.306 516 HA3 GLY 74 3HA GLY 74 -3.884 0.787 -4.681 517 H ASP 75 H ASP 75 -2.115 1.148 -7.615 518 HA ASP 75 HA ASP 75 -4.571 1.674 -9.051 519 HB2 ASP 75 2HB ASP 75 -1.769 2.384 -9.324 520 HB3 ASP 75 3HB ASP 75 -2.452 1.852 -10.859 521 H LYS 76 H LYS 76 -4.306 0.927 -11.543 522 HA LYS 76 HA LYS 76 -3.845 -1.983 -11.484 523 HB2 LYS 76 2HB LYS 76 -5.745 -2.239 -13.029 524 HB3 LYS 76 3HB LYS 76 -6.239 -1.535 -11.495 525 HG2 LYS 76 2HG LYS 76 -5.905 0.727 -12.755 526 HG3 LYS 76 3HG LYS 76 -6.082 -0.281 -14.193 527 HD2 LYS 76 2HD LYS 76 -8.082 -0.792 -12.113 528 HD3 LYS 76 3HD LYS 76 -8.143 0.837 -12.790 529 HE2 LYS 76 2HE LYS 76 -7.791 -1.054 -14.905 530 HE3 LYS 76 3HE LYS 76 -9.149 -1.557 -13.900 531 HZ1 LYS 76 3HZ LYS 76 -8.863 0.797 -15.592 532 HZ2 LYS 76 1HZ LYS 76 -9.692 1.015 -14.134 533 HZ3 LYS 76 2HZ LYS 76 -10.235 -0.132 -15.251 534 H PHE 77 H PHE 77 -2.564 -2.778 -13.032 535 HA PHE 77 HA PHE 77 -1.796 -0.975 -15.229 536 HB2 PHE 77 2HB PHE 77 -0.256 -3.095 -13.745 537 HB3 PHE 77 3HB PHE 77 0.271 -2.505 -15.318 538 HD1 PHE 77 HD2 PHE 77 -0.192 0.323 -15.230 539 HD2 PHE 77 HD1 PHE 77 1.160 -2.271 -12.138 540 HE1 PHE 77 HE2 PHE 77 0.939 2.217 -14.141 541 HE2 PHE 77 HE1 PHE 77 2.292 -0.381 -11.043 542 HZ PHE 77 HZ PHE 77 2.184 1.866 -12.045 543 H VAL 78 H VAL 78 -1.747 -1.726 -17.324 544 HA VAL 78 HA VAL 78 -3.197 -4.235 -17.781 545 HB VAL 78 HB VAL 78 -2.638 -2.026 -19.763 546 HG11 VAL 78 1HG1 VAL 78 -4.488 -3.100 -21.020 547 HG12 VAL 78 2HG1 VAL 78 -3.068 -4.133 -20.843 548 HG13 VAL 78 3HG1 VAL 78 -4.490 -4.405 -19.834 549 HG21 VAL 78 3HG2 VAL 78 -4.924 -1.292 -19.394 550 HG22 VAL 78 1HG2 VAL 78 -5.149 -2.546 -18.174 551 HG23 VAL 78 2HG2 VAL 78 -4.013 -1.228 -17.885 552 H LEU 79 H LEU 79 -2.145 -5.967 -18.482 553 HA LEU 79 HA LEU 79 0.544 -5.618 -19.615 554 HB2 LEU 79 2HB LEU 79 -0.373 -7.251 -17.579 555 HB3 LEU 79 3HB LEU 79 -0.231 -8.340 -18.958 556 HG LEU 79 HG LEU 79 2.127 -7.723 -19.199 557 HD11 LEU 79 1HD1 LEU 79 1.361 -5.585 -17.456 558 HD12 LEU 79 2HD1 LEU 79 2.863 -5.813 -18.351 559 HD13 LEU 79 3HD1 LEU 79 2.686 -6.500 -16.736 560 HD21 LEU 79 3HD2 LEU 79 1.265 -9.566 -17.641 561 HD22 LEU 79 1HD2 LEU 79 1.669 -8.460 -16.328 562 HD23 LEU 79 2HD2 LEU 79 2.929 -9.019 -17.429 563 H ILE 80 H ILE 80 0.941 -6.130 -21.671 564 HA ILE 80 HA ILE 80 -1.053 -7.747 -23.117 565 HB ILE 80 HB ILE 80 -1.321 -5.449 -23.819 566 HG12 ILE 80 2HG1 ILE 80 0.255 -6.588 -26.083 567 HG13 ILE 80 3HG1 ILE 80 -1.123 -7.507 -25.485 568 HG21 ILE 80 1HG2 ILE 80 1.443 -5.289 -23.403 569 HG22 ILE 80 2HG2 ILE 80 1.197 -5.001 -25.125 570 HG23 ILE 80 3HG2 ILE 80 0.360 -4.003 -23.936 571 HD11 ILE 80 3HD1 ILE 80 -2.077 -6.267 -27.156 572 HD12 ILE 80 1HD1 ILE 80 -2.384 -5.245 -25.751 573 HD13 ILE 80 2HD1 ILE 80 -1.056 -4.862 -26.848 574 H THR 81 H THR 81 -0.231 -9.534 -23.962 575 HA THR 81 HA THR 81 2.663 -9.628 -24.516 576 HB THR 81 HB THR 81 2.687 -11.947 -24.013 577 HG1 THR 81 HG1 THR 81 0.924 -13.178 -24.020 578 HG21 THR 81 3HG2 THR 81 2.689 -10.526 -22.035 579 HG22 THR 81 1HG2 THR 81 1.841 -12.036 -21.702 580 HG23 THR 81 2HG2 THR 81 0.926 -10.556 -21.991 581 H ARG 82 H ARG 82 3.384 -10.459 -26.447 582 HA ARG 82 HA ARG 82 1.483 -10.433 -28.617 583 HB2 ARG 82 2HB ARG 82 3.871 -9.480 -28.646 584 HB3 ARG 82 3HB ARG 82 4.399 -11.147 -28.840 585 HG2 ARG 82 2HG ARG 82 4.294 -10.523 -31.022 586 HG3 ARG 82 3HG ARG 82 2.641 -11.105 -30.809 587 HD2 ARG 82 2HD ARG 82 1.748 -9.010 -30.883 588 HD3 ARG 82 3HD ARG 82 3.181 -8.258 -30.183 589 HE ARG 82 HE ARG 82 3.926 -9.155 -32.685 590 HH11 ARG 82 1HH1 ARG 82 1.602 -6.926 -31.362 591 HH12 ARG 82 2HH1 ARG 82 1.614 -5.887 -32.749 592 HH21 ARG 82 1HH2 ARG 82 3.950 -7.795 -34.516 593 HH22 ARG 82 2HH2 ARG 82 2.949 -6.383 -34.543 594 H THR 83 H THR 83 0.968 -12.133 -29.981 595 HA THR 83 HA THR 83 2.005 -14.789 -29.397 596 HB THR 83 HB THR 83 0.064 -14.532 -27.875 597 HG1 THR 83 HG1 THR 83 -0.277 -16.585 -28.241 598 HG21 THR 83 3HG2 THR 83 -1.917 -14.724 -30.023 599 HG22 THR 83 1HG2 THR 83 -1.103 -13.163 -29.940 600 HG23 THR 83 2HG2 THR 83 -1.955 -13.789 -28.529 601 H VAL 84 H VAL 84 2.221 -13.016 -31.651 602 HA VAL 84 HA VAL 84 0.425 -13.865 -33.709 603 HB VAL 84 HB VAL 84 1.933 -12.702 -35.253 604 HG11 VAL 84 1HG1 VAL 84 1.201 -11.286 -32.705 605 HG12 VAL 84 2HG1 VAL 84 1.860 -10.437 -34.105 606 HG13 VAL 84 3HG1 VAL 84 0.330 -11.306 -34.238 607 HG21 VAL 84 3HG2 VAL 84 3.790 -12.998 -33.009 608 HG22 VAL 84 1HG2 VAL 84 4.112 -12.807 -34.733 609 HG23 VAL 84 2HG2 VAL 84 3.787 -11.390 -33.735 610 H GLY 85 H GLY 85 1.190 -14.933 -35.721 611 HA2 GLY 85 2HA GLY 85 3.530 -16.573 -35.656 612 HA3 GLY 85 3HA GLY 85 2.083 -17.501 -35.291 Start of MODEL 4 1 H1 MET 9 H MET 9 2.778 1.069 -2.832 2 HA MET 9 HA MET 9 3.096 -0.139 -0.682 3 HB2 MET 9 2HB MET 9 1.027 1.074 0.216 4 HB3 MET 9 3HB MET 9 0.085 -0.167 -0.600 5 HG2 MET 9 2HG MET 9 1.284 -1.883 0.712 6 HG3 MET 9 3HG MET 9 2.115 -0.593 1.579 7 HE1 MET 9 3HE MET 9 0.019 -1.548 4.457 8 HE2 MET 9 1HE MET 9 1.566 -1.602 3.610 9 HE3 MET 9 2HE MET 9 0.940 -0.064 4.205 10 H LYS 10 H LYS 10 0.068 -0.856 -2.425 11 HA LYS 10 HA LYS 10 1.347 -3.287 -3.481 12 HB2 LYS 10 2HB LYS 10 -1.060 -3.035 -1.808 13 HB3 LYS 10 3HB LYS 10 -1.270 -4.039 -3.237 14 HG2 LYS 10 2HG LYS 10 1.085 -4.983 -2.287 15 HG3 LYS 10 3HG LYS 10 0.266 -4.532 -0.790 16 HD2 LYS 10 2HD LYS 10 -1.730 -5.793 -2.155 17 HD3 LYS 10 3HD LYS 10 -0.310 -6.700 -2.681 18 HE2 LYS 10 2HE LYS 10 0.294 -6.817 -0.192 19 HE3 LYS 10 3HE LYS 10 -1.369 -6.310 0.102 20 HZ1 LYS 10 3HZ LYS 10 -1.858 -8.463 -0.015 21 HZ2 LYS 10 1HZ LYS 10 -0.358 -8.872 -0.681 22 HZ3 LYS 10 2HZ LYS 10 -1.613 -8.347 -1.685 23 H ILE 11 H ILE 11 0.655 -3.974 -5.517 24 HA ILE 11 HA ILE 11 -1.209 -2.204 -6.939 25 HB ILE 11 HB ILE 11 0.223 -2.132 -8.894 26 HG12 ILE 11 2HG1 ILE 11 2.703 -3.028 -7.746 27 HG13 ILE 11 3HG1 ILE 11 1.510 -4.318 -7.650 28 HG21 ILE 11 1HG2 ILE 11 2.158 -1.310 -6.821 29 HG22 ILE 11 2HG2 ILE 11 1.471 -0.395 -8.162 30 HG23 ILE 11 3HG2 ILE 11 0.532 -0.640 -6.690 31 HD11 ILE 11 3HD1 ILE 11 2.291 -2.834 -10.148 32 HD12 ILE 11 1HD1 ILE 11 2.829 -4.450 -9.692 33 HD13 ILE 11 2HD1 ILE 11 1.126 -4.154 -10.044 34 H LYS 12 H LYS 12 -2.223 -3.140 -8.778 35 HA LYS 12 HA LYS 12 -2.117 -6.086 -8.813 36 HB2 LYS 12 2HB LYS 12 -4.526 -4.438 -9.566 37 HB3 LYS 12 3HB LYS 12 -4.453 -6.164 -9.234 38 HG2 LYS 12 2HG LYS 12 -3.738 -5.469 -6.866 39 HG3 LYS 12 3HG LYS 12 -4.351 -3.874 -7.310 40 HD2 LYS 12 2HD LYS 12 -6.243 -4.785 -6.399 41 HD3 LYS 12 3HD LYS 12 -6.450 -5.278 -8.081 42 HE2 LYS 12 2HE LYS 12 -6.223 -7.452 -7.586 43 HE3 LYS 12 3HE LYS 12 -4.870 -7.155 -6.495 44 HZ1 LYS 12 3HZ LYS 12 -6.542 -7.964 -5.125 45 HZ2 LYS 12 1HZ LYS 12 -7.761 -7.085 -5.902 46 HZ3 LYS 12 2HZ LYS 12 -6.649 -6.291 -4.905 47 H ILE 13 H ILE 13 -1.389 -6.927 -10.643 48 HA ILE 13 HA ILE 13 -1.712 -5.376 -13.129 49 HB ILE 13 HB ILE 13 0.626 -5.445 -12.545 50 HG12 ILE 13 2HG1 ILE 13 0.006 -7.430 -14.744 51 HG13 ILE 13 3HG1 ILE 13 0.054 -5.680 -14.923 52 HG21 ILE 13 1HG2 ILE 13 1.848 -7.430 -12.101 53 HG22 ILE 13 2HG2 ILE 13 0.405 -7.483 -11.090 54 HG23 ILE 13 3HG2 ILE 13 0.486 -8.451 -12.562 55 HD11 ILE 13 3HD1 ILE 13 2.507 -6.090 -13.939 56 HD12 ILE 13 1HD1 ILE 13 2.252 -7.632 -14.755 57 HD13 ILE 13 2HD1 ILE 13 2.131 -6.124 -15.662 58 H VAL 14 H VAL 14 -3.047 -6.291 -14.529 59 HA VAL 14 HA VAL 14 -3.281 -9.231 -14.542 60 HB VAL 14 HB VAL 14 -5.346 -8.262 -13.737 61 HG11 VAL 14 1HG1 VAL 14 -5.555 -6.735 -16.323 62 HG12 VAL 14 2HG1 VAL 14 -6.609 -6.629 -14.911 63 HG13 VAL 14 3HG1 VAL 14 -4.954 -6.026 -14.825 64 HG21 VAL 14 3HG2 VAL 14 -6.814 -9.422 -15.107 65 HG22 VAL 14 1HG2 VAL 14 -5.951 -8.975 -16.579 66 HG23 VAL 14 2HG2 VAL 14 -5.264 -10.175 -15.485 67 HA PRO 15 HA PRO 15 -1.706 -8.759 -18.685 68 HB2 PRO 15 2HB PRO 15 -1.774 -11.402 -19.305 69 HB3 PRO 15 3HB PRO 15 -0.519 -10.686 -18.287 70 HG2 PRO 15 2HG PRO 15 -2.978 -12.191 -17.484 71 HG3 PRO 15 3HG PRO 15 -1.330 -12.318 -16.842 72 HD2 PRO 15 2HD PRO 15 -3.280 -10.925 -15.582 73 HD3 PRO 15 3HD PRO 15 -1.571 -10.453 -15.509 74 H ALA 16 H ALA 16 -2.688 -8.440 -20.601 75 HA ALA 16 HA ALA 16 -5.519 -9.057 -20.814 76 HB1 ALA 16 1HB ALA 16 -5.378 -7.681 -22.895 77 HB2 ALA 16 2HB ALA 16 -4.897 -6.835 -21.424 78 HB3 ALA 16 3HB ALA 16 -3.668 -7.426 -22.543 79 H VAL 17 H VAL 17 -4.504 -11.429 -20.842 80 HA VAL 17 HA VAL 17 -5.016 -12.425 -23.470 81 HB VAL 17 HB VAL 17 -2.627 -11.733 -23.685 82 HG11 VAL 17 1HG1 VAL 17 -1.090 -12.256 -22.164 83 HG12 VAL 17 2HG1 VAL 17 -2.397 -12.876 -21.152 84 HG13 VAL 17 3HG1 VAL 17 -1.521 -13.965 -22.229 85 HG21 VAL 17 3HG2 VAL 17 -3.829 -13.817 -24.770 86 HG22 VAL 17 1HG2 VAL 17 -2.107 -13.523 -25.012 87 HG23 VAL 17 2HG2 VAL 17 -2.641 -14.707 -23.818 88 H GLY 18 H GLY 18 -5.261 -14.708 -23.528 89 HA2 GLY 18 2HA GLY 18 -5.997 -16.689 -22.626 90 HA3 GLY 18 3HA GLY 18 -4.618 -16.527 -21.550 91 H GLY 19 H GLY 19 -7.713 -14.780 -21.882 92 HA2 GLY 19 2HA GLY 19 -9.495 -14.751 -20.366 93 HA3 GLY 19 3HA GLY 19 -8.532 -15.706 -19.249 94 H GLY 20 H GLY 20 -6.285 -14.200 -18.923 95 HA2 GLY 20 2HA GLY 20 -5.442 -12.220 -18.045 96 HA3 GLY 20 3HA GLY 20 -6.995 -11.457 -18.353 97 H SER 21 H SER 21 -4.973 -12.929 -16.030 98 HA SER 21 HA SER 21 -7.121 -12.739 -14.020 99 HB2 SER 21 2HB SER 21 -5.893 -15.032 -14.611 100 HB3 SER 21 3HB SER 21 -4.705 -14.397 -13.473 101 HG SER 21 HG SER 21 -6.007 -14.958 -11.939 102 HA PRO 22 HA PRO 22 -4.643 -9.475 -12.323 103 HB2 PRO 22 2HB PRO 22 -6.086 -9.138 -10.048 104 HB3 PRO 22 3HB PRO 22 -6.629 -8.553 -11.626 105 HG2 PRO 22 2HG PRO 22 -7.417 -11.038 -10.154 106 HG3 PRO 22 3HG PRO 22 -8.437 -9.895 -11.047 107 HD2 PRO 22 2HD PRO 22 -7.639 -12.262 -12.093 108 HD3 PRO 22 3HD PRO 22 -7.897 -10.816 -13.090 109 H LEU 23 H LEU 23 -2.806 -9.578 -11.198 110 HA LEU 23 HA LEU 23 -2.594 -11.565 -9.032 111 HB2 LEU 23 2HB LEU 23 -1.189 -11.561 -11.402 112 HB3 LEU 23 3HB LEU 23 -0.075 -10.790 -10.275 113 HG LEU 23 HG LEU 23 -0.686 -12.898 -8.793 114 HD11 LEU 23 1HD1 LEU 23 -2.329 -13.775 -10.388 115 HD12 LEU 23 2HD1 LEU 23 -0.987 -14.892 -10.143 116 HD13 LEU 23 3HD1 LEU 23 -1.063 -13.913 -11.607 117 HD21 LEU 23 3HD2 LEU 23 1.178 -13.513 -11.016 118 HD22 LEU 23 1HD2 LEU 23 1.404 -13.651 -9.272 119 HD23 LEU 23 2HD2 LEU 23 1.505 -12.072 -10.052 120 H GLU 24 H GLU 24 -1.570 -10.957 -7.159 121 HA GLU 24 HA GLU 24 -1.257 -8.087 -6.781 122 HB2 GLU 24 2HB GLU 24 -1.542 -10.443 -4.959 123 HB3 GLU 24 3HB GLU 24 -0.840 -8.957 -4.336 124 HG2 GLU 24 2HG GLU 24 -2.799 -7.813 -4.450 125 HG3 GLU 24 3HG GLU 24 -3.394 -8.748 -5.821 126 H LEU 25 H LEU 25 0.639 -7.075 -6.646 127 HA LEU 25 HA LEU 25 3.045 -8.578 -5.945 128 HB2 LEU 25 2HB LEU 25 2.408 -7.525 -8.586 129 HB3 LEU 25 3HB LEU 25 3.946 -6.932 -7.962 130 HG LEU 25 HG LEU 25 3.681 -9.804 -7.640 131 HD11 LEU 25 1HD1 LEU 25 2.380 -9.884 -9.587 132 HD12 LEU 25 2HD1 LEU 25 4.026 -10.202 -10.133 133 HD13 LEU 25 3HD1 LEU 25 3.312 -8.607 -10.368 134 HD21 LEU 25 3HD2 LEU 25 5.816 -9.440 -9.206 135 HD22 LEU 25 1HD2 LEU 25 5.841 -9.147 -7.467 136 HD23 LEU 25 2HD2 LEU 25 5.639 -7.798 -8.585 137 H GLU 26 H GLU 26 4.842 -7.219 -5.331 138 HA GLU 26 HA GLU 26 3.950 -4.578 -4.386 139 HB2 GLU 26 2HB GLU 26 6.033 -6.459 -3.267 140 HB3 GLU 26 3HB GLU 26 5.773 -4.822 -2.681 141 HG2 GLU 26 2HG GLU 26 3.600 -5.352 -1.900 142 HG3 GLU 26 3HG GLU 26 3.614 -6.910 -2.725 143 H VAL 27 H VAL 27 4.653 -3.047 -5.729 144 HA VAL 27 HA VAL 27 7.511 -2.965 -6.360 145 HB VAL 27 HB VAL 27 7.146 -2.398 -8.673 146 HG11 VAL 27 1HG1 VAL 27 7.416 -4.724 -8.339 147 HG12 VAL 27 2HG1 VAL 27 5.752 -4.911 -7.782 148 HG13 VAL 27 3HG1 VAL 27 6.081 -4.544 -9.476 149 HG21 VAL 27 3HG2 VAL 27 4.423 -2.006 -7.782 150 HG22 VAL 27 1HG2 VAL 27 5.228 -1.417 -9.236 151 HG23 VAL 27 2HG2 VAL 27 4.492 -3.019 -9.223 152 H ALA 28 H ALA 28 8.118 -0.793 -7.306 153 HA ALA 28 HA ALA 28 6.429 1.339 -6.171 154 HB1 ALA 28 1HB ALA 28 8.452 0.849 -4.791 155 HB2 ALA 28 2HB ALA 28 9.442 1.346 -6.165 156 HB3 ALA 28 3HB ALA 28 8.362 2.505 -5.391 157 HA PRO 29 HA PRO 29 6.685 2.672 -10.440 158 HB2 PRO 29 2HB PRO 29 4.943 4.735 -10.156 159 HB3 PRO 29 3HB PRO 29 4.423 3.053 -10.310 160 HG2 PRO 29 2HG PRO 29 4.714 4.727 -7.845 161 HG3 PRO 29 3HG PRO 29 3.413 3.606 -8.289 162 HD2 PRO 29 2HD PRO 29 5.388 2.937 -6.561 163 HD3 PRO 29 3HD PRO 29 4.618 1.752 -7.637 164 H ASN 30 H ASN 30 7.573 4.312 -7.571 165 HA ASN 30 HA ASN 30 8.487 6.712 -8.916 166 HB2 ASN 30 2HB ASN 30 9.092 5.934 -6.067 167 HB3 ASN 30 3HB ASN 30 9.025 7.549 -6.767 168 HD21 ASN 30 1HD2 ASN 30 7.629 6.450 -4.459 169 HD22 ASN 30 2HD2 ASN 30 5.943 6.660 -4.775 170 H ALA 31 H ALA 31 9.603 3.746 -9.052 171 HA ALA 31 HA ALA 31 12.430 4.432 -8.635 172 HB1 ALA 31 1HB ALA 31 12.017 2.468 -7.469 173 HB2 ALA 31 2HB ALA 31 10.956 1.828 -8.726 174 HB3 ALA 31 3HB ALA 31 12.699 1.891 -8.990 175 H THR 32 H THR 32 10.917 2.112 -10.850 176 HA THR 32 HA THR 32 11.693 3.621 -13.183 177 HB THR 32 HB THR 32 12.867 1.044 -13.587 178 HG1 THR 32 HG1 THR 32 14.559 1.223 -12.029 179 HG21 THR 32 3HG2 THR 32 14.123 3.784 -13.392 180 HG22 THR 32 1HG2 THR 32 13.381 3.100 -14.838 181 HG23 THR 32 2HG2 THR 32 14.834 2.365 -14.160 182 H VAL 33 H VAL 33 10.634 2.966 -15.028 183 HA VAL 33 HA VAL 33 8.293 1.398 -14.683 184 HB VAL 33 HB VAL 33 9.569 2.387 -17.238 185 HG11 VAL 33 1HG1 VAL 33 8.034 1.177 -18.295 186 HG12 VAL 33 2HG1 VAL 33 7.317 0.664 -16.767 187 HG13 VAL 33 3HG1 VAL 33 6.792 2.166 -17.528 188 HG21 VAL 33 3HG2 VAL 33 7.226 3.595 -15.795 189 HG22 VAL 33 1HG2 VAL 33 8.888 4.088 -15.467 190 HG23 VAL 33 2HG2 VAL 33 8.207 4.297 -17.081 191 H GLY 34 H GLY 34 11.325 0.842 -16.462 192 HA2 GLY 34 2HA GLY 34 10.626 -1.713 -17.445 193 HA3 GLY 34 3HA GLY 34 12.260 -1.081 -17.300 194 H ALA 35 H ALA 35 12.081 -0.666 -14.426 195 HA ALA 35 HA ALA 35 12.991 -3.198 -13.565 196 HB1 ALA 35 1HB ALA 35 12.102 -1.158 -11.588 197 HB2 ALA 35 2HB ALA 35 13.542 -2.176 -11.591 198 HB3 ALA 35 3HB ALA 35 13.452 -0.774 -12.656 199 H VAL 36 H VAL 36 9.972 -1.426 -12.966 200 HA VAL 36 HA VAL 36 8.827 -3.385 -11.269 201 HB VAL 36 HB VAL 36 7.472 -1.264 -12.941 202 HG11 VAL 36 1HG1 VAL 36 6.434 -3.039 -10.742 203 HG12 VAL 36 2HG1 VAL 36 5.621 -1.561 -11.262 204 HG13 VAL 36 3HG1 VAL 36 5.835 -2.897 -12.394 205 HG21 VAL 36 3HG2 VAL 36 7.662 -0.964 -10.025 206 HG22 VAL 36 1HG2 VAL 36 9.197 -0.868 -10.887 207 HG23 VAL 36 2HG2 VAL 36 7.881 0.228 -11.307 208 H ARG 37 H ARG 37 8.464 -2.704 -14.736 209 HA ARG 37 HA ARG 37 6.548 -4.674 -15.286 210 HB2 ARG 37 2HB ARG 37 7.082 -2.867 -16.850 211 HB3 ARG 37 3HB ARG 37 8.688 -3.541 -17.096 212 HG2 ARG 37 2HG ARG 37 7.856 -5.392 -18.265 213 HG3 ARG 37 3HG ARG 37 6.207 -5.111 -17.702 214 HD2 ARG 37 2HD ARG 37 5.962 -4.191 -19.748 215 HD3 ARG 37 3HD ARG 37 6.669 -2.781 -18.960 216 HE ARG 37 HE ARG 37 8.598 -4.573 -20.127 217 HH11 ARG 37 1HH1 ARG 37 6.514 -1.838 -20.666 218 HH12 ARG 37 2HH1 ARG 37 7.440 -1.229 -21.998 219 HH21 ARG 37 1HH2 ARG 37 9.826 -3.782 -21.879 220 HH22 ARG 37 2HH2 ARG 37 9.323 -2.336 -22.687 221 H THR 38 H THR 38 10.074 -4.799 -15.228 222 HA THR 38 HA THR 38 10.282 -7.447 -16.248 223 HB THR 38 HB THR 38 12.264 -5.859 -14.604 224 HG1 THR 38 HG1 THR 38 11.532 -5.121 -16.811 225 HG21 THR 38 3HG2 THR 38 13.784 -7.532 -16.035 226 HG22 THR 38 1HG2 THR 38 12.357 -8.549 -15.846 227 HG23 THR 38 2HG2 THR 38 13.193 -7.929 -14.422 228 H LYS 39 H LYS 39 10.046 -6.068 -13.019 229 HA LYS 39 HA LYS 39 10.670 -8.407 -11.570 230 HB2 LYS 39 2HB LYS 39 10.341 -5.865 -10.848 231 HB3 LYS 39 3HB LYS 39 8.728 -6.444 -10.453 232 HG2 LYS 39 2HG LYS 39 9.539 -7.104 -8.502 233 HG3 LYS 39 3HG LYS 39 10.445 -8.345 -9.371 234 HD2 LYS 39 2HD LYS 39 11.557 -5.580 -9.175 235 HD3 LYS 39 3HD LYS 39 11.682 -6.666 -7.789 236 HE2 LYS 39 2HE LYS 39 12.436 -7.887 -10.340 237 HE3 LYS 39 3HE LYS 39 13.459 -6.532 -9.863 238 HZ1 LYS 39 3HZ LYS 39 12.965 -9.055 -8.401 239 HZ2 LYS 39 1HZ LYS 39 13.608 -7.692 -7.632 240 HZ3 LYS 39 2HZ LYS 39 14.442 -8.410 -8.916 241 H VAL 40 H VAL 40 7.569 -7.027 -12.614 242 HA VAL 40 HA VAL 40 5.976 -9.083 -11.467 243 HB VAL 40 HB VAL 40 4.160 -8.199 -12.903 244 HG11 VAL 40 1HG1 VAL 40 4.827 -7.188 -10.692 245 HG12 VAL 40 2HG1 VAL 40 5.681 -5.947 -11.610 246 HG13 VAL 40 3HG1 VAL 40 3.934 -6.125 -11.779 247 HG21 VAL 40 3HG2 VAL 40 5.367 -7.613 -14.886 248 HG22 VAL 40 1HG2 VAL 40 4.646 -6.143 -14.232 249 HG23 VAL 40 2HG2 VAL 40 6.365 -6.460 -14.000 250 H CYS 41 H CYS 41 7.367 -8.563 -14.669 251 HA CYS 41 HA CYS 41 6.057 -10.664 -15.998 252 HB2 CYS 41 2HB CYS 41 8.583 -9.128 -16.481 253 HB3 CYS 41 3HB CYS 41 8.234 -10.546 -17.462 254 HG CYS 41 HG CYS 41 7.147 -7.498 -17.833 255 H ALA 42 H ALA 42 9.162 -10.554 -14.289 256 HA ALA 42 HA ALA 42 9.931 -13.210 -14.838 257 HB1 ALA 42 1HB ALA 42 10.715 -11.653 -12.387 258 HB2 ALA 42 2HB ALA 42 11.627 -12.915 -13.217 259 HB3 ALA 42 3HB ALA 42 11.400 -11.343 -13.983 260 H MET 43 H MET 43 8.210 -11.769 -12.088 261 HA MET 43 HA MET 43 8.018 -14.067 -10.509 262 HB2 MET 43 2HB MET 43 7.265 -11.484 -10.202 263 HB3 MET 43 3HB MET 43 5.698 -12.235 -10.471 264 HG2 MET 43 2HG MET 43 5.703 -12.635 -8.286 265 HG3 MET 43 3HG MET 43 6.847 -13.923 -8.655 266 HE1 MET 43 3HE MET 43 6.549 -12.812 -5.903 267 HE2 MET 43 1HE MET 43 7.757 -11.656 -5.340 268 HE3 MET 43 2HE MET 43 6.326 -11.087 -6.198 269 H LYS 44 H LYS 44 6.231 -13.063 -13.319 270 HA LYS 44 HA LYS 44 4.290 -15.225 -12.957 271 HB2 LYS 44 2HB LYS 44 4.366 -13.128 -15.131 272 HB3 LYS 44 3HB LYS 44 3.028 -14.201 -14.739 273 HG2 LYS 44 2HG LYS 44 2.459 -13.019 -12.842 274 HG3 LYS 44 3HG LYS 44 4.067 -12.308 -12.677 275 HD2 LYS 44 2HD LYS 44 2.388 -10.666 -13.418 276 HD3 LYS 44 3HD LYS 44 3.670 -10.895 -14.609 277 HE2 LYS 44 2HE LYS 44 2.285 -12.059 -16.061 278 HE3 LYS 44 3HE LYS 44 1.144 -12.488 -14.788 279 HZ1 LYS 44 3HZ LYS 44 0.235 -10.354 -14.788 280 HZ2 LYS 44 1HZ LYS 44 0.442 -10.706 -16.430 281 HZ3 LYS 44 2HZ LYS 44 1.534 -9.684 -15.640 282 H LYS 45 H LYS 45 7.257 -14.708 -14.381 283 HA LYS 45 HA LYS 45 8.537 -15.921 -15.818 284 HB2 LYS 45 2HB LYS 45 7.447 -17.817 -14.513 285 HB3 LYS 45 3HB LYS 45 6.324 -17.971 -15.857 286 HG2 LYS 45 2HG LYS 45 8.033 -19.589 -16.159 287 HG3 LYS 45 3HG LYS 45 8.292 -18.319 -17.357 288 HD2 LYS 45 2HD LYS 45 10.412 -18.929 -16.392 289 HD3 LYS 45 3HD LYS 45 9.981 -17.307 -15.845 290 HE2 LYS 45 2HE LYS 45 10.894 -18.722 -14.038 291 HE3 LYS 45 3HE LYS 45 9.250 -18.173 -13.716 292 HZ1 LYS 45 3HZ LYS 45 9.808 -20.816 -14.923 293 HZ2 LYS 45 1HZ LYS 45 8.386 -20.282 -14.177 294 HZ3 LYS 45 2HZ LYS 45 9.765 -20.590 -13.247 295 H LEU 46 H LEU 46 7.406 -13.941 -17.072 296 HA LEU 46 HA LEU 46 6.229 -15.074 -19.524 297 HB2 LEU 46 2HB LEU 46 5.776 -12.498 -18.086 298 HB3 LEU 46 3HB LEU 46 5.541 -12.568 -19.832 299 HG LEU 46 HG LEU 46 4.095 -14.301 -17.830 300 HD11 LEU 46 1HD1 LEU 46 2.850 -12.086 -19.405 301 HD12 LEU 46 2HD1 LEU 46 3.641 -11.754 -17.865 302 HD13 LEU 46 3HD1 LEU 46 2.279 -12.873 -17.933 303 HD21 LEU 46 3HD2 LEU 46 4.323 -15.335 -20.022 304 HD22 LEU 46 1HD2 LEU 46 3.687 -13.880 -20.789 305 HD23 LEU 46 2HD2 LEU 46 2.654 -14.844 -19.734 306 HA PRO 47 HA PRO 47 9.622 -13.643 -21.910 307 HB2 PRO 47 2HB PRO 47 8.412 -12.783 -24.182 308 HB3 PRO 47 3HB PRO 47 8.556 -14.493 -23.759 309 HG2 PRO 47 2HG PRO 47 6.222 -12.649 -23.422 310 HG3 PRO 47 3HG PRO 47 6.248 -14.327 -23.995 311 HD2 PRO 47 2HD PRO 47 5.548 -13.661 -21.465 312 HD3 PRO 47 3HD PRO 47 6.368 -15.186 -21.859 313 HA PRO 48 HA PRO 48 9.589 -9.274 -20.769 314 HB2 PRO 48 2HB PRO 48 12.290 -9.010 -20.826 315 HB3 PRO 48 3HB PRO 48 11.423 -9.719 -19.459 316 HG2 PRO 48 2HG PRO 48 12.860 -11.082 -21.704 317 HG3 PRO 48 3HG PRO 48 12.869 -11.466 -19.973 318 HD2 PRO 48 2HD PRO 48 11.364 -12.833 -21.761 319 HD3 PRO 48 3HD PRO 48 10.852 -12.576 -20.080 320 H ASP 49 H ASP 49 11.105 -10.841 -23.505 321 HA ASP 49 HA ASP 49 11.936 -8.541 -24.903 322 HB2 ASP 49 2HB ASP 49 11.144 -11.279 -25.912 323 HB3 ASP 49 3HB ASP 49 11.890 -10.035 -26.911 324 H THR 50 H THR 50 8.903 -10.360 -24.927 325 HA THR 50 HA THR 50 7.702 -8.201 -26.535 326 HB THR 50 HB THR 50 5.881 -10.045 -26.924 327 HG1 THR 50 HG1 THR 50 6.703 -11.661 -25.619 328 HG21 THR 50 3HG2 THR 50 6.900 -10.614 -28.984 329 HG22 THR 50 1HG2 THR 50 8.522 -10.390 -28.330 330 HG23 THR 50 2HG2 THR 50 7.477 -8.994 -28.596 331 H THR 51 H THR 51 7.668 -7.270 -24.218 332 HA THR 51 HA THR 51 4.997 -7.787 -23.140 333 HB THR 51 HB THR 51 6.719 -9.046 -21.772 334 HG1 THR 51 HG1 THR 51 4.591 -7.949 -21.044 335 HG21 THR 51 3HG2 THR 51 8.402 -7.134 -21.951 336 HG22 THR 51 1HG2 THR 51 8.218 -7.889 -20.369 337 HG23 THR 51 2HG2 THR 51 7.454 -6.334 -20.698 338 H ARG 52 H ARG 52 3.959 -5.995 -22.369 339 HA ARG 52 HA ARG 52 5.473 -3.494 -22.162 340 HB2 ARG 52 2HB ARG 52 3.715 -4.154 -24.302 341 HB3 ARG 52 3HB ARG 52 2.939 -2.908 -23.334 342 HG2 ARG 52 2HG ARG 52 4.332 -1.328 -24.059 343 HG3 ARG 52 3HG ARG 52 5.749 -2.358 -23.852 344 HD2 ARG 52 2HD ARG 52 3.939 -3.049 -26.081 345 HD3 ARG 52 3HD ARG 52 4.840 -1.542 -26.246 346 HE ARG 52 HE ARG 52 5.874 -4.170 -26.503 347 HH11 ARG 52 1HH1 ARG 52 6.678 -0.990 -25.336 348 HH12 ARG 52 2HH1 ARG 52 8.383 -1.195 -25.564 349 HH21 ARG 52 1HH2 ARG 52 8.116 -4.452 -26.809 350 HH22 ARG 52 2HH2 ARG 52 9.200 -3.164 -26.403 351 H LEU 53 H LEU 53 4.147 -1.738 -21.150 352 HA LEU 53 HA LEU 53 1.932 -2.659 -19.502 353 HB2 LEU 53 2HB LEU 53 4.232 -3.000 -18.350 354 HB3 LEU 53 3HB LEU 53 4.200 -1.249 -18.150 355 HG LEU 53 HG LEU 53 3.450 -2.429 -16.137 356 HD11 LEU 53 1HD1 LEU 53 0.951 -1.193 -17.122 357 HD12 LEU 53 2HD1 LEU 53 2.409 -0.202 -17.175 358 HD13 LEU 53 3HD1 LEU 53 1.867 -0.889 -15.645 359 HD21 LEU 53 3HD2 LEU 53 2.170 -4.233 -16.287 360 HD22 LEU 53 1HD2 LEU 53 2.007 -3.994 -18.027 361 HD23 LEU 53 2HD2 LEU 53 0.855 -3.242 -16.922 362 H THR 54 H THR 54 0.425 -1.129 -19.301 363 HA THR 54 HA THR 54 1.205 1.674 -19.762 364 HB THR 54 HB THR 54 -1.184 1.881 -20.760 365 HG1 THR 54 HG1 THR 54 -0.726 -0.816 -21.486 366 HG21 THR 54 3HG2 THR 54 -0.327 1.635 -22.942 367 HG22 THR 54 1HG2 THR 54 0.802 0.376 -22.446 368 HG23 THR 54 2HG2 THR 54 1.069 2.046 -21.947 369 H TYR 55 H TYR 55 0.174 3.222 -18.541 370 HA TYR 55 HA TYR 55 -1.723 2.245 -16.510 371 HB2 TYR 55 2HB TYR 55 0.357 2.554 -15.369 372 HB3 TYR 55 3HB TYR 55 0.623 4.112 -16.144 373 HD1 TYR 55 HD1 TYR 55 -2.370 2.713 -14.403 374 HD2 TYR 55 HD2 TYR 55 0.638 5.721 -14.478 375 HE1 TYR 55 HE1 TYR 55 -3.454 3.837 -12.502 376 HE2 TYR 55 HE2 TYR 55 -0.436 6.852 -12.577 377 HH TYR 55 HH TYR 55 -2.532 6.995 -11.466 378 H LYS 56 H LYS 56 -3.572 3.336 -16.404 379 HA LYS 56 HA LYS 56 -5.199 4.861 -16.860 380 HB2 LYS 56 2HB LYS 56 -3.484 6.141 -15.357 381 HB3 LYS 56 3HB LYS 56 -3.126 7.027 -16.833 382 HG2 LYS 56 2HG LYS 56 -4.736 8.385 -16.023 383 HG3 LYS 56 3HG LYS 56 -5.782 7.240 -16.865 384 HD2 LYS 56 2HD LYS 56 -5.284 6.156 -14.312 385 HD3 LYS 56 3HD LYS 56 -5.659 7.864 -14.071 386 HE2 LYS 56 2HE LYS 56 -7.765 7.659 -15.072 387 HE3 LYS 56 3HE LYS 56 -7.350 6.126 -15.838 388 HZ1 LYS 56 3HZ LYS 56 -7.128 5.307 -13.417 389 HZ2 LYS 56 1HZ LYS 56 -8.673 5.478 -14.086 390 HZ3 LYS 56 2HZ LYS 56 -8.072 6.658 -13.034 391 H GLY 57 H GLY 57 -3.929 3.646 -19.114 392 HA2 GLY 57 2HA GLY 57 -4.104 3.822 -21.404 393 HA3 GLY 57 3HA GLY 57 -4.906 5.367 -21.167 394 H ARG 58 H ARG 58 -1.888 5.135 -19.622 395 HA ARG 58 HA ARG 58 -0.643 6.674 -21.805 396 HB2 ARG 58 2HB ARG 58 -1.084 7.432 -19.158 397 HB3 ARG 58 3HB ARG 58 0.621 7.007 -19.212 398 HG2 ARG 58 2HG ARG 58 0.501 9.311 -19.670 399 HG3 ARG 58 3HG ARG 58 0.811 8.523 -21.218 400 HD2 ARG 58 2HD ARG 58 -1.975 8.611 -20.951 401 HD3 ARG 58 3HD ARG 58 -1.395 10.189 -20.420 402 HE ARG 58 HE ARG 58 -0.086 9.574 -22.796 403 HH11 ARG 58 1HH1 ARG 58 -3.325 10.201 -21.686 404 HH12 ARG 58 2HH1 ARG 58 -3.856 10.859 -23.198 405 HH21 ARG 58 1HH2 ARG 58 -0.773 10.438 -24.792 406 HH22 ARG 58 2HH2 ARG 58 -2.404 10.993 -24.965 407 H ALA 59 H ALA 59 1.537 6.304 -22.290 408 HA ALA 59 HA ALA 59 2.516 3.673 -21.424 409 HB1 ALA 59 1HB ALA 59 2.799 3.346 -23.603 410 HB2 ALA 59 2HB ALA 59 2.449 5.038 -23.962 411 HB3 ALA 59 3HB ALA 59 4.092 4.544 -23.553 412 H LEU 60 H LEU 60 4.081 3.643 -19.963 413 HA LEU 60 HA LEU 60 5.968 5.905 -19.872 414 HB2 LEU 60 2HB LEU 60 4.917 4.199 -17.622 415 HB3 LEU 60 3HB LEU 60 6.236 5.355 -17.455 416 HG LEU 60 HG LEU 60 4.333 6.433 -16.597 417 HD11 LEU 60 1HD1 LEU 60 4.656 7.350 -19.450 418 HD12 LEU 60 2HD1 LEU 60 5.663 7.835 -18.087 419 HD13 LEU 60 3HD1 LEU 60 3.960 8.291 -18.130 420 HD21 LEU 60 3HD2 LEU 60 2.197 6.220 -17.331 421 HD22 LEU 60 1HD2 LEU 60 2.841 4.714 -17.986 422 HD23 LEU 60 2HD2 LEU 60 2.669 6.127 -19.028 423 H LYS 61 H LYS 61 8.149 5.453 -19.451 424 HA LYS 61 HA LYS 61 9.072 2.754 -19.117 425 HB2 LYS 61 2HB LYS 61 8.660 2.619 -21.477 426 HB3 LYS 61 3HB LYS 61 9.446 4.167 -21.759 427 HG2 LYS 61 2HG LYS 61 11.414 3.186 -22.008 428 HG3 LYS 61 3HG LYS 61 11.259 2.368 -20.451 429 HD2 LYS 61 2HD LYS 61 11.526 0.733 -22.217 430 HD3 LYS 61 3HD LYS 61 9.900 0.618 -21.538 431 HE2 LYS 61 2HE LYS 61 9.037 0.921 -23.560 432 HE3 LYS 61 3HE LYS 61 9.825 2.494 -23.664 433 HZ1 LYS 61 3HZ LYS 61 10.330 0.382 -25.276 434 HZ2 LYS 61 1HZ LYS 61 11.599 0.288 -24.162 435 HZ3 LYS 61 2HZ LYS 61 11.360 1.705 -25.054 436 H ASP 62 H ASP 62 10.569 5.501 -20.795 437 HA ASP 62 HA ASP 62 12.868 5.390 -19.087 438 HB2 ASP 62 2HB ASP 62 12.395 6.317 -21.636 439 HB3 ASP 62 3HB ASP 62 12.566 7.809 -20.714 440 H THR 63 H THR 63 9.848 6.693 -18.683 441 HA THR 63 HA THR 63 10.318 9.210 -17.555 442 HB THR 63 HB THR 63 8.167 7.313 -16.617 443 HG1 THR 63 HG1 THR 63 7.641 7.304 -18.683 444 HG21 THR 63 3HG2 THR 63 8.800 9.974 -15.978 445 HG22 THR 63 1HG2 THR 63 7.337 9.087 -15.552 446 HG23 THR 63 2HG2 THR 63 7.386 10.049 -17.030 447 H GLU 64 H GLU 64 11.062 6.083 -16.386 448 HA GLU 64 HA GLU 64 12.089 5.356 -14.489 449 HB2 GLU 64 2HB GLU 64 12.735 8.190 -14.619 450 HB3 GLU 64 3HB GLU 64 12.673 7.604 -12.963 451 HG2 GLU 64 2HG GLU 64 14.367 6.024 -13.344 452 HG3 GLU 64 3HG GLU 64 14.241 6.192 -15.094 453 H THR 65 H THR 65 10.712 8.309 -13.101 454 HA THR 65 HA THR 65 9.230 6.660 -11.194 455 HB THR 65 HB THR 65 10.568 8.369 -10.163 456 HG1 THR 65 HG1 THR 65 8.991 9.148 -8.885 457 HG21 THR 65 3HG2 THR 65 9.689 9.943 -12.411 458 HG22 THR 65 1HG2 THR 65 11.010 10.246 -11.284 459 HG23 THR 65 2HG2 THR 65 9.380 10.797 -10.899 460 H LEU 66 H LEU 66 7.019 7.217 -10.641 461 HA LEU 66 HA LEU 66 5.538 8.282 -12.955 462 HB2 LEU 66 2HB LEU 66 5.366 5.780 -11.852 463 HB3 LEU 66 3HB LEU 66 4.040 6.631 -11.062 464 HG LEU 66 HG LEU 66 4.232 6.855 -14.014 465 HD11 LEU 66 1HD1 LEU 66 2.925 4.702 -14.186 466 HD12 LEU 66 2HD1 LEU 66 3.487 4.333 -12.556 467 HD13 LEU 66 3HD1 LEU 66 4.652 4.536 -13.865 468 HD21 LEU 66 3HD2 LEU 66 2.482 7.841 -12.339 469 HD22 LEU 66 1HD2 LEU 66 1.790 6.221 -12.423 470 HD23 LEU 66 2HD2 LEU 66 1.960 7.184 -13.891 471 H GLU 67 H GLU 67 6.287 8.734 -9.688 472 HA GLU 67 HA GLU 67 3.951 9.853 -8.649 473 HB2 GLU 67 2HB GLU 67 6.250 9.307 -7.527 474 HB3 GLU 67 3HB GLU 67 6.643 10.968 -7.948 475 HG2 GLU 67 2HG GLU 67 4.645 11.715 -6.702 476 HG3 GLU 67 3HG GLU 67 4.367 10.046 -6.210 477 H SER 68 H SER 68 6.396 11.198 -10.760 478 HA SER 68 HA SER 68 5.695 13.918 -10.500 479 HB2 SER 68 2HB SER 68 7.541 12.386 -12.022 480 HB3 SER 68 3HB SER 68 6.629 13.384 -13.154 481 HG SER 68 HG SER 68 8.609 14.280 -12.035 482 H LEU 69 H LEU 69 4.133 11.298 -12.033 483 HA LEU 69 HA LEU 69 2.539 13.065 -13.741 484 HB2 LEU 69 2HB LEU 69 2.219 10.096 -13.635 485 HB3 LEU 69 3HB LEU 69 1.915 11.204 -14.972 486 HG LEU 69 HG LEU 69 4.609 10.288 -13.968 487 HD11 LEU 69 1HD1 LEU 69 3.635 9.870 -16.740 488 HD12 LEU 69 2HD1 LEU 69 2.980 8.841 -15.467 489 HD13 LEU 69 3HD1 LEU 69 4.719 8.886 -15.757 490 HD21 LEU 69 3HD2 LEU 69 4.622 12.642 -14.716 491 HD22 LEU 69 1HD2 LEU 69 3.961 12.129 -16.268 492 HD23 LEU 69 2HD2 LEU 69 5.563 11.585 -15.769 493 H GLY 70 H GLY 70 2.448 11.541 -10.719 494 HA2 GLY 70 2HA GLY 70 0.709 12.087 -9.163 495 HA3 GLY 70 3HA GLY 70 -0.423 12.151 -10.506 496 H VAL 71 H VAL 71 1.879 9.741 -9.229 497 HA VAL 71 HA VAL 71 -0.089 7.646 -9.712 498 HB VAL 71 HB VAL 71 2.302 7.331 -10.363 499 HG11 VAL 71 1HG1 VAL 71 4.008 7.496 -8.922 500 HG12 VAL 71 2HG1 VAL 71 2.864 8.357 -7.890 501 HG13 VAL 71 3HG1 VAL 71 3.143 6.631 -7.653 502 HG21 VAL 71 3HG2 VAL 71 1.466 5.325 -8.284 503 HG22 VAL 71 1HG2 VAL 71 0.663 5.469 -9.847 504 HG23 VAL 71 2HG2 VAL 71 2.373 5.046 -9.770 505 H ALA 72 H ALA 72 -1.030 6.400 -8.144 506 HA ALA 72 HA ALA 72 -0.449 7.089 -5.343 507 HB1 ALA 72 1HB ALA 72 -2.413 8.227 -5.486 508 HB2 ALA 72 2HB ALA 72 -3.041 7.206 -6.781 509 HB3 ALA 72 3HB ALA 72 -3.051 6.625 -5.116 510 H ASP 73 H ASP 73 -0.780 5.438 -3.825 511 HA ASP 73 HA ASP 73 -0.150 2.846 -4.657 512 HB2 ASP 73 2HB ASP 73 0.411 3.351 -2.439 513 HB3 ASP 73 3HB ASP 73 -1.192 3.984 -2.079 514 H GLY 74 H GLY 74 -1.350 0.937 -4.789 515 HA2 GLY 74 2HA GLY 74 -3.253 -0.386 -4.957 516 HA3 GLY 74 3HA GLY 74 -4.221 0.993 -4.456 517 H ASP 75 H ASP 75 -2.021 1.526 -7.033 518 HA ASP 75 HA ASP 75 -4.177 2.089 -8.841 519 HB2 ASP 75 2HB ASP 75 -1.270 2.515 -8.762 520 HB3 ASP 75 3HB ASP 75 -1.908 2.206 -10.374 521 H LYS 76 H LYS 76 -4.373 1.174 -10.989 522 HA LYS 76 HA LYS 76 -3.702 -1.691 -11.007 523 HB2 LYS 76 2HB LYS 76 -5.831 -0.348 -12.668 524 HB3 LYS 76 3HB LYS 76 -5.631 -2.067 -12.353 525 HG2 LYS 76 2HG LYS 76 -6.070 -1.526 -9.916 526 HG3 LYS 76 3HG LYS 76 -6.584 0.069 -10.471 527 HD2 LYS 76 2HD LYS 76 -8.600 -0.777 -10.878 528 HD3 LYS 76 3HD LYS 76 -7.881 -1.796 -12.127 529 HE2 LYS 76 2HE LYS 76 -7.245 -3.272 -10.016 530 HE3 LYS 76 3HE LYS 76 -8.650 -2.455 -9.333 531 HZ1 LYS 76 3HZ LYS 76 -9.545 -3.215 -11.754 532 HZ2 LYS 76 1HZ LYS 76 -9.788 -4.084 -10.323 533 HZ3 LYS 76 2HZ LYS 76 -8.518 -4.500 -11.359 534 H PHE 77 H PHE 77 -2.385 -2.471 -12.526 535 HA PHE 77 HA PHE 77 -1.667 -0.698 -14.766 536 HB2 PHE 77 2HB PHE 77 -0.036 -2.760 -13.281 537 HB3 PHE 77 3HB PHE 77 0.478 -2.055 -14.810 538 HD1 PHE 77 HD2 PHE 77 0.008 0.701 -14.682 539 HD2 PHE 77 HD1 PHE 77 1.121 -1.906 -11.507 540 HE1 PHE 77 HE2 PHE 77 0.996 2.602 -13.473 541 HE2 PHE 77 HE1 PHE 77 2.110 -0.008 -10.292 542 HZ PHE 77 HZ PHE 77 2.049 2.249 -11.275 543 H VAL 78 H VAL 78 -1.717 -1.464 -16.827 544 HA VAL 78 HA VAL 78 -2.951 -4.100 -17.197 545 HB VAL 78 HB VAL 78 -2.711 -1.825 -19.170 546 HG11 VAL 78 1HG1 VAL 78 -4.115 -4.484 -19.283 547 HG12 VAL 78 2HG1 VAL 78 -4.495 -3.146 -20.370 548 HG13 VAL 78 3HG1 VAL 78 -2.881 -3.857 -20.376 549 HG21 VAL 78 3HG2 VAL 78 -4.411 -2.085 -16.947 550 HG22 VAL 78 1HG2 VAL 78 -4.518 -0.910 -18.258 551 HG23 VAL 78 2HG2 VAL 78 -5.394 -2.437 -18.368 552 H LEU 79 H LEU 79 -1.764 -5.735 -17.910 553 HA LEU 79 HA LEU 79 0.817 -5.153 -19.188 554 HB2 LEU 79 2HB LEU 79 0.796 -6.499 -17.094 555 HB3 LEU 79 3HB LEU 79 -0.127 -7.733 -17.949 556 HG LEU 79 HG LEU 79 1.981 -7.584 -19.585 557 HD11 LEU 79 1HD1 LEU 79 3.563 -7.445 -17.146 558 HD12 LEU 79 2HD1 LEU 79 2.802 -5.911 -17.567 559 HD13 LEU 79 3HD1 LEU 79 3.851 -6.723 -18.729 560 HD21 LEU 79 3HD2 LEU 79 2.353 -9.680 -18.882 561 HD22 LEU 79 1HD2 LEU 79 0.954 -9.408 -17.844 562 HD23 LEU 79 2HD2 LEU 79 2.582 -9.184 -17.205 563 H ILE 80 H ILE 80 1.179 -5.695 -21.247 564 HA ILE 80 HA ILE 80 -0.814 -7.398 -22.595 565 HB ILE 80 HB ILE 80 -0.856 -5.001 -23.302 566 HG12 ILE 80 2HG1 ILE 80 0.118 -6.609 -25.632 567 HG13 ILE 80 3HG1 ILE 80 -1.324 -7.135 -24.771 568 HG21 ILE 80 1HG2 ILE 80 1.552 -5.244 -24.938 569 HG22 ILE 80 2HG2 ILE 80 0.958 -3.884 -23.986 570 HG23 ILE 80 3HG2 ILE 80 1.871 -5.176 -23.205 571 HD11 ILE 80 3HD1 ILE 80 -0.954 -4.412 -25.994 572 HD12 ILE 80 1HD1 ILE 80 -1.815 -5.754 -26.746 573 HD13 ILE 80 2HD1 ILE 80 -2.420 -5.048 -25.247 574 H THR 81 H THR 81 -0.094 -8.888 -24.116 575 HA THR 81 HA THR 81 2.819 -9.341 -24.170 576 HB THR 81 HB THR 81 1.619 -11.021 -22.774 577 HG1 THR 81 HG1 THR 81 2.448 -12.865 -24.214 578 HG21 THR 81 3HG2 THR 81 0.372 -11.872 -25.389 579 HG22 THR 81 1HG2 THR 81 -0.482 -11.041 -24.090 580 HG23 THR 81 2HG2 THR 81 0.174 -12.656 -23.822 581 H ARG 82 H ARG 82 3.743 -9.759 -26.111 582 HA ARG 82 HA ARG 82 2.041 -9.466 -28.463 583 HB2 ARG 82 2HB ARG 82 4.592 -8.527 -27.785 584 HB3 ARG 82 3HB ARG 82 4.866 -9.737 -29.031 585 HG2 ARG 82 2HG ARG 82 3.249 -8.570 -30.480 586 HG3 ARG 82 3HG ARG 82 3.074 -7.327 -29.239 587 HD2 ARG 82 2HD ARG 82 5.543 -6.943 -29.405 588 HD3 ARG 82 3HD ARG 82 5.559 -8.034 -30.790 589 HE ARG 82 HE ARG 82 3.640 -6.123 -31.331 590 HH11 ARG 82 1HH1 ARG 82 7.067 -6.202 -30.724 591 HH12 ARG 82 2HH1 ARG 82 7.404 -4.808 -31.697 592 HH21 ARG 82 1HH2 ARG 82 4.071 -4.287 -32.615 593 HH22 ARG 82 2HH2 ARG 82 5.699 -3.719 -32.771 594 H THR 83 H THR 83 1.938 -10.948 -30.129 595 HA THR 83 HA THR 83 2.646 -13.679 -29.388 596 HB THR 83 HB THR 83 1.356 -13.941 -31.768 597 HG1 THR 83 HG1 THR 83 0.167 -12.239 -32.175 598 HG21 THR 83 3HG2 THR 83 0.668 -15.199 -29.898 599 HG22 THR 83 1HG2 THR 83 -0.734 -14.219 -30.326 600 HG23 THR 83 2HG2 THR 83 0.285 -13.754 -28.963 601 H VAL 84 H VAL 84 4.454 -14.577 -30.106 602 HA VAL 84 HA VAL 84 6.030 -13.347 -32.167 603 HB VAL 84 HB VAL 84 7.624 -15.164 -31.779 604 HG11 VAL 84 1HG1 VAL 84 6.553 -14.114 -29.164 605 HG12 VAL 84 2HG1 VAL 84 8.207 -14.624 -29.513 606 HG13 VAL 84 3HG1 VAL 84 7.547 -13.180 -30.283 607 HG21 VAL 84 3HG2 VAL 84 5.526 -16.269 -29.913 608 HG22 VAL 84 1HG2 VAL 84 6.044 -16.986 -31.439 609 HG23 VAL 84 2HG2 VAL 84 7.171 -16.880 -30.087 610 H GLY 85 H GLY 85 3.746 -15.955 -31.978 611 HA2 GLY 85 2HA GLY 85 3.707 -16.198 -34.843 612 HA3 GLY 85 3HA GLY 85 4.384 -17.612 -34.049 Start of MODEL 5 1 H1 MET 9 H MET 9 1.438 -1.066 0.325 2 HA MET 9 HA MET 9 0.717 0.691 -1.816 3 HB2 MET 9 2HB MET 9 3.581 0.319 -1.078 4 HB3 MET 9 3HB MET 9 3.167 0.361 -2.787 5 HG2 MET 9 2HG MET 9 1.976 2.537 -2.309 6 HG3 MET 9 3HG MET 9 2.752 2.503 -0.728 7 HE1 MET 9 3HE MET 9 5.670 3.446 -0.584 8 HE2 MET 9 1HE MET 9 5.237 4.891 -1.499 9 HE3 MET 9 2HE MET 9 4.050 4.131 -0.439 10 H LYS 10 H LYS 10 -0.436 -0.775 -2.905 11 HA LYS 10 HA LYS 10 0.917 -3.263 -3.703 12 HB2 LYS 10 2HB LYS 10 -1.855 -2.901 -2.604 13 HB3 LYS 10 3HB LYS 10 -1.485 -4.250 -3.670 14 HG2 LYS 10 2HG LYS 10 0.380 -4.835 -2.067 15 HG3 LYS 10 3HG LYS 10 -0.334 -3.659 -0.961 16 HD2 LYS 10 2HD LYS 10 -1.518 -5.428 -0.228 17 HD3 LYS 10 3HD LYS 10 -2.518 -5.110 -1.647 18 HE2 LYS 10 2HE LYS 10 -2.042 -7.147 -2.392 19 HE3 LYS 10 3HE LYS 10 -0.349 -6.673 -2.526 20 HZ1 LYS 10 3HZ LYS 10 0.020 -7.400 -0.271 21 HZ2 LYS 10 1HZ LYS 10 -0.659 -8.666 -1.165 22 HZ3 LYS 10 2HZ LYS 10 -1.616 -7.787 -0.082 23 H ILE 11 H ILE 11 0.592 -3.937 -5.792 24 HA ILE 11 HA ILE 11 -1.137 -2.255 -7.480 25 HB ILE 11 HB ILE 11 0.515 -2.320 -9.270 26 HG12 ILE 11 2HG1 ILE 11 2.865 -3.079 -7.860 27 HG13 ILE 11 3HG1 ILE 11 1.679 -4.361 -7.640 28 HG21 ILE 11 1HG2 ILE 11 2.338 -0.966 -8.069 29 HG22 ILE 11 2HG2 ILE 11 0.681 -0.369 -8.006 30 HG23 ILE 11 3HG2 ILE 11 1.367 -1.213 -6.619 31 HD11 ILE 11 3HD1 ILE 11 1.389 -4.095 -10.232 32 HD12 ILE 11 1HD1 ILE 11 3.010 -3.411 -10.118 33 HD13 ILE 11 2HD1 ILE 11 2.704 -5.054 -9.552 34 H LYS 12 H LYS 12 -2.183 -3.273 -9.164 35 HA LYS 12 HA LYS 12 -1.882 -6.203 -9.291 36 HB2 LYS 12 2HB LYS 12 -4.068 -4.979 -8.306 37 HB3 LYS 12 3HB LYS 12 -4.496 -5.001 -10.012 38 HG2 LYS 12 2HG LYS 12 -3.791 -7.527 -9.817 39 HG3 LYS 12 3HG LYS 12 -4.151 -7.258 -8.110 40 HD2 LYS 12 2HD LYS 12 -6.306 -6.104 -9.317 41 HD3 LYS 12 3HD LYS 12 -5.955 -7.439 -10.417 42 HE2 LYS 12 2HE LYS 12 -7.412 -8.393 -8.882 43 HE3 LYS 12 3HE LYS 12 -5.828 -8.872 -8.275 44 HZ1 LYS 12 3HZ LYS 12 -7.471 -6.611 -7.271 45 HZ2 LYS 12 1HZ LYS 12 -5.929 -7.018 -6.709 46 HZ3 LYS 12 2HZ LYS 12 -7.220 -8.087 -6.484 47 H ILE 13 H ILE 13 -1.145 -6.853 -11.193 48 HA ILE 13 HA ILE 13 -1.730 -5.215 -13.569 49 HB ILE 13 HB ILE 13 0.645 -5.338 -13.141 50 HG12 ILE 13 2HG1 ILE 13 0.476 -7.302 -15.349 51 HG13 ILE 13 3HG1 ILE 13 -0.529 -5.868 -15.523 52 HG21 ILE 13 1HG2 ILE 13 0.052 -7.954 -12.276 53 HG22 ILE 13 2HG2 ILE 13 1.177 -8.101 -13.625 54 HG23 ILE 13 3HG2 ILE 13 1.603 -7.117 -12.226 55 HD11 ILE 13 3HD1 ILE 13 1.228 -4.746 -16.241 56 HD12 ILE 13 1HD1 ILE 13 2.030 -5.012 -14.693 57 HD13 ILE 13 2HD1 ILE 13 2.247 -6.166 -16.009 58 H VAL 14 H VAL 14 -3.094 -6.042 -14.998 59 HA VAL 14 HA VAL 14 -3.684 -8.913 -14.906 60 HB VAL 14 HB VAL 14 -5.230 -6.796 -16.398 61 HG11 VAL 14 1HG1 VAL 14 -7.065 -8.527 -16.057 62 HG12 VAL 14 2HG1 VAL 14 -5.795 -8.928 -17.215 63 HG13 VAL 14 3HG1 VAL 14 -5.776 -9.642 -15.601 64 HG21 VAL 14 3HG2 VAL 14 -5.076 -7.312 -13.545 65 HG22 VAL 14 1HG2 VAL 14 -5.840 -5.981 -14.413 66 HG23 VAL 14 2HG2 VAL 14 -6.715 -7.493 -14.171 67 HA PRO 15 HA PRO 15 -1.160 -9.133 -18.625 68 HB2 PRO 15 2HB PRO 15 -1.130 -11.846 -18.715 69 HB3 PRO 15 3HB PRO 15 -0.084 -10.909 -17.641 70 HG2 PRO 15 2HG PRO 15 -2.663 -12.302 -17.032 71 HG3 PRO 15 3HG PRO 15 -1.166 -12.253 -16.082 72 HD2 PRO 15 2HD PRO 15 -3.309 -10.701 -15.507 73 HD3 PRO 15 3HD PRO 15 -1.640 -10.173 -15.210 74 H ALA 16 H ALA 16 -1.823 -9.110 -20.684 75 HA ALA 16 HA ALA 16 -4.535 -9.971 -21.296 76 HB1 ALA 16 1HB ALA 16 -4.092 -7.841 -22.145 77 HB2 ALA 16 2HB ALA 16 -2.504 -8.311 -22.752 78 HB3 ALA 16 3HB ALA 16 -3.963 -8.899 -23.550 79 H VAL 17 H VAL 17 -3.269 -12.213 -20.801 80 HA VAL 17 HA VAL 17 -2.213 -13.288 -23.313 81 HB VAL 17 HB VAL 17 -1.689 -15.317 -21.927 82 HG11 VAL 17 1HG1 VAL 17 -0.507 -12.627 -21.567 83 HG12 VAL 17 2HG1 VAL 17 0.026 -13.892 -20.458 84 HG13 VAL 17 3HG1 VAL 17 0.212 -14.108 -22.199 85 HG21 VAL 17 3HG2 VAL 17 -3.382 -14.904 -20.177 86 HG22 VAL 17 1HG2 VAL 17 -1.765 -15.146 -19.514 87 HG23 VAL 17 2HG2 VAL 17 -2.441 -13.520 -19.621 88 H GLY 18 H GLY 18 -4.750 -12.812 -23.761 89 HA2 GLY 18 2HA GLY 18 -6.790 -13.725 -24.296 90 HA3 GLY 18 3HA GLY 18 -5.887 -15.220 -24.493 91 H GLY 19 H GLY 19 -7.515 -13.201 -22.072 92 HA2 GLY 19 2HA GLY 19 -8.951 -13.872 -20.382 93 HA3 GLY 19 3HA GLY 19 -8.716 -15.538 -20.890 94 H GLY 20 H GLY 20 -5.941 -13.570 -20.232 95 HA2 GLY 20 2HA GLY 20 -4.841 -15.347 -18.382 96 HA3 GLY 20 3HA GLY 20 -4.342 -13.675 -18.590 97 H SER 21 H SER 21 -4.005 -14.238 -16.167 98 HA SER 21 HA SER 21 -6.403 -13.315 -14.731 99 HB2 SER 21 2HB SER 21 -5.452 -14.681 -12.762 100 HB3 SER 21 3HB SER 21 -6.247 -15.568 -14.063 101 HG SER 21 HG SER 21 -4.327 -16.286 -14.772 102 HA PRO 22 HA PRO 22 -3.831 -10.071 -13.238 103 HB2 PRO 22 2HB PRO 22 -5.234 -9.398 -11.014 104 HB3 PRO 22 3HB PRO 22 -5.778 -9.003 -12.649 105 HG2 PRO 22 2HG PRO 22 -6.625 -11.251 -10.862 106 HG3 PRO 22 3HG PRO 22 -7.620 -10.201 -11.888 107 HD2 PRO 22 2HD PRO 22 -6.909 -12.707 -12.626 108 HD3 PRO 22 3HD PRO 22 -7.133 -11.394 -13.799 109 H LEU 23 H LEU 23 -2.236 -9.665 -11.722 110 HA LEU 23 HA LEU 23 -1.913 -11.652 -9.575 111 HB2 LEU 23 2HB LEU 23 -0.372 -12.317 -11.236 112 HB3 LEU 23 3HB LEU 23 0.128 -10.654 -11.542 113 HG LEU 23 HG LEU 23 0.641 -11.649 -8.816 114 HD11 LEU 23 1HD1 LEU 23 2.402 -12.618 -11.045 115 HD12 LEU 23 2HD1 LEU 23 1.103 -13.606 -10.377 116 HD13 LEU 23 3HD1 LEU 23 2.427 -13.073 -9.341 117 HD21 LEU 23 3HD2 LEU 23 2.561 -10.377 -10.734 118 HD22 LEU 23 1HD2 LEU 23 2.532 -10.298 -8.972 119 HD23 LEU 23 2HD2 LEU 23 1.322 -9.426 -9.913 120 H GLU 24 H GLU 24 -1.125 -10.909 -7.640 121 HA GLU 24 HA GLU 24 -0.983 -7.990 -7.378 122 HB2 GLU 24 2HB GLU 24 -1.488 -8.304 -5.038 123 HB3 GLU 24 3HB GLU 24 -2.652 -9.203 -6.000 124 HG2 GLU 24 2HG GLU 24 -0.685 -11.058 -5.546 125 HG3 GLU 24 3HG GLU 24 -0.720 -10.143 -4.040 126 H LEU 25 H LEU 25 0.870 -7.000 -6.906 127 HA LEU 25 HA LEU 25 3.022 -8.480 -5.600 128 HB2 LEU 25 2HB LEU 25 2.977 -7.868 -8.378 129 HB3 LEU 25 3HB LEU 25 4.218 -6.876 -7.613 130 HG LEU 25 HG LEU 25 4.043 -9.888 -7.550 131 HD11 LEU 25 1HD1 LEU 25 6.337 -9.491 -8.716 132 HD12 LEU 25 2HD1 LEU 25 5.643 -7.923 -9.126 133 HD13 LEU 25 3HD1 LEU 25 4.845 -9.405 -9.653 134 HD21 LEU 25 3HD2 LEU 25 4.959 -9.179 -5.473 135 HD22 LEU 25 1HD2 LEU 25 5.969 -7.966 -6.261 136 HD23 LEU 25 2HD2 LEU 25 6.310 -9.681 -6.491 137 H GLU 26 H GLU 26 4.749 -7.069 -4.803 138 HA GLU 26 HA GLU 26 3.682 -4.422 -4.101 139 HB2 GLU 26 2HB GLU 26 5.939 -5.870 -2.722 140 HB3 GLU 26 3HB GLU 26 5.014 -4.498 -2.127 141 HG2 GLU 26 2HG GLU 26 4.029 -6.154 -0.936 142 HG3 GLU 26 3HG GLU 26 3.006 -6.188 -2.371 143 H VAL 27 H VAL 27 4.428 -2.906 -5.438 144 HA VAL 27 HA VAL 27 7.325 -2.686 -5.800 145 HB VAL 27 HB VAL 27 5.464 -2.260 -8.129 146 HG11 VAL 27 1HG1 VAL 27 7.679 -2.632 -9.349 147 HG12 VAL 27 2HG1 VAL 27 7.477 -1.113 -8.475 148 HG13 VAL 27 3HG1 VAL 27 8.441 -2.413 -7.773 149 HG21 VAL 27 3HG2 VAL 27 6.359 -4.454 -8.974 150 HG22 VAL 27 1HG2 VAL 27 6.959 -4.753 -7.342 151 HG23 VAL 27 2HG2 VAL 27 5.227 -4.574 -7.627 152 H ALA 28 H ALA 28 8.030 -0.549 -6.416 153 HA ALA 28 HA ALA 28 6.098 1.532 -5.626 154 HB1 ALA 28 1HB ALA 28 7.621 2.409 -4.259 155 HB2 ALA 28 2HB ALA 28 8.554 0.931 -4.498 156 HB3 ALA 28 3HB ALA 28 8.875 2.348 -5.498 157 HA PRO 29 HA PRO 29 6.581 2.792 -9.896 158 HB2 PRO 29 2HB PRO 29 4.739 4.782 -9.775 159 HB3 PRO 29 3HB PRO 29 4.302 3.076 -9.922 160 HG2 PRO 29 2HG PRO 29 4.358 4.813 -7.485 161 HG3 PRO 29 3HG PRO 29 3.139 3.627 -7.985 162 HD2 PRO 29 2HD PRO 29 5.021 3.081 -6.117 163 HD3 PRO 29 3HD PRO 29 4.376 1.842 -7.212 164 H ASN 30 H ASN 30 7.214 4.525 -7.016 165 HA ASN 30 HA ASN 30 8.109 6.937 -8.355 166 HB2 ASN 30 2HB ASN 30 8.652 7.743 -6.116 167 HB3 ASN 30 3HB ASN 30 7.024 7.073 -6.141 168 HD21 ASN 30 1HD2 ASN 30 6.525 5.721 -4.579 169 HD22 ASN 30 2HD2 ASN 30 7.644 4.838 -3.602 170 H ALA 31 H ALA 31 9.356 4.033 -8.386 171 HA ALA 31 HA ALA 31 12.114 4.818 -7.753 172 HB1 ALA 31 1HB ALA 31 10.677 2.227 -7.853 173 HB2 ALA 31 2HB ALA 31 12.388 2.229 -8.282 174 HB3 ALA 31 3HB ALA 31 11.875 2.817 -6.700 175 H THR 32 H THR 32 10.855 2.512 -10.138 176 HA THR 32 HA THR 32 11.772 4.105 -12.363 177 HB THR 32 HB THR 32 13.037 1.413 -12.299 178 HG1 THR 32 HG1 THR 32 14.861 2.382 -11.188 179 HG21 THR 32 3HG2 THR 32 13.208 2.837 -14.277 180 HG22 THR 32 1HG2 THR 32 14.792 2.602 -13.538 181 HG23 THR 32 2HG2 THR 32 13.926 4.120 -13.303 182 H VAL 33 H VAL 33 10.881 3.476 -14.303 183 HA VAL 33 HA VAL 33 8.556 1.854 -14.190 184 HB VAL 33 HB VAL 33 9.994 2.813 -16.667 185 HG11 VAL 33 1HG1 VAL 33 7.586 1.296 -16.220 186 HG12 VAL 33 2HG1 VAL 33 7.228 2.816 -17.042 187 HG13 VAL 33 3HG1 VAL 33 8.398 1.692 -17.734 188 HG21 VAL 33 3HG2 VAL 33 7.951 4.192 -14.931 189 HG22 VAL 33 1HG2 VAL 33 9.594 4.724 -15.288 190 HG23 VAL 33 2HG2 VAL 33 8.374 4.717 -16.561 191 H GLY 34 H GLY 34 11.744 1.388 -15.701 192 HA2 GLY 34 2HA GLY 34 11.210 -1.131 -16.835 193 HA3 GLY 34 3HA GLY 34 12.805 -0.506 -16.445 194 H ALA 35 H ALA 35 12.235 -0.209 -13.607 195 HA ALA 35 HA ALA 35 13.046 -2.766 -12.730 196 HB1 ALA 35 1HB ALA 35 13.723 -0.838 -11.493 197 HB2 ALA 35 2HB ALA 35 12.047 -0.372 -11.199 198 HB3 ALA 35 3HB ALA 35 12.704 -1.824 -10.443 199 H VAL 36 H VAL 36 9.944 -1.054 -12.485 200 HA VAL 36 HA VAL 36 8.603 -3.103 -11.059 201 HB VAL 36 HB VAL 36 7.314 -1.056 -12.863 202 HG11 VAL 36 1HG1 VAL 36 6.365 -2.974 -10.843 203 HG12 VAL 36 2HG1 VAL 36 5.682 -1.351 -10.732 204 HG13 VAL 36 3HG1 VAL 36 5.528 -2.273 -12.227 205 HG21 VAL 36 3HG2 VAL 36 7.208 -0.163 -10.214 206 HG22 VAL 36 1HG2 VAL 36 8.878 -0.664 -10.480 207 HG23 VAL 36 2HG2 VAL 36 8.136 0.534 -11.542 208 H ARG 37 H ARG 37 8.719 -2.260 -14.507 209 HA ARG 37 HA ARG 37 6.929 -4.210 -15.420 210 HB2 ARG 37 2HB ARG 37 7.821 -2.261 -16.736 211 HB3 ARG 37 3HB ARG 37 9.324 -3.154 -16.926 212 HG2 ARG 37 2HG ARG 37 8.037 -4.967 -18.036 213 HG3 ARG 37 3HG ARG 37 6.608 -3.935 -17.958 214 HD2 ARG 37 2HD ARG 37 7.233 -2.976 -19.859 215 HD3 ARG 37 3HD ARG 37 8.679 -2.371 -19.051 216 HE ARG 37 HE ARG 37 9.059 -5.054 -19.854 217 HH11 ARG 37 1HH1 ARG 37 8.852 -1.822 -21.133 218 HH12 ARG 37 2HH1 ARG 37 9.859 -2.160 -22.502 219 HH21 ARG 37 1HH2 ARG 37 10.387 -5.510 -21.651 220 HH22 ARG 37 2HH2 ARG 37 10.731 -4.258 -22.796 221 H THR 38 H THR 38 10.408 -4.336 -14.843 222 HA THR 38 HA THR 38 10.787 -6.934 -15.936 223 HB THR 38 HB THR 38 12.485 -5.433 -13.933 224 HG1 THR 38 HG1 THR 38 12.427 -5.539 -16.766 225 HG21 THR 38 3HG2 THR 38 12.853 -8.007 -15.401 226 HG22 THR 38 1HG2 THR 38 13.287 -7.587 -13.745 227 HG23 THR 38 2HG2 THR 38 14.256 -6.986 -15.090 228 H LYS 39 H LYS 39 10.099 -5.706 -12.705 229 HA LYS 39 HA LYS 39 10.500 -8.105 -11.290 230 HB2 LYS 39 2HB LYS 39 10.307 -5.881 -10.225 231 HB3 LYS 39 3HB LYS 39 8.599 -5.842 -10.646 232 HG2 LYS 39 2HG LYS 39 8.879 -6.461 -8.329 233 HG3 LYS 39 3HG LYS 39 8.220 -7.819 -9.244 234 HD2 LYS 39 2HD LYS 39 9.940 -8.599 -7.725 235 HD3 LYS 39 3HD LYS 39 10.482 -8.785 -9.394 236 HE2 LYS 39 2HE LYS 39 12.260 -7.514 -9.000 237 HE3 LYS 39 3HE LYS 39 11.236 -6.200 -8.425 238 HZ1 LYS 39 3HZ LYS 39 13.001 -7.551 -6.908 239 HZ2 LYS 39 1HZ LYS 39 11.559 -8.355 -6.538 240 HZ3 LYS 39 2HZ LYS 39 11.680 -6.685 -6.304 241 H VAL 40 H VAL 40 7.574 -6.696 -12.728 242 HA VAL 40 HA VAL 40 5.857 -8.819 -11.934 243 HB VAL 40 HB VAL 40 4.945 -6.629 -12.472 244 HG11 VAL 40 1HG1 VAL 40 6.577 -6.058 -14.241 245 HG12 VAL 40 2HG1 VAL 40 5.750 -7.176 -15.327 246 HG13 VAL 40 3HG1 VAL 40 4.908 -5.750 -14.719 247 HG21 VAL 40 3HG2 VAL 40 3.126 -7.341 -14.005 248 HG22 VAL 40 1HG2 VAL 40 4.039 -8.811 -14.345 249 HG23 VAL 40 2HG2 VAL 40 3.447 -8.498 -12.713 250 H CYS 41 H CYS 41 7.707 -8.128 -14.859 251 HA CYS 41 HA CYS 41 6.645 -10.132 -16.499 252 HB2 CYS 41 2HB CYS 41 7.996 -8.439 -17.499 253 HB3 CYS 41 3HB CYS 41 9.357 -8.810 -16.446 254 HG CYS 41 HG CYS 41 8.870 -9.857 -19.436 255 H ALA 42 H ALA 42 9.429 -10.195 -14.298 256 HA ALA 42 HA ALA 42 10.149 -12.883 -14.850 257 HB1 ALA 42 1HB ALA 42 10.761 -11.506 -12.259 258 HB2 ALA 42 2HB ALA 42 11.736 -12.668 -13.160 259 HB3 ALA 42 3HB ALA 42 11.550 -11.020 -13.760 260 H MET 43 H MET 43 8.022 -11.372 -12.486 261 HA MET 43 HA MET 43 7.611 -13.608 -10.834 262 HB2 MET 43 2HB MET 43 6.964 -11.268 -10.272 263 HB3 MET 43 3HB MET 43 5.651 -11.387 -11.435 264 HG2 MET 43 2HG MET 43 4.561 -11.845 -9.479 265 HG3 MET 43 3HG MET 43 4.966 -13.468 -10.033 266 HE1 MET 43 3HE MET 43 5.448 -14.791 -7.019 267 HE2 MET 43 1HE MET 43 5.418 -14.977 -8.772 268 HE3 MET 43 2HE MET 43 6.944 -15.104 -7.899 269 H LYS 44 H LYS 44 6.280 -12.711 -13.923 270 HA LYS 44 HA LYS 44 4.327 -14.892 -13.792 271 HB2 LYS 44 2HB LYS 44 4.657 -12.907 -16.037 272 HB3 LYS 44 3HB LYS 44 3.258 -13.908 -15.675 273 HG2 LYS 44 2HG LYS 44 3.702 -12.365 -13.382 274 HG3 LYS 44 3HG LYS 44 3.897 -11.271 -14.754 275 HD2 LYS 44 2HD LYS 44 1.586 -11.280 -14.051 276 HD3 LYS 44 3HD LYS 44 1.721 -12.047 -15.635 277 HE2 LYS 44 2HE LYS 44 2.041 -14.038 -13.620 278 HE3 LYS 44 3HE LYS 44 0.596 -13.097 -13.257 279 HZ1 LYS 44 3HZ LYS 44 -0.459 -14.229 -14.820 280 HZ2 LYS 44 1HZ LYS 44 0.949 -15.074 -15.222 281 HZ3 LYS 44 2HZ LYS 44 0.592 -13.612 -15.993 282 H LYS 45 H LYS 45 7.455 -14.320 -14.816 283 HA LYS 45 HA LYS 45 8.940 -15.482 -16.088 284 HB2 LYS 45 2HB LYS 45 6.829 -17.646 -16.045 285 HB3 LYS 45 3HB LYS 45 8.529 -17.861 -16.439 286 HG2 LYS 45 2HG LYS 45 9.125 -17.985 -14.295 287 HG3 LYS 45 3HG LYS 45 8.105 -16.618 -13.839 288 HD2 LYS 45 2HD LYS 45 6.775 -19.189 -14.520 289 HD3 LYS 45 3HD LYS 45 7.622 -19.078 -12.976 290 HE2 LYS 45 2HE LYS 45 5.816 -18.088 -12.140 291 HE3 LYS 45 3HE LYS 45 6.154 -16.711 -13.187 292 HZ1 LYS 45 3HZ LYS 45 4.235 -17.140 -14.180 293 HZ2 LYS 45 1HZ LYS 45 4.033 -18.589 -13.331 294 HZ3 LYS 45 2HZ LYS 45 4.901 -18.573 -14.783 295 H LEU 46 H LEU 46 6.926 -13.784 -17.365 296 HA LEU 46 HA LEU 46 6.343 -15.111 -19.883 297 HB2 LEU 46 2HB LEU 46 4.887 -13.414 -20.319 298 HB3 LEU 46 3HB LEU 46 4.892 -13.371 -18.558 299 HG LEU 46 HG LEU 46 6.863 -11.594 -19.116 300 HD11 LEU 46 1HD1 LEU 46 4.926 -10.586 -21.045 301 HD12 LEU 46 2HD1 LEU 46 5.782 -12.024 -21.600 302 HD13 LEU 46 3HD1 LEU 46 6.689 -10.595 -21.103 303 HD21 LEU 46 3HD2 LEU 46 3.920 -10.951 -18.984 304 HD22 LEU 46 1HD2 LEU 46 5.258 -9.884 -18.555 305 HD23 LEU 46 2HD2 LEU 46 4.936 -11.326 -17.592 306 HA PRO 47 HA PRO 47 9.779 -13.619 -22.170 307 HB2 PRO 47 2HB PRO 47 8.656 -13.097 -24.586 308 HB3 PRO 47 3HB PRO 47 8.921 -14.737 -23.984 309 HG2 PRO 47 2HG PRO 47 6.416 -13.098 -23.976 310 HG3 PRO 47 3HG PRO 47 6.629 -14.813 -24.373 311 HD2 PRO 47 2HD PRO 47 5.701 -13.980 -21.970 312 HD3 PRO 47 3HD PRO 47 6.677 -15.450 -22.159 313 HA PRO 48 HA PRO 48 9.290 -9.184 -21.483 314 HB2 PRO 48 2HB PRO 48 11.955 -8.673 -21.424 315 HB3 PRO 48 3HB PRO 48 11.072 -9.328 -20.041 316 HG2 PRO 48 2HG PRO 48 12.760 -10.756 -22.059 317 HG3 PRO 48 3HG PRO 48 12.696 -10.972 -20.300 318 HD2 PRO 48 2HD PRO 48 11.431 -12.638 -22.019 319 HD3 PRO 48 3HD PRO 48 10.796 -12.272 -20.402 320 H ASP 49 H ASP 49 11.096 -10.857 -23.967 321 HA ASP 49 HA ASP 49 11.855 -8.668 -25.545 322 HB2 ASP 49 2HB ASP 49 11.260 -11.543 -26.240 323 HB3 ASP 49 3HB ASP 49 11.830 -10.379 -27.433 324 H THR 50 H THR 50 8.891 -10.598 -25.519 325 HA THR 50 HA THR 50 7.675 -8.623 -27.340 326 HB THR 50 HB THR 50 6.004 -10.437 -27.869 327 HG1 THR 50 HG1 THR 50 7.134 -12.613 -27.428 328 HG21 THR 50 3HG2 THR 50 7.357 -11.439 -29.534 329 HG22 THR 50 1HG2 THR 50 8.820 -11.241 -28.571 330 HG23 THR 50 2HG2 THR 50 8.030 -9.830 -29.274 331 H THR 51 H THR 51 7.566 -7.594 -25.023 332 HA THR 51 HA THR 51 4.841 -8.075 -24.069 333 HB THR 51 HB THR 51 6.580 -9.253 -22.585 334 HG1 THR 51 HG1 THR 51 4.568 -7.465 -21.753 335 HG21 THR 51 3HG2 THR 51 7.003 -6.458 -21.542 336 HG22 THR 51 1HG2 THR 51 8.139 -7.262 -22.624 337 HG23 THR 51 2HG2 THR 51 7.808 -7.941 -21.031 338 H ARG 52 H ARG 52 3.798 -6.265 -23.259 339 HA ARG 52 HA ARG 52 5.297 -3.734 -23.388 340 HB2 ARG 52 2HB ARG 52 2.421 -4.006 -24.246 341 HB3 ARG 52 3HB ARG 52 3.507 -2.648 -24.508 342 HG2 ARG 52 2HG ARG 52 4.862 -4.578 -25.798 343 HG3 ARG 52 3HG ARG 52 3.210 -5.157 -26.017 344 HD2 ARG 52 2HD ARG 52 3.380 -3.791 -27.837 345 HD3 ARG 52 3HD ARG 52 2.785 -2.629 -26.652 346 HE ARG 52 HE ARG 52 5.482 -2.440 -26.433 347 HH11 ARG 52 1HH1 ARG 52 3.254 -2.235 -29.101 348 HH12 ARG 52 2HH1 ARG 52 4.238 -1.134 -30.008 349 HH21 ARG 52 1HH2 ARG 52 6.786 -0.991 -27.618 350 HH22 ARG 52 2HH2 ARG 52 6.248 -0.428 -29.163 351 H LEU 53 H LEU 53 4.277 -1.959 -22.172 352 HA LEU 53 HA LEU 53 2.471 -2.812 -20.037 353 HB2 LEU 53 2HB LEU 53 4.494 -3.130 -18.925 354 HB3 LEU 53 3HB LEU 53 5.240 -1.728 -19.688 355 HG LEU 53 HG LEU 53 3.979 -0.231 -18.282 356 HD11 LEU 53 1HD1 LEU 53 2.452 -2.685 -17.678 357 HD12 LEU 53 2HD1 LEU 53 1.911 -1.013 -17.815 358 HD13 LEU 53 3HD1 LEU 53 2.709 -1.563 -16.342 359 HD21 LEU 53 3HD2 LEU 53 6.011 -0.912 -17.293 360 HD22 LEU 53 1HD2 LEU 53 5.354 -2.485 -16.843 361 HD23 LEU 53 2HD2 LEU 53 4.794 -1.029 -16.021 362 H THR 54 H THR 54 0.867 -1.404 -19.881 363 HA THR 54 HA THR 54 1.405 1.428 -20.488 364 HB THR 54 HB THR 54 -0.910 1.582 -21.410 365 HG1 THR 54 HG1 THR 54 -0.768 -1.266 -21.290 366 HG21 THR 54 3HG2 THR 54 -0.298 0.931 -23.557 367 HG22 THR 54 1HG2 THR 54 0.589 -0.481 -22.985 368 HG23 THR 54 2HG2 THR 54 1.261 1.134 -22.758 369 H TYR 55 H TYR 55 0.654 2.875 -19.048 370 HA TYR 55 HA TYR 55 -1.176 1.906 -16.952 371 HB2 TYR 55 2HB TYR 55 0.985 2.070 -15.936 372 HB3 TYR 55 3HB TYR 55 1.275 3.647 -16.662 373 HD1 TYR 55 HD2 TYR 55 -1.151 1.961 -14.372 374 HD2 TYR 55 HD1 TYR 55 0.957 5.523 -15.353 375 HE1 TYR 55 HE2 TYR 55 -2.060 3.045 -12.360 376 HE2 TYR 55 HE1 TYR 55 0.056 6.618 -13.343 377 HH TYR 55 HH TYR 55 -1.614 6.454 -11.750 378 H LYS 56 H LYS 56 -2.960 3.074 -16.686 379 HA LYS 56 HA LYS 56 -4.533 4.695 -16.965 380 HB2 LYS 56 2HB LYS 56 -2.027 6.297 -16.544 381 HB3 LYS 56 3HB LYS 56 -3.561 7.100 -16.851 382 HG2 LYS 56 2HG LYS 56 -3.515 5.038 -14.727 383 HG3 LYS 56 3HG LYS 56 -2.689 6.564 -14.403 384 HD2 LYS 56 2HD LYS 56 -4.702 7.321 -13.780 385 HD3 LYS 56 3HD LYS 56 -5.060 7.391 -15.507 386 HE2 LYS 56 2HE LYS 56 -5.744 4.908 -15.208 387 HE3 LYS 56 3HE LYS 56 -5.830 5.313 -13.494 388 HZ1 LYS 56 3HZ LYS 56 -7.508 6.885 -13.891 389 HZ2 LYS 56 1HZ LYS 56 -7.951 5.534 -14.809 390 HZ3 LYS 56 2HZ LYS 56 -7.255 6.878 -15.564 391 H GLY 57 H GLY 57 -3.402 3.512 -19.345 392 HA2 GLY 57 2HA GLY 57 -3.735 3.771 -21.611 393 HA3 GLY 57 3HA GLY 57 -4.474 5.329 -21.271 394 H ARG 58 H ARG 58 -1.397 5.026 -19.902 395 HA ARG 58 HA ARG 58 -0.166 6.389 -22.205 396 HB2 ARG 58 2HB ARG 58 -0.703 7.491 -19.674 397 HB3 ARG 58 3HB ARG 58 1.028 7.183 -19.703 398 HG2 ARG 58 2HG ARG 58 1.086 8.406 -21.909 399 HG3 ARG 58 3HG ARG 58 -0.575 8.899 -21.574 400 HD2 ARG 58 2HD ARG 58 0.220 9.864 -19.418 401 HD3 ARG 58 3HD ARG 58 1.871 9.497 -19.917 402 HE ARG 58 HE ARG 58 0.822 10.973 -21.971 403 HH11 ARG 58 1HH1 ARG 58 1.266 11.435 -18.549 404 HH12 ARG 58 2HH1 ARG 58 1.445 13.154 -18.672 405 HH21 ARG 58 1HH2 ARG 58 1.056 13.235 -22.146 406 HH22 ARG 58 2HH2 ARG 58 1.325 14.177 -20.719 407 H ALA 59 H ALA 59 2.132 6.154 -22.400 408 HA ALA 59 HA ALA 59 3.085 3.625 -21.249 409 HB1 ALA 59 1HB ALA 59 2.946 3.947 -23.762 410 HB2 ALA 59 2HB ALA 59 4.302 5.063 -23.591 411 HB3 ALA 59 3HB ALA 59 4.486 3.372 -23.124 412 H LEU 60 H LEU 60 4.647 3.640 -19.774 413 HA LEU 60 HA LEU 60 6.318 6.056 -19.529 414 HB2 LEU 60 2HB LEU 60 5.341 4.216 -17.351 415 HB3 LEU 60 3HB LEU 60 6.465 5.553 -17.118 416 HG LEU 60 HG LEU 60 4.318 6.791 -18.290 417 HD11 LEU 60 1HD1 LEU 60 2.418 5.977 -16.779 418 HD12 LEU 60 2HD1 LEU 60 3.353 4.490 -16.628 419 HD13 LEU 60 3HD1 LEU 60 2.797 5.024 -18.214 420 HD21 LEU 60 3HD2 LEU 60 5.311 6.457 -15.503 421 HD22 LEU 60 1HD2 LEU 60 3.782 7.299 -15.763 422 HD23 LEU 60 2HD2 LEU 60 5.258 7.898 -16.521 423 H LYS 61 H LYS 61 8.494 5.764 -18.873 424 HA LYS 61 HA LYS 61 9.614 3.146 -18.560 425 HB2 LYS 61 2HB LYS 61 11.173 3.874 -20.681 426 HB3 LYS 61 3HB LYS 61 9.851 2.718 -20.758 427 HG2 LYS 61 2HG LYS 61 8.335 4.454 -21.501 428 HG3 LYS 61 3HG LYS 61 9.614 5.662 -21.350 429 HD2 LYS 61 2HD LYS 61 9.643 5.170 -23.617 430 HD3 LYS 61 3HD LYS 61 10.918 4.128 -22.981 431 HE2 LYS 61 2HE LYS 61 9.651 2.212 -23.221 432 HE3 LYS 61 3HE LYS 61 8.124 3.092 -23.177 433 HZ1 LYS 61 3HZ LYS 61 8.168 3.427 -25.373 434 HZ2 LYS 61 1HZ LYS 61 9.296 2.166 -25.412 435 HZ3 LYS 61 2HZ LYS 61 9.824 3.772 -25.406 436 H ASP 62 H ASP 62 10.988 6.059 -20.056 437 HA ASP 62 HA ASP 62 13.161 6.086 -18.187 438 HB2 ASP 62 2HB ASP 62 12.580 7.260 -20.723 439 HB3 ASP 62 3HB ASP 62 13.019 8.550 -19.607 440 H THR 63 H THR 63 10.022 7.107 -17.962 441 HA THR 63 HA THR 63 10.170 9.623 -16.757 442 HB THR 63 HB THR 63 8.108 8.118 -15.476 443 HG1 THR 63 HG1 THR 63 8.055 7.799 -18.297 444 HG21 THR 63 3HG2 THR 63 6.770 9.535 -17.267 445 HG22 THR 63 1HG2 THR 63 8.338 10.316 -17.472 446 HG23 THR 63 2HG2 THR 63 7.559 10.305 -15.890 447 H GLU 64 H GLU 64 11.148 6.554 -15.594 448 HA GLU 64 HA GLU 64 12.122 5.884 -13.649 449 HB2 GLU 64 2HB GLU 64 12.516 8.780 -13.693 450 HB3 GLU 64 3HB GLU 64 12.484 8.116 -12.065 451 HG2 GLU 64 2HG GLU 64 14.316 6.702 -12.495 452 HG3 GLU 64 3HG GLU 64 14.210 6.969 -14.234 453 H THR 65 H THR 65 10.486 8.703 -12.276 454 HA THR 65 HA THR 65 8.990 6.901 -10.515 455 HB THR 65 HB THR 65 8.673 8.733 -9.035 456 HG1 THR 65 HG1 THR 65 8.289 10.570 -10.033 457 HG21 THR 65 3HG2 THR 65 11.424 9.380 -9.986 458 HG22 THR 65 1HG2 THR 65 11.080 7.738 -9.443 459 HG23 THR 65 2HG2 THR 65 10.836 9.098 -8.347 460 H LEU 66 H LEU 66 6.737 7.475 -9.989 461 HA LEU 66 HA LEU 66 5.340 8.613 -12.321 462 HB2 LEU 66 2HB LEU 66 5.174 6.026 -11.281 463 HB3 LEU 66 3HB LEU 66 3.704 6.836 -10.744 464 HG LEU 66 HG LEU 66 4.510 6.929 -13.626 465 HD11 LEU 66 1HD1 LEU 66 3.995 4.541 -12.198 466 HD12 LEU 66 2HD1 LEU 66 4.181 4.762 -13.938 467 HD13 LEU 66 3HD1 LEU 66 2.584 4.883 -13.200 468 HD21 LEU 66 3HD2 LEU 66 1.787 6.848 -12.348 469 HD22 LEU 66 1HD2 LEU 66 2.201 7.306 -14.000 470 HD23 LEU 66 2HD2 LEU 66 2.668 8.346 -12.654 471 H GLU 67 H GLU 67 5.981 8.937 -9.051 472 HA GLU 67 HA GLU 67 3.562 9.816 -7.972 473 HB2 GLU 67 2HB GLU 67 5.576 9.361 -6.631 474 HB3 GLU 67 3HB GLU 67 6.353 10.779 -7.321 475 HG2 GLU 67 2HG GLU 67 4.656 12.209 -6.309 476 HG3 GLU 67 3HG GLU 67 3.869 10.790 -5.622 477 H SER 68 H SER 68 5.942 11.485 -9.941 478 HA SER 68 HA SER 68 4.982 14.108 -9.577 479 HB2 SER 68 2HB SER 68 7.000 12.831 -11.114 480 HB3 SER 68 3HB SER 68 6.031 13.800 -12.224 481 HG SER 68 HG SER 68 7.073 14.793 -9.783 482 H LEU 69 H LEU 69 3.712 11.444 -11.295 483 HA LEU 69 HA LEU 69 2.004 13.150 -12.955 484 HB2 LEU 69 2HB LEU 69 1.919 10.170 -13.034 485 HB3 LEU 69 3HB LEU 69 1.625 11.334 -14.324 486 HG LEU 69 HG LEU 69 4.293 10.474 -13.215 487 HD11 LEU 69 1HD1 LEU 69 3.337 10.298 -16.050 488 HD12 LEU 69 2HD1 LEU 69 2.983 9.028 -14.879 489 HD13 LEU 69 3HD1 LEU 69 4.656 9.429 -15.265 490 HD21 LEU 69 3HD2 LEU 69 4.661 12.039 -15.500 491 HD22 LEU 69 1HD2 LEU 69 5.095 12.448 -13.840 492 HD23 LEU 69 2HD2 LEU 69 3.530 12.939 -14.489 493 H GLY 70 H GLY 70 1.976 11.455 -10.024 494 HA2 GLY 70 2HA GLY 70 0.101 11.844 -8.535 495 HA3 GLY 70 3HA GLY 70 -0.963 11.686 -9.924 496 H VAL 71 H VAL 71 1.083 9.952 -7.662 497 HA VAL 71 HA VAL 71 0.136 7.376 -8.642 498 HB VAL 71 HB VAL 71 1.621 6.431 -6.871 499 HG11 VAL 71 1HG1 VAL 71 3.754 7.640 -7.999 500 HG12 VAL 71 2HG1 VAL 71 2.808 6.377 -8.788 501 HG13 VAL 71 3HG1 VAL 71 2.494 8.074 -9.154 502 HG21 VAL 71 3HG2 VAL 71 3.246 8.686 -6.355 503 HG22 VAL 71 1HG2 VAL 71 1.586 9.135 -5.967 504 HG23 VAL 71 2HG2 VAL 71 2.319 7.723 -5.204 505 H ALA 72 H ALA 72 -1.200 6.006 -7.530 506 HA ALA 72 HA ALA 72 -2.196 6.830 -4.907 507 HB1 ALA 72 1HB ALA 72 -4.553 6.240 -5.807 508 HB2 ALA 72 2HB ALA 72 -3.872 7.831 -6.150 509 HB3 ALA 72 3HB ALA 72 -3.846 6.576 -7.388 510 H ASP 73 H ASP 73 -3.018 5.152 -3.648 511 HA ASP 73 HA ASP 73 -1.909 2.603 -4.087 512 HB2 ASP 73 2HB ASP 73 -3.122 1.913 -2.098 513 HB3 ASP 73 3HB ASP 73 -2.442 3.519 -1.847 514 H GLY 74 H GLY 74 -2.575 0.973 -5.315 515 HA2 GLY 74 2HA GLY 74 -4.329 -0.590 -5.908 516 HA3 GLY 74 3HA GLY 74 -5.454 0.760 -5.922 517 H ASP 75 H ASP 75 -2.401 1.385 -7.321 518 HA ASP 75 HA ASP 75 -3.466 2.013 -9.839 519 HB2 ASP 75 2HB ASP 75 -0.663 1.569 -8.841 520 HB3 ASP 75 3HB ASP 75 -0.978 1.906 -10.541 521 H LYS 76 H LYS 76 -4.026 0.783 -11.503 522 HA LYS 76 HA LYS 76 -3.116 -2.014 -11.545 523 HB2 LYS 76 2HB LYS 76 -5.668 -0.696 -12.144 524 HB3 LYS 76 3HB LYS 76 -5.174 -1.866 -13.360 525 HG2 LYS 76 2HG LYS 76 -5.018 -3.599 -11.685 526 HG3 LYS 76 3HG LYS 76 -5.396 -2.436 -10.411 527 HD2 LYS 76 2HD LYS 76 -7.339 -2.543 -12.615 528 HD3 LYS 76 3HD LYS 76 -7.227 -4.015 -11.648 529 HE2 LYS 76 2HE LYS 76 -7.248 -1.650 -9.984 530 HE3 LYS 76 3HE LYS 76 -8.661 -1.708 -11.037 531 HZ1 LYS 76 3HZ LYS 76 -9.255 -3.823 -10.180 532 HZ2 LYS 76 1HZ LYS 76 -8.935 -2.832 -8.847 533 HZ3 LYS 76 2HZ LYS 76 -7.795 -3.981 -9.339 534 H PHE 77 H PHE 77 -1.861 -2.713 -13.153 535 HA PHE 77 HA PHE 77 -1.452 -0.924 -15.456 536 HB2 PHE 77 2HB PHE 77 0.485 -3.026 -14.490 537 HB3 PHE 77 3HB PHE 77 0.793 -1.704 -15.611 538 HD1 PHE 77 HD2 PHE 77 0.382 0.699 -14.611 539 HD2 PHE 77 HD1 PHE 77 1.155 -2.797 -12.308 540 HE1 PHE 77 HE2 PHE 77 1.149 2.104 -12.742 541 HE2 PHE 77 HE1 PHE 77 1.922 -1.397 -10.436 542 HZ PHE 77 HZ PHE 77 1.921 1.056 -10.652 543 H VAL 78 H VAL 78 -1.457 -1.753 -17.524 544 HA VAL 78 HA VAL 78 -2.601 -4.449 -17.782 545 HB VAL 78 HB VAL 78 -2.594 -2.250 -19.851 546 HG11 VAL 78 1HG1 VAL 78 -3.073 -4.962 -20.112 547 HG12 VAL 78 2HG1 VAL 78 -4.685 -4.254 -19.996 548 HG13 VAL 78 3HG1 VAL 78 -3.565 -3.698 -21.239 549 HG21 VAL 78 3HG2 VAL 78 -4.819 -3.053 -17.978 550 HG22 VAL 78 1HG2 VAL 78 -3.846 -1.588 -17.837 551 HG23 VAL 78 2HG2 VAL 78 -4.899 -1.817 -19.233 552 H LEU 79 H LEU 79 -1.412 -6.026 -18.620 553 HA LEU 79 HA LEU 79 1.081 -5.316 -20.005 554 HB2 LEU 79 2HB LEU 79 1.590 -6.633 -18.140 555 HB3 LEU 79 3HB LEU 79 0.225 -7.713 -18.421 556 HG LEU 79 HG LEU 79 2.091 -7.806 -20.624 557 HD11 LEU 79 1HD1 LEU 79 3.225 -8.736 -18.004 558 HD12 LEU 79 2HD1 LEU 79 3.621 -7.165 -18.700 559 HD13 LEU 79 3HD1 LEU 79 4.018 -8.642 -19.577 560 HD21 LEU 79 3HD2 LEU 79 0.292 -9.446 -19.964 561 HD22 LEU 79 1HD2 LEU 79 1.352 -9.953 -18.649 562 HD23 LEU 79 2HD2 LEU 79 1.871 -10.145 -20.324 563 H ILE 80 H ILE 80 1.383 -5.835 -22.083 564 HA ILE 80 HA ILE 80 -0.718 -7.405 -23.413 565 HB ILE 80 HB ILE 80 1.257 -5.550 -24.738 566 HG12 ILE 80 2HG1 ILE 80 -1.590 -4.989 -23.877 567 HG13 ILE 80 3HG1 ILE 80 -0.143 -4.294 -23.154 568 HG21 ILE 80 1HG2 ILE 80 -1.325 -6.787 -25.684 569 HG22 ILE 80 2HG2 ILE 80 -0.360 -5.624 -26.592 570 HG23 ILE 80 3HG2 ILE 80 0.301 -7.214 -26.216 571 HD11 ILE 80 3HD1 ILE 80 -0.502 -2.593 -24.542 572 HD12 ILE 80 1HD1 ILE 80 0.161 -3.650 -25.789 573 HD13 ILE 80 2HD1 ILE 80 -1.585 -3.536 -25.566 574 H THR 81 H THR 81 -0.185 -9.035 -24.869 575 HA THR 81 HA THR 81 2.635 -9.884 -24.887 576 HB THR 81 HB THR 81 1.340 -11.286 -23.310 577 HG1 THR 81 HG1 THR 81 2.653 -12.799 -23.966 578 HG21 THR 81 3HG2 THR 81 -0.437 -12.691 -24.024 579 HG22 THR 81 1HG2 THR 81 -0.174 -12.282 -25.718 580 HG23 THR 81 2HG2 THR 81 -0.821 -11.073 -24.609 581 H ARG 82 H ARG 82 3.438 -10.440 -26.826 582 HA ARG 82 HA ARG 82 1.558 -10.539 -29.089 583 HB2 ARG 82 2HB ARG 82 4.307 -9.439 -28.767 584 HB3 ARG 82 3HB ARG 82 3.873 -10.109 -30.334 585 HG2 ARG 82 2HG ARG 82 1.770 -8.586 -30.083 586 HG3 ARG 82 3HG ARG 82 2.784 -7.720 -28.927 587 HD2 ARG 82 2HD ARG 82 3.309 -6.601 -30.854 588 HD3 ARG 82 3HD ARG 82 4.549 -7.855 -30.868 589 HE ARG 82 HE ARG 82 3.591 -8.718 -32.754 590 HH11 ARG 82 1HH1 ARG 82 1.299 -6.619 -31.185 591 HH12 ARG 82 2HH1 ARG 82 0.141 -6.707 -32.471 592 HH21 ARG 82 1HH2 ARG 82 2.075 -8.841 -34.454 593 HH22 ARG 82 2HH2 ARG 82 0.583 -7.971 -34.330 594 H THR 83 H THR 83 1.712 -12.163 -30.610 595 HA THR 83 HA THR 83 2.005 -14.313 -31.312 596 HB THR 83 HB THR 83 4.869 -13.994 -30.418 597 HG1 THR 83 HG1 THR 83 5.003 -13.201 -32.738 598 HG21 THR 83 3HG2 THR 83 5.270 -15.843 -31.605 599 HG22 THR 83 1HG2 THR 83 4.374 -15.224 -32.992 600 HG23 THR 83 2HG2 THR 83 3.523 -16.069 -31.699 601 H VAL 84 H VAL 84 0.681 -14.811 -29.302 602 HA VAL 84 HA VAL 84 2.054 -16.006 -27.078 603 HB VAL 84 HB VAL 84 -0.134 -14.910 -26.793 604 HG11 VAL 84 1HG1 VAL 84 -1.987 -15.441 -27.943 605 HG12 VAL 84 2HG1 VAL 84 -0.865 -16.194 -29.078 606 HG13 VAL 84 3HG1 VAL 84 -1.669 -17.173 -27.850 607 HG21 VAL 84 3HG2 VAL 84 -1.064 -16.508 -25.284 608 HG22 VAL 84 1HG2 VAL 84 -0.328 -17.849 -26.161 609 HG23 VAL 84 2HG2 VAL 84 0.687 -16.720 -25.263 610 H GLY 85 H GLY 85 0.781 -17.090 -30.115 611 HA2 GLY 85 2HA GLY 85 1.053 -19.900 -29.285 612 HA3 GLY 85 3HA GLY 85 0.193 -19.336 -30.710 Start of MODEL 6 1 H1 MET 9 H MET 9 3.141 -0.038 -0.113 2 HA MET 9 HA MET 9 1.583 0.761 -2.322 3 HB2 MET 9 2HB MET 9 4.364 0.667 -1.622 4 HB3 MET 9 3HB MET 9 4.155 0.039 -3.252 5 HG2 MET 9 2HG MET 9 4.392 2.230 -3.750 6 HG3 MET 9 3HG MET 9 2.649 2.200 -3.493 7 HE1 MET 9 3HE MET 9 4.109 4.541 -3.742 8 HE2 MET 9 1HE MET 9 3.063 5.407 -2.615 9 HE3 MET 9 2HE MET 9 4.807 5.375 -2.353 10 H LYS 10 H LYS 10 0.223 -0.710 -3.191 11 HA LYS 10 HA LYS 10 1.441 -3.142 -4.314 12 HB2 LYS 10 2HB LYS 10 -1.103 -2.864 -2.745 13 HB3 LYS 10 3HB LYS 10 -0.927 -4.151 -3.930 14 HG2 LYS 10 2HG LYS 10 1.229 -4.747 -2.689 15 HG3 LYS 10 3HG LYS 10 0.613 -3.712 -1.399 16 HD2 LYS 10 2HD LYS 10 -0.968 -5.985 -2.586 17 HD3 LYS 10 3HD LYS 10 0.087 -6.173 -1.183 18 HE2 LYS 10 2HE LYS 10 -1.959 -4.005 -1.177 19 HE3 LYS 10 3HE LYS 10 -2.476 -5.666 -0.895 20 HZ1 LYS 10 3HZ LYS 10 -0.942 -3.893 0.806 21 HZ2 LYS 10 1HZ LYS 10 -0.383 -5.489 0.750 22 HZ3 LYS 10 2HZ LYS 10 -1.976 -5.167 1.220 23 H ILE 11 H ILE 11 0.548 -3.888 -6.275 24 HA ILE 11 HA ILE 11 -1.375 -2.111 -7.596 25 HB ILE 11 HB ILE 11 -0.082 -1.978 -9.614 26 HG12 ILE 11 2HG1 ILE 11 2.441 -2.859 -9.216 27 HG13 ILE 11 3HG1 ILE 11 1.556 -4.040 -8.257 28 HG21 ILE 11 1HG2 ILE 11 1.831 -0.648 -8.849 29 HG22 ILE 11 2HG2 ILE 11 0.370 -0.281 -7.934 30 HG23 ILE 11 3HG2 ILE 11 1.623 -1.297 -7.222 31 HD11 ILE 11 3HD1 ILE 11 0.936 -5.134 -10.074 32 HD12 ILE 11 1HD1 ILE 11 0.293 -3.666 -10.808 33 HD13 ILE 11 2HD1 ILE 11 1.997 -4.075 -11.003 34 H LYS 12 H LYS 12 -2.481 -3.059 -9.385 35 HA LYS 12 HA LYS 12 -2.378 -6.005 -9.395 36 HB2 LYS 12 2HB LYS 12 -4.805 -4.299 -9.965 37 HB3 LYS 12 3HB LYS 12 -4.754 -6.047 -9.786 38 HG2 LYS 12 2HG LYS 12 -3.769 -5.353 -7.403 39 HG3 LYS 12 3HG LYS 12 -4.755 -3.926 -7.731 40 HD2 LYS 12 2HD LYS 12 -6.554 -5.063 -7.089 41 HD3 LYS 12 3HD LYS 12 -6.308 -6.171 -8.441 42 HE2 LYS 12 2HE LYS 12 -6.311 -7.601 -6.624 43 HE3 LYS 12 3HE LYS 12 -4.590 -7.308 -6.867 44 HZ1 LYS 12 3HZ LYS 12 -6.081 -5.572 -5.028 45 HZ2 LYS 12 1HZ LYS 12 -4.449 -6.020 -4.999 46 HZ3 LYS 12 2HZ LYS 12 -5.637 -7.120 -4.509 47 H ILE 13 H ILE 13 -1.642 -6.808 -11.238 48 HA ILE 13 HA ILE 13 -2.168 -5.323 -13.730 49 HB ILE 13 HB ILE 13 0.196 -5.271 -13.268 50 HG12 ILE 13 2HG1 ILE 13 0.294 -7.420 -15.268 51 HG13 ILE 13 3HG1 ILE 13 -0.921 -6.191 -15.602 52 HG21 ILE 13 1HG2 ILE 13 -0.269 -7.857 -12.205 53 HG22 ILE 13 2HG2 ILE 13 0.943 -8.003 -13.476 54 HG23 ILE 13 3HG2 ILE 13 1.203 -6.889 -12.134 55 HD11 ILE 13 3HD1 ILE 13 1.257 -4.683 -14.954 56 HD12 ILE 13 1HD1 ILE 13 1.983 -6.059 -15.783 57 HD13 ILE 13 2HD1 ILE 13 0.745 -5.096 -16.590 58 H VAL 14 H VAL 14 -3.532 -6.323 -15.040 59 HA VAL 14 HA VAL 14 -3.773 -9.252 -14.872 60 HB VAL 14 HB VAL 14 -5.864 -8.193 -14.375 61 HG11 VAL 14 1HG1 VAL 14 -6.593 -6.900 -16.774 62 HG12 VAL 14 2HG1 VAL 14 -6.343 -6.181 -15.182 63 HG13 VAL 14 3HG1 VAL 14 -5.002 -6.291 -16.322 64 HG21 VAL 14 3HG2 VAL 14 -5.597 -10.132 -16.196 65 HG22 VAL 14 1HG2 VAL 14 -7.165 -9.491 -15.703 66 HG23 VAL 14 2HG2 VAL 14 -6.408 -8.922 -17.191 67 HA PRO 15 HA PRO 15 -1.739 -9.098 -18.875 68 HB2 PRO 15 2HB PRO 15 -1.409 -11.786 -19.068 69 HB3 PRO 15 3HB PRO 15 -0.355 -10.756 -18.092 70 HG2 PRO 15 2HG PRO 15 -2.663 -12.458 -17.234 71 HG3 PRO 15 3HG PRO 15 -1.078 -12.254 -16.467 72 HD2 PRO 15 2HD PRO 15 -3.298 -10.979 -15.585 73 HD3 PRO 15 3HD PRO 15 -1.678 -10.265 -15.468 74 H ALA 16 H ALA 16 -2.648 -9.105 -20.838 75 HA ALA 16 HA ALA 16 -5.329 -10.115 -21.167 76 HB1 ALA 16 1HB ALA 16 -5.445 -8.846 -23.083 77 HB2 ALA 16 2HB ALA 16 -4.262 -7.941 -22.139 78 HB3 ALA 16 3HB ALA 16 -3.724 -9.015 -23.430 79 H VAL 17 H VAL 17 -4.099 -12.333 -20.654 80 HA VAL 17 HA VAL 17 -4.416 -13.934 -22.945 81 HB VAL 17 HB VAL 17 -2.213 -12.891 -23.521 82 HG11 VAL 17 1HG1 VAL 17 -1.615 -13.349 -20.870 83 HG12 VAL 17 2HG1 VAL 17 -0.686 -14.587 -21.718 84 HG13 VAL 17 3HG1 VAL 17 -0.470 -12.885 -22.128 85 HG21 VAL 17 3HG2 VAL 17 -2.996 -15.155 -24.305 86 HG22 VAL 17 1HG2 VAL 17 -1.250 -14.902 -24.333 87 HG23 VAL 17 2HG2 VAL 17 -1.983 -15.855 -23.042 88 H GLY 18 H GLY 18 -4.154 -16.192 -22.509 89 HA2 GLY 18 2HA GLY 18 -4.427 -18.024 -21.150 90 HA3 GLY 18 3HA GLY 18 -3.085 -17.350 -20.238 91 H GLY 19 H GLY 19 -6.602 -17.333 -20.572 92 HA2 GLY 19 2HA GLY 19 -8.174 -17.356 -18.859 93 HA3 GLY 19 3HA GLY 19 -6.872 -17.141 -17.699 94 H GLY 20 H GLY 20 -5.703 -14.837 -18.312 95 HA2 GLY 20 2HA GLY 20 -5.915 -12.540 -18.332 96 HA3 GLY 20 3HA GLY 20 -7.536 -12.744 -18.977 97 H SER 21 H SER 21 -5.721 -13.171 -15.943 98 HA SER 21 HA SER 21 -8.050 -12.060 -14.523 99 HB2 SER 21 2HB SER 21 -8.238 -14.141 -13.634 100 HB3 SER 21 3HB SER 21 -6.584 -14.581 -14.059 101 HG SER 21 HG SER 21 -6.002 -14.088 -12.110 102 HA PRO 22 HA PRO 22 -5.311 -9.145 -12.716 103 HB2 PRO 22 2HB PRO 22 -6.477 -8.768 -10.294 104 HB3 PRO 22 3HB PRO 22 -7.169 -8.153 -11.799 105 HG2 PRO 22 2HG PRO 22 -7.883 -10.615 -10.253 106 HG3 PRO 22 3HG PRO 22 -8.952 -9.429 -11.025 107 HD2 PRO 22 2HD PRO 22 -8.368 -11.818 -12.158 108 HD3 PRO 22 3HD PRO 22 -8.679 -10.357 -13.117 109 H LEU 23 H LEU 23 -3.363 -9.330 -11.809 110 HA LEU 23 HA LEU 23 -2.964 -11.413 -9.763 111 HB2 LEU 23 2HB LEU 23 -1.080 -10.357 -11.861 112 HB3 LEU 23 3HB LEU 23 -0.578 -11.404 -10.534 113 HG LEU 23 HG LEU 23 -2.788 -12.416 -12.210 114 HD11 LEU 23 1HD1 LEU 23 -1.783 -12.211 -14.173 115 HD12 LEU 23 2HD1 LEU 23 -0.437 -13.168 -13.558 116 HD13 LEU 23 3HD1 LEU 23 -0.403 -11.410 -13.423 117 HD21 LEU 23 3HD2 LEU 23 -0.923 -14.360 -12.033 118 HD22 LEU 23 1HD2 LEU 23 -2.164 -14.069 -10.814 119 HD23 LEU 23 2HD2 LEU 23 -0.541 -13.416 -10.592 120 H GLU 24 H GLU 24 -1.927 -10.898 -7.892 121 HA GLU 24 HA GLU 24 -1.589 -8.060 -7.345 122 HB2 GLU 24 2HB GLU 24 -2.751 -9.897 -5.845 123 HB3 GLU 24 3HB GLU 24 -1.106 -10.174 -5.291 124 HG2 GLU 24 2HG GLU 24 -1.074 -7.604 -4.930 125 HG3 GLU 24 3HG GLU 24 -2.830 -7.762 -4.968 126 H LEU 25 H LEU 25 0.314 -7.061 -7.205 127 HA LEU 25 HA LEU 25 2.737 -8.620 -6.709 128 HB2 LEU 25 2HB LEU 25 1.991 -7.576 -9.248 129 HB3 LEU 25 3HB LEU 25 3.377 -6.661 -8.658 130 HG LEU 25 HG LEU 25 4.008 -8.554 -10.110 131 HD11 LEU 25 1HD1 LEU 25 5.894 -8.993 -8.931 132 HD12 LEU 25 2HD1 LEU 25 5.019 -9.343 -7.441 133 HD13 LEU 25 3HD1 LEU 25 5.274 -7.671 -7.941 134 HD21 LEU 25 3HD2 LEU 25 2.073 -9.991 -9.226 135 HD22 LEU 25 1HD2 LEU 25 3.161 -10.392 -7.896 136 HD23 LEU 25 2HD2 LEU 25 3.614 -10.786 -9.555 137 H GLU 26 H GLU 26 4.336 -7.522 -5.633 138 HA GLU 26 HA GLU 26 3.577 -4.880 -4.615 139 HB2 GLU 26 2HB GLU 26 5.331 -5.333 -2.882 140 HB3 GLU 26 3HB GLU 26 3.984 -6.462 -2.870 141 HG2 GLU 26 2HG GLU 26 5.331 -8.187 -3.189 142 HG3 GLU 26 3HG GLU 26 6.089 -7.415 -4.581 143 H VAL 27 H VAL 27 4.372 -3.272 -5.810 144 HA VAL 27 HA VAL 27 7.251 -3.230 -6.332 145 HB VAL 27 HB VAL 27 7.009 -2.509 -8.607 146 HG11 VAL 27 1HG1 VAL 27 6.033 -4.517 -9.639 147 HG12 VAL 27 2HG1 VAL 27 7.076 -4.910 -8.271 148 HG13 VAL 27 3HG1 VAL 27 5.322 -4.954 -8.086 149 HG21 VAL 27 3HG2 VAL 27 4.164 -2.256 -7.852 150 HG22 VAL 27 1HG2 VAL 27 5.145 -1.267 -8.933 151 HG23 VAL 27 2HG2 VAL 27 4.495 -2.807 -9.494 152 H ALA 28 H ALA 28 7.951 -1.012 -7.091 153 HA ALA 28 HA ALA 28 6.284 1.074 -5.842 154 HB1 ALA 28 1HB ALA 28 7.914 1.603 -4.433 155 HB2 ALA 28 2HB ALA 28 8.814 0.197 -5.002 156 HB3 ALA 28 3HB ALA 28 9.063 1.769 -5.760 157 HA PRO 29 HA PRO 29 6.660 2.699 -10.003 158 HB2 PRO 29 2HB PRO 29 4.928 4.753 -9.616 159 HB3 PRO 29 3HB PRO 29 4.398 3.092 -9.907 160 HG2 PRO 29 2HG PRO 29 4.634 4.579 -7.320 161 HG3 PRO 29 3HG PRO 29 3.338 3.506 -7.880 162 HD2 PRO 29 2HD PRO 29 5.258 2.693 -6.152 163 HD3 PRO 29 3HD PRO 29 4.510 1.598 -7.332 164 H ASN 30 H ASN 30 7.480 4.118 -6.999 165 HA ASN 30 HA ASN 30 8.449 6.601 -8.139 166 HB2 ASN 30 2HB ASN 30 9.054 7.204 -5.881 167 HB3 ASN 30 3HB ASN 30 7.440 6.500 -5.856 168 HD21 ASN 30 1HD2 ASN 30 10.243 6.591 -4.244 169 HD22 ASN 30 2HD2 ASN 30 10.212 5.044 -3.476 170 H ALA 31 H ALA 31 9.545 3.652 -8.485 171 HA ALA 31 HA ALA 31 12.368 4.294 -7.960 172 HB1 ALA 31 1HB ALA 31 10.950 1.665 -8.313 173 HB2 ALA 31 2HB ALA 31 12.708 1.816 -8.327 174 HB3 ALA 31 3HB ALA 31 11.796 2.268 -6.887 175 H THR 32 H THR 32 10.894 2.079 -10.304 176 HA THR 32 HA THR 32 11.701 3.697 -12.553 177 HB THR 32 HB THR 32 12.907 1.253 -13.203 178 HG1 THR 32 HG1 THR 32 13.850 2.189 -10.680 179 HG21 THR 32 3HG2 THR 32 14.702 2.569 -13.741 180 HG22 THR 32 1HG2 THR 32 14.575 3.535 -12.272 181 HG23 THR 32 2HG2 THR 32 13.460 3.813 -13.610 182 H VAL 33 H VAL 33 10.676 3.123 -14.444 183 HA VAL 33 HA VAL 33 8.331 1.544 -14.211 184 HB VAL 33 HB VAL 33 9.661 2.652 -16.687 185 HG11 VAL 33 1HG1 VAL 33 7.351 0.934 -16.324 186 HG12 VAL 33 2HG1 VAL 33 6.947 2.434 -17.162 187 HG13 VAL 33 3HG1 VAL 33 8.208 1.378 -17.799 188 HG21 VAL 33 3HG2 VAL 33 7.303 3.741 -15.160 189 HG22 VAL 33 1HG2 VAL 33 8.959 4.308 -14.945 190 HG23 VAL 33 2HG2 VAL 33 8.157 4.498 -16.504 191 H GLY 34 H GLY 34 11.449 1.030 -15.824 192 HA2 GLY 34 2HA GLY 34 10.749 -1.480 -16.965 193 HA3 GLY 34 3HA GLY 34 12.378 -0.850 -16.768 194 H ALA 35 H ALA 35 12.139 -0.534 -13.883 195 HA ALA 35 HA ALA 35 13.039 -3.094 -13.093 196 HB1 ALA 35 1HB ALA 35 13.722 -0.919 -12.064 197 HB2 ALA 35 2HB ALA 35 12.149 -0.871 -11.267 198 HB3 ALA 35 3HB ALA 35 13.280 -2.175 -10.906 199 H VAL 36 H VAL 36 10.020 -1.333 -12.442 200 HA VAL 36 HA VAL 36 8.851 -3.384 -10.869 201 HB VAL 36 HB VAL 36 6.713 -2.178 -11.258 202 HG11 VAL 36 1HG1 VAL 36 8.901 -1.399 -9.782 203 HG12 VAL 36 2HG1 VAL 36 8.448 0.077 -10.638 204 HG13 VAL 36 3HG1 VAL 36 7.266 -0.756 -9.627 205 HG21 VAL 36 3HG2 VAL 36 6.840 -0.001 -12.472 206 HG22 VAL 36 1HG2 VAL 36 8.433 -0.480 -13.059 207 HG23 VAL 36 2HG2 VAL 36 7.008 -1.417 -13.511 208 H ARG 37 H ARG 37 8.673 -2.555 -14.301 209 HA ARG 37 HA ARG 37 6.666 -4.400 -15.007 210 HB2 ARG 37 2HB ARG 37 7.428 -2.492 -16.422 211 HB3 ARG 37 3HB ARG 37 8.914 -3.375 -16.747 212 HG2 ARG 37 2HG ARG 37 7.603 -5.172 -17.786 213 HG3 ARG 37 3HG ARG 37 6.131 -4.243 -17.496 214 HD2 ARG 37 2HD ARG 37 6.495 -3.445 -19.563 215 HD3 ARG 37 3HD ARG 37 7.673 -2.404 -18.764 216 HE ARG 37 HE ARG 37 9.061 -4.677 -19.358 217 HH11 ARG 37 1HH1 ARG 37 7.178 -2.393 -21.189 218 HH12 ARG 37 2HH1 ARG 37 8.091 -2.608 -22.645 219 HH21 ARG 37 1HH2 ARG 37 10.272 -4.969 -21.269 220 HH22 ARG 37 2HH2 ARG 37 9.851 -4.075 -22.689 221 H THR 38 H THR 38 10.184 -4.664 -14.859 222 HA THR 38 HA THR 38 10.308 -7.279 -15.981 223 HB THR 38 HB THR 38 12.628 -7.305 -14.946 224 HG1 THR 38 HG1 THR 38 12.825 -5.868 -13.394 225 HG21 THR 38 3HG2 THR 38 13.335 -5.245 -16.412 226 HG22 THR 38 1HG2 THR 38 11.644 -5.281 -16.908 227 HG23 THR 38 2HG2 THR 38 12.669 -6.692 -17.167 228 H LYS 39 H LYS 39 10.076 -6.006 -12.709 229 HA LYS 39 HA LYS 39 10.595 -8.410 -11.330 230 HB2 LYS 39 2HB LYS 39 9.762 -5.734 -10.685 231 HB3 LYS 39 3HB LYS 39 8.773 -6.889 -9.800 232 HG2 LYS 39 2HG LYS 39 10.409 -6.999 -8.312 233 HG3 LYS 39 3HG LYS 39 11.362 -7.850 -9.530 234 HD2 LYS 39 2HD LYS 39 11.291 -4.875 -9.611 235 HD3 LYS 39 3HD LYS 39 12.257 -5.658 -8.358 236 HE2 LYS 39 2HE LYS 39 12.593 -6.759 -11.062 237 HE3 LYS 39 3HE LYS 39 13.138 -5.094 -10.864 238 HZ1 LYS 39 3HZ LYS 39 14.201 -6.205 -8.704 239 HZ2 LYS 39 1HZ LYS 39 15.008 -6.120 -10.188 240 HZ3 LYS 39 2HZ LYS 39 14.218 -7.545 -9.737 241 H VAL 40 H VAL 40 7.555 -6.901 -12.377 242 HA VAL 40 HA VAL 40 5.885 -8.953 -11.334 243 HB VAL 40 HB VAL 40 4.115 -7.959 -12.744 244 HG11 VAL 40 1HG1 VAL 40 5.659 -6.618 -10.708 245 HG12 VAL 40 2HG1 VAL 40 4.880 -5.457 -11.786 246 HG13 VAL 40 3HG1 VAL 40 3.912 -6.668 -10.944 247 HG21 VAL 40 3HG2 VAL 40 5.324 -7.347 -14.707 248 HG22 VAL 40 1HG2 VAL 40 4.690 -5.863 -13.995 249 HG23 VAL 40 2HG2 VAL 40 6.391 -6.283 -13.790 250 H CYS 41 H CYS 41 7.332 -8.341 -14.496 251 HA CYS 41 HA CYS 41 5.986 -10.338 -15.935 252 HB2 CYS 41 2HB CYS 41 8.573 -8.875 -16.295 253 HB3 CYS 41 3HB CYS 41 8.213 -10.248 -17.334 254 HG CYS 41 HG CYS 41 6.526 -7.291 -17.122 255 H ALA 42 H ALA 42 9.055 -10.424 -14.158 256 HA ALA 42 HA ALA 42 9.697 -13.103 -14.796 257 HB1 ALA 42 1HB ALA 42 11.320 -12.950 -12.978 258 HB2 ALA 42 2HB ALA 42 11.368 -11.512 -14.000 259 HB3 ALA 42 3HB ALA 42 10.570 -11.451 -12.428 260 H MET 43 H MET 43 7.898 -11.628 -12.142 261 HA MET 43 HA MET 43 7.663 -13.871 -10.491 262 HB2 MET 43 2HB MET 43 6.783 -11.267 -10.406 263 HB3 MET 43 3HB MET 43 5.281 -12.165 -10.572 264 HG2 MET 43 2HG MET 43 5.492 -12.077 -8.300 265 HG3 MET 43 3HG MET 43 6.269 -13.619 -8.649 266 HE1 MET 43 3HE MET 43 6.834 -12.920 -6.031 267 HE2 MET 43 1HE MET 43 8.204 -11.890 -5.614 268 HE3 MET 43 2HE MET 43 6.662 -11.164 -6.065 269 H LYS 44 H LYS 44 5.996 -12.992 -13.418 270 HA LYS 44 HA LYS 44 4.091 -15.191 -13.083 271 HB2 LYS 44 2HB LYS 44 4.204 -13.179 -15.331 272 HB3 LYS 44 3HB LYS 44 2.866 -14.242 -14.914 273 HG2 LYS 44 2HG LYS 44 3.885 -12.121 -13.048 274 HG3 LYS 44 3HG LYS 44 2.636 -11.813 -14.257 275 HD2 LYS 44 2HD LYS 44 1.363 -12.332 -12.406 276 HD3 LYS 44 3HD LYS 44 1.495 -13.908 -13.191 277 HE2 LYS 44 2HE LYS 44 2.677 -14.773 -11.497 278 HE3 LYS 44 3HE LYS 44 3.688 -13.336 -11.352 279 HZ1 LYS 44 3HZ LYS 44 2.583 -13.192 -9.400 280 HZ2 LYS 44 1HZ LYS 44 1.217 -14.017 -9.962 281 HZ3 LYS 44 2HZ LYS 44 1.443 -12.388 -10.357 282 H LYS 45 H LYS 45 7.104 -14.628 -14.395 283 HA LYS 45 HA LYS 45 8.476 -15.837 -15.749 284 HB2 LYS 45 2HB LYS 45 6.333 -17.960 -15.783 285 HB3 LYS 45 3HB LYS 45 8.060 -18.171 -16.038 286 HG2 LYS 45 2HG LYS 45 7.796 -16.995 -13.509 287 HG3 LYS 45 3HG LYS 45 6.559 -18.251 -13.600 288 HD2 LYS 45 2HD LYS 45 8.398 -19.416 -12.808 289 HD3 LYS 45 3HD LYS 45 8.476 -19.720 -14.545 290 HE2 LYS 45 2HE LYS 45 10.264 -18.270 -14.845 291 HE3 LYS 45 3HE LYS 45 9.935 -17.397 -13.349 292 HZ1 LYS 45 3HZ LYS 45 11.912 -18.910 -13.308 293 HZ2 LYS 45 1HZ LYS 45 10.843 -20.218 -13.399 294 HZ3 LYS 45 2HZ LYS 45 10.787 -19.171 -12.072 295 H LEU 46 H LEU 46 7.320 -13.940 -17.108 296 HA LEU 46 HA LEU 46 6.455 -15.214 -19.619 297 HB2 LEU 46 2HB LEU 46 5.241 -13.031 -18.076 298 HB3 LEU 46 3HB LEU 46 5.418 -12.704 -19.799 299 HG LEU 46 HG LEU 46 4.232 -14.987 -20.109 300 HD11 LEU 46 1HD1 LEU 46 3.299 -16.011 -18.358 301 HD12 LEU 46 2HD1 LEU 46 2.756 -14.494 -17.641 302 HD13 LEU 46 3HD1 LEU 46 4.408 -15.051 -17.378 303 HD21 LEU 46 3HD2 LEU 46 2.817 -12.522 -19.102 304 HD22 LEU 46 1HD2 LEU 46 2.025 -13.870 -19.918 305 HD23 LEU 46 2HD2 LEU 46 3.228 -12.906 -20.774 306 HA PRO 47 HA PRO 47 9.659 -13.054 -21.697 307 HB2 PRO 47 2HB PRO 47 8.478 -12.370 -24.044 308 HB3 PRO 47 3HB PRO 47 8.928 -14.032 -23.643 309 HG2 PRO 47 2HG PRO 47 6.254 -12.698 -23.463 310 HG3 PRO 47 3HG PRO 47 6.659 -14.316 -24.064 311 HD2 PRO 47 2HD PRO 47 5.649 -13.891 -21.588 312 HD3 PRO 47 3HD PRO 47 6.784 -15.209 -21.942 313 HA PRO 48 HA PRO 48 8.663 -8.821 -20.478 314 HB2 PRO 48 2HB PRO 48 11.253 -8.028 -20.293 315 HB3 PRO 48 3HB PRO 48 10.435 -8.943 -19.021 316 HG2 PRO 48 2HG PRO 48 12.293 -9.916 -21.156 317 HG3 PRO 48 3HG PRO 48 12.237 -10.352 -19.438 318 HD2 PRO 48 2HD PRO 48 11.185 -11.924 -21.376 319 HD3 PRO 48 3HD PRO 48 10.496 -11.832 -19.742 320 H ASP 49 H ASP 49 11.087 -9.739 -22.908 321 HA ASP 49 HA ASP 49 11.011 -7.213 -24.245 322 HB2 ASP 49 2HB ASP 49 12.225 -9.890 -24.847 323 HB3 ASP 49 3HB ASP 49 12.171 -8.647 -26.094 324 H THR 50 H THR 50 8.960 -9.899 -24.208 325 HA THR 50 HA THR 50 7.778 -9.133 -26.797 326 HB THR 50 HB THR 50 7.072 -11.713 -25.463 327 HG1 THR 50 HG1 THR 50 9.493 -11.142 -26.838 328 HG21 THR 50 3HG2 THR 50 5.983 -10.813 -27.571 329 HG22 THR 50 1HG2 THR 50 6.638 -12.447 -27.674 330 HG23 THR 50 2HG2 THR 50 7.527 -11.095 -28.376 331 H THR 51 H THR 51 7.379 -8.067 -23.968 332 HA THR 51 HA THR 51 4.454 -8.106 -24.076 333 HB THR 51 HB THR 51 5.251 -9.788 -22.362 334 HG1 THR 51 HG1 THR 51 3.659 -9.131 -20.915 335 HG21 THR 51 3HG2 THR 51 7.119 -8.088 -21.638 336 HG22 THR 51 1HG2 THR 51 6.376 -9.161 -20.452 337 HG23 THR 51 2HG2 THR 51 5.856 -7.480 -20.569 338 H ARG 52 H ARG 52 3.465 -6.234 -23.346 339 HA ARG 52 HA ARG 52 5.289 -4.026 -22.650 340 HB2 ARG 52 2HB ARG 52 3.770 -4.202 -24.919 341 HB3 ARG 52 3HB ARG 52 2.709 -3.293 -23.851 342 HG2 ARG 52 2HG ARG 52 4.806 -1.832 -23.423 343 HG3 ARG 52 3HG ARG 52 5.397 -2.556 -24.919 344 HD2 ARG 52 2HD ARG 52 2.756 -1.131 -24.631 345 HD3 ARG 52 3HD ARG 52 4.231 -0.385 -25.244 346 HE ARG 52 HE ARG 52 3.441 -2.779 -26.641 347 HH11 ARG 52 1HH1 ARG 52 3.132 0.683 -26.446 348 HH12 ARG 52 2HH1 ARG 52 2.672 0.867 -28.107 349 HH21 ARG 52 1HH2 ARG 52 2.837 -2.551 -28.829 350 HH22 ARG 52 2HH2 ARG 52 2.504 -0.974 -29.461 351 H LEU 53 H LEU 53 4.195 -2.221 -21.467 352 HA LEU 53 HA LEU 53 1.974 -3.137 -19.783 353 HB2 LEU 53 2HB LEU 53 3.731 -3.590 -18.343 354 HB3 LEU 53 3HB LEU 53 4.676 -2.212 -18.904 355 HG LEU 53 HG LEU 53 3.250 -0.690 -17.673 356 HD11 LEU 53 1HD1 LEU 53 1.432 -2.877 -17.724 357 HD12 LEU 53 2HD1 LEU 53 1.161 -1.225 -17.171 358 HD13 LEU 53 3HD1 LEU 53 1.749 -2.446 -16.043 359 HD21 LEU 53 3HD2 LEU 53 3.672 -1.615 -15.340 360 HD22 LEU 53 1HD2 LEU 53 5.072 -1.446 -16.399 361 HD23 LEU 53 2HD2 LEU 53 4.347 -3.033 -16.145 362 H THR 54 H THR 54 0.442 -1.643 -19.501 363 HA THR 54 HA THR 54 1.113 1.172 -20.054 364 HB THR 54 HB THR 54 -1.143 1.447 -21.053 365 HG1 THR 54 HG1 THR 54 -2.489 -0.148 -20.734 366 HG21 THR 54 3HG2 THR 54 0.389 1.285 -22.747 367 HG22 THR 54 1HG2 THR 54 -0.585 -0.141 -23.101 368 HG23 THR 54 2HG2 THR 54 0.945 -0.309 -22.240 369 H TYR 55 H TYR 55 0.364 2.641 -18.631 370 HA TYR 55 HA TYR 55 -1.498 1.696 -16.551 371 HB2 TYR 55 2HB TYR 55 0.649 1.913 -15.522 372 HB3 TYR 55 3HB TYR 55 0.927 3.474 -16.284 373 HD1 TYR 55 HD1 TYR 55 -2.118 2.268 -14.517 374 HD2 TYR 55 HD2 TYR 55 1.199 4.933 -14.479 375 HE1 TYR 55 HE1 TYR 55 -3.052 3.394 -12.540 376 HE2 TYR 55 HE2 TYR 55 0.274 6.065 -12.501 377 HH TYR 55 HH TYR 55 -2.877 5.155 -11.169 378 H LYS 56 H LYS 56 -3.303 2.839 -16.318 379 HA LYS 56 HA LYS 56 -4.902 4.426 -16.643 380 HB2 LYS 56 2HB LYS 56 -3.127 5.623 -15.192 381 HB3 LYS 56 3HB LYS 56 -2.708 6.483 -16.667 382 HG2 LYS 56 2HG LYS 56 -4.225 7.956 -15.913 383 HG3 LYS 56 3HG LYS 56 -5.372 6.844 -16.662 384 HD2 LYS 56 2HD LYS 56 -4.600 6.152 -13.914 385 HD3 LYS 56 3HD LYS 56 -5.481 7.673 -14.073 386 HE2 LYS 56 2HE LYS 56 -7.083 6.270 -15.571 387 HE3 LYS 56 3HE LYS 56 -6.353 4.893 -14.747 388 HZ1 LYS 56 3HZ LYS 56 -7.602 7.186 -13.337 389 HZ2 LYS 56 1HZ LYS 56 -7.075 5.730 -12.655 390 HZ3 LYS 56 2HZ LYS 56 -8.412 5.743 -13.690 391 H GLY 57 H GLY 57 -3.738 3.228 -18.993 392 HA2 GLY 57 2HA GLY 57 -4.045 3.451 -21.266 393 HA3 GLY 57 3HA GLY 57 -4.814 5.000 -20.956 394 H ARG 58 H ARG 58 -1.721 4.700 -19.581 395 HA ARG 58 HA ARG 58 -0.522 6.133 -21.860 396 HB2 ARG 58 2HB ARG 58 -0.987 7.109 -19.250 397 HB3 ARG 58 3HB ARG 58 0.746 6.838 -19.380 398 HG2 ARG 58 2HG ARG 58 -0.510 8.218 -21.659 399 HG3 ARG 58 3HG ARG 58 -0.478 9.105 -20.133 400 HD2 ARG 58 2HD ARG 58 1.807 9.231 -20.096 401 HD3 ARG 58 3HD ARG 58 2.011 7.742 -21.019 402 HE ARG 58 HE ARG 58 0.920 9.416 -22.827 403 HH11 ARG 58 1HH1 ARG 58 3.626 9.716 -20.657 404 HH12 ARG 58 2HH1 ARG 58 4.508 10.785 -21.697 405 HH21 ARG 58 1HH2 ARG 58 2.072 10.823 -24.205 406 HH22 ARG 58 2HH2 ARG 58 3.623 11.415 -23.714 407 H ALA 59 H ALA 59 1.758 5.883 -22.131 408 HA ALA 59 HA ALA 59 2.732 3.317 -21.082 409 HB1 ALA 59 1HB ALA 59 2.846 4.591 -23.670 410 HB2 ALA 59 2HB ALA 59 4.454 4.131 -23.109 411 HB3 ALA 59 3HB ALA 59 3.179 2.918 -23.222 412 H LEU 60 H LEU 60 4.424 3.238 -19.744 413 HA LEU 60 HA LEU 60 6.077 5.658 -19.445 414 HB2 LEU 60 2HB LEU 60 5.191 3.737 -17.298 415 HB3 LEU 60 3HB LEU 60 6.318 5.071 -17.063 416 HG LEU 60 HG LEU 60 4.041 6.254 -18.146 417 HD11 LEU 60 1HD1 LEU 60 2.705 4.305 -17.765 418 HD12 LEU 60 2HD1 LEU 60 2.278 5.515 -16.555 419 HD13 LEU 60 3HD1 LEU 60 3.309 4.153 -16.115 420 HD21 LEU 60 3HD2 LEU 60 5.265 7.415 -16.545 421 HD22 LEU 60 1HD2 LEU 60 5.237 6.070 -15.405 422 HD23 LEU 60 2HD2 LEU 60 3.772 7.008 -15.697 423 H LYS 61 H LYS 61 8.276 5.329 -18.831 424 HA LYS 61 HA LYS 61 9.419 2.729 -18.637 425 HB2 LYS 61 2HB LYS 61 10.844 3.430 -20.853 426 HB3 LYS 61 3HB LYS 61 9.505 2.289 -20.845 427 HG2 LYS 61 2HG LYS 61 7.978 3.955 -21.589 428 HG3 LYS 61 3HG LYS 61 9.173 5.234 -21.360 429 HD2 LYS 61 2HD LYS 61 9.225 4.854 -23.657 430 HD3 LYS 61 3HD LYS 61 10.590 3.909 -23.060 431 HE2 LYS 61 2HE LYS 61 9.602 1.926 -23.543 432 HE3 LYS 61 3HE LYS 61 7.982 2.524 -23.188 433 HZ1 LYS 61 3HZ LYS 61 9.529 3.220 -25.625 434 HZ2 LYS 61 1HZ LYS 61 7.923 3.636 -25.293 435 HZ3 LYS 61 2HZ LYS 61 8.340 2.018 -25.557 436 H ASP 62 H ASP 62 10.692 5.632 -20.236 437 HA ASP 62 HA ASP 62 12.977 5.676 -18.508 438 HB2 ASP 62 2HB ASP 62 12.356 6.700 -21.034 439 HB3 ASP 62 3HB ASP 62 12.586 8.120 -20.018 440 H THR 63 H THR 63 9.855 6.703 -18.102 441 HA THR 63 HA THR 63 10.087 9.224 -16.918 442 HB THR 63 HB THR 63 8.103 7.516 -15.618 443 HG1 THR 63 HG1 THR 63 8.114 7.738 -18.462 444 HG21 THR 63 3HG2 THR 63 6.721 9.349 -17.031 445 HG22 THR 63 1HG2 THR 63 8.292 10.143 -16.954 446 HG23 THR 63 2HG2 THR 63 7.463 9.684 -15.467 447 H GLU 64 H GLU 64 11.113 6.155 -15.806 448 HA GLU 64 HA GLU 64 12.137 5.456 -13.899 449 HB2 GLU 64 2HB GLU 64 13.601 7.346 -14.162 450 HB3 GLU 64 3HB GLU 64 12.397 8.436 -13.489 451 HG2 GLU 64 2HG GLU 64 12.688 7.597 -11.319 452 HG3 GLU 64 3HG GLU 64 13.553 6.174 -11.897 453 H THR 65 H THR 65 10.822 8.369 -12.411 454 HA THR 65 HA THR 65 9.222 6.657 -10.638 455 HB THR 65 HB THR 65 10.751 8.017 -9.396 456 HG1 THR 65 HG1 THR 65 9.106 9.492 -8.351 457 HG21 THR 65 3HG2 THR 65 11.432 9.778 -10.719 458 HG22 THR 65 1HG2 THR 65 10.356 10.604 -9.593 459 HG23 THR 65 2HG2 THR 65 9.788 10.186 -11.210 460 H LEU 66 H LEU 66 7.069 7.210 -10.125 461 HA LEU 66 HA LEU 66 5.746 8.816 -12.204 462 HB2 LEU 66 2HB LEU 66 4.778 6.530 -10.508 463 HB3 LEU 66 3HB LEU 66 3.690 7.540 -11.457 464 HG LEU 66 HG LEU 66 5.159 6.843 -13.464 465 HD11 LEU 66 1HD1 LEU 66 5.908 4.750 -11.432 466 HD12 LEU 66 2HD1 LEU 66 6.990 5.841 -12.297 467 HD13 LEU 66 3HD1 LEU 66 6.133 4.572 -13.172 468 HD21 LEU 66 3HD2 LEU 66 3.103 5.962 -13.720 469 HD22 LEU 66 1HD2 LEU 66 3.019 5.403 -12.050 470 HD23 LEU 66 2HD2 LEU 66 3.900 4.460 -13.251 471 H GLU 67 H GLU 67 6.756 9.063 -9.095 472 HA GLU 67 HA GLU 67 4.584 10.092 -7.679 473 HB2 GLU 67 2HB GLU 67 6.604 9.568 -6.510 474 HB3 GLU 67 3HB GLU 67 7.535 10.690 -7.492 475 HG2 GLU 67 2HG GLU 67 6.934 12.474 -6.268 476 HG3 GLU 67 3HG GLU 67 5.296 11.879 -6.007 477 H SER 68 H SER 68 6.719 11.597 -10.019 478 HA SER 68 HA SER 68 5.867 14.271 -9.533 479 HB2 SER 68 2HB SER 68 7.820 14.442 -10.668 480 HB3 SER 68 3HB SER 68 7.605 12.882 -11.462 481 HG SER 68 HG SER 68 7.480 14.987 -12.733 482 H LEU 69 H LEU 69 4.521 11.620 -11.228 483 HA LEU 69 HA LEU 69 2.740 13.350 -12.783 484 HB2 LEU 69 2HB LEU 69 2.653 10.373 -12.911 485 HB3 LEU 69 3HB LEU 69 2.309 11.560 -14.167 486 HG LEU 69 HG LEU 69 5.019 10.681 -13.180 487 HD11 LEU 69 1HD1 LEU 69 5.301 9.680 -15.270 488 HD12 LEU 69 2HD1 LEU 69 3.934 10.544 -15.973 489 HD13 LEU 69 3HD1 LEU 69 3.655 9.252 -14.805 490 HD21 LEU 69 3HD2 LEU 69 5.794 12.666 -13.807 491 HD22 LEU 69 1HD2 LEU 69 4.204 13.164 -14.388 492 HD23 LEU 69 2HD2 LEU 69 5.295 12.280 -15.455 493 H GLY 70 H GLY 70 2.842 11.605 -9.883 494 HA2 GLY 70 2HA GLY 70 1.060 11.917 -8.290 495 HA3 GLY 70 3HA GLY 70 -0.081 11.875 -9.626 496 H VAL 71 H VAL 71 1.847 9.993 -7.432 497 HA VAL 71 HA VAL 71 0.935 7.476 -8.583 498 HB VAL 71 HB VAL 71 2.710 8.000 -6.195 499 HG11 VAL 71 1HG1 VAL 71 3.244 5.613 -6.316 500 HG12 VAL 71 2HG1 VAL 71 1.531 5.878 -5.988 501 HG13 VAL 71 3HG1 VAL 71 2.059 5.415 -7.606 502 HG21 VAL 71 3HG2 VAL 71 3.909 6.679 -8.478 503 HG22 VAL 71 1HG2 VAL 71 3.279 8.273 -8.894 504 HG23 VAL 71 2HG2 VAL 71 4.450 8.101 -7.586 505 H ALA 72 H ALA 72 -0.481 6.077 -7.617 506 HA ALA 72 HA ALA 72 -1.660 6.845 -5.046 507 HB1 ALA 72 1HB ALA 72 -3.876 6.005 -6.368 508 HB2 ALA 72 2HB ALA 72 -3.416 7.695 -6.157 509 HB3 ALA 72 3HB ALA 72 -3.010 6.851 -7.651 510 H ASP 73 H ASP 73 -2.533 5.144 -3.852 511 HA ASP 73 HA ASP 73 -1.453 2.547 -4.501 512 HB2 ASP 73 2HB ASP 73 -3.071 3.518 -2.138 513 HB3 ASP 73 3HB ASP 73 -2.401 1.896 -2.284 514 H GLY 74 H GLY 74 -2.519 0.821 -5.278 515 HA2 GLY 74 2HA GLY 74 -4.420 -0.562 -5.587 516 HA3 GLY 74 3HA GLY 74 -5.450 0.823 -5.258 517 H ASP 75 H ASP 75 -2.818 1.319 -7.409 518 HA ASP 75 HA ASP 75 -4.547 2.041 -9.545 519 HB2 ASP 75 2HB ASP 75 -1.553 1.639 -9.434 520 HB3 ASP 75 3HB ASP 75 -2.406 2.255 -10.847 521 H LYS 76 H LYS 76 -4.833 1.059 -11.564 522 HA LYS 76 HA LYS 76 -4.354 -1.844 -11.559 523 HB2 LYS 76 2HB LYS 76 -6.736 -0.737 -11.714 524 HB3 LYS 76 3HB LYS 76 -6.304 -0.522 -13.405 525 HG2 LYS 76 2HG LYS 76 -5.672 -3.112 -13.107 526 HG3 LYS 76 3HG LYS 76 -6.964 -2.975 -11.911 527 HD2 LYS 76 2HD LYS 76 -7.837 -1.604 -14.216 528 HD3 LYS 76 3HD LYS 76 -7.152 -3.136 -14.764 529 HE2 LYS 76 2HE LYS 76 -8.552 -4.243 -12.966 530 HE3 LYS 76 3HE LYS 76 -9.373 -2.694 -12.782 531 HZ1 LYS 76 3HZ LYS 76 -9.752 -2.875 -15.290 532 HZ2 LYS 76 1HZ LYS 76 -10.690 -3.853 -14.277 533 HZ3 LYS 76 2HZ LYS 76 -9.372 -4.514 -15.105 534 H PHE 77 H PHE 77 -3.061 -2.717 -13.047 535 HA PHE 77 HA PHE 77 -2.223 -1.026 -15.310 536 HB2 PHE 77 2HB PHE 77 -0.654 -3.152 -13.837 537 HB3 PHE 77 3HB PHE 77 -0.089 -2.298 -15.269 538 HD1 PHE 77 HD2 PHE 77 -1.213 -1.757 -11.774 539 HD2 PHE 77 HD1 PHE 77 1.036 -0.275 -15.069 540 HE1 PHE 77 HE2 PHE 77 -0.301 0.026 -10.345 541 HE2 PHE 77 HE1 PHE 77 1.953 1.509 -13.645 542 HZ PHE 77 HZ PHE 77 1.284 1.662 -11.280 543 H VAL 78 H VAL 78 -1.917 -2.005 -17.337 544 HA VAL 78 HA VAL 78 -3.221 -4.634 -17.627 545 HB VAL 78 HB VAL 78 -3.188 -2.429 -19.689 546 HG11 VAL 78 1HG1 VAL 78 -4.470 -5.138 -19.541 547 HG12 VAL 78 2HG1 VAL 78 -5.101 -3.872 -20.596 548 HG13 VAL 78 3HG1 VAL 78 -3.453 -4.462 -20.813 549 HG21 VAL 78 3HG2 VAL 78 -4.533 -1.586 -17.953 550 HG22 VAL 78 1HG2 VAL 78 -5.664 -2.303 -19.101 551 HG23 VAL 78 2HG2 VAL 78 -5.242 -3.166 -17.622 552 H LEU 79 H LEU 79 -1.995 -6.201 -18.432 553 HA LEU 79 HA LEU 79 0.509 -5.466 -19.785 554 HB2 LEU 79 2HB LEU 79 0.198 -7.044 -17.636 555 HB3 LEU 79 3HB LEU 79 0.044 -8.251 -18.911 556 HG LEU 79 HG LEU 79 2.258 -7.619 -19.762 557 HD11 LEU 79 1HD1 LEU 79 3.126 -6.143 -17.433 558 HD12 LEU 79 2HD1 LEU 79 1.856 -5.291 -18.310 559 HD13 LEU 79 3HD1 LEU 79 3.332 -5.775 -19.146 560 HD21 LEU 79 3HD2 LEU 79 1.735 -9.249 -17.731 561 HD22 LEU 79 1HD2 LEU 79 2.738 -8.080 -16.872 562 HD23 LEU 79 2HD2 LEU 79 3.381 -8.927 -18.279 563 H ILE 80 H ILE 80 0.866 -6.027 -21.846 564 HA ILE 80 HA ILE 80 -1.144 -7.737 -23.159 565 HB ILE 80 HB ILE 80 -1.121 -5.366 -23.920 566 HG12 ILE 80 2HG1 ILE 80 -1.059 -5.895 -26.336 567 HG13 ILE 80 3HG1 ILE 80 -0.257 -7.419 -25.970 568 HG21 ILE 80 1HG2 ILE 80 1.550 -5.983 -25.153 569 HG22 ILE 80 2HG2 ILE 80 0.709 -4.435 -25.084 570 HG23 ILE 80 3HG2 ILE 80 1.381 -5.139 -23.614 571 HD11 ILE 80 3HD1 ILE 80 -2.161 -8.359 -25.089 572 HD12 ILE 80 1HD1 ILE 80 -2.895 -6.797 -24.729 573 HD13 ILE 80 2HD1 ILE 80 -2.809 -7.369 -26.396 574 H THR 81 H THR 81 -0.466 -9.277 -24.650 575 HA THR 81 HA THR 81 2.429 -9.833 -24.672 576 HB THR 81 HB THR 81 1.127 -11.447 -23.272 577 HG1 THR 81 HG1 THR 81 2.318 -13.127 -24.022 578 HG21 THR 81 3HG2 THR 81 -0.080 -12.234 -25.927 579 HG22 THR 81 1HG2 THR 81 -0.938 -11.469 -24.591 580 HG23 THR 81 2HG2 THR 81 -0.286 -13.097 -24.404 581 H ARG 82 H ARG 82 3.358 -10.348 -26.594 582 HA ARG 82 HA ARG 82 1.640 -10.134 -28.964 583 HB2 ARG 82 2HB ARG 82 4.632 -9.814 -28.668 584 HB3 ARG 82 3HB ARG 82 3.750 -9.663 -30.182 585 HG2 ARG 82 2HG ARG 82 2.385 -7.876 -28.792 586 HG3 ARG 82 3HG ARG 82 3.889 -7.811 -27.871 587 HD2 ARG 82 2HD ARG 82 4.966 -6.727 -29.505 588 HD3 ARG 82 3HD ARG 82 4.313 -7.788 -30.752 589 HE ARG 82 HE ARG 82 2.216 -6.188 -30.055 590 HH11 ARG 82 1HH1 ARG 82 5.470 -5.636 -31.165 591 HH12 ARG 82 2HH1 ARG 82 5.082 -4.152 -31.970 592 HH21 ARG 82 1HH2 ARG 82 1.694 -4.235 -31.111 593 HH22 ARG 82 2HH2 ARG 82 2.934 -3.355 -31.938 594 H THR 83 H THR 83 1.649 -11.666 -30.575 595 HA THR 83 HA THR 83 2.936 -14.222 -29.881 596 HB THR 83 HB THR 83 0.499 -13.752 -31.611 597 HG1 THR 83 HG1 THR 83 -0.625 -14.620 -29.848 598 HG21 THR 83 3HG2 THR 83 2.138 -16.152 -30.979 599 HG22 THR 83 1HG2 THR 83 1.281 -15.728 -32.460 600 HG23 THR 83 2HG2 THR 83 0.388 -16.349 -31.072 601 H VAL 84 H VAL 84 4.598 -14.806 -31.099 602 HA VAL 84 HA VAL 84 4.956 -13.566 -33.727 603 HB VAL 84 HB VAL 84 6.898 -15.194 -32.080 604 HG11 VAL 84 1HG1 VAL 84 7.367 -15.387 -34.452 605 HG12 VAL 84 2HG1 VAL 84 7.304 -13.633 -34.630 606 HG13 VAL 84 3HG1 VAL 84 8.585 -14.378 -33.673 607 HG21 VAL 84 3HG2 VAL 84 7.911 -12.662 -32.273 608 HG22 VAL 84 1HG2 VAL 84 6.181 -12.359 -32.109 609 HG23 VAL 84 2HG2 VAL 84 7.031 -13.301 -30.885 610 H GLY 85 H GLY 85 4.589 -16.702 -32.178 611 HA2 GLY 85 2HA GLY 85 3.405 -17.993 -34.296 612 HA3 GLY 85 3HA GLY 85 5.129 -18.233 -34.533 Start of MODEL 7 1 H1 MET 9 H MET 9 0.067 -0.156 -0.634 2 HA MET 9 HA MET 9 1.780 0.880 -2.512 3 HB2 MET 9 2HB MET 9 3.942 -0.261 -1.905 4 HB3 MET 9 3HB MET 9 3.521 1.121 -0.903 5 HG2 MET 9 2HG MET 9 2.899 -0.251 0.906 6 HG3 MET 9 3HG MET 9 2.895 -1.699 -0.098 7 HE1 MET 9 3HE MET 9 4.969 1.305 0.675 8 HE2 MET 9 1HE MET 9 5.494 0.586 2.198 9 HE3 MET 9 2HE MET 9 6.628 0.731 0.854 10 H LYS 10 H LYS 10 -0.310 -0.655 -2.853 11 HA LYS 10 HA LYS 10 0.806 -3.242 -3.700 12 HB2 LYS 10 2HB LYS 10 -1.617 -2.683 -2.078 13 HB3 LYS 10 3HB LYS 10 -1.760 -3.930 -3.310 14 HG2 LYS 10 2HG LYS 10 0.654 -4.200 -1.713 15 HG3 LYS 10 3HG LYS 10 -0.824 -4.276 -0.751 16 HD2 LYS 10 2HD LYS 10 -1.003 -5.811 -3.219 17 HD3 LYS 10 3HD LYS 10 0.307 -6.357 -2.170 18 HE2 LYS 10 2HE LYS 10 -1.517 -6.205 -0.306 19 HE3 LYS 10 3HE LYS 10 -2.637 -6.298 -1.664 20 HZ1 LYS 10 3HZ LYS 10 -1.706 -8.382 -2.312 21 HZ2 LYS 10 1HZ LYS 10 -2.081 -8.476 -0.665 22 HZ3 LYS 10 2HZ LYS 10 -0.476 -8.268 -1.156 23 H ILE 11 H ILE 11 0.366 -3.832 -5.750 24 HA ILE 11 HA ILE 11 -1.665 -2.296 -7.226 25 HB ILE 11 HB ILE 11 0.991 -3.114 -8.397 26 HG12 ILE 11 2HG1 ILE 11 0.119 -0.385 -7.422 27 HG13 ILE 11 3HG1 ILE 11 1.303 -1.418 -6.630 28 HG21 ILE 11 1HG2 ILE 11 -0.724 -2.912 -10.056 29 HG22 ILE 11 2HG2 ILE 11 -1.252 -1.367 -9.392 30 HG23 ILE 11 3HG2 ILE 11 0.324 -1.499 -10.172 31 HD11 ILE 11 3HD1 ILE 11 1.602 0.375 -8.896 32 HD12 ILE 11 1HD1 ILE 11 2.814 -0.278 -7.794 33 HD13 ILE 11 2HD1 ILE 11 2.280 -1.228 -9.181 34 H LYS 12 H LYS 12 -2.660 -3.375 -8.971 35 HA LYS 12 HA LYS 12 -2.313 -6.302 -8.933 36 HB2 LYS 12 2HB LYS 12 -4.570 -4.912 -8.234 37 HB3 LYS 12 3HB LYS 12 -4.881 -5.279 -9.925 38 HG2 LYS 12 2HG LYS 12 -4.318 -7.683 -9.364 39 HG3 LYS 12 3HG LYS 12 -4.395 -7.198 -7.668 40 HD2 LYS 12 2HD LYS 12 -6.625 -6.858 -9.673 41 HD3 LYS 12 3HD LYS 12 -6.517 -8.163 -8.489 42 HE2 LYS 12 2HE LYS 12 -6.515 -6.469 -6.687 43 HE3 LYS 12 3HE LYS 12 -6.728 -5.211 -7.903 44 HZ1 LYS 12 3HZ LYS 12 -8.671 -7.246 -8.228 45 HZ2 LYS 12 1HZ LYS 12 -8.895 -5.594 -7.941 46 HZ3 LYS 12 2HZ LYS 12 -8.708 -6.660 -6.641 47 H ILE 13 H ILE 13 -1.493 -7.090 -10.746 48 HA ILE 13 HA ILE 13 -1.842 -5.571 -13.239 49 HB ILE 13 HB ILE 13 0.479 -5.906 -12.676 50 HG12 ILE 13 2HG1 ILE 13 0.308 -7.978 -14.757 51 HG13 ILE 13 3HG1 ILE 13 -0.656 -6.542 -15.086 52 HG21 ILE 13 1HG2 ILE 13 0.775 -8.723 -12.965 53 HG22 ILE 13 2HG2 ILE 13 1.186 -7.703 -11.587 54 HG23 ILE 13 3HG2 ILE 13 -0.427 -8.404 -11.714 55 HD11 ILE 13 3HD1 ILE 13 2.025 -6.881 -15.617 56 HD12 ILE 13 1HD1 ILE 13 1.141 -5.355 -15.612 57 HD13 ILE 13 2HD1 ILE 13 2.006 -5.878 -14.167 58 H VAL 14 H VAL 14 -3.300 -6.312 -14.619 59 HA VAL 14 HA VAL 14 -4.009 -9.166 -14.543 60 HB VAL 14 HB VAL 14 -5.605 -6.928 -15.791 61 HG11 VAL 14 1HG1 VAL 14 -7.450 -8.608 -15.592 62 HG12 VAL 14 2HG1 VAL 14 -6.177 -9.044 -16.734 63 HG13 VAL 14 3HG1 VAL 14 -6.233 -9.802 -15.141 64 HG21 VAL 14 3HG2 VAL 14 -6.944 -7.844 -13.526 65 HG22 VAL 14 1HG2 VAL 14 -5.268 -7.644 -13.015 66 HG23 VAL 14 2HG2 VAL 14 -6.140 -6.287 -13.726 67 HA PRO 15 HA PRO 15 -1.773 -9.293 -18.438 68 HB2 PRO 15 2HB PRO 15 -1.889 -11.995 -18.681 69 HB3 PRO 15 3HB PRO 15 -0.730 -11.174 -17.628 70 HG2 PRO 15 2HG PRO 15 -3.333 -12.476 -16.928 71 HG3 PRO 15 3HG PRO 15 -1.779 -12.554 -16.078 72 HD2 PRO 15 2HD PRO 15 -3.798 -10.938 -15.276 73 HD3 PRO 15 3HD PRO 15 -2.089 -10.509 -15.062 74 H ALA 16 H ALA 16 -2.498 -9.252 -20.492 75 HA ALA 16 HA ALA 16 -5.311 -9.858 -20.957 76 HB1 ALA 16 1HB ALA 16 -3.244 -8.252 -22.392 77 HB2 ALA 16 2HB ALA 16 -4.677 -8.808 -23.259 78 HB3 ALA 16 3HB ALA 16 -4.851 -7.780 -21.836 79 H VAL 17 H VAL 17 -4.176 -12.201 -20.585 80 HA VAL 17 HA VAL 17 -3.701 -13.288 -23.285 81 HB VAL 17 HB VAL 17 -2.395 -15.067 -22.314 82 HG11 VAL 17 1HG1 VAL 17 -1.577 -12.486 -22.519 83 HG12 VAL 17 2HG1 VAL 17 -1.146 -12.852 -20.848 84 HG13 VAL 17 3HG1 VAL 17 -0.515 -13.847 -22.161 85 HG21 VAL 17 3HG2 VAL 17 -3.572 -14.069 -19.816 86 HG22 VAL 17 1HG2 VAL 17 -3.047 -15.694 -20.256 87 HG23 VAL 17 2HG2 VAL 17 -1.866 -14.504 -19.710 88 H GLY 18 H GLY 18 -4.039 -15.921 -22.913 89 HA2 GLY 18 2HA GLY 18 -6.758 -16.343 -23.061 90 HA3 GLY 18 3HA GLY 18 -5.593 -17.596 -22.660 91 H GLY 19 H GLY 19 -4.690 -16.936 -20.215 92 HA2 GLY 19 2HA GLY 19 -7.136 -17.157 -18.592 93 HA3 GLY 19 3HA GLY 19 -5.552 -17.765 -18.134 94 H GLY 20 H GLY 20 -6.803 -14.596 -19.205 95 HA2 GLY 20 2HA GLY 20 -5.055 -13.004 -17.787 96 HA3 GLY 20 3HA GLY 20 -6.695 -12.529 -18.206 97 H SER 21 H SER 21 -4.559 -13.389 -15.700 98 HA SER 21 HA SER 21 -6.775 -13.244 -13.766 99 HB2 SER 21 2HB SER 21 -4.496 -15.177 -13.909 100 HB3 SER 21 3HB SER 21 -5.107 -14.700 -12.325 101 HG SER 21 HG SER 21 -6.529 -16.206 -12.699 102 HA PRO 22 HA PRO 22 -4.441 -9.782 -12.272 103 HB2 PRO 22 2HB PRO 22 -5.946 -9.321 -10.060 104 HB3 PRO 22 3HB PRO 22 -6.470 -8.876 -11.689 105 HG2 PRO 22 2HG PRO 22 -7.213 -11.266 -10.047 106 HG3 PRO 22 3HG PRO 22 -8.248 -10.229 -11.046 107 HD2 PRO 22 2HD PRO 22 -7.353 -12.641 -11.890 108 HD3 PRO 22 3HD PRO 22 -7.632 -11.285 -13.000 109 H LEU 23 H LEU 23 -2.625 -9.744 -11.109 110 HA LEU 23 HA LEU 23 -2.395 -11.566 -8.804 111 HB2 LEU 23 2HB LEU 23 -1.023 -12.015 -10.959 112 HB3 LEU 23 3HB LEU 23 -0.035 -10.664 -10.407 113 HG LEU 23 HG LEU 23 0.092 -12.072 -8.193 114 HD11 LEU 23 1HD1 LEU 23 -0.084 -14.398 -8.432 115 HD12 LEU 23 2HD1 LEU 23 -0.212 -14.295 -10.187 116 HD13 LEU 23 3HD1 LEU 23 -1.549 -13.752 -9.173 117 HD21 LEU 23 3HD2 LEU 23 2.188 -12.861 -8.874 118 HD22 LEU 23 1HD2 LEU 23 1.905 -11.439 -9.879 119 HD23 LEU 23 2HD2 LEU 23 1.671 -13.053 -10.550 120 H GLU 24 H GLU 24 -1.655 -10.743 -6.919 121 HA GLU 24 HA GLU 24 -1.328 -7.854 -6.779 122 HB2 GLU 24 2HB GLU 24 -1.918 -10.025 -4.825 123 HB3 GLU 24 3HB GLU 24 -1.145 -8.566 -4.222 124 HG2 GLU 24 2HG GLU 24 -3.063 -7.468 -4.239 125 HG3 GLU 24 3HG GLU 24 -3.341 -7.878 -5.931 126 H LEU 25 H LEU 25 0.562 -6.850 -6.536 127 HA LEU 25 HA LEU 25 2.854 -8.304 -5.455 128 HB2 LEU 25 2HB LEU 25 2.499 -7.582 -8.228 129 HB3 LEU 25 3HB LEU 25 3.919 -6.793 -7.544 130 HG LEU 25 HG LEU 25 3.561 -9.731 -7.155 131 HD11 LEU 25 1HD1 LEU 25 3.808 -8.409 -9.724 132 HD12 LEU 25 2HD1 LEU 25 3.501 -10.104 -9.347 133 HD13 LEU 25 3HD1 LEU 25 5.157 -9.498 -9.397 134 HD21 LEU 25 3HD2 LEU 25 6.167 -8.638 -7.864 135 HD22 LEU 25 1HD2 LEU 25 5.693 -9.650 -6.500 136 HD23 LEU 25 2HD2 LEU 25 5.474 -7.902 -6.418 137 H GLU 26 H GLU 26 4.642 -6.885 -4.854 138 HA GLU 26 HA GLU 26 3.656 -4.220 -4.101 139 HB2 GLU 26 2HB GLU 26 4.328 -5.794 -2.274 140 HB3 GLU 26 3HB GLU 26 5.968 -5.757 -2.908 141 HG2 GLU 26 2HG GLU 26 5.929 -3.267 -2.566 142 HG3 GLU 26 3HG GLU 26 4.413 -3.492 -1.695 143 H VAL 27 H VAL 27 4.295 -2.718 -5.505 144 HA VAL 27 HA VAL 27 7.145 -2.557 -6.163 145 HB VAL 27 HB VAL 27 6.490 -1.841 -8.511 146 HG11 VAL 27 1HG1 VAL 27 6.257 -4.656 -7.506 147 HG12 VAL 27 2HG1 VAL 27 6.122 -4.286 -9.226 148 HG13 VAL 27 3HG1 VAL 27 7.600 -3.884 -8.350 149 HG21 VAL 27 3HG2 VAL 27 4.104 -3.496 -8.516 150 HG22 VAL 27 1HG2 VAL 27 3.924 -2.060 -7.508 151 HG23 VAL 27 2HG2 VAL 27 4.370 -1.895 -9.206 152 H ALA 28 H ALA 28 7.669 -0.401 -7.190 153 HA ALA 28 HA ALA 28 5.873 1.721 -6.231 154 HB1 ALA 28 1HB ALA 28 8.217 1.060 -4.960 155 HB2 ALA 28 2HB ALA 28 8.697 2.401 -6.001 156 HB3 ALA 28 3HB ALA 28 7.382 2.610 -4.845 157 HA PRO 29 HA PRO 29 6.563 2.936 -10.483 158 HB2 PRO 29 2HB PRO 29 4.795 4.996 -10.442 159 HB3 PRO 29 3HB PRO 29 4.298 3.307 -10.595 160 HG2 PRO 29 2HG PRO 29 4.333 5.059 -8.168 161 HG3 PRO 29 3HG PRO 29 3.088 3.917 -8.705 162 HD2 PRO 29 2HD PRO 29 4.879 3.314 -6.766 163 HD3 PRO 29 3HD PRO 29 4.226 2.092 -7.876 164 H ASN 30 H ASN 30 7.158 4.666 -7.593 165 HA ASN 30 HA ASN 30 8.189 7.033 -8.911 166 HB2 ASN 30 2HB ASN 30 8.639 7.864 -6.685 167 HB3 ASN 30 3HB ASN 30 7.026 7.158 -6.708 168 HD21 ASN 30 1HD2 ASN 30 6.568 5.474 -5.404 169 HD22 ASN 30 2HD2 ASN 30 7.693 4.767 -4.300 170 H ALA 31 H ALA 31 9.323 4.063 -8.833 171 HA ALA 31 HA ALA 31 12.097 4.791 -8.188 172 HB1 ALA 31 1HB ALA 31 12.450 2.272 -8.347 173 HB2 ALA 31 2HB ALA 31 11.508 2.868 -6.980 174 HB3 ALA 31 3HB ALA 31 10.691 2.143 -8.365 175 H THR 32 H THR 32 10.791 2.374 -10.433 176 HA THR 32 HA THR 32 11.788 3.788 -12.744 177 HB THR 32 HB THR 32 13.039 1.129 -12.029 178 HG1 THR 32 HG1 THR 32 14.271 3.696 -12.130 179 HG21 THR 32 3HG2 THR 32 13.023 1.201 -14.350 180 HG22 THR 32 1HG2 THR 32 14.582 1.927 -13.963 181 HG23 THR 32 2HG2 THR 32 13.215 2.954 -14.399 182 H VAL 33 H VAL 33 10.880 3.080 -14.644 183 HA VAL 33 HA VAL 33 8.512 1.525 -14.452 184 HB VAL 33 HB VAL 33 9.953 2.290 -16.991 185 HG11 VAL 33 1HG1 VAL 33 7.412 1.024 -16.370 186 HG12 VAL 33 2HG1 VAL 33 7.228 2.456 -17.385 187 HG13 VAL 33 3HG1 VAL 33 8.276 1.135 -17.903 188 HG21 VAL 33 3HG2 VAL 33 8.513 4.308 -16.973 189 HG22 VAL 33 1HG2 VAL 33 8.006 3.891 -15.336 190 HG23 VAL 33 2HG2 VAL 33 9.694 4.286 -15.663 191 H GLY 34 H GLY 34 11.689 0.915 -15.933 192 HA2 GLY 34 2HA GLY 34 11.099 -1.642 -16.947 193 HA3 GLY 34 3HA GLY 34 12.708 -1.035 -16.584 194 H ALA 35 H ALA 35 12.139 -0.591 -13.764 195 HA ALA 35 HA ALA 35 12.890 -3.123 -12.766 196 HB1 ALA 35 1HB ALA 35 12.819 -2.115 -10.587 197 HB2 ALA 35 2HB ALA 35 13.494 -0.951 -11.727 198 HB3 ALA 35 3HB ALA 35 11.824 -0.788 -11.186 199 H VAL 36 H VAL 36 9.832 -1.323 -12.599 200 HA VAL 36 HA VAL 36 8.443 -3.272 -11.082 201 HB VAL 36 HB VAL 36 7.321 -1.166 -12.937 202 HG11 VAL 36 1HG1 VAL 36 6.056 -2.934 -10.864 203 HG12 VAL 36 2HG1 VAL 36 5.320 -1.415 -11.379 204 HG13 VAL 36 3HG1 VAL 36 5.591 -2.707 -12.549 205 HG21 VAL 36 3HG2 VAL 36 7.064 -0.643 -10.112 206 HG22 VAL 36 1HG2 VAL 36 8.756 -0.849 -10.567 207 HG23 VAL 36 2HG2 VAL 36 7.765 0.362 -11.380 208 H ARG 37 H ARG 37 8.583 -2.589 -14.564 209 HA ARG 37 HA ARG 37 6.737 -4.527 -15.390 210 HB2 ARG 37 2HB ARG 37 8.908 -2.970 -16.678 211 HB3 ARG 37 3HB ARG 37 8.377 -4.420 -17.520 212 HG2 ARG 37 2HG ARG 37 6.623 -3.339 -18.319 213 HG3 ARG 37 3HG ARG 37 6.079 -2.967 -16.682 214 HD2 ARG 37 2HD ARG 37 6.425 -0.964 -18.125 215 HD3 ARG 37 3HD ARG 37 7.371 -0.957 -16.637 216 HE ARG 37 HE ARG 37 9.272 -0.978 -17.902 217 HH11 ARG 37 1HH1 ARG 37 6.596 -2.003 -19.878 218 HH12 ARG 37 2HH1 ARG 37 7.520 -2.033 -21.343 219 HH21 ARG 37 1HH2 ARG 37 10.500 -1.015 -19.824 220 HH22 ARG 37 2HH2 ARG 37 9.741 -1.472 -21.311 221 H THR 38 H THR 38 10.220 -4.718 -14.833 222 HA THR 38 HA THR 38 10.531 -7.368 -15.805 223 HB THR 38 HB THR 38 12.260 -5.839 -13.849 224 HG1 THR 38 HG1 THR 38 12.104 -5.951 -16.658 225 HG21 THR 38 3HG2 THR 38 13.944 -7.523 -15.091 226 HG22 THR 38 1HG2 THR 38 12.485 -8.512 -15.099 227 HG23 THR 38 2HG2 THR 38 13.137 -7.915 -13.573 228 H LYS 39 H LYS 39 9.898 -5.998 -12.615 229 HA LYS 39 HA LYS 39 10.209 -8.365 -11.124 230 HB2 LYS 39 2HB LYS 39 10.122 -6.103 -10.128 231 HB3 LYS 39 3HB LYS 39 8.416 -5.999 -10.543 232 HG2 LYS 39 2HG LYS 39 8.417 -6.583 -8.294 233 HG3 LYS 39 3HG LYS 39 8.136 -8.113 -9.128 234 HD2 LYS 39 2HD LYS 39 10.952 -7.367 -8.571 235 HD3 LYS 39 3HD LYS 39 9.954 -7.839 -7.193 236 HE2 LYS 39 2HE LYS 39 9.319 -9.778 -8.974 237 HE3 LYS 39 3HE LYS 39 10.991 -9.449 -9.428 238 HZ1 LYS 39 3HZ LYS 39 11.291 -11.004 -7.808 239 HZ2 LYS 39 1HZ LYS 39 9.924 -10.538 -6.926 240 HZ3 LYS 39 2HZ LYS 39 11.334 -9.608 -6.853 241 H VAL 40 H VAL 40 7.360 -6.900 -12.645 242 HA VAL 40 HA VAL 40 5.520 -8.860 -11.740 243 HB VAL 40 HB VAL 40 5.280 -7.091 -14.177 244 HG11 VAL 40 1HG1 VAL 40 2.776 -7.418 -13.150 245 HG12 VAL 40 2HG1 VAL 40 3.449 -8.350 -14.489 246 HG13 VAL 40 3HG1 VAL 40 3.497 -8.998 -12.848 247 HG21 VAL 40 3HG2 VAL 40 5.436 -6.373 -11.443 248 HG22 VAL 40 1HG2 VAL 40 5.064 -5.343 -12.826 249 HG23 VAL 40 2HG2 VAL 40 3.763 -6.155 -11.955 250 H CYS 41 H CYS 41 7.261 -8.425 -14.805 251 HA CYS 41 HA CYS 41 6.170 -10.573 -16.200 252 HB2 CYS 41 2HB CYS 41 7.899 -8.668 -16.876 253 HB3 CYS 41 3HB CYS 41 9.063 -9.951 -16.566 254 HG CYS 41 HG CYS 41 6.534 -10.944 -18.497 255 H ALA 42 H ALA 42 9.017 -10.468 -14.084 256 HA ALA 42 HA ALA 42 9.784 -13.155 -14.426 257 HB1 ALA 42 1HB ALA 42 11.411 -11.757 -13.507 258 HB2 ALA 42 2HB ALA 42 10.310 -11.126 -12.281 259 HB3 ALA 42 3HB ALA 42 10.916 -12.778 -12.156 260 H MET 43 H MET 43 7.644 -11.590 -12.079 261 HA MET 43 HA MET 43 7.195 -13.791 -10.415 262 HB2 MET 43 2HB MET 43 5.967 -11.187 -10.886 263 HB3 MET 43 3HB MET 43 4.794 -12.410 -10.414 264 HG2 MET 43 2HG MET 43 7.114 -12.586 -8.744 265 HG3 MET 43 3HG MET 43 6.505 -10.933 -8.763 266 HE1 MET 43 3HE MET 43 6.895 -12.502 -6.425 267 HE2 MET 43 1HE MET 43 5.423 -12.586 -5.457 268 HE3 MET 43 2HE MET 43 5.985 -14.010 -6.332 269 H LYS 44 H LYS 44 5.906 -12.982 -13.545 270 HA LYS 44 HA LYS 44 3.946 -15.149 -13.389 271 HB2 LYS 44 2HB LYS 44 4.367 -13.276 -15.712 272 HB3 LYS 44 3HB LYS 44 2.942 -14.237 -15.339 273 HG2 LYS 44 2HG LYS 44 3.332 -12.601 -13.111 274 HG3 LYS 44 3HG LYS 44 3.619 -11.569 -14.514 275 HD2 LYS 44 2HD LYS 44 1.284 -11.473 -13.938 276 HD3 LYS 44 3HD LYS 44 1.459 -12.347 -15.462 277 HE2 LYS 44 2HE LYS 44 1.636 -14.241 -13.366 278 HE3 LYS 44 3HE LYS 44 0.249 -13.208 -13.026 279 HZ1 LYS 44 3HZ LYS 44 0.467 -14.074 -15.775 280 HZ2 LYS 44 1HZ LYS 44 -0.884 -14.027 -14.758 281 HZ3 LYS 44 2HZ LYS 44 0.197 -15.325 -14.669 282 H LYS 45 H LYS 45 7.112 -14.664 -14.324 283 HA LYS 45 HA LYS 45 8.622 -15.885 -15.509 284 HB2 LYS 45 2HB LYS 45 6.465 -17.887 -14.954 285 HB3 LYS 45 3HB LYS 45 7.805 -18.329 -16.004 286 HG2 LYS 45 2HG LYS 45 8.821 -17.087 -13.637 287 HG3 LYS 45 3HG LYS 45 7.712 -18.389 -13.200 288 HD2 LYS 45 2HD LYS 45 9.866 -19.366 -13.381 289 HD3 LYS 45 3HD LYS 45 8.973 -19.850 -14.824 290 HE2 LYS 45 2HE LYS 45 10.223 -17.423 -15.465 291 HE3 LYS 45 3HE LYS 45 11.432 -18.375 -14.604 292 HZ1 LYS 45 3HZ LYS 45 11.569 -19.859 -16.266 293 HZ2 LYS 45 1HZ LYS 45 10.939 -18.607 -17.213 294 HZ3 LYS 45 2HZ LYS 45 9.914 -19.811 -16.614 295 H LEU 46 H LEU 46 7.522 -14.147 -17.110 296 HA LEU 46 HA LEU 46 6.936 -15.650 -19.573 297 HB2 LEU 46 2HB LEU 46 5.515 -13.370 -18.347 298 HB3 LEU 46 3HB LEU 46 5.760 -13.287 -20.090 299 HG LEU 46 HG LEU 46 4.756 -15.864 -19.528 300 HD11 LEU 46 1HD1 LEU 46 2.480 -14.887 -18.610 301 HD12 LEU 46 2HD1 LEU 46 3.564 -13.720 -17.854 302 HD13 LEU 46 3HD1 LEU 46 3.755 -15.442 -17.525 303 HD21 LEU 46 3HD2 LEU 46 2.672 -14.540 -20.618 304 HD22 LEU 46 1HD2 LEU 46 4.057 -15.128 -21.538 305 HD23 LEU 46 2HD2 LEU 46 3.993 -13.443 -21.020 306 HA PRO 47 HA PRO 47 10.199 -13.465 -21.529 307 HB2 PRO 47 2HB PRO 47 9.205 -13.043 -24.020 308 HB3 PRO 47 3HB PRO 47 9.707 -14.637 -23.444 309 HG2 PRO 47 2HG PRO 47 6.958 -13.463 -23.613 310 HG3 PRO 47 3HG PRO 47 7.506 -15.096 -24.037 311 HD2 PRO 47 2HD PRO 47 6.248 -14.542 -21.704 312 HD3 PRO 47 3HD PRO 47 7.483 -15.809 -21.846 313 HA PRO 48 HA PRO 48 8.860 -9.220 -20.762 314 HB2 PRO 48 2HB PRO 48 11.373 -8.253 -20.421 315 HB3 PRO 48 3HB PRO 48 10.495 -9.114 -19.152 316 HG2 PRO 48 2HG PRO 48 12.593 -10.133 -21.029 317 HG3 PRO 48 3HG PRO 48 12.403 -10.436 -19.292 318 HD2 PRO 48 2HD PRO 48 11.623 -12.218 -21.174 319 HD3 PRO 48 3HD PRO 48 10.784 -12.042 -19.620 320 H ASP 49 H ASP 49 11.180 -10.427 -23.088 321 HA ASP 49 HA ASP 49 11.605 -8.038 -24.525 322 HB2 ASP 49 2HB ASP 49 12.134 -10.903 -24.921 323 HB3 ASP 49 3HB ASP 49 11.901 -9.998 -26.414 324 H THR 50 H THR 50 9.211 -10.617 -24.851 325 HA THR 50 HA THR 50 7.868 -9.068 -26.958 326 HB THR 50 HB THR 50 6.679 -11.079 -27.559 327 HG1 THR 50 HG1 THR 50 7.887 -12.126 -25.211 328 HG21 THR 50 3HG2 THR 50 9.588 -11.749 -27.098 329 HG22 THR 50 1HG2 THR 50 8.970 -10.795 -28.445 330 HG23 THR 50 2HG2 THR 50 8.516 -12.491 -28.285 331 H THR 51 H THR 51 7.704 -8.270 -24.214 332 HA THR 51 HA THR 51 4.802 -8.451 -23.877 333 HB THR 51 HB THR 51 6.801 -9.009 -21.679 334 HG1 THR 51 HG1 THR 51 5.711 -10.999 -21.603 335 HG21 THR 51 3HG2 THR 51 5.331 -8.088 -20.272 336 HG22 THR 51 1HG2 THR 51 4.227 -9.397 -20.691 337 HG23 THR 51 2HG2 THR 51 4.144 -7.863 -21.556 338 H ARG 52 H ARG 52 3.897 -6.538 -23.423 339 HA ARG 52 HA ARG 52 5.683 -4.335 -22.622 340 HB2 ARG 52 2HB ARG 52 3.621 -4.557 -24.690 341 HB3 ARG 52 3HB ARG 52 3.437 -3.134 -23.672 342 HG2 ARG 52 2HG ARG 52 6.168 -3.638 -24.628 343 HG3 ARG 52 3HG ARG 52 4.986 -3.244 -25.878 344 HD2 ARG 52 2HD ARG 52 4.703 -1.521 -23.576 345 HD3 ARG 52 3HD ARG 52 6.342 -1.461 -24.223 346 HE ARG 52 HE ARG 52 3.987 -0.381 -25.417 347 HH11 ARG 52 1HH1 ARG 52 7.091 -1.794 -26.115 348 HH12 ARG 52 2HH1 ARG 52 7.244 -1.017 -27.656 349 HH21 ARG 52 1HH2 ARG 52 4.176 0.648 -27.444 350 HH22 ARG 52 2HH2 ARG 52 5.586 0.372 -28.410 351 H LEU 53 H LEU 53 4.533 -2.540 -21.454 352 HA LEU 53 HA LEU 53 2.260 -3.431 -19.851 353 HB2 LEU 53 2HB LEU 53 4.741 -3.755 -18.846 354 HB3 LEU 53 3HB LEU 53 4.407 -2.105 -18.324 355 HG LEU 53 HG LEU 53 3.861 -3.663 -16.560 356 HD11 LEU 53 1HD1 LEU 53 1.300 -2.659 -17.786 357 HD12 LEU 53 2HD1 LEU 53 2.455 -1.633 -16.936 358 HD13 LEU 53 3HD1 LEU 53 1.640 -2.941 -16.078 359 HD21 LEU 53 3HD2 LEU 53 3.063 -5.683 -17.003 360 HD22 LEU 53 1HD2 LEU 53 2.905 -5.258 -18.708 361 HD23 LEU 53 2HD2 LEU 53 1.565 -4.965 -17.599 362 H THR 54 H THR 54 0.836 -1.844 -19.492 363 HA THR 54 HA THR 54 1.726 0.939 -19.860 364 HB THR 54 HB THR 54 -0.871 1.081 -20.640 365 HG1 THR 54 HG1 THR 54 -1.493 -0.718 -21.621 366 HG21 THR 54 3HG2 THR 54 1.183 1.999 -21.751 367 HG22 THR 54 1HG2 THR 54 -0.047 1.399 -22.864 368 HG23 THR 54 2HG2 THR 54 1.388 0.430 -22.529 369 H TYR 55 H TYR 55 0.772 2.486 -18.557 370 HA TYR 55 HA TYR 55 -1.029 1.474 -16.456 371 HB2 TYR 55 2HB TYR 55 1.032 1.765 -15.349 372 HB3 TYR 55 3HB TYR 55 1.386 3.255 -16.216 373 HD1 TYR 55 HD2 TYR 55 -1.690 2.225 -14.377 374 HD2 TYR 55 HD1 TYR 55 1.616 4.896 -14.586 375 HE1 TYR 55 HE2 TYR 55 -2.631 3.527 -12.515 376 HE2 TYR 55 HE1 TYR 55 0.685 6.204 -12.723 377 HH TYR 55 HH TYR 55 -2.454 5.931 -11.674 378 H LYS 56 H LYS 56 -2.874 2.553 -16.232 379 HA LYS 56 HA LYS 56 -4.520 4.096 -16.529 380 HB2 LYS 56 2HB LYS 56 -2.734 5.389 -15.171 381 HB3 LYS 56 3HB LYS 56 -2.397 6.219 -16.684 382 HG2 LYS 56 2HG LYS 56 -5.062 6.504 -16.605 383 HG3 LYS 56 3HG LYS 56 -4.714 6.435 -14.876 384 HD2 LYS 56 2HD LYS 56 -4.267 8.621 -15.045 385 HD3 LYS 56 3HD LYS 56 -2.764 8.124 -15.826 386 HE2 LYS 56 2HE LYS 56 -3.850 8.267 -18.010 387 HE3 LYS 56 3HE LYS 56 -5.359 8.746 -17.234 388 HZ1 LYS 56 3HZ LYS 56 -3.573 10.527 -16.255 389 HZ2 LYS 56 1HZ LYS 56 -4.627 10.813 -17.548 390 HZ3 LYS 56 2HZ LYS 56 -3.036 10.322 -17.847 391 H GLY 57 H GLY 57 -3.370 2.861 -18.874 392 HA2 GLY 57 2HA GLY 57 -3.730 3.001 -21.145 393 HA3 GLY 57 3HA GLY 57 -4.571 4.518 -20.861 394 H ARG 58 H ARG 58 -1.434 4.416 -19.557 395 HA ARG 58 HA ARG 58 -0.391 5.896 -21.883 396 HB2 ARG 58 2HB ARG 58 -0.647 6.703 -19.138 397 HB3 ARG 58 3HB ARG 58 1.055 6.657 -19.578 398 HG2 ARG 58 2HG ARG 58 0.271 8.852 -20.001 399 HG3 ARG 58 3HG ARG 58 0.490 8.066 -21.566 400 HD2 ARG 58 2HD ARG 58 -1.720 8.087 -22.034 401 HD3 ARG 58 3HD ARG 58 -2.182 7.789 -20.359 402 HE ARG 58 HE ARG 58 -1.155 10.385 -20.546 403 HH11 ARG 58 1HH1 ARG 58 -3.901 8.531 -21.615 404 HH12 ARG 58 2HH1 ARG 58 -4.968 9.895 -21.663 405 HH21 ARG 58 1HH2 ARG 58 -2.550 12.189 -20.606 406 HH22 ARG 58 2HH2 ARG 58 -4.198 11.975 -21.090 407 H ALA 59 H ALA 59 1.843 5.683 -22.342 408 HA ALA 59 HA ALA 59 2.973 3.150 -21.376 409 HB1 ALA 59 1HB ALA 59 3.172 2.807 -23.575 410 HB2 ALA 59 2HB ALA 59 2.945 4.515 -23.954 411 HB3 ALA 59 3HB ALA 59 4.539 3.919 -23.491 412 H LEU 60 H LEU 60 4.585 3.218 -19.966 413 HA LEU 60 HA LEU 60 6.336 5.588 -19.938 414 HB2 LEU 60 2HB LEU 60 6.597 4.900 -17.435 415 HB3 LEU 60 3HB LEU 60 5.227 5.878 -17.959 416 HG LEU 60 HG LEU 60 4.887 2.922 -17.842 417 HD11 LEU 60 1HD1 LEU 60 4.215 4.263 -15.345 418 HD12 LEU 60 2HD1 LEU 60 5.949 4.204 -15.660 419 HD13 LEU 60 3HD1 LEU 60 5.009 2.713 -15.625 420 HD21 LEU 60 3HD2 LEU 60 2.695 3.422 -17.861 421 HD22 LEU 60 1HD2 LEU 60 3.243 4.981 -18.475 422 HD23 LEU 60 2HD2 LEU 60 2.889 4.785 -16.758 423 H LYS 61 H LYS 61 8.522 5.234 -19.296 424 HA LYS 61 HA LYS 61 9.524 2.581 -18.884 425 HB2 LYS 61 2HB LYS 61 11.065 3.126 -21.066 426 HB3 LYS 61 3HB LYS 61 9.675 2.049 -21.068 427 HG2 LYS 61 2HG LYS 61 8.254 3.773 -21.916 428 HG3 LYS 61 3HG LYS 61 9.527 4.982 -21.727 429 HD2 LYS 61 2HD LYS 61 9.581 4.466 -24.003 430 HD3 LYS 61 3HD LYS 61 10.891 3.497 -23.323 431 HE2 LYS 61 2HE LYS 61 8.937 1.716 -23.091 432 HE3 LYS 61 3HE LYS 61 8.264 2.652 -24.425 433 HZ1 LYS 61 3HZ LYS 61 9.948 0.638 -24.771 434 HZ2 LYS 61 1HZ LYS 61 11.065 1.905 -24.661 435 HZ3 LYS 61 2HZ LYS 61 9.852 1.947 -25.839 436 H ASP 62 H ASP 62 11.018 5.333 -20.553 437 HA ASP 62 HA ASP 62 13.217 5.348 -18.713 438 HB2 ASP 62 2HB ASP 62 12.810 6.229 -21.320 439 HB3 ASP 62 3HB ASP 62 13.008 7.714 -20.394 440 H THR 63 H THR 63 10.144 6.549 -18.510 441 HA THR 63 HA THR 63 10.427 9.124 -17.481 442 HB THR 63 HB THR 63 8.368 7.409 -16.213 443 HG1 THR 63 HG1 THR 63 7.186 7.497 -18.282 444 HG21 THR 63 3HG2 THR 63 8.694 10.162 -17.197 445 HG22 THR 63 1HG2 THR 63 7.760 9.549 -15.833 446 HG23 THR 63 2HG2 THR 63 7.099 9.458 -17.466 447 H GLU 64 H GLU 64 11.300 6.101 -16.120 448 HA GLU 64 HA GLU 64 12.294 5.525 -14.156 449 HB2 GLU 64 2HB GLU 64 12.834 8.390 -14.426 450 HB3 GLU 64 3HB GLU 64 12.842 7.834 -12.758 451 HG2 GLU 64 2HG GLU 64 14.578 6.300 -13.169 452 HG3 GLU 64 3HG GLU 64 14.409 6.461 -14.916 453 H THR 65 H THR 65 10.873 8.530 -12.951 454 HA THR 65 HA THR 65 9.194 6.917 -11.149 455 HB THR 65 HB THR 65 10.662 8.219 -9.826 456 HG1 THR 65 HG1 THR 65 9.190 9.400 -8.675 457 HG21 THR 65 3HG2 THR 65 11.639 9.837 -11.128 458 HG22 THR 65 1HG2 THR 65 10.517 10.828 -10.197 459 HG23 THR 65 2HG2 THR 65 10.108 10.342 -11.843 460 H LEU 66 H LEU 66 7.064 7.700 -10.642 461 HA LEU 66 HA LEU 66 5.907 9.360 -12.785 462 HB2 LEU 66 2HB LEU 66 5.251 6.715 -11.904 463 HB3 LEU 66 3HB LEU 66 3.881 7.787 -11.619 464 HG LEU 66 HG LEU 66 4.404 8.465 -14.145 465 HD11 LEU 66 1HD1 LEU 66 5.215 5.566 -14.024 466 HD12 LEU 66 2HD1 LEU 66 6.332 6.909 -14.260 467 HD13 LEU 66 3HD1 LEU 66 5.085 6.579 -15.462 468 HD21 LEU 66 3HD2 LEU 66 2.691 6.796 -14.807 469 HD22 LEU 66 1HD2 LEU 66 2.256 7.718 -13.368 470 HD23 LEU 66 2HD2 LEU 66 2.841 6.062 -13.210 471 H GLU 67 H GLU 67 6.548 9.159 -9.516 472 HA GLU 67 HA GLU 67 4.272 10.220 -8.301 473 HB2 GLU 67 2HB GLU 67 6.937 9.645 -7.550 474 HB3 GLU 67 3HB GLU 67 6.635 11.315 -7.093 475 HG2 GLU 67 2HG GLU 67 4.367 9.852 -6.310 476 HG3 GLU 67 3HG GLU 67 5.774 8.909 -5.821 477 H SER 68 H SER 68 6.809 11.759 -10.151 478 HA SER 68 HA SER 68 6.256 14.431 -9.417 479 HB2 SER 68 2HB SER 68 8.259 14.441 -10.484 480 HB3 SER 68 3HB SER 68 7.839 13.058 -11.494 481 HG SER 68 HG SER 68 7.930 15.557 -12.229 482 H LEU 69 H LEU 69 4.547 12.210 -11.334 483 HA LEU 69 HA LEU 69 3.123 14.317 -12.788 484 HB2 LEU 69 2HB LEU 69 2.526 11.415 -13.113 485 HB3 LEU 69 3HB LEU 69 2.419 12.721 -14.292 486 HG LEU 69 HG LEU 69 4.931 11.358 -13.325 487 HD11 LEU 69 1HD1 LEU 69 4.998 10.250 -15.318 488 HD12 LEU 69 2HD1 LEU 69 4.061 11.480 -16.165 489 HD13 LEU 69 3HD1 LEU 69 3.252 10.343 -15.086 490 HD21 LEU 69 3HD2 LEU 69 4.643 13.580 -15.344 491 HD22 LEU 69 1HD2 LEU 69 6.137 12.782 -14.853 492 HD23 LEU 69 2HD2 LEU 69 5.252 13.781 -13.700 493 H GLY 70 H GLY 70 2.863 12.401 -10.009 494 HA2 GLY 70 2HA GLY 70 1.149 12.848 -8.399 495 HA3 GLY 70 3HA GLY 70 0.051 13.211 -9.722 496 H VAL 71 H VAL 71 2.142 10.429 -8.948 497 HA VAL 71 HA VAL 71 -0.045 8.635 -9.650 498 HB VAL 71 HB VAL 71 2.272 8.227 -10.496 499 HG11 VAL 71 1HG1 VAL 71 4.046 8.028 -9.154 500 HG12 VAL 71 2HG1 VAL 71 3.022 8.717 -7.893 501 HG13 VAL 71 3HG1 VAL 71 3.189 6.967 -8.037 502 HG21 VAL 71 3HG2 VAL 71 1.932 5.981 -10.553 503 HG22 VAL 71 1HG2 VAL 71 1.649 5.868 -8.816 504 HG23 VAL 71 2HG2 VAL 71 0.372 6.456 -9.882 505 H ALA 72 H ALA 72 -1.026 7.222 -8.258 506 HA ALA 72 HA ALA 72 -0.371 7.544 -5.400 507 HB1 ALA 72 1HB ALA 72 -2.460 8.554 -5.644 508 HB2 ALA 72 2HB ALA 72 -3.025 7.328 -6.779 509 HB3 ALA 72 3HB ALA 72 -2.841 6.929 -5.071 510 H ASP 73 H ASP 73 -1.401 5.638 -4.102 511 HA ASP 73 HA ASP 73 -0.314 3.199 -5.268 512 HB2 ASP 73 2HB ASP 73 -0.726 2.299 -2.920 513 HB3 ASP 73 3HB ASP 73 0.466 3.587 -3.066 514 H GLY 74 H GLY 74 -1.464 1.260 -5.450 515 HA2 GLY 74 2HA GLY 74 -3.358 -0.113 -5.443 516 HA3 GLY 74 3HA GLY 74 -4.311 1.243 -4.858 517 H ASP 75 H ASP 75 -2.226 1.063 -7.717 518 HA ASP 75 HA ASP 75 -4.494 1.940 -9.342 519 HB2 ASP 75 2HB ASP 75 -1.517 2.021 -9.676 520 HB3 ASP 75 3HB ASP 75 -2.553 2.122 -11.098 521 H LYS 76 H LYS 76 -4.131 1.063 -11.770 522 HA LYS 76 HA LYS 76 -4.040 -1.875 -11.550 523 HB2 LYS 76 2HB LYS 76 -5.964 -0.047 -12.892 524 HB3 LYS 76 3HB LYS 76 -5.587 -1.558 -13.709 525 HG2 LYS 76 2HG LYS 76 -6.108 -2.631 -11.402 526 HG3 LYS 76 3HG LYS 76 -6.949 -1.110 -11.092 527 HD2 LYS 76 2HD LYS 76 -7.477 -2.552 -13.648 528 HD3 LYS 76 3HD LYS 76 -8.202 -3.165 -12.160 529 HE2 LYS 76 2HE LYS 76 -8.947 -0.708 -11.806 530 HE3 LYS 76 3HE LYS 76 -8.625 -0.536 -13.531 531 HZ1 LYS 76 3HZ LYS 76 -10.096 -2.724 -13.571 532 HZ2 LYS 76 1HZ LYS 76 -10.775 -1.176 -13.641 533 HZ3 LYS 76 2HZ LYS 76 -10.736 -2.017 -12.174 534 H PHE 77 H PHE 77 -2.655 -2.916 -12.835 535 HA PHE 77 HA PHE 77 -1.352 -1.379 -14.982 536 HB2 PHE 77 2HB PHE 77 -0.341 -3.349 -13.000 537 HB3 PHE 77 3HB PHE 77 0.372 -3.398 -14.609 538 HD1 PHE 77 HD2 PHE 77 -0.808 -0.467 -12.656 539 HD2 PHE 77 HD1 PHE 77 2.509 -2.548 -14.324 540 HE1 PHE 77 HE2 PHE 77 0.666 1.409 -12.057 541 HE2 PHE 77 HE1 PHE 77 3.989 -0.675 -13.726 542 HZ PHE 77 HZ PHE 77 3.068 1.308 -12.592 543 H VAL 78 H VAL 78 -1.552 -2.059 -17.018 544 HA VAL 78 HA VAL 78 -2.908 -4.618 -17.490 545 HB VAL 78 HB VAL 78 -2.500 -2.299 -19.383 546 HG11 VAL 78 1HG1 VAL 78 -4.359 -3.543 -20.632 547 HG12 VAL 78 2HG1 VAL 78 -2.725 -4.202 -20.724 548 HG13 VAL 78 3HG1 VAL 78 -3.913 -4.933 -19.644 549 HG21 VAL 78 3HG2 VAL 78 -3.993 -1.793 -17.474 550 HG22 VAL 78 1HG2 VAL 78 -4.831 -1.787 -19.025 551 HG23 VAL 78 2HG2 VAL 78 -5.002 -3.163 -17.936 552 H LEU 79 H LEU 79 -1.746 -6.294 -18.143 553 HA LEU 79 HA LEU 79 0.865 -5.805 -19.401 554 HB2 LEU 79 2HB LEU 79 1.101 -7.091 -17.428 555 HB3 LEU 79 3HB LEU 79 -0.245 -8.140 -17.867 556 HG LEU 79 HG LEU 79 2.127 -8.120 -19.655 557 HD11 LEU 79 1HD1 LEU 79 3.560 -9.182 -18.274 558 HD12 LEU 79 2HD1 LEU 79 2.273 -9.975 -17.366 559 HD13 LEU 79 3HD1 LEU 79 2.677 -8.291 -17.034 560 HD21 LEU 79 3HD2 LEU 79 -0.182 -9.513 -19.627 561 HD22 LEU 79 1HD2 LEU 79 0.855 -10.600 -18.703 562 HD23 LEU 79 2HD2 LEU 79 1.319 -10.112 -20.333 563 H ILE 80 H ILE 80 1.258 -6.435 -21.435 564 HA ILE 80 HA ILE 80 -0.768 -8.107 -22.774 565 HB ILE 80 HB ILE 80 0.841 -5.917 -24.089 566 HG12 ILE 80 2HG1 ILE 80 -1.825 -5.175 -24.162 567 HG13 ILE 80 3HG1 ILE 80 -1.635 -5.825 -22.537 568 HG21 ILE 80 1HG2 ILE 80 0.205 -7.642 -25.634 569 HG22 ILE 80 2HG2 ILE 80 -1.455 -7.619 -25.042 570 HG23 ILE 80 3HG2 ILE 80 -0.813 -6.229 -25.915 571 HD11 ILE 80 3HD1 ILE 80 -0.699 -3.936 -21.889 572 HD12 ILE 80 1HD1 ILE 80 0.581 -4.141 -23.084 573 HD13 ILE 80 2HD1 ILE 80 -0.898 -3.282 -23.515 574 H THR 81 H THR 81 -0.051 -9.611 -24.282 575 HA THR 81 HA THR 81 2.856 -10.104 -24.278 576 HB THR 81 HB THR 81 1.739 -11.841 -23.012 577 HG1 THR 81 HG1 THR 81 2.376 -12.870 -25.591 578 HG21 THR 81 3HG2 THR 81 0.087 -12.335 -25.492 579 HG22 THR 81 1HG2 THR 81 -0.502 -11.600 -24.001 580 HG23 THR 81 2HG2 THR 81 0.038 -13.279 -24.003 581 H ARG 82 H ARG 82 3.848 -10.253 -26.195 582 HA ARG 82 HA ARG 82 2.191 -10.088 -28.605 583 HB2 ARG 82 2HB ARG 82 5.031 -9.338 -27.981 584 HB3 ARG 82 3HB ARG 82 4.508 -9.552 -29.646 585 HG2 ARG 82 2HG ARG 82 2.567 -7.916 -28.734 586 HG3 ARG 82 3HG ARG 82 3.929 -7.391 -27.743 587 HD2 ARG 82 2HD ARG 82 5.059 -7.603 -30.227 588 HD3 ARG 82 3HD ARG 82 3.432 -7.036 -30.603 589 HE ARG 82 HE ARG 82 4.018 -4.997 -29.773 590 HH11 ARG 82 1HH1 ARG 82 6.197 -7.385 -28.482 591 HH12 ARG 82 2HH1 ARG 82 7.206 -6.224 -27.684 592 HH21 ARG 82 1HH2 ARG 82 5.338 -3.458 -28.728 593 HH22 ARG 82 2HH2 ARG 82 6.716 -3.990 -27.824 594 H THR 83 H THR 83 2.151 -11.647 -30.117 595 HA THR 83 HA THR 83 3.835 -14.017 -29.653 596 HB THR 83 HB THR 83 1.250 -13.926 -31.213 597 HG1 THR 83 HG1 THR 83 1.764 -14.411 -28.468 598 HG21 THR 83 3HG2 THR 83 1.308 -16.294 -31.127 599 HG22 THR 83 1HG2 THR 83 2.625 -16.293 -29.955 600 HG23 THR 83 2HG2 THR 83 2.924 -15.788 -31.618 601 H VAL 84 H VAL 84 2.192 -12.388 -32.375 602 HA VAL 84 HA VAL 84 4.652 -12.674 -33.947 603 HB VAL 84 HB VAL 84 3.201 -14.555 -34.573 604 HG11 VAL 84 1HG1 VAL 84 1.220 -12.440 -35.413 605 HG12 VAL 84 2HG1 VAL 84 1.055 -14.181 -35.649 606 HG13 VAL 84 3HG1 VAL 84 1.049 -13.506 -34.019 607 HG21 VAL 84 3HG2 VAL 84 3.253 -14.214 -36.961 608 HG22 VAL 84 1HG2 VAL 84 3.316 -12.465 -36.744 609 HG23 VAL 84 2HG2 VAL 84 4.677 -13.465 -36.238 610 H GLY 85 H GLY 85 5.102 -10.976 -35.261 611 HA2 GLY 85 2HA GLY 85 3.003 -9.008 -35.809 612 HA3 GLY 85 3HA GLY 85 4.420 -8.464 -34.924 Start of MODEL 8 1 H1 MET 9 H MET 9 3.497 1.934 -2.966 2 HA MET 9 HA MET 9 3.832 0.080 -1.639 3 HB2 MET 9 2HB MET 9 1.226 1.279 -1.200 4 HB3 MET 9 3HB MET 9 1.239 -0.416 -0.734 5 HG2 MET 9 2HG MET 9 2.598 -0.065 1.021 6 HG3 MET 9 3HG MET 9 3.538 1.168 0.184 7 HE1 MET 9 3HE MET 9 2.153 0.460 2.961 8 HE2 MET 9 1HE MET 9 1.873 2.046 3.681 9 HE3 MET 9 2HE MET 9 0.508 1.077 3.123 10 H LYS 10 H LYS 10 0.585 -0.582 -2.952 11 HA LYS 10 HA LYS 10 1.603 -3.155 -3.954 12 HB2 LYS 10 2HB LYS 10 -0.342 -2.722 -1.893 13 HB3 LYS 10 3HB LYS 10 -1.129 -3.477 -3.273 14 HG2 LYS 10 2HG LYS 10 1.053 -5.020 -3.118 15 HG3 LYS 10 3HG LYS 10 0.902 -4.550 -1.423 16 HD2 LYS 10 2HD LYS 10 -1.677 -5.243 -2.457 17 HD3 LYS 10 3HD LYS 10 -0.534 -6.541 -2.810 18 HE2 LYS 10 2HE LYS 10 -0.983 -5.301 -0.097 19 HE3 LYS 10 3HE LYS 10 -1.666 -6.833 -0.639 20 HZ1 LYS 10 3HZ LYS 10 0.410 -6.988 0.735 21 HZ2 LYS 10 1HZ LYS 10 1.250 -6.314 -0.570 22 HZ3 LYS 10 2HZ LYS 10 0.465 -7.801 -0.748 23 H ILE 11 H ILE 11 0.896 -3.773 -5.939 24 HA ILE 11 HA ILE 11 -1.263 -2.244 -7.200 25 HB ILE 11 HB ILE 11 0.054 -2.055 -9.292 26 HG12 ILE 11 2HG1 ILE 11 2.648 -2.328 -7.972 27 HG13 ILE 11 3HG1 ILE 11 1.764 -3.847 -8.060 28 HG21 ILE 11 1HG2 ILE 11 1.393 -0.708 -6.952 29 HG22 ILE 11 2HG2 ILE 11 1.334 -0.137 -8.618 30 HG23 ILE 11 3HG2 ILE 11 -0.142 -0.198 -7.655 31 HD11 ILE 11 3HD1 ILE 11 1.439 -2.950 -10.578 32 HD12 ILE 11 1HD1 ILE 11 3.012 -2.257 -10.187 33 HD13 ILE 11 2HD1 ILE 11 2.760 -3.998 -10.061 34 H LYS 12 H LYS 12 -2.434 -3.353 -8.737 35 HA LYS 12 HA LYS 12 -1.733 -6.196 -9.077 36 HB2 LYS 12 2HB LYS 12 -4.019 -5.111 -7.896 37 HB3 LYS 12 3HB LYS 12 -4.543 -5.607 -9.500 38 HG2 LYS 12 2HG LYS 12 -3.797 -7.859 -9.102 39 HG3 LYS 12 3HG LYS 12 -3.105 -7.391 -7.547 40 HD2 LYS 12 2HD LYS 12 -5.666 -6.534 -7.261 41 HD3 LYS 12 3HD LYS 12 -5.894 -7.952 -8.288 42 HE2 LYS 12 2HE LYS 12 -4.798 -9.362 -6.701 43 HE3 LYS 12 3HE LYS 12 -4.286 -7.976 -5.740 44 HZ1 LYS 12 3HZ LYS 12 -6.343 -9.349 -5.024 45 HZ2 LYS 12 1HZ LYS 12 -7.153 -8.439 -6.199 46 HZ3 LYS 12 2HZ LYS 12 -6.387 -7.662 -4.907 47 H ILE 13 H ILE 13 -1.298 -6.777 -11.093 48 HA ILE 13 HA ILE 13 -2.349 -5.119 -13.290 49 HB ILE 13 HB ILE 13 0.083 -5.069 -13.170 50 HG12 ILE 13 2HG1 ILE 13 -0.071 -6.799 -15.502 51 HG13 ILE 13 3HG1 ILE 13 -1.448 -5.707 -15.410 52 HG21 ILE 13 1HG2 ILE 13 0.310 -7.283 -12.040 53 HG22 ILE 13 2HG2 ILE 13 0.034 -8.049 -13.604 54 HG23 ILE 13 3HG2 ILE 13 1.447 -7.022 -13.362 55 HD11 ILE 13 3HD1 ILE 13 -0.149 -4.202 -16.386 56 HD12 ILE 13 1HD1 ILE 13 0.716 -4.087 -14.854 57 HD13 ILE 13 2HD1 ILE 13 1.301 -5.169 -16.118 58 H VAL 14 H VAL 14 -3.746 -6.021 -14.648 59 HA VAL 14 HA VAL 14 -4.153 -8.922 -14.522 60 HB VAL 14 HB VAL 14 -5.962 -6.920 -15.865 61 HG11 VAL 14 1HG1 VAL 14 -6.424 -9.141 -16.562 62 HG12 VAL 14 2HG1 VAL 14 -6.302 -9.756 -14.913 63 HG13 VAL 14 3HG1 VAL 14 -7.654 -8.718 -15.370 64 HG21 VAL 14 3HG2 VAL 14 -5.505 -7.382 -13.026 65 HG22 VAL 14 1HG2 VAL 14 -6.384 -6.086 -13.836 66 HG23 VAL 14 2HG2 VAL 14 -7.187 -7.619 -13.499 67 HA PRO 15 HA PRO 15 -1.979 -8.966 -18.464 68 HB2 PRO 15 2HB PRO 15 -1.760 -11.670 -18.567 69 HB3 PRO 15 3HB PRO 15 -0.686 -10.655 -17.596 70 HG2 PRO 15 2HG PRO 15 -3.085 -12.231 -16.745 71 HG3 PRO 15 3HG PRO 15 -1.511 -12.069 -15.944 72 HD2 PRO 15 2HD PRO 15 -3.695 -10.676 -15.158 73 HD3 PRO 15 3HD PRO 15 -2.049 -10.026 -15.023 74 H ALA 16 H ALA 16 -2.839 -8.999 -20.450 75 HA ALA 16 HA ALA 16 -5.502 -10.152 -20.797 76 HB1 ALA 16 1HB ALA 16 -4.093 -8.533 -22.881 77 HB2 ALA 16 2HB ALA 16 -5.821 -8.685 -22.559 78 HB3 ALA 16 3HB ALA 16 -4.800 -7.749 -21.467 79 H VAL 17 H VAL 17 -3.934 -12.222 -20.602 80 HA VAL 17 HA VAL 17 -3.121 -13.008 -23.316 81 HB VAL 17 HB VAL 17 -1.328 -13.300 -21.765 82 HG11 VAL 17 1HG1 VAL 17 -1.891 -13.466 -19.608 83 HG12 VAL 17 2HG1 VAL 17 -3.468 -14.164 -19.982 84 HG13 VAL 17 3HG1 VAL 17 -2.039 -15.196 -19.912 85 HG21 VAL 17 3HG2 VAL 17 -0.733 -15.401 -22.382 86 HG22 VAL 17 1HG2 VAL 17 -2.258 -16.108 -21.850 87 HG23 VAL 17 2HG2 VAL 17 -2.173 -15.250 -23.388 88 H GLY 18 H GLY 18 -5.292 -13.416 -24.003 89 HA2 GLY 18 2HA GLY 18 -7.176 -14.699 -24.316 90 HA3 GLY 18 3HA GLY 18 -6.093 -16.044 -23.992 91 H GLY 19 H GLY 19 -7.486 -13.453 -21.971 92 HA2 GLY 19 2HA GLY 19 -8.905 -13.606 -20.151 93 HA3 GLY 19 3HA GLY 19 -9.107 -15.316 -20.501 94 H GLY 20 H GLY 20 -6.084 -13.582 -19.879 95 HA2 GLY 20 2HA GLY 20 -5.072 -15.537 -18.144 96 HA3 GLY 20 3HA GLY 20 -4.472 -13.891 -18.276 97 H SER 21 H SER 21 -4.103 -14.342 -15.919 98 HA SER 21 HA SER 21 -6.497 -13.542 -14.403 99 HB2 SER 21 2HB SER 21 -5.282 -15.994 -14.150 100 HB3 SER 21 3HB SER 21 -4.504 -15.061 -12.871 101 HG SER 21 HG SER 21 -6.301 -15.789 -11.916 102 HA PRO 22 HA PRO 22 -4.060 -10.173 -12.968 103 HB2 PRO 22 2HB PRO 22 -5.381 -9.620 -10.662 104 HB3 PRO 22 3HB PRO 22 -6.036 -9.239 -12.259 105 HG2 PRO 22 2HG PRO 22 -6.642 -11.560 -10.468 106 HG3 PRO 22 3HG PRO 22 -7.755 -10.561 -11.421 107 HD2 PRO 22 2HD PRO 22 -6.929 -13.007 -12.238 108 HD3 PRO 22 3HD PRO 22 -7.299 -11.695 -13.375 109 H LEU 23 H LEU 23 -2.354 -9.754 -11.620 110 HA LEU 23 HA LEU 23 -1.836 -11.680 -9.455 111 HB2 LEU 23 2HB LEU 23 -0.460 -11.641 -11.808 112 HB3 LEU 23 3HB LEU 23 0.529 -10.585 -10.802 113 HG LEU 23 HG LEU 23 -0.164 -13.474 -10.285 114 HD11 LEU 23 1HD1 LEU 23 1.692 -12.682 -11.942 115 HD12 LEU 23 2HD1 LEU 23 2.022 -13.974 -10.788 116 HD13 LEU 23 3HD1 LEU 23 2.588 -12.336 -10.463 117 HD21 LEU 23 3HD2 LEU 23 1.532 -13.045 -8.358 118 HD22 LEU 23 1HD2 LEU 23 -0.167 -12.625 -8.139 119 HD23 LEU 23 2HD2 LEU 23 1.009 -11.367 -8.519 120 H GLU 24 H GLU 24 -0.981 -10.866 -7.592 121 HA GLU 24 HA GLU 24 -0.827 -7.940 -7.429 122 HB2 GLU 24 2HB GLU 24 -1.239 -8.163 -5.075 123 HB3 GLU 24 3HB GLU 24 -2.416 -9.149 -5.932 124 HG2 GLU 24 2HG GLU 24 -0.388 -10.925 -5.484 125 HG3 GLU 24 3HG GLU 24 -0.342 -9.922 -4.035 126 H LEU 25 H LEU 25 1.034 -6.922 -7.023 127 HA LEU 25 HA LEU 25 3.266 -8.391 -5.840 128 HB2 LEU 25 2HB LEU 25 3.645 -6.741 -8.324 129 HB3 LEU 25 3HB LEU 25 4.812 -7.799 -7.533 130 HG LEU 25 HG LEU 25 2.845 -9.564 -8.182 131 HD11 LEU 25 1HD1 LEU 25 2.656 -7.248 -10.008 132 HD12 LEU 25 2HD1 LEU 25 1.434 -8.429 -9.537 133 HD13 LEU 25 3HD1 LEU 25 2.646 -8.850 -10.747 134 HD21 LEU 25 3HD2 LEU 25 5.443 -8.752 -9.306 135 HD22 LEU 25 1HD2 LEU 25 4.425 -9.733 -10.361 136 HD23 LEU 25 2HD2 LEU 25 4.880 -10.335 -8.767 137 H GLU 26 H GLU 26 4.937 -7.023 -4.988 138 HA GLU 26 HA GLU 26 3.921 -4.357 -4.293 139 HB2 GLU 26 2HB GLU 26 5.595 -4.477 -2.433 140 HB3 GLU 26 3HB GLU 26 4.333 -5.698 -2.355 141 HG2 GLU 26 2HG GLU 26 6.596 -6.675 -3.834 142 HG3 GLU 26 3HG GLU 26 7.088 -6.095 -2.244 143 H VAL 27 H VAL 27 4.683 -2.824 -5.598 144 HA VAL 27 HA VAL 27 7.579 -2.675 -6.023 145 HB VAL 27 HB VAL 27 7.315 -2.076 -8.369 146 HG11 VAL 27 1HG1 VAL 27 7.040 -4.234 -9.218 147 HG12 VAL 27 2HG1 VAL 27 7.527 -4.499 -7.543 148 HG13 VAL 27 3HG1 VAL 27 5.832 -4.658 -8.005 149 HG21 VAL 27 3HG2 VAL 27 4.718 -2.978 -8.977 150 HG22 VAL 27 1HG2 VAL 27 4.559 -1.844 -7.636 151 HG23 VAL 27 2HG2 VAL 27 5.359 -1.342 -9.125 152 H ALA 28 H ALA 28 8.200 -0.498 -6.946 153 HA ALA 28 HA ALA 28 6.412 1.598 -5.895 154 HB1 ALA 28 1HB ALA 28 8.054 1.865 -4.376 155 HB2 ALA 28 2HB ALA 28 9.267 1.080 -5.389 156 HB3 ALA 28 3HB ALA 28 8.831 2.764 -5.680 157 HA PRO 29 HA PRO 29 6.668 2.917 -10.164 158 HB2 PRO 29 2HB PRO 29 4.906 4.966 -9.898 159 HB3 PRO 29 3HB PRO 29 4.402 3.277 -10.039 160 HG2 PRO 29 2HG PRO 29 4.674 4.974 -7.588 161 HG3 PRO 29 3HG PRO 29 3.386 3.836 -8.024 162 HD2 PRO 29 2HD PRO 29 5.365 3.201 -6.289 163 HD3 PRO 29 3HD PRO 29 4.609 2.000 -7.356 164 H ASN 30 H ASN 30 7.545 4.584 -7.309 165 HA ASN 30 HA ASN 30 8.429 6.987 -8.667 166 HB2 ASN 30 2HB ASN 30 9.120 7.756 -6.471 167 HB3 ASN 30 3HB ASN 30 7.496 7.082 -6.368 168 HD21 ASN 30 1HD2 ASN 30 10.843 6.641 -5.552 169 HD22 ASN 30 2HD2 ASN 30 10.603 5.388 -4.386 170 H ALA 31 H ALA 31 9.575 4.028 -8.785 171 HA ALA 31 HA ALA 31 12.396 4.739 -8.375 172 HB1 ALA 31 1HB ALA 31 12.360 2.064 -8.999 173 HB2 ALA 31 2HB ALA 31 12.404 2.745 -7.372 174 HB3 ALA 31 3HB ALA 31 10.863 2.279 -8.092 175 H THR 32 H THR 32 10.898 2.426 -10.609 176 HA THR 32 HA THR 32 11.667 3.958 -12.931 177 HB THR 32 HB THR 32 12.856 1.326 -13.221 178 HG1 THR 32 HG1 THR 32 14.616 1.720 -11.800 179 HG21 THR 32 3HG2 THR 32 14.014 4.108 -13.430 180 HG22 THR 32 1HG2 THR 32 13.215 3.233 -14.735 181 HG23 THR 32 2HG2 THR 32 14.733 2.630 -14.069 182 H VAL 33 H VAL 33 10.606 3.316 -14.777 183 HA VAL 33 HA VAL 33 8.281 1.720 -14.443 184 HB VAL 33 HB VAL 33 9.539 2.782 -16.976 185 HG11 VAL 33 1HG1 VAL 33 7.275 1.031 -16.525 186 HG12 VAL 33 2HG1 VAL 33 6.812 2.508 -17.373 187 HG13 VAL 33 3HG1 VAL 33 8.079 1.471 -18.031 188 HG21 VAL 33 3HG2 VAL 33 8.199 4.671 -16.768 189 HG22 VAL 33 1HG2 VAL 33 7.119 3.897 -15.608 190 HG23 VAL 33 2HG2 VAL 33 8.740 4.385 -15.114 191 H GLY 34 H GLY 34 11.315 1.222 -16.235 192 HA2 GLY 34 2HA GLY 34 10.645 -1.318 -17.268 193 HA3 GLY 34 3HA GLY 34 12.273 -0.678 -17.095 194 H ALA 35 H ALA 35 12.067 -0.322 -14.216 195 HA ALA 35 HA ALA 35 12.992 -2.860 -13.395 196 HB1 ALA 35 1HB ALA 35 13.810 -0.885 -12.311 197 HB2 ALA 35 2HB ALA 35 12.185 -0.444 -11.785 198 HB3 ALA 35 3HB ALA 35 12.972 -1.872 -11.113 199 H VAL 36 H VAL 36 9.944 -1.138 -12.791 200 HA VAL 36 HA VAL 36 8.803 -3.152 -11.156 201 HB VAL 36 HB VAL 36 7.444 -1.003 -12.788 202 HG11 VAL 36 1HG1 VAL 36 5.809 -2.648 -12.313 203 HG12 VAL 36 2HG1 VAL 36 6.400 -2.861 -10.664 204 HG13 VAL 36 3HG1 VAL 36 5.583 -1.367 -11.122 205 HG21 VAL 36 3HG2 VAL 36 7.366 -0.533 -9.988 206 HG22 VAL 36 1HG2 VAL 36 9.036 -0.871 -10.444 207 HG23 VAL 36 2HG2 VAL 36 8.149 0.427 -11.243 208 H ARG 37 H ARG 37 8.479 -2.390 -14.609 209 HA ARG 37 HA ARG 37 6.584 -4.355 -15.238 210 HB2 ARG 37 2HB ARG 37 7.172 -2.497 -16.743 211 HB3 ARG 37 3HB ARG 37 8.759 -3.210 -16.998 212 HG2 ARG 37 2HG ARG 37 7.409 -3.741 -18.880 213 HG3 ARG 37 3HG ARG 37 7.623 -5.220 -17.941 214 HD2 ARG 37 2HD ARG 37 5.247 -3.499 -17.413 215 HD3 ARG 37 3HD ARG 37 5.258 -4.519 -18.851 216 HE ARG 37 HE ARG 37 4.868 -5.367 -16.169 217 HH11 ARG 37 1HH1 ARG 37 6.287 -6.328 -19.200 218 HH12 ARG 37 2HH1 ARG 37 6.136 -8.025 -18.882 219 HH21 ARG 37 1HH2 ARG 37 4.664 -7.598 -15.739 220 HH22 ARG 37 2HH2 ARG 37 5.212 -8.746 -16.913 221 H THR 38 H THR 38 10.112 -4.471 -15.140 222 HA THR 38 HA THR 38 10.349 -7.093 -16.207 223 HB THR 38 HB THR 38 12.292 -5.563 -14.466 224 HG1 THR 38 HG1 THR 38 13.170 -4.884 -16.401 225 HG21 THR 38 3HG2 THR 38 13.707 -7.258 -16.136 226 HG22 THR 38 1HG2 THR 38 12.348 -8.242 -15.595 227 HG23 THR 38 2HG2 THR 38 13.421 -7.494 -14.412 228 H LYS 39 H LYS 39 10.109 -5.798 -12.935 229 HA LYS 39 HA LYS 39 10.677 -8.179 -11.545 230 HB2 LYS 39 2HB LYS 39 10.270 -5.618 -10.796 231 HB3 LYS 39 3HB LYS 39 8.717 -6.309 -10.345 232 HG2 LYS 39 2HG LYS 39 9.624 -7.041 -8.468 233 HG3 LYS 39 3HG LYS 39 10.686 -8.089 -9.413 234 HD2 LYS 39 2HD LYS 39 11.451 -5.233 -9.181 235 HD3 LYS 39 3HD LYS 39 11.614 -6.233 -7.735 236 HE2 LYS 39 2HE LYS 39 12.659 -7.322 -10.290 237 HE3 LYS 39 3HE LYS 39 13.556 -6.003 -9.540 238 HZ1 LYS 39 3HZ LYS 39 13.766 -7.291 -7.536 239 HZ2 LYS 39 1HZ LYS 39 14.336 -8.205 -8.840 240 HZ3 LYS 39 2HZ LYS 39 12.816 -8.536 -8.177 241 H VAL 40 H VAL 40 7.609 -6.769 -12.637 242 HA VAL 40 HA VAL 40 5.965 -8.809 -11.546 243 HB VAL 40 HB VAL 40 5.390 -6.921 -13.835 244 HG11 VAL 40 1HG1 VAL 40 3.925 -9.143 -12.864 245 HG12 VAL 40 2HG1 VAL 40 3.068 -7.679 -12.379 246 HG13 VAL 40 3HG1 VAL 40 3.445 -7.960 -14.079 247 HG21 VAL 40 3HG2 VAL 40 5.992 -5.904 -11.598 248 HG22 VAL 40 1HG2 VAL 40 4.417 -5.455 -12.253 249 HG23 VAL 40 2HG2 VAL 40 4.528 -6.654 -10.964 250 H CYS 41 H CYS 41 7.262 -8.242 -14.805 251 HA CYS 41 HA CYS 41 6.051 -10.381 -16.106 252 HB2 CYS 41 2HB CYS 41 7.440 -8.473 -17.100 253 HB3 CYS 41 3HB CYS 41 8.852 -9.448 -16.712 254 HG CYS 41 HG CYS 41 8.806 -10.808 -18.878 255 H ALA 42 H ALA 42 9.150 -10.256 -14.382 256 HA ALA 42 HA ALA 42 9.920 -12.916 -14.900 257 HB1 ALA 42 1HB ALA 42 11.230 -12.471 -12.640 258 HB2 ALA 42 2HB ALA 42 11.702 -11.708 -14.159 259 HB3 ALA 42 3HB ALA 42 10.746 -10.809 -12.981 260 H MET 43 H MET 43 8.083 -11.453 -12.252 261 HA MET 43 HA MET 43 7.920 -13.693 -10.588 262 HB2 MET 43 2HB MET 43 6.669 -11.098 -10.778 263 HB3 MET 43 3HB MET 43 5.485 -12.317 -10.328 264 HG2 MET 43 2HG MET 43 6.190 -12.114 -8.243 265 HG3 MET 43 3HG MET 43 7.700 -12.870 -8.747 266 HE1 MET 43 3HE MET 43 6.353 -10.244 -6.762 267 HE2 MET 43 1HE MET 43 7.827 -11.038 -6.210 268 HE3 MET 43 2HE MET 43 7.815 -9.296 -6.485 269 H LYS 44 H LYS 44 6.196 -12.865 -13.496 270 HA LYS 44 HA LYS 44 4.356 -15.116 -13.127 271 HB2 LYS 44 2HB LYS 44 3.436 -12.906 -13.808 272 HB3 LYS 44 3HB LYS 44 4.377 -13.004 -15.291 273 HG2 LYS 44 2HG LYS 44 2.723 -14.103 -16.258 274 HG3 LYS 44 3HG LYS 44 2.893 -15.400 -15.074 275 HD2 LYS 44 2HD LYS 44 1.409 -12.939 -14.291 276 HD3 LYS 44 3HD LYS 44 0.618 -14.098 -15.362 277 HE2 LYS 44 2HE LYS 44 0.927 -15.863 -13.744 278 HE3 LYS 44 3HE LYS 44 1.860 -14.791 -12.702 279 HZ1 LYS 44 3HZ LYS 44 -0.243 -13.367 -12.687 280 HZ2 LYS 44 1HZ LYS 44 -0.252 -14.791 -11.773 281 HZ3 LYS 44 2HZ LYS 44 -1.036 -14.742 -13.271 282 H LYS 45 H LYS 45 7.305 -14.410 -14.549 283 HA LYS 45 HA LYS 45 8.677 -15.553 -15.957 284 HB2 LYS 45 2HB LYS 45 7.572 -17.477 -14.557 285 HB3 LYS 45 3HB LYS 45 6.745 -17.839 -16.066 286 HG2 LYS 45 2HG LYS 45 9.204 -17.716 -17.026 287 HG3 LYS 45 3HG LYS 45 9.611 -18.115 -15.355 288 HD2 LYS 45 2HD LYS 45 9.229 -20.247 -15.882 289 HD3 LYS 45 3HD LYS 45 7.517 -19.830 -15.993 290 HE2 LYS 45 2HE LYS 45 7.564 -19.690 -18.290 291 HE3 LYS 45 3HE LYS 45 9.288 -19.328 -18.339 292 HZ1 LYS 45 3HZ LYS 45 9.830 -21.495 -18.345 293 HZ2 LYS 45 1HZ LYS 45 8.260 -21.708 -18.939 294 HZ3 LYS 45 2HZ LYS 45 8.582 -21.941 -17.295 295 H LEU 46 H LEU 46 7.349 -13.735 -17.273 296 HA LEU 46 HA LEU 46 6.238 -15.064 -19.655 297 HB2 LEU 46 2HB LEU 46 5.656 -12.447 -18.343 298 HB3 LEU 46 3HB LEU 46 5.397 -12.623 -20.078 299 HG LEU 46 HG LEU 46 4.092 -14.337 -17.966 300 HD11 LEU 46 1HD1 LEU 46 2.703 -12.256 -19.607 301 HD12 LEU 46 2HD1 LEU 46 3.483 -11.833 -18.083 302 HD13 LEU 46 3HD1 LEU 46 2.185 -13.026 -18.108 303 HD21 LEU 46 3HD2 LEU 46 4.335 -15.454 -20.115 304 HD22 LEU 46 1HD2 LEU 46 3.602 -14.073 -20.930 305 HD23 LEU 46 2HD2 LEU 46 2.646 -15.045 -19.811 306 HA PRO 47 HA PRO 47 9.503 -13.562 -22.173 307 HB2 PRO 47 2HB PRO 47 8.208 -12.892 -24.463 308 HB3 PRO 47 3HB PRO 47 8.460 -14.567 -23.956 309 HG2 PRO 47 2HG PRO 47 6.027 -12.847 -23.671 310 HG3 PRO 47 3HG PRO 47 6.144 -14.549 -24.158 311 HD2 PRO 47 2HD PRO 47 5.444 -13.795 -21.653 312 HD3 PRO 47 3HD PRO 47 6.347 -15.288 -21.984 313 HA PRO 48 HA PRO 48 9.230 -9.150 -21.255 314 HB2 PRO 48 2HB PRO 48 11.909 -8.731 -21.378 315 HB3 PRO 48 3HB PRO 48 11.109 -9.418 -19.960 316 HG2 PRO 48 2HG PRO 48 12.586 -10.809 -22.162 317 HG3 PRO 48 3HG PRO 48 12.647 -11.102 -20.414 318 HD2 PRO 48 2HD PRO 48 11.196 -12.645 -22.101 319 HD3 PRO 48 3HD PRO 48 10.698 -12.332 -20.425 320 H ASP 49 H ASP 49 10.782 -10.766 -23.939 321 HA ASP 49 HA ASP 49 11.468 -8.507 -25.470 322 HB2 ASP 49 2HB ASP 49 11.258 -11.397 -25.892 323 HB3 ASP 49 3HB ASP 49 10.892 -10.454 -27.335 324 H THR 50 H THR 50 8.514 -10.443 -25.316 325 HA THR 50 HA THR 50 7.184 -8.424 -27.004 326 HB THR 50 HB THR 50 5.429 -10.360 -27.235 327 HG1 THR 50 HG1 THR 50 6.526 -12.414 -27.217 328 HG21 THR 50 3HG2 THR 50 6.175 -10.467 -29.343 329 HG22 THR 50 1HG2 THR 50 7.728 -11.136 -28.844 330 HG23 THR 50 2HG2 THR 50 7.471 -9.391 -28.824 331 H THR 51 H THR 51 7.217 -7.412 -24.692 332 HA THR 51 HA THR 51 4.573 -7.923 -23.547 333 HB THR 51 HB THR 51 6.381 -9.112 -22.190 334 HG1 THR 51 HG1 THR 51 4.241 -8.391 -21.415 335 HG21 THR 51 3HG2 THR 51 7.801 -7.849 -20.785 336 HG22 THR 51 1HG2 THR 51 6.972 -6.342 -21.170 337 HG23 THR 51 2HG2 THR 51 7.972 -7.135 -22.388 338 H ARG 52 H ARG 52 3.566 -6.125 -22.688 339 HA ARG 52 HA ARG 52 5.050 -3.604 -22.634 340 HB2 ARG 52 2HB ARG 52 3.485 -4.256 -24.800 341 HB3 ARG 52 3HB ARG 52 2.376 -3.328 -23.799 342 HG2 ARG 52 2HG ARG 52 3.340 -1.728 -25.167 343 HG3 ARG 52 3HG ARG 52 4.269 -1.595 -23.673 344 HD2 ARG 52 2HD ARG 52 5.885 -3.263 -24.780 345 HD3 ARG 52 3HD ARG 52 5.064 -2.840 -26.282 346 HE ARG 52 HE ARG 52 5.941 -0.542 -24.826 347 HH11 ARG 52 1HH1 ARG 52 6.949 -3.045 -27.025 348 HH12 ARG 52 2HH1 ARG 52 8.247 -2.114 -27.695 349 HH21 ARG 52 1HH2 ARG 52 7.647 0.694 -25.701 350 HH22 ARG 52 2HH2 ARG 52 8.644 0.012 -26.941 351 H LEU 53 H LEU 53 3.818 -1.855 -21.565 352 HA LEU 53 HA LEU 53 1.742 -2.840 -19.738 353 HB2 LEU 53 2HB LEU 53 3.554 -2.941 -18.308 354 HB3 LEU 53 3HB LEU 53 4.343 -1.548 -19.045 355 HG LEU 53 HG LEU 53 2.723 -0.063 -17.962 356 HD11 LEU 53 1HD1 LEU 53 1.202 -2.385 -17.695 357 HD12 LEU 53 2HD1 LEU 53 0.820 -0.780 -17.075 358 HD13 LEU 53 3HD1 LEU 53 1.668 -1.941 -16.053 359 HD21 LEU 53 3HD2 LEU 53 3.753 -0.068 -15.902 360 HD22 LEU 53 1HD2 LEU 53 4.894 -1.004 -16.867 361 HD23 LEU 53 2HD2 LEU 53 3.766 -1.829 -15.791 362 H THR 54 H THR 54 0.094 -1.456 -19.399 363 HA THR 54 HA THR 54 0.397 1.308 -20.372 364 HB THR 54 HB THR 54 -2.326 0.532 -20.638 365 HG1 THR 54 HG1 THR 54 -1.871 -1.102 -22.351 366 HG21 THR 54 3HG2 THR 54 -1.936 1.096 -22.998 367 HG22 THR 54 1HG2 THR 54 -0.197 1.091 -22.707 368 HG23 THR 54 2HG2 THR 54 -1.220 2.291 -21.917 369 H TYR 55 H TYR 55 -0.134 2.814 -18.932 370 HA TYR 55 HA TYR 55 -1.930 2.071 -16.719 371 HB2 TYR 55 2HB TYR 55 0.284 2.163 -15.799 372 HB3 TYR 55 3HB TYR 55 0.616 3.692 -16.605 373 HD1 TYR 55 HD2 TYR 55 -2.201 2.473 -14.465 374 HD2 TYR 55 HD1 TYR 55 0.843 5.386 -15.059 375 HE1 TYR 55 HE2 TYR 55 -2.981 3.687 -12.474 376 HE2 TYR 55 HE1 TYR 55 0.072 6.607 -13.068 377 HH TYR 55 HH TYR 55 -1.227 6.457 -11.205 378 H LYS 56 H LYS 56 -3.635 3.355 -16.466 379 HA LYS 56 HA LYS 56 -5.120 5.050 -16.781 380 HB2 LYS 56 2HB LYS 56 -2.953 6.149 -15.619 381 HB3 LYS 56 3HB LYS 56 -2.986 7.083 -17.108 382 HG2 LYS 56 2HG LYS 56 -5.550 6.815 -15.671 383 HG3 LYS 56 3HG LYS 56 -4.303 7.796 -14.897 384 HD2 LYS 56 2HD LYS 56 -4.955 9.474 -16.210 385 HD3 LYS 56 3HD LYS 56 -4.255 8.582 -17.563 386 HE2 LYS 56 2HE LYS 56 -6.347 7.587 -18.094 387 HE3 LYS 56 3HE LYS 56 -7.073 8.156 -16.592 388 HZ1 LYS 56 3HZ LYS 56 -6.403 10.471 -17.603 389 HZ2 LYS 56 1HZ LYS 56 -7.856 9.714 -18.027 390 HZ3 LYS 56 2HZ LYS 56 -6.521 9.622 -19.062 391 H GLY 57 H GLY 57 -4.148 3.663 -19.124 392 HA2 GLY 57 2HA GLY 57 -4.565 3.808 -21.387 393 HA3 GLY 57 3HA GLY 57 -5.188 5.429 -21.118 394 H ARG 58 H ARG 58 -2.123 5.135 -19.803 395 HA ARG 58 HA ARG 58 -0.866 6.163 -22.261 396 HB2 ARG 58 2HB ARG 58 -1.153 7.424 -19.654 397 HB3 ARG 58 3HB ARG 58 0.531 7.313 -20.149 398 HG2 ARG 58 2HG ARG 58 -1.486 8.341 -22.085 399 HG3 ARG 58 3HG ARG 58 -0.913 9.390 -20.787 400 HD2 ARG 58 2HD ARG 58 1.135 7.912 -22.333 401 HD3 ARG 58 3HD ARG 58 0.297 9.221 -23.164 402 HE ARG 58 HE ARG 58 1.068 10.287 -20.763 403 HH11 ARG 58 1HH1 ARG 58 2.685 8.748 -23.435 404 HH12 ARG 58 2HH1 ARG 58 4.163 9.624 -23.214 405 HH21 ARG 58 1HH2 ARG 58 3.009 11.447 -20.462 406 HH22 ARG 58 2HH2 ARG 58 4.347 11.158 -21.523 407 H ALA 59 H ALA 59 1.390 5.771 -22.484 408 HA ALA 59 HA ALA 59 2.240 3.328 -21.121 409 HB1 ALA 59 1HB ALA 59 2.604 2.894 -23.313 410 HB2 ALA 59 2HB ALA 59 2.841 4.593 -23.725 411 HB3 ALA 59 3HB ALA 59 4.144 3.680 -22.965 412 H LEU 60 H LEU 60 4.269 3.121 -20.130 413 HA LEU 60 HA LEU 60 5.711 5.623 -19.590 414 HB2 LEU 60 2HB LEU 60 5.030 3.537 -17.524 415 HB3 LEU 60 3HB LEU 60 5.957 5.011 -17.253 416 HG LEU 60 HG LEU 60 3.117 5.135 -18.205 417 HD11 LEU 60 1HD1 LEU 60 2.645 3.953 -16.317 418 HD12 LEU 60 2HD1 LEU 60 2.763 5.569 -15.622 419 HD13 LEU 60 3HD1 LEU 60 4.123 4.454 -15.496 420 HD21 LEU 60 3HD2 LEU 60 3.285 7.281 -16.846 421 HD22 LEU 60 1HD2 LEU 60 4.203 7.212 -18.351 422 HD23 LEU 60 2HD2 LEU 60 5.024 6.988 -16.806 423 H LYS 61 H LYS 61 7.927 5.372 -19.030 424 HA LYS 61 HA LYS 61 9.220 2.854 -18.918 425 HB2 LYS 61 2HB LYS 61 8.740 2.713 -21.273 426 HB3 LYS 61 3HB LYS 61 9.337 4.345 -21.542 427 HG2 LYS 61 2HG LYS 61 11.497 3.699 -21.568 428 HG3 LYS 61 3HG LYS 61 11.252 2.448 -20.347 429 HD2 LYS 61 2HD LYS 61 10.096 2.130 -23.090 430 HD3 LYS 61 3HD LYS 61 11.796 1.760 -22.792 431 HE2 LYS 61 2HE LYS 61 10.242 0.571 -20.728 432 HE3 LYS 61 3HE LYS 61 9.513 0.153 -22.278 433 HZ1 LYS 61 3HZ LYS 61 11.303 -1.382 -21.421 434 HZ2 LYS 61 1HZ LYS 61 12.412 -0.152 -21.765 435 HZ3 LYS 61 2HZ LYS 61 11.494 -0.835 -23.011 436 H ASP 62 H ASP 62 10.275 5.800 -20.594 437 HA ASP 62 HA ASP 62 12.614 5.988 -18.946 438 HB2 ASP 62 2HB ASP 62 11.774 7.013 -21.453 439 HB3 ASP 62 3HB ASP 62 12.156 8.396 -20.430 440 H THR 63 H THR 63 9.463 6.850 -18.438 441 HA THR 63 HA THR 63 9.584 9.407 -17.322 442 HB THR 63 HB THR 63 7.789 7.506 -15.952 443 HG1 THR 63 HG1 THR 63 6.496 7.655 -18.079 444 HG21 THR 63 3HG2 THR 63 7.326 9.778 -15.603 445 HG22 THR 63 1HG2 THR 63 6.133 9.276 -16.801 446 HG23 THR 63 2HG2 THR 63 7.562 10.180 -17.304 447 H GLU 64 H GLU 64 10.860 6.443 -16.185 448 HA GLU 64 HA GLU 64 12.027 5.872 -14.318 449 HB2 GLU 64 2HB GLU 64 13.330 7.857 -14.675 450 HB3 GLU 64 3HB GLU 64 12.073 8.871 -13.982 451 HG2 GLU 64 2HG GLU 64 12.957 8.655 -11.972 452 HG3 GLU 64 3HG GLU 64 12.825 6.900 -12.068 453 H THR 65 H THR 65 10.529 8.708 -12.846 454 HA THR 65 HA THR 65 9.184 6.924 -10.941 455 HB THR 65 HB THR 65 9.126 8.724 -9.390 456 HG1 THR 65 HG1 THR 65 10.020 10.399 -11.520 457 HG21 THR 65 3HG2 THR 65 11.475 7.690 -10.296 458 HG22 THR 65 1HG2 THR 65 11.324 8.745 -8.891 459 HG23 THR 65 2HG2 THR 65 11.774 9.420 -10.457 460 H LEU 66 H LEU 66 7.027 7.524 -10.191 461 HA LEU 66 HA LEU 66 5.445 8.799 -12.325 462 HB2 LEU 66 2HB LEU 66 5.268 6.217 -11.459 463 HB3 LEU 66 3HB LEU 66 4.033 7.010 -10.483 464 HG LEU 66 HG LEU 66 4.169 6.879 -13.492 465 HD11 LEU 66 1HD1 LEU 66 2.523 5.326 -13.408 466 HD12 LEU 66 2HD1 LEU 66 1.832 5.973 -11.921 467 HD13 LEU 66 3HD1 LEU 66 3.281 4.972 -11.856 468 HD21 LEU 66 3HD2 LEU 66 3.380 9.080 -12.746 469 HD22 LEU 66 1HD2 LEU 66 2.160 8.295 -11.743 470 HD23 LEU 66 2HD2 LEU 66 2.091 8.139 -13.498 471 H GLU 67 H GLU 67 6.182 8.690 -8.952 472 HA GLU 67 HA GLU 67 3.945 9.956 -7.865 473 HB2 GLU 67 2HB GLU 67 5.984 8.908 -6.683 474 HB3 GLU 67 3HB GLU 67 6.743 10.480 -6.895 475 HG2 GLU 67 2HG GLU 67 4.063 10.605 -5.741 476 HG3 GLU 67 3HG GLU 67 5.234 9.730 -4.756 477 H SER 68 H SER 68 6.593 11.217 -9.727 478 HA SER 68 HA SER 68 6.374 13.937 -9.028 479 HB2 SER 68 2HB SER 68 8.344 13.298 -10.173 480 HB3 SER 68 3HB SER 68 7.436 12.527 -11.473 481 HG SER 68 HG SER 68 7.722 15.292 -10.937 482 H LEU 69 H LEU 69 4.453 11.899 -11.041 483 HA LEU 69 HA LEU 69 3.100 14.196 -12.255 484 HB2 LEU 69 2HB LEU 69 2.451 11.331 -12.826 485 HB3 LEU 69 3HB LEU 69 2.225 12.745 -13.852 486 HG LEU 69 HG LEU 69 4.839 11.379 -13.218 487 HD11 LEU 69 1HD1 LEU 69 3.017 10.512 -14.952 488 HD12 LEU 69 2HD1 LEU 69 4.748 10.410 -15.266 489 HD13 LEU 69 3HD1 LEU 69 3.800 11.720 -15.970 490 HD21 LEU 69 3HD2 LEU 69 5.742 13.388 -13.598 491 HD22 LEU 69 1HD2 LEU 69 4.229 14.053 -14.214 492 HD23 LEU 69 2HD2 LEU 69 5.286 13.129 -15.283 493 H GLY 70 H GLY 70 2.804 12.035 -9.667 494 HA2 GLY 70 2HA GLY 70 1.125 12.453 -7.992 495 HA3 GLY 70 3HA GLY 70 0.012 12.892 -9.280 496 H VAL 71 H VAL 71 2.000 10.089 -8.320 497 HA VAL 71 HA VAL 71 -0.058 8.295 -9.340 498 HB VAL 71 HB VAL 71 2.354 7.856 -9.802 499 HG11 VAL 71 1HG1 VAL 71 2.756 8.461 -7.184 500 HG12 VAL 71 2HG1 VAL 71 2.813 6.698 -7.145 501 HG13 VAL 71 3HG1 VAL 71 3.907 7.595 -8.200 502 HG21 VAL 71 3HG2 VAL 71 1.373 5.567 -8.164 503 HG22 VAL 71 1HG2 VAL 71 0.413 6.105 -9.543 504 HG23 VAL 71 2HG2 VAL 71 2.079 5.577 -9.781 505 H ALA 72 H ALA 72 -1.269 6.918 -8.104 506 HA ALA 72 HA ALA 72 -1.128 7.332 -5.189 507 HB1 ALA 72 1HB ALA 72 -3.460 7.108 -5.043 508 HB2 ALA 72 2HB ALA 72 -3.189 8.139 -6.449 509 HB3 ALA 72 3HB ALA 72 -3.583 6.434 -6.669 510 H ASP 73 H ASP 73 -1.363 5.560 -3.817 511 HA ASP 73 HA ASP 73 -0.399 3.074 -4.884 512 HB2 ASP 73 2HB ASP 73 -0.632 2.319 -2.470 513 HB3 ASP 73 3HB ASP 73 0.449 3.682 -2.749 514 H GLY 74 H GLY 74 -1.583 1.437 -5.610 515 HA2 GLY 74 2HA GLY 74 -3.359 -0.169 -5.205 516 HA3 GLY 74 3HA GLY 74 -4.348 1.159 -4.617 517 H ASP 75 H ASP 75 -2.378 1.383 -7.500 518 HA ASP 75 HA ASP 75 -4.784 1.889 -9.062 519 HB2 ASP 75 2HB ASP 75 -1.843 2.273 -9.611 520 HB3 ASP 75 3HB ASP 75 -3.069 2.489 -10.857 521 H LYS 76 H LYS 76 -5.042 0.926 -11.201 522 HA LYS 76 HA LYS 76 -4.174 -1.882 -11.197 523 HB2 LYS 76 2HB LYS 76 -6.097 -2.278 -12.700 524 HB3 LYS 76 3HB LYS 76 -6.582 -1.608 -11.148 525 HG2 LYS 76 2HG LYS 76 -6.732 0.621 -12.196 526 HG3 LYS 76 3HG LYS 76 -6.342 -0.115 -13.752 527 HD2 LYS 76 2HD LYS 76 -8.560 -1.369 -12.274 528 HD3 LYS 76 3HD LYS 76 -8.861 0.274 -12.846 529 HE2 LYS 76 2HE LYS 76 -8.806 -0.333 -15.035 530 HE3 LYS 76 3HE LYS 76 -7.618 -1.607 -14.764 531 HZ1 LYS 76 3HZ LYS 76 -10.448 -1.798 -14.901 532 HZ2 LYS 76 1HZ LYS 76 -9.882 -2.420 -13.433 533 HZ3 LYS 76 2HZ LYS 76 -9.292 -3.033 -14.894 534 H PHE 77 H PHE 77 -2.853 -2.616 -12.735 535 HA PHE 77 HA PHE 77 -2.295 -0.854 -15.026 536 HB2 PHE 77 2HB PHE 77 -0.530 -2.839 -13.589 537 HB3 PHE 77 3HB PHE 77 -0.094 -2.094 -15.124 538 HD1 PHE 77 HD2 PHE 77 -0.841 -1.400 -11.575 539 HD2 PHE 77 HD1 PHE 77 0.786 0.087 -15.216 540 HE1 PHE 77 HE2 PHE 77 0.087 0.532 -10.367 541 HE2 PHE 77 HE1 PHE 77 1.718 2.021 -14.013 542 HZ PHE 77 HZ PHE 77 1.368 2.246 -11.586 543 H VAL 78 H VAL 78 -2.006 -1.777 -17.089 544 HA VAL 78 HA VAL 78 -3.323 -4.391 -17.400 545 HB VAL 78 HB VAL 78 -3.026 -2.178 -19.436 546 HG11 VAL 78 1HG1 VAL 78 -4.553 -4.777 -19.549 547 HG12 VAL 78 2HG1 VAL 78 -4.609 -3.501 -20.768 548 HG13 VAL 78 3HG1 VAL 78 -3.105 -4.375 -20.472 549 HG21 VAL 78 3HG2 VAL 78 -5.732 -2.739 -18.788 550 HG22 VAL 78 1HG2 VAL 78 -4.852 -2.478 -17.282 551 HG23 VAL 78 2HG2 VAL 78 -4.831 -1.243 -18.542 552 H LEU 79 H LEU 79 -2.114 -6.050 -18.015 553 HA LEU 79 HA LEU 79 0.503 -5.511 -19.239 554 HB2 LEU 79 2HB LEU 79 0.837 -6.734 -17.281 555 HB3 LEU 79 3HB LEU 79 -0.565 -7.761 -17.575 556 HG LEU 79 HG LEU 79 0.628 -8.950 -19.315 557 HD11 LEU 79 1HD1 LEU 79 2.427 -6.669 -19.111 558 HD12 LEU 79 2HD1 LEU 79 2.169 -7.797 -20.441 559 HD13 LEU 79 3HD1 LEU 79 3.267 -8.220 -19.128 560 HD21 LEU 79 3HD2 LEU 79 2.651 -8.869 -17.143 561 HD22 LEU 79 1HD2 LEU 79 1.867 -10.249 -17.913 562 HD23 LEU 79 2HD2 LEU 79 0.994 -9.296 -16.713 563 H ILE 80 H ILE 80 0.862 -6.054 -21.289 564 HA ILE 80 HA ILE 80 -1.042 -7.886 -22.597 565 HB ILE 80 HB ILE 80 -0.765 -6.689 -24.658 566 HG12 ILE 80 2HG1 ILE 80 0.637 -4.353 -23.995 567 HG13 ILE 80 3HG1 ILE 80 1.599 -5.669 -23.333 568 HG21 ILE 80 1HG2 ILE 80 -2.337 -5.831 -22.854 569 HG22 ILE 80 2HG2 ILE 80 -1.146 -4.564 -22.570 570 HG23 ILE 80 3HG2 ILE 80 -1.922 -4.706 -24.147 571 HD11 ILE 80 3HD1 ILE 80 2.191 -6.429 -25.363 572 HD12 ILE 80 1HD1 ILE 80 0.627 -6.049 -26.084 573 HD13 ILE 80 2HD1 ILE 80 1.823 -4.774 -25.847 574 H THR 81 H THR 81 -0.246 -9.386 -24.070 575 HA THR 81 HA THR 81 2.684 -9.675 -24.165 576 HB THR 81 HB THR 81 1.762 -11.311 -22.579 577 HG1 THR 81 HG1 THR 81 3.510 -11.790 -24.236 578 HG21 THR 81 3HG2 THR 81 0.264 -12.468 -24.928 579 HG22 THR 81 1HG2 THR 81 -0.483 -11.476 -23.676 580 HG23 THR 81 2HG2 THR 81 0.236 -13.031 -23.258 581 H ARG 82 H ARG 82 3.524 -9.997 -26.134 582 HA ARG 82 HA ARG 82 1.661 -10.311 -28.374 583 HB2 ARG 82 2HB ARG 82 4.127 -8.839 -27.954 584 HB3 ARG 82 3HB ARG 82 4.209 -9.830 -29.405 585 HG2 ARG 82 2HG ARG 82 2.131 -8.798 -30.208 586 HG3 ARG 82 3HG ARG 82 2.100 -7.778 -28.769 587 HD2 ARG 82 2HD ARG 82 4.560 -7.211 -29.599 588 HD3 ARG 82 3HD ARG 82 3.861 -7.659 -31.154 589 HE ARG 82 HE ARG 82 3.340 -5.280 -29.653 590 HH11 ARG 82 1HH1 ARG 82 1.993 -7.532 -31.941 591 HH12 ARG 82 2HH1 ARG 82 0.881 -6.385 -32.613 592 HH21 ARG 82 1HH2 ARG 82 1.881 -3.761 -30.529 593 HH22 ARG 82 2HH2 ARG 82 0.819 -4.240 -31.809 594 H THR 83 H THR 83 1.801 -11.965 -29.825 595 HA THR 83 HA THR 83 3.200 -14.331 -28.959 596 HB THR 83 HB THR 83 0.913 -14.463 -29.898 597 HG1 THR 83 HG1 THR 83 2.562 -15.849 -31.710 598 HG21 THR 83 3HG2 THR 83 0.460 -14.101 -32.199 599 HG22 THR 83 1HG2 THR 83 2.171 -13.911 -32.580 600 HG23 THR 83 2HG2 THR 83 1.333 -12.675 -31.641 601 H VAL 84 H VAL 84 4.743 -15.496 -30.157 602 HA VAL 84 HA VAL 84 6.201 -13.885 -32.151 603 HB VAL 84 HB VAL 84 7.380 -15.944 -30.281 604 HG11 VAL 84 1HG1 VAL 84 8.702 -15.851 -32.232 605 HG12 VAL 84 2HG1 VAL 84 8.571 -14.094 -32.332 606 HG13 VAL 84 3HG1 VAL 84 9.528 -14.837 -31.049 607 HG21 VAL 84 3HG2 VAL 84 6.704 -14.066 -28.966 608 HG22 VAL 84 1HG2 VAL 84 8.449 -13.959 -29.198 609 HG23 VAL 84 2HG2 VAL 84 7.369 -12.933 -30.142 610 H GLY 85 H GLY 85 5.032 -17.073 -31.255 611 HA2 GLY 85 2HA GLY 85 4.811 -19.020 -32.454 612 HA3 GLY 85 3HA GLY 85 4.576 -17.959 -33.835 Start of MODEL 9 1 H1 MET 9 H MET 9 0.477 0.967 -0.633 2 HA MET 9 HA MET 9 1.987 0.859 -2.329 3 HB2 MET 9 2HB MET 9 4.215 -0.056 -1.841 4 HB3 MET 9 3HB MET 9 3.655 1.006 -0.556 5 HG2 MET 9 2HG MET 9 2.896 -1.717 -0.029 6 HG3 MET 9 3HG MET 9 4.630 -1.590 -0.310 7 HE1 MET 9 3HE MET 9 3.033 -1.736 3.390 8 HE2 MET 9 1HE MET 9 1.887 -0.532 2.801 9 HE3 MET 9 2HE MET 9 2.197 -1.989 1.857 10 H LYS 10 H LYS 10 -0.071 -0.832 -2.640 11 HA LYS 10 HA LYS 10 1.172 -3.304 -3.656 12 HB2 LYS 10 2HB LYS 10 -1.339 -2.831 -2.168 13 HB3 LYS 10 3HB LYS 10 -1.452 -3.961 -3.511 14 HG2 LYS 10 2HG LYS 10 0.868 -4.453 -1.833 15 HG3 LYS 10 3HG LYS 10 -0.655 -4.553 -0.946 16 HD2 LYS 10 2HD LYS 10 -1.513 -6.173 -2.516 17 HD3 LYS 10 3HD LYS 10 -0.078 -6.001 -3.530 18 HE2 LYS 10 2HE LYS 10 1.047 -7.479 -2.306 19 HE3 LYS 10 3HE LYS 10 0.651 -6.630 -0.813 20 HZ1 LYS 10 3HZ LYS 10 -1.207 -8.497 -2.176 21 HZ2 LYS 10 1HZ LYS 10 -1.376 -7.824 -0.633 22 HZ3 LYS 10 2HZ LYS 10 -0.161 -8.963 -0.930 23 H ILE 11 H ILE 11 0.817 -3.869 -5.746 24 HA ILE 11 HA ILE 11 -0.991 -2.161 -7.323 25 HB ILE 11 HB ILE 11 0.617 -2.375 -9.221 26 HG12 ILE 11 2HG1 ILE 11 2.750 -3.071 -7.241 27 HG13 ILE 11 3HG1 ILE 11 1.781 -4.366 -7.937 28 HG21 ILE 11 1HG2 ILE 11 0.686 -0.287 -8.249 29 HG22 ILE 11 2HG2 ILE 11 1.271 -0.907 -6.706 30 HG23 ILE 11 3HG2 ILE 11 2.363 -0.807 -8.087 31 HD11 ILE 11 3HD1 ILE 11 3.673 -4.227 -9.291 32 HD12 ILE 11 1HD1 ILE 11 2.415 -3.390 -10.200 33 HD13 ILE 11 2HD1 ILE 11 3.633 -2.465 -9.322 34 H LYS 12 H LYS 12 -2.118 -3.138 -8.983 35 HA LYS 12 HA LYS 12 -1.926 -6.077 -9.094 36 HB2 LYS 12 2HB LYS 12 -4.129 -4.451 -8.413 37 HB3 LYS 12 3HB LYS 12 -4.472 -5.097 -10.012 38 HG2 LYS 12 2HG LYS 12 -4.351 -7.322 -9.254 39 HG3 LYS 12 3HG LYS 12 -3.604 -6.841 -7.728 40 HD2 LYS 12 2HD LYS 12 -5.584 -6.161 -6.815 41 HD3 LYS 12 3HD LYS 12 -6.278 -5.719 -8.377 42 HE2 LYS 12 2HE LYS 12 -6.943 -7.873 -8.839 43 HE3 LYS 12 3HE LYS 12 -5.713 -8.590 -7.800 44 HZ1 LYS 12 3HZ LYS 12 -7.641 -6.972 -6.396 45 HZ2 LYS 12 1HZ LYS 12 -7.060 -8.520 -6.037 46 HZ3 LYS 12 2HZ LYS 12 -8.314 -8.326 -7.155 47 H ILE 13 H ILE 13 -1.177 -6.798 -10.965 48 HA ILE 13 HA ILE 13 -1.698 -5.215 -13.396 49 HB ILE 13 HB ILE 13 0.574 -7.160 -13.009 50 HG12 ILE 13 2HG1 ILE 13 1.800 -4.764 -13.064 51 HG13 ILE 13 3HG1 ILE 13 0.300 -4.298 -12.269 52 HG21 ILE 13 1HG2 ILE 13 -0.254 -5.264 -15.159 53 HG22 ILE 13 2HG2 ILE 13 1.453 -5.643 -14.939 54 HG23 ILE 13 3HG2 ILE 13 0.301 -6.932 -15.285 55 HD11 ILE 13 3HD1 ILE 13 1.521 -6.714 -11.176 56 HD12 ILE 13 1HD1 ILE 13 2.512 -5.264 -11.019 57 HD13 ILE 13 2HD1 ILE 13 0.877 -5.291 -10.358 58 H VAL 14 H VAL 14 -3.187 -6.108 -14.650 59 HA VAL 14 HA VAL 14 -3.551 -9.019 -14.605 60 HB VAL 14 HB VAL 14 -5.585 -7.824 -14.174 61 HG11 VAL 14 1HG1 VAL 14 -6.136 -6.473 -16.589 62 HG12 VAL 14 2HG1 VAL 14 -5.900 -5.781 -14.983 63 HG13 VAL 14 3HG1 VAL 14 -4.526 -5.972 -16.072 64 HG21 VAL 14 3HG2 VAL 14 -6.947 -8.968 -15.613 65 HG22 VAL 14 1HG2 VAL 14 -5.992 -8.538 -17.032 66 HG23 VAL 14 2HG2 VAL 14 -5.420 -9.791 -15.930 67 HA PRO 15 HA PRO 15 -1.359 -8.966 -18.525 68 HB2 PRO 15 2HB PRO 15 -1.218 -11.668 -18.746 69 HB3 PRO 15 3HB PRO 15 -0.132 -10.731 -17.714 70 HG2 PRO 15 2HG PRO 15 -2.590 -12.270 -16.972 71 HG3 PRO 15 3HG PRO 15 -1.026 -12.192 -16.141 72 HD2 PRO 15 2HD PRO 15 -3.181 -10.769 -15.327 73 HD3 PRO 15 3HD PRO 15 -1.519 -10.176 -15.136 74 H ALA 16 H ALA 16 -2.034 -9.148 -20.611 75 HA ALA 16 HA ALA 16 -4.821 -9.640 -21.083 76 HB1 ALA 16 1HB ALA 16 -2.734 -9.209 -23.201 77 HB2 ALA 16 2HB ALA 16 -4.455 -8.828 -23.260 78 HB3 ALA 16 3HB ALA 16 -3.379 -7.887 -22.228 79 H VAL 17 H VAL 17 -4.245 -11.960 -20.157 80 HA VAL 17 HA VAL 17 -3.637 -13.728 -22.433 81 HB VAL 17 HB VAL 17 -2.189 -13.890 -20.356 82 HG11 VAL 17 1HG1 VAL 17 -2.996 -14.665 -18.360 83 HG12 VAL 17 2HG1 VAL 17 -4.395 -13.746 -18.919 84 HG13 VAL 17 3HG1 VAL 17 -4.357 -15.500 -19.108 85 HG21 VAL 17 3HG2 VAL 17 -3.434 -16.545 -20.671 86 HG22 VAL 17 1HG2 VAL 17 -2.912 -15.754 -22.158 87 HG23 VAL 17 2HG2 VAL 17 -1.753 -16.049 -20.862 88 H GLY 18 H GLY 18 -4.849 -15.769 -22.527 89 HA2 GLY 18 2HA GLY 18 -7.566 -15.452 -22.708 90 HA3 GLY 18 3HA GLY 18 -6.787 -17.011 -22.484 91 H GLY 19 H GLY 19 -5.747 -16.613 -19.896 92 HA2 GLY 19 2HA GLY 19 -7.988 -17.320 -18.332 93 HA3 GLY 19 3HA GLY 19 -6.383 -16.954 -17.717 94 H GLY 20 H GLY 20 -6.260 -14.268 -18.726 95 HA2 GLY 20 2HA GLY 20 -6.706 -12.156 -17.940 96 HA3 GLY 20 3HA GLY 20 -8.392 -12.628 -18.094 97 H SER 21 H SER 21 -5.630 -13.150 -15.900 98 HA SER 21 HA SER 21 -7.477 -12.704 -13.649 99 HB2 SER 21 2HB SER 21 -6.082 -14.360 -12.358 100 HB3 SER 21 3HB SER 21 -7.026 -15.064 -13.671 101 HG SER 21 HG SER 21 -5.223 -15.366 -14.831 102 HA PRO 22 HA PRO 22 -4.538 -9.526 -12.678 103 HB2 PRO 22 2HB PRO 22 -5.624 -8.820 -10.292 104 HB3 PRO 22 3HB PRO 22 -6.328 -8.352 -11.845 105 HG2 PRO 22 2HG PRO 22 -7.105 -10.585 -10.008 106 HG3 PRO 22 3HG PRO 22 -8.143 -9.450 -10.891 107 HD2 PRO 22 2HD PRO 22 -7.688 -11.977 -11.750 108 HD3 PRO 22 3HD PRO 22 -7.962 -10.624 -12.866 109 H LEU 23 H LEU 23 -2.635 -9.489 -11.614 110 HA LEU 23 HA LEU 23 -2.210 -11.513 -9.516 111 HB2 LEU 23 2HB LEU 23 -0.927 -11.992 -11.505 112 HB3 LEU 23 3HB LEU 23 -0.271 -10.356 -11.512 113 HG LEU 23 HG LEU 23 0.661 -11.080 -9.155 114 HD11 LEU 23 1HD1 LEU 23 1.043 -13.725 -10.357 115 HD12 LEU 23 2HD1 LEU 23 -0.595 -13.402 -9.789 116 HD13 LEU 23 3HD1 LEU 23 0.767 -13.266 -8.677 117 HD21 LEU 23 3HD2 LEU 23 2.441 -12.364 -10.900 118 HD22 LEU 23 1HD2 LEU 23 2.493 -10.691 -10.345 119 HD23 LEU 23 2HD2 LEU 23 1.660 -11.096 -11.845 120 H GLU 24 H GLU 24 -1.594 -10.844 -7.558 121 HA GLU 24 HA GLU 24 -1.199 -7.993 -7.133 122 HB2 GLU 24 2HB GLU 24 -1.499 -10.280 -5.179 123 HB3 GLU 24 3HB GLU 24 -1.338 -8.590 -4.722 124 HG2 GLU 24 2HG GLU 24 -3.472 -8.119 -5.207 125 HG3 GLU 24 3HG GLU 24 -3.478 -9.135 -6.647 126 H LEU 25 H LEU 25 0.716 -7.071 -6.805 127 HA LEU 25 HA LEU 25 2.942 -8.653 -5.775 128 HB2 LEU 25 2HB LEU 25 2.657 -7.926 -8.512 129 HB3 LEU 25 3HB LEU 25 3.992 -7.002 -7.828 130 HG LEU 25 HG LEU 25 3.725 -10.006 -7.911 131 HD11 LEU 25 1HD1 LEU 25 4.406 -9.367 -10.027 132 HD12 LEU 25 2HD1 LEU 25 5.940 -9.632 -9.197 133 HD13 LEU 25 3HD1 LEU 25 5.334 -7.992 -9.427 134 HD21 LEU 25 3HD2 LEU 25 5.775 -8.231 -6.604 135 HD22 LEU 25 1HD2 LEU 25 6.064 -9.928 -6.987 136 HD23 LEU 25 2HD2 LEU 25 4.787 -9.486 -5.854 137 H GLU 26 H GLU 26 4.762 -7.322 -5.074 138 HA GLU 26 HA GLU 26 3.841 -4.675 -4.192 139 HB2 GLU 26 2HB GLU 26 6.099 -6.340 -3.071 140 HB3 GLU 26 3HB GLU 26 5.450 -4.857 -2.387 141 HG2 GLU 26 2HG GLU 26 3.356 -5.941 -1.903 142 HG3 GLU 26 3HG GLU 26 3.897 -7.414 -2.706 143 H VAL 27 H VAL 27 4.510 -3.139 -5.551 144 HA VAL 27 HA VAL 27 7.373 -2.969 -6.135 145 HB VAL 27 HB VAL 27 5.353 -2.444 -8.304 146 HG11 VAL 27 1HG1 VAL 27 7.446 -2.828 -9.704 147 HG12 VAL 27 2HG1 VAL 27 7.379 -1.342 -8.756 148 HG13 VAL 27 3HG1 VAL 27 8.343 -2.706 -8.191 149 HG21 VAL 27 3HG2 VAL 27 5.072 -4.753 -7.877 150 HG22 VAL 27 1HG2 VAL 27 6.162 -4.645 -9.259 151 HG23 VAL 27 2HG2 VAL 27 6.804 -4.999 -7.655 152 H ALA 28 H ALA 28 8.059 -0.825 -6.794 153 HA ALA 28 HA ALA 28 6.238 1.271 -5.804 154 HB1 ALA 28 1HB ALA 28 7.851 1.904 -4.422 155 HB2 ALA 28 2HB ALA 28 8.888 0.611 -5.026 156 HB3 ALA 28 3HB ALA 28 8.918 2.198 -5.795 157 HA PRO 29 HA PRO 29 6.451 2.617 -10.070 158 HB2 PRO 29 2HB PRO 29 4.660 4.637 -9.779 159 HB3 PRO 29 3HB PRO 29 4.181 2.942 -9.933 160 HG2 PRO 29 2HG PRO 29 4.438 4.622 -7.468 161 HG3 PRO 29 3HG PRO 29 3.165 3.470 -7.909 162 HD2 PRO 29 2HD PRO 29 5.160 2.849 -6.187 163 HD3 PRO 29 3HD PRO 29 4.417 1.646 -7.261 164 H ASN 30 H ASN 30 7.311 4.275 -7.204 165 HA ASN 30 HA ASN 30 8.162 6.698 -8.552 166 HB2 ASN 30 2HB ASN 30 9.020 7.311 -6.261 167 HB3 ASN 30 3HB ASN 30 7.288 7.005 -6.346 168 HD21 ASN 30 1HD2 ASN 30 6.470 5.704 -4.875 169 HD22 ASN 30 2HD2 ASN 30 7.352 4.560 -3.927 170 H ALA 31 H ALA 31 9.347 3.774 -8.726 171 HA ALA 31 HA ALA 31 12.155 4.495 -8.261 172 HB1 ALA 31 1HB ALA 31 12.055 2.476 -7.272 173 HB2 ALA 31 2HB ALA 31 10.646 1.970 -8.206 174 HB3 ALA 31 3HB ALA 31 12.256 1.879 -8.920 175 H THR 32 H THR 32 10.694 2.262 -10.599 176 HA THR 32 HA THR 32 11.497 3.882 -12.849 177 HB THR 32 HB THR 32 12.687 1.398 -13.460 178 HG1 THR 32 HG1 THR 32 12.769 1.324 -11.026 179 HG21 THR 32 3HG2 THR 32 14.804 2.998 -13.162 180 HG22 THR 32 1HG2 THR 32 13.535 4.220 -13.116 181 HG23 THR 32 2HG2 THR 32 13.683 3.156 -14.514 182 H VAL 33 H VAL 33 10.467 3.312 -14.739 183 HA VAL 33 HA VAL 33 8.118 1.738 -14.501 184 HB VAL 33 HB VAL 33 9.422 2.778 -17.021 185 HG11 VAL 33 1HG1 VAL 33 7.042 1.208 -16.525 186 HG12 VAL 33 2HG1 VAL 33 6.665 2.730 -17.335 187 HG13 VAL 33 3HG1 VAL 33 7.828 1.613 -18.050 188 HG21 VAL 33 3HG2 VAL 33 7.524 4.037 -15.065 189 HG22 VAL 33 1HG2 VAL 33 9.044 4.671 -15.694 190 HG23 VAL 33 2HG2 VAL 33 7.627 4.579 -16.740 191 H GLY 34 H GLY 34 11.192 1.241 -16.220 192 HA2 GLY 34 2HA GLY 34 10.527 -1.237 -17.379 193 HA3 GLY 34 3HA GLY 34 12.158 -0.654 -17.082 194 H ALA 35 H ALA 35 11.779 -0.414 -14.205 195 HA ALA 35 HA ALA 35 12.584 -3.014 -13.446 196 HB1 ALA 35 1HB ALA 35 12.744 -2.167 -11.231 197 HB2 ALA 35 2HB ALA 35 13.236 -0.868 -12.318 198 HB3 ALA 35 3HB ALA 35 11.631 -0.846 -11.588 199 H VAL 36 H VAL 36 9.558 -1.222 -12.949 200 HA VAL 36 HA VAL 36 8.262 -3.261 -11.469 201 HB VAL 36 HB VAL 36 6.923 -1.132 -13.137 202 HG11 VAL 36 1HG1 VAL 36 6.035 -3.077 -11.111 203 HG12 VAL 36 2HG1 VAL 36 5.401 -1.440 -10.934 204 HG13 VAL 36 3HG1 VAL 36 5.144 -2.328 -12.436 205 HG21 VAL 36 3HG2 VAL 36 7.009 -0.338 -10.448 206 HG22 VAL 36 1HG2 VAL 36 8.645 -0.851 -10.859 207 HG23 VAL 36 2HG2 VAL 36 7.846 0.398 -11.814 208 H ARG 37 H ARG 37 8.166 -2.355 -14.901 209 HA ARG 37 HA ARG 37 6.260 -4.242 -15.716 210 HB2 ARG 37 2HB ARG 37 6.892 -2.387 -17.145 211 HB3 ARG 37 3HB ARG 37 8.540 -2.990 -17.255 212 HG2 ARG 37 2HG ARG 37 6.508 -4.915 -18.099 213 HG3 ARG 37 3HG ARG 37 6.573 -3.448 -19.077 214 HD2 ARG 37 2HD ARG 37 9.213 -4.495 -18.469 215 HD3 ARG 37 3HD ARG 37 8.208 -5.665 -19.324 216 HE ARG 37 HE ARG 37 7.948 -3.248 -20.658 217 HH11 ARG 37 1HH1 ARG 37 10.465 -5.537 -19.921 218 HH12 ARG 37 2HH1 ARG 37 11.383 -5.185 -21.347 219 HH21 ARG 37 1HH2 ARG 37 9.148 -2.775 -22.540 220 HH22 ARG 37 2HH2 ARG 37 10.634 -3.613 -22.836 221 H THR 38 H THR 38 9.775 -4.449 -15.433 222 HA THR 38 HA THR 38 10.016 -7.027 -16.599 223 HB THR 38 HB THR 38 11.881 -5.612 -14.683 224 HG1 THR 38 HG1 THR 38 11.589 -5.621 -17.497 225 HG21 THR 38 3HG2 THR 38 12.001 -8.219 -16.058 226 HG22 THR 38 1HG2 THR 38 12.812 -7.673 -14.591 227 HG23 THR 38 2HG2 THR 38 13.455 -7.227 -16.171 228 H LYS 39 H LYS 39 9.620 -5.875 -13.286 229 HA LYS 39 HA LYS 39 10.040 -8.337 -11.986 230 HB2 LYS 39 2HB LYS 39 9.788 -5.872 -11.070 231 HB3 LYS 39 3HB LYS 39 8.103 -6.342 -10.891 232 HG2 LYS 39 2HG LYS 39 8.598 -7.308 -8.967 233 HG3 LYS 39 3HG LYS 39 9.656 -8.436 -9.818 234 HD2 LYS 39 2HD LYS 39 10.533 -5.687 -8.953 235 HD3 LYS 39 3HD LYS 39 10.725 -7.123 -7.944 236 HE2 LYS 39 2HE LYS 39 11.758 -7.945 -10.344 237 HE3 LYS 39 3HE LYS 39 12.240 -6.250 -10.288 238 HZ1 LYS 39 3HZ LYS 39 13.855 -6.813 -8.906 239 HZ2 LYS 39 1HZ LYS 39 13.351 -8.429 -8.909 240 HZ3 LYS 39 2HZ LYS 39 12.719 -7.349 -7.772 241 H VAL 40 H VAL 40 7.090 -6.784 -13.193 242 HA VAL 40 HA VAL 40 5.316 -8.801 -12.282 243 HB VAL 40 HB VAL 40 4.947 -6.826 -14.538 244 HG11 VAL 40 1HG1 VAL 40 2.520 -7.552 -13.236 245 HG12 VAL 40 2HG1 VAL 40 2.979 -7.775 -14.926 246 HG13 VAL 40 3HG1 VAL 40 3.355 -9.023 -13.737 247 HG21 VAL 40 3HG2 VAL 40 3.877 -6.594 -11.740 248 HG22 VAL 40 1HG2 VAL 40 5.445 -5.934 -12.202 249 HG23 VAL 40 2HG2 VAL 40 3.977 -5.350 -12.986 250 H CYS 41 H CYS 41 6.838 -8.176 -15.430 251 HA CYS 41 HA CYS 41 5.641 -10.238 -16.870 252 HB2 CYS 41 2HB CYS 41 7.219 -8.303 -17.636 253 HB3 CYS 41 3HB CYS 41 8.502 -9.472 -17.349 254 HG CYS 41 HG CYS 41 6.095 -9.491 -19.738 255 H ALA 42 H ALA 42 8.637 -10.246 -14.969 256 HA ALA 42 HA ALA 42 9.387 -12.899 -15.534 257 HB1 ALA 42 1HB ALA 42 10.068 -11.732 -12.890 258 HB2 ALA 42 2HB ALA 42 11.088 -12.582 -14.052 259 HB3 ALA 42 3HB ALA 42 10.643 -10.899 -14.335 260 H MET 43 H MET 43 7.434 -11.505 -12.926 261 HA MET 43 HA MET 43 7.105 -13.821 -11.395 262 HB2 MET 43 2HB MET 43 6.450 -11.395 -10.847 263 HB3 MET 43 3HB MET 43 4.959 -11.735 -11.715 264 HG2 MET 43 2HG MET 43 4.424 -12.116 -9.488 265 HG3 MET 43 3HG MET 43 4.704 -13.727 -10.145 266 HE1 MET 43 3HE MET 43 5.500 -15.254 -9.017 267 HE2 MET 43 1HE MET 43 7.016 -15.340 -8.120 268 HE3 MET 43 2HE MET 43 5.530 -14.870 -7.295 269 H LYS 44 H LYS 44 5.583 -12.792 -14.350 270 HA LYS 44 HA LYS 44 3.638 -14.976 -14.199 271 HB2 LYS 44 2HB LYS 44 3.859 -12.916 -16.388 272 HB3 LYS 44 3HB LYS 44 2.474 -13.921 -15.983 273 HG2 LYS 44 2HG LYS 44 3.052 -12.460 -13.667 274 HG3 LYS 44 3HG LYS 44 3.186 -11.320 -15.008 275 HD2 LYS 44 2HD LYS 44 0.920 -11.287 -14.260 276 HD3 LYS 44 3HD LYS 44 0.954 -12.138 -15.807 277 HE2 LYS 44 2HE LYS 44 0.687 -14.235 -14.778 278 HE3 LYS 44 3HE LYS 44 1.099 -13.599 -13.186 279 HZ1 LYS 44 3HZ LYS 44 -1.071 -12.137 -13.932 280 HZ2 LYS 44 1HZ LYS 44 -1.084 -13.456 -12.872 281 HZ3 LYS 44 2HZ LYS 44 -1.438 -13.684 -14.510 282 H LYS 45 H LYS 45 6.715 -14.400 -15.345 283 HA LYS 45 HA LYS 45 8.131 -15.565 -16.690 284 HB2 LYS 45 2HB LYS 45 6.712 -17.471 -15.514 285 HB3 LYS 45 3HB LYS 45 6.114 -17.716 -17.149 286 HG2 LYS 45 2HG LYS 45 7.909 -18.919 -17.609 287 HG3 LYS 45 3HG LYS 45 8.924 -17.504 -17.316 288 HD2 LYS 45 2HD LYS 45 7.933 -19.140 -15.015 289 HD3 LYS 45 3HD LYS 45 9.324 -19.687 -15.954 290 HE2 LYS 45 2HE LYS 45 9.544 -16.885 -15.285 291 HE3 LYS 45 3HE LYS 45 9.326 -17.871 -13.839 292 HZ1 LYS 45 3HZ LYS 45 11.658 -17.638 -14.372 293 HZ2 LYS 45 1HZ LYS 45 11.406 -18.268 -15.922 294 HZ3 LYS 45 2HZ LYS 45 11.186 -19.252 -14.563 295 H LEU 46 H LEU 46 7.050 -13.594 -18.012 296 HA LEU 46 HA LEU 46 6.096 -14.725 -20.560 297 HB2 LEU 46 2HB LEU 46 5.425 -12.247 -19.079 298 HB3 LEU 46 3HB LEU 46 5.480 -12.145 -20.837 299 HG LEU 46 HG LEU 46 3.744 -13.800 -21.039 300 HD11 LEU 46 1HD1 LEU 46 2.619 -14.503 -18.812 301 HD12 LEU 46 2HD1 LEU 46 4.189 -14.130 -18.103 302 HD13 LEU 46 3HD1 LEU 46 4.060 -15.357 -19.363 303 HD21 LEU 46 3HD2 LEU 46 3.419 -11.268 -19.893 304 HD22 LEU 46 1HD2 LEU 46 2.350 -12.343 -18.991 305 HD23 LEU 46 2HD2 LEU 46 2.207 -12.225 -20.745 306 HA PRO 47 HA PRO 47 9.626 -13.217 -22.685 307 HB2 PRO 47 2HB PRO 47 8.572 -12.280 -25.005 308 HB3 PRO 47 3HB PRO 47 8.683 -14.003 -24.627 309 HG2 PRO 47 2HG PRO 47 6.336 -12.160 -24.389 310 HG3 PRO 47 3HG PRO 47 6.397 -13.820 -25.011 311 HD2 PRO 47 2HD PRO 47 5.531 -13.230 -22.514 312 HD3 PRO 47 3HD PRO 47 6.372 -14.746 -22.900 313 HA PRO 48 HA PRO 48 9.529 -8.886 -21.413 314 HB2 PRO 48 2HB PRO 48 12.229 -8.631 -21.285 315 HB3 PRO 48 3HB PRO 48 11.272 -9.380 -20.000 316 HG2 PRO 48 2HG PRO 48 12.850 -10.677 -22.189 317 HG3 PRO 48 3HG PRO 48 12.745 -11.116 -20.474 318 HD2 PRO 48 2HD PRO 48 11.356 -12.419 -22.399 319 HD3 PRO 48 3HD PRO 48 10.736 -12.213 -20.748 320 H ASP 49 H ASP 49 11.219 -10.372 -24.091 321 HA ASP 49 HA ASP 49 12.127 -8.018 -25.356 322 HB2 ASP 49 2HB ASP 49 11.466 -10.746 -26.481 323 HB3 ASP 49 3HB ASP 49 12.239 -9.462 -27.406 324 H THR 50 H THR 50 9.133 -9.878 -25.645 325 HA THR 50 HA THR 50 8.018 -7.700 -27.289 326 HB THR 50 HB THR 50 6.278 -9.485 -27.933 327 HG1 THR 50 HG1 THR 50 6.779 -11.558 -27.523 328 HG21 THR 50 3HG2 THR 50 9.111 -9.902 -28.889 329 HG22 THR 50 1HG2 THR 50 8.064 -8.588 -29.424 330 HG23 THR 50 2HG2 THR 50 7.627 -10.261 -29.771 331 H THR 51 H THR 51 7.795 -6.801 -24.979 332 HA THR 51 HA THR 51 5.070 -7.392 -24.091 333 HB THR 51 HB THR 51 6.693 -8.631 -22.613 334 HG1 THR 51 HG1 THR 51 5.216 -6.564 -21.319 335 HG21 THR 51 3HG2 THR 51 8.385 -6.709 -22.708 336 HG22 THR 51 1HG2 THR 51 8.132 -7.490 -21.147 337 HG23 THR 51 2HG2 THR 51 7.380 -5.931 -21.485 338 H ARG 52 H ARG 52 3.968 -5.647 -23.221 339 HA ARG 52 HA ARG 52 5.398 -3.103 -22.986 340 HB2 ARG 52 2HB ARG 52 2.802 -3.285 -24.504 341 HB3 ARG 52 3HB ARG 52 3.910 -1.923 -24.406 342 HG2 ARG 52 2HG ARG 52 5.598 -3.424 -25.585 343 HG3 ARG 52 3HG ARG 52 4.229 -4.482 -25.933 344 HD2 ARG 52 2HD ARG 52 3.114 -2.750 -27.149 345 HD3 ARG 52 3HD ARG 52 4.305 -1.555 -26.639 346 HE ARG 52 HE ARG 52 5.433 -3.749 -28.111 347 HH11 ARG 52 1HH1 ARG 52 3.897 -0.634 -28.346 348 HH12 ARG 52 2HH1 ARG 52 4.562 -0.278 -29.906 349 HH21 ARG 52 1HH2 ARG 52 6.315 -3.293 -30.165 350 HH22 ARG 52 2HH2 ARG 52 5.936 -1.792 -30.940 351 H LEU 53 H LEU 53 4.687 -1.843 -21.356 352 HA LEU 53 HA LEU 53 2.328 -2.788 -19.872 353 HB2 LEU 53 2HB LEU 53 4.127 -2.960 -18.424 354 HB3 LEU 53 3HB LEU 53 4.890 -1.495 -19.039 355 HG LEU 53 HG LEU 53 3.240 -0.130 -17.872 356 HD11 LEU 53 1HD1 LEU 53 1.783 -2.559 -17.785 357 HD12 LEU 53 2HD1 LEU 53 1.281 -0.955 -17.253 358 HD13 LEU 53 3HD1 LEU 53 2.085 -2.045 -16.125 359 HD21 LEU 53 3HD2 LEU 53 4.010 -0.509 -15.634 360 HD22 LEU 53 1HD2 LEU 53 5.335 -0.861 -16.744 361 HD23 LEU 53 2HD2 LEU 53 4.427 -2.182 -16.009 362 H THR 54 H THR 54 0.661 -1.444 -19.461 363 HA THR 54 HA THR 54 0.942 1.377 -20.263 364 HB THR 54 HB THR 54 -1.528 1.207 -20.938 365 HG1 THR 54 HG1 THR 54 -2.388 -0.748 -21.116 366 HG21 THR 54 3HG2 THR 54 -0.399 1.509 -22.855 367 HG22 THR 54 1HG2 THR 54 -0.611 -0.225 -23.091 368 HG23 THR 54 2HG2 THR 54 0.881 0.392 -22.383 369 H TYR 55 H TYR 55 0.346 2.797 -18.759 370 HA TYR 55 HA TYR 55 -1.395 1.866 -16.571 371 HB2 TYR 55 2HB TYR 55 0.799 2.110 -15.656 372 HB3 TYR 55 3HB TYR 55 1.029 3.662 -16.454 373 HD1 TYR 55 HD1 TYR 55 -1.899 2.450 -14.499 374 HD2 TYR 55 HD2 TYR 55 1.371 5.165 -14.703 375 HE1 TYR 55 HE1 TYR 55 -2.737 3.600 -12.493 376 HE2 TYR 55 HE2 TYR 55 0.543 6.322 -12.697 377 HH TYR 55 HH TYR 55 -2.122 6.447 -11.615 378 H LYS 56 H LYS 56 -3.193 3.001 -16.258 379 HA LYS 56 HA LYS 56 -4.816 4.577 -16.510 380 HB2 LYS 56 2HB LYS 56 -2.761 5.811 -15.315 381 HB3 LYS 56 3HB LYS 56 -2.827 6.768 -16.789 382 HG2 LYS 56 2HG LYS 56 -5.450 6.383 -15.613 383 HG3 LYS 56 3HG LYS 56 -4.320 7.164 -14.505 384 HD2 LYS 56 2HD LYS 56 -4.316 9.068 -15.685 385 HD3 LYS 56 3HD LYS 56 -4.179 8.215 -17.224 386 HE2 LYS 56 2HE LYS 56 -6.469 8.022 -17.468 387 HE3 LYS 56 3HE LYS 56 -6.772 8.191 -15.740 388 HZ1 LYS 56 3HZ LYS 56 -5.945 10.348 -17.606 389 HZ2 LYS 56 1HZ LYS 56 -6.102 10.535 -15.931 390 HZ3 LYS 56 2HZ LYS 56 -7.460 10.173 -16.872 391 H GLY 57 H GLY 57 -3.784 3.339 -18.902 392 HA2 GLY 57 2HA GLY 57 -4.211 3.515 -21.158 393 HA3 GLY 57 3HA GLY 57 -4.997 5.053 -20.832 394 H ARG 58 H ARG 58 -1.902 5.036 -19.552 395 HA ARG 58 HA ARG 58 -0.853 6.414 -21.936 396 HB2 ARG 58 2HB ARG 58 -1.200 7.403 -19.340 397 HB3 ARG 58 3HB ARG 58 0.526 7.096 -19.484 398 HG2 ARG 58 2HG ARG 58 0.032 8.350 -21.832 399 HG3 ARG 58 3HG ARG 58 -1.147 9.128 -20.774 400 HD2 ARG 58 2HD ARG 58 0.526 9.886 -19.299 401 HD3 ARG 58 3HD ARG 58 1.738 8.814 -19.999 402 HE ARG 58 HE ARG 58 0.927 10.496 -22.033 403 HH11 ARG 58 1HH1 ARG 58 2.423 10.809 -18.904 404 HH12 ARG 58 2HH1 ARG 58 3.305 12.239 -19.324 405 HH21 ARG 58 1HH2 ARG 58 2.084 12.379 -22.598 406 HH22 ARG 58 2HH2 ARG 58 3.111 13.132 -21.425 407 H ALA 59 H ALA 59 1.404 6.213 -22.372 408 HA ALA 59 HA ALA 59 2.510 3.668 -21.406 409 HB1 ALA 59 1HB ALA 59 2.399 4.941 -23.991 410 HB2 ALA 59 2HB ALA 59 4.059 4.538 -23.551 411 HB3 ALA 59 3HB ALA 59 2.822 3.281 -23.572 412 H LEU 60 H LEU 60 4.061 3.772 -19.932 413 HA LEU 60 HA LEU 60 5.841 6.121 -19.924 414 HB2 LEU 60 2HB LEU 60 5.030 4.463 -17.542 415 HB3 LEU 60 3HB LEU 60 6.028 5.916 -17.528 416 HG LEU 60 HG LEU 60 3.556 6.606 -18.723 417 HD11 LEU 60 1HD1 LEU 60 2.234 4.996 -17.821 418 HD12 LEU 60 2HD1 LEU 60 2.269 6.107 -16.453 419 HD13 LEU 60 3HD1 LEU 60 3.326 4.695 -16.469 420 HD21 LEU 60 3HD2 LEU 60 5.191 7.325 -16.381 421 HD22 LEU 60 1HD2 LEU 60 3.478 7.732 -16.273 422 HD23 LEU 60 2HD2 LEU 60 4.449 8.350 -17.610 423 H LYS 61 H LYS 61 8.030 5.771 -19.325 424 HA LYS 61 HA LYS 61 9.026 3.103 -18.932 425 HB2 LYS 61 2HB LYS 61 10.595 3.594 -21.055 426 HB3 LYS 61 3HB LYS 61 9.103 2.669 -21.161 427 HG2 LYS 61 2HG LYS 61 8.875 5.597 -21.490 428 HG3 LYS 61 3HG LYS 61 9.676 4.704 -22.785 429 HD2 LYS 61 2HD LYS 61 7.243 3.398 -21.878 430 HD3 LYS 61 3HD LYS 61 6.948 5.037 -22.463 431 HE2 LYS 61 2HE LYS 61 8.760 3.474 -24.148 432 HE3 LYS 61 3HE LYS 61 7.135 2.801 -24.029 433 HZ1 LYS 61 3HZ LYS 61 6.197 4.692 -24.950 434 HZ2 LYS 61 1HZ LYS 61 7.618 4.513 -25.851 435 HZ3 LYS 61 2HZ LYS 61 7.541 5.664 -24.615 436 H ASP 62 H ASP 62 10.457 5.977 -20.464 437 HA ASP 62 HA ASP 62 12.699 5.913 -18.681 438 HB2 ASP 62 2HB ASP 62 11.827 7.723 -20.913 439 HB3 ASP 62 3HB ASP 62 13.167 8.182 -19.867 440 H THR 63 H THR 63 9.600 7.013 -18.313 441 HA THR 63 HA THR 63 9.852 9.500 -17.077 442 HB THR 63 HB THR 63 7.856 7.543 -16.020 443 HG1 THR 63 HG1 THR 63 7.787 8.692 -18.631 444 HG21 THR 63 3HG2 THR 63 6.493 9.755 -16.708 445 HG22 THR 63 1HG2 THR 63 8.089 10.459 -16.456 446 HG23 THR 63 2HG2 THR 63 7.303 9.566 -15.154 447 H GLU 64 H GLU 64 10.816 6.395 -15.997 448 HA GLU 64 HA GLU 64 11.859 5.675 -14.107 449 HB2 GLU 64 2HB GLU 64 12.326 8.566 -14.132 450 HB3 GLU 64 3HB GLU 64 12.386 7.863 -12.523 451 HG2 GLU 64 2HG GLU 64 14.301 6.762 -12.926 452 HG3 GLU 64 3HG GLU 64 13.863 6.391 -14.593 453 H THR 65 H THR 65 10.401 8.529 -12.616 454 HA THR 65 HA THR 65 8.944 6.764 -10.792 455 HB THR 65 HB THR 65 10.263 8.418 -9.660 456 HG1 THR 65 HG1 THR 65 8.533 9.571 -8.572 457 HG21 THR 65 3HG2 THR 65 10.602 10.083 -11.318 458 HG22 THR 65 1HG2 THR 65 9.730 10.869 -10.002 459 HG23 THR 65 2HG2 THR 65 8.872 10.388 -11.466 460 H LEU 66 H LEU 66 6.732 7.347 -10.170 461 HA LEU 66 HA LEU 66 5.246 8.612 -12.377 462 HB2 LEU 66 2HB LEU 66 5.014 5.959 -11.234 463 HB3 LEU 66 3HB LEU 66 3.491 6.843 -11.152 464 HG LEU 66 HG LEU 66 3.456 7.114 -13.541 465 HD11 LEU 66 1HD1 LEU 66 5.611 7.447 -14.271 466 HD12 LEU 66 2HD1 LEU 66 5.312 5.796 -14.815 467 HD13 LEU 66 3HD1 LEU 66 6.251 6.085 -13.351 468 HD21 LEU 66 3HD2 LEU 66 3.291 4.780 -14.240 469 HD22 LEU 66 1HD2 LEU 66 2.576 5.021 -12.646 470 HD23 LEU 66 2HD2 LEU 66 4.169 4.279 -12.794 471 H GLU 67 H GLU 67 5.436 7.963 -8.926 472 HA GLU 67 HA GLU 67 3.102 9.318 -8.137 473 HB2 GLU 67 2HB GLU 67 4.455 7.772 -6.705 474 HB3 GLU 67 3HB GLU 67 5.660 9.044 -6.553 475 HG2 GLU 67 2HG GLU 67 3.371 10.338 -5.823 476 HG3 GLU 67 3HG GLU 67 3.096 8.712 -5.201 477 H SER 68 H SER 68 6.262 10.446 -9.038 478 HA SER 68 HA SER 68 6.181 12.998 -7.849 479 HB2 SER 68 2HB SER 68 7.656 11.914 -10.248 480 HB3 SER 68 3HB SER 68 7.848 13.579 -9.700 481 HG SER 68 HG SER 68 8.573 12.784 -7.709 482 H LEU 69 H LEU 69 4.424 11.679 -10.438 483 HA LEU 69 HA LEU 69 3.830 14.307 -11.586 484 HB2 LEU 69 2HB LEU 69 2.823 11.649 -12.559 485 HB3 LEU 69 3HB LEU 69 2.893 13.174 -13.439 486 HG LEU 69 HG LEU 69 5.290 11.540 -12.609 487 HD11 LEU 69 1HD1 LEU 69 4.274 11.911 -15.405 488 HD12 LEU 69 2HD1 LEU 69 3.721 10.580 -14.390 489 HD13 LEU 69 3HD1 LEU 69 5.432 10.730 -14.792 490 HD21 LEU 69 3HD2 LEU 69 5.187 13.827 -14.556 491 HD22 LEU 69 1HD2 LEU 69 6.602 13.061 -13.835 492 HD23 LEU 69 2HD2 LEU 69 5.538 14.057 -12.842 493 H GLY 70 H GLY 70 2.605 12.080 -9.353 494 HA2 GLY 70 2HA GLY 70 0.728 13.016 -8.014 495 HA3 GLY 70 3HA GLY 70 -0.075 13.313 -9.548 496 H VAL 71 H VAL 71 1.757 10.404 -9.123 497 HA VAL 71 HA VAL 71 -0.694 8.848 -9.377 498 HB VAL 71 HB VAL 71 2.193 7.963 -9.480 499 HG11 VAL 71 1HG1 VAL 71 1.194 5.989 -8.965 500 HG12 VAL 71 2HG1 VAL 71 -0.381 6.498 -9.578 501 HG13 VAL 71 3HG1 VAL 71 0.881 5.991 -10.701 502 HG21 VAL 71 3HG2 VAL 71 0.210 8.297 -11.728 503 HG22 VAL 71 1HG2 VAL 71 1.479 9.455 -11.329 504 HG23 VAL 71 2HG2 VAL 71 1.905 7.831 -11.868 505 H ALA 72 H ALA 72 -1.422 7.374 -7.899 506 HA ALA 72 HA ALA 72 -0.085 7.409 -5.274 507 HB1 ALA 72 1HB ALA 72 -2.625 8.209 -5.834 508 HB2 ALA 72 2HB ALA 72 -2.881 6.536 -5.338 509 HB3 ALA 72 3HB ALA 72 -2.065 7.663 -4.253 510 H ASP 73 H ASP 73 -0.783 5.394 -3.931 511 HA ASP 73 HA ASP 73 0.008 3.072 -5.497 512 HB2 ASP 73 2HB ASP 73 -0.191 3.632 -2.546 513 HB3 ASP 73 3HB ASP 73 0.040 1.996 -3.156 514 H GLY 74 H GLY 74 -1.248 1.330 -5.917 515 HA2 GLY 74 2HA GLY 74 -3.100 -0.124 -5.300 516 HA3 GLY 74 3HA GLY 74 -3.963 1.308 -4.758 517 H ASP 75 H ASP 75 -2.143 1.225 -7.741 518 HA ASP 75 HA ASP 75 -4.649 1.624 -9.208 519 HB2 ASP 75 2HB ASP 75 -1.821 2.452 -9.634 520 HB3 ASP 75 3HB ASP 75 -2.815 2.181 -11.063 521 H LYS 76 H LYS 76 -4.816 0.651 -11.382 522 HA LYS 76 HA LYS 76 -3.760 -2.093 -11.343 523 HB2 LYS 76 2HB LYS 76 -6.198 -0.915 -12.682 524 HB3 LYS 76 3HB LYS 76 -5.642 -2.562 -12.947 525 HG2 LYS 76 2HG LYS 76 -6.653 -3.268 -11.108 526 HG3 LYS 76 3HG LYS 76 -5.869 -2.023 -10.133 527 HD2 LYS 76 2HD LYS 76 -7.600 -0.487 -10.500 528 HD3 LYS 76 3HD LYS 76 -8.230 -1.393 -11.877 529 HE2 LYS 76 2HE LYS 76 -8.460 -3.247 -9.933 530 HE3 LYS 76 3HE LYS 76 -8.669 -1.776 -8.985 531 HZ1 LYS 76 3HZ LYS 76 -10.250 -1.311 -11.108 532 HZ2 LYS 76 1HZ LYS 76 -10.787 -1.945 -9.635 533 HZ3 LYS 76 2HZ LYS 76 -10.433 -2.982 -10.923 534 H PHE 77 H PHE 77 -2.388 -2.756 -12.869 535 HA PHE 77 HA PHE 77 -1.928 -0.976 -15.169 536 HB2 PHE 77 2HB PHE 77 0.030 -2.994 -14.074 537 HB3 PHE 77 3HB PHE 77 0.351 -1.676 -15.196 538 HD1 PHE 77 HD1 PHE 77 -0.983 0.577 -13.890 539 HD2 PHE 77 HD2 PHE 77 1.355 -2.567 -12.227 540 HE1 PHE 77 HE1 PHE 77 -0.371 2.034 -12.004 541 HE2 PHE 77 HE2 PHE 77 1.969 -1.116 -10.338 542 HZ PHE 77 HZ PHE 77 1.105 1.188 -10.224 543 H VAL 78 H VAL 78 -1.577 -1.889 -17.224 544 HA VAL 78 HA VAL 78 -2.718 -4.586 -17.525 545 HB VAL 78 HB VAL 78 -2.576 -2.356 -19.559 546 HG11 VAL 78 1HG1 VAL 78 -2.497 -4.438 -20.706 547 HG12 VAL 78 2HG1 VAL 78 -3.758 -5.123 -19.679 548 HG13 VAL 78 3HG1 VAL 78 -4.153 -3.843 -20.827 549 HG21 VAL 78 3HG2 VAL 78 -4.301 -1.566 -18.351 550 HG22 VAL 78 1HG2 VAL 78 -5.213 -2.848 -19.148 551 HG23 VAL 78 2HG2 VAL 78 -4.563 -3.104 -17.529 552 H LEU 79 H LEU 79 -1.426 -6.168 -18.182 553 HA LEU 79 HA LEU 79 1.147 -5.454 -19.419 554 HB2 LEU 79 2HB LEU 79 1.518 -6.595 -17.382 555 HB3 LEU 79 3HB LEU 79 0.292 -7.805 -17.754 556 HG LEU 79 HG LEU 79 1.752 -8.703 -19.526 557 HD11 LEU 79 1HD1 LEU 79 4.251 -7.845 -19.085 558 HD12 LEU 79 2HD1 LEU 79 3.368 -6.352 -18.769 559 HD13 LEU 79 3HD1 LEU 79 3.197 -7.164 -20.325 560 HD21 LEU 79 3HD2 LEU 79 1.895 -9.136 -16.852 561 HD22 LEU 79 1HD2 LEU 79 3.569 -8.722 -17.220 562 HD23 LEU 79 2HD2 LEU 79 2.786 -10.059 -18.063 563 H ILE 80 H ILE 80 1.433 -5.932 -21.488 564 HA ILE 80 HA ILE 80 -0.281 -8.003 -22.698 565 HB ILE 80 HB ILE 80 -0.729 -5.682 -23.499 566 HG12 ILE 80 2HG1 ILE 80 0.428 -7.113 -25.840 567 HG13 ILE 80 3HG1 ILE 80 -0.776 -7.968 -24.883 568 HG21 ILE 80 1HG2 ILE 80 2.049 -5.503 -23.553 569 HG22 ILE 80 2HG2 ILE 80 1.560 -5.506 -25.246 570 HG23 ILE 80 3HG2 ILE 80 0.896 -4.305 -24.139 571 HD11 ILE 80 3HD1 ILE 80 -1.942 -5.524 -25.238 572 HD12 ILE 80 1HD1 ILE 80 -1.090 -5.769 -26.763 573 HD13 ILE 80 2HD1 ILE 80 -2.259 -6.966 -26.203 574 H THR 81 H THR 81 0.631 -9.426 -24.181 575 HA THR 81 HA THR 81 3.550 -9.323 -24.498 576 HB THR 81 HB THR 81 3.169 -10.897 -22.698 577 HG1 THR 81 HG1 THR 81 4.526 -11.407 -24.773 578 HG21 THR 81 3HG2 THR 81 1.740 -12.929 -24.198 579 HG22 THR 81 1HG2 THR 81 0.786 -11.459 -24.005 580 HG23 THR 81 2HG2 THR 81 1.423 -12.290 -22.586 581 H ARG 82 H ARG 82 4.284 -9.870 -26.481 582 HA ARG 82 HA ARG 82 2.267 -10.647 -28.470 583 HB2 ARG 82 2HB ARG 82 4.068 -8.579 -28.509 584 HB3 ARG 82 3HB ARG 82 4.906 -9.809 -29.446 585 HG2 ARG 82 2HG ARG 82 2.983 -9.993 -30.937 586 HG3 ARG 82 3HG ARG 82 2.134 -8.768 -29.992 587 HD2 ARG 82 2HD ARG 82 3.081 -7.721 -31.932 588 HD3 ARG 82 3HD ARG 82 3.967 -7.177 -30.509 589 HE ARG 82 HE ARG 82 5.274 -9.405 -31.612 590 HH11 ARG 82 1HH1 ARG 82 4.624 -6.056 -32.307 591 HH12 ARG 82 2HH1 ARG 82 6.064 -5.837 -33.246 592 HH21 ARG 82 1HH2 ARG 82 7.172 -9.129 -32.846 593 HH22 ARG 82 2HH2 ARG 82 7.512 -7.585 -33.553 594 H THR 83 H THR 83 2.689 -12.287 -29.976 595 HA THR 83 HA THR 83 3.460 -14.303 -30.702 596 HB THR 83 HB THR 83 6.114 -14.019 -29.403 597 HG1 THR 83 HG1 THR 83 6.720 -12.397 -30.891 598 HG21 THR 83 3HG2 THR 83 6.642 -15.462 -31.014 599 HG22 THR 83 1HG2 THR 83 6.147 -14.303 -32.247 600 HG23 THR 83 2HG2 THR 83 4.969 -15.427 -31.570 601 H VAL 84 H VAL 84 4.401 -16.433 -29.916 602 HA VAL 84 HA VAL 84 4.329 -18.180 -28.459 603 HB VAL 84 HB VAL 84 4.744 -16.120 -26.291 604 HG11 VAL 84 1HG1 VAL 84 6.095 -18.586 -25.850 605 HG12 VAL 84 2HG1 VAL 84 4.805 -17.848 -24.899 606 HG13 VAL 84 3HG1 VAL 84 4.409 -18.931 -26.234 607 HG21 VAL 84 3HG2 VAL 84 6.479 -15.730 -27.844 608 HG22 VAL 84 1HG2 VAL 84 7.182 -16.753 -26.592 609 HG23 VAL 84 2HG2 VAL 84 6.708 -17.453 -28.139 610 H GLY 85 H GLY 85 2.079 -18.470 -28.958 611 HA2 GLY 85 2HA GLY 85 -0.047 -18.993 -28.241 612 HA3 GLY 85 3HA GLY 85 0.439 -18.513 -26.622 Start of MODEL 10 1 H1 MET 9 H MET 9 1.363 2.461 -2.044 2 HA MET 9 HA MET 9 2.399 0.464 -0.766 3 HB2 MET 9 2HB MET 9 -0.446 1.213 -1.057 4 HB3 MET 9 3HB MET 9 -0.144 -0.362 -0.335 5 HG2 MET 9 2HG MET 9 1.412 1.928 0.707 6 HG3 MET 9 3HG MET 9 -0.306 1.868 1.093 7 HE1 MET 9 3HE MET 9 3.085 -0.022 3.045 8 HE2 MET 9 1HE MET 9 2.838 1.462 2.124 9 HE3 MET 9 2HE MET 9 2.150 1.303 3.741 10 H LYS 10 H LYS 10 -0.331 -0.428 -2.881 11 HA LYS 10 HA LYS 10 1.144 -2.864 -3.620 12 HB2 LYS 10 2HB LYS 10 -1.641 -2.595 -2.558 13 HB3 LYS 10 3HB LYS 10 -1.277 -3.885 -3.697 14 HG2 LYS 10 2HG LYS 10 0.766 -4.048 -1.843 15 HG3 LYS 10 3HG LYS 10 -0.661 -3.669 -0.876 16 HD2 LYS 10 2HD LYS 10 -1.744 -5.616 -1.469 17 HD3 LYS 10 3HD LYS 10 -0.838 -5.784 -2.975 18 HE2 LYS 10 2HE LYS 10 1.085 -5.919 -0.968 19 HE3 LYS 10 3HE LYS 10 -0.274 -6.854 -0.347 20 HZ1 LYS 10 3HZ LYS 10 1.173 -8.279 -1.594 21 HZ2 LYS 10 1HZ LYS 10 1.111 -7.259 -2.942 22 HZ3 LYS 10 2HZ LYS 10 -0.273 -8.100 -2.454 23 H ILE 11 H ILE 11 0.592 -3.771 -5.670 24 HA ILE 11 HA ILE 11 -0.937 -2.001 -7.449 25 HB ILE 11 HB ILE 11 1.387 -1.458 -7.842 26 HG12 ILE 11 2HG1 ILE 11 0.429 -3.266 -10.067 27 HG13 ILE 11 3HG1 ILE 11 -0.209 -1.652 -9.773 28 HG21 ILE 11 1HG2 ILE 11 2.691 -3.202 -7.109 29 HG22 ILE 11 2HG2 ILE 11 1.701 -4.421 -7.910 30 HG23 ILE 11 3HG2 ILE 11 2.797 -3.416 -8.856 31 HD11 ILE 11 3HD1 ILE 11 1.853 -2.263 -11.444 32 HD12 ILE 11 1HD1 ILE 11 1.528 -0.670 -10.761 33 HD13 ILE 11 2HD1 ILE 11 2.697 -1.741 -9.986 34 H LYS 12 H LYS 12 -2.040 -3.005 -9.108 35 HA LYS 12 HA LYS 12 -2.007 -5.952 -9.064 36 HB2 LYS 12 2HB LYS 12 -4.390 -4.267 -9.815 37 HB3 LYS 12 3HB LYS 12 -4.352 -5.986 -9.446 38 HG2 LYS 12 2HG LYS 12 -3.629 -5.313 -7.106 39 HG3 LYS 12 3HG LYS 12 -4.092 -3.670 -7.557 40 HD2 LYS 12 2HD LYS 12 -6.044 -4.425 -6.606 41 HD3 LYS 12 3HD LYS 12 -6.321 -4.836 -8.301 42 HE2 LYS 12 2HE LYS 12 -4.915 -6.951 -6.926 43 HE3 LYS 12 3HE LYS 12 -6.425 -6.555 -6.107 44 HZ1 LYS 12 3HZ LYS 12 -7.352 -7.881 -7.622 45 HZ2 LYS 12 1HZ LYS 12 -5.999 -7.851 -8.637 46 HZ3 LYS 12 2HZ LYS 12 -7.141 -6.607 -8.714 47 H ILE 13 H ILE 13 -1.215 -6.794 -10.866 48 HA ILE 13 HA ILE 13 -1.649 -5.352 -13.401 49 HB ILE 13 HB ILE 13 0.698 -5.281 -12.864 50 HG12 ILE 13 2HG1 ILE 13 0.819 -7.483 -14.821 51 HG13 ILE 13 3HG1 ILE 13 -0.323 -6.204 -15.217 52 HG21 ILE 13 1HG2 ILE 13 1.730 -6.879 -11.722 53 HG22 ILE 13 2HG2 ILE 13 0.221 -7.790 -11.700 54 HG23 ILE 13 3HG2 ILE 13 1.394 -8.057 -12.990 55 HD11 ILE 13 3HD1 ILE 13 2.591 -6.208 -15.277 56 HD12 ILE 13 1HD1 ILE 13 1.435 -5.209 -16.156 57 HD13 ILE 13 2HD1 ILE 13 1.892 -4.785 -14.506 58 H VAL 14 H VAL 14 -3.063 -6.381 -14.637 59 HA VAL 14 HA VAL 14 -3.239 -9.312 -14.470 60 HB VAL 14 HB VAL 14 -5.348 -8.289 -13.986 61 HG11 VAL 14 1HG1 VAL 14 -4.511 -6.382 -15.949 62 HG12 VAL 14 2HG1 VAL 14 -6.107 -7.005 -16.373 63 HG13 VAL 14 3HG1 VAL 14 -5.835 -6.277 -14.789 64 HG21 VAL 14 3HG2 VAL 14 -6.659 -9.554 -15.367 65 HG22 VAL 14 1HG2 VAL 14 -5.798 -9.056 -16.823 66 HG23 VAL 14 2HG2 VAL 14 -5.082 -10.249 -15.740 67 HA PRO 15 HA PRO 15 -1.194 -9.146 -18.469 68 HB2 PRO 15 2HB PRO 15 -0.801 -11.826 -18.635 69 HB3 PRO 15 3HB PRO 15 0.227 -10.763 -17.668 70 HG2 PRO 15 2HG PRO 15 -2.041 -12.511 -16.796 71 HG3 PRO 15 3HG PRO 15 -0.462 -12.261 -16.029 72 HD2 PRO 15 2HD PRO 15 -2.714 -11.031 -15.163 73 HD3 PRO 15 3HD PRO 15 -1.111 -10.277 -15.051 74 H ALA 16 H ALA 16 -2.101 -9.193 -20.433 75 HA ALA 16 HA ALA 16 -4.765 -10.215 -20.764 76 HB1 ALA 16 1HB ALA 16 -4.392 -8.209 -21.891 77 HB2 ALA 16 2HB ALA 16 -2.852 -8.757 -22.553 78 HB3 ALA 16 3HB ALA 16 -4.363 -9.422 -23.172 79 H VAL 17 H VAL 17 -3.814 -12.455 -20.175 80 HA VAL 17 HA VAL 17 -2.734 -13.817 -22.535 81 HB VAL 17 HB VAL 17 -2.467 -15.765 -20.957 82 HG11 VAL 17 1HG1 VAL 17 -1.033 -13.177 -20.780 83 HG12 VAL 17 2HG1 VAL 17 -0.653 -14.400 -19.566 84 HG13 VAL 17 3HG1 VAL 17 -0.451 -14.764 -21.281 85 HG21 VAL 17 3HG2 VAL 17 -2.604 -15.369 -18.577 86 HG22 VAL 17 1HG2 VAL 17 -3.090 -13.696 -18.853 87 HG23 VAL 17 2HG2 VAL 17 -4.164 -15.014 -19.321 88 H GLY 18 H GLY 18 -5.150 -13.222 -23.224 89 HA2 GLY 18 2HA GLY 18 -7.230 -14.006 -23.805 90 HA3 GLY 18 3HA GLY 18 -6.471 -15.590 -23.747 91 H GLY 19 H GLY 19 -7.934 -13.122 -21.642 92 HA2 GLY 19 2HA GLY 19 -9.556 -13.427 -20.008 93 HA3 GLY 19 3HA GLY 19 -9.505 -15.155 -20.322 94 H GLY 20 H GLY 20 -6.559 -13.436 -19.676 95 HA2 GLY 20 2HA GLY 20 -5.762 -15.121 -17.601 96 HA3 GLY 20 3HA GLY 20 -5.080 -13.534 -17.924 97 H SER 21 H SER 21 -4.957 -13.919 -15.436 98 HA SER 21 HA SER 21 -7.318 -12.610 -14.259 99 HB2 SER 21 2HB SER 21 -5.955 -15.095 -13.448 100 HB3 SER 21 3HB SER 21 -6.266 -13.962 -12.133 101 HG SER 21 HG SER 21 -8.243 -14.778 -13.993 102 HA PRO 22 HA PRO 22 -4.598 -9.569 -12.645 103 HB2 PRO 22 2HB PRO 22 -5.807 -8.957 -10.292 104 HB3 PRO 22 3HB PRO 22 -6.465 -8.481 -11.862 105 HG2 PRO 22 2HG PRO 22 -7.230 -10.781 -10.107 106 HG3 PRO 22 3HG PRO 22 -8.274 -9.666 -11.007 107 HD2 PRO 22 2HD PRO 22 -7.689 -12.155 -11.899 108 HD3 PRO 22 3HD PRO 22 -7.969 -10.788 -12.997 109 H LEU 23 H LEU 23 -2.741 -9.489 -11.506 110 HA LEU 23 HA LEU 23 -2.345 -11.510 -9.398 111 HB2 LEU 23 2HB LEU 23 -0.973 -11.248 -11.773 112 HB3 LEU 23 3HB LEU 23 0.077 -10.437 -10.612 113 HG LEU 23 HG LEU 23 0.738 -12.753 -10.896 114 HD11 LEU 23 1HD1 LEU 23 -0.521 -12.834 -8.218 115 HD12 LEU 23 2HD1 LEU 23 0.547 -11.476 -8.568 116 HD13 LEU 23 3HD1 LEU 23 1.150 -13.128 -8.699 117 HD21 LEU 23 3HD2 LEU 23 -1.815 -13.698 -9.673 118 HD22 LEU 23 1HD2 LEU 23 -0.647 -14.574 -10.663 119 HD23 LEU 23 2HD2 LEU 23 -1.739 -13.409 -11.412 120 H GLU 24 H GLU 24 -1.349 -10.907 -7.505 121 HA GLU 24 HA GLU 24 -1.222 -8.024 -7.028 122 HB2 GLU 24 2HB GLU 24 -1.469 -10.423 -5.239 123 HB3 GLU 24 3HB GLU 24 -0.970 -8.869 -4.587 124 HG2 GLU 24 2HG GLU 24 -3.068 -7.910 -5.617 125 HG3 GLU 24 3HG GLU 24 -3.574 -9.574 -5.903 126 H LEU 25 H LEU 25 0.637 -6.969 -6.767 127 HA LEU 25 HA LEU 25 3.037 -8.422 -5.955 128 HB2 LEU 25 2HB LEU 25 2.847 -6.728 -8.441 129 HB3 LEU 25 3HB LEU 25 4.352 -7.328 -7.747 130 HG LEU 25 HG LEU 25 3.040 -9.654 -8.067 131 HD11 LEU 25 1HD1 LEU 25 1.215 -9.423 -9.310 132 HD12 LEU 25 2HD1 LEU 25 2.267 -8.975 -10.653 133 HD13 LEU 25 3HD1 LEU 25 1.569 -7.723 -9.625 134 HD21 LEU 25 3HD2 LEU 25 5.214 -9.444 -8.886 135 HD22 LEU 25 1HD2 LEU 25 4.787 -8.101 -9.945 136 HD23 LEU 25 2HD2 LEU 25 4.245 -9.734 -10.331 137 H GLU 26 H GLU 26 4.756 -7.034 -5.210 138 HA GLU 26 HA GLU 26 3.760 -4.409 -4.320 139 HB2 GLU 26 2HB GLU 26 5.415 -4.658 -2.449 140 HB3 GLU 26 3HB GLU 26 4.092 -5.815 -2.420 141 HG2 GLU 26 2HG GLU 26 5.505 -7.512 -2.455 142 HG3 GLU 26 3HG GLU 26 6.281 -6.895 -3.912 143 H VAL 27 H VAL 27 4.588 -2.876 -5.587 144 HA VAL 27 HA VAL 27 7.494 -2.796 -5.941 145 HB VAL 27 HB VAL 27 7.223 -2.057 -8.298 146 HG11 VAL 27 1HG1 VAL 27 6.463 -4.413 -9.122 147 HG12 VAL 27 2HG1 VAL 27 7.943 -4.244 -8.175 148 HG13 VAL 27 3HG1 VAL 27 6.458 -4.801 -7.402 149 HG21 VAL 27 3HG2 VAL 27 4.421 -2.251 -7.578 150 HG22 VAL 27 1HG2 VAL 27 5.182 -1.439 -8.946 151 HG23 VAL 27 2HG2 VAL 27 4.792 -3.156 -9.046 152 H ALA 28 H ALA 28 8.190 -0.620 -6.819 153 HA ALA 28 HA ALA 28 6.437 1.499 -5.755 154 HB1 ALA 28 1HB ALA 28 8.548 2.728 -5.200 155 HB2 ALA 28 2HB ALA 28 8.272 1.265 -4.254 156 HB3 ALA 28 3HB ALA 28 9.433 1.251 -5.581 157 HA PRO 29 HA PRO 29 6.722 2.842 -10.021 158 HB2 PRO 29 2HB PRO 29 4.939 4.872 -9.755 159 HB3 PRO 29 3HB PRO 29 4.452 3.181 -9.921 160 HG2 PRO 29 2HG PRO 29 4.678 4.853 -7.448 161 HG3 PRO 29 3HG PRO 29 3.405 3.709 -7.913 162 HD2 PRO 29 2HD PRO 29 5.368 3.071 -6.159 163 HD3 PRO 29 3HD PRO 29 4.635 1.876 -7.249 164 H ASN 30 H ASN 30 7.554 4.480 -7.138 165 HA ASN 30 HA ASN 30 8.427 6.911 -8.452 166 HB2 ASN 30 2HB ASN 30 9.191 7.579 -6.200 167 HB3 ASN 30 3HB ASN 30 7.506 7.069 -6.199 168 HD21 ASN 30 1HD2 ASN 30 6.895 5.359 -4.990 169 HD22 ASN 30 2HD2 ASN 30 7.964 4.460 -3.973 170 H ALA 31 H ALA 31 9.601 3.967 -8.620 171 HA ALA 31 HA ALA 31 12.414 4.708 -8.199 172 HB1 ALA 31 1HB ALA 31 12.503 2.064 -8.772 173 HB2 ALA 31 2HB ALA 31 12.354 2.724 -7.143 174 HB3 ALA 31 3HB ALA 31 10.916 2.187 -8.011 175 H THR 32 H THR 32 10.979 2.349 -10.420 176 HA THR 32 HA THR 32 11.682 3.894 -12.752 177 HB THR 32 HB THR 32 13.785 3.109 -12.894 178 HG1 THR 32 HG1 THR 32 13.817 1.448 -14.259 179 HG21 THR 32 3HG2 THR 32 12.888 1.018 -10.937 180 HG22 THR 32 1HG2 THR 32 14.068 2.309 -10.715 181 HG23 THR 32 2HG2 THR 32 14.463 0.916 -11.723 182 H VAL 33 H VAL 33 10.623 3.214 -14.579 183 HA VAL 33 HA VAL 33 8.385 1.498 -14.223 184 HB VAL 33 HB VAL 33 9.542 2.673 -16.755 185 HG11 VAL 33 1HG1 VAL 33 8.201 1.163 -17.742 186 HG12 VAL 33 2HG1 VAL 33 7.285 0.858 -16.265 187 HG13 VAL 33 3HG1 VAL 33 6.909 2.263 -17.264 188 HG21 VAL 33 3HG2 VAL 33 7.085 3.594 -15.297 189 HG22 VAL 33 1HG2 VAL 33 8.687 4.209 -14.891 190 HG23 VAL 33 2HG2 VAL 33 8.035 4.448 -16.512 191 H GLY 34 H GLY 34 11.525 1.139 -15.801 192 HA2 GLY 34 2HA GLY 34 10.982 -1.364 -17.022 193 HA3 GLY 34 3HA GLY 34 12.575 -0.690 -16.713 194 H ALA 35 H ALA 35 12.162 -0.459 -13.842 195 HA ALA 35 HA ALA 35 13.083 -3.023 -13.072 196 HB1 ALA 35 1HB ALA 35 13.098 -2.147 -10.811 197 HB2 ALA 35 2HB ALA 35 13.750 -0.950 -11.932 198 HB3 ALA 35 3HB ALA 35 12.108 -0.776 -11.312 199 H VAL 36 H VAL 36 10.004 -1.329 -12.542 200 HA VAL 36 HA VAL 36 8.796 -3.427 -11.062 201 HB VAL 36 HB VAL 36 7.929 -1.180 -10.875 202 HG11 VAL 36 1HG1 VAL 36 7.141 -1.419 -13.777 203 HG12 VAL 36 2HG1 VAL 36 6.789 -0.060 -12.708 204 HG13 VAL 36 3HG1 VAL 36 8.457 -0.426 -13.150 205 HG21 VAL 36 3HG2 VAL 36 5.772 -2.709 -12.292 206 HG22 VAL 36 1HG2 VAL 36 6.417 -3.255 -10.744 207 HG23 VAL 36 2HG2 VAL 36 5.647 -1.673 -10.870 208 H ARG 37 H ARG 37 8.814 -2.562 -14.484 209 HA ARG 37 HA ARG 37 6.863 -4.414 -15.329 210 HB2 ARG 37 2HB ARG 37 7.753 -2.456 -16.648 211 HB3 ARG 37 3HB ARG 37 9.197 -3.410 -16.959 212 HG2 ARG 37 2HG ARG 37 7.272 -5.143 -17.739 213 HG3 ARG 37 3HG ARG 37 6.517 -3.598 -18.136 214 HD2 ARG 37 2HD ARG 37 7.671 -3.936 -20.068 215 HD3 ARG 37 3HD ARG 37 8.924 -3.113 -19.140 216 HE ARG 37 HE ARG 37 9.107 -5.886 -18.703 217 HH11 ARG 37 1HH1 ARG 37 9.652 -3.506 -21.184 218 HH12 ARG 37 2HH1 ARG 37 10.896 -4.420 -21.970 219 HH21 ARG 37 1HH2 ARG 37 10.744 -7.099 -19.728 220 HH22 ARG 37 2HH2 ARG 37 11.516 -6.464 -21.141 221 H THR 38 H THR 38 10.395 -4.626 -15.112 222 HA THR 38 HA THR 38 10.587 -7.237 -16.204 223 HB THR 38 HB THR 38 12.530 -5.835 -14.358 224 HG1 THR 38 HG1 THR 38 12.829 -6.004 -17.153 225 HG21 THR 38 3HG2 THR 38 13.635 -7.775 -14.420 226 HG22 THR 38 1HG2 THR 38 13.903 -7.477 -16.137 227 HG23 THR 38 2HG2 THR 38 12.525 -8.445 -15.615 228 H LYS 39 H LYS 39 10.316 -5.994 -12.911 229 HA LYS 39 HA LYS 39 10.758 -8.425 -11.562 230 HB2 LYS 39 2HB LYS 39 9.813 -5.748 -10.898 231 HB3 LYS 39 3HB LYS 39 9.004 -6.995 -9.956 232 HG2 LYS 39 2HG LYS 39 11.993 -6.753 -10.200 233 HG3 LYS 39 3HG LYS 39 11.044 -6.039 -8.894 234 HD2 LYS 39 2HD LYS 39 10.808 -8.957 -9.526 235 HD3 LYS 39 3HD LYS 39 12.144 -8.361 -8.540 236 HE2 LYS 39 2HE LYS 39 9.532 -7.321 -7.742 237 HE3 LYS 39 3HE LYS 39 9.666 -9.073 -7.610 238 HZ1 LYS 39 3HZ LYS 39 10.353 -8.087 -5.562 239 HZ2 LYS 39 1HZ LYS 39 11.440 -7.056 -6.348 240 HZ3 LYS 39 2HZ LYS 39 11.726 -8.723 -6.318 241 H VAL 40 H VAL 40 7.797 -6.891 -12.751 242 HA VAL 40 HA VAL 40 6.019 -8.837 -11.704 243 HB VAL 40 HB VAL 40 5.639 -6.942 -14.026 244 HG11 VAL 40 1HG1 VAL 40 4.065 -8.783 -14.150 245 HG12 VAL 40 2HG1 VAL 40 3.618 -8.543 -12.460 246 HG13 VAL 40 3HG1 VAL 40 3.235 -7.307 -13.659 247 HG21 VAL 40 3HG2 VAL 40 5.929 -6.394 -11.314 248 HG22 VAL 40 1HG2 VAL 40 5.267 -5.320 -12.547 249 HG23 VAL 40 2HG2 VAL 40 4.189 -6.343 -11.598 250 H CYS 41 H CYS 41 7.451 -8.374 -14.924 251 HA CYS 41 HA CYS 41 6.202 -10.503 -16.218 252 HB2 CYS 41 2HB CYS 41 8.823 -9.096 -16.650 253 HB3 CYS 41 3HB CYS 41 8.360 -10.463 -17.656 254 HG CYS 41 HG CYS 41 5.868 -8.319 -17.507 255 H ALA 42 H ALA 42 9.253 -10.418 -14.412 256 HA ALA 42 HA ALA 42 9.989 -13.098 -14.877 257 HB1 ALA 42 1HB ALA 42 11.515 -12.813 -12.985 258 HB2 ALA 42 2HB ALA 42 11.576 -11.432 -14.081 259 HB3 ALA 42 3HB ALA 42 10.701 -11.308 -12.556 260 H MET 43 H MET 43 8.143 -11.573 -12.262 261 HA MET 43 HA MET 43 7.866 -13.814 -10.615 262 HB2 MET 43 2HB MET 43 7.275 -11.439 -10.033 263 HB3 MET 43 3HB MET 43 5.812 -11.631 -10.991 264 HG2 MET 43 2HG MET 43 4.805 -12.384 -9.175 265 HG3 MET 43 3HG MET 43 5.835 -13.811 -9.259 266 HE1 MET 43 3HE MET 43 6.604 -14.283 -6.355 267 HE2 MET 43 1HE MET 43 5.664 -13.018 -5.563 268 HE3 MET 43 2HE MET 43 4.990 -13.883 -6.945 269 H LYS 44 H LYS 44 6.229 -12.911 -13.551 270 HA LYS 44 HA LYS 44 4.282 -15.074 -13.221 271 HB2 LYS 44 2HB LYS 44 3.457 -12.860 -13.945 272 HB3 LYS 44 3HB LYS 44 4.481 -12.956 -15.372 273 HG2 LYS 44 2HG LYS 44 2.933 -14.096 -16.468 274 HG3 LYS 44 3HG LYS 44 2.846 -15.304 -15.185 275 HD2 LYS 44 2HD LYS 44 1.440 -12.644 -15.047 276 HD3 LYS 44 3HD LYS 44 0.690 -14.102 -15.702 277 HE2 LYS 44 2HE LYS 44 1.902 -14.652 -13.152 278 HE3 LYS 44 3HE LYS 44 0.798 -13.284 -13.022 279 HZ1 LYS 44 3HZ LYS 44 0.053 -15.861 -12.915 280 HZ2 LYS 44 1HZ LYS 44 -0.230 -15.510 -14.545 281 HZ3 LYS 44 2HZ LYS 44 -0.975 -14.587 -13.340 282 H LYS 45 H LYS 45 7.306 -14.540 -14.549 283 HA LYS 45 HA LYS 45 8.663 -15.770 -15.899 284 HB2 LYS 45 2HB LYS 45 7.414 -17.621 -14.530 285 HB3 LYS 45 3HB LYS 45 6.602 -17.941 -16.057 286 HG2 LYS 45 2HG LYS 45 8.322 -19.378 -16.305 287 HG3 LYS 45 3HG LYS 45 9.126 -17.933 -16.923 288 HD2 LYS 45 2HD LYS 45 9.231 -18.581 -14.003 289 HD3 LYS 45 3HD LYS 45 10.313 -19.400 -15.132 290 HE2 LYS 45 2HE LYS 45 10.893 -17.036 -15.961 291 HE3 LYS 45 3HE LYS 45 10.142 -16.480 -14.466 292 HZ1 LYS 45 3HZ LYS 45 12.158 -16.780 -13.592 293 HZ2 LYS 45 1HZ LYS 45 12.694 -17.740 -14.878 294 HZ3 LYS 45 2HZ LYS 45 11.804 -18.434 -13.618 295 H LEU 46 H LEU 46 7.488 -13.889 -17.272 296 HA LEU 46 HA LEU 46 6.433 -15.179 -19.702 297 HB2 LEU 46 2HB LEU 46 5.828 -12.564 -18.396 298 HB3 LEU 46 3HB LEU 46 5.647 -12.723 -20.142 299 HG LEU 46 HG LEU 46 4.222 -14.435 -18.107 300 HD11 LEU 46 1HD1 LEU 46 3.569 -12.026 -18.066 301 HD12 LEU 46 2HD1 LEU 46 2.271 -13.129 -18.521 302 HD13 LEU 46 3HD1 LEU 46 3.097 -12.182 -19.759 303 HD21 LEU 46 3HD2 LEU 46 2.853 -15.106 -20.024 304 HD22 LEU 46 1HD2 LEU 46 4.548 -15.537 -20.253 305 HD23 LEU 46 2HD2 LEU 46 3.873 -14.138 -21.090 306 HA PRO 47 HA PRO 47 9.832 -13.705 -22.053 307 HB2 PRO 47 2HB PRO 47 8.654 -12.996 -24.394 308 HB3 PRO 47 3HB PRO 47 8.858 -14.679 -23.892 309 HG2 PRO 47 2HG PRO 47 6.439 -12.926 -23.703 310 HG3 PRO 47 3HG PRO 47 6.554 -14.624 -24.199 311 HD2 PRO 47 2HD PRO 47 5.751 -13.882 -21.722 312 HD3 PRO 47 3HD PRO 47 6.646 -15.384 -22.025 313 HA PRO 48 HA PRO 48 9.583 -9.296 -21.110 314 HB2 PRO 48 2HB PRO 48 12.272 -8.916 -21.114 315 HB3 PRO 48 3HB PRO 48 11.401 -9.604 -19.738 316 HG2 PRO 48 2HG PRO 48 12.952 -10.997 -21.887 317 HG3 PRO 48 3HG PRO 48 12.933 -11.306 -20.141 318 HD2 PRO 48 2HD PRO 48 11.534 -12.813 -21.903 319 HD3 PRO 48 3HD PRO 48 10.968 -12.507 -20.248 320 H ASP 49 H ASP 49 11.236 -10.911 -23.737 321 HA ASP 49 HA ASP 49 11.985 -8.624 -25.213 322 HB2 ASP 49 2HB ASP 49 11.454 -11.480 -26.034 323 HB3 ASP 49 3HB ASP 49 12.013 -10.250 -27.165 324 H THR 50 H THR 50 9.070 -10.624 -25.229 325 HA THR 50 HA THR 50 7.796 -8.634 -26.991 326 HB THR 50 HB THR 50 6.168 -10.437 -27.576 327 HG1 THR 50 HG1 THR 50 6.276 -12.014 -26.122 328 HG21 THR 50 3HG2 THR 50 8.969 -10.280 -28.342 329 HG22 THR 50 1HG2 THR 50 7.534 -10.474 -29.348 330 HG23 THR 50 2HG2 THR 50 8.288 -11.885 -28.607 331 H THR 51 H THR 51 7.634 -7.569 -24.742 332 HA THR 51 HA THR 51 4.970 -8.188 -23.700 333 HB THR 51 HB THR 51 6.705 -9.248 -22.204 334 HG1 THR 51 HG1 THR 51 4.520 -8.178 -21.595 335 HG21 THR 51 3HG2 THR 51 7.305 -6.446 -21.300 336 HG22 THR 51 1HG2 THR 51 8.300 -7.263 -22.504 337 HG23 THR 51 2HG2 THR 51 8.142 -7.941 -20.883 338 H ARG 52 H ARG 52 3.837 -6.422 -22.913 339 HA ARG 52 HA ARG 52 5.168 -3.807 -23.167 340 HB2 ARG 52 2HB ARG 52 3.012 -4.833 -24.729 341 HB3 ARG 52 3HB ARG 52 2.391 -3.525 -23.731 342 HG2 ARG 52 2HG ARG 52 3.719 -1.942 -24.737 343 HG3 ARG 52 3HG ARG 52 4.923 -3.125 -25.251 344 HD2 ARG 52 2HD ARG 52 3.675 -3.798 -27.074 345 HD3 ARG 52 3HD ARG 52 2.155 -3.257 -26.363 346 HE ARG 52 HE ARG 52 2.496 -1.206 -27.307 347 HH11 ARG 52 1HH1 ARG 52 5.519 -2.934 -27.247 348 HH12 ARG 52 2HH1 ARG 52 6.368 -1.741 -28.172 349 HH21 ARG 52 1HH2 ARG 52 3.604 0.371 -28.527 350 HH22 ARG 52 2HH2 ARG 52 5.279 0.139 -28.899 351 H LEU 53 H LEU 53 4.005 -2.051 -22.006 352 HA LEU 53 HA LEU 53 2.379 -2.967 -19.755 353 HB2 LEU 53 2HB LEU 53 4.478 -3.041 -18.734 354 HB3 LEU 53 3HB LEU 53 5.037 -1.595 -19.573 355 HG LEU 53 HG LEU 53 3.521 -0.236 -18.174 356 HD11 LEU 53 1HD1 LEU 53 2.200 -2.562 -17.689 357 HD12 LEU 53 2HD1 LEU 53 2.030 -1.089 -16.736 358 HD13 LEU 53 3HD1 LEU 53 3.124 -2.364 -16.200 359 HD21 LEU 53 3HD2 LEU 53 5.330 -1.968 -16.501 360 HD22 LEU 53 1HD2 LEU 53 4.867 -0.292 -16.208 361 HD23 LEU 53 2HD2 LEU 53 5.908 -0.693 -17.574 362 H THR 54 H THR 54 0.700 -1.665 -19.452 363 HA THR 54 HA THR 54 0.912 1.141 -20.326 364 HB THR 54 HB THR 54 -1.803 0.141 -20.481 365 HG1 THR 54 HG1 THR 54 0.239 -1.301 -21.766 366 HG21 THR 54 3HG2 THR 54 0.134 1.629 -22.193 367 HG22 THR 54 1HG2 THR 54 -1.461 2.112 -21.618 368 HG23 THR 54 2HG2 THR 54 -1.313 0.953 -22.939 369 H TYR 55 H TYR 55 0.176 2.641 -18.932 370 HA TYR 55 HA TYR 55 -1.408 1.741 -16.624 371 HB2 TYR 55 2HB TYR 55 0.792 1.927 -15.742 372 HB3 TYR 55 3HB TYR 55 1.087 3.436 -16.599 373 HD1 TYR 55 HD1 TYR 55 -1.304 2.040 -14.082 374 HD2 TYR 55 HD2 TYR 55 0.986 5.385 -15.374 375 HE1 TYR 55 HE1 TYR 55 -2.038 3.300 -12.101 376 HE2 TYR 55 HE2 TYR 55 0.260 6.654 -13.396 377 HH TYR 55 HH TYR 55 -1.503 6.675 -11.768 378 H LYS 56 H LYS 56 -3.166 2.927 -16.277 379 HA LYS 56 HA LYS 56 -4.752 4.544 -16.505 380 HB2 LYS 56 2HB LYS 56 -2.576 5.728 -15.404 381 HB3 LYS 56 3HB LYS 56 -2.783 6.722 -16.839 382 HG2 LYS 56 2HG LYS 56 -5.339 6.526 -15.826 383 HG3 LYS 56 3HG LYS 56 -4.327 6.648 -14.384 384 HD2 LYS 56 2HD LYS 56 -4.346 8.855 -14.736 385 HD3 LYS 56 3HD LYS 56 -3.247 8.536 -16.080 386 HE2 LYS 56 2HE LYS 56 -5.505 8.080 -17.364 387 HE3 LYS 56 3HE LYS 56 -6.169 9.114 -16.100 388 HZ1 LYS 56 3HZ LYS 56 -3.915 9.848 -17.889 389 HZ2 LYS 56 1HZ LYS 56 -4.631 10.843 -16.723 390 HZ3 LYS 56 2HZ LYS 56 -5.514 10.363 -18.082 391 H GLY 57 H GLY 57 -3.812 3.277 -18.914 392 HA2 GLY 57 2HA GLY 57 -4.281 3.467 -21.161 393 HA3 GLY 57 3HA GLY 57 -5.003 5.033 -20.821 394 H ARG 58 H ARG 58 -1.832 4.758 -19.663 395 HA ARG 58 HA ARG 58 -0.771 6.068 -22.078 396 HB2 ARG 58 2HB ARG 58 -1.030 7.136 -19.433 397 HB3 ARG 58 3HB ARG 58 0.678 6.980 -19.820 398 HG2 ARG 58 2HG ARG 58 -0.165 9.179 -20.417 399 HG3 ARG 58 3HG ARG 58 0.347 8.286 -21.851 400 HD2 ARG 58 2HD ARG 58 -1.703 8.342 -22.730 401 HD3 ARG 58 3HD ARG 58 -2.445 7.828 -21.216 402 HE ARG 58 HE ARG 58 -2.919 10.021 -20.737 403 HH11 ARG 58 1HH1 ARG 58 -0.636 9.876 -23.362 404 HH12 ARG 58 2HH1 ARG 58 -0.739 11.569 -23.717 405 HH21 ARG 58 1HH2 ARG 58 -3.062 12.251 -21.195 406 HH22 ARG 58 2HH2 ARG 58 -2.118 12.919 -22.483 407 H ALA 59 H ALA 59 1.611 5.968 -22.248 408 HA ALA 59 HA ALA 59 2.576 3.364 -21.289 409 HB1 ALA 59 1HB ALA 59 3.141 3.065 -23.415 410 HB2 ALA 59 2HB ALA 59 2.746 4.738 -23.811 411 HB3 ALA 59 3HB ALA 59 4.355 4.330 -23.215 412 H LEU 60 H LEU 60 4.361 3.185 -20.046 413 HA LEU 60 HA LEU 60 5.946 5.610 -19.538 414 HB2 LEU 60 2HB LEU 60 4.719 3.726 -17.554 415 HB3 LEU 60 3HB LEU 60 6.131 4.698 -17.145 416 HG LEU 60 HG LEU 60 4.547 6.657 -17.999 417 HD11 LEU 60 1HD1 LEU 60 2.525 4.853 -16.730 418 HD12 LEU 60 2HD1 LEU 60 2.775 4.842 -18.475 419 HD13 LEU 60 3HD1 LEU 60 2.277 6.327 -17.665 420 HD21 LEU 60 3HD2 LEU 60 5.372 6.946 -15.887 421 HD22 LEU 60 1HD2 LEU 60 4.862 5.346 -15.348 422 HD23 LEU 60 2HD2 LEU 60 3.676 6.641 -15.510 423 H LYS 61 H LYS 61 8.124 5.275 -18.978 424 HA LYS 61 HA LYS 61 9.266 2.686 -18.698 425 HB2 LYS 61 2HB LYS 61 8.863 2.481 -21.061 426 HB3 LYS 61 3HB LYS 61 9.547 4.072 -21.367 427 HG2 LYS 61 2HG LYS 61 11.603 3.252 -21.521 428 HG3 LYS 61 3HG LYS 61 11.433 2.350 -20.013 429 HD2 LYS 61 2HD LYS 61 10.295 1.442 -22.653 430 HD3 LYS 61 3HD LYS 61 11.870 0.939 -22.036 431 HE2 LYS 61 2HE LYS 61 9.791 0.607 -20.051 432 HE3 LYS 61 3HE LYS 61 9.412 -0.265 -21.536 433 HZ1 LYS 61 3HZ LYS 61 11.796 -0.565 -19.807 434 HZ2 LYS 61 1HZ LYS 61 11.742 -1.177 -21.383 435 HZ3 LYS 61 2HZ LYS 61 10.650 -1.739 -20.221 436 H ASP 62 H ASP 62 10.535 5.513 -20.431 437 HA ASP 62 HA ASP 62 12.830 5.627 -18.717 438 HB2 ASP 62 2HB ASP 62 12.149 6.589 -21.280 439 HB3 ASP 62 3HB ASP 62 12.501 8.010 -20.300 440 H THR 63 H THR 63 9.712 6.686 -18.347 441 HA THR 63 HA THR 63 9.954 9.256 -17.282 442 HB THR 63 HB THR 63 7.997 7.297 -16.130 443 HG1 THR 63 HG1 THR 63 6.741 7.519 -17.999 444 HG21 THR 63 3HG2 THR 63 7.280 9.237 -15.269 445 HG22 THR 63 1HG2 THR 63 6.699 9.610 -16.892 446 HG23 THR 63 2HG2 THR 63 8.281 10.188 -16.366 447 H GLU 64 H GLU 64 10.979 6.239 -16.029 448 HA GLU 64 HA GLU 64 12.060 5.652 -14.114 449 HB2 GLU 64 2HB GLU 64 12.475 8.545 -14.318 450 HB3 GLU 64 3HB GLU 64 12.573 7.938 -12.671 451 HG2 GLU 64 2HG GLU 64 14.093 6.113 -13.927 452 HG3 GLU 64 3HG GLU 64 14.375 7.514 -14.959 453 H THR 65 H THR 65 10.587 8.566 -12.765 454 HA THR 65 HA THR 65 9.158 6.881 -10.841 455 HB THR 65 HB THR 65 8.948 8.819 -9.445 456 HG1 THR 65 HG1 THR 65 10.171 10.349 -11.514 457 HG21 THR 65 3HG2 THR 65 11.689 9.392 -10.318 458 HG22 THR 65 1HG2 THR 65 11.349 7.679 -10.076 459 HG23 THR 65 2HG2 THR 65 11.092 8.824 -8.759 460 H LEU 66 H LEU 66 6.951 7.351 -10.287 461 HA LEU 66 HA LEU 66 5.433 8.412 -12.572 462 HB2 LEU 66 2HB LEU 66 5.217 5.969 -11.674 463 HB3 LEU 66 3HB LEU 66 4.219 6.720 -10.431 464 HG LEU 66 HG LEU 66 3.526 7.373 -13.229 465 HD11 LEU 66 1HD1 LEU 66 2.472 4.787 -12.261 466 HD12 LEU 66 2HD1 LEU 66 4.123 4.794 -12.881 467 HD13 LEU 66 3HD1 LEU 66 2.795 5.342 -13.904 468 HD21 LEU 66 3HD2 LEU 66 2.379 7.619 -10.698 469 HD22 LEU 66 1HD2 LEU 66 1.436 6.373 -11.515 470 HD23 LEU 66 2HD2 LEU 66 1.620 7.965 -12.252 471 H GLU 67 H GLU 67 6.461 9.306 -9.591 472 HA GLU 67 HA GLU 67 4.215 10.342 -8.299 473 HB2 GLU 67 2HB GLU 67 6.527 10.170 -7.345 474 HB3 GLU 67 3HB GLU 67 6.977 11.565 -8.316 475 HG2 GLU 67 2HG GLU 67 5.955 13.016 -6.945 476 HG3 GLU 67 3HG GLU 67 4.596 11.935 -6.641 477 H SER 68 H SER 68 6.325 11.809 -10.739 478 HA SER 68 HA SER 68 5.067 14.340 -10.749 479 HB2 SER 68 2HB SER 68 7.172 13.013 -12.211 480 HB3 SER 68 3HB SER 68 6.130 13.905 -13.319 481 HG SER 68 HG SER 68 7.358 15.508 -12.681 482 H LEU 69 H LEU 69 4.102 11.314 -11.966 483 HA LEU 69 HA LEU 69 2.239 12.509 -13.885 484 HB2 LEU 69 2HB LEU 69 3.338 9.777 -13.450 485 HB3 LEU 69 3HB LEU 69 1.762 9.939 -14.222 486 HG LEU 69 HG LEU 69 2.718 11.170 -16.048 487 HD11 LEU 69 1HD1 LEU 69 5.275 11.063 -14.461 488 HD12 LEU 69 2HD1 LEU 69 4.360 12.496 -14.929 489 HD13 LEU 69 3HD1 LEU 69 5.180 11.533 -16.159 490 HD21 LEU 69 3HD2 LEU 69 4.713 8.987 -15.695 491 HD22 LEU 69 1HD2 LEU 69 3.748 9.420 -17.107 492 HD23 LEU 69 2HD2 LEU 69 2.999 8.573 -15.753 493 H GLY 70 H GLY 70 2.367 11.373 -10.698 494 HA2 GLY 70 2HA GLY 70 0.504 11.761 -9.234 495 HA3 GLY 70 3HA GLY 70 -0.574 11.407 -10.577 496 H VAL 71 H VAL 71 1.444 10.064 -8.075 497 HA VAL 71 HA VAL 71 0.835 7.327 -8.813 498 HB VAL 71 HB VAL 71 2.275 8.418 -6.390 499 HG11 VAL 71 1HG1 VAL 71 1.472 6.304 -5.764 500 HG12 VAL 71 2HG1 VAL 71 1.781 5.619 -7.361 501 HG13 VAL 71 3HG1 VAL 71 3.129 6.017 -6.295 502 HG21 VAL 71 3HG2 VAL 71 3.814 6.903 -8.343 503 HG22 VAL 71 1HG2 VAL 71 3.124 8.384 -9.008 504 HG23 VAL 71 2HG2 VAL 71 4.164 8.456 -7.585 505 H ALA 72 H ALA 72 -0.545 5.955 -7.761 506 HA ALA 72 HA ALA 72 -2.068 6.994 -5.481 507 HB1 ALA 72 1HB ALA 72 -3.713 7.482 -6.953 508 HB2 ALA 72 2HB ALA 72 -3.130 6.333 -8.157 509 HB3 ALA 72 3HB ALA 72 -4.065 5.763 -6.775 510 H ASP 73 H ASP 73 -2.908 5.421 -4.100 511 HA ASP 73 HA ASP 73 -1.485 2.930 -4.105 512 HB2 ASP 73 2HB ASP 73 -3.511 4.185 -2.268 513 HB3 ASP 73 3HB ASP 73 -2.985 2.519 -2.043 514 H GLY 74 H GLY 74 -2.109 1.071 -4.984 515 HA2 GLY 74 2HA GLY 74 -3.591 -0.665 -5.512 516 HA3 GLY 74 3HA GLY 74 -4.938 0.413 -5.178 517 H ASP 75 H ASP 75 -2.406 1.549 -7.229 518 HA ASP 75 HA ASP 75 -4.060 2.215 -9.348 519 HB2 ASP 75 2HB ASP 75 -1.128 1.911 -8.989 520 HB3 ASP 75 3HB ASP 75 -1.724 1.954 -10.646 521 H LYS 76 H LYS 76 -4.185 1.342 -11.515 522 HA LYS 76 HA LYS 76 -4.156 -1.598 -11.494 523 HB2 LYS 76 2HB LYS 76 -5.925 0.439 -12.729 524 HB3 LYS 76 3HB LYS 76 -5.638 -1.023 -13.662 525 HG2 LYS 76 2HG LYS 76 -7.553 -1.526 -12.469 526 HG3 LYS 76 3HG LYS 76 -6.278 -2.268 -11.500 527 HD2 LYS 76 2HD LYS 76 -7.619 -1.162 -9.934 528 HD3 LYS 76 3HD LYS 76 -6.259 -0.066 -10.187 529 HE2 LYS 76 2HE LYS 76 -7.993 1.413 -10.354 530 HE3 LYS 76 3HE LYS 76 -7.848 0.927 -12.042 531 HZ1 LYS 76 3HZ LYS 76 -9.686 -0.509 -11.838 532 HZ2 LYS 76 1HZ LYS 76 -10.157 0.935 -11.094 533 HZ3 LYS 76 2HZ LYS 76 -9.707 -0.394 -10.151 534 H PHE 77 H PHE 77 -2.836 -2.681 -12.810 535 HA PHE 77 HA PHE 77 -1.477 -1.177 -14.949 536 HB2 PHE 77 2HB PHE 77 -0.450 -3.017 -12.874 537 HB3 PHE 77 3HB PHE 77 0.222 -3.235 -14.486 538 HD1 PHE 77 HD2 PHE 77 -0.834 -0.112 -12.771 539 HD2 PHE 77 HD1 PHE 77 2.382 -2.411 -14.349 540 HE1 PHE 77 HE2 PHE 77 0.699 1.772 -12.382 541 HE2 PHE 77 HE1 PHE 77 3.921 -0.531 -13.962 542 HZ PHE 77 HZ PHE 77 3.080 1.565 -12.979 543 H VAL 78 H VAL 78 -1.289 -2.102 -16.951 544 HA VAL 78 HA VAL 78 -2.717 -4.653 -17.337 545 HB VAL 78 HB VAL 78 -2.454 -2.433 -19.365 546 HG11 VAL 78 1HG1 VAL 78 -4.399 -3.731 -20.387 547 HG12 VAL 78 2HG1 VAL 78 -2.794 -4.454 -20.508 548 HG13 VAL 78 3HG1 VAL 78 -3.938 -5.042 -19.301 549 HG21 VAL 78 3HG2 VAL 78 -3.793 -1.703 -17.443 550 HG22 VAL 78 1HG2 VAL 78 -4.780 -1.896 -18.891 551 HG23 VAL 78 2HG2 VAL 78 -4.821 -3.124 -17.626 552 H LEU 79 H LEU 79 -1.555 -6.281 -18.113 553 HA LEU 79 HA LEU 79 1.056 -5.688 -19.324 554 HB2 LEU 79 2HB LEU 79 0.249 -7.507 -17.334 555 HB3 LEU 79 3HB LEU 79 0.664 -8.470 -18.751 556 HG LEU 79 HG LEU 79 2.508 -6.429 -17.519 557 HD11 LEU 79 1HD1 LEU 79 3.319 -7.943 -16.074 558 HD12 LEU 79 2HD1 LEU 79 3.106 -9.285 -17.198 559 HD13 LEU 79 3HD1 LEU 79 1.735 -8.698 -16.257 560 HD21 LEU 79 3HD2 LEU 79 2.851 -7.035 -19.911 561 HD22 LEU 79 1HD2 LEU 79 3.081 -8.709 -19.405 562 HD23 LEU 79 2HD2 LEU 79 4.202 -7.461 -18.860 563 H ILE 80 H ILE 80 1.481 -6.219 -21.380 564 HA ILE 80 HA ILE 80 -0.586 -7.715 -22.853 565 HB ILE 80 HB ILE 80 1.402 -5.735 -23.970 566 HG12 ILE 80 2HG1 ILE 80 -0.943 -4.535 -24.375 567 HG13 ILE 80 3HG1 ILE 80 -1.382 -5.455 -22.939 568 HG21 ILE 80 1HG2 ILE 80 0.894 -7.135 -25.737 569 HG22 ILE 80 2HG2 ILE 80 -0.752 -7.420 -25.173 570 HG23 ILE 80 3HG2 ILE 80 -0.327 -5.873 -25.905 571 HD11 ILE 80 3HD1 ILE 80 0.971 -4.371 -22.159 572 HD12 ILE 80 1HD1 ILE 80 0.350 -3.113 -23.227 573 HD13 ILE 80 2HD1 ILE 80 -0.613 -3.659 -21.854 574 H THR 81 H THR 81 0.021 -9.305 -24.320 575 HA THR 81 HA THR 81 2.851 -10.118 -24.256 576 HB THR 81 HB THR 81 1.736 -11.639 -22.780 577 HG1 THR 81 HG1 THR 81 1.791 -13.607 -24.297 578 HG21 THR 81 3HG2 THR 81 -0.556 -11.358 -23.324 579 HG22 THR 81 1HG2 THR 81 -0.176 -13.046 -23.664 580 HG23 THR 81 2HG2 THR 81 -0.300 -11.886 -24.987 581 H ARG 82 H ARG 82 3.720 -10.782 -26.157 582 HA ARG 82 HA ARG 82 1.935 -10.760 -28.500 583 HB2 ARG 82 2HB ARG 82 4.223 -9.242 -27.986 584 HB3 ARG 82 3HB ARG 82 4.751 -10.473 -29.126 585 HG2 ARG 82 2HG ARG 82 4.069 -8.592 -30.391 586 HG3 ARG 82 3HG ARG 82 2.818 -9.822 -30.581 587 HD2 ARG 82 2HD ARG 82 1.394 -8.705 -29.013 588 HD3 ARG 82 3HD ARG 82 2.674 -7.573 -28.582 589 HE ARG 82 HE ARG 82 2.360 -7.160 -31.234 590 HH11 ARG 82 1HH1 ARG 82 0.141 -7.241 -28.552 591 HH12 ARG 82 2HH1 ARG 82 -0.958 -6.103 -29.259 592 HH21 ARG 82 1HH2 ARG 82 0.920 -5.661 -32.174 593 HH22 ARG 82 2HH2 ARG 82 -0.515 -5.206 -31.320 594 H THR 83 H THR 83 1.941 -12.451 -29.888 595 HA THR 83 HA THR 83 3.387 -14.837 -29.046 596 HB THR 83 HB THR 83 0.962 -14.995 -29.536 597 HG1 THR 83 HG1 THR 83 2.181 -16.873 -29.783 598 HG21 THR 83 3HG2 THR 83 1.118 -13.320 -31.463 599 HG22 THR 83 1HG2 THR 83 0.073 -14.721 -31.697 600 HG23 THR 83 2HG2 THR 83 1.671 -14.679 -32.441 601 H VAL 84 H VAL 84 3.365 -12.487 -31.602 602 HA VAL 84 HA VAL 84 5.275 -14.081 -33.163 603 HB VAL 84 HB VAL 84 4.889 -12.520 -34.990 604 HG11 VAL 84 1HG1 VAL 84 2.100 -13.023 -34.187 605 HG12 VAL 84 2HG1 VAL 84 2.971 -13.509 -35.643 606 HG13 VAL 84 3HG1 VAL 84 3.171 -14.423 -34.148 607 HG21 VAL 84 3HG2 VAL 84 3.151 -10.766 -34.778 608 HG22 VAL 84 1HG2 VAL 84 3.070 -11.101 -33.048 609 HG23 VAL 84 2HG2 VAL 84 4.558 -10.474 -33.756 610 H GLY 85 H GLY 85 7.052 -12.775 -34.228 611 HA2 GLY 85 2HA GLY 85 8.710 -11.124 -34.156 612 HA3 GLY 85 3HA GLY 85 7.957 -10.463 -32.712 Start of MODEL 11 1 H1 MET 9 H MET 9 1.730 1.487 -1.016 2 HA MET 9 HA MET 9 2.700 0.900 -3.029 3 HB2 MET 9 2HB MET 9 4.230 -0.508 -0.860 4 HB3 MET 9 3HB MET 9 4.752 -0.599 -2.537 5 HG2 MET 9 2HG MET 9 5.847 1.294 -2.231 6 HG3 MET 9 3HG MET 9 4.294 2.108 -2.058 7 HE1 MET 9 3HE MET 9 7.687 1.423 0.060 8 HE2 MET 9 1HE MET 9 7.183 2.653 -1.100 9 HE3 MET 9 2HE MET 9 7.223 3.030 0.623 10 H LYS 10 H LYS 10 0.477 -0.399 -3.237 11 HA LYS 10 HA LYS 10 1.223 -3.148 -3.990 12 HB2 LYS 10 2HB LYS 10 -0.535 -2.579 -2.017 13 HB3 LYS 10 3HB LYS 10 -1.624 -2.596 -3.398 14 HG2 LYS 10 2HG LYS 10 -0.519 -4.863 -3.949 15 HG3 LYS 10 3HG LYS 10 0.030 -4.818 -2.272 16 HD2 LYS 10 2HD LYS 10 -2.847 -4.306 -2.890 17 HD3 LYS 10 3HD LYS 10 -2.241 -5.964 -2.896 18 HE2 LYS 10 2HE LYS 10 -1.266 -5.417 -0.594 19 HE3 LYS 10 3HE LYS 10 -2.312 -3.998 -0.626 20 HZ1 LYS 10 3HZ LYS 10 -3.289 -5.961 0.502 21 HZ2 LYS 10 1HZ LYS 10 -3.289 -6.778 -0.980 22 HZ3 LYS 10 2HZ LYS 10 -4.226 -5.384 -0.782 23 H ILE 11 H ILE 11 0.752 -3.771 -6.022 24 HA ILE 11 HA ILE 11 -1.048 -2.092 -7.624 25 HB ILE 11 HB ILE 11 1.672 -3.045 -8.530 26 HG12 ILE 11 2HG1 ILE 11 1.722 -1.093 -6.999 27 HG13 ILE 11 3HG1 ILE 11 2.266 -0.690 -8.624 28 HG21 ILE 11 1HG2 ILE 11 0.020 -3.136 -10.321 29 HG22 ILE 11 2HG2 ILE 11 -0.429 -1.461 -10.003 30 HG23 ILE 11 3HG2 ILE 11 1.185 -1.842 -10.603 31 HD11 ILE 11 3HD1 ILE 11 0.190 0.383 -9.118 32 HD12 ILE 11 1HD1 ILE 11 -0.511 -0.168 -7.596 33 HD13 ILE 11 2HD1 ILE 11 0.798 1.014 -7.588 34 H LYS 12 H LYS 12 -2.205 -3.151 -9.206 35 HA LYS 12 HA LYS 12 -1.838 -6.070 -9.364 36 HB2 LYS 12 2HB LYS 12 -4.479 -4.598 -9.348 37 HB3 LYS 12 3HB LYS 12 -4.263 -6.339 -9.471 38 HG2 LYS 12 2HG LYS 12 -3.459 -6.482 -7.242 39 HG3 LYS 12 3HG LYS 12 -3.334 -4.726 -7.109 40 HD2 LYS 12 2HD LYS 12 -5.302 -5.269 -5.956 41 HD3 LYS 12 3HD LYS 12 -5.856 -4.694 -7.530 42 HE2 LYS 12 2HE LYS 12 -5.394 -7.480 -7.746 43 HE3 LYS 12 3HE LYS 12 -6.326 -7.209 -6.274 44 HZ1 LYS 12 3HZ LYS 12 -7.293 -7.287 -8.845 45 HZ2 LYS 12 1HZ LYS 12 -7.329 -5.648 -8.426 46 HZ3 LYS 12 2HZ LYS 12 -8.132 -6.785 -7.464 47 H ILE 13 H ILE 13 -1.317 -6.665 -11.353 48 HA ILE 13 HA ILE 13 -2.410 -5.122 -13.615 49 HB ILE 13 HB ILE 13 -0.376 -5.942 -14.884 50 HG12 ILE 13 2HG1 ILE 13 0.583 -6.523 -12.073 51 HG13 ILE 13 3HG1 ILE 13 0.292 -7.717 -13.333 52 HG21 ILE 13 1HG2 ILE 13 0.626 -4.219 -12.697 53 HG22 ILE 13 2HG2 ILE 13 0.691 -3.991 -14.444 54 HG23 ILE 13 3HG2 ILE 13 -0.803 -3.661 -13.567 55 HD11 ILE 13 3HD1 ILE 13 2.355 -7.470 -14.075 56 HD12 ILE 13 1HD1 ILE 13 2.094 -5.743 -14.320 57 HD13 ILE 13 2HD1 ILE 13 2.669 -6.336 -12.761 58 H VAL 14 H VAL 14 -3.730 -6.215 -14.901 59 HA VAL 14 HA VAL 14 -3.645 -9.156 -14.834 60 HB VAL 14 HB VAL 14 -5.775 -8.169 -14.101 61 HG11 VAL 14 1HG1 VAL 14 -5.347 -6.290 -16.029 62 HG12 VAL 14 2HG1 VAL 14 -6.587 -7.298 -16.777 63 HG13 VAL 14 3HG1 VAL 14 -6.882 -6.559 -15.203 64 HG21 VAL 14 3HG2 VAL 14 -7.248 -9.458 -15.592 65 HG22 VAL 14 1HG2 VAL 14 -5.924 -9.611 -16.747 66 HG23 VAL 14 2HG2 VAL 14 -5.797 -10.358 -15.154 67 HA PRO 15 HA PRO 15 -2.174 -9.056 -19.008 68 HB2 PRO 15 2HB PRO 15 -2.552 -11.687 -19.563 69 HB3 PRO 15 3HB PRO 15 -1.228 -11.099 -18.550 70 HG2 PRO 15 2HG PRO 15 -3.855 -12.281 -17.736 71 HG3 PRO 15 3HG PRO 15 -2.238 -12.585 -17.074 72 HD2 PRO 15 2HD PRO 15 -4.018 -10.939 -15.869 73 HD3 PRO 15 3HD PRO 15 -2.265 -10.671 -15.790 74 H ALA 16 H ALA 16 -3.076 -8.734 -20.972 75 HA ALA 16 HA ALA 16 -5.961 -8.925 -21.189 76 HB1 ALA 16 1HB ALA 16 -5.587 -7.765 -23.376 77 HB2 ALA 16 2HB ALA 16 -5.000 -6.888 -21.963 78 HB3 ALA 16 3HB ALA 16 -3.863 -7.749 -23.001 79 H VAL 17 H VAL 17 -5.115 -11.441 -21.011 80 HA VAL 17 HA VAL 17 -4.862 -12.495 -23.737 81 HB VAL 17 HB VAL 17 -4.420 -14.678 -22.611 82 HG11 VAL 17 1HG1 VAL 17 -2.742 -12.491 -22.956 83 HG12 VAL 17 2HG1 VAL 17 -2.366 -13.089 -21.339 84 HG13 VAL 17 3HG1 VAL 17 -2.255 -14.170 -22.728 85 HG21 VAL 17 3HG2 VAL 17 -4.401 -13.006 -20.099 86 HG22 VAL 17 1HG2 VAL 17 -5.609 -14.220 -20.520 87 HG23 VAL 17 2HG2 VAL 17 -3.940 -14.703 -20.220 88 H GLY 18 H GLY 18 -7.316 -11.462 -23.369 89 HA2 GLY 18 2HA GLY 18 -9.565 -11.934 -23.383 90 HA3 GLY 18 3HA GLY 18 -9.064 -13.493 -24.020 91 H GLY 19 H GLY 19 -9.662 -11.697 -21.032 92 HA2 GLY 19 2HA GLY 19 -10.607 -12.411 -19.056 93 HA3 GLY 19 3HA GLY 19 -10.957 -13.945 -19.839 94 H GLY 20 H GLY 20 -7.771 -12.467 -19.468 95 HA2 GLY 20 2HA GLY 20 -6.592 -14.852 -18.531 96 HA3 GLY 20 3HA GLY 20 -5.859 -13.256 -18.472 97 H SER 21 H SER 21 -4.946 -13.831 -16.432 98 HA SER 21 HA SER 21 -6.884 -13.597 -14.228 99 HB2 SER 21 2HB SER 21 -5.036 -14.993 -12.958 100 HB3 SER 21 3HB SER 21 -6.264 -15.805 -13.929 101 HG SER 21 HG SER 21 -4.594 -16.643 -14.895 102 HA PRO 22 HA PRO 22 -4.374 -10.079 -13.230 103 HB2 PRO 22 2HB PRO 22 -5.580 -9.497 -10.868 104 HB3 PRO 22 3HB PRO 22 -6.309 -9.129 -12.436 105 HG2 PRO 22 2HG PRO 22 -6.838 -11.429 -10.593 106 HG3 PRO 22 3HG PRO 22 -7.992 -10.436 -11.502 107 HD2 PRO 22 2HD PRO 22 -7.215 -12.893 -12.332 108 HD3 PRO 22 3HD PRO 22 -7.634 -11.592 -13.464 109 H LEU 23 H LEU 23 -2.645 -9.601 -11.902 110 HA LEU 23 HA LEU 23 -1.983 -11.587 -9.830 111 HB2 LEU 23 2HB LEU 23 0.008 -10.236 -11.640 112 HB3 LEU 23 3HB LEU 23 0.324 -11.514 -10.468 113 HG LEU 23 HG LEU 23 -1.574 -12.133 -12.661 114 HD11 LEU 23 1HD1 LEU 23 0.789 -12.830 -13.808 115 HD12 LEU 23 2HD1 LEU 23 1.189 -11.264 -13.103 116 HD13 LEU 23 3HD1 LEU 23 -0.157 -11.403 -14.235 117 HD21 LEU 23 3HD2 LEU 23 0.355 -13.523 -10.894 118 HD22 LEU 23 1HD2 LEU 23 0.094 -14.204 -12.499 119 HD23 LEU 23 2HD2 LEU 23 -1.268 -13.994 -11.398 120 H GLU 24 H GLU 24 -1.385 -10.795 -7.902 121 HA GLU 24 HA GLU 24 -1.130 -7.877 -7.664 122 HB2 GLU 24 2HB GLU 24 -1.738 -9.880 -5.485 123 HB3 GLU 24 3HB GLU 24 -1.803 -8.129 -5.351 124 HG2 GLU 24 2HG GLU 24 -3.987 -8.405 -5.719 125 HG3 GLU 24 3HG GLU 24 -3.508 -8.546 -7.410 126 H LEU 25 H LEU 25 0.743 -6.995 -7.068 127 HA LEU 25 HA LEU 25 2.700 -8.587 -5.595 128 HB2 LEU 25 2HB LEU 25 2.899 -8.250 -8.331 129 HB3 LEU 25 3HB LEU 25 3.959 -7.001 -7.681 130 HG LEU 25 HG LEU 25 4.488 -9.476 -6.344 131 HD11 LEU 25 1HD1 LEU 25 4.956 -9.693 -9.294 132 HD12 LEU 25 2HD1 LEU 25 3.475 -10.306 -8.559 133 HD13 LEU 25 3HD1 LEU 25 5.039 -10.947 -8.056 134 HD21 LEU 25 3HD2 LEU 25 6.052 -7.711 -8.220 135 HD22 LEU 25 1HD2 LEU 25 6.741 -9.076 -7.341 136 HD23 LEU 25 2HD2 LEU 25 6.083 -7.699 -6.456 137 H GLU 26 H GLU 26 4.357 -7.315 -4.575 138 HA GLU 26 HA GLU 26 3.434 -4.592 -4.001 139 HB2 GLU 26 2HB GLU 26 4.962 -4.770 -2.022 140 HB3 GLU 26 3HB GLU 26 3.644 -5.933 -2.032 141 HG2 GLU 26 2HG GLU 26 5.061 -7.624 -1.919 142 HG3 GLU 26 3HG GLU 26 5.929 -7.052 -3.343 143 H VAL 27 H VAL 27 4.344 -3.128 -5.295 144 HA VAL 27 HA VAL 27 7.265 -3.052 -5.453 145 HB VAL 27 HB VAL 27 6.297 -4.154 -7.533 146 HG11 VAL 27 1HG1 VAL 27 4.940 -3.045 -8.970 147 HG12 VAL 27 2HG1 VAL 27 4.456 -2.213 -7.491 148 HG13 VAL 27 3HG1 VAL 27 5.628 -1.470 -8.579 149 HG21 VAL 27 3HG2 VAL 27 7.868 -3.088 -8.978 150 HG22 VAL 27 1HG2 VAL 27 7.821 -1.603 -8.027 151 HG23 VAL 27 2HG2 VAL 27 8.546 -3.061 -7.350 152 H ALA 28 H ALA 28 8.091 -0.948 -6.153 153 HA ALA 28 HA ALA 28 6.260 1.218 -5.362 154 HB1 ALA 28 1HB ALA 28 8.788 0.558 -4.401 155 HB2 ALA 28 2HB ALA 28 9.043 1.981 -5.412 156 HB3 ALA 28 3HB ALA 28 7.883 2.039 -4.085 157 HA PRO 29 HA PRO 29 6.532 2.350 -9.689 158 HB2 PRO 29 2HB PRO 29 4.734 4.376 -9.523 159 HB3 PRO 29 3HB PRO 29 4.260 2.675 -9.604 160 HG2 PRO 29 2HG PRO 29 4.475 4.471 -7.218 161 HG3 PRO 29 3HG PRO 29 3.210 3.295 -7.623 162 HD2 PRO 29 2HD PRO 29 5.179 2.761 -5.843 163 HD3 PRO 29 3HD PRO 29 4.455 1.507 -6.870 164 H ASN 30 H ASN 30 7.366 4.127 -6.895 165 HA ASN 30 HA ASN 30 8.212 6.501 -8.326 166 HB2 ASN 30 2HB ASN 30 9.010 7.256 -6.096 167 HB3 ASN 30 3HB ASN 30 7.310 6.794 -6.093 168 HD21 ASN 30 1HD2 ASN 30 10.152 6.533 -4.467 169 HD22 ASN 30 2HD2 ASN 30 9.824 5.114 -3.538 170 H ALA 31 H ALA 31 9.403 3.602 -8.472 171 HA ALA 31 HA ALA 31 12.211 4.329 -8.003 172 HB1 ALA 31 1HB ALA 31 10.699 1.819 -7.870 173 HB2 ALA 31 2HB ALA 31 12.278 1.690 -8.646 174 HB3 ALA 31 3HB ALA 31 12.152 2.320 -7.004 175 H THR 32 H THR 32 10.793 2.033 -10.301 176 HA THR 32 HA THR 32 11.544 3.626 -12.584 177 HB THR 32 HB THR 32 12.855 1.292 -13.265 178 HG1 THR 32 HG1 THR 32 13.996 2.010 -10.799 179 HG21 THR 32 3HG2 THR 32 13.764 3.306 -13.989 180 HG22 THR 32 1HG2 THR 32 14.944 2.760 -12.798 181 HG23 THR 32 2HG2 THR 32 13.768 4.002 -12.369 182 H VAL 33 H VAL 33 10.531 2.980 -14.456 183 HA VAL 33 HA VAL 33 8.254 1.307 -14.181 184 HB VAL 33 HB VAL 33 9.500 2.370 -16.720 185 HG11 VAL 33 1HG1 VAL 33 7.958 1.126 -17.736 186 HG12 VAL 33 2HG1 VAL 33 7.206 0.688 -16.201 187 HG13 VAL 33 3HG1 VAL 33 6.743 2.182 -17.016 188 HG21 VAL 33 3HG2 VAL 33 9.031 4.256 -15.397 189 HG22 VAL 33 1HG2 VAL 33 7.638 4.093 -16.466 190 HG23 VAL 33 2HG2 VAL 33 7.529 3.560 -14.789 191 H GLY 34 H GLY 34 11.324 0.929 -15.943 192 HA2 GLY 34 2HA GLY 34 10.745 -1.623 -17.007 193 HA3 GLY 34 3HA GLY 34 12.348 -0.929 -16.821 194 H ALA 35 H ALA 35 12.105 -0.606 -13.936 195 HA ALA 35 HA ALA 35 13.114 -3.121 -13.136 196 HB1 ALA 35 1HB ALA 35 13.124 -2.167 -10.868 197 HB2 ALA 35 2HB ALA 35 13.834 -1.075 -12.058 198 HB3 ALA 35 3HB ALA 35 12.200 -0.787 -11.460 199 H VAL 36 H VAL 36 10.009 -1.503 -12.547 200 HA VAL 36 HA VAL 36 8.925 -3.555 -10.920 201 HB VAL 36 HB VAL 36 7.466 -1.488 -12.572 202 HG11 VAL 36 1HG1 VAL 36 5.830 -3.029 -12.016 203 HG12 VAL 36 2HG1 VAL 36 6.586 -3.428 -10.472 204 HG13 VAL 36 3HG1 VAL 36 5.747 -1.890 -10.673 205 HG21 VAL 36 3HG2 VAL 36 7.417 -0.858 -9.829 206 HG22 VAL 36 1HG2 VAL 36 9.091 -1.243 -10.230 207 HG23 VAL 36 2HG2 VAL 36 8.235 0.013 -11.126 208 H ARG 37 H ARG 37 8.581 -2.793 -14.372 209 HA ARG 37 HA ARG 37 6.768 -4.836 -15.005 210 HB2 ARG 37 2HB ARG 37 7.648 -2.795 -16.402 211 HB3 ARG 37 3HB ARG 37 8.846 -3.951 -16.969 212 HG2 ARG 37 2HG ARG 37 7.093 -5.405 -17.797 213 HG3 ARG 37 3HG ARG 37 5.863 -4.306 -17.168 214 HD2 ARG 37 2HD ARG 37 6.214 -4.008 -19.577 215 HD3 ARG 37 3HD ARG 37 6.628 -2.556 -18.667 216 HE ARG 37 HE ARG 37 8.873 -4.275 -19.167 217 HH11 ARG 37 1HH1 ARG 37 6.894 -1.713 -20.448 218 HH12 ARG 37 2HH1 ARG 37 8.126 -1.115 -21.509 219 HH21 ARG 37 1HH2 ARG 37 10.503 -3.498 -20.560 220 HH22 ARG 37 2HH2 ARG 37 10.178 -2.132 -21.573 221 H THR 38 H THR 38 10.299 -4.789 -14.927 222 HA THR 38 HA THR 38 10.643 -7.397 -16.008 223 HB THR 38 HB THR 38 12.535 -5.765 -14.303 224 HG1 THR 38 HG1 THR 38 13.201 -4.893 -16.163 225 HG21 THR 38 3HG2 THR 38 13.551 -7.800 -14.184 226 HG22 THR 38 1HG2 THR 38 14.148 -7.308 -15.769 227 HG23 THR 38 2HG2 THR 38 12.768 -8.400 -15.646 228 H LYS 39 H LYS 39 10.359 -6.114 -12.738 229 HA LYS 39 HA LYS 39 11.075 -8.455 -11.348 230 HB2 LYS 39 2HB LYS 39 10.995 -6.319 -10.216 231 HB3 LYS 39 3HB LYS 39 9.276 -6.160 -10.553 232 HG2 LYS 39 2HG LYS 39 8.717 -7.342 -8.757 233 HG3 LYS 39 3HG LYS 39 9.886 -8.611 -9.130 234 HD2 LYS 39 2HD LYS 39 10.783 -5.982 -8.004 235 HD3 LYS 39 3HD LYS 39 10.166 -7.253 -6.946 236 HE2 LYS 39 2HE LYS 39 12.050 -8.371 -8.789 237 HE3 LYS 39 3HE LYS 39 12.768 -6.970 -7.995 238 HZ1 LYS 39 3HZ LYS 39 11.847 -8.062 -5.867 239 HZ2 LYS 39 1HZ LYS 39 13.261 -8.684 -6.558 240 HZ3 LYS 39 2HZ LYS 39 11.784 -9.474 -6.797 241 H VAL 40 H VAL 40 7.917 -7.221 -12.400 242 HA VAL 40 HA VAL 40 6.416 -9.370 -11.309 243 HB VAL 40 HB VAL 40 5.674 -7.505 -13.568 244 HG11 VAL 40 1HG1 VAL 40 3.389 -8.255 -12.183 245 HG12 VAL 40 2HG1 VAL 40 3.888 -8.819 -13.779 246 HG13 VAL 40 3HG1 VAL 40 4.314 -9.747 -12.341 247 HG21 VAL 40 3HG2 VAL 40 4.905 -7.271 -10.667 248 HG22 VAL 40 1HG2 VAL 40 6.299 -6.444 -11.363 249 HG23 VAL 40 2HG2 VAL 40 4.677 -6.087 -11.954 250 H CYS 41 H CYS 41 7.622 -8.676 -14.576 251 HA CYS 41 HA CYS 41 6.515 -10.855 -15.901 252 HB2 CYS 41 2HB CYS 41 8.999 -9.228 -16.360 253 HB3 CYS 41 3HB CYS 41 8.625 -10.601 -17.395 254 HG CYS 41 HG CYS 41 7.061 -7.608 -17.167 255 H ALA 42 H ALA 42 9.623 -10.596 -14.208 256 HA ALA 42 HA ALA 42 10.523 -13.204 -14.782 257 HB1 ALA 42 1HB ALA 42 12.318 -12.155 -13.971 258 HB2 ALA 42 2HB ALA 42 11.342 -10.997 -13.068 259 HB3 ALA 42 3HB ALA 42 11.695 -12.580 -12.377 260 H MET 43 H MET 43 8.647 -11.881 -12.089 261 HA MET 43 HA MET 43 8.623 -14.152 -10.458 262 HB2 MET 43 2HB MET 43 7.598 -11.633 -10.271 263 HB3 MET 43 3HB MET 43 6.133 -12.578 -10.500 264 HG2 MET 43 2HG MET 43 8.191 -13.233 -8.414 265 HG3 MET 43 3HG MET 43 6.827 -12.157 -8.121 266 HE1 MET 43 3HE MET 43 7.442 -16.050 -7.202 267 HE2 MET 43 1HE MET 43 7.735 -14.424 -6.584 268 HE3 MET 43 2HE MET 43 6.266 -15.288 -6.130 269 H LYS 44 H LYS 44 6.820 -13.371 -13.332 270 HA LYS 44 HA LYS 44 5.117 -15.731 -12.979 271 HB2 LYS 44 2HB LYS 44 4.940 -13.663 -15.170 272 HB3 LYS 44 3HB LYS 44 3.720 -14.842 -14.706 273 HG2 LYS 44 2HG LYS 44 4.663 -12.659 -12.869 274 HG3 LYS 44 3HG LYS 44 3.303 -12.470 -13.979 275 HD2 LYS 44 2HD LYS 44 2.216 -13.131 -12.063 276 HD3 LYS 44 3HD LYS 44 2.474 -14.688 -12.854 277 HE2 LYS 44 2HE LYS 44 3.936 -15.384 -11.286 278 HE3 LYS 44 3HE LYS 44 4.665 -13.789 -11.111 279 HZ1 LYS 44 3HZ LYS 44 2.041 -14.584 -9.971 280 HZ2 LYS 44 1HZ LYS 44 2.829 -13.105 -9.740 281 HZ3 LYS 44 2HZ LYS 44 3.492 -14.524 -9.104 282 H LYS 45 H LYS 45 8.001 -14.849 -14.404 283 HA LYS 45 HA LYS 45 9.411 -15.879 -15.861 284 HB2 LYS 45 2HB LYS 45 8.359 -17.901 -14.532 285 HB3 LYS 45 3HB LYS 45 7.596 -18.244 -16.079 286 HG2 LYS 45 2HG LYS 45 9.480 -19.495 -16.294 287 HG3 LYS 45 3HG LYS 45 10.065 -17.970 -16.965 288 HD2 LYS 45 2HD LYS 45 10.349 -18.169 -14.061 289 HD3 LYS 45 3HD LYS 45 11.267 -19.386 -14.950 290 HE2 LYS 45 2HE LYS 45 11.369 -16.415 -15.462 291 HE3 LYS 45 3HE LYS 45 12.557 -17.322 -14.528 292 HZ1 LYS 45 3HZ LYS 45 13.600 -17.808 -16.402 293 HZ2 LYS 45 1HZ LYS 45 12.452 -16.947 -17.299 294 HZ3 LYS 45 2HZ LYS 45 12.225 -18.596 -16.996 295 H LEU 46 H LEU 46 8.002 -14.069 -17.101 296 HA LEU 46 HA LEU 46 7.126 -15.358 -19.601 297 HB2 LEU 46 2HB LEU 46 5.866 -13.227 -17.983 298 HB3 LEU 46 3HB LEU 46 5.834 -13.014 -19.732 299 HG LEU 46 HG LEU 46 4.938 -15.571 -19.494 300 HD11 LEU 46 1HD1 LEU 46 3.098 -15.241 -17.692 301 HD12 LEU 46 2HD1 LEU 46 4.237 -14.089 -16.997 302 HD13 LEU 46 3HD1 LEU 46 4.708 -15.776 -17.208 303 HD21 LEU 46 3HD2 LEU 46 3.423 -12.969 -19.521 304 HD22 LEU 46 1HD2 LEU 46 2.661 -14.541 -19.766 305 HD23 LEU 46 2HD2 LEU 46 3.887 -13.970 -20.898 306 HA PRO 47 HA PRO 47 10.021 -12.893 -21.790 307 HB2 PRO 47 2HB PRO 47 8.658 -12.253 -24.050 308 HB3 PRO 47 3HB PRO 47 9.262 -13.881 -23.721 309 HG2 PRO 47 2HG PRO 47 6.504 -12.775 -23.359 310 HG3 PRO 47 3HG PRO 47 7.003 -14.341 -24.026 311 HD2 PRO 47 2HD PRO 47 6.103 -14.058 -21.488 312 HD3 PRO 47 3HD PRO 47 7.319 -15.270 -21.940 313 HA PRO 48 HA PRO 48 8.758 -8.785 -20.401 314 HB2 PRO 48 2HB PRO 48 11.282 -7.786 -20.341 315 HB3 PRO 48 3HB PRO 48 10.616 -8.794 -19.050 316 HG2 PRO 48 2HG PRO 48 12.419 -9.560 -21.314 317 HG3 PRO 48 3HG PRO 48 12.499 -10.040 -19.608 318 HD2 PRO 48 2HD PRO 48 11.466 -11.648 -21.527 319 HD3 PRO 48 3HD PRO 48 10.869 -11.651 -19.855 320 H ASP 49 H ASP 49 10.782 -9.654 -23.135 321 HA ASP 49 HA ASP 49 10.583 -7.044 -24.355 322 HB2 ASP 49 2HB ASP 49 11.950 -9.603 -24.974 323 HB3 ASP 49 3HB ASP 49 11.533 -8.583 -26.348 324 H THR 50 H THR 50 8.914 -10.088 -24.494 325 HA THR 50 HA THR 50 7.415 -9.285 -26.870 326 HB THR 50 HB THR 50 6.865 -11.820 -25.373 327 HG1 THR 50 HG1 THR 50 8.579 -12.723 -26.798 328 HG21 THR 50 3HG2 THR 50 6.976 -11.229 -28.330 329 HG22 THR 50 1HG2 THR 50 5.514 -11.100 -27.353 330 HG23 THR 50 2HG2 THR 50 6.308 -12.662 -27.550 331 H THR 51 H THR 51 7.153 -8.016 -24.158 332 HA THR 51 HA THR 51 4.234 -8.183 -24.021 333 HB THR 51 HB THR 51 5.080 -9.662 -22.235 334 HG1 THR 51 HG1 THR 51 3.617 -8.897 -20.847 335 HG21 THR 51 3HG2 THR 51 7.214 -8.310 -21.919 336 HG22 THR 51 1HG2 THR 51 6.426 -8.892 -20.453 337 HG23 THR 51 2HG2 THR 51 6.246 -7.207 -20.942 338 H ARG 52 H ARG 52 3.215 -6.291 -23.392 339 HA ARG 52 HA ARG 52 4.978 -3.952 -23.063 340 HB2 ARG 52 2HB ARG 52 3.076 -4.472 -25.082 341 HB3 ARG 52 3HB ARG 52 2.377 -3.229 -24.053 342 HG2 ARG 52 2HG ARG 52 3.513 -1.979 -25.610 343 HG3 ARG 52 3HG ARG 52 4.695 -2.086 -24.304 344 HD2 ARG 52 2HD ARG 52 5.741 -4.004 -25.469 345 HD3 ARG 52 3HD ARG 52 4.607 -3.776 -26.800 346 HE ARG 52 HE ARG 52 6.940 -2.192 -26.213 347 HH11 ARG 52 1HH1 ARG 52 3.855 -2.290 -27.824 348 HH12 ARG 52 2HH1 ARG 52 4.263 -1.051 -28.963 349 HH21 ARG 52 1HH2 ARG 52 7.490 -0.559 -27.708 350 HH22 ARG 52 2HH2 ARG 52 6.331 -0.067 -28.897 351 H LEU 53 H LEU 53 3.886 -2.083 -21.976 352 HA LEU 53 HA LEU 53 1.837 -2.905 -20.049 353 HB2 LEU 53 2HB LEU 53 3.730 -3.199 -18.730 354 HB3 LEU 53 3HB LEU 53 4.558 -1.818 -19.445 355 HG LEU 53 HG LEU 53 2.986 -0.318 -18.246 356 HD11 LEU 53 1HD1 LEU 53 1.796 -2.904 -17.529 357 HD12 LEU 53 2HD1 LEU 53 1.064 -1.304 -17.636 358 HD13 LEU 53 3HD1 LEU 53 1.970 -1.763 -16.195 359 HD21 LEU 53 3HD2 LEU 53 5.256 -1.192 -17.371 360 HD22 LEU 53 1HD2 LEU 53 4.277 -2.133 -16.246 361 HD23 LEU 53 2HD2 LEU 53 4.167 -0.373 -16.250 362 H THR 54 H THR 54 0.282 -1.431 -19.798 363 HA THR 54 HA THR 54 0.838 1.344 -20.615 364 HB THR 54 HB THR 54 -1.768 1.211 -21.204 365 HG1 THR 54 HG1 THR 54 -2.435 -0.771 -21.490 366 HG21 THR 54 3HG2 THR 54 -0.605 0.220 -23.536 367 HG22 THR 54 1HG2 THR 54 0.705 1.047 -22.694 368 HG23 THR 54 2HG2 THR 54 -0.782 1.914 -23.079 369 H TYR 55 H TYR 55 0.083 2.919 -19.300 370 HA TYR 55 HA TYR 55 -1.711 2.140 -17.103 371 HB2 TYR 55 2HB TYR 55 0.427 2.213 -16.070 372 HB3 TYR 55 3HB TYR 55 0.873 3.685 -16.926 373 HD1 TYR 55 HD1 TYR 55 -2.276 2.938 -15.089 374 HD2 TYR 55 HD2 TYR 55 1.320 5.208 -15.210 375 HE1 TYR 55 HE1 TYR 55 -3.065 4.278 -13.184 376 HE2 TYR 55 HE2 TYR 55 0.542 6.554 -13.305 377 HH TYR 55 HH TYR 55 -2.535 6.736 -12.318 378 H LYS 56 H LYS 56 -3.418 3.426 -16.885 379 HA LYS 56 HA LYS 56 -4.890 5.128 -17.227 380 HB2 LYS 56 2HB LYS 56 -2.632 6.215 -16.084 381 HB3 LYS 56 3HB LYS 56 -2.881 7.245 -17.488 382 HG2 LYS 56 2HG LYS 56 -4.996 6.641 -15.435 383 HG3 LYS 56 3HG LYS 56 -3.964 8.072 -15.418 384 HD2 LYS 56 2HD LYS 56 -5.660 7.348 -17.793 385 HD3 LYS 56 3HD LYS 56 -6.281 8.319 -16.456 386 HE2 LYS 56 2HE LYS 56 -3.927 9.575 -16.998 387 HE3 LYS 56 3HE LYS 56 -4.410 9.028 -18.603 388 HZ1 LYS 56 3HZ LYS 56 -5.301 11.199 -18.208 389 HZ2 LYS 56 1HZ LYS 56 -6.006 10.711 -16.750 390 HZ3 LYS 56 2HZ LYS 56 -6.583 10.096 -18.216 391 H GLY 57 H GLY 57 -3.893 3.770 -19.556 392 HA2 GLY 57 2HA GLY 57 -4.212 3.950 -21.830 393 HA3 GLY 57 3HA GLY 57 -4.854 5.562 -21.555 394 H ARG 58 H ARG 58 -1.794 5.157 -20.186 395 HA ARG 58 HA ARG 58 -0.500 6.324 -22.561 396 HB2 ARG 58 2HB ARG 58 -1.010 7.665 -20.199 397 HB3 ARG 58 3HB ARG 58 0.657 7.140 -20.005 398 HG2 ARG 58 2HG ARG 58 0.603 9.347 -20.961 399 HG3 ARG 58 3HG ARG 58 1.216 8.200 -22.155 400 HD2 ARG 58 2HD ARG 58 -0.804 8.220 -23.363 401 HD3 ARG 58 3HD ARG 58 -1.679 8.989 -22.041 402 HE ARG 58 HE ARG 58 0.428 10.644 -22.992 403 HH11 ARG 58 1HH1 ARG 58 -2.798 9.557 -23.721 404 HH12 ARG 58 2HH1 ARG 58 -3.209 10.972 -24.633 405 HH21 ARG 58 1HH2 ARG 58 -0.100 12.511 -24.190 406 HH22 ARG 58 2HH2 ARG 58 -1.673 12.651 -24.900 407 H ALA 59 H ALA 59 1.752 5.911 -22.792 408 HA ALA 59 HA ALA 59 2.579 3.414 -21.488 409 HB1 ALA 59 1HB ALA 59 3.999 3.016 -23.354 410 HB2 ALA 59 2HB ALA 59 2.434 3.524 -23.990 411 HB3 ALA 59 3HB ALA 59 3.781 4.662 -23.950 412 H LEU 60 H LEU 60 4.001 3.552 -19.892 413 HA LEU 60 HA LEU 60 5.884 5.818 -19.872 414 HB2 LEU 60 2HB LEU 60 4.860 4.225 -17.527 415 HB3 LEU 60 3HB LEU 60 5.953 5.605 -17.452 416 HG LEU 60 HG LEU 60 3.936 6.837 -18.622 417 HD11 LEU 60 1HD1 LEU 60 2.368 5.179 -18.966 418 HD12 LEU 60 2HD1 LEU 60 1.827 5.887 -17.444 419 HD13 LEU 60 3HD1 LEU 60 2.730 4.372 -17.440 420 HD21 LEU 60 3HD2 LEU 60 3.642 6.212 -15.706 421 HD22 LEU 60 1HD2 LEU 60 3.382 7.739 -16.551 422 HD23 LEU 60 2HD2 LEU 60 5.021 7.136 -16.305 423 H LYS 61 H LYS 61 8.025 5.427 -19.110 424 HA LYS 61 HA LYS 61 8.958 2.779 -18.580 425 HB2 LYS 61 2HB LYS 61 10.583 3.176 -20.724 426 HB3 LYS 61 3HB LYS 61 9.151 2.154 -20.740 427 HG2 LYS 61 2HG LYS 61 7.864 3.768 -21.826 428 HG3 LYS 61 3HG LYS 61 8.994 5.065 -21.430 429 HD2 LYS 61 2HD LYS 61 9.494 4.694 -23.647 430 HD3 LYS 61 3HD LYS 61 10.667 3.642 -22.851 431 HE2 LYS 61 2HE LYS 61 8.614 1.933 -23.072 432 HE3 LYS 61 3HE LYS 61 8.281 2.962 -24.463 433 HZ1 LYS 61 3HZ LYS 61 10.961 1.804 -23.998 434 HZ2 LYS 61 1HZ LYS 61 10.319 2.429 -25.433 435 HZ3 LYS 61 2HZ LYS 61 9.760 0.952 -24.829 436 H ASP 62 H ASP 62 10.392 5.604 -20.213 437 HA ASP 62 HA ASP 62 12.661 5.581 -18.464 438 HB2 ASP 62 2HB ASP 62 11.917 6.849 -20.939 439 HB3 ASP 62 3HB ASP 62 12.562 8.051 -19.824 440 H THR 63 H THR 63 9.558 6.665 -18.065 441 HA THR 63 HA THR 63 9.824 9.166 -16.852 442 HB THR 63 HB THR 63 7.821 7.374 -15.634 443 HG1 THR 63 HG1 THR 63 7.858 7.912 -18.433 444 HG21 THR 63 3HG2 THR 63 6.764 9.323 -15.396 445 HG22 THR 63 1HG2 THR 63 6.813 9.616 -17.134 446 HG23 THR 63 2HG2 THR 63 8.165 10.115 -16.117 447 H GLU 64 H GLU 64 10.794 6.067 -15.764 448 HA GLU 64 HA GLU 64 11.846 5.355 -13.876 449 HB2 GLU 64 2HB GLU 64 12.306 8.249 -13.910 450 HB3 GLU 64 3HB GLU 64 12.381 7.545 -12.300 451 HG2 GLU 64 2HG GLU 64 13.849 5.805 -13.886 452 HG3 GLU 64 3HG GLU 64 14.283 7.412 -14.465 453 H THR 65 H THR 65 10.401 8.211 -12.379 454 HA THR 65 HA THR 65 8.943 6.447 -10.554 455 HB THR 65 HB THR 65 8.769 8.276 -9.049 456 HG1 THR 65 HG1 THR 65 9.567 10.400 -9.771 457 HG21 THR 65 3HG2 THR 65 11.464 8.940 -10.083 458 HG22 THR 65 1HG2 THR 65 11.152 7.245 -9.714 459 HG23 THR 65 2HG2 THR 65 10.957 8.470 -8.461 460 H LEU 66 H LEU 66 6.744 7.105 -9.888 461 HA LEU 66 HA LEU 66 5.256 8.388 -12.082 462 HB2 LEU 66 2HB LEU 66 5.047 5.706 -11.069 463 HB3 LEU 66 3HB LEU 66 3.531 6.570 -10.822 464 HG LEU 66 HG LEU 66 3.400 5.379 -12.891 465 HD11 LEU 66 1HD1 LEU 66 2.984 8.094 -12.642 466 HD12 LEU 66 2HD1 LEU 66 2.380 7.059 -13.935 467 HD13 LEU 66 3HD1 LEU 66 3.888 7.948 -14.150 468 HD21 LEU 66 3HD2 LEU 66 6.078 5.622 -13.061 469 HD22 LEU 66 1HD2 LEU 66 5.578 6.852 -14.222 470 HD23 LEU 66 2HD2 LEU 66 5.045 5.183 -14.422 471 H GLU 67 H GLU 67 5.396 7.617 -8.645 472 HA GLU 67 HA GLU 67 3.095 8.951 -7.800 473 HB2 GLU 67 2HB GLU 67 4.321 7.476 -6.317 474 HB3 GLU 67 3HB GLU 67 5.722 8.537 -6.366 475 HG2 GLU 67 2HG GLU 67 4.390 10.300 -5.277 476 HG3 GLU 67 3HG GLU 67 3.038 9.174 -5.164 477 H SER 68 H SER 68 6.204 10.165 -8.761 478 HA SER 68 HA SER 68 6.077 12.709 -7.555 479 HB2 SER 68 2HB SER 68 8.124 11.649 -8.577 480 HB3 SER 68 3HB SER 68 7.455 12.036 -10.162 481 HG SER 68 HG SER 68 7.672 14.067 -8.244 482 H LEU 69 H LEU 69 4.302 11.353 -10.104 483 HA LEU 69 HA LEU 69 3.638 13.964 -11.255 484 HB2 LEU 69 2HB LEU 69 3.340 11.138 -12.148 485 HB3 LEU 69 3HB LEU 69 2.228 12.349 -12.783 486 HG LEU 69 HG LEU 69 4.067 13.588 -13.747 487 HD11 LEU 69 1HD1 LEU 69 5.765 11.550 -12.337 488 HD12 LEU 69 2HD1 LEU 69 5.827 13.307 -12.213 489 HD13 LEU 69 3HD1 LEU 69 6.362 12.509 -13.691 490 HD21 LEU 69 3HD2 LEU 69 4.089 12.280 -15.553 491 HD22 LEU 69 1HD2 LEU 69 3.161 11.125 -14.596 492 HD23 LEU 69 2HD2 LEU 69 4.916 10.976 -14.701 493 H GLY 70 H GLY 70 2.498 11.734 -8.980 494 HA2 GLY 70 2HA GLY 70 0.636 12.651 -7.606 495 HA3 GLY 70 3HA GLY 70 -0.205 12.922 -9.125 496 H VAL 71 H VAL 71 1.679 10.047 -8.755 497 HA VAL 71 HA VAL 71 -0.756 8.453 -8.912 498 HB VAL 71 HB VAL 71 2.140 7.621 -9.136 499 HG11 VAL 71 1HG1 VAL 71 1.383 5.555 -8.793 500 HG12 VAL 71 2HG1 VAL 71 -0.298 6.090 -8.828 501 HG13 VAL 71 3HG1 VAL 71 0.536 5.699 -10.333 502 HG21 VAL 71 3HG2 VAL 71 1.600 8.961 -11.013 503 HG22 VAL 71 1HG2 VAL 71 1.483 7.286 -11.553 504 HG23 VAL 71 2HG2 VAL 71 0.019 8.201 -11.192 505 H ALA 72 H ALA 72 -1.541 7.231 -7.305 506 HA ALA 72 HA ALA 72 -0.045 7.190 -4.775 507 HB1 ALA 72 1HB ALA 72 -1.987 7.989 -4.011 508 HB2 ALA 72 2HB ALA 72 -2.867 7.488 -5.456 509 HB3 ALA 72 3HB ALA 72 -2.570 6.331 -4.159 510 H ASP 73 H ASP 73 -0.713 5.195 -3.380 511 HA ASP 73 HA ASP 73 0.157 2.872 -4.843 512 HB2 ASP 73 2HB ASP 73 -0.008 1.759 -2.586 513 HB3 ASP 73 3HB ASP 73 1.066 3.153 -2.650 514 H GLY 74 H GLY 74 -1.019 1.137 -5.464 515 HA2 GLY 74 2HA GLY 74 -2.917 -0.341 -5.159 516 HA3 GLY 74 3HA GLY 74 -3.859 1.059 -4.670 517 H ASP 75 H ASP 75 -1.769 1.563 -7.324 518 HA ASP 75 HA ASP 75 -3.947 2.115 -9.074 519 HB2 ASP 75 2HB ASP 75 -1.135 2.605 -9.015 520 HB3 ASP 75 3HB ASP 75 -1.531 1.852 -10.558 521 H LYS 76 H LYS 76 -3.633 1.202 -11.464 522 HA LYS 76 HA LYS 76 -3.109 -1.664 -11.441 523 HB2 LYS 76 2HB LYS 76 -5.802 -0.420 -11.777 524 HB3 LYS 76 3HB LYS 76 -5.410 -1.838 -12.741 525 HG2 LYS 76 2HG LYS 76 -5.082 -3.170 -10.807 526 HG3 LYS 76 3HG LYS 76 -5.137 -1.759 -9.748 527 HD2 LYS 76 2HD LYS 76 -7.265 -2.564 -9.469 528 HD3 LYS 76 3HD LYS 76 -7.522 -1.459 -10.822 529 HE2 LYS 76 2HE LYS 76 -8.002 -3.128 -12.243 530 HE3 LYS 76 3HE LYS 76 -6.714 -4.157 -11.620 531 HZ1 LYS 76 3HZ LYS 76 -8.238 -5.331 -10.555 532 HZ2 LYS 76 1HZ LYS 76 -9.468 -4.312 -11.112 533 HZ3 LYS 76 2HZ LYS 76 -8.684 -3.971 -9.654 534 H PHE 77 H PHE 77 -2.158 -2.292 -13.272 535 HA PHE 77 HA PHE 77 -2.418 -0.553 -15.637 536 HB2 PHE 77 2HB PHE 77 0.044 -2.185 -15.086 537 HB3 PHE 77 3HB PHE 77 -0.138 -0.779 -16.130 538 HD1 PHE 77 HD1 PHE 77 -1.429 1.161 -14.393 539 HD2 PHE 77 HD2 PHE 77 1.654 -1.643 -13.528 540 HE1 PHE 77 HE1 PHE 77 -0.623 2.612 -12.577 541 HE2 PHE 77 HE2 PHE 77 2.464 -0.197 -11.710 542 HZ PHE 77 HZ PHE 77 1.325 1.934 -11.232 543 H VAL 78 H VAL 78 -2.368 -1.565 -17.683 544 HA VAL 78 HA VAL 78 -3.243 -4.363 -17.604 545 HB VAL 78 HB VAL 78 -3.488 -2.368 -19.859 546 HG11 VAL 78 1HG1 VAL 78 -4.703 -5.103 -19.481 547 HG12 VAL 78 2HG1 VAL 78 -5.069 -3.993 -20.803 548 HG13 VAL 78 3HG1 VAL 78 -3.448 -4.668 -20.641 549 HG21 VAL 78 3HG2 VAL 78 -4.951 -1.502 -18.313 550 HG22 VAL 78 1HG2 VAL 78 -5.993 -2.661 -19.138 551 HG23 VAL 78 2HG2 VAL 78 -5.277 -3.073 -17.580 552 H LEU 79 H LEU 79 -1.995 -5.944 -18.359 553 HA LEU 79 HA LEU 79 0.413 -5.209 -19.877 554 HB2 LEU 79 2HB LEU 79 -0.120 -7.068 -17.720 555 HB3 LEU 79 3HB LEU 79 0.671 -7.857 -19.083 556 HG LEU 79 HG LEU 79 1.802 -5.328 -17.947 557 HD11 LEU 79 1HD1 LEU 79 3.027 -6.479 -16.303 558 HD12 LEU 79 2HD1 LEU 79 2.538 -8.055 -16.923 559 HD13 LEU 79 3HD1 LEU 79 1.360 -7.024 -16.111 560 HD21 LEU 79 3HD2 LEU 79 2.490 -6.772 -20.104 561 HD22 LEU 79 1HD2 LEU 79 3.458 -7.588 -18.876 562 HD23 LEU 79 2HD2 LEU 79 3.647 -5.854 -19.139 563 H ILE 80 H ILE 80 0.712 -5.938 -21.894 564 HA ILE 80 HA ILE 80 -1.292 -7.804 -22.975 565 HB ILE 80 HB ILE 80 -1.228 -5.524 -23.989 566 HG12 ILE 80 2HG1 ILE 80 -0.340 -7.215 -26.226 567 HG13 ILE 80 3HG1 ILE 80 -1.554 -7.962 -25.194 568 HG21 ILE 80 1HG2 ILE 80 1.338 -6.290 -25.318 569 HG22 ILE 80 2HG2 ILE 80 0.597 -4.700 -25.149 570 HG23 ILE 80 3HG2 ILE 80 1.353 -5.472 -23.756 571 HD11 ILE 80 3HD1 ILE 80 -2.766 -5.659 -25.502 572 HD12 ILE 80 1HD1 ILE 80 -1.759 -5.574 -26.947 573 HD13 ILE 80 2HD1 ILE 80 -2.878 -6.920 -26.729 574 H THR 81 H THR 81 -0.651 -9.509 -24.295 575 HA THR 81 HA THR 81 2.237 -10.094 -24.313 576 HB THR 81 HB THR 81 0.995 -11.496 -22.659 577 HG1 THR 81 HG1 THR 81 1.883 -13.494 -23.513 578 HG21 THR 81 3HG2 THR 81 -0.478 -13.262 -23.485 579 HG22 THR 81 1HG2 THR 81 -0.328 -12.633 -25.125 580 HG23 THR 81 2HG2 THR 81 -1.126 -11.671 -23.881 581 H ARG 82 H ARG 82 3.095 -10.836 -26.187 582 HA ARG 82 HA ARG 82 1.254 -11.085 -28.469 583 HB2 ARG 82 2HB ARG 82 3.873 -9.811 -28.114 584 HB3 ARG 82 3HB ARG 82 3.756 -10.802 -29.562 585 HG2 ARG 82 2HG ARG 82 1.558 -9.513 -29.985 586 HG3 ARG 82 3HG ARG 82 2.209 -8.357 -28.821 587 HD2 ARG 82 2HD ARG 82 4.009 -7.807 -30.184 588 HD3 ARG 82 3HD ARG 82 3.875 -9.293 -31.124 589 HE ARG 82 HE ARG 82 1.546 -7.784 -31.500 590 HH11 ARG 82 1HH1 ARG 82 4.943 -7.670 -32.251 591 HH12 ARG 82 2HH1 ARG 82 4.726 -6.746 -33.700 592 HH21 ARG 82 1HH2 ARG 82 1.246 -6.567 -33.406 593 HH22 ARG 82 2HH2 ARG 82 2.622 -6.118 -34.356 594 H THR 83 H THR 83 1.696 -12.687 -30.075 595 HA THR 83 HA THR 83 3.188 -15.000 -29.018 596 HB THR 83 HB THR 83 1.659 -16.464 -30.213 597 HG1 THR 83 HG1 THR 83 -0.159 -15.541 -31.289 598 HG21 THR 83 3HG2 THR 83 0.989 -15.937 -27.975 599 HG22 THR 83 1HG2 THR 83 -0.457 -15.919 -28.984 600 HG23 THR 83 2HG2 THR 83 0.291 -14.401 -28.489 601 H VAL 84 H VAL 84 4.832 -15.740 -30.197 602 HA VAL 84 HA VAL 84 4.923 -15.112 -33.067 603 HB VAL 84 HB VAL 84 7.388 -14.731 -32.848 604 HG11 VAL 84 1HG1 VAL 84 5.250 -12.946 -31.923 605 HG12 VAL 84 2HG1 VAL 84 6.879 -12.462 -31.449 606 HG13 VAL 84 3HG1 VAL 84 6.488 -12.694 -33.153 607 HG21 VAL 84 3HG2 VAL 84 8.421 -14.397 -30.772 608 HG22 VAL 84 1HG2 VAL 84 6.879 -14.295 -29.922 609 HG23 VAL 84 2HG2 VAL 84 7.442 -15.846 -30.544 610 H GLY 85 H GLY 85 6.517 -16.460 -34.253 611 HA2 GLY 85 2HA GLY 85 8.012 -18.496 -33.841 612 HA3 GLY 85 3HA GLY 85 6.574 -19.167 -33.087 Start of MODEL 12 1 H1 MET 9 H MET 9 1.597 -0.982 0.359 2 HA MET 9 HA MET 9 1.108 0.746 -1.951 3 HB2 MET 9 2HB MET 9 3.776 0.062 -0.779 4 HB3 MET 9 3HB MET 9 3.627 0.263 -2.520 5 HG2 MET 9 2HG MET 9 4.099 2.401 -2.049 6 HG3 MET 9 3HG MET 9 2.376 2.490 -1.688 7 HE1 MET 9 3HE MET 9 2.689 4.481 -0.619 8 HE2 MET 9 1HE MET 9 1.937 4.008 0.905 9 HE3 MET 9 2HE MET 9 3.504 4.817 0.909 10 H LYS 10 H LYS 10 -0.216 -0.831 -2.834 11 HA LYS 10 HA LYS 10 1.192 -3.240 -3.770 12 HB2 LYS 10 2HB LYS 10 -1.354 -3.018 -2.288 13 HB3 LYS 10 3HB LYS 10 -1.380 -4.102 -3.672 14 HG2 LYS 10 2HG LYS 10 0.609 -5.257 -2.726 15 HG3 LYS 10 3HG LYS 10 0.452 -4.243 -1.289 16 HD2 LYS 10 2HD LYS 10 -0.916 -5.809 -0.481 17 HD3 LYS 10 3HD LYS 10 -2.096 -5.263 -1.675 18 HE2 LYS 10 2HE LYS 10 -1.169 -6.889 -3.284 19 HE3 LYS 10 3HE LYS 10 -0.062 -7.462 -2.038 20 HZ1 LYS 10 3HZ LYS 10 -2.094 -7.963 -0.682 21 HZ2 LYS 10 1HZ LYS 10 -1.890 -8.929 -2.056 22 HZ3 LYS 10 2HZ LYS 10 -3.018 -7.669 -2.068 23 H ILE 11 H ILE 11 0.516 -4.061 -5.802 24 HA ILE 11 HA ILE 11 -1.225 -2.301 -7.380 25 HB ILE 11 HB ILE 11 0.310 -2.423 -9.290 26 HG12 ILE 11 2HG1 ILE 11 2.714 -3.140 -7.877 27 HG13 ILE 11 3HG1 ILE 11 1.540 -4.446 -7.754 28 HG21 ILE 11 1HG2 ILE 11 1.768 -0.724 -8.587 29 HG22 ILE 11 2HG2 ILE 11 0.365 -0.581 -7.529 30 HG23 ILE 11 3HG2 ILE 11 1.838 -1.349 -6.939 31 HD11 ILE 11 3HD1 ILE 11 3.070 -4.667 -9.673 32 HD12 ILE 11 1HD1 ILE 11 1.372 -4.586 -10.143 33 HD13 ILE 11 2HD1 ILE 11 2.410 -3.172 -10.335 34 H LYS 12 H LYS 12 -2.391 -3.299 -8.998 35 HA LYS 12 HA LYS 12 -2.189 -6.239 -9.086 36 HB2 LYS 12 2HB LYS 12 -4.322 -4.818 -8.176 37 HB3 LYS 12 3HB LYS 12 -4.749 -5.001 -9.873 38 HG2 LYS 12 2HG LYS 12 -4.182 -7.504 -9.475 39 HG3 LYS 12 3HG LYS 12 -4.402 -7.092 -7.773 40 HD2 LYS 12 2HD LYS 12 -6.616 -5.980 -8.699 41 HD3 LYS 12 3HD LYS 12 -6.387 -7.163 -9.989 42 HE2 LYS 12 2HE LYS 12 -7.379 -8.653 -8.667 43 HE3 LYS 12 3HE LYS 12 -5.945 -8.588 -7.643 44 HZ1 LYS 12 3HZ LYS 12 -7.705 -8.144 -6.211 45 HZ2 LYS 12 1HZ LYS 12 -8.501 -7.144 -7.319 46 HZ3 LYS 12 2HZ LYS 12 -7.091 -6.606 -6.557 47 H ILE 13 H ILE 13 -1.456 -6.961 -10.964 48 HA ILE 13 HA ILE 13 -2.136 -5.461 -13.409 49 HB ILE 13 HB ILE 13 0.235 -5.265 -12.996 50 HG12 ILE 13 2HG1 ILE 13 0.422 -7.330 -15.072 51 HG13 ILE 13 3HG1 ILE 13 -0.892 -6.187 -15.329 52 HG21 ILE 13 1HG2 ILE 13 0.354 -7.326 -11.559 53 HG22 ILE 13 2HG2 ILE 13 0.431 -8.267 -13.048 54 HG23 ILE 13 3HG2 ILE 13 1.702 -7.103 -12.674 55 HD11 ILE 13 3HD1 ILE 13 1.110 -4.491 -14.738 56 HD12 ILE 13 1HD1 ILE 13 2.014 -5.803 -15.495 57 HD13 ILE 13 2HD1 ILE 13 0.705 -5.011 -16.373 58 H VAL 14 H VAL 14 -3.425 -6.527 -14.744 59 HA VAL 14 HA VAL 14 -3.609 -9.447 -14.524 60 HB VAL 14 HB VAL 14 -5.487 -7.671 -16.069 61 HG11 VAL 14 1HG1 VAL 14 -6.594 -10.014 -14.794 62 HG12 VAL 14 2HG1 VAL 14 -6.615 -9.542 -16.494 63 HG13 VAL 14 3HG1 VAL 14 -5.240 -10.434 -15.842 64 HG21 VAL 14 3HG2 VAL 14 -5.174 -7.939 -13.179 65 HG22 VAL 14 1HG2 VAL 14 -6.067 -6.742 -14.118 66 HG23 VAL 14 2HG2 VAL 14 -6.805 -8.299 -13.746 67 HA PRO 15 HA PRO 15 -1.203 -9.468 -18.323 68 HB2 PRO 15 2HB PRO 15 -0.816 -12.155 -18.330 69 HB3 PRO 15 3HB PRO 15 0.129 -11.051 -17.324 70 HG2 PRO 15 2HG PRO 15 -2.222 -12.749 -16.581 71 HG3 PRO 15 3HG PRO 15 -0.716 -12.470 -15.687 72 HD2 PRO 15 2HD PRO 15 -3.027 -11.193 -15.084 73 HD3 PRO 15 3HD PRO 15 -1.435 -10.440 -14.863 74 H ALA 16 H ALA 16 -1.914 -9.622 -20.363 75 HA ALA 16 HA ALA 16 -3.082 -10.313 -22.206 76 HB1 ALA 16 1HB ALA 16 -4.646 -12.377 -20.777 77 HB2 ALA 16 2HB ALA 16 -3.830 -12.447 -22.339 78 HB3 ALA 16 3HB ALA 16 -2.899 -12.607 -20.850 79 H VAL 17 H VAL 17 -5.162 -10.699 -19.329 80 HA VAL 17 HA VAL 17 -7.123 -9.700 -18.734 81 HB VAL 17 HB VAL 17 -6.750 -7.752 -21.000 82 HG11 VAL 17 1HG1 VAL 17 -7.854 -6.244 -19.260 83 HG12 VAL 17 2HG1 VAL 17 -8.864 -7.474 -20.022 84 HG13 VAL 17 3HG1 VAL 17 -8.240 -7.730 -18.392 85 HG21 VAL 17 3HG2 VAL 17 -5.498 -6.333 -19.433 86 HG22 VAL 17 1HG2 VAL 17 -5.523 -7.637 -18.246 87 HG23 VAL 17 2HG2 VAL 17 -4.655 -7.845 -19.767 88 H GLY 18 H GLY 18 -9.361 -9.478 -19.423 89 HA2 GLY 18 2HA GLY 18 -11.203 -10.039 -20.687 90 HA3 GLY 18 3HA GLY 18 -10.152 -10.082 -22.095 91 H GLY 19 H GLY 19 -8.929 -12.050 -19.671 92 HA2 GLY 19 2HA GLY 19 -10.522 -14.377 -20.043 93 HA3 GLY 19 3HA GLY 19 -9.120 -14.413 -21.103 94 H GLY 20 H GLY 20 -7.370 -13.020 -19.257 95 HA2 GLY 20 2HA GLY 20 -6.608 -15.312 -17.665 96 HA3 GLY 20 3HA GLY 20 -5.708 -13.813 -17.838 97 H SER 21 H SER 21 -5.377 -14.110 -15.501 98 HA SER 21 HA SER 21 -7.620 -12.942 -13.994 99 HB2 SER 21 2HB SER 21 -6.557 -14.302 -12.015 100 HB3 SER 21 3HB SER 21 -7.662 -15.099 -13.134 101 HG SER 21 HG SER 21 -4.832 -15.211 -13.104 102 HA PRO 22 HA PRO 22 -4.782 -9.880 -12.637 103 HB2 PRO 22 2HB PRO 22 -5.819 -9.275 -10.203 104 HB3 PRO 22 3HB PRO 22 -6.588 -8.796 -11.720 105 HG2 PRO 22 2HG PRO 22 -7.223 -11.102 -9.919 106 HG3 PRO 22 3HG PRO 22 -8.330 -9.986 -10.740 107 HD2 PRO 22 2HD PRO 22 -7.808 -12.472 -11.677 108 HD3 PRO 22 3HD PRO 22 -8.167 -11.103 -12.749 109 H LEU 23 H LEU 23 -2.911 -9.666 -11.482 110 HA LEU 23 HA LEU 23 -2.342 -11.733 -9.461 111 HB2 LEU 23 2HB LEU 23 -0.598 -10.654 -11.655 112 HB3 LEU 23 3HB LEU 23 0.069 -11.480 -10.249 113 HG LEU 23 HG LEU 23 -2.003 -13.069 -11.471 114 HD11 LEU 23 1HD1 LEU 23 -1.656 -12.521 -13.617 115 HD12 LEU 23 2HD1 LEU 23 -0.186 -13.479 -13.445 116 HD13 LEU 23 3HD1 LEU 23 -0.120 -11.726 -13.274 117 HD21 LEU 23 3HD2 LEU 23 0.798 -13.316 -10.558 118 HD22 LEU 23 1HD2 LEU 23 0.248 -14.487 -11.757 119 HD23 LEU 23 2HD2 LEU 23 -0.603 -14.333 -10.220 120 H GLU 24 H GLU 24 -1.466 -11.073 -7.575 121 HA GLU 24 HA GLU 24 -1.234 -8.203 -7.151 122 HB2 GLU 24 2HB GLU 24 -1.324 -8.672 -4.822 123 HB3 GLU 24 3HB GLU 24 -2.513 -9.715 -5.590 124 HG2 GLU 24 2HG GLU 24 -0.359 -11.339 -5.600 125 HG3 GLU 24 3HG GLU 24 -0.049 -10.396 -4.144 126 H LEU 25 H LEU 25 0.628 -7.136 -6.906 127 HA LEU 25 HA LEU 25 3.069 -8.598 -6.249 128 HB2 LEU 25 2HB LEU 25 2.709 -6.887 -8.700 129 HB3 LEU 25 3HB LEU 25 4.280 -7.384 -8.073 130 HG LEU 25 HG LEU 25 2.884 -9.764 -8.358 131 HD11 LEU 25 1HD1 LEU 25 2.376 -9.431 -10.925 132 HD12 LEU 25 2HD1 LEU 25 2.044 -7.780 -10.403 133 HD13 LEU 25 3HD1 LEU 25 1.150 -9.125 -9.694 134 HD21 LEU 25 3HD2 LEU 25 5.137 -8.370 -9.602 135 HD22 LEU 25 1HD2 LEU 25 4.388 -9.595 -10.627 136 HD23 LEU 25 2HD2 LEU 25 5.003 -10.035 -9.033 137 H GLU 26 H GLU 26 4.838 -7.194 -5.602 138 HA GLU 26 HA GLU 26 3.858 -4.622 -4.553 139 HB2 GLU 26 2HB GLU 26 5.423 -6.795 -3.355 140 HB3 GLU 26 3HB GLU 26 6.105 -5.198 -3.083 141 HG2 GLU 26 2HG GLU 26 4.705 -4.997 -1.383 142 HG3 GLU 26 3HG GLU 26 3.403 -4.879 -2.565 143 H VAL 27 H VAL 27 4.562 -3.029 -5.821 144 HA VAL 27 HA VAL 27 7.431 -2.872 -6.384 145 HB VAL 27 HB VAL 27 7.103 -2.219 -8.682 146 HG11 VAL 27 1HG1 VAL 27 5.460 -4.709 -8.346 147 HG12 VAL 27 2HG1 VAL 27 6.625 -4.314 -9.611 148 HG13 VAL 27 3HG1 VAL 27 7.184 -4.679 -7.979 149 HG21 VAL 27 3HG2 VAL 27 5.171 -1.243 -9.222 150 HG22 VAL 27 1HG2 VAL 27 4.490 -2.866 -9.334 151 HG23 VAL 27 2HG2 VAL 27 4.342 -1.949 -7.835 152 H ALA 28 H ALA 28 8.019 -0.655 -7.233 153 HA ALA 28 HA ALA 28 6.262 1.403 -6.065 154 HB1 ALA 28 1HB ALA 28 8.039 2.487 -5.029 155 HB2 ALA 28 2HB ALA 28 8.382 0.781 -4.740 156 HB3 ALA 28 3HB ALA 28 9.247 1.652 -6.007 157 HA PRO 29 HA PRO 29 6.634 2.904 -10.270 158 HB2 PRO 29 2HB PRO 29 4.849 4.926 -9.966 159 HB3 PRO 29 3HB PRO 29 4.363 3.243 -10.201 160 HG2 PRO 29 2HG PRO 29 4.544 4.825 -7.666 161 HG3 PRO 29 3HG PRO 29 3.279 3.701 -8.196 162 HD2 PRO 29 2HD PRO 29 5.206 2.998 -6.429 163 HD3 PRO 29 3HD PRO 29 4.494 1.843 -7.574 164 H ASN 30 H ASN 30 7.412 4.437 -7.314 165 HA ASN 30 HA ASN 30 8.315 6.910 -8.527 166 HB2 ASN 30 2HB ASN 30 9.024 7.507 -6.240 167 HB3 ASN 30 3HB ASN 30 7.342 6.986 -6.287 168 HD21 ASN 30 1HD2 ASN 30 8.191 6.905 -3.903 169 HD22 ASN 30 2HD2 ASN 30 8.677 5.332 -3.377 170 H ALA 31 H ALA 31 9.488 3.974 -8.773 171 HA ALA 31 HA ALA 31 12.293 4.700 -8.273 172 HB1 ALA 31 1HB ALA 31 10.787 2.202 -8.101 173 HB2 ALA 31 2HB ALA 31 12.332 2.048 -8.940 174 HB3 ALA 31 3HB ALA 31 12.280 2.687 -7.297 175 H THR 32 H THR 32 10.889 2.400 -10.576 176 HA THR 32 HA THR 32 11.643 3.997 -12.856 177 HB THR 32 HB THR 32 12.965 1.324 -12.826 178 HG1 THR 32 HG1 THR 32 14.316 1.892 -11.310 179 HG21 THR 32 3HG2 THR 32 13.734 2.119 -14.758 180 HG22 THR 32 1HG2 THR 32 14.570 3.402 -13.884 181 HG23 THR 32 2HG2 THR 32 12.926 3.659 -14.468 182 H VAL 33 H VAL 33 10.635 3.352 -14.731 183 HA VAL 33 HA VAL 33 8.362 1.672 -14.463 184 HB VAL 33 HB VAL 33 9.622 2.803 -16.966 185 HG11 VAL 33 1HG1 VAL 33 8.205 1.453 -18.035 186 HG12 VAL 33 2HG1 VAL 33 7.369 1.017 -16.544 187 HG13 VAL 33 3HG1 VAL 33 6.918 2.485 -17.412 188 HG21 VAL 33 3HG2 VAL 33 8.916 4.492 -15.300 189 HG22 VAL 33 1HG2 VAL 33 7.982 4.566 -16.794 190 HG23 VAL 33 2HG2 VAL 33 7.285 3.824 -15.353 191 H GLY 34 H GLY 34 11.497 1.283 -16.074 192 HA2 GLY 34 2HA GLY 34 10.916 -1.256 -17.208 193 HA3 GLY 34 3HA GLY 34 12.516 -0.563 -16.991 194 H ALA 35 H ALA 35 12.226 -0.251 -14.111 195 HA ALA 35 HA ALA 35 13.217 -2.771 -13.302 196 HB1 ALA 35 1HB ALA 35 13.912 -0.713 -12.215 197 HB2 ALA 35 2HB ALA 35 12.272 -0.453 -11.621 198 HB3 ALA 35 3HB ALA 35 13.212 -1.826 -11.039 199 H VAL 36 H VAL 36 10.120 -1.134 -12.698 200 HA VAL 36 HA VAL 36 9.014 -3.234 -11.141 201 HB VAL 36 HB VAL 36 6.833 -2.109 -11.559 202 HG11 VAL 36 1HG1 VAL 36 8.658 -1.407 -9.841 203 HG12 VAL 36 2HG1 VAL 36 8.815 0.018 -10.869 204 HG13 VAL 36 3HG1 VAL 36 7.266 -0.360 -10.115 205 HG21 VAL 36 3HG2 VAL 36 6.874 0.064 -12.759 206 HG22 VAL 36 1HG2 VAL 36 8.516 -0.303 -13.291 207 HG23 VAL 36 2HG2 VAL 36 7.172 -1.321 -13.810 208 H ARG 37 H ARG 37 8.879 -2.414 -14.573 209 HA ARG 37 HA ARG 37 6.935 -4.310 -15.322 210 HB2 ARG 37 2HB ARG 37 7.690 -2.388 -16.724 211 HB3 ARG 37 3HB ARG 37 9.201 -3.240 -17.011 212 HG2 ARG 37 2HG ARG 37 7.926 -5.080 -18.052 213 HG3 ARG 37 3HG ARG 37 6.449 -4.137 -17.837 214 HD2 ARG 37 2HD ARG 37 6.851 -3.092 -19.753 215 HD3 ARG 37 3HD ARG 37 8.353 -2.457 -19.083 216 HE ARG 37 HE ARG 37 8.733 -5.109 -19.976 217 HH11 ARG 37 1HH1 ARG 37 8.282 -1.869 -21.167 218 HH12 ARG 37 2HH1 ARG 37 9.149 -2.150 -22.640 219 HH21 ARG 37 1HH2 ARG 37 9.877 -5.491 -21.912 220 HH22 ARG 37 2HH2 ARG 37 10.055 -4.211 -23.064 221 H THR 38 H THR 38 10.471 -4.475 -15.196 222 HA THR 38 HA THR 38 10.660 -7.104 -16.257 223 HB THR 38 HB THR 38 12.670 -5.708 -14.483 224 HG1 THR 38 HG1 THR 38 13.526 -4.897 -16.417 225 HG21 THR 38 3HG2 THR 38 13.012 -7.865 -16.569 226 HG22 THR 38 1HG2 THR 38 13.062 -8.113 -14.824 227 HG23 THR 38 2HG2 THR 38 14.297 -7.131 -15.611 228 H LYS 39 H LYS 39 10.429 -5.794 -12.994 229 HA LYS 39 HA LYS 39 10.995 -8.165 -11.588 230 HB2 LYS 39 2HB LYS 39 10.943 -5.876 -10.596 231 HB3 LYS 39 3HB LYS 39 9.189 -5.902 -10.719 232 HG2 LYS 39 2HG LYS 39 9.685 -6.461 -8.494 233 HG3 LYS 39 3HG LYS 39 9.249 -7.980 -9.281 234 HD2 LYS 39 2HD LYS 39 12.002 -7.733 -9.658 235 HD3 LYS 39 3HD LYS 39 11.720 -7.215 -7.994 236 HE2 LYS 39 2HE LYS 39 10.460 -9.295 -7.591 237 HE3 LYS 39 3HE LYS 39 10.818 -9.812 -9.238 238 HZ1 LYS 39 3HZ LYS 39 12.323 -10.772 -7.561 239 HZ2 LYS 39 1HZ LYS 39 12.877 -9.218 -7.183 240 HZ3 LYS 39 2HZ LYS 39 13.144 -9.859 -8.725 241 H VAL 40 H VAL 40 7.926 -6.764 -12.688 242 HA VAL 40 HA VAL 40 6.286 -8.806 -11.595 243 HB VAL 40 HB VAL 40 5.660 -6.988 -13.924 244 HG11 VAL 40 1HG1 VAL 40 3.564 -7.771 -13.885 245 HG12 VAL 40 2HG1 VAL 40 4.237 -9.139 -12.997 246 HG13 VAL 40 3HG1 VAL 40 3.508 -7.792 -12.123 247 HG21 VAL 40 3HG2 VAL 40 6.183 -6.321 -11.228 248 HG22 VAL 40 1HG2 VAL 40 5.566 -5.279 -12.510 249 HG23 VAL 40 2HG2 VAL 40 4.444 -6.165 -11.477 250 H CYS 41 H CYS 41 7.561 -8.230 -14.862 251 HA CYS 41 HA CYS 41 6.359 -10.370 -16.163 252 HB2 CYS 41 2HB CYS 41 8.563 -8.548 -16.672 253 HB3 CYS 41 3HB CYS 41 8.888 -10.151 -17.321 254 HG CYS 41 HG CYS 41 6.311 -8.063 -18.130 255 H ALA 42 H ALA 42 9.454 -10.254 -14.430 256 HA ALA 42 HA ALA 42 10.203 -12.925 -14.948 257 HB1 ALA 42 1HB ALA 42 11.609 -12.532 -12.795 258 HB2 ALA 42 2HB ALA 42 11.966 -11.608 -14.255 259 HB3 ALA 42 3HB ALA 42 11.040 -10.869 -12.949 260 H MET 43 H MET 43 8.366 -11.426 -12.328 261 HA MET 43 HA MET 43 8.217 -13.627 -10.612 262 HB2 MET 43 2HB MET 43 7.273 -11.055 -10.572 263 HB3 MET 43 3HB MET 43 5.788 -11.982 -10.734 264 HG2 MET 43 2HG MET 43 5.851 -12.150 -8.520 265 HG3 MET 43 3HG MET 43 7.113 -13.352 -8.779 266 HE1 MET 43 3HE MET 43 8.495 -13.454 -7.187 267 HE2 MET 43 1HE MET 43 9.933 -12.668 -7.838 268 HE3 MET 43 2HE MET 43 9.312 -12.197 -6.256 269 H LYS 44 H LYS 44 6.497 -12.886 -13.546 270 HA LYS 44 HA LYS 44 4.656 -15.123 -13.128 271 HB2 LYS 44 2HB LYS 44 4.712 -13.203 -15.456 272 HB3 LYS 44 3HB LYS 44 3.399 -14.272 -14.980 273 HG2 LYS 44 2HG LYS 44 4.395 -12.036 -13.237 274 HG3 LYS 44 3HG LYS 44 3.106 -11.833 -14.427 275 HD2 LYS 44 2HD LYS 44 1.823 -12.338 -12.617 276 HD3 LYS 44 3HD LYS 44 2.156 -13.981 -13.169 277 HE2 LYS 44 2HE LYS 44 4.283 -13.078 -11.474 278 HE3 LYS 44 3HE LYS 44 2.738 -12.839 -10.661 279 HZ1 LYS 44 3HZ LYS 44 2.681 -15.353 -11.864 280 HZ2 LYS 44 1HZ LYS 44 2.705 -14.991 -10.212 281 HZ3 LYS 44 2HZ LYS 44 4.156 -15.231 -11.045 282 H LYS 45 H LYS 45 7.649 -14.525 -14.481 283 HA LYS 45 HA LYS 45 9.046 -15.742 -15.800 284 HB2 LYS 45 2HB LYS 45 8.023 -17.603 -14.372 285 HB3 LYS 45 3HB LYS 45 6.993 -17.949 -15.755 286 HG2 LYS 45 2HG LYS 45 8.827 -19.446 -15.844 287 HG3 LYS 45 3HG LYS 45 9.070 -18.248 -17.118 288 HD2 LYS 45 2HD LYS 45 11.162 -18.639 -15.982 289 HD3 LYS 45 3HD LYS 45 10.592 -17.012 -15.605 290 HE2 LYS 45 2HE LYS 45 10.060 -17.561 -13.427 291 HE3 LYS 45 3HE LYS 45 9.885 -19.277 -13.793 292 HZ1 LYS 45 3HZ LYS 45 12.102 -17.996 -12.736 293 HZ2 LYS 45 1HZ LYS 45 12.534 -18.448 -14.309 294 HZ3 LYS 45 2HZ LYS 45 11.981 -19.614 -13.215 295 H LEU 46 H LEU 46 7.808 -13.948 -17.227 296 HA LEU 46 HA LEU 46 6.955 -15.361 -19.666 297 HB2 LEU 46 2HB LEU 46 5.809 -12.962 -18.323 298 HB3 LEU 46 3HB LEU 46 5.748 -13.060 -20.081 299 HG LEU 46 HG LEU 46 4.767 -15.462 -18.723 300 HD11 LEU 46 1HD1 LEU 46 2.998 -14.636 -17.578 301 HD12 LEU 46 2HD1 LEU 46 2.852 -13.211 -18.605 302 HD13 LEU 46 3HD1 LEU 46 4.093 -13.272 -17.354 303 HD21 LEU 46 3HD2 LEU 46 4.377 -15.371 -21.010 304 HD22 LEU 46 1HD2 LEU 46 3.935 -13.664 -20.969 305 HD23 LEU 46 2HD2 LEU 46 2.828 -14.877 -20.325 306 HA PRO 47 HA PRO 47 10.084 -13.224 -21.878 307 HB2 PRO 47 2HB PRO 47 8.868 -12.708 -24.249 308 HB3 PRO 47 3HB PRO 47 9.373 -14.330 -23.762 309 HG2 PRO 47 2HG PRO 47 6.659 -13.073 -23.635 310 HG3 PRO 47 3HG PRO 47 7.111 -14.709 -24.148 311 HD2 PRO 47 2HD PRO 47 6.103 -14.180 -21.691 312 HD3 PRO 47 3HD PRO 47 7.278 -15.479 -21.982 313 HA PRO 48 HA PRO 48 8.963 -8.963 -20.886 314 HB2 PRO 48 2HB PRO 48 11.528 -8.080 -20.773 315 HB3 PRO 48 3HB PRO 48 10.751 -8.948 -19.443 316 HG2 PRO 48 2HG PRO 48 12.621 -9.978 -21.541 317 HG3 PRO 48 3HG PRO 48 12.594 -10.320 -19.802 318 HD2 PRO 48 2HD PRO 48 11.576 -12.030 -21.639 319 HD3 PRO 48 3HD PRO 48 10.899 -11.869 -20.005 320 H ASP 49 H ASP 49 11.106 -10.127 -23.419 321 HA ASP 49 HA ASP 49 11.306 -7.679 -24.841 322 HB2 ASP 49 2HB ASP 49 12.874 -9.604 -25.105 323 HB3 ASP 49 3HB ASP 49 11.592 -10.486 -25.930 324 H THR 50 H THR 50 9.133 -10.455 -25.072 325 HA THR 50 HA THR 50 7.612 -9.104 -27.181 326 HB THR 50 HB THR 50 6.544 -11.677 -26.374 327 HG1 THR 50 HG1 THR 50 9.224 -11.665 -27.344 328 HG21 THR 50 3HG2 THR 50 6.212 -11.894 -28.599 329 HG22 THR 50 1HG2 THR 50 7.839 -11.345 -29.001 330 HG23 THR 50 2HG2 THR 50 6.580 -10.169 -28.622 331 H THR 51 H THR 51 7.612 -8.287 -24.325 332 HA THR 51 HA THR 51 4.707 -8.306 -23.967 333 HB THR 51 HB THR 51 6.685 -9.030 -21.800 334 HG1 THR 51 HG1 THR 51 5.890 -10.711 -23.257 335 HG21 THR 51 3HG2 THR 51 4.282 -9.321 -20.627 336 HG22 THR 51 1HG2 THR 51 3.938 -7.944 -21.673 337 HG23 THR 51 2HG2 THR 51 5.249 -7.852 -20.498 338 H ARG 52 H ARG 52 3.871 -6.450 -23.081 339 HA ARG 52 HA ARG 52 5.788 -4.366 -22.282 340 HB2 ARG 52 2HB ARG 52 4.808 -4.163 -24.670 341 HB3 ARG 52 3HB ARG 52 3.313 -3.719 -23.858 342 HG2 ARG 52 2HG ARG 52 4.192 -1.741 -23.038 343 HG3 ARG 52 3HG ARG 52 5.859 -2.293 -23.215 344 HD2 ARG 52 2HD ARG 52 5.950 -1.250 -25.173 345 HD3 ARG 52 3HD ARG 52 4.726 -2.362 -25.785 346 HE ARG 52 HE ARG 52 3.546 -0.226 -24.330 347 HH11 ARG 52 1HH1 ARG 52 4.998 -1.031 -27.390 348 HH12 ARG 52 2HH1 ARG 52 4.136 0.189 -28.267 349 HH21 ARG 52 1HH2 ARG 52 2.406 1.385 -25.474 350 HH22 ARG 52 2HH2 ARG 52 2.663 1.563 -27.177 351 H LEU 53 H LEU 53 4.707 -2.547 -21.101 352 HA LEU 53 HA LEU 53 2.360 -3.468 -19.585 353 HB2 LEU 53 2HB LEU 53 3.976 -3.856 -18.005 354 HB3 LEU 53 3HB LEU 53 5.011 -2.556 -18.590 355 HG LEU 53 HG LEU 53 3.541 -0.908 -17.539 356 HD11 LEU 53 1HD1 LEU 53 1.743 -3.124 -17.421 357 HD12 LEU 53 2HD1 LEU 53 1.442 -1.425 -17.057 358 HD13 LEU 53 3HD1 LEU 53 2.020 -2.508 -15.791 359 HD21 LEU 53 3HD2 LEU 53 4.245 -1.261 -15.323 360 HD22 LEU 53 1HD2 LEU 53 5.454 -2.062 -16.327 361 HD23 LEU 53 2HD2 LEU 53 4.218 -3.016 -15.506 362 H THR 54 H THR 54 0.797 -1.990 -19.312 363 HA THR 54 HA THR 54 1.425 0.823 -19.920 364 HB THR 54 HB THR 54 -1.121 0.761 -20.718 365 HG1 THR 54 HG1 THR 54 -0.140 -1.880 -21.026 366 HG21 THR 54 3HG2 THR 54 1.462 0.483 -22.069 367 HG22 THR 54 1HG2 THR 54 0.124 1.582 -22.399 368 HG23 THR 54 2HG2 THR 54 0.090 -0.063 -23.033 369 H TYR 55 H TYR 55 0.424 2.366 -18.681 370 HA TYR 55 HA TYR 55 -1.358 1.400 -16.545 371 HB2 TYR 55 2HB TYR 55 0.744 1.775 -15.484 372 HB3 TYR 55 3HB TYR 55 0.977 3.300 -16.331 373 HD1 TYR 55 HD2 TYR 55 -1.909 1.938 -14.385 374 HD2 TYR 55 HD1 TYR 55 1.012 5.007 -14.774 375 HE1 TYR 55 HE2 TYR 55 -2.926 3.138 -12.495 376 HE2 TYR 55 HE1 TYR 55 0.003 6.215 -12.883 377 HH TYR 55 HH TYR 55 -1.610 5.213 -10.711 378 H LYS 56 H LYS 56 -3.223 2.457 -16.383 379 HA LYS 56 HA LYS 56 -4.898 3.942 -16.795 380 HB2 LYS 56 2HB LYS 56 -3.124 5.298 -15.426 381 HB3 LYS 56 3HB LYS 56 -2.876 6.149 -16.945 382 HG2 LYS 56 2HG LYS 56 -5.571 6.230 -16.764 383 HG3 LYS 56 3HG LYS 56 -5.121 6.261 -15.057 384 HD2 LYS 56 2HD LYS 56 -4.989 8.489 -15.446 385 HD3 LYS 56 3HD LYS 56 -3.372 8.058 -16.008 386 HE2 LYS 56 2HE LYS 56 -5.444 7.787 -18.052 387 HE3 LYS 56 3HE LYS 56 -5.255 9.434 -17.452 388 HZ1 LYS 56 3HZ LYS 56 -3.770 9.241 -19.231 389 HZ2 LYS 56 1HZ LYS 56 -3.222 7.717 -18.744 390 HZ3 LYS 56 2HZ LYS 56 -2.796 9.092 -17.857 391 H GLY 57 H GLY 57 -3.646 2.693 -19.074 392 HA2 GLY 57 2HA GLY 57 -3.926 2.787 -21.358 393 HA3 GLY 57 3HA GLY 57 -4.802 4.293 -21.131 394 H ARG 58 H ARG 58 -1.714 4.272 -19.713 395 HA ARG 58 HA ARG 58 -0.612 5.725 -22.029 396 HB2 ARG 58 2HB ARG 58 -1.078 6.669 -19.407 397 HB3 ARG 58 3HB ARG 58 0.664 6.487 -19.570 398 HG2 ARG 58 2HG ARG 58 0.039 7.720 -21.907 399 HG3 ARG 58 3HG ARG 58 -1.156 8.415 -20.809 400 HD2 ARG 58 2HD ARG 58 1.174 8.469 -19.337 401 HD3 ARG 58 3HD ARG 58 1.718 8.852 -20.970 402 HE ARG 58 HE ARG 58 -0.587 10.353 -20.138 403 HH11 ARG 58 1HH1 ARG 58 2.890 10.198 -20.111 404 HH12 ARG 58 2HH1 ARG 58 3.095 11.906 -19.901 405 HH21 ARG 58 1HH2 ARG 58 -0.331 12.602 -19.861 406 HH22 ARG 58 2HH2 ARG 58 1.262 13.272 -19.758 407 H ALA 59 H ALA 59 1.600 5.485 -22.465 408 HA ALA 59 HA ALA 59 2.755 3.021 -21.371 409 HB1 ALA 59 1HB ALA 59 4.349 3.860 -23.491 410 HB2 ALA 59 2HB ALA 59 3.126 2.589 -23.520 411 HB3 ALA 59 3HB ALA 59 2.699 4.234 -23.991 412 H LEU 60 H LEU 60 4.297 3.175 -19.893 413 HA LEU 60 HA LEU 60 5.940 5.620 -19.820 414 HB2 LEU 60 2HB LEU 60 5.227 3.782 -17.540 415 HB3 LEU 60 3HB LEU 60 6.210 5.240 -17.427 416 HG LEU 60 HG LEU 60 3.727 5.990 -18.556 417 HD11 LEU 60 1HD1 LEU 60 2.348 5.341 -16.467 418 HD12 LEU 60 2HD1 LEU 60 3.515 4.029 -16.308 419 HD13 LEU 60 3HD1 LEU 60 2.538 4.167 -17.769 420 HD21 LEU 60 3HD2 LEU 60 5.039 7.496 -17.274 421 HD22 LEU 60 1HD2 LEU 60 5.037 6.416 -15.880 422 HD23 LEU 60 2HD2 LEU 60 3.548 7.225 -16.370 423 H LYS 61 H LYS 61 8.157 5.392 -19.203 424 HA LYS 61 HA LYS 61 9.378 2.829 -18.928 425 HB2 LYS 61 2HB LYS 61 9.006 2.652 -21.296 426 HB3 LYS 61 3HB LYS 61 9.632 4.273 -21.568 427 HG2 LYS 61 2HG LYS 61 11.838 3.614 -21.186 428 HG3 LYS 61 3HG LYS 61 11.348 2.118 -20.388 429 HD2 LYS 61 2HD LYS 61 10.732 2.663 -23.280 430 HD3 LYS 61 3HD LYS 61 12.255 1.932 -22.767 431 HE2 LYS 61 2HE LYS 61 10.502 0.392 -21.417 432 HE3 LYS 61 3HE LYS 61 9.528 0.807 -22.826 433 HZ1 LYS 61 3HZ LYS 61 12.176 0.067 -23.567 434 HZ2 LYS 61 1HZ LYS 61 10.698 -0.575 -24.084 435 HZ3 LYS 61 2HZ LYS 61 11.429 -1.162 -22.676 436 H ASP 62 H ASP 62 10.564 5.733 -20.592 437 HA ASP 62 HA ASP 62 12.844 5.887 -18.861 438 HB2 ASP 62 2HB ASP 62 13.474 7.835 -20.189 439 HB3 ASP 62 3HB ASP 62 12.968 6.517 -21.243 440 H THR 63 H THR 63 9.692 6.824 -18.481 441 HA THR 63 HA THR 63 9.850 9.379 -17.353 442 HB THR 63 HB THR 63 7.729 8.878 -16.244 443 HG1 THR 63 HG1 THR 63 7.800 6.832 -15.533 444 HG21 THR 63 3HG2 THR 63 6.741 9.178 -18.217 445 HG22 THR 63 1HG2 THR 63 7.008 7.486 -18.637 446 HG23 THR 63 2HG2 THR 63 8.236 8.694 -19.018 447 H GLU 64 H GLU 64 10.955 6.364 -16.175 448 HA GLU 64 HA GLU 64 11.991 5.734 -14.251 449 HB2 GLU 64 2HB GLU 64 13.392 7.667 -14.536 450 HB3 GLU 64 3HB GLU 64 12.148 8.727 -13.889 451 HG2 GLU 64 2HG GLU 64 12.437 7.903 -11.702 452 HG3 GLU 64 3HG GLU 64 13.399 6.537 -12.265 453 H THR 65 H THR 65 10.551 8.628 -12.837 454 HA THR 65 HA THR 65 9.104 6.924 -10.950 455 HB THR 65 HB THR 65 8.781 8.969 -9.622 456 HG1 THR 65 HG1 THR 65 8.742 10.548 -11.215 457 HG21 THR 65 3HG2 THR 65 11.670 9.100 -10.271 458 HG22 THR 65 1HG2 THR 65 11.029 7.528 -9.795 459 HG23 THR 65 2HG2 THR 65 10.867 8.911 -8.713 460 H LEU 66 H LEU 66 6.894 7.415 -10.379 461 HA LEU 66 HA LEU 66 5.384 8.581 -12.625 462 HB2 LEU 66 2HB LEU 66 5.261 6.009 -11.603 463 HB3 LEU 66 3HB LEU 66 3.864 6.816 -10.894 464 HG LEU 66 HG LEU 66 4.303 7.045 -13.832 465 HD11 LEU 66 1HD1 LEU 66 4.585 4.733 -13.693 466 HD12 LEU 66 2HD1 LEU 66 2.863 4.936 -14.011 467 HD13 LEU 66 3HD1 LEU 66 3.421 4.576 -12.377 468 HD21 LEU 66 3HD2 LEU 66 1.812 6.720 -12.165 469 HD22 LEU 66 1HD2 LEU 66 1.903 7.159 -13.870 470 HD23 LEU 66 2HD2 LEU 66 2.504 8.272 -12.640 471 H GLU 67 H GLU 67 6.054 8.720 -9.281 472 HA GLU 67 HA GLU 67 3.695 9.790 -8.243 473 HB2 GLU 67 2HB GLU 67 6.065 9.135 -7.168 474 HB3 GLU 67 3HB GLU 67 6.267 10.880 -7.237 475 HG2 GLU 67 2HG GLU 67 4.029 11.034 -6.050 476 HG3 GLU 67 3HG GLU 67 4.194 9.305 -5.749 477 H SER 68 H SER 68 6.353 11.325 -9.967 478 HA SER 68 HA SER 68 5.599 14.002 -9.512 479 HB2 SER 68 2HB SER 68 7.810 13.551 -10.322 480 HB3 SER 68 3HB SER 68 7.183 12.714 -11.743 481 HG SER 68 HG SER 68 7.859 14.878 -12.182 482 H LEU 69 H LEU 69 4.189 11.565 -11.415 483 HA LEU 69 HA LEU 69 2.812 13.491 -13.140 484 HB2 LEU 69 2HB LEU 69 3.297 10.557 -13.239 485 HB3 LEU 69 3HB LEU 69 1.868 11.200 -14.045 486 HG LEU 69 HG LEU 69 3.226 12.539 -15.506 487 HD11 LEU 69 1HD1 LEU 69 5.589 11.509 -13.944 488 HD12 LEU 69 2HD1 LEU 69 4.975 13.161 -13.935 489 HD13 LEU 69 3HD1 LEU 69 5.669 12.487 -15.409 490 HD21 LEU 69 3HD2 LEU 69 4.777 10.033 -15.631 491 HD22 LEU 69 1HD2 LEU 69 3.825 10.847 -16.874 492 HD23 LEU 69 2HD2 LEU 69 3.021 9.861 -15.652 493 H GLY 70 H GLY 70 2.378 11.753 -10.268 494 HA2 GLY 70 2HA GLY 70 0.498 12.206 -8.860 495 HA3 GLY 70 3HA GLY 70 -0.484 12.427 -10.301 496 H VAL 71 H VAL 71 1.614 9.832 -9.036 497 HA VAL 71 HA VAL 71 -0.355 7.862 -9.893 498 HB VAL 71 HB VAL 71 2.075 7.518 -10.349 499 HG11 VAL 71 1HG1 VAL 71 2.657 6.547 -7.661 500 HG12 VAL 71 2HG1 VAL 71 3.641 7.523 -8.753 501 HG13 VAL 71 3HG1 VAL 71 2.419 8.292 -7.739 502 HG21 VAL 71 3HG2 VAL 71 1.264 5.295 -8.549 503 HG22 VAL 71 1HG2 VAL 71 0.213 5.695 -9.907 504 HG23 VAL 71 2HG2 VAL 71 1.893 5.244 -10.195 505 H ALA 72 H ALA 72 -1.475 6.514 -8.542 506 HA ALA 72 HA ALA 72 -1.281 7.103 -5.660 507 HB1 ALA 72 1HB ALA 72 -3.806 6.093 -6.891 508 HB2 ALA 72 2HB ALA 72 -3.574 7.057 -5.433 509 HB3 ALA 72 3HB ALA 72 -3.391 7.802 -7.021 510 H ASP 73 H ASP 73 -1.487 5.394 -4.205 511 HA ASP 73 HA ASP 73 -0.561 2.861 -5.176 512 HB2 ASP 73 2HB ASP 73 -0.562 2.193 -2.816 513 HB3 ASP 73 3HB ASP 73 0.212 3.761 -3.026 514 H GLY 74 H GLY 74 -1.751 1.194 -5.818 515 HA2 GLY 74 2HA GLY 74 -3.527 -0.387 -5.352 516 HA3 GLY 74 3HA GLY 74 -4.507 0.960 -4.791 517 H ASP 75 H ASP 75 -2.577 1.093 -7.707 518 HA ASP 75 HA ASP 75 -4.993 1.581 -9.251 519 HB2 ASP 75 2HB ASP 75 -2.134 2.205 -9.526 520 HB3 ASP 75 3HB ASP 75 -2.921 1.757 -11.037 521 H LYS 76 H LYS 76 -4.671 0.697 -11.671 522 HA LYS 76 HA LYS 76 -4.142 -2.194 -11.446 523 HB2 LYS 76 2HB LYS 76 -6.407 -0.765 -12.831 524 HB3 LYS 76 3HB LYS 76 -5.983 -2.433 -13.193 525 HG2 LYS 76 2HG LYS 76 -6.471 -3.107 -10.943 526 HG3 LYS 76 3HG LYS 76 -6.726 -1.430 -10.453 527 HD2 LYS 76 2HD LYS 76 -8.403 -1.920 -12.677 528 HD3 LYS 76 3HD LYS 76 -8.596 -3.279 -11.567 529 HE2 LYS 76 2HE LYS 76 -9.447 -1.965 -9.893 530 HE3 LYS 76 3HE LYS 76 -8.603 -0.521 -10.449 531 HZ1 LYS 76 3HZ LYS 76 -10.848 -0.162 -10.937 532 HZ2 LYS 76 1HZ LYS 76 -11.074 -1.727 -11.540 533 HZ3 LYS 76 2HZ LYS 76 -10.164 -0.605 -12.419 534 H PHE 77 H PHE 77 -2.777 -3.018 -12.898 535 HA PHE 77 HA PHE 77 -2.033 -1.333 -15.196 536 HB2 PHE 77 2HB PHE 77 -0.417 -3.393 -13.683 537 HB3 PHE 77 3HB PHE 77 0.126 -2.600 -15.158 538 HD1 PHE 77 HD2 PHE 77 -1.007 -1.889 -11.692 539 HD2 PHE 77 HD1 PHE 77 1.257 -0.578 -15.050 540 HE1 PHE 77 HE2 PHE 77 -0.105 -0.032 -10.355 541 HE2 PHE 77 HE1 PHE 77 2.163 1.281 -13.718 542 HZ PHE 77 HZ PHE 77 1.481 1.557 -11.367 543 H VAL 78 H VAL 78 -1.675 -2.316 -17.221 544 HA VAL 78 HA VAL 78 -2.941 -4.964 -17.516 545 HB VAL 78 HB VAL 78 -2.952 -2.671 -19.484 546 HG11 VAL 78 1HG1 VAL 78 -3.042 -4.427 -20.924 547 HG12 VAL 78 2HG1 VAL 78 -3.679 -5.536 -19.707 548 HG13 VAL 78 3HG1 VAL 78 -4.748 -4.365 -20.482 549 HG21 VAL 78 3HG2 VAL 78 -4.974 -3.746 -17.561 550 HG22 VAL 78 1HG2 VAL 78 -4.531 -2.074 -17.904 551 HG23 VAL 78 2HG2 VAL 78 -5.499 -2.985 -19.063 552 H LEU 79 H LEU 79 -1.674 -6.519 -18.276 553 HA LEU 79 HA LEU 79 0.837 -5.763 -19.602 554 HB2 LEU 79 2HB LEU 79 0.409 -7.413 -17.466 555 HB3 LEU 79 3HB LEU 79 0.493 -8.559 -18.803 556 HG LEU 79 HG LEU 79 2.714 -7.721 -19.386 557 HD11 LEU 79 1HD1 LEU 79 3.494 -5.774 -18.668 558 HD12 LEU 79 2HD1 LEU 79 3.281 -6.257 -16.985 559 HD13 LEU 79 3HD1 LEU 79 1.950 -5.500 -17.860 560 HD21 LEU 79 3HD2 LEU 79 2.703 -8.312 -16.443 561 HD22 LEU 79 1HD2 LEU 79 3.884 -8.789 -17.663 562 HD23 LEU 79 2HD2 LEU 79 2.287 -9.538 -17.642 563 H ILE 80 H ILE 80 1.230 -6.328 -21.656 564 HA ILE 80 HA ILE 80 -0.744 -8.060 -22.992 565 HB ILE 80 HB ILE 80 -0.806 -5.771 -23.833 566 HG12 ILE 80 2HG1 ILE 80 0.557 -7.518 -25.885 567 HG13 ILE 80 3HG1 ILE 80 -1.100 -7.780 -25.354 568 HG21 ILE 80 1HG2 ILE 80 1.960 -5.856 -23.456 569 HG22 ILE 80 2HG2 ILE 80 1.727 -5.714 -25.198 570 HG23 ILE 80 3HG2 ILE 80 1.011 -4.523 -24.113 571 HD11 ILE 80 3HD1 ILE 80 -1.524 -6.517 -27.173 572 HD12 ILE 80 1HD1 ILE 80 -1.285 -5.210 -26.013 573 HD13 ILE 80 2HD1 ILE 80 0.027 -5.681 -27.094 574 H THR 81 H THR 81 -0.057 -9.850 -23.993 575 HA THR 81 HA THR 81 2.853 -10.268 -24.205 576 HB THR 81 HB THR 81 2.020 -11.839 -22.635 577 HG1 THR 81 HG1 THR 81 2.526 -13.756 -23.686 578 HG21 THR 81 3HG2 THR 81 0.152 -13.465 -23.721 579 HG22 THR 81 1HG2 THR 81 -0.300 -11.927 -24.454 580 HG23 THR 81 2HG2 THR 81 -0.228 -12.080 -22.698 581 H ARG 82 H ARG 82 3.701 -10.696 -26.149 582 HA ARG 82 HA ARG 82 1.875 -10.881 -28.425 583 HB2 ARG 82 2HB ARG 82 4.614 -9.880 -28.001 584 HB3 ARG 82 3HB ARG 82 4.364 -10.728 -29.521 585 HG2 ARG 82 2HG ARG 82 2.304 -9.187 -29.770 586 HG3 ARG 82 3HG ARG 82 3.100 -8.206 -28.538 587 HD2 ARG 82 2HD ARG 82 5.158 -8.669 -30.241 588 HD3 ARG 82 3HD ARG 82 3.797 -8.638 -31.362 589 HE ARG 82 HE ARG 82 3.408 -6.425 -29.859 590 HH11 ARG 82 1HH1 ARG 82 6.133 -7.655 -31.642 591 HH12 ARG 82 2HH1 ARG 82 6.772 -6.085 -32.002 592 HH21 ARG 82 1HH2 ARG 82 4.239 -4.353 -30.326 593 HH22 ARG 82 2HH2 ARG 82 5.694 -4.207 -31.252 594 H THR 83 H THR 83 2.105 -12.473 -30.041 595 HA THR 83 HA THR 83 3.501 -14.908 -29.138 596 HB THR 83 HB THR 83 1.013 -14.788 -30.852 597 HG1 THR 83 HG1 THR 83 0.156 -15.789 -28.799 598 HG21 THR 83 3HG2 THR 83 1.707 -16.860 -31.386 599 HG22 THR 83 1HG2 THR 83 1.160 -17.289 -29.766 600 HG23 THR 83 2HG2 THR 83 2.861 -16.922 -30.055 601 H VAL 84 H VAL 84 5.306 -13.780 -30.356 602 HA VAL 84 HA VAL 84 6.716 -13.703 -32.142 603 HB VAL 84 HB VAL 84 4.950 -15.887 -33.256 604 HG11 VAL 84 1HG1 VAL 84 6.305 -15.036 -35.006 605 HG12 VAL 84 2HG1 VAL 84 7.724 -14.952 -33.959 606 HG13 VAL 84 3HG1 VAL 84 7.078 -16.519 -34.448 607 HG21 VAL 84 3HG2 VAL 84 7.249 -17.060 -32.307 608 HG22 VAL 84 1HG2 VAL 84 6.888 -15.845 -31.080 609 HG23 VAL 84 2HG2 VAL 84 5.682 -17.062 -31.498 610 H GLY 85 H GLY 85 5.824 -11.560 -32.581 611 HA2 GLY 85 2HA GLY 85 4.856 -11.410 -35.310 612 HA3 GLY 85 3HA GLY 85 3.748 -10.779 -34.101 Start of MODEL 13 1 H1 MET 9 H MET 9 0.154 0.231 0.296 2 HA MET 9 HA MET 9 1.286 0.732 -2.209 3 HB2 MET 9 2HB MET 9 3.366 -0.198 -1.247 4 HB3 MET 9 3HB MET 9 2.580 0.950 -0.172 5 HG2 MET 9 2HG MET 9 2.248 -0.579 1.420 6 HG3 MET 9 3HG MET 9 1.771 -1.820 0.264 7 HE1 MET 9 3HE MET 9 4.373 -1.274 2.979 8 HE2 MET 9 1HE MET 9 5.868 -1.044 2.072 9 HE3 MET 9 2HE MET 9 4.556 0.125 1.919 10 H LYS 10 H LYS 10 -0.575 -0.890 -3.052 11 HA LYS 10 HA LYS 10 0.856 -3.365 -3.751 12 HB2 LYS 10 2HB LYS 10 -1.967 -3.024 -2.809 13 HB3 LYS 10 3HB LYS 10 -1.575 -4.331 -3.918 14 HG2 LYS 10 2HG LYS 10 0.272 -4.919 -2.218 15 HG3 LYS 10 3HG LYS 10 -0.649 -3.902 -1.107 16 HD2 LYS 10 2HD LYS 10 -2.657 -5.289 -1.604 17 HD3 LYS 10 3HD LYS 10 -1.628 -6.357 -2.562 18 HE2 LYS 10 2HE LYS 10 -0.226 -6.700 -0.521 19 HE3 LYS 10 3HE LYS 10 -1.429 -5.791 0.392 20 HZ1 LYS 10 3HZ LYS 10 -1.450 -8.499 -0.197 21 HZ2 LYS 10 1HZ LYS 10 -2.697 -7.813 -1.112 22 HZ3 LYS 10 2HZ LYS 10 -2.666 -7.602 0.565 23 H ILE 11 H ILE 11 0.518 -4.155 -5.845 24 HA ILE 11 HA ILE 11 -0.928 -2.345 -7.665 25 HB ILE 11 HB ILE 11 1.469 -1.958 -7.916 26 HG12 ILE 11 2HG1 ILE 11 0.837 -3.552 -10.349 27 HG13 ILE 11 3HG1 ILE 11 -0.289 -2.273 -9.907 28 HG21 ILE 11 1HG2 ILE 11 1.549 -4.934 -8.268 29 HG22 ILE 11 2HG2 ILE 11 2.809 -3.898 -8.936 30 HG23 ILE 11 3HG2 ILE 11 2.512 -3.916 -7.198 31 HD11 ILE 11 3HD1 ILE 11 1.058 -0.998 -11.154 32 HD12 ILE 11 1HD1 ILE 11 2.068 -0.966 -9.709 33 HD13 ILE 11 2HD1 ILE 11 2.419 -2.109 -11.006 34 H LYS 12 H LYS 12 -1.985 -3.283 -9.401 35 HA LYS 12 HA LYS 12 -2.142 -6.227 -9.344 36 HB2 LYS 12 2HB LYS 12 -4.180 -4.660 -8.677 37 HB3 LYS 12 3HB LYS 12 -4.392 -4.592 -10.421 38 HG2 LYS 12 2HG LYS 12 -4.101 -7.255 -10.056 39 HG3 LYS 12 3HG LYS 12 -4.879 -6.791 -8.541 40 HD2 LYS 12 2HD LYS 12 -5.898 -6.071 -11.288 41 HD3 LYS 12 3HD LYS 12 -6.486 -7.425 -10.321 42 HE2 LYS 12 2HE LYS 12 -7.257 -5.925 -8.603 43 HE3 LYS 12 3HE LYS 12 -6.532 -4.545 -9.427 44 HZ1 LYS 12 3HZ LYS 12 -8.663 -6.220 -10.630 45 HZ2 LYS 12 1HZ LYS 12 -8.085 -4.729 -11.184 46 HZ3 LYS 12 2HZ LYS 12 -8.978 -4.810 -9.750 47 H ILE 13 H ILE 13 -1.445 -7.203 -11.119 48 HA ILE 13 HA ILE 13 -1.358 -5.662 -13.628 49 HB ILE 13 HB ILE 13 0.863 -6.227 -13.025 50 HG12 ILE 13 2HG1 ILE 13 1.579 -7.610 -14.867 51 HG13 ILE 13 3HG1 ILE 13 -0.005 -8.369 -14.974 52 HG21 ILE 13 1HG2 ILE 13 1.092 -8.974 -12.890 53 HG22 ILE 13 2HG2 ILE 13 1.132 -7.856 -11.528 54 HG23 ILE 13 3HG2 ILE 13 -0.383 -8.634 -11.987 55 HD11 ILE 13 3HD1 ILE 13 0.903 -6.207 -16.434 56 HD12 ILE 13 1HD1 ILE 13 -0.762 -6.774 -16.310 57 HD13 ILE 13 2HD1 ILE 13 -0.182 -5.500 -15.237 58 H VAL 14 H VAL 14 -3.017 -6.190 -14.891 59 HA VAL 14 HA VAL 14 -3.970 -8.966 -14.926 60 HB VAL 14 HB VAL 14 -5.296 -6.564 -16.183 61 HG11 VAL 14 1HG1 VAL 14 -7.313 -8.158 -15.803 62 HG12 VAL 14 2HG1 VAL 14 -6.237 -8.429 -17.175 63 HG13 VAL 14 3HG1 VAL 14 -6.077 -9.412 -15.719 64 HG21 VAL 14 3HG2 VAL 14 -6.786 -7.274 -13.968 65 HG22 VAL 14 1HG2 VAL 14 -5.120 -7.366 -13.396 66 HG23 VAL 14 2HG2 VAL 14 -5.727 -5.870 -14.105 67 HA PRO 15 HA PRO 15 -1.665 -9.258 -18.776 68 HB2 PRO 15 2HB PRO 15 -2.002 -11.940 -19.037 69 HB3 PRO 15 3HB PRO 15 -0.796 -11.223 -17.962 70 HG2 PRO 15 2HG PRO 15 -3.509 -12.307 -17.310 71 HG3 PRO 15 3HG PRO 15 -1.981 -12.518 -16.436 72 HD2 PRO 15 2HD PRO 15 -3.872 -10.743 -15.657 73 HD3 PRO 15 3HD PRO 15 -2.136 -10.458 -15.413 74 H ALA 16 H ALA 16 -2.401 -9.019 -20.798 75 HA ALA 16 HA ALA 16 -5.228 -9.458 -21.323 76 HB1 ALA 16 1HB ALA 16 -3.354 -8.377 -23.373 77 HB2 ALA 16 2HB ALA 16 -5.039 -7.964 -23.056 78 HB3 ALA 16 3HB ALA 16 -3.771 -7.383 -21.977 79 H VAL 17 H VAL 17 -4.108 -11.872 -20.993 80 HA VAL 17 HA VAL 17 -3.946 -12.930 -23.739 81 HB VAL 17 HB VAL 17 -1.743 -13.126 -22.778 82 HG11 VAL 17 1HG1 VAL 17 -1.390 -13.418 -20.606 83 HG12 VAL 17 2HG1 VAL 17 -3.136 -13.493 -20.363 84 HG13 VAL 17 3HG1 VAL 17 -2.219 -14.974 -20.643 85 HG21 VAL 17 3HG2 VAL 17 -2.822 -15.048 -24.082 86 HG22 VAL 17 1HG2 VAL 17 -1.361 -15.404 -23.161 87 HG23 VAL 17 2HG2 VAL 17 -2.939 -15.869 -22.525 88 H GLY 18 H GLY 18 -5.607 -14.207 -24.196 89 HA2 GLY 18 2HA GLY 18 -7.440 -15.568 -23.928 90 HA3 GLY 18 3HA GLY 18 -6.423 -16.431 -22.783 91 H GLY 19 H GLY 19 -7.258 -16.641 -20.822 92 HA2 GLY 19 2HA GLY 19 -9.632 -15.312 -20.031 93 HA3 GLY 19 3HA GLY 19 -8.622 -16.316 -19.002 94 H GLY 20 H GLY 20 -6.234 -14.681 -19.417 95 HA2 GLY 20 2HA GLY 20 -5.176 -12.920 -18.392 96 HA3 GLY 20 3HA GLY 20 -6.622 -11.992 -18.760 97 H SER 21 H SER 21 -4.855 -13.704 -16.340 98 HA SER 21 HA SER 21 -6.940 -13.094 -14.353 99 HB2 SER 21 2HB SER 21 -5.852 -15.496 -14.749 100 HB3 SER 21 3HB SER 21 -4.623 -14.842 -13.666 101 HG SER 21 HG SER 21 -5.997 -15.521 -12.205 102 HA PRO 22 HA PRO 22 -4.273 -9.851 -12.922 103 HB2 PRO 22 2HB PRO 22 -5.705 -9.231 -10.701 104 HB3 PRO 22 3HB PRO 22 -6.200 -8.751 -12.328 105 HG2 PRO 22 2HG PRO 22 -7.152 -11.046 -10.658 106 HG3 PRO 22 3HG PRO 22 -8.093 -9.924 -11.658 107 HD2 PRO 22 2HD PRO 22 -7.439 -12.417 -12.487 108 HD3 PRO 22 3HD PRO 22 -7.599 -11.049 -13.608 109 H LEU 23 H LEU 23 -2.517 -9.822 -11.641 110 HA LEU 23 HA LEU 23 -2.393 -11.752 -9.418 111 HB2 LEU 23 2HB LEU 23 -1.000 -12.464 -11.288 112 HB3 LEU 23 3HB LEU 23 -0.176 -10.907 -11.279 113 HG LEU 23 HG LEU 23 0.139 -11.942 -8.694 114 HD11 LEU 23 1HD1 LEU 23 1.423 -14.089 -9.555 115 HD12 LEU 23 2HD1 LEU 23 0.155 -14.054 -10.779 116 HD13 LEU 23 3HD1 LEU 23 -0.272 -14.148 -9.070 117 HD21 LEU 23 3HD2 LEU 23 2.517 -12.410 -9.919 118 HD22 LEU 23 1HD2 LEU 23 1.984 -10.835 -9.332 119 HD23 LEU 23 2HD2 LEU 23 1.776 -11.259 -11.031 120 H GLU 24 H GLU 24 -1.510 -11.076 -7.505 121 HA GLU 24 HA GLU 24 -1.222 -8.196 -7.194 122 HB2 GLU 24 2HB GLU 24 -2.089 -10.376 -5.529 123 HB3 GLU 24 3HB GLU 24 -0.805 -9.487 -4.721 124 HG2 GLU 24 2HG GLU 24 -2.168 -7.814 -4.230 125 HG3 GLU 24 3HG GLU 24 -2.712 -7.682 -5.901 126 H LEU 25 H LEU 25 0.655 -7.168 -6.910 127 HA LEU 25 HA LEU 25 3.019 -8.678 -6.080 128 HB2 LEU 25 2HB LEU 25 2.526 -7.822 -8.739 129 HB3 LEU 25 3HB LEU 25 3.822 -6.824 -8.083 130 HG LEU 25 HG LEU 25 4.136 -9.711 -7.628 131 HD11 LEU 25 1HD1 LEU 25 4.399 -10.432 -9.769 132 HD12 LEU 25 2HD1 LEU 25 4.788 -8.826 -10.383 133 HD13 LEU 25 3HD1 LEU 25 3.114 -9.252 -10.030 134 HD21 LEU 25 3HD2 LEU 25 6.401 -8.878 -8.769 135 HD22 LEU 25 1HD2 LEU 25 6.039 -8.618 -7.062 136 HD23 LEU 25 2HD2 LEU 25 5.775 -7.320 -8.227 137 H GLU 26 H GLU 26 4.813 -7.282 -5.416 138 HA GLU 26 HA GLU 26 3.810 -4.738 -4.330 139 HB2 GLU 26 2HB GLU 26 5.696 -4.980 -2.685 140 HB3 GLU 26 3HB GLU 26 4.441 -6.205 -2.560 141 HG2 GLU 26 2HG GLU 26 5.923 -7.818 -2.841 142 HG3 GLU 26 3HG GLU 26 6.470 -7.107 -4.358 143 H VAL 27 H VAL 27 4.397 -3.094 -5.593 144 HA VAL 27 HA VAL 27 7.231 -2.816 -6.274 145 HB VAL 27 HB VAL 27 6.786 -2.141 -8.542 146 HG11 VAL 27 1HG1 VAL 27 5.811 -4.290 -9.448 147 HG12 VAL 27 2HG1 VAL 27 7.179 -4.467 -8.348 148 HG13 VAL 27 3HG1 VAL 27 5.538 -4.769 -7.774 149 HG21 VAL 27 3HG2 VAL 27 4.322 -2.658 -9.339 150 HG22 VAL 27 1HG2 VAL 27 3.951 -2.286 -7.655 151 HG23 VAL 27 2HG2 VAL 27 4.759 -1.088 -8.666 152 H ALA 28 H ALA 28 7.698 -0.563 -7.101 153 HA ALA 28 HA ALA 28 5.883 1.418 -5.899 154 HB1 ALA 28 1HB ALA 28 7.975 2.671 -5.197 155 HB2 ALA 28 2HB ALA 28 7.579 1.218 -4.279 156 HB3 ALA 28 3HB ALA 28 8.851 1.170 -5.499 157 HA PRO 29 HA PRO 29 6.400 3.017 -10.054 158 HB2 PRO 29 2HB PRO 29 4.543 4.980 -9.790 159 HB3 PRO 29 3HB PRO 29 4.118 3.290 -10.083 160 HG2 PRO 29 2HG PRO 29 4.136 4.819 -7.510 161 HG3 PRO 29 3HG PRO 29 2.930 3.671 -8.121 162 HD2 PRO 29 2HD PRO 29 4.795 2.983 -6.282 163 HD3 PRO 29 3HD PRO 29 4.170 1.835 -7.484 164 H ASN 30 H ASN 30 6.990 4.508 -7.033 165 HA ASN 30 HA ASN 30 7.880 7.029 -8.153 166 HB2 ASN 30 2HB ASN 30 8.561 7.493 -5.762 167 HB3 ASN 30 3HB ASN 30 6.845 7.186 -6.007 168 HD21 ASN 30 1HD2 ASN 30 5.898 5.575 -4.924 169 HD22 ASN 30 2HD2 ASN 30 6.723 4.454 -3.901 170 H ALA 31 H ALA 31 9.148 4.134 -8.396 171 HA ALA 31 HA ALA 31 11.902 4.930 -7.741 172 HB1 ALA 31 1HB ALA 31 11.837 2.907 -6.766 173 HB2 ALA 31 2HB ALA 31 10.473 2.364 -7.744 174 HB3 ALA 31 3HB ALA 31 12.107 2.312 -8.404 175 H THR 32 H THR 32 10.672 2.633 -10.145 176 HA THR 32 HA THR 32 11.505 4.284 -12.359 177 HB THR 32 HB THR 32 12.851 1.704 -12.594 178 HG1 THR 32 HG1 THR 32 14.005 1.776 -10.827 179 HG21 THR 32 3HG2 THR 32 13.493 3.196 -14.214 180 HG22 THR 32 1HG2 THR 32 14.767 3.474 -13.027 181 HG23 THR 32 2HG2 THR 32 13.399 4.583 -13.129 182 H VAL 33 H VAL 33 10.602 3.655 -14.291 183 HA VAL 33 HA VAL 33 8.349 1.932 -14.165 184 HB VAL 33 HB VAL 33 9.705 3.087 -16.606 185 HG11 VAL 33 1HG1 VAL 33 7.419 1.334 -16.255 186 HG12 VAL 33 2HG1 VAL 33 7.002 2.818 -17.115 187 HG13 VAL 33 3HG1 VAL 33 8.289 1.777 -17.724 188 HG21 VAL 33 3HG2 VAL 33 9.083 4.915 -15.258 189 HG22 VAL 33 1HG2 VAL 33 7.780 4.740 -16.433 190 HG23 VAL 33 2HG2 VAL 33 7.564 4.153 -14.784 191 H GLY 34 H GLY 34 11.515 1.649 -15.766 192 HA2 GLY 34 2HA GLY 34 11.037 -0.900 -16.897 193 HA3 GLY 34 3HA GLY 34 12.614 -0.169 -16.639 194 H ALA 35 H ALA 35 12.273 0.110 -13.768 195 HA ALA 35 HA ALA 35 13.307 -2.388 -12.958 196 HB1 ALA 35 1HB ALA 35 13.723 -0.109 -11.910 197 HB2 ALA 35 2HB ALA 35 12.179 -0.328 -11.084 198 HB3 ALA 35 3HB ALA 35 13.498 -1.465 -10.804 199 H VAL 36 H VAL 36 10.144 -0.854 -12.445 200 HA VAL 36 HA VAL 36 9.057 -2.969 -10.902 201 HB VAL 36 HB VAL 36 7.627 -0.872 -12.543 202 HG11 VAL 36 1HG1 VAL 36 5.928 -2.343 -12.158 203 HG12 VAL 36 2HG1 VAL 36 6.680 -3.006 -10.706 204 HG13 VAL 36 3HG1 VAL 36 5.871 -1.439 -10.645 205 HG21 VAL 36 3HG2 VAL 36 7.552 -0.547 -9.674 206 HG22 VAL 36 1HG2 VAL 36 9.210 -0.571 -10.273 207 HG23 VAL 36 2HG2 VAL 36 8.054 0.593 -10.921 208 H ARG 37 H ARG 37 8.816 -2.136 -14.346 209 HA ARG 37 HA ARG 37 7.062 -4.186 -15.097 210 HB2 ARG 37 2HB ARG 37 7.467 -2.370 -16.605 211 HB3 ARG 37 3HB ARG 37 9.190 -2.718 -16.653 212 HG2 ARG 37 2HG ARG 37 8.087 -3.440 -18.693 213 HG3 ARG 37 3HG ARG 37 8.745 -4.817 -17.807 214 HD2 ARG 37 2HD ARG 37 6.136 -4.458 -16.847 215 HD3 ARG 37 3HD ARG 37 6.033 -4.279 -18.598 216 HE ARG 37 HE ARG 37 7.493 -6.510 -18.358 217 HH11 ARG 37 1HH1 ARG 37 4.526 -5.509 -16.837 218 HH12 ARG 37 2HH1 ARG 37 3.916 -7.122 -16.669 219 HH21 ARG 37 1HH2 ARG 37 6.700 -8.638 -18.142 220 HH22 ARG 37 2HH2 ARG 37 5.153 -8.901 -17.411 221 H THR 38 H THR 38 10.581 -4.116 -14.833 222 HA THR 38 HA THR 38 11.002 -6.697 -15.955 223 HB THR 38 HB THR 38 12.787 -5.077 -14.128 224 HG1 THR 38 HG1 THR 38 12.358 -5.150 -16.904 225 HG21 THR 38 3HG2 THR 38 13.401 -7.439 -14.107 226 HG22 THR 38 1HG2 THR 38 14.601 -6.495 -14.989 227 HG23 THR 38 2HG2 THR 38 13.419 -7.463 -15.870 228 H LYS 39 H LYS 39 10.554 -5.486 -12.675 229 HA LYS 39 HA LYS 39 11.214 -7.851 -11.300 230 HB2 LYS 39 2HB LYS 39 10.935 -5.553 -10.299 231 HB3 LYS 39 3HB LYS 39 9.195 -5.781 -10.425 232 HG2 LYS 39 2HG LYS 39 9.725 -6.330 -8.216 233 HG3 LYS 39 3HG LYS 39 9.525 -7.882 -9.032 234 HD2 LYS 39 2HD LYS 39 12.244 -7.055 -9.282 235 HD3 LYS 39 3HD LYS 39 11.767 -6.932 -7.587 236 HE2 LYS 39 2HE LYS 39 11.593 -9.162 -7.348 237 HE3 LYS 39 3HE LYS 39 10.864 -9.374 -8.939 238 HZ1 LYS 39 3HZ LYS 39 13.688 -9.393 -8.170 239 HZ2 LYS 39 1HZ LYS 39 13.292 -8.799 -9.704 240 HZ3 LYS 39 2HZ LYS 39 12.863 -10.377 -9.271 241 H VAL 40 H VAL 40 8.094 -6.613 -12.461 242 HA VAL 40 HA VAL 40 6.576 -8.820 -11.508 243 HB VAL 40 HB VAL 40 4.787 -7.976 -12.998 244 HG11 VAL 40 1HG1 VAL 40 4.532 -6.898 -11.027 245 HG12 VAL 40 2HG1 VAL 40 6.201 -6.326 -10.999 246 HG13 VAL 40 3HG1 VAL 40 4.999 -5.496 -11.989 247 HG21 VAL 40 3HG2 VAL 40 6.931 -6.053 -13.888 248 HG22 VAL 40 1HG2 VAL 40 6.053 -7.217 -14.881 249 HG23 VAL 40 2HG2 VAL 40 5.210 -5.826 -14.199 250 H CYS 41 H CYS 41 8.107 -8.049 -14.593 251 HA CYS 41 HA CYS 41 7.008 -10.115 -16.127 252 HB2 CYS 41 2HB CYS 41 8.283 -8.207 -17.060 253 HB3 CYS 41 3HB CYS 41 9.760 -8.884 -16.384 254 HG CYS 41 HG CYS 41 7.862 -10.602 -18.646 255 H ALA 42 H ALA 42 9.977 -10.024 -14.185 256 HA ALA 42 HA ALA 42 10.778 -12.677 -14.797 257 HB1 ALA 42 1HB ALA 42 11.698 -11.685 -12.220 258 HB2 ALA 42 2HB ALA 42 12.619 -12.148 -13.652 259 HB3 ALA 42 3HB ALA 42 11.933 -10.528 -13.530 260 H MET 43 H MET 43 8.813 -11.252 -12.247 261 HA MET 43 HA MET 43 8.669 -13.508 -10.569 262 HB2 MET 43 2HB MET 43 7.754 -10.928 -10.446 263 HB3 MET 43 3HB MET 43 6.259 -11.830 -10.658 264 HG2 MET 43 2HG MET 43 8.300 -12.458 -8.542 265 HG3 MET 43 3HG MET 43 6.917 -11.395 -8.290 266 HE1 MET 43 3HE MET 43 6.695 -12.982 -6.238 267 HE2 MET 43 1HE MET 43 5.046 -12.595 -6.730 268 HE3 MET 43 2HE MET 43 5.472 -14.252 -6.300 269 H LYS 44 H LYS 44 6.959 -12.621 -13.476 270 HA LYS 44 HA LYS 44 5.151 -14.911 -13.173 271 HB2 LYS 44 2HB LYS 44 5.070 -12.839 -15.360 272 HB3 LYS 44 3HB LYS 44 3.790 -13.935 -14.861 273 HG2 LYS 44 2HG LYS 44 4.438 -12.446 -12.583 274 HG3 LYS 44 3HG LYS 44 4.399 -11.295 -13.921 275 HD2 LYS 44 2HD LYS 44 2.198 -11.434 -12.978 276 HD3 LYS 44 3HD LYS 44 2.173 -12.214 -14.561 277 HE2 LYS 44 2HE LYS 44 2.590 -14.392 -13.276 278 HE3 LYS 44 3HE LYS 44 2.133 -13.480 -11.838 279 HZ1 LYS 44 3HZ LYS 44 0.214 -14.588 -12.685 280 HZ2 LYS 44 1HZ LYS 44 0.462 -13.972 -14.242 281 HZ3 LYS 44 2HZ LYS 44 0.024 -12.933 -12.981 282 H LYS 45 H LYS 45 8.081 -14.118 -14.565 283 HA LYS 45 HA LYS 45 9.440 -15.118 -16.091 284 HB2 LYS 45 2HB LYS 45 7.532 -17.387 -15.529 285 HB3 LYS 45 3HB LYS 45 8.950 -17.564 -16.554 286 HG2 LYS 45 2HG LYS 45 9.961 -16.409 -14.266 287 HG3 LYS 45 3HG LYS 45 8.736 -17.527 -13.662 288 HD2 LYS 45 2HD LYS 45 10.787 -18.729 -13.783 289 HD3 LYS 45 3HD LYS 45 9.775 -19.294 -15.114 290 HE2 LYS 45 2HE LYS 45 11.038 -17.383 -16.423 291 HE3 LYS 45 3HE LYS 45 12.250 -17.638 -15.168 292 HZ1 LYS 45 3HZ LYS 45 11.868 -19.132 -17.468 293 HZ2 LYS 45 1HZ LYS 45 11.379 -20.123 -16.188 294 HZ3 LYS 45 2HZ LYS 45 12.934 -19.459 -16.196 295 H LEU 46 H LEU 46 7.934 -13.394 -17.342 296 HA LEU 46 HA LEU 46 6.730 -14.784 -19.638 297 HB2 LEU 46 2HB LEU 46 6.069 -12.355 -18.169 298 HB3 LEU 46 3HB LEU 46 6.108 -12.117 -19.914 299 HG LEU 46 HG LEU 46 4.499 -14.037 -20.112 300 HD11 LEU 46 1HD1 LEU 46 5.091 -14.291 -17.356 301 HD12 LEU 46 2HD1 LEU 46 4.013 -15.277 -18.343 302 HD13 LEU 46 3HD1 LEU 46 3.388 -13.858 -17.503 303 HD21 LEU 46 3HD2 LEU 46 3.512 -11.967 -20.408 304 HD22 LEU 46 1HD2 LEU 46 3.843 -11.456 -18.752 305 HD23 LEU 46 2HD2 LEU 46 2.575 -12.640 -19.073 306 HA PRO 47 HA PRO 47 9.832 -13.387 -22.408 307 HB2 PRO 47 2HB PRO 47 8.396 -12.735 -24.618 308 HB3 PRO 47 3HB PRO 47 8.651 -14.404 -24.097 309 HG2 PRO 47 2HG PRO 47 6.274 -12.633 -23.681 310 HG3 PRO 47 3HG PRO 47 6.327 -14.344 -24.140 311 HD2 PRO 47 2HD PRO 47 5.814 -13.531 -21.609 312 HD3 PRO 47 3HD PRO 47 6.665 -15.046 -21.971 313 HA PRO 48 HA PRO 48 9.696 -8.952 -21.560 314 HB2 PRO 48 2HB PRO 48 12.369 -8.588 -21.859 315 HB3 PRO 48 3HB PRO 48 11.647 -9.232 -20.380 316 HG2 PRO 48 2HG PRO 48 12.958 -10.693 -22.641 317 HG3 PRO 48 3HG PRO 48 13.123 -10.954 -20.894 318 HD2 PRO 48 2HD PRO 48 11.541 -12.501 -22.455 319 HD3 PRO 48 3HD PRO 48 11.155 -12.146 -20.759 320 H ASP 49 H ASP 49 11.061 -10.647 -24.300 321 HA ASP 49 HA ASP 49 11.628 -8.387 -25.906 322 HB2 ASP 49 2HB ASP 49 11.152 -11.295 -26.528 323 HB3 ASP 49 3HB ASP 49 11.447 -10.115 -27.802 324 H THR 50 H THR 50 8.778 -10.450 -25.571 325 HA THR 50 HA THR 50 7.292 -8.567 -27.285 326 HB THR 50 HB THR 50 5.683 -10.383 -27.696 327 HG1 THR 50 HG1 THR 50 6.163 -12.473 -26.954 328 HG21 THR 50 3HG2 THR 50 6.928 -11.446 -29.333 329 HG22 THR 50 1HG2 THR 50 8.369 -11.544 -28.322 330 HG23 THR 50 2HG2 THR 50 7.892 -10.001 -29.032 331 H THR 51 H THR 51 7.317 -7.374 -25.104 332 HA THR 51 HA THR 51 4.792 -7.991 -23.759 333 HB THR 51 HB THR 51 6.658 -8.934 -22.376 334 HG1 THR 51 HG1 THR 51 5.301 -8.507 -20.821 335 HG21 THR 51 3HG2 THR 51 8.264 -7.577 -21.353 336 HG22 THR 51 1HG2 THR 51 7.384 -6.095 -21.723 337 HG23 THR 51 2HG2 THR 51 8.209 -6.975 -23.010 338 H ARG 52 H ARG 52 3.605 -6.225 -23.248 339 HA ARG 52 HA ARG 52 4.879 -3.590 -23.578 340 HB2 ARG 52 2HB ARG 52 2.022 -4.174 -24.336 341 HB3 ARG 52 3HB ARG 52 2.983 -2.757 -24.735 342 HG2 ARG 52 2HG ARG 52 4.479 -4.381 -26.038 343 HG3 ARG 52 3HG ARG 52 3.132 -5.512 -25.894 344 HD2 ARG 52 2HD ARG 52 2.338 -4.560 -27.751 345 HD3 ARG 52 3HD ARG 52 1.903 -3.199 -26.719 346 HE ARG 52 HE ARG 52 4.579 -2.944 -27.582 347 HH11 ARG 52 1HH1 ARG 52 1.306 -2.693 -28.742 348 HH12 ARG 52 2HH1 ARG 52 1.693 -1.538 -29.974 349 HH21 ARG 52 1HH2 ARG 52 5.101 -1.423 -29.200 350 HH22 ARG 52 2HH2 ARG 52 3.852 -0.817 -30.234 351 H LEU 53 H LEU 53 3.945 -1.858 -22.363 352 HA LEU 53 HA LEU 53 2.198 -2.682 -20.151 353 HB2 LEU 53 2HB LEU 53 4.100 -2.670 -18.921 354 HB3 LEU 53 3HB LEU 53 4.932 -1.572 -20.021 355 HG LEU 53 HG LEU 53 3.703 0.317 -19.043 356 HD11 LEU 53 1HD1 LEU 53 1.947 -1.609 -18.143 357 HD12 LEU 53 2HD1 LEU 53 1.956 0.093 -17.682 358 HD13 LEU 53 3HD1 LEU 53 2.787 -1.097 -16.679 359 HD21 LEU 53 3HD2 LEU 53 5.642 0.319 -17.916 360 HD22 LEU 53 1HD2 LEU 53 5.561 -1.410 -17.574 361 HD23 LEU 53 2HD2 LEU 53 4.668 -0.269 -16.568 362 H THR 54 H THR 54 0.500 -1.389 -19.958 363 HA THR 54 HA THR 54 0.738 1.404 -20.866 364 HB THR 54 HB THR 54 -1.967 0.607 -21.151 365 HG1 THR 54 HG1 THR 54 -1.786 -1.404 -21.769 366 HG21 THR 54 3HG2 THR 54 -1.764 1.629 -23.176 367 HG22 THR 54 1HG2 THR 54 -0.225 0.850 -23.540 368 HG23 THR 54 2HG2 THR 54 -0.278 2.227 -22.439 369 H TYR 55 H TYR 55 0.358 2.785 -19.275 370 HA TYR 55 HA TYR 55 -1.492 1.984 -17.125 371 HB2 TYR 55 2HB TYR 55 0.845 2.062 -16.347 372 HB3 TYR 55 3HB TYR 55 0.964 3.735 -16.881 373 HD1 TYR 55 HD1 TYR 55 -0.903 1.516 -14.549 374 HD2 TYR 55 HD2 TYR 55 0.369 5.477 -15.441 375 HE1 TYR 55 HE1 TYR 55 -1.725 2.267 -12.356 376 HE2 TYR 55 HE2 TYR 55 -0.449 6.239 -13.250 377 HH TYR 55 HH TYR 55 -1.776 5.665 -11.479 378 H LYS 56 H LYS 56 -3.192 3.261 -16.818 379 HA LYS 56 HA LYS 56 -4.672 4.972 -17.061 380 HB2 LYS 56 2HB LYS 56 -2.639 6.018 -15.763 381 HB3 LYS 56 3HB LYS 56 -2.404 6.916 -17.257 382 HG2 LYS 56 2HG LYS 56 -5.029 7.336 -16.885 383 HG3 LYS 56 3HG LYS 56 -4.507 7.157 -15.208 384 HD2 LYS 56 2HD LYS 56 -4.377 9.477 -15.775 385 HD3 LYS 56 3HD LYS 56 -2.729 8.855 -15.665 386 HE2 LYS 56 2HE LYS 56 -2.412 8.929 -17.958 387 HE3 LYS 56 3HE LYS 56 -4.141 8.896 -18.300 388 HZ1 LYS 56 3HZ LYS 56 -2.416 11.140 -17.839 389 HZ2 LYS 56 1HZ LYS 56 -3.817 11.194 -16.893 390 HZ3 LYS 56 2HZ LYS 56 -3.937 11.082 -18.577 391 H GLY 57 H GLY 57 -3.702 3.681 -19.461 392 HA2 GLY 57 2HA GLY 57 -4.124 3.921 -21.715 393 HA3 GLY 57 3HA GLY 57 -4.742 5.531 -21.378 394 H ARG 58 H ARG 58 -1.698 5.239 -20.058 395 HA ARG 58 HA ARG 58 -0.418 6.304 -22.488 396 HB2 ARG 58 2HB ARG 58 -0.957 7.722 -20.141 397 HB3 ARG 58 3HB ARG 58 0.753 7.327 -20.043 398 HG2 ARG 58 2HG ARG 58 -0.144 8.358 -22.643 399 HG3 ARG 58 3HG ARG 58 -0.240 9.496 -21.298 400 HD2 ARG 58 2HD ARG 58 2.242 8.140 -21.112 401 HD3 ARG 58 3HD ARG 58 2.045 8.671 -22.782 402 HE ARG 58 HE ARG 58 2.547 10.317 -20.508 403 HH11 ARG 58 1HH1 ARG 58 0.975 10.230 -23.613 404 HH12 ARG 58 2HH1 ARG 58 1.065 11.943 -23.853 405 HH21 ARG 58 1HH2 ARG 58 2.672 12.574 -20.812 406 HH22 ARG 58 2HH2 ARG 58 2.032 13.276 -22.260 407 H ALA 59 H ALA 59 1.914 6.055 -22.564 408 HA ALA 59 HA ALA 59 2.766 3.597 -21.200 409 HB1 ALA 59 1HB ALA 59 3.482 2.956 -23.197 410 HB2 ALA 59 2HB ALA 59 2.988 4.502 -23.889 411 HB3 ALA 59 3HB ALA 59 4.609 4.312 -23.222 412 H LEU 60 H LEU 60 4.348 3.636 -19.735 413 HA LEU 60 HA LEU 60 5.953 6.097 -19.497 414 HB2 LEU 60 2HB LEU 60 5.127 4.183 -17.319 415 HB3 LEU 60 3HB LEU 60 6.115 5.626 -17.104 416 HG LEU 60 HG LEU 60 3.558 6.229 -18.341 417 HD11 LEU 60 1HD1 LEU 60 2.130 5.752 -16.484 418 HD12 LEU 60 2HD1 LEU 60 3.477 5.106 -15.547 419 HD13 LEU 60 3HD1 LEU 60 2.908 4.248 -16.978 420 HD21 LEU 60 3HD2 LEU 60 4.557 8.084 -17.491 421 HD22 LEU 60 1HD2 LEU 60 5.305 7.208 -16.156 422 HD23 LEU 60 2HD2 LEU 60 3.595 7.633 -16.083 423 H LYS 61 H LYS 61 8.141 5.875 -18.808 424 HA LYS 61 HA LYS 61 9.377 3.320 -18.528 425 HB2 LYS 61 2HB LYS 61 9.090 4.392 -21.189 426 HB3 LYS 61 3HB LYS 61 10.793 4.299 -20.757 427 HG2 LYS 61 2HG LYS 61 10.818 2.099 -21.024 428 HG3 LYS 61 3HG LYS 61 9.398 1.892 -19.996 429 HD2 LYS 61 2HD LYS 61 7.938 1.961 -21.767 430 HD3 LYS 61 3HD LYS 61 9.021 2.938 -22.760 431 HE2 LYS 61 2HE LYS 61 9.124 0.876 -23.801 432 HE3 LYS 61 3HE LYS 61 10.531 0.830 -22.739 433 HZ1 LYS 61 3HZ LYS 61 7.957 -0.223 -21.781 434 HZ2 LYS 61 1HZ LYS 61 9.528 -0.654 -21.325 435 HZ3 LYS 61 2HZ LYS 61 8.909 -1.168 -22.812 436 H ASP 62 H ASP 62 10.562 6.295 -20.071 437 HA ASP 62 HA ASP 62 12.794 6.431 -18.277 438 HB2 ASP 62 2HB ASP 62 13.543 8.259 -19.576 439 HB3 ASP 62 3HB ASP 62 12.754 7.176 -20.719 440 H THR 63 H THR 63 9.615 7.286 -17.941 441 HA THR 63 HA THR 63 9.676 9.800 -16.725 442 HB THR 63 HB THR 63 7.782 7.841 -15.574 443 HG1 THR 63 HG1 THR 63 6.632 8.165 -17.769 444 HG21 THR 63 3HG2 THR 63 7.857 10.493 -15.567 445 HG22 THR 63 1HG2 THR 63 6.331 9.611 -15.593 446 HG23 THR 63 2HG2 THR 63 6.990 10.277 -17.087 447 H GLU 64 H GLU 64 10.828 6.772 -15.612 448 HA GLU 64 HA GLU 64 11.868 6.122 -13.695 449 HB2 GLU 64 2HB GLU 64 12.155 9.051 -13.712 450 HB3 GLU 64 3HB GLU 64 12.305 8.313 -12.123 451 HG2 GLU 64 2HG GLU 64 13.883 6.674 -13.570 452 HG3 GLU 64 3HG GLU 64 14.099 8.189 -14.445 453 H THR 65 H THR 65 10.298 8.914 -12.215 454 HA THR 65 HA THR 65 8.837 7.080 -10.455 455 HB THR 65 HB THR 65 8.619 8.875 -8.898 456 HG1 THR 65 HG1 THR 65 8.367 10.800 -9.733 457 HG21 THR 65 3HG2 THR 65 11.384 9.320 -9.970 458 HG22 THR 65 1HG2 THR 65 10.924 7.763 -9.283 459 HG23 THR 65 2HG2 THR 65 10.844 9.221 -8.294 460 H LEU 66 H LEU 66 6.626 7.680 -9.817 461 HA LEU 66 HA LEU 66 5.165 8.919 -12.057 462 HB2 LEU 66 2HB LEU 66 4.963 6.341 -11.194 463 HB3 LEU 66 3HB LEU 66 3.666 7.122 -10.291 464 HG LEU 66 HG LEU 66 3.711 7.744 -13.162 465 HD11 LEU 66 1HD1 LEU 66 2.447 5.405 -13.383 466 HD12 LEU 66 2HD1 LEU 66 3.653 4.955 -12.178 467 HD13 LEU 66 3HD1 LEU 66 4.164 5.601 -13.737 468 HD21 LEU 66 3HD2 LEU 66 1.300 7.313 -12.887 469 HD22 LEU 66 1HD2 LEU 66 1.916 8.484 -11.721 470 HD23 LEU 66 2HD2 LEU 66 1.596 6.823 -11.219 471 H GLU 67 H GLU 67 5.830 8.998 -8.712 472 HA GLU 67 HA GLU 67 3.503 10.126 -7.663 473 HB2 GLU 67 2HB GLU 67 5.031 11.115 -5.930 474 HB3 GLU 67 3HB GLU 67 5.202 9.381 -6.164 475 HG2 GLU 67 2HG GLU 67 7.349 9.599 -6.639 476 HG3 GLU 67 3HG GLU 67 6.999 10.777 -7.903 477 H SER 68 H SER 68 6.071 11.531 -9.559 478 HA SER 68 HA SER 68 5.567 14.248 -9.013 479 HB2 SER 68 2HB SER 68 7.280 12.746 -10.726 480 HB3 SER 68 3HB SER 68 6.467 13.965 -11.707 481 HG SER 68 HG SER 68 8.178 14.301 -9.503 482 H LEU 69 H LEU 69 3.872 11.930 -10.894 483 HA LEU 69 HA LEU 69 2.378 14.005 -12.324 484 HB2 LEU 69 2HB LEU 69 1.915 11.074 -12.665 485 HB3 LEU 69 3HB LEU 69 1.685 12.382 -13.823 486 HG LEU 69 HG LEU 69 4.327 11.221 -12.942 487 HD11 LEU 69 1HD1 LEU 69 3.525 11.167 -15.763 488 HD12 LEU 69 2HD1 LEU 69 2.563 10.144 -14.697 489 HD13 LEU 69 3HD1 LEU 69 4.312 9.933 -14.778 490 HD21 LEU 69 3HD2 LEU 69 3.749 13.359 -14.989 491 HD22 LEU 69 1HD2 LEU 69 5.330 12.685 -14.591 492 HD23 LEU 69 2HD2 LEU 69 4.450 13.637 -13.394 493 H GLY 70 H GLY 70 2.188 12.055 -9.563 494 HA2 GLY 70 2HA GLY 70 0.452 12.469 -7.954 495 HA3 GLY 70 3HA GLY 70 -0.663 12.738 -9.286 496 H VAL 71 H VAL 71 1.500 10.144 -8.134 497 HA VAL 71 HA VAL 71 -0.439 8.155 -9.018 498 HB VAL 71 HB VAL 71 2.003 7.855 -9.462 499 HG11 VAL 71 1HG1 VAL 71 2.530 6.868 -6.754 500 HG12 VAL 71 2HG1 VAL 71 3.561 7.793 -7.847 501 HG13 VAL 71 3HG1 VAL 71 2.345 8.617 -6.871 502 HG21 VAL 71 3HG2 VAL 71 1.784 5.602 -9.424 503 HG22 VAL 71 1HG2 VAL 71 1.295 5.569 -7.730 504 HG23 VAL 71 2HG2 VAL 71 0.125 6.001 -8.978 505 H ALA 72 H ALA 72 -1.547 6.781 -7.685 506 HA ALA 72 HA ALA 72 -1.319 7.285 -4.789 507 HB1 ALA 72 1HB ALA 72 -3.526 7.795 -6.436 508 HB2 ALA 72 2HB ALA 72 -3.936 6.349 -5.511 509 HB3 ALA 72 3HB ALA 72 -3.468 7.829 -4.674 510 H ASP 73 H ASP 73 -1.598 5.529 -3.403 511 HA ASP 73 HA ASP 73 -0.559 3.091 -4.171 512 HB2 ASP 73 2HB ASP 73 -1.509 2.202 -2.047 513 HB3 ASP 73 3HB ASP 73 -0.657 3.730 -1.841 514 H GLY 74 H GLY 74 -1.415 1.075 -4.679 515 HA2 GLY 74 2HA GLY 74 -3.091 -0.466 -5.225 516 HA3 GLY 74 3HA GLY 74 -4.291 0.804 -5.034 517 H ASP 75 H ASP 75 -1.427 1.201 -6.998 518 HA ASP 75 HA ASP 75 -2.941 1.967 -9.270 519 HB2 ASP 75 2HB ASP 75 -0.012 1.230 -9.066 520 HB3 ASP 75 3HB ASP 75 -0.768 2.051 -10.430 521 H LYS 76 H LYS 76 -2.917 0.953 -11.376 522 HA LYS 76 HA LYS 76 -2.326 -1.896 -11.463 523 HB2 LYS 76 2HB LYS 76 -5.079 -0.893 -12.188 524 HB3 LYS 76 3HB LYS 76 -4.528 -2.562 -12.141 525 HG2 LYS 76 2HG LYS 76 -4.333 -2.479 -9.742 526 HG3 LYS 76 3HG LYS 76 -4.737 -0.761 -9.737 527 HD2 LYS 76 2HD LYS 76 -6.572 -2.912 -10.782 528 HD3 LYS 76 3HD LYS 76 -6.629 -2.292 -9.131 529 HE2 LYS 76 2HE LYS 76 -6.868 0.017 -10.198 530 HE3 LYS 76 3HE LYS 76 -7.206 -0.844 -11.699 531 HZ1 LYS 76 3HZ LYS 76 -8.897 -0.412 -9.431 532 HZ2 LYS 76 1HZ LYS 76 -8.829 -2.044 -9.873 533 HZ3 LYS 76 2HZ LYS 76 -9.304 -0.880 -11.004 534 H PHE 77 H PHE 77 -1.501 -2.448 -13.377 535 HA PHE 77 HA PHE 77 -2.027 -0.683 -15.678 536 HB2 PHE 77 2HB PHE 77 0.270 -1.071 -16.434 537 HB3 PHE 77 3HB PHE 77 0.256 -0.354 -14.827 538 HD1 PHE 77 HD2 PHE 77 0.515 -1.938 -12.832 539 HD2 PHE 77 HD1 PHE 77 1.445 -3.029 -16.840 540 HE1 PHE 77 HE2 PHE 77 1.928 -3.772 -12.001 541 HE2 PHE 77 HE1 PHE 77 2.859 -4.865 -16.015 542 HZ PHE 77 HZ PHE 77 3.104 -5.238 -13.593 543 H VAL 78 H VAL 78 -2.068 -1.664 -17.741 544 HA VAL 78 HA VAL 78 -2.793 -4.503 -17.645 545 HB VAL 78 HB VAL 78 -3.247 -2.528 -19.885 546 HG11 VAL 78 1HG1 VAL 78 -4.098 -5.364 -19.407 547 HG12 VAL 78 2HG1 VAL 78 -5.012 -4.296 -20.475 548 HG13 VAL 78 3HG1 VAL 78 -3.322 -4.663 -20.827 549 HG21 VAL 78 3HG2 VAL 78 -5.661 -2.710 -19.054 550 HG22 VAL 78 1HG2 VAL 78 -4.964 -3.336 -17.559 551 HG23 VAL 78 2HG2 VAL 78 -4.549 -1.714 -18.114 552 H LEU 79 H LEU 79 -1.553 -6.027 -18.529 553 HA LEU 79 HA LEU 79 0.773 -5.173 -20.107 554 HB2 LEU 79 2HB LEU 79 1.605 -6.362 -18.320 555 HB3 LEU 79 3HB LEU 79 0.231 -7.465 -18.281 556 HG LEU 79 HG LEU 79 2.047 -7.620 -20.625 557 HD11 LEU 79 1HD1 LEU 79 2.829 -8.255 -17.822 558 HD12 LEU 79 2HD1 LEU 79 3.798 -7.615 -19.148 559 HD13 LEU 79 3HD1 LEU 79 3.358 -9.322 -19.124 560 HD21 LEU 79 3HD2 LEU 79 0.310 -9.445 -19.018 561 HD22 LEU 79 1HD2 LEU 79 1.602 -10.109 -20.018 562 HD23 LEU 79 2HD2 LEU 79 0.321 -9.147 -20.757 563 H ILE 80 H ILE 80 1.015 -5.779 -22.172 564 HA ILE 80 HA ILE 80 -1.017 -7.583 -23.303 565 HB ILE 80 HB ILE 80 0.666 -5.564 -24.787 566 HG12 ILE 80 2HG1 ILE 80 -2.233 -5.346 -23.948 567 HG13 ILE 80 3HG1 ILE 80 -0.900 -4.517 -23.152 568 HG21 ILE 80 1HG2 ILE 80 -1.597 -6.068 -26.254 569 HG22 ILE 80 2HG2 ILE 80 -0.008 -6.776 -26.538 570 HG23 ILE 80 3HG2 ILE 80 -1.205 -7.651 -25.584 571 HD11 ILE 80 3HD1 ILE 80 -2.387 -3.761 -25.478 572 HD12 ILE 80 1HD1 ILE 80 -1.204 -2.837 -24.553 573 HD13 ILE 80 2HD1 ILE 80 -0.671 -3.888 -25.865 574 H THR 81 H THR 81 -0.419 -9.216 -24.729 575 HA THR 81 HA THR 81 2.456 -9.872 -24.743 576 HB THR 81 HB THR 81 1.397 -11.510 -23.390 577 HG1 THR 81 HG1 THR 81 2.817 -12.398 -24.954 578 HG21 THR 81 3HG2 THR 81 -0.778 -11.260 -25.371 579 HG22 THR 81 1HG2 THR 81 -0.855 -11.546 -23.633 580 HG23 THR 81 2HG2 THR 81 -0.499 -12.879 -24.732 581 H ARG 82 H ARG 82 3.406 -10.187 -26.661 582 HA ARG 82 HA ARG 82 1.674 -10.329 -29.040 583 HB2 ARG 82 2HB ARG 82 3.927 -8.633 -28.384 584 HB3 ARG 82 3HB ARG 82 4.226 -9.530 -29.867 585 HG2 ARG 82 2HG ARG 82 1.868 -8.721 -30.551 586 HG3 ARG 82 3HG ARG 82 2.092 -7.526 -29.272 587 HD2 ARG 82 2HD ARG 82 3.763 -6.440 -30.390 588 HD3 ARG 82 3HD ARG 82 4.293 -7.896 -31.231 589 HE ARG 82 HE ARG 82 1.733 -7.166 -32.144 590 HH11 ARG 82 1HH1 ARG 82 5.051 -6.122 -32.291 591 HH12 ARG 82 2HH1 ARG 82 4.877 -5.352 -33.833 592 HH21 ARG 82 1HH2 ARG 82 1.492 -6.157 -34.175 593 HH22 ARG 82 2HH2 ARG 82 2.852 -5.372 -34.904 594 H THR 83 H THR 83 2.020 -11.897 -30.534 595 HA THR 83 HA THR 83 2.711 -13.889 -31.394 596 HB THR 83 HB THR 83 5.470 -13.386 -30.323 597 HG1 THR 83 HG1 THR 83 5.591 -11.588 -31.418 598 HG21 THR 83 3HG2 THR 83 4.217 -14.956 -32.460 599 HG22 THR 83 1HG2 THR 83 5.744 -15.208 -31.615 600 HG23 THR 83 2HG2 THR 83 5.657 -14.071 -32.961 601 H VAL 84 H VAL 84 1.537 -15.212 -29.992 602 HA VAL 84 HA VAL 84 3.058 -16.343 -27.735 603 HB VAL 84 HB VAL 84 0.064 -16.418 -28.120 604 HG11 VAL 84 1HG1 VAL 84 0.926 -16.718 -25.420 605 HG12 VAL 84 2HG1 VAL 84 0.044 -17.862 -26.434 606 HG13 VAL 84 3HG1 VAL 84 1.808 -17.864 -26.429 607 HG21 VAL 84 3HG2 VAL 84 0.221 -14.795 -26.091 608 HG22 VAL 84 1HG2 VAL 84 1.839 -14.467 -26.714 609 HG23 VAL 84 2HG2 VAL 84 0.426 -14.168 -27.727 610 H GLY 85 H GLY 85 4.001 -18.186 -28.342 611 HA2 GLY 85 2HA GLY 85 2.322 -20.216 -29.647 612 HA3 GLY 85 3HA GLY 85 3.884 -19.823 -30.349 Start of MODEL 14 1 H1 MET 9 H MET 9 1.919 1.076 -3.181 2 HA MET 9 HA MET 9 3.024 -0.059 -1.250 3 HB2 MET 9 2HB MET 9 0.334 0.569 -0.192 4 HB3 MET 9 3HB MET 9 0.986 -1.000 0.258 5 HG2 MET 9 2HG MET 9 2.670 1.438 0.577 6 HG3 MET 9 3HG MET 9 1.407 1.086 1.754 7 HE1 MET 9 3HE MET 9 4.375 1.547 1.911 8 HE2 MET 9 1HE MET 9 4.995 0.393 3.092 9 HE3 MET 9 2HE MET 9 5.395 0.207 1.385 10 H LYS 10 H LYS 10 -0.096 -0.621 -2.801 11 HA LYS 10 HA LYS 10 0.827 -3.328 -3.497 12 HB2 LYS 10 2HB LYS 10 -1.599 -2.523 -2.077 13 HB3 LYS 10 3HB LYS 10 -1.927 -3.531 -3.480 14 HG2 LYS 10 2HG LYS 10 0.112 -4.896 -2.332 15 HG3 LYS 10 3HG LYS 10 -0.683 -4.210 -0.913 16 HD2 LYS 10 2HD LYS 10 -2.465 -5.396 -2.943 17 HD3 LYS 10 3HD LYS 10 -1.424 -6.528 -2.076 18 HE2 LYS 10 2HE LYS 10 -2.842 -6.467 -0.369 19 HE3 LYS 10 3HE LYS 10 -2.467 -4.758 -0.152 20 HZ1 LYS 10 3HZ LYS 10 -4.690 -4.614 -0.488 21 HZ2 LYS 10 1HZ LYS 10 -4.768 -6.007 -1.444 22 HZ3 LYS 10 2HZ LYS 10 -4.205 -4.557 -2.108 23 H ILE 11 H ILE 11 0.587 -3.909 -5.588 24 HA ILE 11 HA ILE 11 -0.951 -2.105 -7.338 25 HB ILE 11 HB ILE 11 1.615 -3.464 -8.151 26 HG12 ILE 11 2HG1 ILE 11 2.140 -1.860 -6.400 27 HG13 ILE 11 3HG1 ILE 11 2.664 -1.226 -7.956 28 HG21 ILE 11 1HG2 ILE 11 0.150 -2.946 -9.995 29 HG22 ILE 11 2HG2 ILE 11 -0.049 -1.293 -9.416 30 HG23 ILE 11 3HG2 ILE 11 1.520 -1.836 -10.010 31 HD11 ILE 11 3HD1 ILE 11 0.036 -0.313 -7.560 32 HD12 ILE 11 1HD1 ILE 11 0.900 -0.071 -6.041 33 HD13 ILE 11 2HD1 ILE 11 1.532 0.621 -7.536 34 H LYS 12 H LYS 12 -2.079 -3.036 -9.018 35 HA LYS 12 HA LYS 12 -2.156 -5.983 -9.032 36 HB2 LYS 12 2HB LYS 12 -4.203 -4.381 -8.283 37 HB3 LYS 12 3HB LYS 12 -4.521 -4.497 -10.009 38 HG2 LYS 12 2HG LYS 12 -4.191 -7.064 -9.571 39 HG3 LYS 12 3HG LYS 12 -4.604 -6.607 -7.917 40 HD2 LYS 12 2HD LYS 12 -6.478 -5.279 -9.464 41 HD3 LYS 12 3HD LYS 12 -6.303 -6.845 -10.261 42 HE2 LYS 12 2HE LYS 12 -6.620 -7.915 -8.016 43 HE3 LYS 12 3HE LYS 12 -7.010 -6.318 -7.379 44 HZ1 LYS 12 3HZ LYS 12 -8.584 -8.071 -9.083 45 HZ2 LYS 12 1HZ LYS 12 -8.665 -6.420 -9.445 46 HZ3 LYS 12 2HZ LYS 12 -9.087 -6.969 -7.902 47 H ILE 13 H ILE 13 -1.545 -6.900 -10.870 48 HA ILE 13 HA ILE 13 -1.654 -5.297 -13.341 49 HB ILE 13 HB ILE 13 0.631 -5.787 -12.781 50 HG12 ILE 13 2HG1 ILE 13 -0.311 -7.656 -14.967 51 HG13 ILE 13 3HG1 ILE 13 -0.012 -5.933 -15.161 52 HG21 ILE 13 1HG2 ILE 13 0.774 -8.610 -13.014 53 HG22 ILE 13 2HG2 ILE 13 1.187 -7.599 -11.631 54 HG23 ILE 13 3HG2 ILE 13 -0.453 -8.223 -11.808 55 HD11 ILE 13 3HD1 ILE 13 2.367 -6.614 -14.237 56 HD12 ILE 13 1HD1 ILE 13 1.901 -8.177 -14.908 57 HD13 ILE 13 2HD1 ILE 13 1.950 -6.751 -15.946 58 H VAL 14 H VAL 14 -3.227 -5.912 -14.659 59 HA VAL 14 HA VAL 14 -4.144 -8.698 -14.603 60 HB VAL 14 HB VAL 14 -5.931 -7.137 -14.276 61 HG11 VAL 14 1HG1 VAL 14 -5.795 -5.079 -15.097 62 HG12 VAL 14 2HG1 VAL 14 -4.459 -5.551 -16.150 63 HG13 VAL 14 3HG1 VAL 14 -6.125 -5.728 -16.703 64 HG21 VAL 14 3HG2 VAL 14 -6.218 -7.904 -17.159 65 HG22 VAL 14 1HG2 VAL 14 -6.171 -9.129 -15.891 66 HG23 VAL 14 2HG2 VAL 14 -7.436 -7.899 -15.884 67 HA PRO 15 HA PRO 15 -1.801 -9.104 -18.420 68 HB2 PRO 15 2HB PRO 15 -2.106 -11.796 -18.588 69 HB3 PRO 15 3HB PRO 15 -0.919 -11.028 -17.528 70 HG2 PRO 15 2HG PRO 15 -3.627 -12.117 -16.864 71 HG3 PRO 15 3HG PRO 15 -2.105 -12.281 -15.968 72 HD2 PRO 15 2HD PRO 15 -4.022 -10.499 -15.271 73 HD3 PRO 15 3HD PRO 15 -2.292 -10.188 -15.021 74 H ALA 16 H ALA 16 -2.519 -8.944 -20.456 75 HA ALA 16 HA ALA 16 -5.332 -9.524 -20.990 76 HB1 ALA 16 1HB ALA 16 -5.123 -8.130 -22.914 77 HB2 ALA 16 2HB ALA 16 -4.338 -7.304 -21.567 78 HB3 ALA 16 3HB ALA 16 -3.363 -8.123 -22.787 79 H VAL 17 H VAL 17 -4.254 -11.878 -20.738 80 HA VAL 17 HA VAL 17 -4.559 -13.115 -23.249 81 HB VAL 17 HB VAL 17 -2.271 -12.167 -23.583 82 HG11 VAL 17 1HG1 VAL 17 -0.833 -14.114 -22.054 83 HG12 VAL 17 2HG1 VAL 17 -0.697 -12.355 -22.027 84 HG13 VAL 17 3HG1 VAL 17 -1.865 -13.167 -20.984 85 HG21 VAL 17 3HG2 VAL 17 -2.159 -15.168 -23.486 86 HG22 VAL 17 1HG2 VAL 17 -3.181 -14.306 -24.637 87 HG23 VAL 17 2HG2 VAL 17 -1.433 -14.075 -24.665 88 H GLY 18 H GLY 18 -4.508 -15.415 -23.127 89 HA2 GLY 18 2HA GLY 18 -4.982 -17.391 -22.055 90 HA3 GLY 18 3HA GLY 18 -3.623 -16.972 -21.023 91 H GLY 19 H GLY 19 -7.107 -16.477 -21.453 92 HA2 GLY 19 2HA GLY 19 -8.775 -16.509 -19.850 93 HA3 GLY 19 3HA GLY 19 -7.550 -16.844 -18.636 94 H GLY 20 H GLY 20 -5.956 -14.800 -18.473 95 HA2 GLY 20 2HA GLY 20 -5.756 -12.475 -18.192 96 HA3 GLY 20 3HA GLY 20 -7.466 -12.306 -18.564 97 H SER 21 H SER 21 -5.258 -13.541 -16.071 98 HA SER 21 HA SER 21 -7.294 -12.838 -14.058 99 HB2 SER 21 2HB SER 21 -6.066 -14.495 -12.586 100 HB3 SER 21 3HB SER 21 -6.916 -15.197 -13.963 101 HG SER 21 HG SER 21 -4.146 -14.573 -13.888 102 HA PRO 22 HA PRO 22 -4.415 -9.706 -12.798 103 HB2 PRO 22 2HB PRO 22 -5.757 -8.933 -10.568 104 HB3 PRO 22 3HB PRO 22 -6.263 -8.479 -12.200 105 HG2 PRO 22 2HG PRO 22 -7.302 -10.661 -10.433 106 HG3 PRO 22 3HG PRO 22 -8.202 -9.520 -11.449 107 HD2 PRO 22 2HD PRO 22 -7.709 -12.072 -12.209 108 HD3 PRO 22 3HD PRO 22 -7.819 -10.734 -13.370 109 H LEU 23 H LEU 23 -2.757 -9.501 -11.333 110 HA LEU 23 HA LEU 23 -2.630 -11.487 -9.164 111 HB2 LEU 23 2HB LEU 23 -1.050 -11.460 -11.456 112 HB3 LEU 23 3HB LEU 23 -0.027 -10.765 -10.200 113 HG LEU 23 HG LEU 23 -1.431 -13.283 -9.526 114 HD11 LEU 23 1HD1 LEU 23 1.085 -13.606 -11.045 115 HD12 LEU 23 2HD1 LEU 23 -0.377 -13.286 -11.977 116 HD13 LEU 23 3HD1 LEU 23 -0.305 -14.683 -10.903 117 HD21 LEU 23 3HD2 LEU 23 1.442 -13.055 -9.114 118 HD22 LEU 23 1HD2 LEU 23 0.154 -13.393 -7.958 119 HD23 LEU 23 2HD2 LEU 23 0.534 -11.726 -8.392 120 H GLU 24 H GLU 24 -1.712 -10.824 -7.252 121 HA GLU 24 HA GLU 24 -1.359 -7.934 -6.976 122 HB2 GLU 24 2HB GLU 24 -1.728 -10.116 -4.919 123 HB3 GLU 24 3HB GLU 24 -1.477 -8.422 -4.524 124 HG2 GLU 24 2HG GLU 24 -3.615 -7.946 -4.845 125 HG3 GLU 24 3HG GLU 24 -3.624 -8.736 -6.420 126 H LEU 25 H LEU 25 0.562 -7.014 -6.644 127 HA LEU 25 HA LEU 25 2.773 -8.605 -5.587 128 HB2 LEU 25 2HB LEU 25 2.493 -7.895 -8.326 129 HB3 LEU 25 3HB LEU 25 3.827 -6.963 -7.649 130 HG LEU 25 HG LEU 25 4.725 -8.946 -8.624 131 HD11 LEU 25 1HD1 LEU 25 5.426 -8.153 -6.250 132 HD12 LEU 25 2HD1 LEU 25 6.020 -9.692 -6.870 133 HD13 LEU 25 3HD1 LEU 25 4.679 -9.662 -5.726 134 HD21 LEU 25 3HD2 LEU 25 2.446 -10.157 -8.384 135 HD22 LEU 25 1HD2 LEU 25 3.089 -10.694 -6.831 136 HD23 LEU 25 2HD2 LEU 25 3.935 -11.101 -8.324 137 H GLU 26 H GLU 26 4.465 -7.367 -4.667 138 HA GLU 26 HA GLU 26 3.620 -4.660 -3.920 139 HB2 GLU 26 2HB GLU 26 4.889 -6.842 -2.519 140 HB3 GLU 26 3HB GLU 26 5.872 -5.389 -2.408 141 HG2 GLU 26 2HG GLU 26 3.875 -4.161 -1.603 142 HG3 GLU 26 3HG GLU 26 2.992 -5.687 -1.594 143 H VAL 27 H VAL 27 4.418 -3.161 -5.250 144 HA VAL 27 HA VAL 27 7.312 -3.100 -5.681 145 HB VAL 27 HB VAL 27 5.470 -2.477 -7.971 146 HG11 VAL 27 1HG1 VAL 27 7.648 -1.580 -8.242 147 HG12 VAL 27 2HG1 VAL 27 8.407 -3.078 -7.697 148 HG13 VAL 27 3HG1 VAL 27 7.572 -3.025 -9.251 149 HG21 VAL 27 3HG2 VAL 27 6.597 -5.147 -7.174 150 HG22 VAL 27 1HG2 VAL 27 4.931 -4.731 -7.575 151 HG23 VAL 27 2HG2 VAL 27 6.159 -4.771 -8.840 152 H ALA 28 H ALA 28 8.088 -0.980 -6.391 153 HA ALA 28 HA ALA 28 6.325 1.180 -5.435 154 HB1 ALA 28 1HB ALA 28 9.191 0.608 -5.013 155 HB2 ALA 28 2HB ALA 28 8.754 2.300 -5.254 156 HB3 ALA 28 3HB ALA 28 8.015 1.377 -3.946 157 HA PRO 29 HA PRO 29 6.544 2.436 -9.733 158 HB2 PRO 29 2HB PRO 29 4.760 4.466 -9.481 159 HB3 PRO 29 3HB PRO 29 4.275 2.771 -9.609 160 HG2 PRO 29 2HG PRO 29 4.530 4.490 -7.171 161 HG3 PRO 29 3HG PRO 29 3.254 3.335 -7.597 162 HD2 PRO 29 2HD PRO 29 5.242 2.734 -5.859 163 HD3 PRO 29 3HD PRO 29 4.498 1.517 -6.916 164 H ASN 30 H ASN 30 7.417 4.125 -6.894 165 HA ASN 30 HA ASN 30 8.269 6.532 -8.270 166 HB2 ASN 30 2HB ASN 30 7.334 6.573 -5.944 167 HB3 ASN 30 3HB ASN 30 8.776 5.721 -5.400 168 HD21 ASN 30 1HD2 ASN 30 7.747 8.629 -7.130 169 HD22 ASN 30 2HD2 ASN 30 9.022 9.639 -6.546 170 H ALA 31 H ALA 31 9.438 3.660 -8.557 171 HA ALA 31 HA ALA 31 12.254 4.347 -8.058 172 HB1 ALA 31 1HB ALA 31 12.224 2.313 -7.125 173 HB2 ALA 31 2HB ALA 31 10.730 1.855 -7.942 174 HB3 ALA 31 3HB ALA 31 12.274 1.715 -8.783 175 H THR 32 H THR 32 10.785 2.133 -10.407 176 HA THR 32 HA THR 32 11.565 3.774 -12.649 177 HB THR 32 HB THR 32 12.761 1.190 -13.112 178 HG1 THR 32 HG1 THR 32 14.486 1.434 -11.601 179 HG21 THR 32 3HG2 THR 32 14.442 2.441 -14.080 180 HG22 THR 32 1HG2 THR 32 14.297 3.745 -12.902 181 HG23 THR 32 2HG2 THR 32 13.087 3.566 -14.173 182 H VAL 33 H VAL 33 10.526 3.212 -14.535 183 HA VAL 33 HA VAL 33 8.192 1.617 -14.298 184 HB VAL 33 HB VAL 33 9.498 2.739 -16.781 185 HG11 VAL 33 1HG1 VAL 33 8.024 1.479 -17.881 186 HG12 VAL 33 2HG1 VAL 33 7.184 1.029 -16.395 187 HG13 VAL 33 3HG1 VAL 33 6.776 2.534 -17.220 188 HG21 VAL 33 3HG2 VAL 33 8.747 4.329 -14.919 189 HG22 VAL 33 1HG2 VAL 33 8.139 4.632 -16.546 190 HG23 VAL 33 2HG2 VAL 33 7.105 3.852 -15.349 191 H GLY 34 H GLY 34 11.248 1.157 -16.065 192 HA2 GLY 34 2HA GLY 34 10.567 -1.355 -17.171 193 HA3 GLY 34 3HA GLY 34 12.196 -0.720 -16.989 194 H ALA 35 H ALA 35 11.987 -0.433 -14.097 195 HA ALA 35 HA ALA 35 12.914 -2.996 -13.346 196 HB1 ALA 35 1HB ALA 35 13.707 -0.972 -12.256 197 HB2 ALA 35 2HB ALA 35 12.094 -0.671 -11.609 198 HB3 ALA 35 3HB ALA 35 13.009 -2.081 -11.074 199 H VAL 36 H VAL 36 9.879 -1.273 -12.696 200 HA VAL 36 HA VAL 36 8.737 -3.310 -11.089 201 HB VAL 36 HB VAL 36 7.360 -1.142 -12.682 202 HG11 VAL 36 1HG1 VAL 36 6.370 -3.259 -10.887 203 HG12 VAL 36 2HG1 VAL 36 5.722 -1.643 -10.601 204 HG13 VAL 36 3HG1 VAL 36 5.550 -2.395 -12.187 205 HG21 VAL 36 3HG2 VAL 36 7.299 -0.593 -9.931 206 HG22 VAL 36 1HG2 VAL 36 8.957 -1.067 -10.299 207 HG23 VAL 36 2HG2 VAL 36 8.204 0.262 -11.179 208 H ARG 37 H ARG 37 8.381 -2.476 -14.524 209 HA ARG 37 HA ARG 37 6.486 -4.439 -15.169 210 HB2 ARG 37 2HB ARG 37 6.934 -2.603 -16.676 211 HB3 ARG 37 3HB ARG 37 8.601 -3.124 -16.877 212 HG2 ARG 37 2HG ARG 37 7.792 -5.199 -17.939 213 HG3 ARG 37 3HG ARG 37 6.141 -4.588 -17.806 214 HD2 ARG 37 2HD ARG 37 7.074 -4.203 -20.037 215 HD3 ARG 37 3HD ARG 37 6.711 -2.688 -19.211 216 HE ARG 37 HE ARG 37 8.923 -2.159 -19.336 217 HH11 ARG 37 1HH1 ARG 37 8.585 -5.605 -19.696 218 HH12 ARG 37 2HH1 ARG 37 10.265 -5.866 -20.033 219 HH21 ARG 37 1HH2 ARG 37 11.137 -2.490 -19.779 220 HH22 ARG 37 2HH2 ARG 37 11.715 -4.093 -20.079 221 H THR 38 H THR 38 10.016 -4.525 -15.133 222 HA THR 38 HA THR 38 10.250 -7.124 -16.263 223 HB THR 38 HB THR 38 12.219 -5.588 -14.556 224 HG1 THR 38 HG1 THR 38 13.144 -5.152 -16.662 225 HG21 THR 38 3HG2 THR 38 13.842 -7.120 -15.868 226 HG22 THR 38 1HG2 THR 38 12.429 -8.146 -16.108 227 HG23 THR 38 2HG2 THR 38 12.990 -7.786 -14.475 228 H LYS 39 H LYS 39 10.064 -5.890 -12.966 229 HA LYS 39 HA LYS 39 10.700 -8.283 -11.628 230 HB2 LYS 39 2HB LYS 39 10.463 -5.851 -10.728 231 HB3 LYS 39 3HB LYS 39 8.771 -6.276 -10.508 232 HG2 LYS 39 2HG LYS 39 9.245 -7.286 -8.601 233 HG3 LYS 39 3HG LYS 39 10.384 -8.357 -9.421 234 HD2 LYS 39 2HD LYS 39 11.185 -5.561 -8.716 235 HD3 LYS 39 3HD LYS 39 11.222 -6.831 -7.491 236 HE2 LYS 39 2HE LYS 39 12.625 -8.179 -9.079 237 HE3 LYS 39 3HE LYS 39 12.724 -6.746 -10.102 238 HZ1 LYS 39 3HZ LYS 39 14.567 -7.225 -8.365 239 HZ2 LYS 39 1HZ LYS 39 13.472 -6.550 -7.266 240 HZ3 LYS 39 2HZ LYS 39 14.017 -5.640 -8.583 241 H VAL 40 H VAL 40 7.583 -6.903 -12.615 242 HA VAL 40 HA VAL 40 6.007 -9.005 -11.537 243 HB VAL 40 HB VAL 40 5.250 -7.169 -13.810 244 HG11 VAL 40 1HG1 VAL 40 2.978 -7.522 -12.531 245 HG12 VAL 40 2HG1 VAL 40 3.547 -8.700 -13.716 246 HG13 VAL 40 3HG1 VAL 40 3.768 -9.003 -11.992 247 HG21 VAL 40 3HG2 VAL 40 5.874 -6.530 -11.088 248 HG22 VAL 40 1HG2 VAL 40 5.372 -5.460 -12.397 249 HG23 VAL 40 2HG2 VAL 40 4.159 -6.245 -11.386 250 H CYS 41 H CYS 41 7.193 -8.308 -14.812 251 HA CYS 41 HA CYS 41 5.982 -10.421 -16.151 252 HB2 CYS 41 2HB CYS 41 8.292 -8.652 -16.628 253 HB3 CYS 41 3HB CYS 41 8.347 -10.188 -17.484 254 HG CYS 41 HG CYS 41 6.359 -9.758 -19.158 255 H ALA 42 H ALA 42 9.120 -10.313 -14.499 256 HA ALA 42 HA ALA 42 9.905 -12.947 -15.126 257 HB1 ALA 42 1HB ALA 42 11.732 -11.878 -14.367 258 HB2 ALA 42 2HB ALA 42 10.803 -10.833 -13.292 259 HB3 ALA 42 3HB ALA 42 11.199 -12.478 -12.797 260 H MET 43 H MET 43 8.104 -11.588 -12.403 261 HA MET 43 HA MET 43 8.021 -13.866 -10.786 262 HB2 MET 43 2HB MET 43 6.835 -11.284 -10.809 263 HB3 MET 43 3HB MET 43 5.545 -12.455 -10.569 264 HG2 MET 43 2HG MET 43 6.352 -11.754 -8.436 265 HG3 MET 43 3HG MET 43 6.836 -13.428 -8.699 266 HE1 MET 43 3HE MET 43 9.601 -11.813 -6.503 267 HE2 MET 43 1HE MET 43 7.931 -12.380 -6.495 268 HE3 MET 43 2HE MET 43 9.232 -13.479 -6.952 269 H LYS 44 H LYS 44 6.205 -13.002 -13.632 270 HA LYS 44 HA LYS 44 4.450 -15.326 -13.287 271 HB2 LYS 44 2HB LYS 44 4.274 -13.256 -15.471 272 HB3 LYS 44 3HB LYS 44 3.026 -14.372 -14.933 273 HG2 LYS 44 2HG LYS 44 3.444 -13.033 -12.647 274 HG3 LYS 44 3HG LYS 44 3.861 -11.777 -13.814 275 HD2 LYS 44 2HD LYS 44 1.284 -13.348 -13.754 276 HD3 LYS 44 3HD LYS 44 1.492 -11.683 -13.205 277 HE2 LYS 44 2HE LYS 44 1.113 -10.964 -15.270 278 HE3 LYS 44 3HE LYS 44 2.529 -11.851 -15.834 279 HZ1 LYS 44 3HZ LYS 44 1.169 -13.164 -16.959 280 HZ2 LYS 44 1HZ LYS 44 -0.192 -12.383 -16.329 281 HZ3 LYS 44 2HZ LYS 44 0.481 -13.700 -15.510 282 H LYS 45 H LYS 45 7.334 -14.495 -14.738 283 HA LYS 45 HA LYS 45 8.697 -15.538 -16.232 284 HB2 LYS 45 2HB LYS 45 6.696 -17.798 -16.225 285 HB3 LYS 45 3HB LYS 45 8.404 -17.883 -16.633 286 HG2 LYS 45 2HG LYS 45 7.316 -17.229 -13.903 287 HG3 LYS 45 3HG LYS 45 7.894 -18.816 -14.414 288 HD2 LYS 45 2HD LYS 45 9.603 -16.341 -14.542 289 HD3 LYS 45 3HD LYS 45 9.535 -17.382 -13.117 290 HE2 LYS 45 2HE LYS 45 10.134 -19.298 -14.661 291 HE3 LYS 45 3HE LYS 45 10.481 -18.080 -15.888 292 HZ1 LYS 45 3HZ LYS 45 12.028 -17.070 -14.195 293 HZ2 LYS 45 1HZ LYS 45 12.515 -18.553 -14.848 294 HZ3 LYS 45 2HZ LYS 45 11.848 -18.491 -13.295 295 H LEU 46 H LEU 46 7.326 -13.665 -17.419 296 HA LEU 46 HA LEU 46 6.116 -14.855 -19.822 297 HB2 LEU 46 2HB LEU 46 5.520 -12.500 -18.221 298 HB3 LEU 46 3HB LEU 46 5.648 -12.137 -19.941 299 HG LEU 46 HG LEU 46 4.017 -14.248 -20.084 300 HD11 LEU 46 1HD1 LEU 46 3.068 -12.959 -17.553 301 HD12 LEU 46 2HD1 LEU 46 4.139 -14.359 -17.518 302 HD13 LEU 46 3HD1 LEU 46 2.558 -14.478 -18.290 303 HD21 LEU 46 3HD2 LEU 46 2.989 -11.516 -19.348 304 HD22 LEU 46 1HD2 LEU 46 2.231 -12.716 -20.394 305 HD23 LEU 46 2HD2 LEU 46 3.702 -11.894 -20.917 306 HA PRO 47 HA PRO 47 9.355 -13.453 -22.428 307 HB2 PRO 47 2HB PRO 47 8.016 -12.577 -24.621 308 HB3 PRO 47 3HB PRO 47 8.164 -14.289 -24.207 309 HG2 PRO 47 2HG PRO 47 5.879 -12.415 -23.726 310 HG3 PRO 47 3HG PRO 47 5.849 -14.093 -24.298 311 HD2 PRO 47 2HD PRO 47 5.316 -13.419 -21.730 312 HD3 PRO 47 3HD PRO 47 6.091 -14.954 -22.174 313 HA PRO 48 HA PRO 48 9.448 -9.084 -21.291 314 HB2 PRO 48 2HB PRO 48 12.144 -8.854 -21.516 315 HB3 PRO 48 3HB PRO 48 11.354 -9.553 -20.097 316 HG2 PRO 48 2HG PRO 48 12.632 -10.934 -22.426 317 HG3 PRO 48 3HG PRO 48 12.743 -11.318 -20.698 318 HD2 PRO 48 2HD PRO 48 11.112 -12.666 -22.388 319 HD3 PRO 48 3HD PRO 48 10.709 -12.402 -20.679 320 H ASP 49 H ASP 49 11.066 -10.600 -24.046 321 HA ASP 49 HA ASP 49 11.692 -8.295 -25.495 322 HB2 ASP 49 2HB ASP 49 11.305 -11.168 -26.150 323 HB3 ASP 49 3HB ASP 49 11.260 -10.030 -27.493 324 H THR 50 H THR 50 8.734 -10.229 -25.414 325 HA THR 50 HA THR 50 7.409 -8.149 -27.029 326 HB THR 50 HB THR 50 5.659 -9.969 -27.440 327 HG1 THR 50 HG1 THR 50 6.604 -12.124 -27.268 328 HG21 THR 50 3HG2 THR 50 6.795 -10.775 -29.354 329 HG22 THR 50 1HG2 THR 50 8.373 -10.589 -28.590 330 HG23 THR 50 2HG2 THR 50 7.446 -9.164 -29.057 331 H THR 51 H THR 51 7.329 -7.071 -24.834 332 HA THR 51 HA THR 51 4.769 -7.743 -23.583 333 HB THR 51 HB THR 51 6.596 -8.738 -22.188 334 HG1 THR 51 HG1 THR 51 4.772 -6.808 -21.301 335 HG21 THR 51 3HG2 THR 51 7.320 -5.992 -21.280 336 HG22 THR 51 1HG2 THR 51 8.090 -6.634 -22.730 337 HG23 THR 51 2HG2 THR 51 8.250 -7.488 -21.195 338 H ARG 52 H ARG 52 3.569 -6.001 -23.011 339 HA ARG 52 HA ARG 52 4.847 -3.353 -23.143 340 HB2 ARG 52 2HB ARG 52 2.099 -3.975 -24.232 341 HB3 ARG 52 3HB ARG 52 2.976 -2.456 -24.359 342 HG2 ARG 52 2HG ARG 52 3.397 -3.271 -26.426 343 HG3 ARG 52 3HG ARG 52 4.744 -4.024 -25.569 344 HD2 ARG 52 2HD ARG 52 2.974 -5.933 -25.167 345 HD3 ARG 52 3HD ARG 52 2.225 -5.233 -26.601 346 HE ARG 52 HE ARG 52 4.560 -6.847 -26.520 347 HH11 ARG 52 1HH1 ARG 52 3.111 -4.153 -28.182 348 HH12 ARG 52 2HH1 ARG 52 3.979 -4.427 -29.656 349 HH21 ARG 52 1HH2 ARG 52 5.708 -7.219 -28.456 350 HH22 ARG 52 2HH2 ARG 52 5.455 -6.172 -29.811 351 H LEU 53 H LEU 53 4.034 -1.783 -21.762 352 HA LEU 53 HA LEU 53 2.016 -2.692 -19.819 353 HB2 LEU 53 2HB LEU 53 3.690 -2.717 -18.339 354 HB3 LEU 53 3HB LEU 53 4.759 -1.800 -19.398 355 HG LEU 53 HG LEU 53 3.604 0.280 -18.647 356 HD11 LEU 53 1HD1 LEU 53 1.714 -1.479 -17.652 357 HD12 LEU 53 2HD1 LEU 53 1.808 0.254 -17.338 358 HD13 LEU 53 3HD1 LEU 53 2.549 -0.886 -16.216 359 HD21 LEU 53 3HD2 LEU 53 5.733 -0.465 -17.673 360 HD22 LEU 53 1HD2 LEU 53 4.845 -1.376 -16.452 361 HD23 LEU 53 2HD2 LEU 53 4.728 0.384 -16.498 362 H THR 54 H THR 54 0.336 -1.372 -19.600 363 HA THR 54 HA THR 54 0.654 1.454 -20.372 364 HB THR 54 HB THR 54 -2.057 0.587 -20.769 365 HG1 THR 54 HG1 THR 54 -0.161 -0.770 -22.401 366 HG21 THR 54 3HG2 THR 54 -0.102 1.382 -22.907 367 HG22 THR 54 1HG2 THR 54 -0.726 2.553 -21.747 368 HG23 THR 54 2HG2 THR 54 -1.834 1.700 -22.822 369 H TYR 55 H TYR 55 0.298 2.735 -18.693 370 HA TYR 55 HA TYR 55 -1.628 1.865 -16.640 371 HB2 TYR 55 2HB TYR 55 0.557 1.945 -15.666 372 HB3 TYR 55 3HB TYR 55 0.887 3.517 -16.385 373 HD1 TYR 55 HD1 TYR 55 -2.107 2.318 -14.513 374 HD2 TYR 55 HD2 TYR 55 1.216 4.973 -14.604 375 HE1 TYR 55 HE1 TYR 55 -2.937 3.418 -12.475 376 HE2 TYR 55 HE2 TYR 55 0.396 6.080 -12.567 377 HH TYR 55 HH TYR 55 -2.181 6.275 -11.490 378 H LYS 56 H LYS 56 -3.366 3.091 -16.329 379 HA LYS 56 HA LYS 56 -4.887 4.768 -16.560 380 HB2 LYS 56 2HB LYS 56 -2.656 5.852 -15.378 381 HB3 LYS 56 3HB LYS 56 -2.921 6.940 -16.735 382 HG2 LYS 56 2HG LYS 56 -5.087 6.201 -14.788 383 HG3 LYS 56 3HG LYS 56 -4.017 7.587 -14.566 384 HD2 LYS 56 2HD LYS 56 -5.692 7.154 -17.034 385 HD3 LYS 56 3HD LYS 56 -6.231 8.099 -15.644 386 HE2 LYS 56 2HE LYS 56 -4.192 9.517 -15.922 387 HE3 LYS 56 3HE LYS 56 -3.852 8.643 -17.415 388 HZ1 LYS 56 3HZ LYS 56 -4.989 10.552 -18.077 389 HZ2 LYS 56 1HZ LYS 56 -6.120 10.444 -16.823 390 HZ3 LYS 56 2HZ LYS 56 -6.175 9.346 -18.108 391 H GLY 57 H GLY 57 -3.839 3.566 -18.973 392 HA2 GLY 57 2HA GLY 57 -4.188 3.850 -21.231 393 HA3 GLY 57 3HA GLY 57 -4.910 5.410 -20.865 394 H ARG 58 H ARG 58 -1.857 5.185 -19.502 395 HA ARG 58 HA ARG 58 -0.662 6.580 -21.807 396 HB2 ARG 58 2HB ARG 58 -0.521 7.134 -18.866 397 HB3 ARG 58 3HB ARG 58 0.816 7.607 -19.905 398 HG2 ARG 58 2HG ARG 58 -1.901 8.402 -20.764 399 HG3 ARG 58 3HG ARG 58 -1.221 9.220 -19.356 400 HD2 ARG 58 2HD ARG 58 0.666 9.965 -20.605 401 HD3 ARG 58 3HD ARG 58 0.236 8.944 -21.976 402 HE ARG 58 HE ARG 58 -1.902 10.649 -21.568 403 HH11 ARG 58 1HH1 ARG 58 1.478 10.918 -22.361 404 HH12 ARG 58 2HH1 ARG 58 1.281 12.377 -23.274 405 HH21 ARG 58 1HH2 ARG 58 -2.173 12.570 -22.768 406 HH22 ARG 58 2HH2 ARG 58 -0.796 13.316 -23.505 407 H ALA 59 H ALA 59 1.598 6.291 -22.155 408 HA ALA 59 HA ALA 59 2.563 3.694 -21.178 409 HB1 ALA 59 1HB ALA 59 3.916 5.064 -23.432 410 HB2 ALA 59 2HB ALA 59 3.579 3.350 -23.182 411 HB3 ALA 59 3HB ALA 59 2.293 4.432 -23.717 412 H LEU 60 H LEU 60 4.057 3.719 -19.643 413 HA LEU 60 HA LEU 60 5.858 6.044 -19.466 414 HB2 LEU 60 2HB LEU 60 4.992 4.169 -17.270 415 HB3 LEU 60 3HB LEU 60 6.067 5.553 -17.086 416 HG LEU 60 HG LEU 60 4.003 6.893 -17.987 417 HD11 LEU 60 1HD1 LEU 60 2.477 5.228 -18.545 418 HD12 LEU 60 2HD1 LEU 60 1.916 5.789 -16.970 419 HD13 LEU 60 3HD1 LEU 60 2.827 4.285 -17.097 420 HD21 LEU 60 3HD2 LEU 60 5.150 6.667 -15.601 421 HD22 LEU 60 1HD2 LEU 60 3.595 5.932 -15.211 422 HD23 LEU 60 2HD2 LEU 60 3.658 7.577 -15.845 423 H LYS 61 H LYS 61 8.051 5.678 -18.930 424 HA LYS 61 HA LYS 61 9.114 3.033 -18.695 425 HB2 LYS 61 2HB LYS 61 8.832 4.192 -21.330 426 HB3 LYS 61 3HB LYS 61 10.527 3.916 -20.950 427 HG2 LYS 61 2HG LYS 61 10.111 1.588 -20.533 428 HG3 LYS 61 3HG LYS 61 8.372 1.826 -20.721 429 HD2 LYS 61 2HD LYS 61 9.951 2.758 -23.002 430 HD3 LYS 61 3HD LYS 61 10.085 1.024 -22.700 431 HE2 LYS 61 2HE LYS 61 8.075 0.682 -23.578 432 HE3 LYS 61 3HE LYS 61 7.352 1.818 -22.440 433 HZ1 LYS 61 3HZ LYS 61 8.612 3.382 -24.308 434 HZ2 LYS 61 1HZ LYS 61 6.948 3.101 -24.187 435 HZ3 LYS 61 2HZ LYS 61 7.893 2.148 -25.215 436 H ASP 62 H ASP 62 10.449 5.943 -20.239 437 HA ASP 62 HA ASP 62 12.749 5.894 -18.532 438 HB2 ASP 62 2HB ASP 62 11.781 7.698 -20.727 439 HB3 ASP 62 3HB ASP 62 13.136 8.188 -19.713 440 H THR 63 H THR 63 9.648 6.970 -18.068 441 HA THR 63 HA THR 63 9.960 9.440 -16.786 442 HB THR 63 HB THR 63 7.898 7.928 -15.482 443 HG1 THR 63 HG1 THR 63 7.635 7.869 -18.302 444 HG21 THR 63 3HG2 THR 63 6.505 9.542 -16.985 445 HG22 THR 63 1HG2 THR 63 8.076 10.241 -17.373 446 HG23 THR 63 2HG2 THR 63 7.517 10.202 -15.701 447 H GLU 64 H GLU 64 10.863 6.289 -15.801 448 HA GLU 64 HA GLU 64 11.884 5.488 -13.932 449 HB2 GLU 64 2HB GLU 64 12.401 8.377 -13.854 450 HB3 GLU 64 3HB GLU 64 12.477 7.596 -12.280 451 HG2 GLU 64 2HG GLU 64 13.888 5.942 -14.061 452 HG3 GLU 64 3HG GLU 64 14.397 7.596 -14.393 453 H THR 65 H THR 65 10.517 8.325 -12.334 454 HA THR 65 HA THR 65 8.984 6.535 -10.595 455 HB THR 65 HB THR 65 8.885 8.289 -8.998 456 HG1 THR 65 HG1 THR 65 9.457 10.412 -9.499 457 HG21 THR 65 3HG2 THR 65 11.075 8.352 -8.399 458 HG22 THR 65 1HG2 THR 65 11.607 8.903 -9.986 459 HG23 THR 65 2HG2 THR 65 11.229 7.200 -9.725 460 H LEU 66 H LEU 66 6.813 7.254 -9.903 461 HA LEU 66 HA LEU 66 5.361 8.470 -12.158 462 HB2 LEU 66 2HB LEU 66 4.639 6.320 -10.206 463 HB3 LEU 66 3HB LEU 66 3.378 7.250 -11.013 464 HG LEU 66 HG LEU 66 4.509 6.519 -13.198 465 HD11 LEU 66 1HD1 LEU 66 5.687 4.480 -11.316 466 HD12 LEU 66 2HD1 LEU 66 6.585 5.710 -12.205 467 HD13 LEU 66 3HD1 LEU 66 5.750 4.425 -13.078 468 HD21 LEU 66 3HD2 LEU 66 3.492 4.058 -12.615 469 HD22 LEU 66 1HD2 LEU 66 2.536 5.461 -13.092 470 HD23 LEU 66 2HD2 LEU 66 2.728 5.065 -11.384 471 H GLU 67 H GLU 67 6.254 8.880 -8.921 472 HA GLU 67 HA GLU 67 4.060 10.208 -7.821 473 HB2 GLU 67 2HB GLU 67 5.988 9.510 -6.489 474 HB3 GLU 67 3HB GLU 67 7.005 10.677 -7.322 475 HG2 GLU 67 2HG GLU 67 6.253 12.407 -6.104 476 HG3 GLU 67 3HG GLU 67 4.605 11.787 -6.041 477 H SER 68 H SER 68 6.558 11.324 -10.007 478 HA SER 68 HA SER 68 6.107 14.093 -9.758 479 HB2 SER 68 2HB SER 68 7.674 12.346 -11.431 480 HB3 SER 68 3HB SER 68 6.909 13.593 -12.416 481 HG SER 68 HG SER 68 8.667 14.612 -11.727 482 H LEU 69 H LEU 69 4.372 11.592 -11.391 483 HA LEU 69 HA LEU 69 2.802 13.541 -12.915 484 HB2 LEU 69 2HB LEU 69 2.384 10.586 -13.042 485 HB3 LEU 69 3HB LEU 69 2.097 11.808 -14.279 486 HG LEU 69 HG LEU 69 4.767 10.706 -13.409 487 HD11 LEU 69 1HD1 LEU 69 3.289 9.296 -14.883 488 HD12 LEU 69 2HD1 LEU 69 4.871 9.700 -15.548 489 HD13 LEU 69 3HD1 LEU 69 3.436 10.561 -16.103 490 HD21 LEU 69 3HD2 LEU 69 4.173 12.783 -15.514 491 HD22 LEU 69 1HD2 LEU 69 5.755 12.130 -15.087 492 HD23 LEU 69 2HD2 LEU 69 4.868 13.119 -13.927 493 H GLY 70 H GLY 70 2.723 11.781 -10.024 494 HA2 GLY 70 2HA GLY 70 1.006 12.324 -8.412 495 HA3 GLY 70 3HA GLY 70 -0.147 12.395 -9.737 496 H VAL 71 H VAL 71 2.088 10.097 -8.182 497 HA VAL 71 HA VAL 71 0.340 7.886 -8.926 498 HB VAL 71 HB VAL 71 2.822 7.687 -9.144 499 HG11 VAL 71 1HG1 VAL 71 3.199 7.105 -6.301 500 HG12 VAL 71 2HG1 VAL 71 4.243 7.967 -7.433 501 HG13 VAL 71 3HG1 VAL 71 2.900 8.806 -6.655 502 HG21 VAL 71 3HG2 VAL 71 0.975 5.808 -8.400 503 HG22 VAL 71 1HG2 VAL 71 2.629 5.467 -8.910 504 HG23 VAL 71 2HG2 VAL 71 2.243 5.587 -7.194 505 H ALA 72 H ALA 72 -0.797 6.631 -7.503 506 HA ALA 72 HA ALA 72 -0.740 7.411 -4.666 507 HB1 ALA 72 1HB ALA 72 -2.702 8.441 -5.134 508 HB2 ALA 72 2HB ALA 72 -3.033 7.421 -6.534 509 HB3 ALA 72 3HB ALA 72 -3.330 6.809 -4.907 510 H ASP 73 H ASP 73 -1.198 5.779 -3.181 511 HA ASP 73 HA ASP 73 -0.318 3.220 -3.764 512 HB2 ASP 73 2HB ASP 73 -0.319 3.826 -1.493 513 HB3 ASP 73 3HB ASP 73 -2.011 4.314 -1.531 514 H GLY 74 H GLY 74 -1.243 1.349 -4.432 515 HA2 GLY 74 2HA GLY 74 -3.020 -0.139 -4.866 516 HA3 GLY 74 3HA GLY 74 -4.152 1.191 -4.671 517 H ASP 75 H ASP 75 -1.310 1.447 -6.684 518 HA ASP 75 HA ASP 75 -2.805 2.272 -8.936 519 HB2 ASP 75 2HB ASP 75 0.014 1.882 -8.259 520 HB3 ASP 75 3HB ASP 75 -0.348 1.518 -9.944 521 H LYS 76 H LYS 76 -2.881 1.240 -11.038 522 HA LYS 76 HA LYS 76 -2.510 -1.646 -11.100 523 HB2 LYS 76 2HB LYS 76 -4.752 -1.553 -10.288 524 HB3 LYS 76 3HB LYS 76 -5.185 -0.293 -11.436 525 HG2 LYS 76 2HG LYS 76 -4.218 -2.633 -12.808 526 HG3 LYS 76 3HG LYS 76 -5.549 -3.038 -11.721 527 HD2 LYS 76 2HD LYS 76 -7.040 -1.642 -12.821 528 HD3 LYS 76 3HD LYS 76 -5.754 -0.662 -13.529 529 HE2 LYS 76 2HE LYS 76 -5.996 -1.855 -15.391 530 HE3 LYS 76 3HE LYS 76 -5.317 -3.226 -14.517 531 HZ1 LYS 76 3HZ LYS 76 -7.501 -3.943 -13.915 532 HZ2 LYS 76 1HZ LYS 76 -7.475 -3.699 -15.589 533 HZ3 LYS 76 2HZ LYS 76 -8.208 -2.557 -14.579 534 H PHE 77 H PHE 77 -1.756 -2.278 -13.019 535 HA PHE 77 HA PHE 77 -2.273 -0.580 -15.364 536 HB2 PHE 77 2HB PHE 77 0.046 -0.929 -16.109 537 HB3 PHE 77 3HB PHE 77 -0.012 -0.098 -14.558 538 HD1 PHE 77 HD2 PHE 77 0.445 -1.405 -12.465 539 HD2 PHE 77 HD1 PHE 77 1.173 -2.970 -16.355 540 HE1 PHE 77 HE2 PHE 77 1.936 -3.106 -11.498 541 HE2 PHE 77 HE1 PHE 77 2.664 -4.674 -15.395 542 HZ PHE 77 HZ PHE 77 3.049 -4.743 -12.963 543 H VAL 78 H VAL 78 -2.278 -1.649 -17.382 544 HA VAL 78 HA VAL 78 -2.847 -4.518 -17.163 545 HB VAL 78 HB VAL 78 -3.464 -2.677 -19.475 546 HG11 VAL 78 1HG1 VAL 78 -3.590 -5.513 -19.134 547 HG12 VAL 78 2HG1 VAL 78 -5.221 -4.873 -19.339 548 HG13 VAL 78 3HG1 VAL 78 -3.985 -4.545 -20.554 549 HG21 VAL 78 3HG2 VAL 78 -5.774 -2.680 -18.631 550 HG22 VAL 78 1HG2 VAL 78 -5.238 -3.565 -17.203 551 HG23 VAL 78 2HG2 VAL 78 -4.655 -1.927 -17.496 552 H LEU 79 H LEU 79 -1.516 -5.989 -17.998 553 HA LEU 79 HA LEU 79 0.636 -5.061 -19.780 554 HB2 LEU 79 2HB LEU 79 1.485 -5.896 -17.691 555 HB3 LEU 79 3HB LEU 79 0.539 -7.374 -17.852 556 HG LEU 79 HG LEU 79 2.098 -7.397 -20.119 557 HD11 LEU 79 1HD1 LEU 79 3.598 -5.721 -19.636 558 HD12 LEU 79 2HD1 LEU 79 4.418 -7.128 -18.959 559 HD13 LEU 79 3HD1 LEU 79 3.543 -6.022 -17.899 560 HD21 LEU 79 3HD2 LEU 79 2.945 -9.338 -19.242 561 HD22 LEU 79 1HD2 LEU 79 1.517 -9.125 -18.229 562 HD23 LEU 79 2HD2 LEU 79 3.107 -8.666 -17.619 563 H ILE 80 H ILE 80 0.814 -5.903 -21.765 564 HA ILE 80 HA ILE 80 -0.885 -8.219 -22.431 565 HB ILE 80 HB ILE 80 -1.666 -6.100 -23.461 566 HG12 ILE 80 2HG1 ILE 80 -0.618 -7.736 -25.726 567 HG13 ILE 80 3HG1 ILE 80 -1.652 -8.528 -24.541 568 HG21 ILE 80 1HG2 ILE 80 1.016 -6.182 -24.833 569 HG22 ILE 80 2HG2 ILE 80 -0.320 -5.130 -25.298 570 HG23 ILE 80 3HG2 ILE 80 0.435 -4.949 -23.715 571 HD11 ILE 80 3HD1 ILE 80 -3.198 -7.855 -26.072 572 HD12 ILE 80 1HD1 ILE 80 -3.201 -6.462 -24.990 573 HD13 ILE 80 2HD1 ILE 80 -2.301 -6.400 -26.505 574 H THR 81 H THR 81 -0.067 -9.769 -23.842 575 HA THR 81 HA THR 81 2.848 -9.640 -24.262 576 HB THR 81 HB THR 81 2.059 -11.416 -22.680 577 HG1 THR 81 HG1 THR 81 3.286 -13.088 -23.792 578 HG21 THR 81 3HG2 THR 81 0.839 -13.300 -23.459 579 HG22 THR 81 1HG2 THR 81 0.941 -12.761 -25.134 580 HG23 THR 81 2HG2 THR 81 -0.060 -11.876 -23.982 581 H ARG 82 H ARG 82 3.674 -10.050 -26.255 582 HA ARG 82 HA ARG 82 1.724 -10.409 -28.426 583 HB2 ARG 82 2HB ARG 82 3.498 -8.412 -28.161 584 HB3 ARG 82 3HB ARG 82 4.506 -9.566 -29.022 585 HG2 ARG 82 2HG ARG 82 3.598 -8.370 -30.753 586 HG3 ARG 82 3HG ARG 82 2.468 -9.721 -30.636 587 HD2 ARG 82 2HD ARG 82 0.772 -8.393 -30.019 588 HD3 ARG 82 3HD ARG 82 1.783 -7.470 -28.908 589 HE ARG 82 HE ARG 82 2.553 -6.643 -31.396 590 HH11 ARG 82 1HH1 ARG 82 -0.459 -6.778 -29.656 591 HH12 ARG 82 2HH1 ARG 82 -1.134 -5.397 -30.456 592 HH21 ARG 82 1HH2 ARG 82 1.676 -4.823 -32.456 593 HH22 ARG 82 2HH2 ARG 82 0.082 -4.286 -32.049 594 H THR 83 H THR 83 1.833 -12.120 -29.759 595 HA THR 83 HA THR 83 3.947 -14.093 -29.241 596 HB THR 83 HB THR 83 2.184 -15.468 -30.752 597 HG1 THR 83 HG1 THR 83 0.418 -14.307 -30.905 598 HG21 THR 83 3HG2 THR 83 2.289 -15.000 -27.790 599 HG22 THR 83 1HG2 THR 83 2.860 -16.388 -28.715 600 HG23 THR 83 2HG2 THR 83 1.130 -16.129 -28.490 601 H VAL 84 H VAL 84 5.525 -14.267 -30.679 602 HA VAL 84 HA VAL 84 5.222 -13.111 -33.329 603 HB VAL 84 HB VAL 84 7.280 -12.711 -31.988 604 HG11 VAL 84 1HG1 VAL 84 8.932 -14.470 -31.752 605 HG12 VAL 84 2HG1 VAL 84 7.423 -14.950 -30.972 606 HG13 VAL 84 3HG1 VAL 84 7.855 -15.619 -32.546 607 HG21 VAL 84 3HG2 VAL 84 8.662 -12.657 -33.833 608 HG22 VAL 84 1HG2 VAL 84 8.107 -14.222 -34.427 609 HG23 VAL 84 2HG2 VAL 84 7.077 -12.800 -34.592 610 H GLY 85 H GLY 85 5.310 -16.229 -31.810 611 HA2 GLY 85 2HA GLY 85 4.820 -17.466 -34.422 612 HA3 GLY 85 3HA GLY 85 6.135 -18.100 -33.444 Start of MODEL 15 1 H1 MET 9 H MET 9 0.987 0.132 0.509 2 HA MET 9 HA MET 9 1.377 0.236 -1.825 3 HB2 MET 9 2HB MET 9 3.679 -0.621 -0.170 4 HB3 MET 9 3HB MET 9 3.898 -0.720 -1.912 5 HG2 MET 9 2HG MET 9 2.755 1.774 -1.496 6 HG3 MET 9 3HG MET 9 3.906 1.583 -0.176 7 HE1 MET 9 3HE MET 9 5.482 3.892 -2.934 8 HE2 MET 9 1HE MET 9 4.184 3.822 -1.743 9 HE3 MET 9 2HE MET 9 5.858 3.602 -1.235 10 H LYS 10 H LYS 10 -0.175 -1.361 -2.575 11 HA LYS 10 HA LYS 10 1.173 -3.756 -3.624 12 HB2 LYS 10 2HB LYS 10 -1.285 -3.562 -2.012 13 HB3 LYS 10 3HB LYS 10 -1.421 -4.576 -3.442 14 HG2 LYS 10 2HG LYS 10 0.809 -5.612 -2.557 15 HG3 LYS 10 3HG LYS 10 0.273 -4.932 -1.019 16 HD2 LYS 10 2HD LYS 10 -1.818 -6.371 -2.475 17 HD3 LYS 10 3HD LYS 10 -0.448 -7.381 -2.008 18 HE2 LYS 10 2HE LYS 10 -1.190 -5.649 0.161 19 HE3 LYS 10 3HE LYS 10 -2.598 -6.546 -0.406 20 HZ1 LYS 10 3HZ LYS 10 -0.108 -8.028 -0.016 21 HZ2 LYS 10 1HZ LYS 10 -1.709 -8.523 0.219 22 HZ3 LYS 10 2HZ LYS 10 -0.951 -7.539 1.367 23 H ILE 11 H ILE 11 0.790 -4.238 -5.732 24 HA ILE 11 HA ILE 11 -1.167 -2.564 -7.163 25 HB ILE 11 HB ILE 11 1.481 -3.441 -8.311 26 HG12 ILE 11 2HG1 ILE 11 1.451 -0.648 -8.016 27 HG13 ILE 11 3HG1 ILE 11 0.883 -1.287 -6.477 28 HG21 ILE 11 1HG2 ILE 11 0.277 -2.983 -10.169 29 HG22 ILE 11 2HG2 ILE 11 -0.866 -1.954 -9.307 30 HG23 ILE 11 3HG2 ILE 11 0.715 -1.323 -9.768 31 HD11 ILE 11 3HD1 ILE 11 3.517 -1.040 -7.353 32 HD12 ILE 11 1HD1 ILE 11 2.939 -1.852 -5.898 33 HD13 ILE 11 2HD1 ILE 11 3.164 -2.768 -7.389 34 H LYS 12 H LYS 12 -2.294 -3.518 -8.839 35 HA LYS 12 HA LYS 12 -1.964 -6.436 -9.093 36 HB2 LYS 12 2HB LYS 12 -4.177 -5.077 -8.157 37 HB3 LYS 12 3HB LYS 12 -4.584 -5.373 -9.843 38 HG2 LYS 12 2HG LYS 12 -4.007 -7.789 -9.443 39 HG3 LYS 12 3HG LYS 12 -3.919 -7.397 -7.724 40 HD2 LYS 12 2HD LYS 12 -6.289 -6.379 -8.127 41 HD3 LYS 12 3HD LYS 12 -6.287 -7.426 -9.548 42 HE2 LYS 12 2HE LYS 12 -5.627 -9.301 -7.943 43 HE3 LYS 12 3HE LYS 12 -6.095 -8.196 -6.651 44 HZ1 LYS 12 3HZ LYS 12 -7.814 -9.297 -8.799 45 HZ2 LYS 12 1HZ LYS 12 -8.292 -8.014 -7.805 46 HZ3 LYS 12 2HZ LYS 12 -7.965 -9.529 -7.130 47 H ILE 13 H ILE 13 -1.246 -7.040 -11.017 48 HA ILE 13 HA ILE 13 -1.762 -5.305 -13.333 49 HB ILE 13 HB ILE 13 0.593 -5.656 -12.947 50 HG12 ILE 13 2HG1 ILE 13 0.511 -7.494 -15.175 51 HG13 ILE 13 3HG1 ILE 13 -0.753 -6.279 -15.335 52 HG21 ILE 13 1HG2 ILE 13 1.382 -7.535 -12.073 53 HG22 ILE 13 2HG2 ILE 13 -0.230 -8.243 -12.166 54 HG23 ILE 13 3HG2 ILE 13 0.894 -8.431 -13.512 55 HD11 ILE 13 3HD1 ILE 13 1.969 -6.038 -15.958 56 HD12 ILE 13 1HD1 ILE 13 0.727 -4.787 -16.012 57 HD13 ILE 13 2HD1 ILE 13 1.684 -5.016 -14.548 58 H VAL 14 H VAL 14 -3.285 -5.939 -14.695 59 HA VAL 14 HA VAL 14 -4.050 -8.771 -14.770 60 HB VAL 14 HB VAL 14 -5.542 -6.419 -15.936 61 HG11 VAL 14 1HG1 VAL 14 -6.479 -8.183 -17.020 62 HG12 VAL 14 2HG1 VAL 14 -6.033 -9.338 -15.763 63 HG13 VAL 14 3HG1 VAL 14 -7.414 -8.267 -15.528 64 HG21 VAL 14 3HG2 VAL 14 -6.164 -5.881 -13.871 65 HG22 VAL 14 1HG2 VAL 14 -6.909 -7.472 -13.713 66 HG23 VAL 14 2HG2 VAL 14 -5.238 -7.225 -13.204 67 HA PRO 15 HA PRO 15 -1.795 -8.869 -18.654 68 HB2 PRO 15 2HB PRO 15 -2.016 -11.555 -18.981 69 HB3 PRO 15 3HB PRO 15 -0.833 -10.814 -17.897 70 HG2 PRO 15 2HG PRO 15 -3.490 -12.031 -17.252 71 HG3 PRO 15 3HG PRO 15 -1.946 -12.198 -16.396 72 HD2 PRO 15 2HD PRO 15 -3.905 -10.527 -15.556 73 HD3 PRO 15 3HD PRO 15 -2.181 -10.173 -15.319 74 H ALA 16 H ALA 16 -2.463 -8.836 -20.742 75 HA ALA 16 HA ALA 16 -5.309 -9.208 -21.235 76 HB1 ALA 16 1HB ALA 16 -5.096 -7.782 -23.008 77 HB2 ALA 16 2HB ALA 16 -3.761 -7.219 -22.002 78 HB3 ALA 16 3HB ALA 16 -3.446 -8.293 -23.365 79 H VAL 17 H VAL 17 -4.117 -11.621 -20.780 80 HA VAL 17 HA VAL 17 -3.712 -12.807 -23.439 81 HB VAL 17 HB VAL 17 -2.722 -14.709 -22.341 82 HG11 VAL 17 1HG1 VAL 17 -1.323 -12.721 -20.739 83 HG12 VAL 17 2HG1 VAL 17 -0.750 -13.687 -22.101 84 HG13 VAL 17 3HG1 VAL 17 -1.627 -12.184 -22.391 85 HG21 VAL 17 3HG2 VAL 17 -3.787 -15.161 -20.376 86 HG22 VAL 17 1HG2 VAL 17 -2.366 -14.334 -19.738 87 HG23 VAL 17 2HG2 VAL 17 -3.889 -13.462 -19.912 88 H GLY 18 H GLY 18 -4.386 -15.386 -23.059 89 HA2 GLY 18 2HA GLY 18 -7.106 -15.496 -23.488 90 HA3 GLY 18 3HA GLY 18 -6.145 -16.861 -22.942 91 H GLY 19 H GLY 19 -5.740 -16.989 -20.571 92 HA2 GLY 19 2HA GLY 19 -8.162 -16.949 -19.155 93 HA3 GLY 19 3HA GLY 19 -6.572 -17.165 -18.440 94 H GLY 20 H GLY 20 -5.430 -14.688 -19.103 95 HA2 GLY 20 2HA GLY 20 -5.209 -12.603 -18.162 96 HA3 GLY 20 3HA GLY 20 -6.907 -12.415 -18.572 97 H SER 21 H SER 21 -4.634 -13.281 -16.062 98 HA SER 21 HA SER 21 -6.791 -12.939 -14.085 99 HB2 SER 21 2HB SER 21 -5.409 -14.518 -12.626 100 HB3 SER 21 3HB SER 21 -6.258 -15.250 -13.987 101 HG SER 21 HG SER 21 -4.399 -15.607 -14.983 102 HA PRO 22 HA PRO 22 -4.240 -9.641 -12.608 103 HB2 PRO 22 2HB PRO 22 -5.569 -9.198 -10.282 104 HB3 PRO 22 3HB PRO 22 -6.192 -8.689 -11.856 105 HG2 PRO 22 2HG PRO 22 -6.897 -11.102 -10.231 106 HG3 PRO 22 3HG PRO 22 -7.965 -10.004 -11.126 107 HD2 PRO 22 2HD PRO 22 -7.212 -12.417 -12.097 108 HD3 PRO 22 3HD PRO 22 -7.523 -11.020 -13.147 109 H LEU 23 H LEU 23 -2.348 -9.690 -11.572 110 HA LEU 23 HA LEU 23 -1.989 -11.655 -9.406 111 HB2 LEU 23 2HB LEU 23 -0.666 -12.217 -11.346 112 HB3 LEU 23 3HB LEU 23 0.006 -10.588 -11.398 113 HG LEU 23 HG LEU 23 1.253 -10.984 -9.376 114 HD11 LEU 23 1HD1 LEU 23 1.004 -13.714 -8.879 115 HD12 LEU 23 2HD1 LEU 23 -0.649 -13.121 -9.039 116 HD13 LEU 23 3HD1 LEU 23 0.440 -12.388 -7.862 117 HD21 LEU 23 3HD2 LEU 23 2.576 -13.053 -10.157 118 HD22 LEU 23 1HD2 LEU 23 2.499 -11.651 -11.223 119 HD23 LEU 23 2HD2 LEU 23 1.473 -13.052 -11.534 120 H GLU 24 H GLU 24 -1.319 -10.951 -7.467 121 HA GLU 24 HA GLU 24 -0.936 -8.081 -7.126 122 HB2 GLU 24 2HB GLU 24 -2.178 -10.097 -5.600 123 HB3 GLU 24 3HB GLU 24 -0.780 -9.576 -4.670 124 HG2 GLU 24 2HG GLU 24 -1.672 -7.576 -4.202 125 HG3 GLU 24 3HG GLU 24 -2.376 -7.397 -5.808 126 H LEU 25 H LEU 25 0.979 -7.164 -6.772 127 HA LEU 25 HA LEU 25 3.176 -8.748 -5.682 128 HB2 LEU 25 2HB LEU 25 3.314 -8.892 -8.151 129 HB3 LEU 25 3HB LEU 25 3.430 -7.134 -8.216 130 HG LEU 25 HG LEU 25 5.570 -7.203 -7.078 131 HD11 LEU 25 1HD1 LEU 25 4.705 -9.839 -6.361 132 HD12 LEU 25 2HD1 LEU 25 6.058 -8.897 -5.736 133 HD13 LEU 25 3HD1 LEU 25 6.276 -9.915 -7.159 134 HD21 LEU 25 3HD2 LEU 25 5.744 -7.319 -9.432 135 HD22 LEU 25 1HD2 LEU 25 5.285 -9.021 -9.457 136 HD23 LEU 25 2HD2 LEU 25 6.850 -8.540 -8.801 137 H GLU 26 H GLU 26 5.003 -7.415 -4.982 138 HA GLU 26 HA GLU 26 4.070 -4.778 -4.090 139 HB2 GLU 26 2HB GLU 26 5.424 -6.911 -2.781 140 HB3 GLU 26 3HB GLU 26 6.515 -5.534 -2.827 141 HG2 GLU 26 2HG GLU 26 4.978 -4.159 -1.668 142 HG3 GLU 26 3HG GLU 26 3.681 -5.338 -1.854 143 H VAL 27 H VAL 27 4.687 -3.216 -5.442 144 HA VAL 27 HA VAL 27 7.531 -3.006 -6.103 145 HB VAL 27 HB VAL 27 5.434 -2.483 -8.201 146 HG11 VAL 27 1HG1 VAL 27 8.428 -2.617 -8.156 147 HG12 VAL 27 2HG1 VAL 27 7.524 -2.832 -9.656 148 HG13 VAL 27 3HG1 VAL 27 7.383 -1.326 -8.748 149 HG21 VAL 27 3HG2 VAL 27 6.930 -5.014 -7.592 150 HG22 VAL 27 1HG2 VAL 27 5.202 -4.790 -7.864 151 HG23 VAL 27 2HG2 VAL 27 6.332 -4.655 -9.211 152 H ALA 28 H ALA 28 8.200 -0.855 -6.688 153 HA ALA 28 HA ALA 28 6.366 1.215 -5.669 154 HB1 ALA 28 1HB ALA 28 9.191 0.657 -5.133 155 HB2 ALA 28 2HB ALA 28 8.832 2.351 -5.469 156 HB3 ALA 28 3HB ALA 28 7.996 1.516 -4.160 157 HA PRO 29 HA PRO 29 6.613 2.641 -9.907 158 HB2 PRO 29 2HB PRO 29 4.807 4.644 -9.597 159 HB3 PRO 29 3HB PRO 29 4.339 2.950 -9.788 160 HG2 PRO 29 2HG PRO 29 4.561 4.584 -7.290 161 HG3 PRO 29 3HG PRO 29 3.299 3.433 -7.765 162 HD2 PRO 29 2HD PRO 29 5.280 2.791 -6.034 163 HD3 PRO 29 3HD PRO 29 4.556 1.605 -7.139 164 H ASN 30 H ASN 30 7.435 4.248 -7.002 165 HA ASN 30 HA ASN 30 8.280 6.704 -8.291 166 HB2 ASN 30 2HB ASN 30 8.976 5.943 -5.469 167 HB3 ASN 30 3HB ASN 30 8.691 7.544 -6.146 168 HD21 ASN 30 1HD2 ASN 30 7.516 6.076 -3.836 169 HD22 ASN 30 2HD2 ASN 30 5.808 6.155 -4.084 170 H ALA 31 H ALA 31 9.487 3.784 -8.501 171 HA ALA 31 HA ALA 31 12.287 4.515 -8.009 172 HB1 ALA 31 1HB ALA 31 10.789 1.991 -7.995 173 HB2 ALA 31 2HB ALA 31 12.382 1.906 -8.747 174 HB3 ALA 31 3HB ALA 31 12.221 2.470 -7.084 175 H THR 32 H THR 32 10.860 2.327 -10.410 176 HA THR 32 HA THR 32 11.667 4.006 -12.616 177 HB THR 32 HB THR 32 12.887 1.308 -12.789 178 HG1 THR 32 HG1 THR 32 14.785 2.179 -11.688 179 HG21 THR 32 3HG2 THR 32 14.068 2.262 -14.443 180 HG22 THR 32 1HG2 THR 32 14.453 3.682 -13.471 181 HG23 THR 32 2HG2 THR 32 12.911 3.586 -14.321 182 H VAL 33 H VAL 33 10.647 3.479 -14.521 183 HA VAL 33 HA VAL 33 8.316 1.870 -14.337 184 HB VAL 33 HB VAL 33 9.638 3.071 -16.774 185 HG11 VAL 33 1HG1 VAL 33 7.357 1.305 -16.479 186 HG12 VAL 33 2HG1 VAL 33 6.926 2.827 -17.262 187 HG13 VAL 33 3HG1 VAL 33 8.207 1.818 -17.936 188 HG21 VAL 33 3HG2 VAL 33 8.402 4.976 -16.448 189 HG22 VAL 33 1HG2 VAL 33 7.157 4.139 -15.520 190 HG23 VAL 33 2HG2 VAL 33 8.712 4.509 -14.775 191 H GLY 34 H GLY 34 11.416 1.453 -16.025 192 HA2 GLY 34 2HA GLY 34 10.794 -0.986 -17.283 193 HA3 GLY 34 3HA GLY 34 12.414 -0.407 -16.926 194 H ALA 35 H ALA 35 11.984 -0.274 -14.056 195 HA ALA 35 HA ALA 35 12.787 -2.887 -13.367 196 HB1 ALA 35 1HB ALA 35 11.855 -0.612 -11.621 197 HB2 ALA 35 2HB ALA 35 12.609 -2.093 -11.029 198 HB3 ALA 35 3HB ALA 35 13.518 -0.995 -12.068 199 H VAL 36 H VAL 36 9.719 -1.159 -12.911 200 HA VAL 36 HA VAL 36 8.415 -3.288 -11.556 201 HB VAL 36 HB VAL 36 7.064 -1.102 -13.136 202 HG11 VAL 36 1HG1 VAL 36 6.045 -3.262 -11.722 203 HG12 VAL 36 2HG1 VAL 36 5.867 -1.892 -10.623 204 HG13 VAL 36 3HG1 VAL 36 5.160 -1.827 -12.238 205 HG21 VAL 36 3HG2 VAL 36 7.112 -0.339 -10.465 206 HG22 VAL 36 1HG2 VAL 36 8.749 -0.908 -10.792 207 HG23 VAL 36 2HG2 VAL 36 8.046 0.371 -11.782 208 H ARG 37 H ARG 37 8.600 -2.294 -14.938 209 HA ARG 37 HA ARG 37 6.643 -4.035 -15.956 210 HB2 ARG 37 2HB ARG 37 7.691 -2.097 -17.168 211 HB3 ARG 37 3HB ARG 37 9.124 -3.089 -17.395 212 HG2 ARG 37 2HG ARG 37 6.615 -4.337 -18.260 213 HG3 ARG 37 3HG ARG 37 7.087 -2.897 -19.163 214 HD2 ARG 37 2HD ARG 37 9.015 -5.134 -18.616 215 HD3 ARG 37 3HD ARG 37 7.930 -5.161 -20.006 216 HE ARG 37 HE ARG 37 9.396 -2.723 -19.856 217 HH11 ARG 37 1HH1 ARG 37 9.625 -6.068 -20.794 218 HH12 ARG 37 2HH1 ARG 37 10.870 -5.789 -21.966 219 HH21 ARG 37 1HH2 ARG 37 11.035 -2.343 -21.396 220 HH22 ARG 37 2HH2 ARG 37 11.672 -3.670 -22.307 221 H THR 38 H THR 38 10.166 -4.417 -15.666 222 HA THR 38 HA THR 38 10.229 -7.041 -16.744 223 HB THR 38 HB THR 38 12.218 -5.557 -16.647 224 HG1 THR 38 HG1 THR 38 13.432 -7.306 -16.629 225 HG21 THR 38 3HG2 THR 38 12.200 -6.235 -13.704 226 HG22 THR 38 1HG2 THR 38 11.863 -4.648 -14.393 227 HG23 THR 38 2HG2 THR 38 13.469 -5.358 -14.558 228 H LYS 39 H LYS 39 9.872 -5.756 -13.495 229 HA LYS 39 HA LYS 39 10.287 -8.146 -12.069 230 HB2 LYS 39 2HB LYS 39 9.098 -5.498 -11.513 231 HB3 LYS 39 3HB LYS 39 8.540 -6.810 -10.483 232 HG2 LYS 39 2HG LYS 39 11.338 -7.049 -10.633 233 HG3 LYS 39 3HG LYS 39 10.985 -5.339 -10.370 234 HD2 LYS 39 2HD LYS 39 11.159 -6.298 -8.220 235 HD3 LYS 39 3HD LYS 39 9.431 -6.091 -8.512 236 HE2 LYS 39 2HE LYS 39 9.146 -8.400 -8.979 237 HE3 LYS 39 3HE LYS 39 10.887 -8.668 -9.058 238 HZ1 LYS 39 3HZ LYS 39 9.564 -9.307 -6.935 239 HZ2 LYS 39 1HZ LYS 39 9.703 -7.662 -6.564 240 HZ3 LYS 39 2HZ LYS 39 11.093 -8.599 -6.790 241 H VAL 40 H VAL 40 7.323 -6.654 -13.332 242 HA VAL 40 HA VAL 40 5.584 -8.686 -12.369 243 HB VAL 40 HB VAL 40 5.160 -6.708 -14.613 244 HG11 VAL 40 1HG1 VAL 40 3.294 -8.581 -13.187 245 HG12 VAL 40 2HG1 VAL 40 2.719 -7.137 -14.022 246 HG13 VAL 40 3HG1 VAL 40 3.559 -8.400 -14.921 247 HG21 VAL 40 3HG2 VAL 40 3.718 -6.230 -12.151 248 HG22 VAL 40 1HG2 VAL 40 5.462 -6.240 -11.893 249 HG23 VAL 40 2HG2 VAL 40 4.752 -5.144 -13.079 250 H CYS 41 H CYS 41 7.207 -8.114 -15.458 251 HA CYS 41 HA CYS 41 5.970 -10.133 -16.946 252 HB2 CYS 41 2HB CYS 41 8.658 -8.796 -17.144 253 HB3 CYS 41 3HB CYS 41 8.197 -10.077 -18.257 254 HG CYS 41 HG CYS 41 7.314 -8.310 -19.908 255 H ALA 42 H ALA 42 8.921 -10.216 -14.975 256 HA ALA 42 HA ALA 42 9.555 -12.920 -15.516 257 HB1 ALA 42 1HB ALA 42 10.731 -12.500 -13.123 258 HB2 ALA 42 2HB ALA 42 11.405 -11.962 -14.662 259 HB3 ALA 42 3HB ALA 42 10.488 -10.837 -13.660 260 H MET 43 H MET 43 7.629 -11.348 -13.016 261 HA MET 43 HA MET 43 7.277 -13.534 -11.309 262 HB2 MET 43 2HB MET 43 6.184 -10.902 -11.610 263 HB3 MET 43 3HB MET 43 4.871 -12.036 -11.323 264 HG2 MET 43 2HG MET 43 6.829 -12.753 -9.489 265 HG3 MET 43 3HG MET 43 6.843 -10.991 -9.497 266 HE1 MET 43 3HE MET 43 4.896 -13.294 -6.799 267 HE2 MET 43 1HE MET 43 4.096 -14.073 -8.165 268 HE3 MET 43 2HE MET 43 5.852 -13.906 -8.149 269 H LYS 44 H LYS 44 5.794 -12.739 -14.356 270 HA LYS 44 HA LYS 44 3.839 -14.898 -14.060 271 HB2 LYS 44 2HB LYS 44 4.114 -13.040 -16.416 272 HB3 LYS 44 3HB LYS 44 2.713 -13.993 -15.945 273 HG2 LYS 44 2HG LYS 44 3.253 -12.346 -13.757 274 HG3 LYS 44 3HG LYS 44 3.452 -11.323 -15.182 275 HD2 LYS 44 2HD LYS 44 1.158 -11.224 -14.438 276 HD3 LYS 44 3HD LYS 44 1.234 -12.076 -15.982 277 HE2 LYS 44 2HE LYS 44 1.539 -13.987 -13.904 278 HE3 LYS 44 3HE LYS 44 0.156 -12.969 -13.507 279 HZ1 LYS 44 3HZ LYS 44 0.321 -15.030 -15.408 280 HZ2 LYS 44 1HZ LYS 44 -0.003 -13.581 -16.219 281 HZ3 LYS 44 2HZ LYS 44 -1.025 -14.101 -14.976 282 H LYS 45 H LYS 45 6.938 -14.424 -15.209 283 HA LYS 45 HA LYS 45 8.371 -15.698 -16.432 284 HB2 LYS 45 2HB LYS 45 6.223 -17.817 -16.470 285 HB3 LYS 45 3HB LYS 45 7.961 -18.044 -16.619 286 HG2 LYS 45 2HG LYS 45 6.582 -17.021 -14.146 287 HG3 LYS 45 3HG LYS 45 7.056 -18.701 -14.415 288 HD2 LYS 45 2HD LYS 45 8.979 -16.380 -14.481 289 HD3 LYS 45 3HD LYS 45 8.671 -17.360 -13.046 290 HE2 LYS 45 2HE LYS 45 9.173 -19.262 -14.942 291 HE3 LYS 45 3HE LYS 45 10.250 -17.959 -15.440 292 HZ1 LYS 45 3HZ LYS 45 11.006 -19.730 -13.696 293 HZ2 LYS 45 1HZ LYS 45 10.190 -18.721 -12.610 294 HZ3 LYS 45 2HZ LYS 45 11.469 -18.110 -13.533 295 H LEU 46 H LEU 46 7.292 -13.872 -17.945 296 HA LEU 46 HA LEU 46 6.535 -15.272 -20.423 297 HB2 LEU 46 2HB LEU 46 5.433 -12.794 -19.184 298 HB3 LEU 46 3HB LEU 46 5.459 -12.935 -20.940 299 HG LEU 46 HG LEU 46 4.281 -15.230 -19.524 300 HD11 LEU 46 1HD1 LEU 46 2.464 -14.244 -18.601 301 HD12 LEU 46 2HD1 LEU 46 2.476 -12.896 -19.738 302 HD13 LEU 46 3HD1 LEU 46 3.603 -12.916 -18.382 303 HD21 LEU 46 3HD2 LEU 46 2.497 -14.592 -21.335 304 HD22 LEU 46 1HD2 LEU 46 4.016 -15.360 -21.800 305 HD23 LEU 46 2HD2 LEU 46 3.815 -13.617 -21.988 306 HA PRO 47 HA PRO 47 9.899 -13.315 -22.449 307 HB2 PRO 47 2HB PRO 47 8.864 -12.787 -24.902 308 HB3 PRO 47 3HB PRO 47 9.264 -14.421 -24.360 309 HG2 PRO 47 2HG PRO 47 6.606 -13.045 -24.430 310 HG3 PRO 47 3HG PRO 47 7.017 -14.708 -24.889 311 HD2 PRO 47 2HD PRO 47 5.875 -14.094 -22.512 312 HD3 PRO 47 3HD PRO 47 7.008 -15.447 -22.706 313 HA PRO 48 HA PRO 48 8.904 -8.993 -21.593 314 HB2 PRO 48 2HB PRO 48 11.492 -8.220 -21.321 315 HB3 PRO 48 3HB PRO 48 10.591 -9.030 -20.034 316 HG2 PRO 48 2HG PRO 48 12.549 -10.177 -21.987 317 HG3 PRO 48 3HG PRO 48 12.391 -10.487 -20.249 318 HD2 PRO 48 2HD PRO 48 11.423 -12.182 -22.125 319 HD3 PRO 48 3HD PRO 48 10.646 -11.965 -20.544 320 H ASP 49 H ASP 49 11.051 -10.340 -24.006 321 HA ASP 49 HA ASP 49 11.702 -8.026 -25.429 322 HB2 ASP 49 2HB ASP 49 12.154 -9.511 -27.321 323 HB3 ASP 49 3HB ASP 49 12.773 -10.205 -25.825 324 H THR 50 H THR 50 8.887 -10.150 -25.656 325 HA THR 50 HA THR 50 7.662 -8.233 -27.528 326 HB THR 50 HB THR 50 6.061 -10.141 -28.035 327 HG1 THR 50 HG1 THR 50 8.086 -11.832 -27.025 328 HG21 THR 50 3HG2 THR 50 8.816 -9.762 -28.885 329 HG22 THR 50 1HG2 THR 50 7.374 -10.085 -29.847 330 HG23 THR 50 2HG2 THR 50 8.264 -11.421 -29.117 331 H THR 51 H THR 51 7.675 -7.613 -24.821 332 HA THR 51 HA THR 51 4.806 -7.708 -24.248 333 HB THR 51 HB THR 51 6.962 -8.465 -22.272 334 HG1 THR 51 HG1 THR 51 4.608 -9.834 -23.121 335 HG21 THR 51 3HG2 THR 51 4.958 -8.704 -20.702 336 HG22 THR 51 1HG2 THR 51 4.094 -7.670 -21.840 337 HG23 THR 51 2HG2 THR 51 5.537 -7.070 -21.023 338 H ARG 52 H ARG 52 4.000 -5.891 -23.262 339 HA ARG 52 HA ARG 52 5.911 -3.807 -22.471 340 HB2 ARG 52 2HB ARG 52 3.714 -3.602 -24.503 341 HB3 ARG 52 3HB ARG 52 4.194 -2.186 -23.578 342 HG2 ARG 52 2HG ARG 52 6.595 -2.850 -24.374 343 HG3 ARG 52 3HG ARG 52 5.710 -3.709 -25.637 344 HD2 ARG 52 2HD ARG 52 4.467 -1.256 -25.564 345 HD3 ARG 52 3HD ARG 52 6.158 -0.851 -25.270 346 HE ARG 52 HE ARG 52 5.740 -2.642 -27.487 347 HH11 ARG 52 1HH1 ARG 52 5.926 0.680 -26.463 348 HH12 ARG 52 2HH1 ARG 52 6.331 1.279 -28.038 349 HH21 ARG 52 1HH2 ARG 52 6.273 -1.865 -29.565 350 HH22 ARG 52 2HH2 ARG 52 6.527 -0.170 -29.801 351 H LEU 53 H LEU 53 4.833 -2.021 -21.249 352 HA LEU 53 HA LEU 53 2.477 -2.977 -19.768 353 HB2 LEU 53 2HB LEU 53 4.127 -3.379 -18.211 354 HB3 LEU 53 3HB LEU 53 5.104 -2.011 -18.740 355 HG LEU 53 HG LEU 53 3.535 -0.476 -17.645 356 HD11 LEU 53 1HD1 LEU 53 1.937 -2.892 -17.464 357 HD12 LEU 53 2HD1 LEU 53 1.455 -1.202 -17.324 358 HD13 LEU 53 3HD1 LEU 53 2.082 -2.058 -15.916 359 HD21 LEU 53 3HD2 LEU 53 5.466 -1.238 -16.402 360 HD22 LEU 53 1HD2 LEU 53 4.594 -2.679 -15.878 361 HD23 LEU 53 2HD2 LEU 53 4.080 -1.086 -15.320 362 H THR 54 H THR 54 0.908 -1.509 -19.437 363 HA THR 54 HA THR 54 1.507 1.312 -20.038 364 HB THR 54 HB THR 54 -0.857 1.448 -20.957 365 HG1 THR 54 HG1 THR 54 -1.805 -0.494 -21.586 366 HG21 THR 54 3HG2 THR 54 -0.148 0.246 -23.143 367 HG22 THR 54 1HG2 THR 54 1.376 -0.031 -22.302 368 HG23 THR 54 2HG2 THR 54 0.806 1.615 -22.575 369 H TYR 55 H TYR 55 0.289 2.867 -18.914 370 HA TYR 55 HA TYR 55 -1.417 1.883 -16.740 371 HB2 TYR 55 2HB TYR 55 0.716 2.171 -15.679 372 HB3 TYR 55 3HB TYR 55 0.946 3.741 -16.439 373 HD1 TYR 55 HD2 TYR 55 -1.868 2.211 -14.505 374 HD2 TYR 55 HD1 TYR 55 0.911 5.415 -14.855 375 HE1 TYR 55 HE2 TYR 55 -2.886 3.301 -12.549 376 HE2 TYR 55 HE1 TYR 55 -0.099 6.513 -12.900 377 HH TYR 55 HH TYR 55 -2.805 5.017 -11.148 378 H LYS 56 H LYS 56 -3.251 2.991 -16.572 379 HA LYS 56 HA LYS 56 -4.875 4.535 -16.967 380 HB2 LYS 56 2HB LYS 56 -2.958 5.805 -15.602 381 HB3 LYS 56 3HB LYS 56 -2.896 6.754 -17.081 382 HG2 LYS 56 2HG LYS 56 -5.606 6.550 -16.481 383 HG3 LYS 56 3HG LYS 56 -4.810 6.823 -14.929 384 HD2 LYS 56 2HD LYS 56 -4.912 8.992 -15.511 385 HD3 LYS 56 3HD LYS 56 -3.513 8.610 -16.518 386 HE2 LYS 56 2HE LYS 56 -5.604 7.868 -18.119 387 HE3 LYS 56 3HE LYS 56 -6.262 9.271 -17.277 388 HZ1 LYS 56 3HZ LYS 56 -3.568 9.600 -18.282 389 HZ2 LYS 56 1HZ LYS 56 -4.886 10.659 -18.346 390 HZ3 LYS 56 2HZ LYS 56 -4.750 9.410 -19.478 391 H GLY 57 H GLY 57 -3.650 3.310 -19.263 392 HA2 GLY 57 2HA GLY 57 -3.896 3.478 -21.547 393 HA3 GLY 57 3HA GLY 57 -4.716 5.011 -21.288 394 H ARG 58 H ARG 58 -1.662 4.861 -19.822 395 HA ARG 58 HA ARG 58 -0.463 6.306 -22.095 396 HB2 ARG 58 2HB ARG 58 -1.041 7.362 -19.619 397 HB3 ARG 58 3HB ARG 58 0.653 6.916 -19.457 398 HG2 ARG 58 2HG ARG 58 1.339 8.400 -21.082 399 HG3 ARG 58 3HG ARG 58 -0.250 8.459 -21.845 400 HD2 ARG 58 2HD ARG 58 -0.679 10.317 -20.707 401 HD3 ARG 58 3HD ARG 58 -0.608 9.378 -19.217 402 HE ARG 58 HE ARG 58 1.416 10.336 -18.762 403 HH11 ARG 58 1HH1 ARG 58 0.693 10.777 -22.138 404 HH12 ARG 58 2HH1 ARG 58 2.050 11.815 -22.427 405 HH21 ARG 58 1HH2 ARG 58 3.205 11.701 -19.129 406 HH22 ARG 58 2HH2 ARG 58 3.479 12.339 -20.715 407 H ALA 59 H ALA 59 1.820 6.099 -22.365 408 HA ALA 59 HA ALA 59 2.841 3.542 -21.340 409 HB1 ALA 59 1HB ALA 59 3.338 3.163 -23.470 410 HB2 ALA 59 2HB ALA 59 2.908 4.814 -23.918 411 HB3 ALA 59 3HB ALA 59 4.542 4.448 -23.365 412 H LEU 60 H LEU 60 4.281 3.628 -19.756 413 HA LEU 60 HA LEU 60 5.954 6.036 -19.495 414 HB2 LEU 60 2HB LEU 60 4.893 4.093 -17.468 415 HB3 LEU 60 3HB LEU 60 6.246 5.164 -17.106 416 HG LEU 60 HG LEU 60 4.374 6.921 -18.039 417 HD11 LEU 60 1HD1 LEU 60 2.742 4.999 -18.076 418 HD12 LEU 60 2HD1 LEU 60 2.250 6.408 -17.137 419 HD13 LEU 60 3HD1 LEU 60 2.864 4.973 -16.316 420 HD21 LEU 60 3HD2 LEU 60 5.455 7.590 -16.147 421 HD22 LEU 60 1HD2 LEU 60 5.284 6.021 -15.359 422 HD23 LEU 60 2HD2 LEU 60 3.908 7.121 -15.440 423 H LYS 61 H LYS 61 8.157 5.776 -18.859 424 HA LYS 61 HA LYS 61 9.397 3.217 -18.718 425 HB2 LYS 61 2HB LYS 61 10.820 4.032 -20.896 426 HB3 LYS 61 3HB LYS 61 9.527 2.841 -20.936 427 HG2 LYS 61 2HG LYS 61 7.944 4.470 -21.651 428 HG3 LYS 61 3HG LYS 61 9.092 5.784 -21.380 429 HD2 LYS 61 2HD LYS 61 9.130 5.433 -23.699 430 HD3 LYS 61 3HD LYS 61 10.572 4.608 -23.102 431 HE2 LYS 61 2HE LYS 61 9.783 2.564 -23.646 432 HE3 LYS 61 3HE LYS 61 8.124 2.974 -23.214 433 HZ1 LYS 61 3HZ LYS 61 9.091 4.363 -25.540 434 HZ2 LYS 61 1HZ LYS 61 7.642 3.521 -25.308 435 HZ3 LYS 61 2HZ LYS 61 9.049 2.683 -25.733 436 H ASP 62 H ASP 62 10.572 6.213 -20.221 437 HA ASP 62 HA ASP 62 12.835 6.296 -18.462 438 HB2 ASP 62 2HB ASP 62 11.818 8.197 -20.579 439 HB3 ASP 62 3HB ASP 62 13.287 8.486 -19.650 440 H THR 63 H THR 63 9.674 7.176 -18.056 441 HA THR 63 HA THR 63 9.770 9.676 -16.819 442 HB THR 63 HB THR 63 7.847 8.130 -15.428 443 HG1 THR 63 HG1 THR 63 7.585 7.656 -18.202 444 HG21 THR 63 3HG2 THR 63 6.992 10.154 -15.927 445 HG22 THR 63 1HG2 THR 63 6.455 9.373 -17.413 446 HG23 THR 63 2HG2 THR 63 7.951 10.306 -17.399 447 H GLU 64 H GLU 64 10.949 6.640 -15.757 448 HA GLU 64 HA GLU 64 12.056 5.988 -13.879 449 HB2 GLU 64 2HB GLU 64 12.328 8.902 -13.904 450 HB3 GLU 64 3HB GLU 64 12.436 8.209 -12.292 451 HG2 GLU 64 2HG GLU 64 14.061 6.534 -13.612 452 HG3 GLU 64 3HG GLU 64 14.280 7.993 -14.577 453 H THR 65 H THR 65 10.410 8.730 -12.371 454 HA THR 65 HA THR 65 9.065 6.848 -10.569 455 HB THR 65 HB THR 65 10.322 8.507 -9.384 456 HG1 THR 65 HG1 THR 65 8.727 8.962 -8.037 457 HG21 THR 65 3HG2 THR 65 10.688 10.288 -10.819 458 HG22 THR 65 1HG2 THR 65 9.523 10.972 -9.686 459 HG23 THR 65 2HG2 THR 65 8.988 10.409 -11.270 460 H LEU 66 H LEU 66 6.837 7.291 -9.932 461 HA LEU 66 HA LEU 66 5.284 8.464 -12.144 462 HB2 LEU 66 2HB LEU 66 5.214 5.880 -11.111 463 HB3 LEU 66 3HB LEU 66 3.787 6.669 -10.442 464 HG LEU 66 HG LEU 66 4.325 6.823 -13.379 465 HD11 LEU 66 1HD1 LEU 66 3.794 4.398 -11.868 466 HD12 LEU 66 2HD1 LEU 66 4.261 4.603 -13.555 467 HD13 LEU 66 3HD1 LEU 66 2.565 4.726 -13.090 468 HD21 LEU 66 3HD2 LEU 66 2.502 8.092 -12.078 469 HD22 LEU 66 1HD2 LEU 66 1.697 6.527 -11.969 470 HD23 LEU 66 2HD2 LEU 66 2.040 7.234 -13.548 471 H GLU 67 H GLU 67 6.193 8.934 -8.999 472 HA GLU 67 HA GLU 67 3.862 9.722 -7.685 473 HB2 GLU 67 2HB GLU 67 5.324 11.049 -6.230 474 HB3 GLU 67 3HB GLU 67 5.997 9.453 -6.531 475 HG2 GLU 67 2HG GLU 67 7.881 10.607 -6.905 476 HG3 GLU 67 3HG GLU 67 7.182 10.837 -8.507 477 H SER 68 H SER 68 5.971 11.500 -9.883 478 HA SER 68 HA SER 68 4.713 14.021 -9.538 479 HB2 SER 68 2HB SER 68 6.854 12.918 -11.132 480 HB3 SER 68 3HB SER 68 5.828 13.958 -12.120 481 HG SER 68 HG SER 68 7.695 14.800 -10.626 482 H LEU 69 H LEU 69 3.781 11.188 -11.161 483 HA LEU 69 HA LEU 69 1.959 12.623 -12.951 484 HB2 LEU 69 2HB LEU 69 3.051 9.856 -12.845 485 HB3 LEU 69 3HB LEU 69 1.489 10.115 -13.619 486 HG LEU 69 HG LEU 69 2.472 11.560 -15.260 487 HD11 LEU 69 1HD1 LEU 69 4.935 11.946 -15.275 488 HD12 LEU 69 2HD1 LEU 69 4.998 11.274 -13.646 489 HD13 LEU 69 3HD1 LEU 69 4.082 12.748 -13.956 490 HD21 LEU 69 3HD2 LEU 69 2.791 8.935 -15.251 491 HD22 LEU 69 1HD2 LEU 69 4.494 9.385 -15.167 492 HD23 LEU 69 2HD2 LEU 69 3.499 9.950 -16.509 493 H GLY 70 H GLY 70 2.018 11.091 -9.932 494 HA2 GLY 70 2HA GLY 70 0.069 11.373 -8.512 495 HA3 GLY 70 3HA GLY 70 -0.932 11.025 -9.914 496 H VAL 71 H VAL 71 1.182 9.653 -7.480 497 HA VAL 71 HA VAL 71 0.562 6.937 -8.336 498 HB VAL 71 HB VAL 71 2.052 6.265 -6.446 499 HG11 VAL 71 1HG1 VAL 71 3.367 6.215 -8.265 500 HG12 VAL 71 2HG1 VAL 71 2.831 7.802 -8.819 501 HG13 VAL 71 3HG1 VAL 71 4.081 7.675 -7.581 502 HG21 VAL 71 3HG2 VAL 71 1.687 8.994 -5.716 503 HG22 VAL 71 1HG2 VAL 71 2.543 7.722 -4.845 504 HG23 VAL 71 2HG2 VAL 71 3.402 8.717 -6.021 505 H ALA 72 H ALA 72 -0.673 5.497 -7.198 506 HA ALA 72 HA ALA 72 -1.854 6.333 -4.661 507 HB1 ALA 72 1HB ALA 72 -3.657 5.323 -6.836 508 HB2 ALA 72 2HB ALA 72 -4.083 6.141 -5.332 509 HB3 ALA 72 3HB ALA 72 -3.318 7.043 -6.640 510 H ASP 73 H ASP 73 -2.579 4.634 -3.370 511 HA ASP 73 HA ASP 73 -1.255 2.162 -3.721 512 HB2 ASP 73 2HB ASP 73 -2.031 3.299 -1.537 513 HB3 ASP 73 3HB ASP 73 -3.594 2.556 -1.869 514 H GLY 74 H GLY 74 -2.068 0.098 -4.162 515 HA2 GLY 74 2HA GLY 74 -3.458 -1.475 -5.105 516 HA3 GLY 74 3HA GLY 74 -4.803 -0.390 -4.785 517 H ASP 75 H ASP 75 -2.113 0.756 -6.637 518 HA ASP 75 HA ASP 75 -3.600 1.639 -8.788 519 HB2 ASP 75 2HB ASP 75 -1.064 1.987 -8.104 520 HB3 ASP 75 3HB ASP 75 -0.807 0.708 -9.289 521 H LYS 76 H LYS 76 -3.389 0.886 -11.094 522 HA LYS 76 HA LYS 76 -3.501 -2.053 -11.254 523 HB2 LYS 76 2HB LYS 76 -5.343 -0.041 -12.553 524 HB3 LYS 76 3HB LYS 76 -5.291 -1.743 -12.994 525 HG2 LYS 76 2HG LYS 76 -5.868 -2.309 -10.644 526 HG3 LYS 76 3HG LYS 76 -6.068 -0.584 -10.327 527 HD2 LYS 76 2HD LYS 76 -8.205 -0.913 -10.919 528 HD3 LYS 76 3HD LYS 76 -7.591 -0.943 -12.574 529 HE2 LYS 76 2HE LYS 76 -7.171 -3.521 -11.636 530 HE3 LYS 76 3HE LYS 76 -8.744 -3.073 -10.979 531 HZ1 LYS 76 3HZ LYS 76 -9.321 -3.901 -13.017 532 HZ2 LYS 76 1HZ LYS 76 -7.914 -3.353 -13.781 533 HZ3 LYS 76 2HZ LYS 76 -9.150 -2.262 -13.403 534 H PHE 77 H PHE 77 -2.263 -2.938 -12.780 535 HA PHE 77 HA PHE 77 -1.163 -1.168 -14.864 536 HB2 PHE 77 2HB PHE 77 0.095 -3.330 -13.222 537 HB3 PHE 77 3HB PHE 77 0.705 -3.023 -14.845 538 HD1 PHE 77 HD2 PHE 77 0.711 -0.214 -15.181 539 HD2 PHE 77 HD1 PHE 77 1.507 -2.454 -11.650 540 HE1 PHE 77 HE2 PHE 77 2.076 1.641 -14.316 541 HE2 PHE 77 HE1 PHE 77 2.873 -0.601 -10.779 542 HZ PHE 77 HZ PHE 77 3.159 1.449 -12.113 543 H VAL 78 H VAL 78 -1.002 -1.940 -16.963 544 HA VAL 78 HA VAL 78 -2.584 -4.362 -17.512 545 HB VAL 78 HB VAL 78 -2.074 -1.991 -19.314 546 HG11 VAL 78 1HG1 VAL 78 -3.151 -4.675 -19.792 547 HG12 VAL 78 2HG1 VAL 78 -4.159 -3.360 -20.400 548 HG13 VAL 78 3HG1 VAL 78 -2.480 -3.501 -20.924 549 HG21 VAL 78 3HG2 VAL 78 -4.710 -1.975 -18.999 550 HG22 VAL 78 1HG2 VAL 78 -4.274 -2.718 -17.460 551 HG23 VAL 78 2HG2 VAL 78 -3.631 -1.132 -17.887 552 H LEU 79 H LEU 79 -1.506 -6.067 -18.230 553 HA LEU 79 HA LEU 79 1.141 -5.662 -19.441 554 HB2 LEU 79 2HB LEU 79 0.701 -7.132 -17.344 555 HB3 LEU 79 3HB LEU 79 0.102 -8.309 -18.511 556 HG LEU 79 HG LEU 79 2.432 -8.729 -17.844 557 HD11 LEU 79 1HD1 LEU 79 1.442 -9.192 -20.175 558 HD12 LEU 79 2HD1 LEU 79 3.191 -9.277 -19.968 559 HD13 LEU 79 3HD1 LEU 79 2.459 -7.853 -20.706 560 HD21 LEU 79 3HD2 LEU 79 2.784 -6.084 -17.782 561 HD22 LEU 79 1HD2 LEU 79 3.404 -6.408 -19.402 562 HD23 LEU 79 2HD2 LEU 79 4.116 -7.219 -18.007 563 H ILE 80 H ILE 80 1.369 -5.971 -21.549 564 HA ILE 80 HA ILE 80 -0.643 -7.606 -22.952 565 HB ILE 80 HB ILE 80 -0.764 -5.242 -23.584 566 HG12 ILE 80 2HG1 ILE 80 0.422 -6.960 -25.775 567 HG13 ILE 80 3HG1 ILE 80 -1.258 -7.002 -25.251 568 HG21 ILE 80 1HG2 ILE 80 1.992 -5.298 -23.337 569 HG22 ILE 80 2HG2 ILE 80 1.720 -5.119 -25.070 570 HG23 ILE 80 3HG2 ILE 80 1.020 -3.957 -23.943 571 HD11 ILE 80 3HD1 ILE 80 0.092 -5.174 -27.056 572 HD12 ILE 80 1HD1 ILE 80 -1.626 -5.532 -26.875 573 HD13 ILE 80 2HD1 ILE 80 -0.855 -4.348 -25.819 574 H THR 81 H THR 81 0.046 -9.314 -24.078 575 HA THR 81 HA THR 81 2.951 -9.622 -24.473 576 HB THR 81 HB THR 81 2.177 -11.295 -22.934 577 HG1 THR 81 HG1 THR 81 3.524 -12.455 -24.100 578 HG21 THR 81 3HG2 THR 81 0.095 -11.979 -25.013 579 HG22 THR 81 1HG2 THR 81 -0.203 -11.240 -23.440 580 HG23 THR 81 2HG2 THR 81 0.400 -12.895 -23.537 581 H ARG 82 H ARG 82 3.701 -9.915 -26.482 582 HA ARG 82 HA ARG 82 1.726 -10.217 -28.641 583 HB2 ARG 82 2HB ARG 82 3.365 -8.180 -28.435 584 HB3 ARG 82 3HB ARG 82 4.539 -9.304 -29.106 585 HG2 ARG 82 2HG ARG 82 2.608 -9.685 -30.878 586 HG3 ARG 82 3HG ARG 82 2.169 -8.053 -30.368 587 HD2 ARG 82 2HD ARG 82 4.256 -7.178 -31.030 588 HD3 ARG 82 3HD ARG 82 4.967 -8.784 -31.182 589 HE ARG 82 HE ARG 82 2.848 -8.647 -32.973 590 HH11 ARG 82 1HH1 ARG 82 5.923 -7.098 -32.460 591 HH12 ARG 82 2HH1 ARG 82 6.183 -6.766 -34.141 592 HH21 ARG 82 1HH2 ARG 82 3.179 -8.215 -35.189 593 HH22 ARG 82 2HH2 ARG 82 4.621 -7.401 -35.692 594 H THR 83 H THR 83 1.845 -11.886 -30.036 595 HA THR 83 HA THR 83 2.454 -13.886 -30.937 596 HB THR 83 HB THR 83 5.279 -13.147 -30.158 597 HG1 THR 83 HG1 THR 83 5.171 -11.683 -31.672 598 HG21 THR 83 3HG2 THR 83 5.024 -15.466 -30.853 599 HG22 THR 83 1HG2 THR 83 5.880 -14.550 -32.093 600 HG23 THR 83 2HG2 THR 83 4.177 -14.955 -32.313 601 H VAL 84 H VAL 84 1.297 -14.709 -28.977 602 HA VAL 84 HA VAL 84 3.133 -16.152 -27.180 603 HB VAL 84 HB VAL 84 1.610 -14.561 -26.044 604 HG11 VAL 84 1HG1 VAL 84 -0.254 -15.228 -27.827 605 HG12 VAL 84 2HG1 VAL 84 -0.722 -16.325 -26.526 606 HG13 VAL 84 3HG1 VAL 84 -0.654 -14.587 -26.233 607 HG21 VAL 84 3HG2 VAL 84 2.372 -16.961 -25.202 608 HG22 VAL 84 1HG2 VAL 84 1.311 -15.927 -24.245 609 HG23 VAL 84 2HG2 VAL 84 0.630 -17.237 -25.210 610 H GLY 85 H GLY 85 3.022 -18.334 -27.035 611 HA2 GLY 85 2HA GLY 85 1.042 -20.104 -27.362 612 HA3 GLY 85 3HA GLY 85 1.412 -19.702 -29.032 Start of MODEL 16 1 H1 MET 9 H MET 9 1.370 0.460 0.091 2 HA MET 9 HA MET 9 2.133 0.463 -2.327 3 HB2 MET 9 2HB MET 9 3.752 -1.095 -0.305 4 HB3 MET 9 3HB MET 9 4.380 -0.499 -1.835 5 HG2 MET 9 2HG MET 9 3.132 1.653 -0.444 6 HG3 MET 9 3HG MET 9 4.252 0.833 0.641 7 HE1 MET 9 3HE MET 9 5.807 2.264 1.113 8 HE2 MET 9 1HE MET 9 7.144 2.799 0.095 9 HE3 MET 9 2HE MET 9 5.671 3.763 0.192 10 H LYS 10 H LYS 10 0.219 -1.109 -2.959 11 HA LYS 10 HA LYS 10 1.492 -3.583 -3.916 12 HB2 LYS 10 2HB LYS 10 -1.093 -3.227 -2.483 13 HB3 LYS 10 3HB LYS 10 -1.040 -4.414 -3.780 14 HG2 LYS 10 2HG LYS 10 1.088 -5.264 -2.547 15 HG3 LYS 10 3HG LYS 10 0.405 -4.393 -1.172 16 HD2 LYS 10 2HD LYS 10 -1.639 -5.945 -2.455 17 HD3 LYS 10 3HD LYS 10 -0.253 -6.973 -2.081 18 HE2 LYS 10 2HE LYS 10 -1.405 -5.087 -0.050 19 HE3 LYS 10 3HE LYS 10 -2.080 -6.697 -0.296 20 HZ1 LYS 10 3HZ LYS 10 -0.067 -6.134 1.384 21 HZ2 LYS 10 1HZ LYS 10 0.791 -6.630 0.013 22 HZ3 LYS 10 2HZ LYS 10 -0.350 -7.662 0.716 23 H ILE 11 H ILE 11 0.751 -4.362 -5.940 24 HA ILE 11 HA ILE 11 -0.978 -2.564 -7.478 25 HB ILE 11 HB ILE 11 1.748 -3.489 -8.393 26 HG12 ILE 11 2HG1 ILE 11 1.878 -0.867 -8.688 27 HG13 ILE 11 3HG1 ILE 11 0.624 -0.881 -7.453 28 HG21 ILE 11 1HG2 ILE 11 0.160 -3.595 -10.220 29 HG22 ILE 11 2HG2 ILE 11 -0.383 -1.954 -9.873 30 HG23 ILE 11 3HG2 ILE 11 1.258 -2.235 -10.453 31 HD11 ILE 11 3HD1 ILE 11 3.315 -0.877 -6.999 32 HD12 ILE 11 1HD1 ILE 11 2.078 -1.357 -5.837 33 HD13 ILE 11 2HD1 ILE 11 2.898 -2.580 -6.808 34 H LYS 12 H LYS 12 -2.153 -3.542 -9.097 35 HA LYS 12 HA LYS 12 -1.905 -6.474 -9.266 36 HB2 LYS 12 2HB LYS 12 -4.059 -5.066 -8.315 37 HB3 LYS 12 3HB LYS 12 -4.504 -5.319 -9.998 38 HG2 LYS 12 2HG LYS 12 -3.973 -7.769 -9.621 39 HG3 LYS 12 3HG LYS 12 -3.922 -7.384 -7.899 40 HD2 LYS 12 2HD LYS 12 -6.244 -6.339 -8.281 41 HD3 LYS 12 3HD LYS 12 -6.246 -7.248 -9.794 42 HE2 LYS 12 2HE LYS 12 -7.330 -8.641 -8.247 43 HE3 LYS 12 3HE LYS 12 -5.697 -9.292 -8.378 44 HZ1 LYS 12 3HZ LYS 12 -6.090 -9.240 -6.110 45 HZ2 LYS 12 1HZ LYS 12 -6.897 -7.754 -6.164 46 HZ3 LYS 12 2HZ LYS 12 -5.218 -7.813 -6.360 47 H ILE 13 H ILE 13 -1.200 -7.135 -11.177 48 HA ILE 13 HA ILE 13 -1.938 -5.573 -13.566 49 HB ILE 13 HB ILE 13 0.432 -5.366 -13.213 50 HG12 ILE 13 2HG1 ILE 13 0.574 -7.430 -15.305 51 HG13 ILE 13 3HG1 ILE 13 -0.717 -6.255 -15.533 52 HG21 ILE 13 1HG2 ILE 13 1.613 -6.945 -12.198 53 HG22 ILE 13 2HG2 ILE 13 0.209 -8.011 -12.231 54 HG23 ILE 13 3HG2 ILE 13 1.361 -8.029 -13.566 55 HD11 ILE 13 3HD1 ILE 13 1.160 -4.515 -15.092 56 HD12 ILE 13 1HD1 ILE 13 2.233 -5.848 -15.517 57 HD13 ILE 13 2HD1 ILE 13 1.023 -5.288 -16.672 58 H VAL 14 H VAL 14 -3.315 -6.611 -14.834 59 HA VAL 14 HA VAL 14 -3.391 -9.545 -14.763 60 HB VAL 14 HB VAL 14 -5.529 -8.605 -14.282 61 HG11 VAL 14 1HG1 VAL 14 -6.361 -7.229 -16.550 62 HG12 VAL 14 2HG1 VAL 14 -5.962 -6.535 -14.977 63 HG13 VAL 14 3HG1 VAL 14 -4.732 -6.632 -16.237 64 HG21 VAL 14 3HG2 VAL 14 -6.764 -9.886 -15.692 65 HG22 VAL 14 1HG2 VAL 14 -5.998 -9.227 -17.137 66 HG23 VAL 14 2HG2 VAL 14 -5.166 -10.451 -16.179 67 HA PRO 15 HA PRO 15 -1.316 -9.248 -18.741 68 HB2 PRO 15 2HB PRO 15 -0.847 -11.914 -18.951 69 HB3 PRO 15 3HB PRO 15 0.144 -10.840 -17.957 70 HG2 PRO 15 2HG PRO 15 -2.082 -12.665 -17.135 71 HG3 PRO 15 3HG PRO 15 -0.517 -12.385 -16.350 72 HD2 PRO 15 2HD PRO 15 -2.808 -11.234 -15.481 73 HD3 PRO 15 3HD PRO 15 -1.227 -10.438 -15.343 74 H ALA 16 H ALA 16 -2.127 -9.381 -20.755 75 HA ALA 16 HA ALA 16 -3.420 -10.019 -22.533 76 HB1 ALA 16 1HB ALA 16 -4.819 -12.140 -20.984 77 HB2 ALA 16 2HB ALA 16 -4.270 -12.139 -22.661 78 HB3 ALA 16 3HB ALA 16 -3.107 -12.351 -21.352 79 H VAL 17 H VAL 17 -5.293 -10.486 -19.528 80 HA VAL 17 HA VAL 17 -7.204 -9.500 -18.770 81 HB VAL 17 HB VAL 17 -7.001 -7.515 -21.026 82 HG11 VAL 17 1HG1 VAL 17 -8.947 -6.949 -20.031 83 HG12 VAL 17 2HG1 VAL 17 -8.528 -7.747 -18.514 84 HG13 VAL 17 3HG1 VAL 17 -7.877 -6.149 -18.880 85 HG21 VAL 17 3HG2 VAL 17 -5.666 -6.110 -19.499 86 HG22 VAL 17 1HG2 VAL 17 -5.578 -7.460 -18.367 87 HG23 VAL 17 2HG2 VAL 17 -4.829 -7.592 -19.958 88 H GLY 18 H GLY 18 -9.398 -9.739 -19.103 89 HA2 GLY 18 2HA GLY 18 -11.359 -10.078 -20.348 90 HA3 GLY 18 3HA GLY 18 -10.384 -10.222 -21.803 91 H GLY 19 H GLY 19 -8.590 -12.202 -21.009 92 HA2 GLY 19 2HA GLY 19 -10.408 -14.497 -20.594 93 HA3 GLY 19 3HA GLY 19 -9.076 -14.528 -21.740 94 H GLY 20 H GLY 20 -7.553 -12.900 -19.584 95 HA2 GLY 20 2HA GLY 20 -6.550 -15.290 -18.211 96 HA3 GLY 20 3HA GLY 20 -5.692 -13.767 -18.390 97 H SER 21 H SER 21 -5.301 -14.191 -16.051 98 HA SER 21 HA SER 21 -7.491 -13.031 -14.462 99 HB2 SER 21 2HB SER 21 -6.240 -14.491 -12.580 100 HB3 SER 21 3HB SER 21 -7.585 -15.116 -13.533 101 HG SER 21 HG SER 21 -4.920 -15.804 -13.573 102 HA PRO 22 HA PRO 22 -4.585 -10.046 -13.076 103 HB2 PRO 22 2HB PRO 22 -5.554 -9.509 -10.598 104 HB3 PRO 22 3HB PRO 22 -6.356 -8.974 -12.079 105 HG2 PRO 22 2HG PRO 22 -6.971 -11.329 -10.337 106 HG3 PRO 22 3HG PRO 22 -8.085 -10.175 -11.094 107 HD2 PRO 22 2HD PRO 22 -7.616 -12.636 -12.123 108 HD3 PRO 22 3HD PRO 22 -7.986 -11.229 -13.141 109 H LEU 23 H LEU 23 -2.754 -9.780 -11.804 110 HA LEU 23 HA LEU 23 -2.121 -11.983 -9.955 111 HB2 LEU 23 2HB LEU 23 -0.957 -11.731 -12.360 112 HB3 LEU 23 3HB LEU 23 0.101 -10.687 -11.413 113 HG LEU 23 HG LEU 23 -0.410 -13.335 -10.237 114 HD11 LEU 23 1HD1 LEU 23 1.383 -13.161 -12.642 115 HD12 LEU 23 2HD1 LEU 23 -0.278 -13.745 -12.733 116 HD13 LEU 23 3HD1 LEU 23 0.902 -14.594 -11.733 117 HD21 LEU 23 3HD2 LEU 23 1.731 -13.098 -9.443 118 HD22 LEU 23 1HD2 LEU 23 1.249 -11.409 -9.601 119 HD23 LEU 23 2HD2 LEU 23 2.263 -12.156 -10.836 120 H GLU 24 H GLU 24 -1.333 -11.411 -8.015 121 HA GLU 24 HA GLU 24 -1.100 -8.568 -7.436 122 HB2 GLU 24 2HB GLU 24 -1.294 -11.040 -5.736 123 HB3 GLU 24 3HB GLU 24 -0.823 -9.495 -5.041 124 HG2 GLU 24 2HG GLU 24 -3.176 -9.172 -6.646 125 HG3 GLU 24 3HG GLU 24 -3.409 -10.465 -5.471 126 H LEU 25 H LEU 25 0.767 -7.528 -7.175 127 HA LEU 25 HA LEU 25 3.176 -9.015 -6.459 128 HB2 LEU 25 2HB LEU 25 2.639 -8.288 -9.089 129 HB3 LEU 25 3HB LEU 25 3.755 -7.053 -8.508 130 HG LEU 25 HG LEU 25 4.750 -9.620 -7.753 131 HD11 LEU 25 1HD1 LEU 25 3.889 -10.867 -9.422 132 HD12 LEU 25 2HD1 LEU 25 5.181 -10.115 -10.358 133 HD13 LEU 25 3HD1 LEU 25 3.543 -9.468 -10.439 134 HD21 LEU 25 3HD2 LEU 25 5.610 -7.323 -9.457 135 HD22 LEU 25 1HD2 LEU 25 6.545 -8.818 -9.461 136 HD23 LEU 25 2HD2 LEU 25 6.307 -7.932 -7.955 137 H GLU 26 H GLU 26 4.948 -7.617 -5.776 138 HA GLU 26 HA GLU 26 3.939 -5.083 -4.671 139 HB2 GLU 26 2HB GLU 26 5.867 -5.369 -3.034 140 HB3 GLU 26 3HB GLU 26 4.524 -6.492 -2.871 141 HG2 GLU 26 2HG GLU 26 5.783 -8.271 -3.369 142 HG3 GLU 26 3HG GLU 26 6.666 -7.420 -4.636 143 H VAL 27 H VAL 27 4.559 -3.433 -5.908 144 HA VAL 27 HA VAL 27 7.404 -3.179 -6.553 145 HB VAL 27 HB VAL 27 6.774 -2.249 -8.812 146 HG11 VAL 27 1HG1 VAL 27 6.258 -4.638 -9.728 147 HG12 VAL 27 2HG1 VAL 27 7.805 -4.307 -8.946 148 HG13 VAL 27 3HG1 VAL 27 6.522 -5.126 -8.054 149 HG21 VAL 27 3HG2 VAL 27 4.607 -3.101 -9.739 150 HG22 VAL 27 1HG2 VAL 27 4.140 -3.521 -8.091 151 HG23 VAL 27 2HG2 VAL 27 4.441 -1.837 -8.521 152 H ALA 28 H ALA 28 7.900 -0.919 -7.357 153 HA ALA 28 HA ALA 28 6.115 1.058 -6.101 154 HB1 ALA 28 1HB ALA 28 8.321 2.292 -5.555 155 HB2 ALA 28 2HB ALA 28 7.814 0.949 -4.529 156 HB3 ALA 28 3HB ALA 28 9.065 0.705 -5.748 157 HA PRO 29 HA PRO 29 6.472 2.704 -10.252 158 HB2 PRO 29 2HB PRO 29 4.650 4.683 -9.888 159 HB3 PRO 29 3HB PRO 29 4.195 3.000 -10.180 160 HG2 PRO 29 2HG PRO 29 4.340 4.502 -7.594 161 HG3 PRO 29 3HG PRO 29 3.097 3.373 -8.164 162 HD2 PRO 29 2HD PRO 29 5.033 2.647 -6.415 163 HD3 PRO 29 3HD PRO 29 4.344 1.518 -7.600 164 H ASN 30 H ASN 30 7.208 4.158 -7.245 165 HA ASN 30 HA ASN 30 8.078 6.680 -8.380 166 HB2 ASN 30 2HB ASN 30 8.610 5.709 -5.575 167 HB3 ASN 30 3HB ASN 30 8.525 7.370 -6.155 168 HD21 ASN 30 1HD2 ASN 30 7.067 5.940 -4.015 169 HD22 ASN 30 2HD2 ASN 30 5.393 6.181 -4.368 170 H ALA 31 H ALA 31 9.302 3.784 -8.721 171 HA ALA 31 HA ALA 31 12.090 4.545 -8.172 172 HB1 ALA 31 1HB ALA 31 10.779 1.862 -8.516 173 HB2 ALA 31 2HB ALA 31 12.530 2.077 -8.549 174 HB3 ALA 31 3HB ALA 31 11.617 2.500 -7.101 175 H THR 32 H THR 32 10.727 2.269 -10.525 176 HA THR 32 HA THR 32 11.482 3.917 -12.769 177 HB THR 32 HB THR 32 12.796 1.272 -12.918 178 HG1 THR 32 HG1 THR 32 14.138 1.603 -11.320 179 HG21 THR 32 3HG2 THR 32 14.455 3.506 -13.566 180 HG22 THR 32 1HG2 THR 32 12.858 3.758 -14.268 181 HG23 THR 32 2HG2 THR 32 13.765 2.292 -14.643 182 H VAL 33 H VAL 33 10.504 3.292 -14.671 183 HA VAL 33 HA VAL 33 8.221 1.623 -14.455 184 HB VAL 33 HB VAL 33 9.534 2.748 -16.934 185 HG11 VAL 33 1HG1 VAL 33 7.274 0.972 -16.558 186 HG12 VAL 33 2HG1 VAL 33 6.818 2.457 -17.396 187 HG13 VAL 33 3HG1 VAL 33 8.108 1.440 -18.039 188 HG21 VAL 33 3HG2 VAL 33 8.049 4.582 -16.765 189 HG22 VAL 33 1HG2 VAL 33 7.120 3.806 -15.482 190 HG23 VAL 33 2HG2 VAL 33 8.757 4.380 -15.162 191 H GLY 34 H GLY 34 11.324 1.242 -16.155 192 HA2 GLY 34 2HA GLY 34 10.749 -1.307 -17.238 193 HA3 GLY 34 3HA GLY 34 12.351 -0.614 -17.037 194 H ALA 35 H ALA 35 12.107 -0.295 -14.161 195 HA ALA 35 HA ALA 35 13.077 -2.831 -13.362 196 HB1 ALA 35 1HB ALA 35 13.191 -1.876 -11.122 197 HB2 ALA 35 2HB ALA 35 13.823 -0.747 -12.322 198 HB3 ALA 35 3HB ALA 35 12.212 -0.506 -11.646 199 H VAL 36 H VAL 36 10.014 -1.138 -12.770 200 HA VAL 36 HA VAL 36 8.892 -3.136 -11.105 201 HB VAL 36 HB VAL 36 7.512 -1.041 -12.790 202 HG11 VAL 36 1HG1 VAL 36 5.660 -2.197 -12.300 203 HG12 VAL 36 2HG1 VAL 36 6.487 -3.185 -11.094 204 HG13 VAL 36 3HG1 VAL 36 5.877 -1.589 -10.659 205 HG21 VAL 36 3HG2 VAL 36 7.528 -0.657 -9.915 206 HG22 VAL 36 1HG2 VAL 36 9.158 -0.719 -10.587 207 HG23 VAL 36 2HG2 VAL 36 7.993 0.452 -11.205 208 H ARG 37 H ARG 37 8.575 -2.452 -14.575 209 HA ARG 37 HA ARG 37 6.723 -4.481 -15.157 210 HB2 ARG 37 2HB ARG 37 7.252 -2.606 -16.680 211 HB3 ARG 37 3HB ARG 37 8.838 -3.308 -16.970 212 HG2 ARG 37 2HG ARG 37 7.663 -5.350 -17.837 213 HG3 ARG 37 3HG ARG 37 6.161 -4.428 -17.749 214 HD2 ARG 37 2HD ARG 37 7.180 -4.404 -20.001 215 HD3 ARG 37 3HD ARG 37 7.020 -2.795 -19.299 216 HE ARG 37 HE ARG 37 9.289 -2.591 -19.388 217 HH11 ARG 37 1HH1 ARG 37 8.468 -5.971 -19.547 218 HH12 ARG 37 2HH1 ARG 37 10.098 -6.488 -19.827 219 HH21 ARG 37 1HH2 ARG 37 11.439 -3.259 -19.756 220 HH22 ARG 37 2HH2 ARG 37 11.787 -4.944 -19.945 221 H THR 38 H THR 38 10.255 -4.469 -15.105 222 HA THR 38 HA THR 38 10.602 -7.070 -16.165 223 HB THR 38 HB THR 38 12.439 -5.459 -14.383 224 HG1 THR 38 HG1 THR 38 11.862 -4.616 -16.535 225 HG21 THR 38 3HG2 THR 38 14.214 -6.939 -15.321 226 HG22 THR 38 1HG2 THR 38 12.945 -7.947 -16.016 227 HG23 THR 38 2HG2 THR 38 13.076 -7.776 -14.265 228 H LYS 39 H LYS 39 10.390 -5.834 -12.852 229 HA LYS 39 HA LYS 39 10.929 -8.265 -11.539 230 HB2 LYS 39 2HB LYS 39 10.971 -6.023 -10.459 231 HB3 LYS 39 3HB LYS 39 9.216 -5.973 -10.561 232 HG2 LYS 39 2HG LYS 39 8.992 -7.181 -8.714 233 HG3 LYS 39 3HG LYS 39 10.130 -8.401 -9.290 234 HD2 LYS 39 2HD LYS 39 11.066 -5.760 -8.210 235 HD3 LYS 39 3HD LYS 39 10.721 -7.124 -7.144 236 HE2 LYS 39 2HE LYS 39 12.367 -7.889 -9.408 237 HE3 LYS 39 3HE LYS 39 13.109 -6.607 -8.453 238 HZ1 LYS 39 3HZ LYS 39 12.399 -8.168 -6.492 239 HZ2 LYS 39 1HZ LYS 39 13.841 -8.434 -7.336 240 HZ3 LYS 39 2HZ LYS 39 12.472 -9.361 -7.689 241 H VAL 40 H VAL 40 7.922 -6.812 -12.685 242 HA VAL 40 HA VAL 40 6.187 -8.740 -11.538 243 HB VAL 40 HB VAL 40 5.735 -6.964 -13.941 244 HG11 VAL 40 1HG1 VAL 40 4.185 -8.859 -13.858 245 HG12 VAL 40 2HG1 VAL 40 3.744 -8.423 -12.206 246 HG13 VAL 40 3HG1 VAL 40 3.362 -7.332 -13.539 247 HG21 VAL 40 3HG2 VAL 40 5.362 -5.259 -12.550 248 HG22 VAL 40 1HG2 VAL 40 4.377 -6.254 -11.478 249 HG23 VAL 40 2HG2 VAL 40 6.131 -6.236 -11.299 250 H CYS 41 H CYS 41 7.619 -8.404 -14.769 251 HA CYS 41 HA CYS 41 6.366 -10.636 -15.929 252 HB2 CYS 41 2HB CYS 41 8.230 -8.680 -16.728 253 HB3 CYS 41 3HB CYS 41 9.006 -10.234 -17.012 254 HG CYS 41 HG CYS 41 7.953 -10.344 -19.355 255 H ALA 42 H ALA 42 9.339 -10.304 -14.074 256 HA ALA 42 HA ALA 42 10.282 -12.947 -14.526 257 HB1 ALA 42 1HB ALA 42 11.649 -10.971 -13.750 258 HB2 ALA 42 2HB ALA 42 10.948 -11.226 -12.151 259 HB3 ALA 42 3HB ALA 42 11.930 -12.488 -12.894 260 H MET 43 H MET 43 8.308 -11.450 -12.006 261 HA MET 43 HA MET 43 8.219 -13.692 -10.286 262 HB2 MET 43 2HB MET 43 7.014 -11.069 -10.429 263 HB3 MET 43 3HB MET 43 5.826 -12.269 -9.938 264 HG2 MET 43 2HG MET 43 8.506 -11.901 -8.623 265 HG3 MET 43 3HG MET 43 7.007 -11.168 -8.057 266 HE1 MET 43 3HE MET 43 6.835 -12.672 -5.432 267 HE2 MET 43 1HE MET 43 8.058 -13.938 -5.533 268 HE3 MET 43 2HE MET 43 8.422 -12.314 -6.115 269 H LYS 44 H LYS 44 6.431 -12.801 -13.138 270 HA LYS 44 HA LYS 44 4.537 -14.997 -12.729 271 HB2 LYS 44 2HB LYS 44 3.327 -14.052 -14.645 272 HB3 LYS 44 3HB LYS 44 3.584 -12.848 -13.389 273 HG2 LYS 44 2HG LYS 44 5.691 -12.240 -14.802 274 HG3 LYS 44 3HG LYS 44 4.812 -13.055 -16.097 275 HD2 LYS 44 2HD LYS 44 3.792 -10.746 -14.443 276 HD3 LYS 44 3HD LYS 44 4.374 -10.651 -16.106 277 HE2 LYS 44 2HE LYS 44 2.329 -11.122 -16.828 278 HE3 LYS 44 3HE LYS 44 2.419 -12.687 -16.022 279 HZ1 LYS 44 3HZ LYS 44 0.842 -10.443 -15.354 280 HZ2 LYS 44 1HZ LYS 44 1.864 -10.814 -14.058 281 HZ3 LYS 44 2HZ LYS 44 0.822 -11.994 -14.677 282 H LYS 45 H LYS 45 7.497 -14.445 -14.156 283 HA LYS 45 HA LYS 45 8.810 -15.661 -15.561 284 HB2 LYS 45 2HB LYS 45 6.642 -17.761 -15.530 285 HB3 LYS 45 3HB LYS 45 8.355 -17.990 -15.859 286 HG2 LYS 45 2HG LYS 45 8.211 -16.832 -13.311 287 HG3 LYS 45 3HG LYS 45 6.955 -18.072 -13.361 288 HD2 LYS 45 2HD LYS 45 8.974 -19.096 -12.585 289 HD3 LYS 45 3HD LYS 45 8.673 -19.667 -14.228 290 HE2 LYS 45 2HE LYS 45 10.213 -17.326 -14.466 291 HE3 LYS 45 3HE LYS 45 10.949 -18.274 -13.175 292 HZ1 LYS 45 3HZ LYS 45 11.313 -18.648 -15.851 293 HZ2 LYS 45 1HZ LYS 45 10.231 -19.879 -15.430 294 HZ3 LYS 45 2HZ LYS 45 11.716 -19.748 -14.631 295 H LEU 46 H LEU 46 7.635 -13.743 -16.868 296 HA LEU 46 HA LEU 46 6.473 -14.964 -19.285 297 HB2 LEU 46 2HB LEU 46 5.798 -12.576 -17.754 298 HB3 LEU 46 3HB LEU 46 5.979 -12.265 -19.479 299 HG LEU 46 HG LEU 46 4.270 -13.931 -19.972 300 HD11 LEU 46 1HD1 LEU 46 4.785 -14.729 -17.269 301 HD12 LEU 46 2HD1 LEU 46 3.856 -15.553 -18.521 302 HD13 LEU 46 3HD1 LEU 46 3.071 -14.369 -17.476 303 HD21 LEU 46 3HD2 LEU 46 3.747 -11.608 -18.218 304 HD22 LEU 46 1HD2 LEU 46 2.415 -12.737 -18.462 305 HD23 LEU 46 2HD2 LEU 46 3.171 -11.954 -19.849 306 HA PRO 47 HA PRO 47 9.820 -13.562 -21.750 307 HB2 PRO 47 2HB PRO 47 8.583 -12.690 -24.004 308 HB3 PRO 47 3HB PRO 47 8.712 -14.401 -23.579 309 HG2 PRO 47 2HG PRO 47 6.408 -12.525 -23.209 310 HG3 PRO 47 3HG PRO 47 6.403 -14.205 -23.777 311 HD2 PRO 47 2HD PRO 47 5.754 -13.525 -21.238 312 HD3 PRO 47 3HD PRO 47 6.547 -15.061 -21.642 313 HA PRO 48 HA PRO 48 9.867 -9.191 -20.622 314 HB2 PRO 48 2HB PRO 48 12.570 -8.961 -20.733 315 HB3 PRO 48 3HB PRO 48 11.721 -9.657 -19.347 316 HG2 PRO 48 2HG PRO 48 13.095 -11.043 -21.618 317 HG3 PRO 48 3HG PRO 48 13.134 -11.424 -19.886 318 HD2 PRO 48 2HD PRO 48 11.575 -12.774 -21.641 319 HD3 PRO 48 3HD PRO 48 11.100 -12.507 -19.951 320 H ASP 49 H ASP 49 11.297 -10.784 -23.386 321 HA ASP 49 HA ASP 49 11.887 -8.330 -24.780 322 HB2 ASP 49 2HB ASP 49 12.314 -11.201 -25.220 323 HB3 ASP 49 3HB ASP 49 11.952 -10.301 -26.690 324 H THR 50 H THR 50 9.290 -10.664 -24.663 325 HA THR 50 HA THR 50 7.847 -9.120 -26.718 326 HB THR 50 HB THR 50 6.995 -11.878 -25.922 327 HG1 THR 50 HG1 THR 50 8.967 -11.328 -27.905 328 HG21 THR 50 3HG2 THR 50 6.630 -10.026 -28.225 329 HG22 THR 50 1HG2 THR 50 5.448 -11.034 -27.390 330 HG23 THR 50 2HG2 THR 50 6.578 -11.762 -28.531 331 H THR 51 H THR 51 7.710 -7.894 -24.414 332 HA THR 51 HA THR 51 4.989 -8.441 -23.487 333 HB THR 51 HB THR 51 6.333 -9.507 -21.793 334 HG1 THR 51 HG1 THR 51 5.397 -8.487 -20.117 335 HG21 THR 51 3HG2 THR 51 8.062 -8.340 -20.552 336 HG22 THR 51 1HG2 THR 51 7.791 -6.878 -21.499 337 HG23 THR 51 2HG2 THR 51 8.448 -8.321 -22.272 338 H ARG 52 H ARG 52 3.844 -6.633 -22.826 339 HA ARG 52 HA ARG 52 5.229 -4.047 -23.065 340 HB2 ARG 52 2HB ARG 52 3.196 -5.087 -24.773 341 HB3 ARG 52 3HB ARG 52 2.513 -3.744 -23.867 342 HG2 ARG 52 2HG ARG 52 5.130 -3.527 -25.320 343 HG3 ARG 52 3HG ARG 52 3.580 -3.205 -26.100 344 HD2 ARG 52 2HD ARG 52 4.055 -1.096 -25.402 345 HD3 ARG 52 3HD ARG 52 3.257 -1.685 -23.944 346 HE ARG 52 HE ARG 52 6.025 -2.218 -23.811 347 HH11 ARG 52 1HH1 ARG 52 3.747 0.408 -23.626 348 HH12 ARG 52 2HH1 ARG 52 4.750 1.378 -22.599 349 HH21 ARG 52 1HH2 ARG 52 7.355 -0.950 -22.458 350 HH22 ARG 52 2HH2 ARG 52 6.802 0.605 -21.936 351 H LEU 53 H LEU 53 3.964 -2.238 -22.077 352 HA LEU 53 HA LEU 53 2.182 -3.085 -19.916 353 HB2 LEU 53 2HB LEU 53 4.203 -3.070 -18.745 354 HB3 LEU 53 3HB LEU 53 4.795 -1.652 -19.607 355 HG LEU 53 HG LEU 53 3.122 -0.279 -18.386 356 HD11 LEU 53 1HD1 LEU 53 2.593 -2.902 -17.017 357 HD12 LEU 53 2HD1 LEU 53 1.441 -1.835 -17.819 358 HD13 LEU 53 3HD1 LEU 53 2.184 -1.344 -16.297 359 HD21 LEU 53 3HD2 LEU 53 5.548 -0.784 -17.649 360 HD22 LEU 53 1HD2 LEU 53 4.790 -1.755 -16.387 361 HD23 LEU 53 2HD2 LEU 53 4.445 -0.029 -16.498 362 H THR 54 H THR 54 0.486 -1.775 -19.718 363 HA THR 54 HA THR 54 0.699 0.970 -20.767 364 HB THR 54 HB THR 54 -1.988 -0.169 -20.939 365 HG1 THR 54 HG1 THR 54 -1.249 -2.027 -21.715 366 HG21 THR 54 3HG2 THR 54 -0.121 1.384 -22.700 367 HG22 THR 54 1HG2 THR 54 -1.667 1.878 -22.013 368 HG23 THR 54 2HG2 THR 54 -1.623 0.717 -23.340 369 H TYR 55 H TYR 55 0.063 2.515 -19.405 370 HA TYR 55 HA TYR 55 -1.727 1.796 -17.185 371 HB2 TYR 55 2HB TYR 55 0.435 1.840 -16.181 372 HB3 TYR 55 3HB TYR 55 0.874 3.319 -17.029 373 HD1 TYR 55 HD1 TYR 55 -2.282 2.590 -15.206 374 HD2 TYR 55 HD2 TYR 55 1.356 4.795 -15.273 375 HE1 TYR 55 HE1 TYR 55 -3.057 3.915 -13.284 376 HE2 TYR 55 HE2 TYR 55 0.592 6.125 -13.350 377 HH TYR 55 HH TYR 55 -2.586 6.190 -12.307 378 H LYS 56 H LYS 56 -3.407 3.119 -16.973 379 HA LYS 56 HA LYS 56 -4.846 4.845 -17.331 380 HB2 LYS 56 2HB LYS 56 -2.969 5.930 -15.956 381 HB3 LYS 56 3HB LYS 56 -2.432 6.640 -17.473 382 HG2 LYS 56 2HG LYS 56 -3.785 8.330 -16.946 383 HG3 LYS 56 3HG LYS 56 -5.092 7.261 -17.463 384 HD2 LYS 56 2HD LYS 56 -4.068 7.200 -14.645 385 HD3 LYS 56 3HD LYS 56 -5.265 8.394 -15.152 386 HE2 LYS 56 2HE LYS 56 -6.866 6.881 -14.885 387 HE3 LYS 56 3HE LYS 56 -6.116 5.880 -16.127 388 HZ1 LYS 56 3HZ LYS 56 -6.139 5.544 -13.274 389 HZ2 LYS 56 1HZ LYS 56 -4.592 5.396 -13.944 390 HZ3 LYS 56 2HZ LYS 56 -5.850 4.408 -14.494 391 H GLY 57 H GLY 57 -3.871 3.434 -19.647 392 HA2 GLY 57 2HA GLY 57 -4.199 3.584 -21.921 393 HA3 GLY 57 3HA GLY 57 -4.824 5.206 -21.667 394 H ARG 58 H ARG 58 -1.785 4.863 -20.281 395 HA ARG 58 HA ARG 58 -0.468 5.921 -22.695 396 HB2 ARG 58 2HB ARG 58 -1.047 7.475 -20.578 397 HB3 ARG 58 3HB ARG 58 0.501 6.833 -20.044 398 HG2 ARG 58 2HG ARG 58 1.609 7.716 -21.966 399 HG3 ARG 58 3HG ARG 58 0.073 8.182 -22.698 400 HD2 ARG 58 2HD ARG 58 -0.291 9.679 -20.706 401 HD3 ARG 58 3HD ARG 58 1.376 9.340 -20.243 402 HE ARG 58 HE ARG 58 2.072 10.791 -21.863 403 HH11 ARG 58 1HH1 ARG 58 -1.221 9.871 -22.518 404 HH12 ARG 58 2HH1 ARG 58 -1.412 10.993 -23.824 405 HH21 ARG 58 1HH2 ARG 58 1.833 12.272 -23.581 406 HH22 ARG 58 2HH2 ARG 58 0.326 12.358 -24.429 407 H ALA 59 H ALA 59 1.820 5.558 -22.830 408 HA ALA 59 HA ALA 59 2.631 3.109 -21.423 409 HB1 ALA 59 1HB ALA 59 2.995 2.476 -23.543 410 HB2 ALA 59 2HB ALA 59 3.040 4.137 -24.136 411 HB3 ALA 59 3HB ALA 59 4.475 3.425 -23.398 412 H LEU 60 H LEU 60 4.017 3.324 -19.804 413 HA LEU 60 HA LEU 60 5.750 5.693 -19.717 414 HB2 LEU 60 2HB LEU 60 4.902 3.782 -17.546 415 HB3 LEU 60 3HB LEU 60 6.024 5.122 -17.317 416 HG LEU 60 HG LEU 60 4.053 6.585 -18.164 417 HD11 LEU 60 1HD1 LEU 60 2.381 5.213 -18.866 418 HD12 LEU 60 2HD1 LEU 60 1.907 5.386 -17.176 419 HD13 LEU 60 3HD1 LEU 60 2.778 3.946 -17.704 420 HD21 LEU 60 3HD2 LEU 60 3.051 6.374 -15.745 421 HD22 LEU 60 1HD2 LEU 60 4.675 7.013 -16.001 422 HD23 LEU 60 2HD2 LEU 60 4.457 5.339 -15.488 423 H LYS 61 H LYS 61 7.959 5.475 -19.105 424 HA LYS 61 HA LYS 61 9.209 2.920 -18.873 425 HB2 LYS 61 2HB LYS 61 10.628 3.690 -21.072 426 HB3 LYS 61 3HB LYS 61 9.348 2.485 -21.079 427 HG2 LYS 61 2HG LYS 61 7.742 4.102 -21.811 428 HG3 LYS 61 3HG LYS 61 8.910 5.412 -21.625 429 HD2 LYS 61 2HD LYS 61 8.996 5.012 -23.900 430 HD3 LYS 61 3HD LYS 61 10.331 4.022 -23.306 431 HE2 LYS 61 2HE LYS 61 8.356 2.228 -23.131 432 HE3 LYS 61 3HE LYS 61 7.718 3.216 -24.444 433 HZ1 LYS 61 3HZ LYS 61 10.203 2.915 -25.278 434 HZ2 LYS 61 1HZ LYS 61 8.980 1.810 -25.656 435 HZ3 LYS 61 2HZ LYS 61 10.057 1.480 -24.394 436 H ASP 62 H ASP 62 10.358 5.893 -20.443 437 HA ASP 62 HA ASP 62 12.632 6.026 -18.705 438 HB2 ASP 62 2HB ASP 62 11.711 7.360 -21.133 439 HB3 ASP 62 3HB ASP 62 12.499 8.464 -20.011 440 H THR 63 H THR 63 9.464 6.888 -18.290 441 HA THR 63 HA THR 63 9.559 9.404 -17.081 442 HB THR 63 HB THR 63 7.703 7.363 -15.954 443 HG1 THR 63 HG1 THR 63 7.864 8.118 -18.668 444 HG21 THR 63 3HG2 THR 63 6.636 9.219 -15.345 445 HG22 THR 63 1HG2 THR 63 6.437 9.666 -17.039 446 HG23 THR 63 2HG2 THR 63 7.864 10.196 -16.149 447 H GLU 64 H GLU 64 10.753 6.385 -15.997 448 HA GLU 64 HA GLU 64 11.821 5.727 -14.100 449 HB2 GLU 64 2HB GLU 64 13.185 7.689 -14.351 450 HB3 GLU 64 3HB GLU 64 11.927 8.713 -13.673 451 HG2 GLU 64 2HG GLU 64 12.269 7.897 -11.508 452 HG3 GLU 64 3HG GLU 64 13.183 6.505 -12.085 453 H THR 65 H THR 65 10.356 8.556 -12.589 454 HA THR 65 HA THR 65 8.909 6.762 -10.777 455 HB THR 65 HB THR 65 10.303 8.325 -9.609 456 HG1 THR 65 HG1 THR 65 8.570 9.584 -8.522 457 HG21 THR 65 3HG2 THR 65 9.299 10.857 -10.029 458 HG22 THR 65 1HG2 THR 65 9.345 10.172 -11.653 459 HG23 THR 65 2HG2 THR 65 10.813 10.228 -10.677 460 H LEU 66 H LEU 66 6.725 7.329 -10.121 461 HA LEU 66 HA LEU 66 5.232 8.671 -12.279 462 HB2 LEU 66 2HB LEU 66 5.004 6.051 -11.300 463 HB3 LEU 66 3HB LEU 66 3.600 6.921 -10.685 464 HG LEU 66 HG LEU 66 4.370 6.798 -13.598 465 HD11 LEU 66 1HD1 LEU 66 2.819 5.075 -13.913 466 HD12 LEU 66 2HD1 LEU 66 2.127 5.281 -12.305 467 HD13 LEU 66 3HD1 LEU 66 3.738 4.588 -12.489 468 HD21 LEU 66 3HD2 LEU 66 1.901 7.759 -12.159 469 HD22 LEU 66 1HD2 LEU 66 2.030 7.559 -13.906 470 HD23 LEU 66 2HD2 LEU 66 3.047 8.737 -13.077 471 H GLU 67 H GLU 67 5.973 8.622 -8.955 472 HA GLU 67 HA GLU 67 3.671 9.702 -7.804 473 HB2 GLU 67 2HB GLU 67 6.219 9.053 -6.933 474 HB3 GLU 67 3HB GLU 67 6.138 10.792 -6.692 475 HG2 GLU 67 2HG GLU 67 3.865 10.275 -5.560 476 HG3 GLU 67 3HG GLU 67 4.497 8.634 -5.445 477 H SER 68 H SER 68 6.319 11.246 -9.532 478 HA SER 68 HA SER 68 5.652 13.917 -8.927 479 HB2 SER 68 2HB SER 68 7.833 13.169 -9.892 480 HB3 SER 68 3HB SER 68 7.014 12.893 -11.429 481 HG SER 68 HG SER 68 7.219 15.369 -10.053 482 H LEU 69 H LEU 69 4.116 11.613 -10.888 483 HA LEU 69 HA LEU 69 2.760 13.649 -12.499 484 HB2 LEU 69 2HB LEU 69 3.137 10.705 -12.720 485 HB3 LEU 69 3HB LEU 69 1.713 11.430 -13.464 486 HG LEU 69 HG LEU 69 3.081 12.771 -14.912 487 HD11 LEU 69 1HD1 LEU 69 5.584 12.438 -14.865 488 HD12 LEU 69 2HD1 LEU 69 5.367 11.705 -13.276 489 HD13 LEU 69 3HD1 LEU 69 4.903 13.385 -13.542 490 HD21 LEU 69 3HD2 LEU 69 4.548 10.226 -15.166 491 HD22 LEU 69 1HD2 LEU 69 3.588 11.111 -16.352 492 HD23 LEU 69 2HD2 LEU 69 2.788 10.106 -15.143 493 H GLY 70 H GLY 70 2.343 11.814 -9.684 494 HA2 GLY 70 2HA GLY 70 0.523 12.261 -8.204 495 HA3 GLY 70 3HA GLY 70 -0.489 12.595 -9.602 496 H VAL 71 H VAL 71 1.567 9.839 -8.659 497 HA VAL 71 HA VAL 71 -0.564 8.021 -9.463 498 HB VAL 71 HB VAL 71 1.798 7.614 -10.166 499 HG11 VAL 71 1HG1 VAL 71 2.564 6.416 -7.618 500 HG12 VAL 71 2HG1 VAL 71 3.498 7.424 -8.724 501 HG13 VAL 71 3HG1 VAL 71 2.412 8.171 -7.553 502 HG21 VAL 71 3HG2 VAL 71 1.770 5.194 -9.641 503 HG22 VAL 71 1HG2 VAL 71 0.475 5.492 -8.482 504 HG23 VAL 71 2HG2 VAL 71 0.209 5.798 -10.198 505 H ALA 72 H ALA 72 -1.619 6.624 -8.109 506 HA ALA 72 HA ALA 72 -1.109 6.957 -5.224 507 HB1 ALA 72 1HB ALA 72 -3.270 7.949 -6.263 508 HB2 ALA 72 2HB ALA 72 -3.820 6.273 -6.281 509 HB3 ALA 72 3HB ALA 72 -3.371 7.038 -4.756 510 H ASP 73 H ASP 73 -1.311 5.143 -3.903 511 HA ASP 73 HA ASP 73 -0.530 2.686 -5.028 512 HB2 ASP 73 2HB ASP 73 -0.709 1.782 -2.798 513 HB3 ASP 73 3HB ASP 73 -0.054 3.413 -2.686 514 H GLY 74 H GLY 74 -1.627 0.758 -5.353 515 HA2 GLY 74 2HA GLY 74 -3.517 -0.656 -5.369 516 HA3 GLY 74 3HA GLY 74 -4.523 0.724 -4.954 517 H ASP 75 H ASP 75 -2.195 0.987 -7.513 518 HA ASP 75 HA ASP 75 -4.341 1.450 -9.410 519 HB2 ASP 75 2HB ASP 75 -1.354 1.816 -9.502 520 HB3 ASP 75 3HB ASP 75 -2.344 1.964 -10.951 521 H LYS 76 H LYS 76 -4.535 0.377 -11.419 522 HA LYS 76 HA LYS 76 -3.383 -2.336 -11.425 523 HB2 LYS 76 2HB LYS 76 -5.371 -3.098 -12.577 524 HB3 LYS 76 3HB LYS 76 -5.838 -2.263 -11.101 525 HG2 LYS 76 2HG LYS 76 -6.215 -0.214 -12.527 526 HG3 LYS 76 3HG LYS 76 -6.036 -1.271 -13.929 527 HD2 LYS 76 2HD LYS 76 -8.238 -1.622 -13.736 528 HD3 LYS 76 3HD LYS 76 -7.824 -2.645 -12.358 529 HE2 LYS 76 2HE LYS 76 -9.513 -1.138 -11.631 530 HE3 LYS 76 3HE LYS 76 -7.995 -0.599 -10.915 531 HZ1 LYS 76 3HZ LYS 76 -9.420 1.190 -11.890 532 HZ2 LYS 76 1HZ LYS 76 -9.096 0.543 -13.419 533 HZ3 LYS 76 2HZ LYS 76 -7.833 1.152 -12.473 534 H PHE 77 H PHE 77 -2.155 -2.910 -13.101 535 HA PHE 77 HA PHE 77 -2.122 -1.139 -15.454 536 HB2 PHE 77 2HB PHE 77 0.122 -2.917 -14.484 537 HB3 PHE 77 3HB PHE 77 0.203 -1.710 -15.763 538 HD1 PHE 77 HD2 PHE 77 -1.329 0.481 -14.376 539 HD2 PHE 77 HD1 PHE 77 1.768 -2.108 -13.023 540 HE1 PHE 77 HE2 PHE 77 -0.636 2.174 -12.731 541 HE2 PHE 77 HE1 PHE 77 2.465 -0.419 -11.376 542 HZ PHE 77 HZ PHE 77 1.263 1.726 -11.229 543 H VAL 78 H VAL 78 -1.920 -2.065 -17.524 544 HA VAL 78 HA VAL 78 -2.948 -4.809 -17.673 545 HB VAL 78 HB VAL 78 -2.884 -2.656 -19.792 546 HG11 VAL 78 1HG1 VAL 78 -4.699 -4.478 -20.639 547 HG12 VAL 78 2HG1 VAL 78 -3.015 -4.437 -21.163 548 HG13 VAL 78 3HG1 VAL 78 -3.510 -5.527 -19.868 549 HG21 VAL 78 3HG2 VAL 78 -4.444 -2.123 -18.014 550 HG22 VAL 78 1HG2 VAL 78 -5.325 -2.601 -19.466 551 HG23 VAL 78 2HG2 VAL 78 -5.156 -3.732 -18.124 552 H LEU 79 H LEU 79 -1.736 -6.426 -18.419 553 HA LEU 79 HA LEU 79 0.886 -5.771 -19.569 554 HB2 LEU 79 2HB LEU 79 0.077 -7.572 -17.570 555 HB3 LEU 79 3HB LEU 79 0.548 -8.555 -18.955 556 HG LEU 79 HG LEU 79 2.326 -6.435 -17.768 557 HD11 LEU 79 1HD1 LEU 79 2.557 -7.763 -15.995 558 HD12 LEU 79 2HD1 LEU 79 3.382 -8.884 -17.077 559 HD13 LEU 79 3HD1 LEU 79 1.659 -9.075 -16.757 560 HD21 LEU 79 3HD2 LEU 79 3.524 -8.729 -19.087 561 HD22 LEU 79 1HD2 LEU 79 3.800 -7.005 -19.340 562 HD23 LEU 79 2HD2 LEU 79 2.460 -7.813 -20.155 563 H ILE 80 H ILE 80 1.400 -6.326 -21.599 564 HA ILE 80 HA ILE 80 -0.590 -7.864 -23.129 565 HB ILE 80 HB ILE 80 1.489 -5.952 -24.199 566 HG12 ILE 80 2HG1 ILE 80 -1.490 -5.535 -23.883 567 HG13 ILE 80 3HG1 ILE 80 -0.269 -4.847 -22.819 568 HG21 ILE 80 1HG2 ILE 80 -0.789 -7.431 -25.498 569 HG22 ILE 80 2HG2 ILE 80 0.070 -6.093 -26.260 570 HG23 ILE 80 3HG2 ILE 80 0.933 -7.575 -25.851 571 HD11 ILE 80 3HD1 ILE 80 0.698 -3.824 -24.979 572 HD12 ILE 80 1HD1 ILE 80 -0.889 -4.179 -25.661 573 HD13 ILE 80 2HD1 ILE 80 -0.747 -3.113 -24.263 574 H THR 81 H THR 81 0.069 -9.499 -24.524 575 HA THR 81 HA THR 81 2.890 -10.305 -24.393 576 HB THR 81 HB THR 81 1.769 -11.673 -22.736 577 HG1 THR 81 HG1 THR 81 3.324 -12.769 -23.945 578 HG21 THR 81 3HG2 THR 81 -0.388 -11.588 -24.582 579 HG22 THR 81 1HG2 THR 81 -0.363 -12.277 -22.959 580 HG23 THR 81 2HG2 THR 81 0.060 -13.278 -24.349 581 H ARG 82 H ARG 82 3.720 -10.900 -26.301 582 HA ARG 82 HA ARG 82 1.843 -11.400 -28.518 583 HB2 ARG 82 2HB ARG 82 4.035 -9.534 -28.265 584 HB3 ARG 82 3HB ARG 82 4.311 -10.633 -29.610 585 HG2 ARG 82 2HG ARG 82 2.617 -9.783 -30.834 586 HG3 ARG 82 3HG ARG 82 1.612 -9.460 -29.419 587 HD2 ARG 82 2HD ARG 82 2.226 -7.356 -30.344 588 HD3 ARG 82 3HD ARG 82 3.163 -7.570 -28.866 589 HE ARG 82 HE ARG 82 4.773 -8.518 -30.867 590 HH11 ARG 82 1HH1 ARG 82 3.159 -5.508 -30.190 591 HH12 ARG 82 2HH1 ARG 82 4.350 -4.539 -30.992 592 HH21 ARG 82 1HH2 ARG 82 6.347 -7.252 -31.926 593 HH22 ARG 82 2HH2 ARG 82 6.163 -5.532 -31.980 594 H THR 83 H THR 83 2.492 -12.911 -30.129 595 HA THR 83 HA THR 83 4.724 -14.675 -29.424 596 HB THR 83 HB THR 83 2.822 -15.781 -28.438 597 HG1 THR 83 HG1 THR 83 4.209 -17.215 -29.445 598 HG21 THR 83 3HG2 THR 83 1.118 -14.599 -29.865 599 HG22 THR 83 1HG2 THR 83 0.818 -16.318 -29.616 600 HG23 THR 83 2HG2 THR 83 1.492 -15.754 -31.145 601 H VAL 84 H VAL 84 5.659 -15.764 -31.153 602 HA VAL 84 HA VAL 84 5.511 -14.503 -33.669 603 HB VAL 84 HB VAL 84 6.926 -16.411 -34.467 604 HG11 VAL 84 1HG1 VAL 84 7.837 -14.342 -33.420 605 HG12 VAL 84 2HG1 VAL 84 7.880 -15.199 -31.878 606 HG13 VAL 84 3HG1 VAL 84 8.869 -15.759 -33.227 607 HG21 VAL 84 3HG2 VAL 84 7.678 -18.086 -32.926 608 HG22 VAL 84 1HG2 VAL 84 6.788 -17.335 -31.601 609 HG23 VAL 84 2HG2 VAL 84 5.914 -18.098 -32.930 610 H GLY 85 H GLY 85 3.795 -17.182 -32.297 611 HA2 GLY 85 2HA GLY 85 2.170 -17.352 -34.713 612 HA3 GLY 85 3HA GLY 85 2.994 -18.825 -34.222 Start of MODEL 17 1 H1 MET 9 H MET 9 0.559 -0.753 0.869 2 HA MET 9 HA MET 9 0.762 0.894 -1.567 3 HB2 MET 9 2HB MET 9 2.646 1.233 0.031 4 HB3 MET 9 3HB MET 9 3.041 -0.473 -0.127 5 HG2 MET 9 2HG MET 9 3.844 -0.235 -2.261 6 HG3 MET 9 3HG MET 9 2.875 1.202 -2.580 7 HE1 MET 9 3HE MET 9 7.119 0.893 -1.326 8 HE2 MET 9 1HE MET 9 5.968 -0.361 -1.788 9 HE3 MET 9 2HE MET 9 6.483 0.841 -2.971 10 H LYS 10 H LYS 10 -0.783 -0.754 -2.379 11 HA LYS 10 HA LYS 10 0.687 -3.092 -3.394 12 HB2 LYS 10 2HB LYS 10 -1.898 -2.986 -1.953 13 HB3 LYS 10 3HB LYS 10 -1.839 -4.046 -3.356 14 HG2 LYS 10 2HG LYS 10 0.270 -5.027 -2.314 15 HG3 LYS 10 3HG LYS 10 -0.211 -4.180 -0.842 16 HD2 LYS 10 2HD LYS 10 -2.445 -5.612 -1.959 17 HD3 LYS 10 3HD LYS 10 -1.073 -6.697 -1.722 18 HE2 LYS 10 2HE LYS 10 -1.159 -6.525 0.532 19 HE3 LYS 10 3HE LYS 10 -1.644 -4.831 0.490 20 HZ1 LYS 10 3HZ LYS 10 -3.689 -5.503 0.950 21 HZ2 LYS 10 1HZ LYS 10 -3.256 -7.132 0.810 22 HZ3 LYS 10 2HZ LYS 10 -3.759 -6.271 -0.556 23 H ILE 11 H ILE 11 0.033 -3.854 -5.460 24 HA ILE 11 HA ILE 11 -1.726 -2.062 -6.982 25 HB ILE 11 HB ILE 11 -0.188 -2.058 -8.877 26 HG12 ILE 11 2HG1 ILE 11 2.251 -2.832 -7.644 27 HG13 ILE 11 3HG1 ILE 11 1.094 -4.131 -7.373 28 HG21 ILE 11 1HG2 ILE 11 1.653 -0.681 -7.803 29 HG22 ILE 11 2HG2 ILE 11 -0.003 -0.161 -7.494 30 HG23 ILE 11 3HG2 ILE 11 0.887 -1.050 -6.258 31 HD11 ILE 11 3HD1 ILE 11 2.000 -4.770 -9.364 32 HD12 ILE 11 1HD1 ILE 11 0.629 -3.817 -9.932 33 HD13 ILE 11 2HD1 ILE 11 2.246 -3.112 -9.913 34 H LYS 12 H LYS 12 -2.721 -2.997 -8.805 35 HA LYS 12 HA LYS 12 -2.604 -5.942 -8.866 36 HB2 LYS 12 2HB LYS 12 -4.998 -4.288 -9.654 37 HB3 LYS 12 3HB LYS 12 -4.932 -6.018 -9.343 38 HG2 LYS 12 2HG LYS 12 -4.217 -5.280 -6.949 39 HG3 LYS 12 3HG LYS 12 -4.957 -3.745 -7.412 40 HD2 LYS 12 2HD LYS 12 -6.769 -4.807 -6.499 41 HD3 LYS 12 3HD LYS 12 -6.929 -5.317 -8.181 42 HE2 LYS 12 2HE LYS 12 -5.652 -7.384 -7.586 43 HE3 LYS 12 3HE LYS 12 -5.737 -6.883 -5.898 44 HZ1 LYS 12 3HZ LYS 12 -8.204 -6.855 -6.173 45 HZ2 LYS 12 1HZ LYS 12 -7.501 -8.390 -6.278 46 HZ3 LYS 12 2HZ LYS 12 -7.996 -7.589 -7.683 47 H ILE 13 H ILE 13 -1.740 -6.715 -10.665 48 HA ILE 13 HA ILE 13 -2.078 -5.181 -13.161 49 HB ILE 13 HB ILE 13 0.041 -6.372 -13.905 50 HG12 ILE 13 2HG1 ILE 13 0.233 -6.868 -10.926 51 HG13 ILE 13 3HG1 ILE 13 0.106 -8.096 -12.182 52 HG21 ILE 13 1HG2 ILE 13 -0.369 -3.998 -12.485 53 HG22 ILE 13 2HG2 ILE 13 1.073 -4.730 -11.784 54 HG23 ILE 13 3HG2 ILE 13 1.002 -4.407 -13.516 55 HD11 ILE 13 3HD1 ILE 13 2.431 -6.688 -11.182 56 HD12 ILE 13 1HD1 ILE 13 2.321 -8.189 -12.100 57 HD13 ILE 13 2HD1 ILE 13 2.312 -6.639 -12.941 58 H VAL 14 H VAL 14 -3.280 -6.151 -14.643 59 HA VAL 14 HA VAL 14 -3.480 -9.092 -14.594 60 HB VAL 14 HB VAL 14 -5.610 -8.118 -14.010 61 HG11 VAL 14 1HG1 VAL 14 -5.596 -6.651 -16.638 62 HG12 VAL 14 2HG1 VAL 14 -6.762 -6.511 -15.321 63 HG13 VAL 14 3HG1 VAL 14 -5.118 -5.906 -15.113 64 HG21 VAL 14 3HG2 VAL 14 -5.335 -10.050 -15.758 65 HG22 VAL 14 1HG2 VAL 14 -6.924 -9.357 -15.433 66 HG23 VAL 14 2HG2 VAL 14 -6.024 -8.865 -16.868 67 HA PRO 15 HA PRO 15 -1.520 -8.693 -18.590 68 HB2 PRO 15 2HB PRO 15 -1.364 -11.362 -19.065 69 HB3 PRO 15 3HB PRO 15 -0.252 -10.512 -17.986 70 HG2 PRO 15 2HG PRO 15 -2.672 -12.140 -17.312 71 HG3 PRO 15 3HG PRO 15 -1.082 -12.121 -16.527 72 HD2 PRO 15 2HD PRO 15 -3.222 -10.804 -15.517 73 HD3 PRO 15 3HD PRO 15 -1.558 -10.213 -15.325 74 H ALA 16 H ALA 16 -2.265 -8.681 -20.658 75 HA ALA 16 HA ALA 16 -5.057 -9.397 -21.061 76 HB1 ALA 16 1HB ALA 16 -4.864 -8.162 -23.159 77 HB2 ALA 16 2HB ALA 16 -4.296 -7.198 -21.795 78 HB3 ALA 16 3HB ALA 16 -3.134 -7.956 -22.884 79 H VAL 17 H VAL 17 -4.424 -11.734 -20.875 80 HA VAL 17 HA VAL 17 -4.095 -12.818 -23.547 81 HB VAL 17 HB VAL 17 -2.406 -14.513 -22.681 82 HG11 VAL 17 1HG1 VAL 17 -1.316 -11.715 -22.776 83 HG12 VAL 17 2HG1 VAL 17 -0.581 -13.205 -23.371 84 HG13 VAL 17 3HG1 VAL 17 -1.974 -12.513 -24.204 85 HG21 VAL 17 3HG2 VAL 17 -1.568 -14.372 -20.619 86 HG22 VAL 17 1HG2 VAL 17 -1.265 -12.642 -20.783 87 HG23 VAL 17 2HG2 VAL 17 -2.853 -13.215 -20.274 88 H GLY 18 H GLY 18 -5.669 -14.254 -23.791 89 HA2 GLY 18 2HA GLY 18 -7.318 -15.776 -23.292 90 HA3 GLY 18 3HA GLY 18 -6.093 -16.516 -22.273 91 H GLY 19 H GLY 19 -8.359 -13.760 -22.243 92 HA2 GLY 19 2HA GLY 19 -9.991 -13.314 -20.633 93 HA3 GLY 19 3HA GLY 19 -9.349 -14.623 -19.653 94 H GLY 20 H GLY 20 -6.753 -13.944 -19.283 95 HA2 GLY 20 2HA GLY 20 -5.336 -12.544 -18.128 96 HA3 GLY 20 3HA GLY 20 -6.376 -11.205 -18.590 97 H SER 21 H SER 21 -5.242 -13.001 -16.034 98 HA SER 21 HA SER 21 -7.545 -12.296 -14.340 99 HB2 SER 21 2HB SER 21 -6.147 -13.931 -12.739 100 HB3 SER 21 3HB SER 21 -7.325 -14.532 -13.905 101 HG SER 21 HG SER 21 -5.762 -15.470 -14.934 102 HA PRO 22 HA PRO 22 -5.066 -9.184 -12.435 103 HB2 PRO 22 2HB PRO 22 -6.542 -8.845 -10.182 104 HB3 PRO 22 3HB PRO 22 -7.051 -8.242 -11.764 105 HG2 PRO 22 2HG PRO 22 -7.895 -10.727 -10.324 106 HG3 PRO 22 3HG PRO 22 -8.886 -9.565 -11.226 107 HD2 PRO 22 2HD PRO 22 -8.100 -11.934 -12.276 108 HD3 PRO 22 3HD PRO 22 -8.323 -10.478 -13.266 109 H LEU 23 H LEU 23 -3.247 -9.322 -11.284 110 HA LEU 23 HA LEU 23 -3.089 -11.346 -9.147 111 HB2 LEU 23 2HB LEU 23 -1.735 -11.642 -11.347 112 HB3 LEU 23 3HB LEU 23 -0.689 -10.400 -10.661 113 HG LEU 23 HG LEU 23 -0.400 -11.900 -8.660 114 HD11 LEU 23 1HD1 LEU 23 -1.721 -13.670 -8.470 115 HD12 LEU 23 2HD1 LEU 23 -0.901 -14.380 -9.861 116 HD13 LEU 23 3HD1 LEU 23 -2.364 -13.423 -10.094 117 HD21 LEU 23 3HD2 LEU 23 1.117 -11.683 -10.758 118 HD22 LEU 23 1HD2 LEU 23 0.534 -13.306 -11.128 119 HD23 LEU 23 2HD2 LEU 23 1.393 -13.001 -9.617 120 H GLU 24 H GLU 24 -2.220 -10.753 -7.214 121 HA GLU 24 HA GLU 24 -1.858 -7.897 -6.787 122 HB2 GLU 24 2HB GLU 24 -2.071 -10.232 -4.886 123 HB3 GLU 24 3HB GLU 24 -1.773 -8.581 -4.360 124 HG2 GLU 24 2HG GLU 24 -3.891 -7.875 -4.912 125 HG3 GLU 24 3HG GLU 24 -4.130 -9.168 -6.086 126 H LEU 25 H LEU 25 0.053 -6.936 -6.553 127 HA LEU 25 HA LEU 25 2.371 -8.488 -5.691 128 HB2 LEU 25 2HB LEU 25 1.903 -7.685 -8.388 129 HB3 LEU 25 3HB LEU 25 3.272 -6.774 -7.755 130 HG LEU 25 HG LEU 25 4.088 -8.728 -8.880 131 HD11 LEU 25 1HD1 LEU 25 5.510 -9.557 -7.235 132 HD12 LEU 25 2HD1 LEU 25 4.286 -9.422 -5.972 133 HD13 LEU 25 3HD1 LEU 25 5.046 -7.969 -6.621 134 HD21 LEU 25 3HD2 LEU 25 3.191 -10.789 -8.766 135 HD22 LEU 25 1HD2 LEU 25 1.766 -9.928 -8.183 136 HD23 LEU 25 2HD2 LEU 25 2.878 -10.672 -7.034 137 H GLU 26 H GLU 26 4.194 -7.138 -5.054 138 HA GLU 26 HA GLU 26 3.299 -4.476 -4.167 139 HB2 GLU 26 2HB GLU 26 5.090 -4.749 -2.398 140 HB3 GLU 26 3HB GLU 26 3.698 -5.813 -2.251 141 HG2 GLU 26 2HG GLU 26 4.918 -7.661 -2.550 142 HG3 GLU 26 3HG GLU 26 5.900 -6.929 -3.818 143 H VAL 27 H VAL 27 4.081 -2.993 -5.526 144 HA VAL 27 HA VAL 27 6.970 -2.937 -5.989 145 HB VAL 27 HB VAL 27 5.805 -3.996 -7.976 146 HG11 VAL 27 1HG1 VAL 27 4.034 -1.920 -7.677 147 HG12 VAL 27 2HG1 VAL 27 5.013 -1.405 -9.052 148 HG13 VAL 27 3HG1 VAL 27 4.175 -2.956 -9.097 149 HG21 VAL 27 3HG2 VAL 27 7.220 -1.412 -8.605 150 HG22 VAL 27 1HG2 VAL 27 8.044 -2.852 -8.006 151 HG23 VAL 27 2HG2 VAL 27 7.204 -2.897 -9.556 152 H ALA 28 H ALA 28 7.745 -0.828 -6.709 153 HA ALA 28 HA ALA 28 5.964 1.348 -5.823 154 HB1 ALA 28 1HB ALA 28 7.662 2.348 -4.697 155 HB2 ALA 28 2HB ALA 28 8.220 0.679 -4.581 156 HB3 ALA 28 3HB ALA 28 8.899 1.753 -5.805 157 HA PRO 29 HA PRO 29 6.378 2.555 -10.121 158 HB2 PRO 29 2HB PRO 29 4.600 4.600 -9.969 159 HB3 PRO 29 3HB PRO 29 4.108 2.908 -10.098 160 HG2 PRO 29 2HG PRO 29 4.272 4.652 -7.671 161 HG3 PRO 29 3HG PRO 29 3.006 3.502 -8.138 162 HD2 PRO 29 2HD PRO 29 4.913 2.907 -6.310 163 HD3 PRO 29 3HD PRO 29 4.205 1.683 -7.384 164 H ASN 30 H ASN 30 7.153 4.261 -7.268 165 HA ASN 30 HA ASN 30 8.069 6.654 -8.624 166 HB2 ASN 30 2HB ASN 30 8.761 7.395 -6.382 167 HB3 ASN 30 3HB ASN 30 7.085 6.854 -6.390 168 HD21 ASN 30 1HD2 ASN 30 6.488 5.165 -5.144 169 HD22 ASN 30 2HD2 ASN 30 7.557 4.319 -4.082 170 H ALA 31 H ALA 31 9.228 3.770 -8.854 171 HA ALA 31 HA ALA 31 12.029 4.440 -8.264 172 HB1 ALA 31 1HB ALA 31 12.074 1.813 -8.976 173 HB2 ALA 31 2HB ALA 31 11.931 2.408 -7.321 174 HB3 ALA 31 3HB ALA 31 10.485 1.951 -8.222 175 H THR 32 H THR 32 10.661 2.210 -10.653 176 HA THR 32 HA THR 32 11.479 3.847 -12.880 177 HB THR 32 HB THR 32 12.777 1.222 -13.090 178 HG1 THR 32 HG1 THR 32 13.375 1.585 -10.971 179 HG21 THR 32 3HG2 THR 32 12.879 3.424 -14.551 180 HG22 THR 32 1HG2 THR 32 14.280 2.365 -14.393 181 HG23 THR 32 2HG2 THR 32 14.171 3.834 -13.422 182 H VAL 33 H VAL 33 10.518 3.242 -14.790 183 HA VAL 33 HA VAL 33 8.241 1.552 -14.614 184 HB VAL 33 HB VAL 33 9.533 2.658 -17.110 185 HG11 VAL 33 1HG1 VAL 33 7.191 1.028 -16.624 186 HG12 VAL 33 2HG1 VAL 33 6.781 2.540 -17.437 187 HG13 VAL 33 3HG1 VAL 33 7.974 1.451 -18.146 188 HG21 VAL 33 3HG2 VAL 33 7.417 3.857 -15.325 189 HG22 VAL 33 1HG2 VAL 33 9.060 4.455 -15.554 190 HG23 VAL 33 2HG2 VAL 33 7.910 4.500 -16.891 191 H GLY 34 H GLY 34 11.358 1.237 -16.303 192 HA2 GLY 34 2HA GLY 34 10.832 -1.275 -17.468 193 HA3 GLY 34 3HA GLY 34 12.427 -0.594 -17.183 194 H ALA 35 H ALA 35 12.053 -0.376 -14.302 195 HA ALA 35 HA ALA 35 13.020 -2.922 -13.549 196 HB1 ALA 35 1HB ALA 35 13.222 -2.059 -11.374 197 HB2 ALA 35 2HB ALA 35 13.487 -0.680 -12.442 198 HB3 ALA 35 3HB ALA 35 11.934 -0.881 -11.631 199 H VAL 36 H VAL 36 9.893 -1.318 -13.042 200 HA VAL 36 HA VAL 36 8.731 -3.424 -11.545 201 HB VAL 36 HB VAL 36 7.365 -1.287 -13.188 202 HG11 VAL 36 1HG1 VAL 36 6.366 -3.451 -11.451 203 HG12 VAL 36 2HG1 VAL 36 5.637 -1.862 -11.208 204 HG13 VAL 36 3HG1 VAL 36 5.587 -2.623 -12.799 205 HG21 VAL 36 3HG2 VAL 36 7.116 -0.719 -10.472 206 HG22 VAL 36 1HG2 VAL 36 8.798 -1.205 -10.683 207 HG23 VAL 36 2HG2 VAL 36 8.136 0.119 -11.642 208 H ARG 37 H ARG 37 8.561 -2.546 -14.982 209 HA ARG 37 HA ARG 37 6.774 -4.552 -15.778 210 HB2 ARG 37 2HB ARG 37 7.341 -2.634 -17.193 211 HB3 ARG 37 3HB ARG 37 8.985 -3.236 -17.366 212 HG2 ARG 37 2HG ARG 37 8.322 -5.015 -18.718 213 HG3 ARG 37 3HG ARG 37 6.634 -4.884 -18.218 214 HD2 ARG 37 2HD ARG 37 7.179 -4.039 -20.538 215 HD3 ARG 37 3HD ARG 37 6.308 -2.921 -19.488 216 HE ARG 37 HE ARG 37 8.081 -1.498 -19.638 217 HH11 ARG 37 1HH1 ARG 37 9.166 -4.705 -20.448 218 HH12 ARG 37 2HH1 ARG 37 10.763 -4.195 -20.885 219 HH21 ARG 37 1HH2 ARG 37 10.180 -0.814 -20.210 220 HH22 ARG 37 2HH2 ARG 37 11.339 -1.982 -20.749 221 H THR 38 H THR 38 10.309 -4.532 -15.585 222 HA THR 38 HA THR 38 10.689 -7.106 -16.704 223 HB THR 38 HB THR 38 12.490 -5.566 -14.824 224 HG1 THR 38 HG1 THR 38 11.982 -4.548 -16.879 225 HG21 THR 38 3HG2 THR 38 13.545 -7.566 -14.742 226 HG22 THR 38 1HG2 THR 38 14.141 -7.085 -16.330 227 HG23 THR 38 2HG2 THR 38 12.752 -8.164 -16.199 228 H LYS 39 H LYS 39 10.278 -5.947 -13.395 229 HA LYS 39 HA LYS 39 10.865 -8.361 -12.075 230 HB2 LYS 39 2HB LYS 39 10.795 -6.309 -10.828 231 HB3 LYS 39 3HB LYS 39 9.121 -6.026 -11.285 232 HG2 LYS 39 2HG LYS 39 9.246 -6.782 -8.998 233 HG3 LYS 39 3HG LYS 39 8.446 -8.001 -9.994 234 HD2 LYS 39 2HD LYS 39 9.983 -9.101 -8.506 235 HD3 LYS 39 3HD LYS 39 10.610 -9.212 -10.152 236 HE2 LYS 39 2HE LYS 39 12.432 -8.002 -9.660 237 HE3 LYS 39 3HE LYS 39 11.514 -6.839 -8.704 238 HZ1 LYS 39 3HZ LYS 39 13.244 -8.344 -7.551 239 HZ2 LYS 39 1HZ LYS 39 12.039 -9.530 -7.631 240 HZ3 LYS 39 2HZ LYS 39 11.751 -8.086 -6.799 241 H VAL 40 H VAL 40 7.820 -7.031 -13.301 242 HA VAL 40 HA VAL 40 6.176 -9.128 -12.330 243 HB VAL 40 HB VAL 40 5.709 -7.201 -14.609 244 HG11 VAL 40 1HG1 VAL 40 4.296 -9.146 -14.873 245 HG12 VAL 40 2HG1 VAL 40 3.786 -9.039 -13.187 246 HG13 VAL 40 3HG1 VAL 40 3.327 -7.776 -14.331 247 HG21 VAL 40 3HG2 VAL 40 6.045 -6.252 -12.297 248 HG22 VAL 40 1HG2 VAL 40 4.504 -5.866 -13.062 249 HG23 VAL 40 2HG2 VAL 40 4.583 -7.113 -11.818 250 H CYS 41 H CYS 41 7.671 -8.504 -15.490 251 HA CYS 41 HA CYS 41 6.602 -10.678 -16.870 252 HB2 CYS 41 2HB CYS 41 8.348 -8.632 -17.466 253 HB3 CYS 41 3HB CYS 41 9.374 -10.056 -17.586 254 HG CYS 41 HG CYS 41 6.890 -9.035 -19.592 255 H ALA 42 H ALA 42 9.548 -10.439 -14.917 256 HA ALA 42 HA ALA 42 10.464 -13.068 -15.421 257 HB1 ALA 42 1HB ALA 42 11.314 -10.818 -13.900 258 HB2 ALA 42 2HB ALA 42 11.358 -12.247 -12.866 259 HB3 ALA 42 3HB ALA 42 12.242 -12.234 -14.393 260 H MET 43 H MET 43 8.556 -11.668 -12.772 261 HA MET 43 HA MET 43 8.350 -13.970 -11.198 262 HB2 MET 43 2HB MET 43 7.006 -11.377 -11.374 263 HB3 MET 43 3HB MET 43 5.958 -12.662 -10.787 264 HG2 MET 43 2HG MET 43 8.649 -12.478 -9.582 265 HG3 MET 43 3HG MET 43 7.505 -11.196 -9.191 266 HE1 MET 43 3HE MET 43 7.603 -15.424 -7.589 267 HE2 MET 43 1HE MET 43 7.995 -15.118 -9.282 268 HE3 MET 43 2HE MET 43 8.932 -14.340 -8.006 269 H LYS 44 H LYS 44 6.672 -13.014 -14.092 270 HA LYS 44 HA LYS 44 4.769 -15.220 -13.820 271 HB2 LYS 44 2HB LYS 44 3.910 -13.007 -14.501 272 HB3 LYS 44 3HB LYS 44 4.943 -13.054 -15.924 273 HG2 LYS 44 2HG LYS 44 3.428 -14.202 -17.056 274 HG3 LYS 44 3HG LYS 44 3.342 -15.431 -15.792 275 HD2 LYS 44 2HD LYS 44 1.879 -12.795 -15.703 276 HD3 LYS 44 3HD LYS 44 1.168 -14.308 -16.268 277 HE2 LYS 44 2HE LYS 44 2.397 -14.774 -13.744 278 HE3 LYS 44 3HE LYS 44 1.384 -13.337 -13.612 279 HZ1 LYS 44 3HZ LYS 44 0.529 -15.923 -13.482 280 HZ2 LYS 44 1HZ LYS 44 0.094 -15.447 -15.046 281 HZ3 LYS 44 2HZ LYS 44 -0.451 -14.564 -13.711 282 H LYS 45 H LYS 45 7.788 -14.610 -15.129 283 HA LYS 45 HA LYS 45 9.167 -15.789 -16.502 284 HB2 LYS 45 2HB LYS 45 8.125 -17.698 -15.167 285 HB3 LYS 45 3HB LYS 45 7.070 -17.954 -16.550 286 HG2 LYS 45 2HG LYS 45 8.876 -19.484 -16.727 287 HG3 LYS 45 3HG LYS 45 9.113 -18.241 -17.957 288 HD2 LYS 45 2HD LYS 45 11.221 -18.711 -16.881 289 HD3 LYS 45 3HD LYS 45 10.687 -17.090 -16.431 290 HE2 LYS 45 2HE LYS 45 10.686 -17.627 -14.273 291 HE3 LYS 45 3HE LYS 45 9.665 -19.033 -14.574 292 HZ1 LYS 45 3HZ LYS 45 11.591 -20.342 -15.060 293 HZ2 LYS 45 1HZ LYS 45 11.830 -19.584 -13.566 294 HZ3 LYS 45 2HZ LYS 45 12.609 -18.995 -14.947 295 H LEU 46 H LEU 46 7.955 -13.906 -17.841 296 HA LEU 46 HA LEU 46 6.990 -15.183 -20.316 297 HB2 LEU 46 2HB LEU 46 5.975 -12.923 -18.773 298 HB3 LEU 46 3HB LEU 46 6.188 -12.561 -20.484 299 HG LEU 46 HG LEU 46 4.676 -14.327 -21.100 300 HD11 LEU 46 1HD1 LEU 46 4.884 -15.048 -18.210 301 HD12 LEU 46 2HD1 LEU 46 4.991 -16.080 -19.636 302 HD13 LEU 46 3HD1 LEU 46 3.427 -15.451 -19.118 303 HD21 LEU 46 3HD2 LEU 46 3.155 -13.115 -18.869 304 HD22 LEU 46 1HD2 LEU 46 2.769 -13.214 -20.587 305 HD23 LEU 46 2HD2 LEU 46 3.922 -12.010 -20.011 306 HA PRO 47 HA PRO 47 10.265 -13.337 -22.578 307 HB2 PRO 47 2HB PRO 47 9.044 -12.560 -24.875 308 HB3 PRO 47 3HB PRO 47 9.354 -14.254 -24.477 309 HG2 PRO 47 2HG PRO 47 6.829 -12.671 -24.188 310 HG3 PRO 47 3HG PRO 47 7.050 -14.325 -24.789 311 HD2 PRO 47 2HD PRO 47 6.203 -13.790 -22.274 312 HD3 PRO 47 3HD PRO 47 7.191 -15.212 -22.666 313 HA PRO 48 HA PRO 48 9.739 -9.020 -21.364 314 HB2 PRO 48 2HB PRO 48 12.398 -8.472 -21.334 315 HB3 PRO 48 3HB PRO 48 11.572 -9.298 -20.007 316 HG2 PRO 48 2HG PRO 48 13.208 -10.454 -22.231 317 HG3 PRO 48 3HG PRO 48 13.209 -10.872 -20.508 318 HD2 PRO 48 2HD PRO 48 11.907 -12.351 -22.365 319 HD3 PRO 48 3HD PRO 48 11.323 -12.185 -20.697 320 H ASP 49 H ASP 49 11.495 -10.360 -24.078 321 HA ASP 49 HA ASP 49 12.188 -8.011 -25.421 322 HB2 ASP 49 2HB ASP 49 11.629 -10.820 -26.316 323 HB3 ASP 49 3HB ASP 49 11.917 -9.556 -27.509 324 H THR 50 H THR 50 9.195 -9.892 -25.473 325 HA THR 50 HA THR 50 7.938 -7.725 -27.028 326 HB THR 50 HB THR 50 6.145 -9.579 -27.440 327 HG1 THR 50 HG1 THR 50 6.936 -11.217 -26.168 328 HG21 THR 50 3HG2 THR 50 7.299 -10.273 -29.464 329 HG22 THR 50 1HG2 THR 50 8.838 -9.728 -28.800 330 HG23 THR 50 2HG2 THR 50 7.574 -8.556 -29.171 331 H THR 51 H THR 51 7.854 -6.759 -24.768 332 HA THR 51 HA THR 51 5.245 -7.416 -23.612 333 HB THR 51 HB THR 51 7.030 -8.533 -22.239 334 HG1 THR 51 HG1 THR 51 5.497 -6.456 -21.026 335 HG21 THR 51 3HG2 THR 51 8.564 -6.425 -22.605 336 HG22 THR 51 1HG2 THR 51 8.662 -7.362 -21.115 337 HG23 THR 51 2HG2 THR 51 7.752 -5.851 -21.149 338 H ARG 52 H ARG 52 4.150 -5.679 -22.724 339 HA ARG 52 HA ARG 52 5.487 -3.074 -22.714 340 HB2 ARG 52 2HB ARG 52 3.119 -3.858 -24.369 341 HB3 ARG 52 3HB ARG 52 3.243 -2.211 -23.765 342 HG2 ARG 52 2HG ARG 52 4.250 -1.967 -25.790 343 HG3 ARG 52 3HG ARG 52 5.656 -2.369 -24.802 344 HD2 ARG 52 2HD ARG 52 6.060 -4.028 -26.230 345 HD3 ARG 52 3HD ARG 52 4.629 -4.828 -25.581 346 HE ARG 52 HE ARG 52 3.569 -4.406 -27.554 347 HH11 ARG 52 1HH1 ARG 52 6.265 -2.224 -27.253 348 HH12 ARG 52 2HH1 ARG 52 6.071 -1.558 -28.841 349 HH21 ARG 52 1HH2 ARG 52 3.303 -3.537 -29.646 350 HH22 ARG 52 2HH2 ARG 52 4.385 -2.305 -30.201 351 H LEU 53 H LEU 53 4.123 -1.384 -21.653 352 HA LEU 53 HA LEU 53 2.208 -2.493 -19.729 353 HB2 LEU 53 2HB LEU 53 4.138 -2.445 -18.416 354 HB3 LEU 53 3HB LEU 53 4.695 -0.934 -19.131 355 HG LEU 53 HG LEU 53 3.019 0.306 -17.902 356 HD11 LEU 53 1HD1 LEU 53 1.785 -2.260 -17.665 357 HD12 LEU 53 2HD1 LEU 53 1.135 -0.670 -17.268 358 HD13 LEU 53 3HD1 LEU 53 2.039 -1.579 -16.058 359 HD21 LEU 53 3HD2 LEU 53 4.731 -1.589 -16.326 360 HD22 LEU 53 1HD2 LEU 53 3.757 -0.345 -15.541 361 HD23 LEU 53 2HD2 LEU 53 5.012 0.114 -16.692 362 H THR 54 H THR 54 0.474 -1.231 -19.357 363 HA THR 54 HA THR 54 0.543 1.536 -20.365 364 HB THR 54 HB THR 54 -2.121 0.485 -20.515 365 HG1 THR 54 HG1 THR 54 -1.447 -0.969 -22.386 366 HG21 THR 54 3HG2 THR 54 -1.749 2.278 -21.892 367 HG22 THR 54 1HG2 THR 54 -1.523 0.968 -23.049 368 HG23 THR 54 2HG2 THR 54 -0.122 1.752 -22.320 369 H TYR 55 H TYR 55 0.110 2.964 -18.828 370 HA TYR 55 HA TYR 55 -1.655 2.157 -16.611 371 HB2 TYR 55 2HB TYR 55 0.557 2.283 -15.711 372 HB3 TYR 55 3HB TYR 55 0.869 3.811 -16.525 373 HD1 TYR 55 HD1 TYR 55 -1.842 2.526 -14.285 374 HD2 TYR 55 HD2 TYR 55 1.035 5.567 -15.048 375 HE1 TYR 55 HE1 TYR 55 -2.602 3.739 -12.284 376 HE2 TYR 55 HE2 TYR 55 0.283 6.787 -13.049 377 HH TYR 55 HH TYR 55 -2.076 6.824 -11.695 378 H LYS 56 H LYS 56 -3.383 3.397 -16.310 379 HA LYS 56 HA LYS 56 -4.914 5.059 -16.584 380 HB2 LYS 56 2HB LYS 56 -2.843 6.179 -15.353 381 HB3 LYS 56 3HB LYS 56 -2.757 7.101 -16.848 382 HG2 LYS 56 2HG LYS 56 -4.341 8.447 -16.102 383 HG3 LYS 56 3HG LYS 56 -5.460 7.085 -16.018 384 HD2 LYS 56 2HD LYS 56 -3.492 7.366 -13.818 385 HD3 LYS 56 3HD LYS 56 -4.804 8.544 -13.882 386 HE2 LYS 56 2HE LYS 56 -5.249 5.569 -14.001 387 HE3 LYS 56 3HE LYS 56 -5.236 6.480 -12.492 388 HZ1 LYS 56 3HZ LYS 56 -6.964 7.931 -13.816 389 HZ2 LYS 56 1HZ LYS 56 -7.441 6.545 -12.971 390 HZ3 LYS 56 2HZ LYS 56 -7.214 6.478 -14.646 391 H GLY 57 H GLY 57 -3.939 3.752 -18.966 392 HA2 GLY 57 2HA GLY 57 -4.343 3.939 -21.225 393 HA3 GLY 57 3HA GLY 57 -5.046 5.519 -20.910 394 H ARG 58 H ARG 58 -1.899 5.157 -19.685 395 HA ARG 58 HA ARG 58 -0.767 6.475 -22.064 396 HB2 ARG 58 2HB ARG 58 -0.954 7.436 -19.334 397 HB3 ARG 58 3HB ARG 58 0.718 7.364 -19.872 398 HG2 ARG 58 2HG ARG 58 -1.231 8.582 -21.731 399 HG3 ARG 58 3HG ARG 58 -0.841 9.484 -20.265 400 HD2 ARG 58 2HD ARG 58 1.409 8.330 -21.819 401 HD3 ARG 58 3HD ARG 58 0.574 9.724 -22.502 402 HE ARG 58 HE ARG 58 2.392 9.734 -20.321 403 HH11 ARG 58 1HH1 ARG 58 -0.505 11.250 -21.516 404 HH12 ARG 58 2HH1 ARG 58 -0.230 12.738 -20.672 405 HH21 ARG 58 1HH2 ARG 58 2.765 11.688 -19.205 406 HH22 ARG 58 2HH2 ARG 58 1.630 12.986 -19.359 407 H ALA 59 H ALA 59 1.479 6.138 -22.437 408 HA ALA 59 HA ALA 59 2.446 3.609 -21.294 409 HB1 ALA 59 1HB ALA 59 4.069 4.316 -23.463 410 HB2 ALA 59 2HB ALA 59 2.825 3.067 -23.413 411 HB3 ALA 59 3HB ALA 59 2.418 4.696 -23.952 412 H LEU 60 H LEU 60 3.972 3.730 -19.796 413 HA LEU 60 HA LEU 60 5.782 6.055 -19.811 414 HB2 LEU 60 2HB LEU 60 4.846 4.334 -17.522 415 HB3 LEU 60 3HB LEU 60 6.092 5.572 -17.387 416 HG LEU 60 HG LEU 60 3.942 6.929 -18.477 417 HD11 LEU 60 1HD1 LEU 60 3.008 4.769 -16.637 418 HD12 LEU 60 2HD1 LEU 60 2.276 5.374 -18.123 419 HD13 LEU 60 3HD1 LEU 60 2.198 6.336 -16.647 420 HD21 LEU 60 3HD2 LEU 60 5.361 7.897 -16.845 421 HD22 LEU 60 1HD2 LEU 60 4.952 6.661 -15.655 422 HD23 LEU 60 2HD2 LEU 60 3.744 7.851 -16.139 423 H LYS 61 H LYS 61 7.988 5.716 -19.269 424 HA LYS 61 HA LYS 61 9.038 3.061 -18.975 425 HB2 LYS 61 2HB LYS 61 8.776 4.198 -21.619 426 HB3 LYS 61 3HB LYS 61 10.470 3.933 -21.226 427 HG2 LYS 61 2HG LYS 61 10.063 1.607 -20.793 428 HG3 LYS 61 3HG LYS 61 8.324 1.834 -20.993 429 HD2 LYS 61 2HD LYS 61 8.503 2.132 -23.294 430 HD3 LYS 61 3HD LYS 61 10.218 2.540 -23.205 431 HE2 LYS 61 2HE LYS 61 10.861 0.384 -23.263 432 HE3 LYS 61 3HE LYS 61 9.536 -0.143 -22.227 433 HZ1 LYS 61 3HZ LYS 61 9.750 -0.268 -25.050 434 HZ2 LYS 61 1HZ LYS 61 8.377 0.618 -24.611 435 HZ3 LYS 61 2HZ LYS 61 8.584 -0.959 -24.037 436 H ASP 62 H ASP 62 10.401 5.953 -20.527 437 HA ASP 62 HA ASP 62 12.683 5.906 -18.795 438 HB2 ASP 62 2HB ASP 62 12.221 6.889 -21.304 439 HB3 ASP 62 3HB ASP 62 12.203 8.364 -20.341 440 H THR 63 H THR 63 9.585 6.994 -18.366 441 HA THR 63 HA THR 63 9.887 9.480 -17.114 442 HB THR 63 HB THR 63 7.839 7.689 -15.962 443 HG1 THR 63 HG1 THR 63 7.624 8.481 -18.685 444 HG21 THR 63 3HG2 THR 63 8.164 10.488 -16.789 445 HG22 THR 63 1HG2 THR 63 7.219 9.799 -15.470 446 HG23 THR 63 2HG2 THR 63 6.569 9.808 -17.109 447 H GLU 64 H GLU 64 10.787 6.342 -16.081 448 HA GLU 64 HA GLU 64 11.803 5.569 -14.197 449 HB2 GLU 64 2HB GLU 64 12.326 8.454 -14.167 450 HB3 GLU 64 3HB GLU 64 12.384 7.708 -12.576 451 HG2 GLU 64 2HG GLU 64 14.116 6.248 -13.209 452 HG3 GLU 64 3HG GLU 64 13.895 6.605 -14.921 453 H THR 65 H THR 65 10.414 8.431 -12.659 454 HA THR 65 HA THR 65 8.851 6.656 -10.923 455 HB THR 65 HB THR 65 8.802 8.383 -9.301 456 HG1 THR 65 HG1 THR 65 9.725 10.076 -11.395 457 HG21 THR 65 3HG2 THR 65 11.036 7.207 -9.769 458 HG22 THR 65 1HG2 THR 65 11.072 8.669 -8.785 459 HG23 THR 65 2HG2 THR 65 11.541 8.737 -10.484 460 H LEU 66 H LEU 66 6.685 7.344 -10.282 461 HA LEU 66 HA LEU 66 5.310 8.786 -12.453 462 HB2 LEU 66 2HB LEU 66 4.504 6.396 -10.834 463 HB3 LEU 66 3HB LEU 66 3.297 7.405 -11.630 464 HG LEU 66 HG LEU 66 5.217 6.756 -13.588 465 HD11 LEU 66 1HD1 LEU 66 5.124 4.301 -13.560 466 HD12 LEU 66 2HD1 LEU 66 4.362 4.359 -11.972 467 HD13 LEU 66 3HD1 LEU 66 6.009 4.951 -12.180 468 HD21 LEU 66 3HD2 LEU 66 2.846 7.153 -13.969 469 HD22 LEU 66 1HD2 LEU 66 2.443 5.679 -13.089 470 HD23 LEU 66 2HD2 LEU 66 3.327 5.583 -14.613 471 H GLU 67 H GLU 67 5.984 8.667 -9.116 472 HA GLU 67 HA GLU 67 3.725 9.863 -7.997 473 HB2 GLU 67 2HB GLU 67 5.138 10.487 -6.146 474 HB3 GLU 67 3HB GLU 67 5.612 8.890 -6.708 475 HG2 GLU 67 2HG GLU 67 7.480 9.901 -7.944 476 HG3 GLU 67 3HG GLU 67 7.021 11.480 -7.310 477 H SER 68 H SER 68 6.361 11.225 -9.834 478 HA SER 68 HA SER 68 5.982 13.936 -9.161 479 HB2 SER 68 2HB SER 68 7.614 12.428 -10.969 480 HB3 SER 68 3HB SER 68 6.899 13.783 -11.843 481 HG SER 68 HG SER 68 7.854 15.189 -10.463 482 H LEU 69 H LEU 69 4.148 11.790 -11.081 483 HA LEU 69 HA LEU 69 2.802 13.979 -12.488 484 HB2 LEU 69 2HB LEU 69 2.147 11.085 -12.848 485 HB3 LEU 69 3HB LEU 69 1.975 12.415 -13.991 486 HG LEU 69 HG LEU 69 4.561 11.099 -13.161 487 HD11 LEU 69 1HD1 LEU 69 3.081 9.772 -14.657 488 HD12 LEU 69 2HD1 LEU 69 4.625 10.215 -15.385 489 HD13 LEU 69 3HD1 LEU 69 3.159 11.089 -15.828 490 HD21 LEU 69 3HD2 LEU 69 4.056 13.300 -15.161 491 HD22 LEU 69 1HD2 LEU 69 5.602 12.512 -14.847 492 HD23 LEU 69 2HD2 LEU 69 4.841 13.493 -13.594 493 H GLY 70 H GLY 70 2.480 12.021 -9.745 494 HA2 GLY 70 2HA GLY 70 0.790 12.519 -8.120 495 HA3 GLY 70 3HA GLY 70 -0.302 12.926 -9.435 496 H VAL 71 H VAL 71 1.675 10.092 -8.543 497 HA VAL 71 HA VAL 71 -0.511 8.345 -9.357 498 HB VAL 71 HB VAL 71 1.845 7.856 -10.036 499 HG11 VAL 71 1HG1 VAL 71 3.520 7.601 -8.575 500 HG12 VAL 71 2HG1 VAL 71 2.451 8.396 -7.418 501 HG13 VAL 71 3HG1 VAL 71 2.536 6.635 -7.476 502 HG21 VAL 71 3HG2 VAL 71 1.578 5.547 -9.910 503 HG22 VAL 71 1HG2 VAL 71 0.833 5.623 -8.314 504 HG23 VAL 71 2HG2 VAL 71 -0.069 6.151 -9.734 505 H ALA 72 H ALA 72 -1.631 6.999 -8.007 506 HA ALA 72 HA ALA 72 -1.156 7.356 -5.119 507 HB1 ALA 72 1HB ALA 72 -3.442 7.998 -6.584 508 HB2 ALA 72 2HB ALA 72 -3.843 6.514 -5.720 509 HB3 ALA 72 3HB ALA 72 -3.283 7.928 -4.829 510 H ASP 73 H ASP 73 -1.444 5.565 -3.761 511 HA ASP 73 HA ASP 73 -0.661 3.076 -4.862 512 HB2 ASP 73 2HB ASP 73 -1.510 3.992 -2.133 513 HB3 ASP 73 3HB ASP 73 -1.295 2.275 -2.460 514 H GLY 74 H GLY 74 -1.793 1.142 -5.081 515 HA2 GLY 74 2HA GLY 74 -3.705 -0.237 -5.014 516 HA3 GLY 74 3HA GLY 74 -4.681 1.173 -4.630 517 H ASP 75 H ASP 75 -2.491 1.658 -7.185 518 HA ASP 75 HA ASP 75 -4.648 1.937 -9.066 519 HB2 ASP 75 2HB ASP 75 -1.815 2.681 -8.923 520 HB3 ASP 75 3HB ASP 75 -2.338 2.200 -10.535 521 H LYS 76 H LYS 76 -4.662 0.919 -11.186 522 HA LYS 76 HA LYS 76 -3.599 -1.829 -11.093 523 HB2 LYS 76 2HB LYS 76 -6.006 -1.865 -10.935 524 HB3 LYS 76 3HB LYS 76 -6.157 -0.785 -12.316 525 HG2 LYS 76 2HG LYS 76 -4.645 -3.107 -13.052 526 HG3 LYS 76 3HG LYS 76 -6.176 -3.584 -12.314 527 HD2 LYS 76 2HD LYS 76 -5.953 -1.540 -14.517 528 HD3 LYS 76 3HD LYS 76 -6.244 -3.257 -14.805 529 HE2 LYS 76 2HE LYS 76 -7.987 -1.587 -13.010 530 HE3 LYS 76 3HE LYS 76 -8.286 -1.756 -14.740 531 HZ1 LYS 76 3HZ LYS 76 -8.136 -4.018 -12.821 532 HZ2 LYS 76 1HZ LYS 76 -8.527 -4.118 -14.464 533 HZ3 LYS 76 2HZ LYS 76 -9.572 -3.331 -13.393 534 H PHE 77 H PHE 77 -2.280 -2.443 -12.685 535 HA PHE 77 HA PHE 77 -2.049 -0.684 -15.036 536 HB2 PHE 77 2HB PHE 77 0.103 -2.547 -14.045 537 HB3 PHE 77 3HB PHE 77 0.264 -1.191 -15.156 538 HD1 PHE 77 HD2 PHE 77 -0.162 1.150 -14.228 539 HD2 PHE 77 HD1 PHE 77 0.486 -2.266 -11.773 540 HE1 PHE 77 HE2 PHE 77 0.440 2.619 -12.349 541 HE2 PHE 77 HE1 PHE 77 1.088 -0.802 -9.889 542 HZ PHE 77 HZ PHE 77 1.067 1.644 -10.176 543 H VAL 78 H VAL 78 -1.818 -1.603 -17.086 544 HA VAL 78 HA VAL 78 -2.835 -4.350 -17.281 545 HB VAL 78 HB VAL 78 -2.677 -2.287 -19.479 546 HG11 VAL 78 1HG1 VAL 78 -3.054 -4.130 -20.704 547 HG12 VAL 78 2HG1 VAL 78 -3.564 -5.077 -19.305 548 HG13 VAL 78 3HG1 VAL 78 -4.704 -3.989 -20.099 549 HG21 VAL 78 3HG2 VAL 78 -4.780 -2.827 -17.424 550 HG22 VAL 78 1HG2 VAL 78 -4.171 -1.286 -18.028 551 HG23 VAL 78 2HG2 VAL 78 -5.241 -2.265 -19.031 552 H LEU 79 H LEU 79 -1.588 -5.952 -17.999 553 HA LEU 79 HA LEU 79 1.047 -5.268 -19.104 554 HB2 LEU 79 2HB LEU 79 0.302 -8.003 -18.166 555 HB3 LEU 79 3HB LEU 79 1.887 -7.235 -18.222 556 HG LEU 79 HG LEU 79 -0.287 -6.467 -16.279 557 HD11 LEU 79 1HD1 LEU 79 1.365 -7.651 -14.669 558 HD12 LEU 79 2HD1 LEU 79 1.889 -8.509 -16.117 559 HD13 LEU 79 3HD1 LEU 79 0.210 -8.615 -15.589 560 HD21 LEU 79 3HD2 LEU 79 2.623 -5.754 -16.560 561 HD22 LEU 79 1HD2 LEU 79 1.707 -5.494 -15.075 562 HD23 LEU 79 2HD2 LEU 79 1.229 -4.673 -16.561 563 H ILE 80 H ILE 80 1.572 -5.794 -21.132 564 HA ILE 80 HA ILE 80 -0.267 -7.556 -22.617 565 HB ILE 80 HB ILE 80 1.363 -5.319 -23.815 566 HG12 ILE 80 2HG1 ILE 80 -1.330 -4.639 -23.995 567 HG13 ILE 80 3HG1 ILE 80 -1.154 -5.248 -22.353 568 HG21 ILE 80 1HG2 ILE 80 0.897 -6.742 -25.557 569 HG22 ILE 80 2HG2 ILE 80 -0.625 -7.282 -24.851 570 HG23 ILE 80 3HG2 ILE 80 -0.517 -5.689 -25.599 571 HD11 ILE 80 3HD1 ILE 80 -0.649 -2.696 -23.166 572 HD12 ILE 80 1HD1 ILE 80 -0.033 -3.442 -21.691 573 HD13 ILE 80 2HD1 ILE 80 0.963 -3.411 -23.147 574 H THR 81 H THR 81 0.607 -9.012 -24.092 575 HA THR 81 HA THR 81 3.502 -9.190 -24.353 576 HB THR 81 HB THR 81 3.271 -10.538 -22.418 577 HG1 THR 81 HG1 THR 81 3.505 -12.751 -23.453 578 HG21 THR 81 3HG2 THR 81 0.682 -11.165 -23.562 579 HG22 THR 81 1HG2 THR 81 1.231 -11.286 -21.891 580 HG23 THR 81 2HG2 THR 81 1.522 -12.615 -23.013 581 H ARG 82 H ARG 82 4.076 -9.847 -26.332 582 HA ARG 82 HA ARG 82 1.963 -10.835 -28.108 583 HB2 ARG 82 2HB ARG 82 4.456 -9.263 -28.498 584 HB3 ARG 82 3HB ARG 82 3.963 -10.328 -29.807 585 HG2 ARG 82 2HG ARG 82 2.199 -8.224 -28.575 586 HG3 ARG 82 3HG ARG 82 3.155 -7.999 -30.041 587 HD2 ARG 82 2HD ARG 82 1.664 -10.410 -30.295 588 HD3 ARG 82 3HD ARG 82 0.569 -9.131 -29.772 589 HE ARG 82 HE ARG 82 2.051 -8.050 -31.822 590 HH11 ARG 82 1HH1 ARG 82 -0.097 -10.759 -31.415 591 HH12 ARG 82 2HH1 ARG 82 -0.652 -10.733 -33.056 592 HH21 ARG 82 1HH2 ARG 82 1.327 -8.004 -33.985 593 HH22 ARG 82 2HH2 ARG 82 0.159 -9.166 -34.517 594 H THR 83 H THR 83 2.001 -12.829 -28.950 595 HA THR 83 HA THR 83 4.001 -14.689 -28.025 596 HB THR 83 HB THR 83 2.604 -16.289 -29.543 597 HG1 THR 83 HG1 THR 83 0.366 -15.338 -29.602 598 HG21 THR 83 3HG2 THR 83 0.758 -15.465 -27.477 599 HG22 THR 83 1HG2 THR 83 2.417 -15.471 -26.880 600 HG23 THR 83 2HG2 THR 83 1.730 -16.932 -27.592 601 H VAL 84 H VAL 84 5.195 -16.118 -29.431 602 HA VAL 84 HA VAL 84 5.755 -14.961 -32.084 603 HB VAL 84 HB VAL 84 8.125 -15.684 -31.785 604 HG11 VAL 84 1HG1 VAL 84 8.782 -13.780 -30.457 605 HG12 VAL 84 2HG1 VAL 84 7.380 -13.349 -31.439 606 HG13 VAL 84 3HG1 VAL 84 7.182 -13.698 -29.721 607 HG21 VAL 84 3HG2 VAL 84 7.850 -15.734 -28.851 608 HG22 VAL 84 1HG2 VAL 84 7.234 -17.150 -29.704 609 HG23 VAL 84 2HG2 VAL 84 8.916 -16.659 -29.909 610 H GLY 85 H GLY 85 4.027 -17.223 -31.209 611 HA2 GLY 85 2HA GLY 85 5.433 -19.579 -32.181 612 HA3 GLY 85 3HA GLY 85 3.789 -19.525 -31.563 Start of MODEL 18 1 H1 MET 9 H MET 9 1.238 0.493 0.290 2 HA MET 9 HA MET 9 0.923 0.938 -1.920 3 HB2 MET 9 2HB MET 9 3.916 0.583 -1.951 4 HB3 MET 9 3HB MET 9 2.998 0.964 -3.402 5 HG2 MET 9 2HG MET 9 3.426 3.082 -2.839 6 HG3 MET 9 3HG MET 9 2.086 2.867 -1.715 7 HE1 MET 9 3HE MET 9 4.540 4.982 -1.643 8 HE2 MET 9 1HE MET 9 5.835 4.590 -0.511 9 HE3 MET 9 2HE MET 9 5.780 3.810 -2.092 10 H LYS 10 H LYS 10 -0.126 -0.423 -3.199 11 HA LYS 10 HA LYS 10 1.106 -3.021 -3.824 12 HB2 LYS 10 2HB LYS 10 -1.733 -2.469 -2.969 13 HB3 LYS 10 3HB LYS 10 -1.266 -3.949 -3.797 14 HG2 LYS 10 2HG LYS 10 0.547 -3.961 -1.827 15 HG3 LYS 10 3HG LYS 10 -0.757 -3.083 -1.024 16 HD2 LYS 10 2HD LYS 10 -1.922 -4.958 -0.738 17 HD3 LYS 10 3HD LYS 10 -1.803 -5.351 -2.455 18 HE2 LYS 10 2HE LYS 10 0.411 -6.328 -2.069 19 HE3 LYS 10 3HE LYS 10 0.282 -5.940 -0.354 20 HZ1 LYS 10 3HZ LYS 10 -1.993 -7.333 -0.874 21 HZ2 LYS 10 1HZ LYS 10 -0.599 -7.958 -0.149 22 HZ3 LYS 10 2HZ LYS 10 -0.839 -8.136 -1.814 23 H ILE 11 H ILE 11 0.818 -3.779 -5.891 24 HA ILE 11 HA ILE 11 -0.694 -2.043 -7.731 25 HB ILE 11 HB ILE 11 1.728 -1.677 -7.998 26 HG12 ILE 11 2HG1 ILE 11 1.119 -3.166 -10.469 27 HG13 ILE 11 3HG1 ILE 11 -0.135 -2.042 -9.956 28 HG21 ILE 11 1HG2 ILE 11 3.078 -3.540 -8.997 29 HG22 ILE 11 2HG2 ILE 11 2.636 -3.763 -7.305 30 HG23 ILE 11 3HG2 ILE 11 1.762 -4.633 -8.566 31 HD11 ILE 11 3HD1 ILE 11 2.554 -1.527 -11.021 32 HD12 ILE 11 1HD1 ILE 11 1.066 -0.593 -11.177 33 HD13 ILE 11 2HD1 ILE 11 2.032 -0.475 -9.705 34 H LYS 12 H LYS 12 -1.804 -3.036 -9.389 35 HA LYS 12 HA LYS 12 -1.893 -5.981 -9.289 36 HB2 LYS 12 2HB LYS 12 -3.945 -4.295 -8.645 37 HB3 LYS 12 3HB LYS 12 -4.266 -4.598 -10.347 38 HG2 LYS 12 2HG LYS 12 -3.966 -7.089 -9.709 39 HG3 LYS 12 3HG LYS 12 -4.234 -6.519 -8.060 40 HD2 LYS 12 2HD LYS 12 -6.093 -6.088 -10.399 41 HD3 LYS 12 3HD LYS 12 -6.319 -7.271 -9.108 42 HE2 LYS 12 2HE LYS 12 -6.225 -5.294 -7.505 43 HE3 LYS 12 3HE LYS 12 -6.395 -4.270 -8.930 44 HZ1 LYS 12 3HZ LYS 12 -8.366 -5.878 -7.578 45 HZ2 LYS 12 1HZ LYS 12 -8.377 -6.066 -9.259 46 HZ3 LYS 12 2HZ LYS 12 -8.571 -4.530 -8.579 47 H ILE 13 H ILE 13 -1.334 -6.983 -11.102 48 HA ILE 13 HA ILE 13 -1.387 -5.451 -13.619 49 HB ILE 13 HB ILE 13 0.877 -6.004 -13.055 50 HG12 ILE 13 2HG1 ILE 13 -0.129 -7.940 -15.152 51 HG13 ILE 13 3HG1 ILE 13 0.212 -6.235 -15.426 52 HG21 ILE 13 1HG2 ILE 13 -0.298 -8.375 -12.000 53 HG22 ILE 13 2HG2 ILE 13 0.951 -8.826 -13.160 54 HG23 ILE 13 3HG2 ILE 13 1.348 -7.773 -11.803 55 HD11 ILE 13 3HD1 ILE 13 2.579 -6.772 -14.640 56 HD12 ILE 13 1HD1 ILE 13 2.130 -8.462 -14.865 57 HD13 ILE 13 2HD1 ILE 13 2.087 -7.348 -16.233 58 H VAL 14 H VAL 14 -3.037 -6.030 -14.862 59 HA VAL 14 HA VAL 14 -4.006 -8.798 -14.770 60 HB VAL 14 HB VAL 14 -5.753 -7.199 -14.401 61 HG11 VAL 14 1HG1 VAL 14 -4.300 -5.648 -16.314 62 HG12 VAL 14 2HG1 VAL 14 -5.980 -5.799 -16.834 63 HG13 VAL 14 3HG1 VAL 14 -5.604 -5.149 -15.237 64 HG21 VAL 14 3HG2 VAL 14 -7.315 -7.933 -15.969 65 HG22 VAL 14 1HG2 VAL 14 -6.126 -7.979 -17.271 66 HG23 VAL 14 2HG2 VAL 14 -6.082 -9.194 -15.994 67 HA PRO 15 HA PRO 15 -1.783 -9.274 -18.647 68 HB2 PRO 15 2HB PRO 15 -2.177 -11.956 -18.808 69 HB3 PRO 15 3HB PRO 15 -0.940 -11.226 -17.776 70 HG2 PRO 15 2HG PRO 15 -3.664 -12.231 -17.046 71 HG3 PRO 15 3HG PRO 15 -2.126 -12.442 -16.188 72 HD2 PRO 15 2HD PRO 15 -3.969 -10.603 -15.444 73 HD3 PRO 15 3HD PRO 15 -2.224 -10.345 -15.237 74 H ALA 16 H ALA 16 -2.508 -9.192 -20.696 75 HA ALA 16 HA ALA 16 -5.362 -9.473 -21.160 76 HB1 ALA 16 1HB ALA 16 -4.683 -8.630 -23.482 77 HB2 ALA 16 2HB ALA 16 -4.503 -7.524 -22.119 78 HB3 ALA 16 3HB ALA 16 -3.092 -8.356 -22.771 79 H VAL 17 H VAL 17 -4.445 -11.927 -20.611 80 HA VAL 17 HA VAL 17 -4.103 -13.252 -23.218 81 HB VAL 17 HB VAL 17 -3.187 -15.154 -22.057 82 HG11 VAL 17 1HG1 VAL 17 -1.155 -14.237 -21.905 83 HG12 VAL 17 2HG1 VAL 17 -1.955 -12.706 -22.265 84 HG13 VAL 17 3HG1 VAL 17 -1.641 -13.166 -20.591 85 HG21 VAL 17 3HG2 VAL 17 -4.202 -15.464 -20.044 86 HG22 VAL 17 1HG2 VAL 17 -2.736 -14.661 -19.482 87 HG23 VAL 17 2HG2 VAL 17 -4.230 -13.742 -19.667 88 H GLY 18 H GLY 18 -4.905 -15.768 -22.706 89 HA2 GLY 18 2HA GLY 18 -7.639 -15.745 -23.055 90 HA3 GLY 18 3HA GLY 18 -6.737 -17.138 -22.477 91 H GLY 19 H GLY 19 -6.219 -17.121 -20.098 92 HA2 GLY 19 2HA GLY 19 -8.600 -16.938 -18.616 93 HA3 GLY 19 3HA GLY 19 -6.994 -17.162 -17.939 94 H GLY 20 H GLY 20 -5.779 -14.782 -18.721 95 HA2 GLY 20 2HA GLY 20 -5.469 -12.659 -17.899 96 HA3 GLY 20 3HA GLY 20 -7.161 -12.424 -18.311 97 H SER 21 H SER 21 -4.904 -13.229 -15.769 98 HA SER 21 HA SER 21 -7.033 -12.697 -13.803 99 HB2 SER 21 2HB SER 21 -5.870 -15.131 -14.088 100 HB3 SER 21 3HB SER 21 -4.777 -14.392 -12.919 101 HG SER 21 HG SER 21 -7.535 -14.918 -12.687 102 HA PRO 22 HA PRO 22 -4.324 -9.425 -12.554 103 HB2 PRO 22 2HB PRO 22 -5.657 -8.741 -10.290 104 HB3 PRO 22 3HB PRO 22 -6.229 -8.316 -11.907 105 HG2 PRO 22 2HG PRO 22 -7.088 -10.561 -10.123 106 HG3 PRO 22 3HG PRO 22 -8.081 -9.477 -11.113 107 HD2 PRO 22 2HD PRO 22 -7.450 -11.992 -11.893 108 HD3 PRO 22 3HD PRO 22 -7.670 -10.661 -13.047 109 H LEU 23 H LEU 23 -2.462 -9.467 -11.460 110 HA LEU 23 HA LEU 23 -2.231 -11.304 -9.168 111 HB2 LEU 23 2HB LEU 23 -0.895 -12.055 -11.028 112 HB3 LEU 23 3HB LEU 23 -0.160 -10.461 -11.188 113 HG LEU 23 HG LEU 23 0.556 -11.060 -8.658 114 HD11 LEU 23 1HD1 LEU 23 -0.073 -13.609 -10.011 115 HD12 LEU 23 2HD1 LEU 23 -0.066 -13.203 -8.296 116 HD13 LEU 23 3HD1 LEU 23 1.452 -13.534 -9.129 117 HD21 LEU 23 3HD2 LEU 23 2.256 -12.223 -10.791 118 HD22 LEU 23 1HD2 LEU 23 2.673 -11.114 -9.484 119 HD23 LEU 23 2HD2 LEU 23 1.840 -10.513 -10.918 120 H GLU 24 H GLU 24 -1.719 -10.452 -7.259 121 HA GLU 24 HA GLU 24 -1.129 -7.605 -7.113 122 HB2 GLU 24 2HB GLU 24 -2.087 -9.677 -5.194 123 HB3 GLU 24 3HB GLU 24 -1.260 -8.267 -4.547 124 HG2 GLU 24 2HG GLU 24 -2.904 -6.806 -5.276 125 HG3 GLU 24 3HG GLU 24 -3.528 -7.946 -6.466 126 H LEU 25 H LEU 25 0.793 -6.756 -6.587 127 HA LEU 25 HA LEU 25 2.841 -8.449 -5.370 128 HB2 LEU 25 2HB LEU 25 2.991 -8.448 -7.923 129 HB3 LEU 25 3HB LEU 25 3.490 -6.765 -7.769 130 HG LEU 25 HG LEU 25 5.361 -7.638 -6.263 131 HD11 LEU 25 1HD1 LEU 25 4.037 -9.986 -6.380 132 HD12 LEU 25 2HD1 LEU 25 5.760 -9.840 -6.035 133 HD13 LEU 25 3HD1 LEU 25 5.218 -10.218 -7.670 134 HD21 LEU 25 3HD2 LEU 25 5.990 -6.814 -8.355 135 HD22 LEU 25 1HD2 LEU 25 5.177 -8.120 -9.218 136 HD23 LEU 25 2HD2 LEU 25 6.661 -8.446 -8.322 137 H GLU 26 H GLU 26 4.603 -7.254 -4.435 138 HA GLU 26 HA GLU 26 3.781 -4.553 -3.643 139 HB2 GLU 26 2HB GLU 26 5.491 -4.860 -1.826 140 HB3 GLU 26 3HB GLU 26 4.137 -5.980 -1.765 141 HG2 GLU 26 2HG GLU 26 5.499 -7.717 -1.861 142 HG3 GLU 26 3HG GLU 26 6.249 -7.106 -3.334 143 H VAL 27 H VAL 27 4.608 -3.021 -4.912 144 HA VAL 27 HA VAL 27 7.503 -2.999 -5.350 145 HB VAL 27 HB VAL 27 6.375 -3.929 -7.397 146 HG11 VAL 27 1HG1 VAL 27 5.454 -1.177 -8.059 147 HG12 VAL 27 2HG1 VAL 27 4.875 -2.736 -8.650 148 HG13 VAL 27 3HG1 VAL 27 4.434 -2.185 -7.033 149 HG21 VAL 27 3HG2 VAL 27 7.983 -3.025 -8.698 150 HG22 VAL 27 1HG2 VAL 27 7.526 -1.370 -8.298 151 HG23 VAL 27 2HG2 VAL 27 8.517 -2.306 -7.180 152 H ALA 28 H ALA 28 8.359 -0.892 -5.847 153 HA ALA 28 HA ALA 28 6.655 1.264 -4.796 154 HB1 ALA 28 1HB ALA 28 8.878 0.583 -3.676 155 HB2 ALA 28 2HB ALA 28 9.635 1.447 -5.015 156 HB3 ALA 28 3HB ALA 28 8.541 2.296 -3.923 157 HA PRO 29 HA PRO 29 6.681 2.732 -9.030 158 HB2 PRO 29 2HB PRO 29 4.977 4.796 -8.581 159 HB3 PRO 29 3HB PRO 29 4.433 3.124 -8.761 160 HG2 PRO 29 2HG PRO 29 4.876 4.714 -6.263 161 HG3 PRO 29 3HG PRO 29 3.543 3.617 -6.670 162 HD2 PRO 29 2HD PRO 29 5.605 2.878 -5.078 163 HD3 PRO 29 3HD PRO 29 4.767 1.735 -6.147 164 H ASN 30 H ASN 30 7.764 4.253 -6.169 165 HA ASN 30 HA ASN 30 8.602 6.706 -7.465 166 HB2 ASN 30 2HB ASN 30 9.518 5.870 -4.735 167 HB3 ASN 30 3HB ASN 30 9.178 7.486 -5.348 168 HD21 ASN 30 1HD2 ASN 30 7.287 8.363 -4.873 169 HD22 ASN 30 2HD2 ASN 30 5.924 7.524 -4.223 170 H ALA 31 H ALA 31 9.678 3.753 -7.843 171 HA ALA 31 HA ALA 31 12.533 4.365 -7.552 172 HB1 ALA 31 1HB ALA 31 12.579 1.814 -8.310 173 HB2 ALA 31 2HB ALA 31 12.339 2.299 -6.631 174 HB3 ALA 31 3HB ALA 31 10.952 1.862 -7.628 175 H THR 32 H THR 32 10.891 2.280 -9.899 176 HA THR 32 HA THR 32 11.531 4.012 -12.114 177 HB THR 32 HB THR 32 12.711 1.437 -12.720 178 HG1 THR 32 HG1 THR 32 13.362 1.398 -10.565 179 HG21 THR 32 3HG2 THR 32 14.661 2.985 -13.274 180 HG22 THR 32 1HG2 THR 32 13.601 4.311 -12.801 181 HG23 THR 32 2HG2 THR 32 13.154 3.262 -14.147 182 H VAL 33 H VAL 33 10.359 3.537 -13.938 183 HA VAL 33 HA VAL 33 8.075 1.877 -13.619 184 HB VAL 33 HB VAL 33 9.165 3.264 -16.070 185 HG11 VAL 33 1HG1 VAL 33 6.613 2.948 -16.695 186 HG12 VAL 33 2HG1 VAL 33 7.821 1.722 -17.081 187 HG13 VAL 33 3HG1 VAL 33 6.789 1.528 -15.664 188 HG21 VAL 33 3HG2 VAL 33 6.770 4.027 -14.421 189 HG22 VAL 33 1HG2 VAL 33 8.390 4.632 -14.073 190 HG23 VAL 33 2HG2 VAL 33 7.628 4.992 -15.622 191 H GLY 34 H GLY 34 11.059 1.584 -15.514 192 HA2 GLY 34 2HA GLY 34 10.335 -0.841 -16.804 193 HA3 GLY 34 3HA GLY 34 11.961 -0.190 -16.664 194 H ALA 35 H ALA 35 11.908 -0.121 -13.751 195 HA ALA 35 HA ALA 35 12.920 -2.708 -13.240 196 HB1 ALA 35 1HB ALA 35 12.691 -1.824 -10.775 197 HB2 ALA 35 2HB ALA 35 13.891 -1.146 -11.876 198 HB3 ALA 35 3HB ALA 35 12.375 -0.291 -11.589 199 H VAL 36 H VAL 36 9.898 -1.111 -12.265 200 HA VAL 36 HA VAL 36 8.887 -3.330 -10.813 201 HB VAL 36 HB VAL 36 8.025 -1.119 -10.365 202 HG11 VAL 36 1HG1 VAL 36 8.284 -0.195 -12.624 203 HG12 VAL 36 2HG1 VAL 36 6.911 -1.162 -13.169 204 HG13 VAL 36 3HG1 VAL 36 6.676 0.111 -11.969 205 HG21 VAL 36 3HG2 VAL 36 5.695 -1.605 -10.270 206 HG22 VAL 36 1HG2 VAL 36 5.810 -2.717 -11.634 207 HG23 VAL 36 2HG2 VAL 36 6.553 -3.135 -10.090 208 H ARG 37 H ARG 37 8.508 -2.222 -14.143 209 HA ARG 37 HA ARG 37 6.489 -4.032 -14.901 210 HB2 ARG 37 2HB ARG 37 7.169 -2.003 -16.189 211 HB3 ARG 37 3HB ARG 37 8.640 -2.844 -16.660 212 HG2 ARG 37 2HG ARG 37 6.017 -4.132 -17.216 213 HG3 ARG 37 3HG ARG 37 6.545 -2.789 -18.231 214 HD2 ARG 37 2HD ARG 37 8.791 -4.392 -18.023 215 HD3 ARG 37 3HD ARG 37 7.462 -5.543 -18.157 216 HE ARG 37 HE ARG 37 7.221 -4.934 -20.343 217 HH11 ARG 37 1HH1 ARG 37 9.013 -2.454 -18.681 218 HH12 ARG 37 2HH1 ARG 37 9.355 -1.554 -20.121 219 HH21 ARG 37 1HH2 ARG 37 7.665 -3.757 -22.246 220 HH22 ARG 37 2HH2 ARG 37 8.587 -2.296 -22.148 221 H THR 38 H THR 38 10.023 -4.232 -15.071 222 HA THR 38 HA THR 38 10.087 -6.770 -16.347 223 HB THR 38 HB THR 38 12.235 -5.454 -14.672 224 HG1 THR 38 HG1 THR 38 11.687 -5.359 -17.469 225 HG21 THR 38 3HG2 THR 38 12.345 -7.691 -16.696 226 HG22 THR 38 1HG2 THR 38 12.699 -7.803 -14.973 227 HG23 THR 38 2HG2 THR 38 13.760 -6.874 -16.033 228 H LYS 39 H LYS 39 10.155 -5.720 -12.983 229 HA LYS 39 HA LYS 39 10.799 -8.200 -11.820 230 HB2 LYS 39 2HB LYS 39 9.881 -5.592 -10.923 231 HB3 LYS 39 3HB LYS 39 9.155 -6.893 -9.988 232 HG2 LYS 39 2HG LYS 39 12.108 -6.805 -10.476 233 HG3 LYS 39 3HG LYS 39 11.363 -5.877 -9.171 234 HD2 LYS 39 2HD LYS 39 10.990 -8.845 -9.540 235 HD3 LYS 39 3HD LYS 39 12.231 -8.136 -8.505 236 HE2 LYS 39 2HE LYS 39 10.031 -6.822 -7.633 237 HE3 LYS 39 3HE LYS 39 9.324 -8.368 -8.100 238 HZ1 LYS 39 3HZ LYS 39 11.694 -8.849 -6.677 239 HZ2 LYS 39 1HZ LYS 39 10.109 -9.258 -6.249 240 HZ3 LYS 39 2HZ LYS 39 10.753 -7.765 -5.783 241 H VAL 40 H VAL 40 7.671 -6.687 -12.541 242 HA VAL 40 HA VAL 40 6.097 -8.793 -11.473 243 HB VAL 40 HB VAL 40 5.315 -6.780 -13.585 244 HG11 VAL 40 1HG1 VAL 40 3.667 -8.479 -11.717 245 HG12 VAL 40 2HG1 VAL 40 3.027 -7.187 -12.736 246 HG13 VAL 40 3HG1 VAL 40 3.754 -8.616 -13.473 247 HG21 VAL 40 3HG2 VAL 40 5.324 -5.203 -12.020 248 HG22 VAL 40 1HG2 VAL 40 4.303 -6.192 -10.976 249 HG23 VAL 40 2HG2 VAL 40 6.057 -6.351 -10.900 250 H CYS 41 H CYS 41 7.164 -8.000 -14.763 251 HA CYS 41 HA CYS 41 5.802 -10.006 -16.132 252 HB2 CYS 41 2HB CYS 41 7.980 -8.172 -16.674 253 HB3 CYS 41 3HB CYS 41 8.254 -9.728 -17.449 254 HG CYS 41 HG CYS 41 6.248 -9.643 -19.177 255 H ALA 42 H ALA 42 9.022 -10.071 -14.642 256 HA ALA 42 HA ALA 42 9.664 -12.711 -15.416 257 HB1 ALA 42 1HB ALA 42 10.696 -11.179 -13.032 258 HB2 ALA 42 2HB ALA 42 11.456 -12.573 -13.801 259 HB3 ALA 42 3HB ALA 42 11.327 -11.046 -14.674 260 H MET 43 H MET 43 8.086 -11.373 -12.552 261 HA MET 43 HA MET 43 8.031 -13.687 -10.986 262 HB2 MET 43 2HB MET 43 6.688 -11.096 -11.011 263 HB3 MET 43 3HB MET 43 5.666 -12.381 -10.381 264 HG2 MET 43 2HG MET 43 8.413 -12.334 -9.341 265 HG3 MET 43 3HG MET 43 7.409 -10.954 -8.903 266 HE1 MET 43 3HE MET 43 8.232 -13.947 -6.509 267 HE2 MET 43 1HE MET 43 7.552 -15.132 -7.625 268 HE3 MET 43 2HE MET 43 8.746 -13.968 -8.197 269 H LYS 44 H LYS 44 6.104 -12.722 -13.717 270 HA LYS 44 HA LYS 44 4.214 -14.909 -13.291 271 HB2 LYS 44 2HB LYS 44 4.221 -12.964 -15.593 272 HB3 LYS 44 3HB LYS 44 2.879 -13.931 -14.994 273 HG2 LYS 44 2HG LYS 44 3.686 -12.368 -12.827 274 HG3 LYS 44 3HG LYS 44 3.721 -11.293 -14.226 275 HD2 LYS 44 2HD LYS 44 1.532 -11.206 -13.229 276 HD3 LYS 44 3HD LYS 44 1.418 -12.031 -14.786 277 HE2 LYS 44 2HE LYS 44 1.943 -14.035 -12.905 278 HE3 LYS 44 3HE LYS 44 0.749 -12.982 -12.148 279 HZ1 LYS 44 3HZ LYS 44 0.392 -14.868 -14.229 280 HZ2 LYS 44 1HZ LYS 44 -0.083 -13.332 -14.758 281 HZ3 LYS 44 2HZ LYS 44 -0.776 -14.000 -13.367 282 H LYS 45 H LYS 45 7.162 -14.413 -14.767 283 HA LYS 45 HA LYS 45 8.433 -15.652 -16.189 284 HB2 LYS 45 2HB LYS 45 7.073 -17.484 -14.790 285 HB3 LYS 45 3HB LYS 45 6.413 -17.826 -16.384 286 HG2 LYS 45 2HG LYS 45 9.365 -17.707 -15.846 287 HG3 LYS 45 3HG LYS 45 8.417 -19.186 -15.678 288 HD2 LYS 45 2HD LYS 45 8.572 -17.531 -18.195 289 HD3 LYS 45 3HD LYS 45 9.548 -18.969 -17.882 290 HE2 LYS 45 2HE LYS 45 6.794 -19.559 -17.379 291 HE3 LYS 45 3HE LYS 45 6.949 -18.825 -18.974 292 HZ1 LYS 45 3HZ LYS 45 7.672 -20.761 -19.726 293 HZ2 LYS 45 1HZ LYS 45 7.602 -21.441 -18.179 294 HZ3 LYS 45 2HZ LYS 45 9.014 -20.672 -18.701 295 H LEU 46 H LEU 46 7.231 -13.742 -17.492 296 HA LEU 46 HA LEU 46 6.018 -14.990 -19.869 297 HB2 LEU 46 2HB LEU 46 5.585 -12.354 -18.537 298 HB3 LEU 46 3HB LEU 46 5.305 -12.505 -20.270 299 HG LEU 46 HG LEU 46 3.925 -14.159 -18.157 300 HD11 LEU 46 1HD1 LEU 46 2.150 -12.717 -18.181 301 HD12 LEU 46 2HD1 LEU 46 2.546 -12.076 -19.775 302 HD13 LEU 46 3HD1 LEU 46 3.483 -11.577 -18.367 303 HD21 LEU 46 3HD2 LEU 46 3.437 -13.858 -21.119 304 HD22 LEU 46 1HD2 LEU 46 2.429 -14.775 -19.999 305 HD23 LEU 46 2HD2 LEU 46 4.090 -15.282 -20.307 306 HA PRO 47 HA PRO 47 9.350 -13.652 -22.391 307 HB2 PRO 47 2HB PRO 47 8.082 -12.917 -24.677 308 HB3 PRO 47 3HB PRO 47 8.253 -14.603 -24.173 309 HG2 PRO 47 2HG PRO 47 5.908 -12.766 -23.877 310 HG3 PRO 47 3HG PRO 47 5.940 -14.470 -24.367 311 HD2 PRO 47 2HD PRO 47 5.286 -13.686 -21.859 312 HD3 PRO 47 3HD PRO 47 6.114 -15.221 -22.194 313 HA PRO 48 HA PRO 48 9.293 -9.232 -21.468 314 HB2 PRO 48 2HB PRO 48 11.990 -8.945 -21.592 315 HB3 PRO 48 3HB PRO 48 11.158 -9.594 -20.174 316 HG2 PRO 48 2HG PRO 48 12.564 -11.053 -22.377 317 HG3 PRO 48 3HG PRO 48 12.611 -11.351 -20.630 318 HD2 PRO 48 2HD PRO 48 11.085 -12.819 -22.317 319 HD3 PRO 48 3HD PRO 48 10.604 -12.483 -20.641 320 H ASP 49 H ASP 49 10.786 -10.916 -24.149 321 HA ASP 49 HA ASP 49 11.515 -8.645 -25.671 322 HB2 ASP 49 2HB ASP 49 11.314 -11.550 -26.107 323 HB3 ASP 49 3HB ASP 49 11.075 -10.573 -27.554 324 H THR 50 H THR 50 8.597 -10.637 -25.567 325 HA THR 50 HA THR 50 7.272 -8.672 -27.321 326 HB THR 50 HB THR 50 5.637 -10.454 -27.859 327 HG1 THR 50 HG1 THR 50 5.642 -12.120 -26.560 328 HG21 THR 50 3HG2 THR 50 7.089 -10.465 -29.591 329 HG22 THR 50 1HG2 THR 50 7.578 -12.018 -28.914 330 HG23 THR 50 2HG2 THR 50 8.502 -10.564 -28.540 331 H THR 51 H THR 51 7.163 -7.534 -25.123 332 HA THR 51 HA THR 51 4.551 -8.148 -23.954 333 HB THR 51 HB THR 51 6.305 -9.139 -22.471 334 HG1 THR 51 HG1 THR 51 4.474 -7.174 -21.705 335 HG21 THR 51 3HG2 THR 51 7.876 -7.829 -21.334 336 HG22 THR 51 1HG2 THR 51 7.053 -6.323 -21.741 337 HG23 THR 51 2HG2 THR 51 7.934 -7.211 -22.985 338 H ARG 52 H ARG 52 3.347 -6.382 -23.499 339 HA ARG 52 HA ARG 52 4.648 -3.755 -23.806 340 HB2 ARG 52 2HB ARG 52 2.162 -4.872 -24.957 341 HB3 ARG 52 3HB ARG 52 2.065 -3.211 -24.386 342 HG2 ARG 52 2HG ARG 52 4.455 -3.482 -25.889 343 HG3 ARG 52 3HG ARG 52 3.132 -4.189 -26.819 344 HD2 ARG 52 2HD ARG 52 1.832 -2.121 -26.485 345 HD3 ARG 52 3HD ARG 52 3.201 -1.421 -25.623 346 HE ARG 52 HE ARG 52 4.150 -2.235 -28.093 347 HH11 ARG 52 1HH1 ARG 52 1.796 0.012 -26.856 348 HH12 ARG 52 2HH1 ARG 52 1.963 1.116 -28.181 349 HH21 ARG 52 1HH2 ARG 52 4.378 -0.790 -29.842 350 HH22 ARG 52 2HH2 ARG 52 3.431 0.659 -29.879 351 H LEU 53 H LEU 53 3.665 -1.982 -22.620 352 HA LEU 53 HA LEU 53 2.071 -2.796 -20.297 353 HB2 LEU 53 2HB LEU 53 4.090 -2.765 -19.225 354 HB3 LEU 53 3HB LEU 53 4.771 -1.558 -20.313 355 HG LEU 53 HG LEU 53 3.475 0.187 -19.169 356 HD11 LEU 53 1HD1 LEU 53 2.073 -2.054 -18.115 357 HD12 LEU 53 2HD1 LEU 53 1.715 -0.337 -17.931 358 HD13 LEU 53 3HD1 LEU 53 2.776 -1.145 -16.777 359 HD21 LEU 53 3HD2 LEU 53 5.800 -0.687 -18.436 360 HD22 LEU 53 1HD2 LEU 53 4.931 -1.339 -17.047 361 HD23 LEU 53 2HD2 LEU 53 4.911 0.396 -17.364 362 H THR 54 H THR 54 0.354 -1.534 -20.079 363 HA THR 54 HA THR 54 0.518 1.254 -21.016 364 HB THR 54 HB THR 54 -1.713 1.162 -21.890 365 HG1 THR 54 HG1 THR 54 -3.079 -0.326 -21.260 366 HG21 THR 54 3HG2 THR 54 -0.691 -1.412 -22.963 367 HG22 THR 54 1HG2 THR 54 0.351 0.002 -23.110 368 HG23 THR 54 2HG2 THR 54 -1.265 0.021 -23.816 369 H TYR 55 H TYR 55 0.194 2.629 -19.407 370 HA TYR 55 HA TYR 55 -1.625 1.843 -17.226 371 HB2 TYR 55 2HB TYR 55 0.660 1.822 -16.404 372 HB3 TYR 55 3HB TYR 55 0.937 3.440 -17.038 373 HD1 TYR 55 HD1 TYR 55 -1.018 1.526 -14.532 374 HD2 TYR 55 HD2 TYR 55 0.403 5.344 -15.759 375 HE1 TYR 55 HE1 TYR 55 -1.759 2.483 -12.391 376 HE2 TYR 55 HE2 TYR 55 -0.332 6.311 -13.620 377 HH TYR 55 HH TYR 55 -2.446 5.173 -11.718 378 H LYS 56 H LYS 56 -3.285 3.164 -16.884 379 HA LYS 56 HA LYS 56 -4.718 4.920 -17.092 380 HB2 LYS 56 2HB LYS 56 -2.068 6.325 -16.840 381 HB3 LYS 56 3HB LYS 56 -3.572 7.224 -16.994 382 HG2 LYS 56 2HG LYS 56 -3.220 5.134 -14.877 383 HG3 LYS 56 3HG LYS 56 -2.651 6.789 -14.647 384 HD2 LYS 56 2HD LYS 56 -4.714 7.509 -14.213 385 HD3 LYS 56 3HD LYS 56 -5.346 6.757 -15.679 386 HE2 LYS 56 2HE LYS 56 -5.344 4.574 -14.416 387 HE3 LYS 56 3HE LYS 56 -4.994 5.507 -12.962 388 HZ1 LYS 56 3HZ LYS 56 -7.089 6.253 -12.841 389 HZ2 LYS 56 1HZ LYS 56 -7.460 4.936 -13.836 390 HZ3 LYS 56 2HZ LYS 56 -7.237 6.470 -14.512 391 H GLY 57 H GLY 57 -3.793 3.645 -19.522 392 HA2 GLY 57 2HA GLY 57 -4.190 3.932 -21.773 393 HA3 GLY 57 3HA GLY 57 -4.814 5.532 -21.402 394 H ARG 58 H ARG 58 -1.756 5.185 -20.102 395 HA ARG 58 HA ARG 58 -0.492 6.338 -22.500 396 HB2 ARG 58 2HB ARG 58 -0.727 7.426 -19.782 397 HB3 ARG 58 3HB ARG 58 0.909 7.455 -20.427 398 HG2 ARG 58 2HG ARG 58 -0.378 8.454 -22.536 399 HG3 ARG 58 3HG ARG 58 -1.492 8.961 -21.264 400 HD2 ARG 58 2HD ARG 58 0.015 10.389 -20.324 401 HD3 ARG 58 3HD ARG 58 1.403 9.414 -20.808 402 HE ARG 58 HE ARG 58 0.235 11.580 -22.259 403 HH11 ARG 58 1HH1 ARG 58 1.960 8.574 -22.589 404 HH12 ARG 58 2HH1 ARG 58 2.660 8.993 -24.117 405 HH21 ARG 58 1HH2 ARG 58 1.149 12.143 -24.271 406 HH22 ARG 58 2HH2 ARG 58 2.199 11.023 -25.073 407 H ALA 59 H ALA 59 1.894 6.174 -22.489 408 HA ALA 59 HA ALA 59 2.706 3.585 -21.375 409 HB1 ALA 59 1HB ALA 59 4.706 4.404 -23.101 410 HB2 ALA 59 2HB ALA 59 3.407 3.268 -23.465 411 HB3 ALA 59 3HB ALA 59 3.223 4.976 -23.866 412 H LEU 60 H LEU 60 4.297 3.399 -19.907 413 HA LEU 60 HA LEU 60 5.864 5.805 -19.255 414 HB2 LEU 60 2HB LEU 60 4.631 3.809 -17.366 415 HB3 LEU 60 3HB LEU 60 5.821 5.016 -16.883 416 HG LEU 60 HG LEU 60 4.120 6.730 -17.800 417 HD11 LEU 60 1HD1 LEU 60 2.601 4.205 -17.915 418 HD12 LEU 60 2HD1 LEU 60 2.421 5.686 -18.855 419 HD13 LEU 60 3HD1 LEU 60 1.761 5.592 -17.222 420 HD21 LEU 60 3HD2 LEU 60 3.394 5.193 -15.312 421 HD22 LEU 60 1HD2 LEU 60 3.073 6.893 -15.656 422 HD23 LEU 60 2HD2 LEU 60 4.731 6.341 -15.412 423 H LYS 61 H LYS 61 7.966 5.435 -18.383 424 HA LYS 61 HA LYS 61 9.137 2.925 -17.999 425 HB2 LYS 61 2HB LYS 61 8.787 3.598 -20.749 426 HB3 LYS 61 3HB LYS 61 10.507 3.663 -20.386 427 HG2 LYS 61 2HG LYS 61 10.651 1.454 -20.384 428 HG3 LYS 61 3HG LYS 61 9.333 1.316 -19.217 429 HD2 LYS 61 2HD LYS 61 8.404 0.207 -20.989 430 HD3 LYS 61 3HD LYS 61 7.862 1.848 -21.347 431 HE2 LYS 61 2HE LYS 61 10.504 1.165 -22.425 432 HE3 LYS 61 3HE LYS 61 9.174 0.221 -23.093 433 HZ1 LYS 61 3HZ LYS 61 8.910 1.956 -24.449 434 HZ2 LYS 61 1HZ LYS 61 9.830 2.996 -23.482 435 HZ3 LYS 61 2HZ LYS 61 8.196 2.736 -23.128 436 H ASP 62 H ASP 62 10.302 5.745 -19.841 437 HA ASP 62 HA ASP 62 12.631 5.972 -18.185 438 HB2 ASP 62 2HB ASP 62 12.299 6.598 -20.710 439 HB3 ASP 62 3HB ASP 62 11.745 8.137 -20.057 440 H THR 63 H THR 63 9.488 6.863 -17.712 441 HA THR 63 HA THR 63 9.578 9.456 -16.710 442 HB THR 63 HB THR 63 7.882 7.371 -15.377 443 HG1 THR 63 HG1 THR 63 6.421 7.809 -17.253 444 HG21 THR 63 3HG2 THR 63 7.256 9.370 -14.486 445 HG22 THR 63 1HG2 THR 63 6.249 9.415 -15.933 446 HG23 THR 63 2HG2 THR 63 7.781 10.288 -15.897 447 H GLU 64 H GLU 64 10.919 6.568 -15.433 448 HA GLU 64 HA GLU 64 12.165 6.137 -13.579 449 HB2 GLU 64 2HB GLU 64 12.353 9.041 -13.916 450 HB3 GLU 64 3HB GLU 64 12.602 8.512 -12.258 451 HG2 GLU 64 2HG GLU 64 14.093 6.771 -13.882 452 HG3 GLU 64 3HG GLU 64 14.392 8.402 -14.478 453 H THR 65 H THR 65 10.564 8.991 -12.243 454 HA THR 65 HA THR 65 9.434 7.308 -10.135 455 HB THR 65 HB THR 65 8.977 9.421 -8.949 456 HG1 THR 65 HG1 THR 65 9.398 11.347 -9.870 457 HG21 THR 65 3HG2 THR 65 11.742 9.981 -9.585 458 HG22 THR 65 1HG2 THR 65 11.462 8.248 -9.427 459 HG23 THR 65 2HG2 THR 65 11.041 9.333 -8.102 460 H LEU 66 H LEU 66 7.240 7.415 -9.534 461 HA LEU 66 HA LEU 66 5.462 8.301 -11.706 462 HB2 LEU 66 2HB LEU 66 5.611 5.891 -10.121 463 HB3 LEU 66 3HB LEU 66 4.018 6.636 -9.996 464 HG LEU 66 HG LEU 66 5.393 5.750 -12.532 465 HD11 LEU 66 1HD1 LEU 66 4.607 3.797 -11.630 466 HD12 LEU 66 2HD1 LEU 66 3.186 4.336 -12.525 467 HD13 LEU 66 3HD1 LEU 66 3.279 4.592 -10.783 468 HD21 LEU 66 3HD2 LEU 66 4.115 7.275 -13.537 469 HD22 LEU 66 1HD2 LEU 66 3.216 7.613 -12.057 470 HD23 LEU 66 2HD2 LEU 66 2.739 6.265 -13.089 471 H GLU 67 H GLU 67 6.250 8.684 -8.376 472 HA GLU 67 HA GLU 67 3.794 9.731 -7.445 473 HB2 GLU 67 2HB GLU 67 6.319 9.176 -6.355 474 HB3 GLU 67 3HB GLU 67 6.073 10.899 -6.108 475 HG2 GLU 67 2HG GLU 67 4.193 8.712 -5.248 476 HG3 GLU 67 3HG GLU 67 5.302 9.597 -4.202 477 H SER 68 H SER 68 6.433 11.099 -9.242 478 HA SER 68 HA SER 68 5.890 13.832 -8.727 479 HB2 SER 68 2HB SER 68 7.346 12.432 -10.972 480 HB3 SER 68 3HB SER 68 7.216 14.188 -10.869 481 HG SER 68 HG SER 68 9.037 13.814 -9.790 482 H LEU 69 H LEU 69 4.205 11.503 -10.485 483 HA LEU 69 HA LEU 69 2.958 13.473 -12.259 484 HB2 LEU 69 2HB LEU 69 2.684 10.473 -12.154 485 HB3 LEU 69 3HB LEU 69 1.903 11.527 -13.331 486 HG LEU 69 HG LEU 69 3.713 10.624 -14.486 487 HD11 LEU 69 1HD1 LEU 69 5.216 12.993 -13.577 488 HD12 LEU 69 2HD1 LEU 69 3.573 13.282 -14.149 489 HD13 LEU 69 3HD1 LEU 69 4.748 12.496 -15.203 490 HD21 LEU 69 3HD2 LEU 69 5.412 9.663 -13.435 491 HD22 LEU 69 1HD2 LEU 69 4.842 10.335 -11.907 492 HD23 LEU 69 2HD2 LEU 69 5.991 11.239 -12.894 493 H GLY 70 H GLY 70 2.469 11.931 -9.284 494 HA2 GLY 70 2HA GLY 70 0.734 12.496 -7.792 495 HA3 GLY 70 3HA GLY 70 -0.241 13.017 -9.158 496 H VAL 71 H VAL 71 1.400 9.953 -8.376 497 HA VAL 71 HA VAL 71 -1.015 8.510 -9.140 498 HB VAL 71 HB VAL 71 0.382 6.479 -8.913 499 HG11 VAL 71 1HG1 VAL 71 1.757 6.869 -10.860 500 HG12 VAL 71 2HG1 VAL 71 0.222 7.718 -11.047 501 HG13 VAL 71 3HG1 VAL 71 1.678 8.612 -10.606 502 HG21 VAL 71 3HG2 VAL 71 1.872 7.404 -7.142 503 HG22 VAL 71 1HG2 VAL 71 2.733 6.619 -8.466 504 HG23 VAL 71 2HG2 VAL 71 2.662 8.379 -8.381 505 H ALA 72 H ALA 72 -2.211 7.233 -7.786 506 HA ALA 72 HA ALA 72 -1.715 7.608 -4.914 507 HB1 ALA 72 1HB ALA 72 -4.133 7.453 -6.570 508 HB2 ALA 72 2HB ALA 72 -4.220 6.572 -5.044 509 HB3 ALA 72 3HB ALA 72 -3.848 8.296 -5.047 510 H ASP 73 H ASP 73 -1.782 5.871 -3.480 511 HA ASP 73 HA ASP 73 -0.593 3.501 -4.263 512 HB2 ASP 73 2HB ASP 73 -1.036 2.676 -2.070 513 HB3 ASP 73 3HB ASP 73 -0.797 4.414 -1.913 514 H GLY 74 H GLY 74 -1.275 1.611 -5.088 515 HA2 GLY 74 2HA GLY 74 -2.908 -0.139 -5.307 516 HA3 GLY 74 3HA GLY 74 -4.169 1.073 -5.141 517 H ASP 75 H ASP 75 -1.386 1.557 -7.193 518 HA ASP 75 HA ASP 75 -2.989 2.133 -9.454 519 HB2 ASP 75 2HB ASP 75 -0.025 1.677 -9.121 520 HB3 ASP 75 3HB ASP 75 -0.754 2.088 -10.671 521 H LYS 76 H LYS 76 -2.997 1.028 -11.504 522 HA LYS 76 HA LYS 76 -2.256 -1.791 -11.483 523 HB2 LYS 76 2HB LYS 76 -4.515 -2.454 -12.303 524 HB3 LYS 76 3HB LYS 76 -4.507 -1.890 -10.637 525 HG2 LYS 76 2HG LYS 76 -5.168 0.387 -11.614 526 HG3 LYS 76 3HG LYS 76 -5.558 -0.515 -13.080 527 HD2 LYS 76 2HD LYS 76 -6.973 -2.017 -11.590 528 HD3 LYS 76 3HD LYS 76 -6.775 -0.785 -10.342 529 HE2 LYS 76 2HE LYS 76 -8.837 -0.351 -11.453 530 HE3 LYS 76 3HE LYS 76 -7.689 0.883 -11.970 531 HZ1 LYS 76 3HZ LYS 76 -7.559 0.016 -14.067 532 HZ2 LYS 76 1HZ LYS 76 -9.168 -0.357 -13.698 533 HZ3 LYS 76 2HZ LYS 76 -7.975 -1.551 -13.584 534 H PHE 77 H PHE 77 -1.442 -2.391 -13.387 535 HA PHE 77 HA PHE 77 -2.077 -0.748 -15.750 536 HB2 PHE 77 2HB PHE 77 0.219 -1.115 -16.538 537 HB3 PHE 77 3HB PHE 77 0.206 -0.304 -14.976 538 HD1 PHE 77 HD1 PHE 77 0.872 -1.505 -12.948 539 HD2 PHE 77 HD2 PHE 77 1.129 -3.305 -16.796 540 HE1 PHE 77 HE1 PHE 77 2.360 -3.239 -12.034 541 HE2 PHE 77 HE2 PHE 77 2.616 -5.042 -15.889 542 HZ PHE 77 HZ PHE 77 3.233 -5.011 -13.505 543 H VAL 78 H VAL 78 -2.134 -1.814 -17.768 544 HA VAL 78 HA VAL 78 -2.750 -4.672 -17.542 545 HB VAL 78 HB VAL 78 -3.376 -2.759 -19.795 546 HG11 VAL 78 1HG1 VAL 78 -3.476 -4.743 -20.891 547 HG12 VAL 78 2HG1 VAL 78 -3.749 -5.672 -19.416 548 HG13 VAL 78 3HG1 VAL 78 -5.079 -4.780 -20.156 549 HG21 VAL 78 3HG2 VAL 78 -5.653 -3.818 -18.383 550 HG22 VAL 78 1HG2 VAL 78 -4.572 -2.968 -17.279 551 HG23 VAL 78 2HG2 VAL 78 -5.211 -2.140 -18.699 552 H LEU 79 H LEU 79 -1.455 -6.171 -18.382 553 HA LEU 79 HA LEU 79 0.756 -5.288 -20.105 554 HB2 LEU 79 2HB LEU 79 1.150 -6.471 -17.869 555 HB3 LEU 79 3HB LEU 79 0.582 -7.926 -18.684 556 HG LEU 79 HG LEU 79 2.472 -7.272 -20.412 557 HD11 LEU 79 1HD1 LEU 79 2.851 -5.229 -18.695 558 HD12 LEU 79 2HD1 LEU 79 4.121 -5.912 -19.710 559 HD13 LEU 79 3HD1 LEU 79 3.969 -6.418 -18.027 560 HD21 LEU 79 3HD2 LEU 79 3.500 -8.440 -17.881 561 HD22 LEU 79 1HD2 LEU 79 3.679 -9.001 -19.543 562 HD23 LEU 79 2HD2 LEU 79 2.158 -9.252 -18.688 563 H ILE 80 H ILE 80 0.953 -6.019 -22.135 564 HA ILE 80 HA ILE 80 -1.043 -7.964 -23.072 565 HB ILE 80 HB ILE 80 0.584 -6.081 -24.777 566 HG12 ILE 80 2HG1 ILE 80 -1.978 -5.120 -24.833 567 HG13 ILE 80 3HG1 ILE 80 -1.827 -5.622 -23.153 568 HG21 ILE 80 1HG2 ILE 80 -1.397 -6.535 -26.338 569 HG22 ILE 80 2HG2 ILE 80 -0.203 -7.814 -26.129 570 HG23 ILE 80 3HG2 ILE 80 -1.745 -7.901 -25.279 571 HD11 ILE 80 3HD1 ILE 80 -0.540 -3.410 -24.594 572 HD12 ILE 80 1HD1 ILE 80 -1.016 -3.546 -22.902 573 HD13 ILE 80 2HD1 ILE 80 0.486 -4.286 -23.459 574 H THR 81 H THR 81 -0.446 -9.692 -24.383 575 HA THR 81 HA THR 81 2.444 -10.255 -24.514 576 HB THR 81 HB THR 81 1.285 -11.631 -22.780 577 HG1 THR 81 HG1 THR 81 2.469 -13.369 -23.334 578 HG21 THR 81 3HG2 THR 81 -0.885 -11.859 -23.881 579 HG22 THR 81 1HG2 THR 81 -0.195 -13.443 -23.527 580 HG23 THR 81 2HG2 THR 81 -0.142 -12.804 -25.171 581 H ARG 82 H ARG 82 3.227 -11.056 -26.401 582 HA ARG 82 HA ARG 82 1.277 -11.588 -28.546 583 HB2 ARG 82 2HB ARG 82 2.589 -9.394 -28.694 584 HB3 ARG 82 3HB ARG 82 4.003 -10.393 -29.007 585 HG2 ARG 82 2HG ARG 82 2.218 -11.390 -30.805 586 HG3 ARG 82 3HG ARG 82 1.774 -9.683 -30.758 587 HD2 ARG 82 2HD ARG 82 4.527 -9.620 -30.836 588 HD3 ARG 82 3HD ARG 82 4.126 -10.978 -31.887 589 HE ARG 82 HE ARG 82 3.411 -9.472 -33.435 590 HH11 ARG 82 1HH1 ARG 82 3.295 -7.962 -30.300 591 HH12 ARG 82 2HH1 ARG 82 2.819 -6.415 -30.918 592 HH21 ARG 82 1HH2 ARG 82 2.784 -7.440 -34.261 593 HH22 ARG 82 2HH2 ARG 82 2.528 -6.120 -33.172 594 H THR 83 H THR 83 1.626 -13.338 -29.831 595 HA THR 83 HA THR 83 3.235 -15.436 -28.856 596 HB THR 83 HB THR 83 2.562 -16.695 -30.792 597 HG1 THR 83 HG1 THR 83 1.335 -14.444 -31.960 598 HG21 THR 83 3HG2 THR 83 0.336 -14.847 -29.926 599 HG22 THR 83 1HG2 THR 83 0.831 -16.328 -29.109 600 HG23 THR 83 2HG2 THR 83 0.123 -16.405 -30.723 601 H VAL 84 H VAL 84 5.186 -16.253 -29.499 602 HA VAL 84 HA VAL 84 7.003 -14.435 -30.764 603 HB VAL 84 HB VAL 84 7.479 -17.321 -30.011 604 HG11 VAL 84 1HG1 VAL 84 9.288 -16.795 -31.316 605 HG12 VAL 84 2HG1 VAL 84 9.225 -15.080 -30.905 606 HG13 VAL 84 3HG1 VAL 84 9.861 -16.244 -29.742 607 HG21 VAL 84 3HG2 VAL 84 8.677 -15.957 -28.051 608 HG22 VAL 84 1HG2 VAL 84 7.357 -14.841 -28.401 609 HG23 VAL 84 2HG2 VAL 84 7.005 -16.508 -27.945 610 H GLY 85 H GLY 85 7.228 -14.195 -32.883 611 HA2 GLY 85 2HA GLY 85 6.095 -16.019 -34.764 612 HA3 GLY 85 3HA GLY 85 7.081 -14.615 -35.143 Start of MODEL 19 1 H1 MET 9 H MET 9 1.413 -0.164 0.410 2 HA MET 9 HA MET 9 1.948 0.549 -2.319 3 HB2 MET 9 2HB MET 9 3.550 -0.971 -0.260 4 HB3 MET 9 3HB MET 9 4.142 -0.614 -1.877 5 HG2 MET 9 2HG MET 9 3.304 1.839 -0.961 6 HG3 MET 9 3HG MET 9 3.991 1.081 0.474 7 HE1 MET 9 3HE MET 9 6.647 3.102 0.203 8 HE2 MET 9 1HE MET 9 6.134 3.787 -1.339 9 HE3 MET 9 2HE MET 9 4.941 3.445 -0.086 10 H LYS 10 H LYS 10 -0.128 -0.949 -2.697 11 HA LYS 10 HA LYS 10 0.941 -3.513 -3.666 12 HB2 LYS 10 2HB LYS 10 -1.678 -3.007 -2.260 13 HB3 LYS 10 3HB LYS 10 -1.386 -4.448 -3.225 14 HG2 LYS 10 2HG LYS 10 0.680 -4.769 -1.719 15 HG3 LYS 10 3HG LYS 10 -0.120 -3.620 -0.644 16 HD2 LYS 10 2HD LYS 10 -1.525 -5.184 0.093 17 HD3 LYS 10 3HD LYS 10 -1.966 -5.645 -1.552 18 HE2 LYS 10 2HE LYS 10 -1.039 -7.602 -0.786 19 HE3 LYS 10 3HE LYS 10 0.368 -6.832 -1.519 20 HZ1 LYS 10 3HZ LYS 10 -0.012 -6.105 1.231 21 HZ2 LYS 10 1HZ LYS 10 1.376 -6.670 0.445 22 HZ3 LYS 10 2HZ LYS 10 0.225 -7.767 1.022 23 H ILE 11 H ILE 11 0.495 -3.984 -5.739 24 HA ILE 11 HA ILE 11 -1.592 -2.431 -7.109 25 HB ILE 11 HB ILE 11 -0.164 -2.177 -9.073 26 HG12 ILE 11 2HG1 ILE 11 2.420 -2.575 -8.298 27 HG13 ILE 11 3HG1 ILE 11 1.614 -3.910 -7.482 28 HG21 ILE 11 1HG2 ILE 11 1.157 -1.132 -6.572 29 HG22 ILE 11 2HG2 ILE 11 1.339 -0.476 -8.198 30 HG23 ILE 11 3HG2 ILE 11 -0.224 -0.399 -7.387 31 HD11 ILE 11 3HD1 ILE 11 2.481 -3.834 -10.111 32 HD12 ILE 11 1HD1 ILE 11 1.436 -5.047 -9.372 33 HD13 ILE 11 2HD1 ILE 11 0.728 -3.668 -10.214 34 H LYS 12 H LYS 12 -2.688 -3.484 -8.739 35 HA LYS 12 HA LYS 12 -2.069 -6.350 -9.050 36 HB2 LYS 12 2HB LYS 12 -4.600 -4.919 -8.523 37 HB3 LYS 12 3HB LYS 12 -4.694 -6.201 -9.723 38 HG2 LYS 12 2HG LYS 12 -3.249 -6.964 -7.303 39 HG3 LYS 12 3HG LYS 12 -4.937 -6.529 -7.025 40 HD2 LYS 12 2HD LYS 12 -4.537 -8.231 -9.366 41 HD3 LYS 12 3HD LYS 12 -4.034 -8.985 -7.852 42 HE2 LYS 12 2HE LYS 12 -6.368 -7.984 -7.050 43 HE3 LYS 12 3HE LYS 12 -6.731 -8.155 -8.767 44 HZ1 LYS 12 3HZ LYS 12 -7.009 -10.320 -8.485 45 HZ2 LYS 12 1HZ LYS 12 -6.770 -10.133 -6.821 46 HZ3 LYS 12 2HZ LYS 12 -5.460 -10.490 -7.829 47 H ILE 13 H ILE 13 -1.455 -6.914 -11.022 48 HA ILE 13 HA ILE 13 -2.202 -5.186 -13.282 49 HB ILE 13 HB ILE 13 0.009 -7.234 -13.257 50 HG12 ILE 13 2HG1 ILE 13 0.167 -4.268 -12.678 51 HG13 ILE 13 3HG1 ILE 13 0.464 -5.565 -11.526 52 HG21 ILE 13 1HG2 ILE 13 0.827 -5.983 -15.187 53 HG22 ILE 13 2HG2 ILE 13 -0.812 -6.572 -15.458 54 HG23 ILE 13 3HG2 ILE 13 -0.540 -4.877 -15.055 55 HD11 ILE 13 3HD1 ILE 13 2.196 -4.453 -13.614 56 HD12 ILE 13 1HD1 ILE 13 2.605 -5.199 -12.069 57 HD13 ILE 13 2HD1 ILE 13 2.225 -6.210 -13.464 58 H VAL 14 H VAL 14 -3.708 -5.921 -14.613 59 HA VAL 14 HA VAL 14 -4.264 -8.804 -14.684 60 HB VAL 14 HB VAL 14 -6.000 -6.591 -15.776 61 HG11 VAL 14 1HG1 VAL 14 -7.623 -8.171 -16.125 62 HG12 VAL 14 2HG1 VAL 14 -6.175 -9.131 -16.435 63 HG13 VAL 14 3HG1 VAL 14 -6.996 -9.249 -14.878 64 HG21 VAL 14 3HG2 VAL 14 -5.527 -7.412 -13.031 65 HG22 VAL 14 1HG2 VAL 14 -6.396 -6.012 -13.659 66 HG23 VAL 14 2HG2 VAL 14 -7.222 -7.561 -13.495 67 HA PRO 15 HA PRO 15 -2.192 -8.651 -18.671 68 HB2 PRO 15 2HB PRO 15 -2.172 -11.344 -19.019 69 HB3 PRO 15 3HB PRO 15 -1.011 -10.500 -17.986 70 HG2 PRO 15 2HG PRO 15 -3.504 -11.972 -17.225 71 HG3 PRO 15 3HG PRO 15 -1.910 -11.995 -16.449 72 HD2 PRO 15 2HD PRO 15 -3.975 -10.527 -15.493 73 HD3 PRO 15 3HD PRO 15 -2.283 -10.011 -15.337 74 H ALA 16 H ALA 16 -2.916 -8.777 -20.757 75 HA ALA 16 HA ALA 16 -5.729 -9.549 -21.105 76 HB1 ALA 16 1HB ALA 16 -5.834 -8.053 -22.939 77 HB2 ALA 16 2HB ALA 16 -4.990 -7.202 -21.645 78 HB3 ALA 16 3HB ALA 16 -4.079 -7.885 -22.992 79 H VAL 17 H VAL 17 -4.373 -11.766 -21.019 80 HA VAL 17 HA VAL 17 -4.420 -12.727 -23.754 81 HB VAL 17 HB VAL 17 -2.206 -13.926 -23.421 82 HG11 VAL 17 1HG1 VAL 17 -1.696 -10.995 -23.524 83 HG12 VAL 17 2HG1 VAL 17 -1.093 -12.285 -24.566 84 HG13 VAL 17 3HG1 VAL 17 -2.753 -11.713 -24.739 85 HG21 VAL 17 3HG2 VAL 17 -1.251 -11.795 -21.648 86 HG22 VAL 17 1HG2 VAL 17 -2.351 -12.944 -20.886 87 HG23 VAL 17 2HG2 VAL 17 -0.873 -13.518 -21.659 88 H GLY 18 H GLY 18 -5.360 -14.667 -23.820 89 HA2 GLY 18 2HA GLY 18 -6.374 -16.595 -23.086 90 HA3 GLY 18 3HA GLY 18 -4.874 -16.851 -22.207 91 H GLY 19 H GLY 19 -7.960 -15.091 -21.992 92 HA2 GLY 19 2HA GLY 19 -9.436 -15.030 -20.200 93 HA3 GLY 19 3HA GLY 19 -8.305 -16.003 -19.272 94 H GLY 20 H GLY 20 -6.075 -14.597 -19.074 95 HA2 GLY 20 2HA GLY 20 -5.070 -12.673 -18.252 96 HA3 GLY 20 3HA GLY 20 -6.584 -11.815 -18.497 97 H SER 21 H SER 21 -4.591 -13.511 -16.265 98 HA SER 21 HA SER 21 -6.641 -13.266 -14.170 99 HB2 SER 21 2HB SER 21 -5.418 -15.498 -14.664 100 HB3 SER 21 3HB SER 21 -4.045 -14.754 -13.845 101 HG SER 21 HG SER 21 -5.082 -14.844 -11.982 102 HA PRO 22 HA PRO 22 -4.386 -9.757 -12.655 103 HB2 PRO 22 2HB PRO 22 -5.804 -9.449 -10.360 104 HB3 PRO 22 3HB PRO 22 -6.421 -8.963 -11.944 105 HG2 PRO 22 2HG PRO 22 -6.988 -11.446 -10.370 106 HG3 PRO 22 3HG PRO 22 -8.111 -10.416 -11.279 107 HD2 PRO 22 2HD PRO 22 -7.157 -12.752 -12.261 108 HD3 PRO 22 3HD PRO 22 -7.543 -11.366 -13.301 109 H LEU 23 H LEU 23 -2.522 -9.684 -11.571 110 HA LEU 23 HA LEU 23 -2.089 -11.626 -9.397 111 HB2 LEU 23 2HB LEU 23 -0.735 -12.048 -11.414 112 HB3 LEU 23 3HB LEU 23 -0.039 -10.436 -11.261 113 HG LEU 23 HG LEU 23 0.820 -11.202 -8.986 114 HD11 LEU 23 1HD1 LEU 23 -0.090 -13.821 -10.141 115 HD12 LEU 23 2HD1 LEU 23 -0.442 -13.137 -8.555 116 HD13 LEU 23 3HD1 LEU 23 1.183 -13.713 -8.925 117 HD21 LEU 23 3HD2 LEU 23 2.249 -10.906 -10.948 118 HD22 LEU 23 1HD2 LEU 23 1.873 -12.548 -11.472 119 HD23 LEU 23 2HD2 LEU 23 2.769 -12.283 -9.975 120 H GLU 24 H GLU 24 -1.480 -10.872 -7.457 121 HA GLU 24 HA GLU 24 -1.198 -7.977 -7.162 122 HB2 GLU 24 2HB GLU 24 -2.796 -9.487 -5.776 123 HB3 GLU 24 3HB GLU 24 -1.347 -9.920 -4.879 124 HG2 GLU 24 2HG GLU 24 -1.187 -7.900 -3.882 125 HG3 GLU 24 3HG GLU 24 -1.844 -7.037 -5.272 126 H LEU 25 H LEU 25 0.685 -7.026 -6.735 127 HA LEU 25 HA LEU 25 2.840 -8.553 -5.488 128 HB2 LEU 25 2HB LEU 25 2.743 -7.872 -8.268 129 HB3 LEU 25 3HB LEU 25 4.062 -6.996 -7.495 130 HG LEU 25 HG LEU 25 4.750 -9.309 -6.568 131 HD11 LEU 25 1HD1 LEU 25 2.443 -10.035 -8.020 132 HD12 LEU 25 2HD1 LEU 25 3.582 -11.088 -7.180 133 HD13 LEU 25 3HD1 LEU 25 3.832 -10.699 -8.882 134 HD21 LEU 25 3HD2 LEU 25 6.349 -9.305 -8.145 135 HD22 LEU 25 1HD2 LEU 25 5.569 -7.817 -8.683 136 HD23 LEU 25 2HD2 LEU 25 5.185 -9.348 -9.471 137 H GLU 26 H GLU 26 4.595 -7.188 -4.704 138 HA GLU 26 HA GLU 26 3.610 -4.507 -4.005 139 HB2 GLU 26 2HB GLU 26 4.186 -6.289 -2.221 140 HB3 GLU 26 3HB GLU 26 5.862 -5.927 -2.610 141 HG2 GLU 26 2HG GLU 26 4.734 -3.439 -2.234 142 HG3 GLU 26 3HG GLU 26 3.962 -4.441 -1.006 143 H VAL 27 H VAL 27 4.401 -3.029 -5.361 144 HA VAL 27 HA VAL 27 7.303 -2.892 -5.711 145 HB VAL 27 HB VAL 27 6.270 -4.020 -7.721 146 HG11 VAL 27 1HG1 VAL 27 4.749 -3.002 -9.064 147 HG12 VAL 27 2HG1 VAL 27 4.304 -2.228 -7.542 148 HG13 VAL 27 3HG1 VAL 27 5.340 -1.382 -8.693 149 HG21 VAL 27 3HG2 VAL 27 7.575 -1.376 -8.337 150 HG22 VAL 27 1HG2 VAL 27 8.447 -2.773 -7.707 151 HG23 VAL 27 2HG2 VAL 27 7.655 -2.864 -9.280 152 H ALA 28 H ALA 28 8.056 -0.778 -6.396 153 HA ALA 28 HA ALA 28 6.195 1.358 -5.588 154 HB1 ALA 28 1HB ALA 28 8.876 0.750 -4.780 155 HB2 ALA 28 2HB ALA 28 8.819 2.353 -5.516 156 HB3 ALA 28 3HB ALA 28 7.770 1.971 -4.150 157 HA PRO 29 HA PRO 29 6.529 2.518 -9.903 158 HB2 PRO 29 2HB PRO 29 4.710 4.528 -9.756 159 HB3 PRO 29 3HB PRO 29 4.252 2.824 -9.852 160 HG2 PRO 29 2HG PRO 29 4.413 4.608 -7.454 161 HG3 PRO 29 3HG PRO 29 3.166 3.424 -7.886 162 HD2 PRO 29 2HD PRO 29 5.110 2.898 -6.076 163 HD3 PRO 29 3HD PRO 29 4.413 1.643 -7.122 164 H ASN 30 H ASN 30 7.284 4.300 -7.084 165 HA ASN 30 HA ASN 30 8.154 6.675 -8.505 166 HB2 ASN 30 2HB ASN 30 8.952 7.368 -6.200 167 HB3 ASN 30 3HB ASN 30 7.219 7.097 -6.356 168 HD21 ASN 30 1HD2 ASN 30 6.333 5.962 -4.801 169 HD22 ASN 30 2HD2 ASN 30 7.131 4.801 -3.800 170 H ALA 31 H ALA 31 9.370 3.798 -8.619 171 HA ALA 31 HA ALA 31 12.156 4.554 -8.059 172 HB1 ALA 31 1HB ALA 31 10.718 1.947 -8.127 173 HB2 ALA 31 2HB ALA 31 12.442 1.981 -8.499 174 HB3 ALA 31 3HB ALA 31 11.864 2.574 -6.942 175 H THR 32 H THR 32 10.792 2.215 -10.352 176 HA THR 32 HA THR 32 11.638 3.759 -12.639 177 HB THR 32 HB THR 32 12.865 1.115 -12.816 178 HG1 THR 32 HG1 THR 32 14.357 1.336 -11.258 179 HG21 THR 32 3HG2 THR 32 13.363 2.693 -14.498 180 HG22 THR 32 1HG2 THR 32 14.819 2.598 -13.510 181 HG23 THR 32 2HG2 THR 32 13.712 3.958 -13.321 182 H VAL 33 H VAL 33 10.674 3.100 -14.534 183 HA VAL 33 HA VAL 33 8.343 1.499 -14.304 184 HB VAL 33 HB VAL 33 9.676 2.370 -16.868 185 HG11 VAL 33 1HG1 VAL 33 6.871 2.470 -17.025 186 HG12 VAL 33 2HG1 VAL 33 7.960 1.341 -17.833 187 HG13 VAL 33 3HG1 VAL 33 7.273 0.933 -16.260 188 HG21 VAL 33 3HG2 VAL 33 8.126 4.337 -16.713 189 HG22 VAL 33 1HG2 VAL 33 7.817 3.877 -15.039 190 HG23 VAL 33 2HG2 VAL 33 9.444 4.337 -15.541 191 H GLY 34 H GLY 34 11.463 0.987 -15.936 192 HA2 GLY 34 2HA GLY 34 10.860 -1.557 -16.987 193 HA3 GLY 34 3HA GLY 34 12.476 -0.924 -16.706 194 H ALA 35 H ALA 35 12.062 -0.555 -13.846 195 HA ALA 35 HA ALA 35 12.915 -3.100 -12.958 196 HB1 ALA 35 1HB ALA 35 12.050 -0.650 -11.433 197 HB2 ALA 35 2HB ALA 35 12.736 -2.091 -10.680 198 HB3 ALA 35 3HB ALA 35 13.696 -1.150 -11.821 199 H VAL 36 H VAL 36 9.853 -1.343 -12.575 200 HA VAL 36 HA VAL 36 8.584 -3.325 -10.997 201 HB VAL 36 HB VAL 36 7.260 -1.278 -12.779 202 HG11 VAL 36 1HG1 VAL 36 5.484 -2.535 -12.146 203 HG12 VAL 36 2HG1 VAL 36 6.303 -3.171 -10.718 204 HG13 VAL 36 3HG1 VAL 36 5.613 -1.548 -10.690 205 HG21 VAL 36 3HG2 VAL 36 7.224 -0.466 -10.080 206 HG22 VAL 36 1HG2 VAL 36 8.886 -0.919 -10.457 207 HG23 VAL 36 2HG2 VAL 36 8.061 0.297 -11.432 208 H ARG 37 H ARG 37 8.493 -2.603 -14.474 209 HA ARG 37 HA ARG 37 6.635 -4.578 -15.193 210 HB2 ARG 37 2HB ARG 37 7.314 -2.719 -16.669 211 HB3 ARG 37 3HB ARG 37 8.903 -3.452 -16.845 212 HG2 ARG 37 2HG ARG 37 8.069 -5.237 -18.101 213 HG3 ARG 37 3HG ARG 37 6.406 -4.926 -17.600 214 HD2 ARG 37 2HD ARG 37 6.998 -4.240 -19.957 215 HD3 ARG 37 3HD ARG 37 6.259 -2.994 -18.952 216 HE ARG 37 HE ARG 37 8.163 -1.765 -19.185 217 HH11 ARG 37 1HH1 ARG 37 8.909 -5.098 -19.856 218 HH12 ARG 37 2HH1 ARG 37 10.542 -4.773 -20.332 219 HH21 ARG 37 1HH2 ARG 37 10.312 -1.323 -19.809 220 HH22 ARG 37 2HH2 ARG 37 11.340 -2.625 -20.304 221 H THR 38 H THR 38 10.154 -4.674 -14.898 222 HA THR 38 HA THR 38 10.465 -7.302 -15.930 223 HB THR 38 HB THR 38 12.289 -5.724 -14.106 224 HG1 THR 38 HG1 THR 38 12.168 -6.038 -16.934 225 HG21 THR 38 3HG2 THR 38 13.540 -7.561 -13.961 226 HG22 THR 38 1HG2 THR 38 13.724 -7.545 -15.715 227 HG23 THR 38 2HG2 THR 38 12.404 -8.450 -14.975 228 H LYS 39 H LYS 39 10.020 -5.988 -12.688 229 HA LYS 39 HA LYS 39 10.519 -8.361 -11.254 230 HB2 LYS 39 2HB LYS 39 10.285 -5.933 -10.398 231 HB3 LYS 39 3HB LYS 39 8.558 -6.264 -10.358 232 HG2 LYS 39 2HG LYS 39 8.795 -7.194 -8.368 233 HG3 LYS 39 3HG LYS 39 9.855 -8.419 -9.070 234 HD2 LYS 39 2HD LYS 39 10.879 -5.701 -8.304 235 HD3 LYS 39 3HD LYS 39 10.766 -7.012 -7.127 236 HE2 LYS 39 2HE LYS 39 12.054 -8.368 -8.951 237 HE3 LYS 39 3HE LYS 39 12.504 -6.770 -9.546 238 HZ1 LYS 39 3HZ LYS 39 13.862 -8.098 -7.675 239 HZ2 LYS 39 1HZ LYS 39 12.837 -7.176 -6.696 240 HZ3 LYS 39 2HZ LYS 39 13.857 -6.412 -7.807 241 H VAL 40 H VAL 40 7.517 -6.966 -12.529 242 HA VAL 40 HA VAL 40 5.816 -8.999 -11.521 243 HB VAL 40 HB VAL 40 5.378 -7.127 -13.852 244 HG11 VAL 40 1HG1 VAL 40 3.847 -9.343 -12.919 245 HG12 VAL 40 2HG1 VAL 40 2.957 -7.855 -12.587 246 HG13 VAL 40 3HG1 VAL 40 3.485 -8.221 -14.231 247 HG21 VAL 40 3HG2 VAL 40 3.945 -6.633 -11.355 248 HG22 VAL 40 1HG2 VAL 40 5.696 -6.472 -11.211 249 HG23 VAL 40 2HG2 VAL 40 4.818 -5.514 -12.403 250 H CYS 41 H CYS 41 7.321 -8.466 -14.692 251 HA CYS 41 HA CYS 41 6.185 -10.627 -16.039 252 HB2 CYS 41 2HB CYS 41 8.631 -8.970 -16.390 253 HB3 CYS 41 3HB CYS 41 8.552 -10.486 -17.278 254 HG CYS 41 HG CYS 41 7.093 -7.605 -17.933 255 H ALA 42 H ALA 42 9.177 -10.450 -14.142 256 HA ALA 42 HA ALA 42 10.018 -13.099 -14.596 257 HB1 ALA 42 1HB ALA 42 11.777 -12.076 -13.671 258 HB2 ALA 42 2HB ALA 42 10.768 -10.897 -12.833 259 HB3 ALA 42 3HB ALA 42 11.033 -12.490 -12.126 260 H MET 43 H MET 43 8.032 -11.659 -12.036 261 HA MET 43 HA MET 43 7.780 -13.921 -10.413 262 HB2 MET 43 2HB MET 43 6.881 -11.347 -10.295 263 HB3 MET 43 3HB MET 43 5.385 -12.220 -10.602 264 HG2 MET 43 2HG MET 43 7.248 -13.110 -8.442 265 HG3 MET 43 3HG MET 43 6.123 -11.781 -8.171 266 HE1 MET 43 3HE MET 43 5.543 -13.368 -6.142 267 HE2 MET 43 1HE MET 43 4.489 -14.776 -6.263 268 HE3 MET 43 2HE MET 43 6.203 -14.923 -6.650 269 H LYS 44 H LYS 44 6.215 -13.056 -13.398 270 HA LYS 44 HA LYS 44 4.335 -15.288 -13.148 271 HB2 LYS 44 2HB LYS 44 3.438 -13.115 -13.880 272 HB3 LYS 44 3HB LYS 44 4.531 -13.129 -15.258 273 HG2 LYS 44 2HG LYS 44 3.247 -14.551 -16.429 274 HG3 LYS 44 3HG LYS 44 2.807 -15.496 -15.004 275 HD2 LYS 44 2HD LYS 44 0.858 -14.368 -15.948 276 HD3 LYS 44 3HD LYS 44 1.226 -13.754 -14.334 277 HE2 LYS 44 2HE LYS 44 1.583 -11.688 -15.100 278 HE3 LYS 44 3HE LYS 44 2.596 -12.270 -16.421 279 HZ1 LYS 44 3HZ LYS 44 -0.021 -12.966 -17.036 280 HZ2 LYS 44 1HZ LYS 44 0.944 -11.801 -17.795 281 HZ3 LYS 44 2HZ LYS 44 -0.068 -11.357 -16.515 282 H LYS 45 H LYS 45 7.380 -14.637 -14.369 283 HA LYS 45 HA LYS 45 8.824 -15.808 -15.680 284 HB2 LYS 45 2HB LYS 45 7.568 -17.713 -14.374 285 HB3 LYS 45 3HB LYS 45 6.859 -18.051 -15.948 286 HG2 LYS 45 2HG LYS 45 9.581 -17.803 -16.446 287 HG3 LYS 45 3HG LYS 45 9.476 -18.700 -14.929 288 HD2 LYS 45 2HD LYS 45 9.224 -20.483 -16.281 289 HD3 LYS 45 3HD LYS 45 7.550 -19.931 -16.384 290 HE2 LYS 45 2HE LYS 45 7.770 -19.568 -18.564 291 HE3 LYS 45 3HE LYS 45 9.134 -18.489 -18.275 292 HZ1 LYS 45 3HZ LYS 45 9.448 -20.609 -19.704 293 HZ2 LYS 45 1HZ LYS 45 9.551 -21.399 -18.211 294 HZ3 LYS 45 2HZ LYS 45 10.646 -20.168 -18.594 295 H LEU 46 H LEU 46 7.638 -13.954 -17.077 296 HA LEU 46 HA LEU 46 6.752 -15.260 -19.566 297 HB2 LEU 46 2HB LEU 46 5.902 -12.725 -18.241 298 HB3 LEU 46 3HB LEU 46 5.809 -12.859 -19.996 299 HG LEU 46 HG LEU 46 4.424 -14.709 -18.056 300 HD11 LEU 46 1HD1 LEU 46 3.094 -12.634 -19.760 301 HD12 LEU 46 2HD1 LEU 46 3.668 -12.260 -18.136 302 HD13 LEU 46 3HD1 LEU 46 2.450 -13.513 -18.374 303 HD21 LEU 46 3HD2 LEU 46 4.923 -15.747 -20.200 304 HD22 LEU 46 1HD2 LEU 46 4.190 -14.384 -21.046 305 HD23 LEU 46 2HD2 LEU 46 3.192 -15.439 -20.045 306 HA PRO 47 HA PRO 47 10.137 -13.498 -21.730 307 HB2 PRO 47 2HB PRO 47 9.017 -12.835 -24.113 308 HB3 PRO 47 3HB PRO 47 9.323 -14.506 -23.628 309 HG2 PRO 47 2HG PRO 47 6.774 -12.941 -23.525 310 HG3 PRO 47 3HG PRO 47 7.037 -14.616 -24.041 311 HD2 PRO 47 2HD PRO 47 6.069 -13.982 -21.594 312 HD3 PRO 47 3HD PRO 47 7.087 -15.408 -21.877 313 HA PRO 48 HA PRO 48 9.510 -9.138 -20.731 314 HB2 PRO 48 2HB PRO 48 12.159 -8.561 -20.586 315 HB3 PRO 48 3HB PRO 48 11.272 -9.337 -19.269 316 HG2 PRO 48 2HG PRO 48 13.032 -10.572 -21.352 317 HG3 PRO 48 3HG PRO 48 12.945 -10.914 -19.614 318 HD2 PRO 48 2HD PRO 48 11.755 -12.487 -21.470 319 HD3 PRO 48 3HD PRO 48 11.084 -12.254 -19.843 320 H ASP 49 H ASP 49 11.417 -10.576 -23.288 321 HA ASP 49 HA ASP 49 12.159 -8.279 -24.695 322 HB2 ASP 49 2HB ASP 49 11.736 -11.144 -25.430 323 HB3 ASP 49 3HB ASP 49 11.939 -9.965 -26.722 324 H THR 50 H THR 50 9.193 -10.198 -24.825 325 HA THR 50 HA THR 50 7.999 -8.115 -26.536 326 HB THR 50 HB THR 50 7.953 -10.176 -27.734 327 HG1 THR 50 HG1 THR 50 5.507 -10.636 -27.448 328 HG21 THR 50 3HG2 THR 50 8.329 -11.897 -26.239 329 HG22 THR 50 1HG2 THR 50 6.621 -12.125 -26.609 330 HG23 THR 50 2HG2 THR 50 7.100 -11.327 -25.111 331 H THR 51 H THR 51 7.806 -7.075 -24.301 332 HA THR 51 HA THR 51 5.131 -7.681 -23.281 333 HB THR 51 HB THR 51 6.858 -8.770 -21.787 334 HG1 THR 51 HG1 THR 51 4.714 -8.031 -21.097 335 HG21 THR 51 3HG2 THR 51 8.384 -6.663 -22.062 336 HG22 THR 51 1HG2 THR 51 8.352 -7.533 -20.529 337 HG23 THR 51 2HG2 THR 51 7.433 -6.039 -20.715 338 H ARG 52 H ARG 52 3.962 -5.909 -22.703 339 HA ARG 52 HA ARG 52 5.334 -3.320 -22.566 340 HB2 ARG 52 2HB ARG 52 2.789 -3.725 -24.136 341 HB3 ARG 52 3HB ARG 52 3.779 -2.275 -24.054 342 HG2 ARG 52 2HG ARG 52 4.715 -4.880 -25.231 343 HG3 ARG 52 3HG ARG 52 3.999 -3.568 -26.169 344 HD2 ARG 52 2HD ARG 52 6.104 -2.588 -24.460 345 HD3 ARG 52 3HD ARG 52 6.688 -3.897 -25.485 346 HE ARG 52 HE ARG 52 5.950 -1.256 -26.312 347 HH11 ARG 52 1HH1 ARG 52 6.203 -4.578 -27.320 348 HH12 ARG 52 2HH1 ARG 52 6.367 -4.192 -29.001 349 HH21 ARG 52 1HH2 ARG 52 6.166 -0.734 -28.522 350 HH22 ARG 52 2HH2 ARG 52 6.347 -2.005 -29.683 351 H LEU 53 H LEU 53 4.570 -1.978 -21.029 352 HA LEU 53 HA LEU 53 2.188 -2.865 -19.543 353 HB2 LEU 53 2HB LEU 53 3.926 -2.971 -18.029 354 HB3 LEU 53 3HB LEU 53 4.743 -1.567 -18.714 355 HG LEU 53 HG LEU 53 3.051 -0.104 -17.696 356 HD11 LEU 53 1HD1 LEU 53 1.598 -2.498 -17.446 357 HD12 LEU 53 2HD1 LEU 53 1.119 -0.879 -16.938 358 HD13 LEU 53 3HD1 LEU 53 1.951 -1.947 -15.808 359 HD21 LEU 53 3HD2 LEU 53 5.183 -1.262 -16.496 360 HD22 LEU 53 1HD2 LEU 53 3.894 -1.700 -15.375 361 HD23 LEU 53 2HD2 LEU 53 4.190 -0.004 -15.759 362 H THR 54 H THR 54 0.538 -1.472 -19.159 363 HA THR 54 HA THR 54 0.833 1.286 -20.153 364 HB THR 54 HB THR 54 -1.808 0.850 -20.560 365 HG1 THR 54 HG1 THR 54 -2.176 -1.192 -21.215 366 HG21 THR 54 3HG2 THR 54 0.603 0.866 -22.232 367 HG22 THR 54 1HG2 THR 54 -0.906 1.761 -22.410 368 HG23 THR 54 2HG2 THR 54 -0.796 0.095 -22.980 369 H TYR 55 H TYR 55 0.415 2.758 -18.651 370 HA TYR 55 HA TYR 55 -1.392 2.034 -16.438 371 HB2 TYR 55 2HB TYR 55 0.813 2.177 -15.532 372 HB3 TYR 55 3HB TYR 55 1.142 3.675 -16.396 373 HD1 TYR 55 HD1 TYR 55 -1.640 2.528 -14.170 374 HD2 TYR 55 HD2 TYR 55 1.370 5.437 -14.931 375 HE1 TYR 55 HE1 TYR 55 -2.396 3.814 -12.214 376 HE2 TYR 55 HE2 TYR 55 0.623 6.730 -12.977 377 HH TYR 55 HH TYR 55 -1.214 5.556 -10.587 378 H LYS 56 H LYS 56 -3.115 3.291 -16.170 379 HA LYS 56 HA LYS 56 -4.637 4.954 -16.486 380 HB2 LYS 56 2HB LYS 56 -2.325 6.121 -15.505 381 HB3 LYS 56 3HB LYS 56 -2.726 7.122 -16.895 382 HG2 LYS 56 2HG LYS 56 -4.776 6.436 -14.821 383 HG3 LYS 56 3HG LYS 56 -3.665 7.792 -14.616 384 HD2 LYS 56 2HD LYS 56 -5.385 7.450 -17.062 385 HD3 LYS 56 3HD LYS 56 -5.925 8.331 -15.631 386 HE2 LYS 56 2HE LYS 56 -3.940 9.799 -15.847 387 HE3 LYS 56 3HE LYS 56 -3.521 8.961 -17.340 388 HZ1 LYS 56 3HZ LYS 56 -5.025 10.117 -18.479 389 HZ2 LYS 56 1HZ LYS 56 -5.104 11.157 -17.147 390 HZ3 LYS 56 2HZ LYS 56 -6.228 9.904 -17.309 391 H GLY 57 H GLY 57 -3.679 3.561 -18.827 392 HA2 GLY 57 2HA GLY 57 -4.098 3.672 -21.089 393 HA3 GLY 57 3HA GLY 57 -4.793 5.264 -20.825 394 H ARG 58 H ARG 58 -1.703 5.119 -19.541 395 HA ARG 58 HA ARG 58 -0.566 6.305 -21.988 396 HB2 ARG 58 2HB ARG 58 -1.008 7.727 -19.800 397 HB3 ARG 58 3HB ARG 58 0.509 6.997 -19.291 398 HG2 ARG 58 2HG ARG 58 1.494 8.702 -20.325 399 HG3 ARG 58 3HG ARG 58 1.079 7.875 -21.828 400 HD2 ARG 58 2HD ARG 58 -1.198 9.120 -21.546 401 HD3 ARG 58 3HD ARG 58 -0.267 10.185 -20.495 402 HE ARG 58 HE ARG 58 1.027 9.788 -22.999 403 HH11 ARG 58 1HH1 ARG 58 -1.549 11.533 -21.436 404 HH12 ARG 58 2HH1 ARG 58 -1.512 12.852 -22.558 405 HH21 ARG 58 1HH2 ARG 58 1.086 11.519 -24.483 406 HH22 ARG 58 2HH2 ARG 58 -0.013 12.843 -24.291 407 H ALA 59 H ALA 59 1.693 5.982 -22.356 408 HA ALA 59 HA ALA 59 2.660 3.457 -21.206 409 HB1 ALA 59 1HB ALA 59 2.334 3.679 -23.699 410 HB2 ALA 59 2HB ALA 59 3.696 4.799 -23.690 411 HB3 ALA 59 3HB ALA 59 3.926 3.128 -23.176 412 H LEU 60 H LEU 60 4.183 3.585 -19.705 413 HA LEU 60 HA LEU 60 6.041 5.872 -19.774 414 HB2 LEU 60 2HB LEU 60 5.128 4.306 -17.365 415 HB3 LEU 60 3HB LEU 60 6.226 5.685 -17.358 416 HG LEU 60 HG LEU 60 3.281 5.711 -18.009 417 HD11 LEU 60 1HD1 LEU 60 2.993 6.150 -15.858 418 HD12 LEU 60 2HD1 LEU 60 4.070 7.540 -15.984 419 HD13 LEU 60 3HD1 LEU 60 4.724 5.952 -15.583 420 HD21 LEU 60 3HD2 LEU 60 3.553 8.145 -18.231 421 HD22 LEU 60 1HD2 LEU 60 4.442 7.259 -19.470 422 HD23 LEU 60 2HD2 LEU 60 5.301 7.951 -18.093 423 H LYS 61 H LYS 61 8.219 5.494 -19.219 424 HA LYS 61 HA LYS 61 9.149 2.809 -18.729 425 HB2 LYS 61 2HB LYS 61 10.745 3.231 -20.851 426 HB3 LYS 61 3HB LYS 61 9.241 2.324 -20.944 427 HG2 LYS 61 2HG LYS 61 9.083 5.252 -21.350 428 HG3 LYS 61 3HG LYS 61 9.835 4.290 -22.625 429 HD2 LYS 61 2HD LYS 61 7.391 3.069 -21.667 430 HD3 LYS 61 3HD LYS 61 7.113 4.717 -22.237 431 HE2 LYS 61 2HE LYS 61 8.845 3.097 -23.965 432 HE3 LYS 61 3HE LYS 61 7.191 2.504 -23.825 433 HZ1 LYS 61 3HZ LYS 61 6.836 3.977 -25.466 434 HZ2 LYS 61 1HZ LYS 61 8.192 4.915 -25.089 435 HZ3 LYS 61 2HZ LYS 61 6.762 5.103 -24.206 436 H ASP 62 H ASP 62 10.674 5.600 -20.319 437 HA ASP 62 HA ASP 62 12.890 5.528 -18.505 438 HB2 ASP 62 2HB ASP 62 12.265 6.773 -21.021 439 HB3 ASP 62 3HB ASP 62 12.911 7.977 -19.910 440 H THR 63 H THR 63 9.818 6.726 -18.211 441 HA THR 63 HA THR 63 10.136 9.237 -17.033 442 HB THR 63 HB THR 63 8.047 7.408 -15.945 443 HG1 THR 63 HG1 THR 63 7.759 8.509 -18.536 444 HG21 THR 63 3HG2 THR 63 8.455 10.263 -16.409 445 HG22 THR 63 1HG2 THR 63 7.399 9.444 -15.259 446 HG23 THR 63 2HG2 THR 63 6.868 9.692 -16.922 447 H GLU 64 H GLU 64 10.975 6.129 -15.867 448 HA GLU 64 HA GLU 64 11.962 5.421 -13.943 449 HB2 GLU 64 2HB GLU 64 12.511 8.290 -14.024 450 HB3 GLU 64 3HB GLU 64 12.480 7.646 -12.388 451 HG2 GLU 64 2HG GLU 64 14.361 6.438 -12.677 452 HG3 GLU 64 3HG GLU 64 14.007 6.085 -14.367 453 H THR 65 H THR 65 10.514 8.333 -12.551 454 HA THR 65 HA THR 65 8.951 6.619 -10.758 455 HB THR 65 HB THR 65 8.818 8.435 -9.242 456 HG1 THR 65 HG1 THR 65 8.379 10.184 -10.514 457 HG21 THR 65 3HG2 THR 65 11.564 8.924 -10.307 458 HG22 THR 65 1HG2 THR 65 11.139 7.311 -9.736 459 HG23 THR 65 2HG2 THR 65 11.029 8.690 -8.643 460 H LEU 66 H LEU 66 6.755 7.303 -10.191 461 HA LEU 66 HA LEU 66 5.386 8.557 -12.480 462 HB2 LEU 66 2HB LEU 66 4.590 6.274 -10.706 463 HB3 LEU 66 3HB LEU 66 3.394 7.184 -11.625 464 HG LEU 66 HG LEU 66 4.812 6.576 -13.683 465 HD11 LEU 66 1HD1 LEU 66 5.829 4.532 -11.714 466 HD12 LEU 66 2HD1 LEU 66 6.781 5.788 -12.505 467 HD13 LEU 66 3HD1 LEU 66 6.074 4.485 -13.460 468 HD21 LEU 66 3HD2 LEU 66 3.715 4.046 -12.767 469 HD22 LEU 66 1HD2 LEU 66 3.208 5.086 -14.098 470 HD23 LEU 66 2HD2 LEU 66 2.632 5.405 -12.462 471 H GLU 67 H GLU 67 6.022 8.707 -9.145 472 HA GLU 67 HA GLU 67 3.712 9.898 -8.130 473 HB2 GLU 67 2HB GLU 67 6.148 9.210 -7.102 474 HB3 GLU 67 3HB GLU 67 6.242 10.965 -7.075 475 HG2 GLU 67 2HG GLU 67 4.016 10.939 -5.886 476 HG3 GLU 67 3HG GLU 67 4.236 9.199 -5.710 477 H SER 68 H SER 68 6.334 11.227 -10.021 478 HA SER 68 HA SER 68 5.834 13.961 -9.562 479 HB2 SER 68 2HB SER 68 7.760 12.588 -10.892 480 HB3 SER 68 3HB SER 68 6.818 13.207 -12.247 481 HG SER 68 HG SER 68 8.483 14.525 -10.544 482 H LEU 69 H LEU 69 4.197 11.601 -11.457 483 HA LEU 69 HA LEU 69 2.736 13.653 -12.953 484 HB2 LEU 69 2HB LEU 69 2.305 10.713 -13.274 485 HB3 LEU 69 3HB LEU 69 2.090 12.007 -14.452 486 HG LEU 69 HG LEU 69 4.698 10.819 -13.512 487 HD11 LEU 69 1HD1 LEU 69 4.904 9.924 -15.670 488 HD12 LEU 69 2HD1 LEU 69 3.588 10.913 -16.300 489 HD13 LEU 69 3HD1 LEU 69 3.240 9.585 -15.194 490 HD21 LEU 69 3HD2 LEU 69 5.792 12.348 -15.038 491 HD22 LEU 69 1HD2 LEU 69 4.875 13.254 -13.834 492 HD23 LEU 69 2HD2 LEU 69 4.240 13.069 -15.469 493 H GLY 70 H GLY 70 2.472 11.730 -10.179 494 HA2 GLY 70 2HA GLY 70 0.682 12.165 -8.630 495 HA3 GLY 70 3HA GLY 70 -0.393 12.392 -10.002 496 H VAL 71 H VAL 71 1.757 9.854 -8.710 497 HA VAL 71 HA VAL 71 -0.116 7.818 -9.627 498 HB VAL 71 HB VAL 71 2.344 7.538 -9.961 499 HG11 VAL 71 1HG1 VAL 71 2.776 6.636 -7.206 500 HG12 VAL 71 2HG1 VAL 71 3.836 7.546 -8.284 501 HG13 VAL 71 3HG1 VAL 71 2.570 8.379 -7.380 502 HG21 VAL 71 3HG2 VAL 71 1.562 5.300 -8.185 503 HG22 VAL 71 1HG2 VAL 71 0.487 5.672 -9.533 504 HG23 VAL 71 2HG2 VAL 71 2.179 5.275 -9.837 505 H ALA 72 H ALA 72 -1.263 6.460 -8.309 506 HA ALA 72 HA ALA 72 -1.143 7.007 -5.415 507 HB1 ALA 72 1HB ALA 72 -3.443 7.046 -7.261 508 HB2 ALA 72 2HB ALA 72 -3.708 6.263 -5.703 509 HB3 ALA 72 3HB ALA 72 -3.168 7.941 -5.767 510 H ASP 73 H ASP 73 -1.504 5.267 -4.026 511 HA ASP 73 HA ASP 73 -0.691 2.724 -5.027 512 HB2 ASP 73 2HB ASP 73 -0.702 1.996 -2.768 513 HB3 ASP 73 3HB ASP 73 -0.185 3.679 -2.726 514 H GLY 74 H GLY 74 -1.850 0.792 -5.130 515 HA2 GLY 74 2HA GLY 74 -3.748 -0.572 -5.090 516 HA3 GLY 74 3HA GLY 74 -4.706 0.815 -4.591 517 H ASP 75 H ASP 75 -2.632 1.266 -7.289 518 HA ASP 75 HA ASP 75 -4.924 1.638 -9.016 519 HB2 ASP 75 2HB ASP 75 -2.133 2.486 -8.976 520 HB3 ASP 75 3HB ASP 75 -2.658 1.977 -10.578 521 H LYS 76 H LYS 76 -5.068 0.682 -11.149 522 HA LYS 76 HA LYS 76 -4.033 -2.073 -11.173 523 HB2 LYS 76 2HB LYS 76 -5.946 -2.481 -12.785 524 HB3 LYS 76 3HB LYS 76 -6.402 -2.132 -11.123 525 HG2 LYS 76 2HG LYS 76 -7.130 0.030 -11.658 526 HG3 LYS 76 3HG LYS 76 -6.307 0.011 -13.219 527 HD2 LYS 76 2HD LYS 76 -8.150 -2.183 -13.059 528 HD3 LYS 76 3HD LYS 76 -8.979 -0.674 -12.667 529 HE2 LYS 76 2HE LYS 76 -9.199 -0.635 -14.935 530 HE3 LYS 76 3HE LYS 76 -7.641 0.178 -14.789 531 HZ1 LYS 76 3HZ LYS 76 -6.510 -1.664 -15.526 532 HZ2 LYS 76 1HZ LYS 76 -7.925 -1.769 -16.448 533 HZ3 LYS 76 2HZ LYS 76 -7.731 -2.747 -15.082 534 H PHE 77 H PHE 77 -2.687 -2.689 -12.742 535 HA PHE 77 HA PHE 77 -2.283 -0.850 -15.006 536 HB2 PHE 77 2HB PHE 77 -0.281 -2.887 -14.044 537 HB3 PHE 77 3HB PHE 77 -0.003 -1.489 -15.077 538 HD1 PHE 77 HD1 PHE 77 -1.366 0.637 -13.585 539 HD2 PHE 77 HD2 PHE 77 1.086 -2.557 -12.206 540 HE1 PHE 77 HE1 PHE 77 -0.744 1.970 -11.613 541 HE2 PHE 77 HE2 PHE 77 1.711 -1.229 -10.231 542 HZ PHE 77 HZ PHE 77 0.796 1.037 -9.932 543 H VAL 78 H VAL 78 -1.971 -1.708 -17.089 544 HA VAL 78 HA VAL 78 -3.203 -4.345 -17.459 545 HB VAL 78 HB VAL 78 -2.731 -2.197 -19.529 546 HG11 VAL 78 1HG1 VAL 78 -4.856 -3.888 -20.237 547 HG12 VAL 78 2HG1 VAL 78 -3.264 -3.781 -20.992 548 HG13 VAL 78 3HG1 VAL 78 -3.549 -4.941 -19.694 549 HG21 VAL 78 3HG2 VAL 78 -4.342 -1.130 -18.357 550 HG22 VAL 78 1HG2 VAL 78 -5.404 -2.253 -19.206 551 HG23 VAL 78 2HG2 VAL 78 -4.887 -2.603 -17.557 552 H LEU 79 H LEU 79 -2.038 -6.028 -18.114 553 HA LEU 79 HA LEU 79 0.697 -5.539 -19.073 554 HB2 LEU 79 2HB LEU 79 0.716 -6.860 -17.112 555 HB3 LEU 79 3HB LEU 79 -0.587 -7.887 -17.706 556 HG LEU 79 HG LEU 79 0.887 -8.935 -19.290 557 HD11 LEU 79 1HD1 LEU 79 2.505 -7.664 -20.151 558 HD12 LEU 79 2HD1 LEU 79 3.444 -8.111 -18.727 559 HD13 LEU 79 3HD1 LEU 79 2.537 -6.599 -18.745 560 HD21 LEU 79 3HD2 LEU 79 0.882 -9.585 -16.812 561 HD22 LEU 79 1HD2 LEU 79 2.460 -8.801 -16.739 562 HD23 LEU 79 2HD2 LEU 79 2.208 -10.176 -17.815 563 H ILE 80 H ILE 80 1.261 -6.065 -21.088 564 HA ILE 80 HA ILE 80 -0.589 -7.745 -22.652 565 HB ILE 80 HB ILE 80 1.099 -5.507 -23.767 566 HG12 ILE 80 2HG1 ILE 80 -1.858 -5.516 -23.127 567 HG13 ILE 80 3HG1 ILE 80 -0.626 -4.624 -22.242 568 HG21 ILE 80 1HG2 ILE 80 0.556 -6.339 -25.749 569 HG22 ILE 80 2HG2 ILE 80 -0.301 -7.662 -24.959 570 HG23 ILE 80 3HG2 ILE 80 -1.156 -6.173 -25.359 571 HD11 ILE 80 3HD1 ILE 80 -1.825 -4.087 -24.897 572 HD12 ILE 80 1HD1 ILE 80 -1.413 -2.977 -23.590 573 HD13 ILE 80 2HD1 ILE 80 -0.144 -3.621 -24.633 574 H THR 81 H THR 81 0.266 -9.342 -23.895 575 HA THR 81 HA THR 81 3.175 -9.513 -24.177 576 HB THR 81 HB THR 81 2.627 -10.821 -22.166 577 HG1 THR 81 HG1 THR 81 4.172 -12.068 -22.873 578 HG21 THR 81 3HG2 THR 81 1.228 -12.777 -22.267 579 HG22 THR 81 1HG2 THR 81 0.966 -12.555 -23.996 580 HG23 THR 81 2HG2 THR 81 0.299 -11.396 -22.847 581 H ARG 82 H ARG 82 3.786 -10.191 -26.139 582 HA ARG 82 HA ARG 82 1.699 -11.186 -27.948 583 HB2 ARG 82 2HB ARG 82 3.896 -9.331 -28.237 584 HB3 ARG 82 3HB ARG 82 4.012 -10.617 -29.430 585 HG2 ARG 82 2HG ARG 82 1.378 -9.302 -29.048 586 HG3 ARG 82 3HG ARG 82 2.647 -8.410 -29.889 587 HD2 ARG 82 2HD ARG 82 2.798 -10.875 -31.062 588 HD3 ARG 82 3HD ARG 82 1.068 -10.717 -30.757 589 HE ARG 82 HE ARG 82 1.861 -8.336 -31.899 590 HH11 ARG 82 1HH1 ARG 82 1.857 -11.702 -32.787 591 HH12 ARG 82 2HH1 ARG 82 1.697 -11.389 -34.484 592 HH21 ARG 82 1HH2 ARG 82 1.651 -7.911 -34.130 593 HH22 ARG 82 2HH2 ARG 82 1.581 -9.232 -35.247 594 H THR 83 H THR 83 1.830 -13.143 -28.895 595 HA THR 83 HA THR 83 3.900 -14.951 -27.954 596 HB THR 83 HB THR 83 2.560 -16.735 -28.932 597 HG1 THR 83 HG1 THR 83 1.071 -14.565 -30.003 598 HG21 THR 83 3HG2 THR 83 0.794 -16.668 -27.421 599 HG22 THR 83 1HG2 THR 83 0.568 -14.930 -27.607 600 HG23 THR 83 2HG2 THR 83 1.953 -15.548 -26.706 601 H VAL 84 H VAL 84 3.009 -13.255 -30.841 602 HA VAL 84 HA VAL 84 3.965 -13.084 -32.900 603 HB VAL 84 HB VAL 84 6.376 -14.345 -31.587 604 HG11 VAL 84 1HG1 VAL 84 5.942 -12.880 -34.163 605 HG12 VAL 84 2HG1 VAL 84 7.518 -12.864 -33.369 606 HG13 VAL 84 3HG1 VAL 84 6.798 -14.394 -33.872 607 HG21 VAL 84 3HG2 VAL 84 5.620 -12.382 -30.346 608 HG22 VAL 84 1HG2 VAL 84 7.136 -12.055 -31.186 609 HG23 VAL 84 2HG2 VAL 84 5.618 -11.434 -31.833 610 H GLY 85 H GLY 85 2.448 -14.694 -33.667 611 HA2 GLY 85 2HA GLY 85 3.609 -16.679 -35.235 612 HA3 GLY 85 3HA GLY 85 3.071 -17.457 -33.754 Start of MODEL 20 1 H1 MET 9 H MET 9 1.083 0.725 0.283 2 HA MET 9 HA MET 9 1.735 0.936 -2.327 3 HB2 MET 9 2HB MET 9 3.261 0.994 -0.260 4 HB3 MET 9 3HB MET 9 3.443 -0.739 -0.500 5 HG2 MET 9 2HG MET 9 4.171 -0.178 -2.867 6 HG3 MET 9 3HG MET 9 4.290 1.491 -2.315 7 HE1 MET 9 3HE MET 9 7.366 1.939 -0.691 8 HE2 MET 9 1HE MET 9 5.688 2.438 -0.902 9 HE3 MET 9 2HE MET 9 6.167 1.547 0.543 10 H LYS 10 H LYS 10 -0.215 -0.673 -2.849 11 HA LYS 10 HA LYS 10 1.060 -3.176 -3.727 12 HB2 LYS 10 2HB LYS 10 -1.492 -2.783 -2.249 13 HB3 LYS 10 3HB LYS 10 -1.469 -4.013 -3.505 14 HG2 LYS 10 2HG LYS 10 0.790 -4.651 -2.200 15 HG3 LYS 10 3HG LYS 10 -0.149 -3.963 -0.873 16 HD2 LYS 10 2HD LYS 10 -1.418 -5.952 -2.707 17 HD3 LYS 10 3HD LYS 10 -0.332 -6.509 -1.432 18 HE2 LYS 10 2HE LYS 10 -1.901 -6.221 0.119 19 HE3 LYS 10 3HE LYS 10 -2.197 -4.565 -0.410 20 HZ1 LYS 10 3HZ LYS 10 -4.213 -5.533 -0.811 21 HZ2 LYS 10 1HZ LYS 10 -3.555 -7.041 -1.208 22 HZ3 LYS 10 2HZ LYS 10 -3.475 -5.766 -2.316 23 H ILE 11 H ILE 11 0.573 -3.862 -5.777 24 HA ILE 11 HA ILE 11 -1.331 -2.242 -7.326 25 HB ILE 11 HB ILE 11 1.383 -3.102 -8.334 26 HG12 ILE 11 2HG1 ILE 11 0.416 -0.318 -7.654 27 HG13 ILE 11 3HG1 ILE 11 1.459 -1.285 -6.616 28 HG21 ILE 11 1HG2 ILE 11 0.305 -2.920 -10.296 29 HG22 ILE 11 2HG2 ILE 11 -1.020 -1.991 -9.598 30 HG23 ILE 11 3HG2 ILE 11 0.488 -1.186 -10.031 31 HD11 ILE 11 3HD1 ILE 11 2.118 0.335 -8.913 32 HD12 ILE 11 1HD1 ILE 11 3.164 -0.329 -7.658 33 HD13 ILE 11 2HD1 ILE 11 2.742 -1.308 -9.064 34 H LYS 12 H LYS 12 -2.377 -3.296 -9.018 35 HA LYS 12 HA LYS 12 -2.040 -6.225 -9.059 36 HB2 LYS 12 2HB LYS 12 -4.599 -4.753 -9.679 37 HB3 LYS 12 3HB LYS 12 -4.387 -6.477 -9.399 38 HG2 LYS 12 2HG LYS 12 -3.793 -5.999 -7.059 39 HG3 LYS 12 3HG LYS 12 -4.091 -4.285 -7.355 40 HD2 LYS 12 2HD LYS 12 -6.126 -4.888 -6.508 41 HD3 LYS 12 3HD LYS 12 -6.415 -5.207 -8.220 42 HE2 LYS 12 2HE LYS 12 -5.289 -7.555 -7.287 43 HE3 LYS 12 3HE LYS 12 -6.337 -7.040 -5.966 44 HZ1 LYS 12 3HZ LYS 12 -7.519 -6.846 -8.597 45 HZ2 LYS 12 1HZ LYS 12 -8.172 -7.448 -7.157 46 HZ3 LYS 12 2HZ LYS 12 -7.166 -8.425 -8.103 47 H ILE 13 H ILE 13 -1.343 -7.019 -10.921 48 HA ILE 13 HA ILE 13 -1.692 -5.410 -13.359 49 HB ILE 13 HB ILE 13 0.255 -7.679 -12.963 50 HG12 ILE 13 2HG1 ILE 13 1.812 -5.468 -12.999 51 HG13 ILE 13 3HG1 ILE 13 0.394 -4.827 -12.176 52 HG21 ILE 13 1HG2 ILE 13 -0.127 -5.579 -15.075 53 HG22 ILE 13 2HG2 ILE 13 1.391 -6.455 -14.885 54 HG23 ILE 13 3HG2 ILE 13 -0.092 -7.333 -15.259 55 HD11 ILE 13 3HD1 ILE 13 2.216 -5.734 -10.705 56 HD12 ILE 13 1HD1 ILE 13 0.602 -6.381 -10.415 57 HD13 ILE 13 2HD1 ILE 13 1.789 -7.337 -11.303 58 H VAL 14 H VAL 14 -3.252 -6.061 -14.673 59 HA VAL 14 HA VAL 14 -4.078 -8.877 -14.638 60 HB VAL 14 HB VAL 14 -5.517 -6.561 -15.934 61 HG11 VAL 14 1HG1 VAL 14 -6.039 -8.864 -16.733 62 HG12 VAL 14 2HG1 VAL 14 -6.553 -9.264 -15.093 63 HG13 VAL 14 3HG1 VAL 14 -7.410 -8.025 -16.010 64 HG21 VAL 14 3HG2 VAL 14 -6.935 -7.359 -13.672 65 HG22 VAL 14 1HG2 VAL 14 -5.256 -7.251 -13.144 66 HG23 VAL 14 2HG2 VAL 14 -6.038 -5.856 -13.888 67 HA PRO 15 HA PRO 15 -1.799 -9.177 -18.499 68 HB2 PRO 15 2HB PRO 15 -2.065 -11.870 -18.713 69 HB3 PRO 15 3HB PRO 15 -0.875 -11.104 -17.655 70 HG2 PRO 15 2HG PRO 15 -3.557 -12.247 -16.975 71 HG3 PRO 15 3HG PRO 15 -2.021 -12.403 -16.103 72 HD2 PRO 15 2HD PRO 15 -3.954 -10.666 -15.347 73 HD3 PRO 15 3HD PRO 15 -2.226 -10.332 -15.114 74 H ALA 16 H ALA 16 -2.467 -9.188 -20.582 75 HA ALA 16 HA ALA 16 -5.314 -9.590 -21.075 76 HB1 ALA 16 1HB ALA 16 -3.111 -8.198 -22.538 77 HB2 ALA 16 2HB ALA 16 -4.586 -8.655 -23.390 78 HB3 ALA 16 3HB ALA 16 -4.671 -7.575 -21.999 79 H VAL 17 H VAL 17 -4.127 -11.982 -20.592 80 HA VAL 17 HA VAL 17 -3.899 -13.197 -23.270 81 HB VAL 17 HB VAL 17 -2.514 -14.937 -22.344 82 HG11 VAL 17 1HG1 VAL 17 -1.343 -12.959 -23.077 83 HG12 VAL 17 2HG1 VAL 17 -1.579 -12.195 -21.504 84 HG13 VAL 17 3HG1 VAL 17 -0.542 -13.615 -21.649 85 HG21 VAL 17 3HG2 VAL 17 -2.831 -15.501 -20.210 86 HG22 VAL 17 1HG2 VAL 17 -1.805 -14.129 -19.791 87 HG23 VAL 17 2HG2 VAL 17 -3.558 -13.939 -19.830 88 H GLY 18 H GLY 18 -4.196 -15.816 -22.710 89 HA2 GLY 18 2HA GLY 18 -6.917 -16.234 -22.616 90 HA3 GLY 18 3HA GLY 18 -5.724 -17.464 -22.223 91 H GLY 19 H GLY 19 -8.292 -15.664 -21.058 92 HA2 GLY 19 2HA GLY 19 -9.341 -16.054 -18.989 93 HA3 GLY 19 3HA GLY 19 -7.827 -16.694 -18.367 94 H GLY 20 H GLY 20 -6.095 -14.607 -18.949 95 HA2 GLY 20 2HA GLY 20 -5.307 -12.692 -17.952 96 HA3 GLY 20 3HA GLY 20 -6.892 -12.035 -18.333 97 H SER 21 H SER 21 -4.926 -13.565 -15.881 98 HA SER 21 HA SER 21 -7.004 -12.977 -13.880 99 HB2 SER 21 2HB SER 21 -5.471 -14.520 -12.437 100 HB3 SER 21 3HB SER 21 -6.530 -15.249 -13.644 101 HG SER 21 HG SER 21 -4.477 -16.115 -13.865 102 HA PRO 22 HA PRO 22 -4.402 -9.646 -12.534 103 HB2 PRO 22 2HB PRO 22 -5.814 -9.033 -10.298 104 HB3 PRO 22 3HB PRO 22 -6.349 -8.590 -11.924 105 HG2 PRO 22 2HG PRO 22 -7.210 -10.885 -10.206 106 HG3 PRO 22 3HG PRO 22 -8.198 -9.804 -11.205 107 HD2 PRO 22 2HD PRO 22 -7.490 -12.290 -12.011 108 HD3 PRO 22 3HD PRO 22 -7.706 -10.943 -13.147 109 H LEU 23 H LEU 23 -2.559 -9.703 -11.414 110 HA LEU 23 HA LEU 23 -2.366 -11.554 -9.130 111 HB2 LEU 23 2HB LEU 23 -0.740 -11.233 -11.472 112 HB3 LEU 23 3HB LEU 23 0.217 -10.901 -10.030 113 HG LEU 23 HG LEU 23 0.361 -13.249 -10.829 114 HD11 LEU 23 1HD1 LEU 23 0.554 -14.076 -8.717 115 HD12 LEU 23 2HD1 LEU 23 -0.978 -13.386 -8.184 116 HD13 LEU 23 3HD1 LEU 23 0.445 -12.356 -8.341 117 HD21 LEU 23 3HD2 LEU 23 -1.995 -13.402 -11.600 118 HD22 LEU 23 1HD2 LEU 23 -2.504 -13.444 -9.912 119 HD23 LEU 23 2HD2 LEU 23 -1.501 -14.741 -10.563 120 H GLU 24 H GLU 24 -1.715 -10.779 -7.207 121 HA GLU 24 HA GLU 24 -1.307 -7.906 -6.982 122 HB2 GLU 24 2HB GLU 24 -1.671 -10.046 -4.879 123 HB3 GLU 24 3HB GLU 24 -1.489 -8.332 -4.534 124 HG2 GLU 24 2HG GLU 24 -3.720 -8.313 -4.560 125 HG3 GLU 24 3HG GLU 24 -3.533 -8.287 -6.312 126 H LEU 25 H LEU 25 0.589 -6.955 -6.570 127 HA LEU 25 HA LEU 25 2.800 -8.532 -5.491 128 HB2 LEU 25 2HB LEU 25 2.602 -7.496 -8.217 129 HB3 LEU 25 3HB LEU 25 4.078 -7.015 -7.381 130 HG LEU 25 HG LEU 25 4.011 -9.689 -6.865 131 HD11 LEU 25 1HD1 LEU 25 2.843 -9.257 -9.608 132 HD12 LEU 25 2HD1 LEU 25 2.108 -10.124 -8.260 133 HD13 LEU 25 3HD1 LEU 25 3.547 -10.773 -9.046 134 HD21 LEU 25 3HD2 LEU 25 5.416 -7.889 -8.702 135 HD22 LEU 25 1HD2 LEU 25 5.463 -9.590 -9.166 136 HD23 LEU 25 2HD2 LEU 25 6.051 -9.093 -7.579 137 H GLU 26 H GLU 26 4.588 -7.205 -4.722 138 HA GLU 26 HA GLU 26 3.646 -4.552 -3.871 139 HB2 GLU 26 2HB GLU 26 5.460 -4.823 -2.099 140 HB3 GLU 26 3HB GLU 26 4.046 -5.857 -1.953 141 HG2 GLU 26 2HG GLU 26 5.289 -7.699 -2.972 142 HG3 GLU 26 3HG GLU 26 6.708 -6.662 -3.105 143 H VAL 27 H VAL 27 4.427 -3.000 -5.142 144 HA VAL 27 HA VAL 27 7.316 -2.925 -5.626 145 HB VAL 27 HB VAL 27 6.830 -2.045 -7.958 146 HG11 VAL 27 1HG1 VAL 27 6.277 -4.492 -8.765 147 HG12 VAL 27 2HG1 VAL 27 7.827 -4.104 -8.016 148 HG13 VAL 27 3HG1 VAL 27 6.554 -4.870 -7.065 149 HG21 VAL 27 3HG2 VAL 27 4.395 -3.577 -8.243 150 HG22 VAL 27 1HG2 VAL 27 4.193 -2.248 -7.101 151 HG23 VAL 27 2HG2 VAL 27 4.749 -1.923 -8.743 152 H ALA 28 H ALA 28 7.986 -0.738 -6.487 153 HA ALA 28 HA ALA 28 6.293 1.372 -5.314 154 HB1 ALA 28 1HB ALA 28 8.054 2.320 -4.241 155 HB2 ALA 28 2HB ALA 28 8.628 0.652 -4.253 156 HB3 ALA 28 3HB ALA 28 9.220 1.797 -5.457 157 HA PRO 29 HA PRO 29 6.427 2.812 -9.552 158 HB2 PRO 29 2HB PRO 29 4.707 4.876 -9.165 159 HB3 PRO 29 3HB PRO 29 4.173 3.201 -9.343 160 HG2 PRO 29 2HG PRO 29 4.549 4.814 -6.849 161 HG3 PRO 29 3HG PRO 29 3.230 3.710 -7.279 162 HD2 PRO 29 2HD PRO 29 5.253 2.990 -5.630 163 HD3 PRO 29 3HD PRO 29 4.444 1.836 -6.709 164 H ASN 30 H ASN 30 7.428 4.368 -6.678 165 HA ASN 30 HA ASN 30 8.294 6.809 -7.976 166 HB2 ASN 30 2HB ASN 30 8.349 5.757 -5.172 167 HB3 ASN 30 3HB ASN 30 9.414 7.089 -5.613 168 HD21 ASN 30 1HD2 ASN 30 7.054 6.917 -3.823 169 HD22 ASN 30 2HD2 ASN 30 5.987 8.163 -4.366 170 H ALA 31 H ALA 31 9.395 3.823 -8.220 171 HA ALA 31 HA ALA 31 12.239 4.491 -7.928 172 HB1 ALA 31 1HB ALA 31 10.682 2.009 -7.747 173 HB2 ALA 31 2HB ALA 31 12.220 1.863 -8.600 174 HB3 ALA 31 3HB ALA 31 12.184 2.473 -6.945 175 H THR 32 H THR 32 10.642 2.253 -10.165 176 HA THR 32 HA THR 32 11.291 3.859 -12.471 177 HB THR 32 HB THR 32 12.499 1.240 -12.866 178 HG1 THR 32 HG1 THR 32 14.425 1.969 -11.586 179 HG21 THR 32 3HG2 THR 32 14.298 2.581 -13.816 180 HG22 THR 32 1HG2 THR 32 13.593 4.044 -13.129 181 HG23 THR 32 2HG2 THR 32 12.734 3.159 -14.390 182 H VAL 33 H VAL 33 10.133 3.277 -14.270 183 HA VAL 33 HA VAL 33 7.864 1.610 -13.876 184 HB VAL 33 HB VAL 33 8.943 2.848 -16.412 185 HG11 VAL 33 1HG1 VAL 33 6.301 2.532 -16.855 186 HG12 VAL 33 2HG1 VAL 33 7.530 1.375 -17.372 187 HG13 VAL 33 3HG1 VAL 33 6.632 1.101 -15.878 188 HG21 VAL 33 3HG2 VAL 33 6.488 3.863 -15.134 189 HG22 VAL 33 1HG2 VAL 33 7.991 4.164 -14.262 190 HG23 VAL 33 2HG2 VAL 33 7.804 4.735 -15.920 191 H GLY 34 H GLY 34 10.788 1.288 -15.879 192 HA2 GLY 34 2HA GLY 34 10.129 -1.203 -17.015 193 HA3 GLY 34 3HA GLY 34 11.751 -0.544 -16.871 194 H ALA 35 H ALA 35 11.662 -0.364 -13.969 195 HA ALA 35 HA ALA 35 12.652 -2.936 -13.345 196 HB1 ALA 35 1HB ALA 35 12.714 -2.075 -11.002 197 HB2 ALA 35 2HB ALA 35 13.521 -1.040 -12.181 198 HB3 ALA 35 3HB ALA 35 11.921 -0.608 -11.579 199 H VAL 36 H VAL 36 9.623 -1.282 -12.510 200 HA VAL 36 HA VAL 36 8.573 -3.374 -10.921 201 HB VAL 36 HB VAL 36 7.092 -1.216 -12.432 202 HG11 VAL 36 1HG1 VAL 36 5.574 -2.980 -11.847 203 HG12 VAL 36 2HG1 VAL 36 6.216 -3.050 -10.204 204 HG13 VAL 36 3HG1 VAL 36 5.314 -1.632 -10.741 205 HG21 VAL 36 3HG2 VAL 36 7.784 -1.224 -9.508 206 HG22 VAL 36 1HG2 VAL 36 8.856 -0.529 -10.723 207 HG23 VAL 36 2HG2 VAL 36 7.231 0.121 -10.505 208 H ARG 37 H ARG 37 8.106 -2.498 -14.330 209 HA ARG 37 HA ARG 37 6.222 -4.482 -14.950 210 HB2 ARG 37 2HB ARG 37 6.668 -2.568 -16.413 211 HB3 ARG 37 3HB ARG 37 8.282 -3.184 -16.742 212 HG2 ARG 37 2HG ARG 37 6.054 -5.026 -17.316 213 HG3 ARG 37 3HG ARG 37 6.176 -3.598 -18.345 214 HD2 ARG 37 2HD ARG 37 8.427 -5.530 -17.802 215 HD3 ARG 37 3HD ARG 37 7.399 -5.562 -19.234 216 HE ARG 37 HE ARG 37 9.558 -3.738 -18.684 217 HH11 ARG 37 1HH1 ARG 37 6.631 -4.271 -20.492 218 HH12 ARG 37 2HH1 ARG 37 7.047 -3.151 -21.746 219 HH21 ARG 37 1HH2 ARG 37 10.117 -2.261 -20.329 220 HH22 ARG 37 2HH2 ARG 37 9.031 -2.009 -21.653 221 H THR 38 H THR 38 9.758 -4.499 -15.085 222 HA THR 38 HA THR 38 10.032 -7.051 -16.261 223 HB THR 38 HB THR 38 11.971 -5.586 -14.460 224 HG1 THR 38 HG1 THR 38 11.381 -5.470 -17.210 225 HG21 THR 38 3HG2 THR 38 12.548 -7.933 -14.614 226 HG22 THR 38 1HG2 THR 38 13.678 -6.988 -15.582 227 HG23 THR 38 2HG2 THR 38 12.383 -7.890 -16.369 228 H LYS 39 H LYS 39 9.894 -5.973 -12.897 229 HA LYS 39 HA LYS 39 10.483 -8.474 -11.722 230 HB2 LYS 39 2HB LYS 39 10.360 -6.046 -10.706 231 HB3 LYS 39 3HB LYS 39 8.696 -6.499 -10.361 232 HG2 LYS 39 2HG LYS 39 9.415 -7.463 -8.505 233 HG3 LYS 39 3HG LYS 39 10.244 -8.659 -9.503 234 HD2 LYS 39 2HD LYS 39 11.513 -6.010 -8.905 235 HD3 LYS 39 3HD LYS 39 11.608 -7.341 -7.749 236 HE2 LYS 39 2HE LYS 39 12.891 -8.646 -9.159 237 HE3 LYS 39 3HE LYS 39 12.334 -7.810 -10.608 238 HZ1 LYS 39 3HZ LYS 39 14.179 -6.696 -8.564 239 HZ2 LYS 39 1HZ LYS 39 13.632 -5.879 -9.941 240 HZ3 LYS 39 2HZ LYS 39 14.619 -7.243 -10.103 241 H VAL 40 H VAL 40 7.481 -6.966 -12.772 242 HA VAL 40 HA VAL 40 5.733 -8.877 -11.611 243 HB VAL 40 HB VAL 40 5.276 -7.057 -13.980 244 HG11 VAL 40 1HG1 VAL 40 2.885 -7.390 -13.494 245 HG12 VAL 40 2HG1 VAL 40 3.687 -8.888 -13.973 246 HG13 VAL 40 3HG1 VAL 40 3.315 -8.589 -12.274 247 HG21 VAL 40 3HG2 VAL 40 5.761 -6.320 -11.400 248 HG22 VAL 40 1HG2 VAL 40 4.820 -5.381 -12.559 249 HG23 VAL 40 2HG2 VAL 40 4.002 -6.444 -11.413 250 H CYS 41 H CYS 41 6.978 -8.476 -14.923 251 HA CYS 41 HA CYS 41 5.727 -10.779 -15.972 252 HB2 CYS 41 2HB CYS 41 6.989 -10.408 -17.924 253 HB3 CYS 41 3HB CYS 41 6.757 -8.803 -17.243 254 HG CYS 41 HG CYS 41 9.558 -10.387 -17.942 255 H ALA 42 H ALA 42 8.705 -10.279 -14.235 256 HA ALA 42 HA ALA 42 9.932 -12.755 -14.899 257 HB1 ALA 42 1HB ALA 42 11.224 -12.235 -12.706 258 HB2 ALA 42 2HB ALA 42 11.439 -11.192 -14.112 259 HB3 ALA 42 3HB ALA 42 10.386 -10.685 -12.792 260 H MET 43 H MET 43 8.006 -11.669 -12.116 261 HA MET 43 HA MET 43 8.135 -14.068 -10.660 262 HB2 MET 43 2HB MET 43 7.135 -11.608 -10.158 263 HB3 MET 43 3HB MET 43 5.642 -12.487 -10.460 264 HG2 MET 43 2HG MET 43 5.827 -12.800 -8.221 265 HG3 MET 43 3HG MET 43 6.714 -14.212 -8.791 266 HE1 MET 43 3HE MET 43 8.698 -14.890 -7.525 267 HE2 MET 43 1HE MET 43 9.401 -13.884 -6.258 268 HE3 MET 43 2HE MET 43 7.683 -14.277 -6.218 269 H LYS 44 H LYS 44 6.166 -13.079 -13.354 270 HA LYS 44 HA LYS 44 4.411 -15.393 -13.078 271 HB2 LYS 44 2HB LYS 44 4.400 -13.297 -15.252 272 HB3 LYS 44 3HB LYS 44 3.117 -14.436 -14.865 273 HG2 LYS 44 2HG LYS 44 4.059 -12.393 -12.883 274 HG3 LYS 44 3HG LYS 44 2.835 -12.022 -14.100 275 HD2 LYS 44 2HD LYS 44 1.473 -12.697 -12.397 276 HD3 LYS 44 3HD LYS 44 1.763 -14.259 -13.166 277 HE2 LYS 44 2HE LYS 44 3.887 -13.874 -11.378 278 HE3 LYS 44 3HE LYS 44 2.435 -13.372 -10.513 279 HZ1 LYS 44 3HZ LYS 44 3.315 -15.982 -11.116 280 HZ2 LYS 44 1HZ LYS 44 1.808 -15.725 -11.841 281 HZ3 LYS 44 2HZ LYS 44 1.994 -15.500 -10.175 282 H LYS 45 H LYS 45 7.368 -14.684 -14.446 283 HA LYS 45 HA LYS 45 8.745 -15.800 -15.871 284 HB2 LYS 45 2HB LYS 45 7.444 -17.754 -14.585 285 HB3 LYS 45 3HB LYS 45 6.850 -18.067 -16.211 286 HG2 LYS 45 2HG LYS 45 9.775 -17.817 -15.574 287 HG3 LYS 45 3HG LYS 45 8.901 -19.349 -15.496 288 HD2 LYS 45 2HD LYS 45 9.044 -17.585 -17.939 289 HD3 LYS 45 3HD LYS 45 10.087 -18.979 -17.651 290 HE2 LYS 45 2HE LYS 45 7.346 -19.723 -17.267 291 HE3 LYS 45 3HE LYS 45 7.531 -18.937 -18.834 292 HZ1 LYS 45 3HZ LYS 45 8.269 -21.542 -18.089 293 HZ2 LYS 45 1HZ LYS 45 9.670 -20.694 -18.513 294 HZ3 LYS 45 2HZ LYS 45 8.387 -20.809 -19.609 295 H LEU 46 H LEU 46 7.486 -13.906 -17.141 296 HA LEU 46 HA LEU 46 6.320 -15.101 -19.563 297 HB2 LEU 46 2HB LEU 46 5.947 -12.491 -18.181 298 HB3 LEU 46 3HB LEU 46 5.736 -12.557 -19.929 299 HG LEU 46 HG LEU 46 4.258 -14.639 -18.514 300 HD11 LEU 46 1HD1 LEU 46 4.311 -12.414 -17.042 301 HD12 LEU 46 2HD1 LEU 46 2.877 -13.428 -17.192 302 HD13 LEU 46 3HD1 LEU 46 3.031 -11.970 -18.171 303 HD21 LEU 46 3HD2 LEU 46 2.443 -13.273 -19.913 304 HD22 LEU 46 1HD2 LEU 46 3.541 -14.437 -20.656 305 HD23 LEU 46 2HD2 LEU 46 3.901 -12.712 -20.734 306 HA PRO 47 HA PRO 47 9.705 -13.858 -22.063 307 HB2 PRO 47 2HB PRO 47 8.476 -13.025 -24.336 308 HB3 PRO 47 3HB PRO 47 8.571 -14.726 -23.863 309 HG2 PRO 47 2HG PRO 47 6.309 -12.792 -23.537 310 HG3 PRO 47 3HG PRO 47 6.266 -14.487 -24.058 311 HD2 PRO 47 2HD PRO 47 5.642 -13.721 -21.537 312 HD3 PRO 47 3HD PRO 47 6.402 -15.285 -21.900 313 HA PRO 48 HA PRO 48 9.842 -9.458 -21.057 314 HB2 PRO 48 2HB PRO 48 12.549 -9.289 -21.169 315 HB3 PRO 48 3HB PRO 48 11.684 -9.926 -19.766 316 HG2 PRO 48 2HG PRO 48 13.031 -11.406 -21.992 317 HG3 PRO 48 3HG PRO 48 13.059 -11.737 -20.250 318 HD2 PRO 48 2HD PRO 48 11.475 -13.105 -21.968 319 HD3 PRO 48 3HD PRO 48 11.003 -12.779 -20.287 320 H ASP 49 H ASP 49 11.256 -11.159 -23.767 321 HA ASP 49 HA ASP 49 12.096 -8.895 -25.245 322 HB2 ASP 49 2HB ASP 49 11.454 -11.739 -26.003 323 HB3 ASP 49 3HB ASP 49 11.910 -10.543 -27.214 324 H THR 50 H THR 50 9.088 -10.752 -25.181 325 HA THR 50 HA THR 50 7.860 -8.694 -26.899 326 HB THR 50 HB THR 50 7.725 -10.792 -28.030 327 HG1 THR 50 HG1 THR 50 5.547 -10.848 -28.308 328 HG21 THR 50 3HG2 THR 50 8.056 -12.547 -26.621 329 HG22 THR 50 1HG2 THR 50 6.295 -12.610 -26.683 330 HG23 THR 50 2HG2 THR 50 7.102 -11.827 -25.324 331 H THR 51 H THR 51 7.802 -7.602 -24.673 332 HA THR 51 HA THR 51 5.157 -8.109 -23.528 333 HB THR 51 HB THR 51 6.852 -9.231 -22.067 334 HG1 THR 51 HG1 THR 51 5.723 -8.628 -20.330 335 HG21 THR 51 3HG2 THR 51 8.585 -7.389 -22.511 336 HG22 THR 51 1HG2 THR 51 8.467 -8.023 -20.870 337 HG23 THR 51 2HG2 THR 51 7.733 -6.471 -21.270 338 H ARG 52 H ARG 52 4.069 -6.293 -22.909 339 HA ARG 52 HA ARG 52 5.507 -3.746 -22.836 340 HB2 ARG 52 2HB ARG 52 2.959 -4.040 -24.419 341 HB3 ARG 52 3HB ARG 52 4.059 -2.669 -24.380 342 HG2 ARG 52 2HG ARG 52 5.742 -4.534 -25.286 343 HG3 ARG 52 3HG ARG 52 4.224 -5.194 -25.899 344 HD2 ARG 52 2HD ARG 52 3.771 -3.252 -27.155 345 HD3 ARG 52 3HD ARG 52 5.002 -2.320 -26.304 346 HE ARG 52 HE ARG 52 6.129 -4.542 -27.683 347 HH11 ARG 52 1HH1 ARG 52 4.898 -1.316 -28.127 348 HH12 ARG 52 2HH1 ARG 52 5.852 -1.006 -29.539 349 HH21 ARG 52 1HH2 ARG 52 7.390 -4.146 -29.542 350 HH22 ARG 52 2HH2 ARG 52 7.268 -2.617 -30.344 351 H LEU 53 H LEU 53 4.757 -2.364 -21.326 352 HA LEU 53 HA LEU 53 2.310 -3.150 -19.889 353 HB2 LEU 53 2HB LEU 53 3.979 -3.352 -18.319 354 HB3 LEU 53 3HB LEU 53 4.918 -2.022 -18.993 355 HG LEU 53 HG LEU 53 3.302 -0.427 -18.034 356 HD11 LEU 53 1HD1 LEU 53 1.832 -2.886 -17.521 357 HD12 LEU 53 2HD1 LEU 53 1.265 -1.218 -17.593 358 HD13 LEU 53 3HD1 LEU 53 1.963 -1.847 -16.101 359 HD21 LEU 53 3HD2 LEU 53 5.263 -0.875 -16.756 360 HD22 LEU 53 1HD2 LEU 53 4.593 -2.390 -16.149 361 HD23 LEU 53 2HD2 LEU 53 3.898 -0.851 -15.638 362 H THR 54 H THR 54 0.692 -1.717 -19.660 363 HA THR 54 HA THR 54 1.176 1.061 -20.515 364 HB THR 54 HB THR 54 -1.483 0.636 -21.108 365 HG1 THR 54 HG1 THR 54 -0.066 -1.573 -22.192 366 HG21 THR 54 3HG2 THR 54 0.153 1.900 -22.440 367 HG22 THR 54 1HG2 THR 54 -0.779 0.787 -23.440 368 HG23 THR 54 2HG2 THR 54 0.876 0.385 -22.980 369 H TYR 55 H TYR 55 0.193 2.653 -19.343 370 HA TYR 55 HA TYR 55 -1.601 1.837 -17.164 371 HB2 TYR 55 2HB TYR 55 0.541 2.077 -16.111 372 HB3 TYR 55 3HB TYR 55 0.839 3.604 -16.936 373 HD1 TYR 55 HD2 TYR 55 -1.963 2.223 -14.871 374 HD2 TYR 55 HD1 TYR 55 0.801 5.397 -15.496 375 HE1 TYR 55 HE2 TYR 55 -2.933 3.436 -12.964 376 HE2 TYR 55 HE1 TYR 55 -0.160 6.617 -13.590 377 HH TYR 55 HH TYR 55 -1.439 6.091 -11.523 378 H LYS 56 H LYS 56 -3.387 3.028 -17.047 379 HA LYS 56 HA LYS 56 -4.941 4.629 -17.495 380 HB2 LYS 56 2HB LYS 56 -2.933 5.876 -16.224 381 HB3 LYS 56 3HB LYS 56 -2.887 6.760 -17.743 382 HG2 LYS 56 2HG LYS 56 -5.576 6.691 -17.083 383 HG3 LYS 56 3HG LYS 56 -4.753 6.952 -15.544 384 HD2 LYS 56 2HD LYS 56 -4.670 9.110 -16.121 385 HD3 LYS 56 3HD LYS 56 -3.419 8.637 -17.274 386 HE2 LYS 56 2HE LYS 56 -5.637 8.045 -18.692 387 HE3 LYS 56 3HE LYS 56 -6.236 9.391 -17.722 388 HZ1 LYS 56 3HZ LYS 56 -4.016 10.484 -18.505 389 HZ2 LYS 56 1HZ LYS 56 -5.375 10.488 -19.513 390 HZ3 LYS 56 2HZ LYS 56 -4.136 9.366 -19.770 391 H GLY 57 H GLY 57 -3.758 3.243 -19.737 392 HA2 GLY 57 2HA GLY 57 -4.028 3.308 -22.025 393 HA3 GLY 57 3HA GLY 57 -4.779 4.885 -21.837 394 H ARG 58 H ARG 58 -1.754 4.757 -20.357 395 HA ARG 58 HA ARG 58 -0.453 5.887 -22.746 396 HB2 ARG 58 2HB ARG 58 -1.184 7.439 -20.705 397 HB3 ARG 58 3HB ARG 58 0.342 6.863 -20.048 398 HG2 ARG 58 2HG ARG 58 1.594 7.922 -21.660 399 HG3 ARG 58 3HG ARG 58 0.263 7.961 -22.818 400 HD2 ARG 58 2HD ARG 58 -0.830 9.706 -21.622 401 HD3 ARG 58 3HD ARG 58 0.278 9.546 -20.259 402 HE ARG 58 HE ARG 58 1.769 10.875 -21.369 403 HH11 ARG 58 1HH1 ARG 58 -0.587 9.682 -23.637 404 HH12 ARG 58 2HH1 ARG 58 -0.019 10.667 -24.945 405 HH21 ARG 58 1HH2 ARG 58 2.527 12.176 -23.082 406 HH22 ARG 58 2HH2 ARG 58 1.753 12.084 -24.628 407 H ALA 59 H ALA 59 1.932 5.822 -22.655 408 HA ALA 59 HA ALA 59 2.820 3.324 -21.390 409 HB1 ALA 59 1HB ALA 59 4.807 4.148 -23.149 410 HB2 ALA 59 2HB ALA 59 3.595 2.897 -23.430 411 HB3 ALA 59 3HB ALA 59 3.295 4.552 -23.963 412 H LEU 60 H LEU 60 4.555 3.247 -20.034 413 HA LEU 60 HA LEU 60 5.900 5.793 -19.419 414 HB2 LEU 60 2HB LEU 60 4.838 3.721 -17.514 415 HB3 LEU 60 3HB LEU 60 6.005 4.953 -17.040 416 HG LEU 60 HG LEU 60 3.327 5.662 -18.206 417 HD11 LEU 60 1HD1 LEU 60 4.044 4.953 -15.385 418 HD12 LEU 60 2HD1 LEU 60 2.656 4.440 -16.344 419 HD13 LEU 60 3HD1 LEU 60 2.747 6.095 -15.741 420 HD21 LEU 60 3HD2 LEU 60 5.157 7.196 -16.369 421 HD22 LEU 60 1HD2 LEU 60 3.726 7.794 -17.209 422 HD23 LEU 60 2HD2 LEU 60 5.167 7.352 -18.127 423 H LYS 61 H LYS 61 8.049 5.620 -18.602 424 HA LYS 61 HA LYS 61 9.438 3.203 -18.270 425 HB2 LYS 61 2HB LYS 61 9.009 3.930 -20.995 426 HB3 LYS 61 3HB LYS 61 10.719 4.132 -20.637 427 HG2 LYS 61 2HG LYS 61 10.849 1.836 -19.855 428 HG3 LYS 61 3HG LYS 61 9.121 1.625 -20.150 429 HD2 LYS 61 2HD LYS 61 10.470 2.644 -22.495 430 HD3 LYS 61 3HD LYS 61 11.204 1.138 -21.938 431 HE2 LYS 61 2HE LYS 61 8.834 0.217 -21.817 432 HE3 LYS 61 3HE LYS 61 8.349 1.643 -22.734 433 HZ1 LYS 61 3HZ LYS 61 8.993 0.642 -24.584 434 HZ2 LYS 61 1HZ LYS 61 9.418 -0.742 -23.707 435 HZ3 LYS 61 2HZ LYS 61 10.567 0.466 -23.990 436 H ASP 62 H ASP 62 10.327 6.175 -20.024 437 HA ASP 62 HA ASP 62 12.644 6.557 -18.381 438 HB2 ASP 62 2HB ASP 62 12.069 7.292 -20.899 439 HB3 ASP 62 3HB ASP 62 11.644 8.786 -20.069 440 H THR 63 H THR 63 9.437 7.143 -17.851 441 HA THR 63 HA THR 63 9.305 9.695 -16.754 442 HB THR 63 HB THR 63 7.689 8.032 -15.133 443 HG1 THR 63 HG1 THR 63 7.347 7.315 -17.850 444 HG21 THR 63 3HG2 THR 63 6.845 9.432 -17.663 445 HG22 THR 63 1HG2 THR 63 7.226 10.299 -16.176 446 HG23 THR 63 2HG2 THR 63 5.893 9.145 -16.207 447 H GLU 64 H GLU 64 10.924 6.902 -15.602 448 HA GLU 64 HA GLU 64 12.262 6.549 -13.794 449 HB2 GLU 64 2HB GLU 64 12.140 9.426 -14.043 450 HB3 GLU 64 3HB GLU 64 12.254 8.956 -12.353 451 HG2 GLU 64 2HG GLU 64 14.332 8.029 -12.603 452 HG3 GLU 64 3HG GLU 64 14.097 7.696 -14.318 453 H THR 65 H THR 65 10.173 9.037 -12.369 454 HA THR 65 HA THR 65 9.090 6.973 -10.564 455 HB THR 65 HB THR 65 9.019 8.535 -8.768 456 HG1 THR 65 HG1 THR 65 9.479 10.716 -9.050 457 HG21 THR 65 3HG2 THR 65 11.666 9.215 -9.991 458 HG22 THR 65 1HG2 THR 65 11.297 7.546 -9.555 459 HG23 THR 65 2HG2 THR 65 11.279 8.805 -8.320 460 H LEU 66 H LEU 66 6.922 7.274 -9.818 461 HA LEU 66 HA LEU 66 5.244 8.574 -11.819 462 HB2 LEU 66 2HB LEU 66 5.017 6.156 -10.774 463 HB3 LEU 66 3HB LEU 66 4.115 7.032 -9.539 464 HG LEU 66 HG LEU 66 2.729 7.948 -11.511 465 HD11 LEU 66 1HD1 LEU 66 2.674 6.670 -13.502 466 HD12 LEU 66 2HD1 LEU 66 3.766 5.455 -12.837 467 HD13 LEU 66 3HD1 LEU 66 4.367 7.071 -13.211 468 HD21 LEU 66 3HD2 LEU 66 1.201 6.547 -10.714 469 HD22 LEU 66 1HD2 LEU 66 2.489 5.715 -9.843 470 HD23 LEU 66 2HD2 LEU 66 2.012 5.163 -11.449 471 H GLU 67 H GLU 67 6.743 9.737 -9.302 472 HA GLU 67 HA GLU 67 4.689 10.836 -7.674 473 HB2 GLU 67 2HB GLU 67 7.481 10.726 -7.604 474 HB3 GLU 67 3HB GLU 67 7.104 12.438 -7.738 475 HG2 GLU 67 2HG GLU 67 5.536 12.142 -5.802 476 HG3 GLU 67 3HG GLU 67 6.198 10.519 -5.611 477 H SER 68 H SER 68 6.586 12.104 -10.388 478 HA SER 68 HA SER 68 5.354 14.674 -10.354 479 HB2 SER 68 2HB SER 68 7.562 13.565 -11.606 480 HB3 SER 68 3HB SER 68 6.445 13.856 -12.939 481 HG SER 68 HG SER 68 6.810 15.875 -11.037 482 H LEU 69 H LEU 69 4.410 11.615 -11.535 483 HA LEU 69 HA LEU 69 2.460 12.776 -13.389 484 HB2 LEU 69 2HB LEU 69 3.146 9.883 -12.895 485 HB3 LEU 69 3HB LEU 69 2.093 10.505 -14.164 486 HG LEU 69 HG LEU 69 4.055 10.049 -15.300 487 HD11 LEU 69 1HD1 LEU 69 4.883 12.804 -14.608 488 HD12 LEU 69 2HD1 LEU 69 3.243 12.586 -15.218 489 HD13 LEU 69 3HD1 LEU 69 4.620 12.056 -16.184 490 HD21 LEU 69 3HD2 LEU 69 5.249 10.342 -12.728 491 HD22 LEU 69 1HD2 LEU 69 6.141 11.327 -13.887 492 HD23 LEU 69 2HD2 LEU 69 5.918 9.603 -14.184 493 H GLY 70 H GLY 70 2.717 11.624 -10.215 494 HA2 GLY 70 2HA GLY 70 0.863 11.995 -8.713 495 HA3 GLY 70 3HA GLY 70 -0.223 11.537 -10.017 496 H VAL 71 H VAL 71 1.716 10.439 -7.396 497 HA VAL 71 HA VAL 71 1.680 7.660 -8.041 498 HB VAL 71 HB VAL 71 2.109 9.034 -5.385 499 HG11 VAL 71 1HG1 VAL 71 2.111 6.180 -6.196 500 HG12 VAL 71 2HG1 VAL 71 3.357 6.713 -5.064 501 HG13 VAL 71 3HG1 VAL 71 1.652 6.923 -4.664 502 HG21 VAL 71 3HG2 VAL 71 4.255 9.333 -5.951 503 HG22 VAL 71 1HG2 VAL 71 4.372 7.740 -6.700 504 HG23 VAL 71 2HG2 VAL 71 3.708 9.096 -7.611 505 H ALA 72 H ALA 72 0.317 6.053 -7.361 506 HA ALA 72 HA ALA 72 -1.956 6.754 -5.663 507 HB1 ALA 72 1HB ALA 72 -2.821 7.162 -7.861 508 HB2 ALA 72 2HB ALA 72 -2.221 5.607 -8.437 509 HB3 ALA 72 3HB ALA 72 -3.527 5.665 -7.253 510 H ASP 73 H ASP 73 -2.884 5.012 -4.577 511 HA ASP 73 HA ASP 73 -1.222 2.600 -4.542 512 HB2 ASP 73 2HB ASP 73 -2.375 2.142 -2.371 513 HB3 ASP 73 3HB ASP 73 -1.464 3.649 -2.389 514 H GLY 74 H GLY 74 -2.104 0.521 -4.666 515 HA2 GLY 74 2HA GLY 74 -3.581 -1.111 -5.329 516 HA3 GLY 74 3HA GLY 74 -4.881 0.008 -4.947 517 H ASP 75 H ASP 75 -2.526 1.142 -7.159 518 HA ASP 75 HA ASP 75 -4.345 1.640 -9.207 519 HB2 ASP 75 2HB ASP 75 -1.394 1.653 -8.946 520 HB3 ASP 75 3HB ASP 75 -2.025 1.545 -10.587 521 H LYS 76 H LYS 76 -3.783 0.767 -11.557 522 HA LYS 76 HA LYS 76 -3.590 -2.165 -11.454 523 HB2 LYS 76 2HB LYS 76 -5.603 -0.666 -13.136 524 HB3 LYS 76 3HB LYS 76 -5.453 -2.410 -12.965 525 HG2 LYS 76 2HG LYS 76 -6.036 -2.170 -10.565 526 HG3 LYS 76 3HG LYS 76 -6.322 -0.452 -10.851 527 HD2 LYS 76 2HD LYS 76 -7.784 -1.688 -12.840 528 HD3 LYS 76 3HD LYS 76 -8.006 -2.750 -11.447 529 HE2 LYS 76 2HE LYS 76 -8.720 -0.837 -10.103 530 HE3 LYS 76 3HE LYS 76 -8.486 0.229 -11.487 531 HZ1 LYS 76 3HZ LYS 76 -10.782 -0.296 -11.352 532 HZ2 LYS 76 1HZ LYS 76 -10.475 -1.955 -11.221 533 HZ3 LYS 76 2HZ LYS 76 -10.163 -1.150 -12.675 534 H PHE 77 H PHE 77 -2.243 -2.999 -12.917 535 HA PHE 77 HA PHE 77 -1.326 -1.245 -15.097 536 HB2 PHE 77 2HB PHE 77 0.081 -3.298 -13.425 537 HB3 PHE 77 3HB PHE 77 0.674 -2.935 -15.043 538 HD1 PHE 77 HD2 PHE 77 0.450 -0.128 -15.359 539 HD2 PHE 77 HD1 PHE 77 1.425 -2.327 -11.847 540 HE1 PHE 77 HE2 PHE 77 1.661 1.824 -14.477 541 HE2 PHE 77 HE1 PHE 77 2.637 -0.378 -10.959 542 HZ PHE 77 HZ PHE 77 2.757 1.701 -12.275 543 H VAL 78 H VAL 78 -1.251 -2.003 -17.176 544 HA VAL 78 HA VAL 78 -2.694 -4.511 -17.662 545 HB VAL 78 HB VAL 78 -2.102 -2.241 -19.567 546 HG11 VAL 78 1HG1 VAL 78 -3.243 -4.932 -19.917 547 HG12 VAL 78 2HG1 VAL 78 -4.138 -3.618 -20.683 548 HG13 VAL 78 3HG1 VAL 78 -2.439 -3.878 -21.079 549 HG21 VAL 78 3HG2 VAL 78 -3.833 -1.208 -18.630 550 HG22 VAL 78 1HG2 VAL 78 -4.862 -2.539 -19.157 551 HG23 VAL 78 2HG2 VAL 78 -4.123 -2.576 -17.557 552 H LEU 79 H LEU 79 -1.524 -6.243 -18.125 553 HA LEU 79 HA LEU 79 1.119 -5.887 -19.362 554 HB2 LEU 79 2HB LEU 79 1.230 -7.024 -17.259 555 HB3 LEU 79 3HB LEU 79 -0.045 -8.142 -17.740 556 HG LEU 79 HG LEU 79 1.425 -9.221 -19.313 557 HD11 LEU 79 1HD1 LEU 79 3.960 -8.278 -18.880 558 HD12 LEU 79 2HD1 LEU 79 3.003 -6.798 -18.934 559 HD13 LEU 79 3HD1 LEU 79 2.959 -7.926 -20.289 560 HD21 LEU 79 3HD2 LEU 79 1.582 -10.151 -17.153 561 HD22 LEU 79 1HD2 LEU 79 2.566 -8.812 -16.561 562 HD23 LEU 79 2HD2 LEU 79 3.245 -9.964 -17.711 563 H ILE 80 H ILE 80 1.307 -6.352 -21.442 564 HA ILE 80 HA ILE 80 -0.537 -8.332 -22.614 565 HB ILE 80 HB ILE 80 -1.091 -6.128 -23.454 566 HG12 ILE 80 2HG1 ILE 80 0.418 -7.250 -25.761 567 HG13 ILE 80 3HG1 ILE 80 -0.752 -8.303 -24.973 568 HG21 ILE 80 1HG2 ILE 80 1.850 -5.963 -23.998 569 HG22 ILE 80 2HG2 ILE 80 0.700 -4.982 -24.906 570 HG23 ILE 80 3HG2 ILE 80 0.808 -4.818 -23.154 571 HD11 ILE 80 3HD1 ILE 80 -2.135 -7.375 -26.484 572 HD12 ILE 80 1HD1 ILE 80 -2.257 -6.112 -25.259 573 HD13 ILE 80 2HD1 ILE 80 -1.170 -5.907 -26.633 574 H THR 81 H THR 81 0.290 -9.802 -24.074 575 HA THR 81 HA THR 81 3.197 -9.746 -24.521 576 HB THR 81 HB THR 81 2.783 -11.336 -22.718 577 HG1 THR 81 HG1 THR 81 4.049 -12.839 -23.609 578 HG21 THR 81 3HG2 THR 81 1.210 -12.999 -22.747 579 HG22 THR 81 1HG2 THR 81 1.232 -13.141 -24.504 580 HG23 THR 81 2HG2 THR 81 0.379 -11.800 -23.738 581 H ARG 82 H ARG 82 3.801 -10.123 -26.564 582 HA ARG 82 HA ARG 82 1.720 -10.890 -28.482 583 HB2 ARG 82 2HB ARG 82 4.054 -9.121 -28.553 584 HB3 ARG 82 3HB ARG 82 3.919 -10.158 -29.967 585 HG2 ARG 82 2HG ARG 82 1.429 -9.330 -29.944 586 HG3 ARG 82 3HG ARG 82 2.117 -7.990 -29.025 587 HD2 ARG 82 2HD ARG 82 3.554 -7.384 -30.796 588 HD3 ARG 82 3HD ARG 82 3.269 -8.901 -31.646 589 HE ARG 82 HE ARG 82 0.823 -7.590 -31.415 590 HH11 ARG 82 1HH1 ARG 82 3.902 -7.136 -32.975 591 HH12 ARG 82 2HH1 ARG 82 3.245 -6.233 -34.299 592 HH21 ARG 82 1HH2 ARG 82 -0.054 -6.401 -33.153 593 HH22 ARG 82 2HH2 ARG 82 0.995 -5.814 -34.399 594 H THR 83 H THR 83 2.173 -12.419 -30.148 595 HA THR 83 HA THR 83 4.454 -14.200 -29.666 596 HB THR 83 HB THR 83 2.523 -15.193 -28.501 597 HG1 THR 83 HG1 THR 83 3.037 -17.153 -29.230 598 HG21 THR 83 3HG2 THR 83 1.001 -14.187 -30.511 599 HG22 THR 83 1HG2 THR 83 0.473 -15.457 -29.408 600 HG23 THR 83 2HG2 THR 83 1.119 -15.879 -30.995 601 H VAL 84 H VAL 84 4.074 -12.243 -31.703 602 HA VAL 84 HA VAL 84 3.508 -13.842 -34.098 603 HB VAL 84 HB VAL 84 3.442 -11.760 -35.329 604 HG11 VAL 84 1HG1 VAL 84 1.888 -11.501 -32.757 605 HG12 VAL 84 2HG1 VAL 84 1.503 -10.727 -34.296 606 HG13 VAL 84 3HG1 VAL 84 1.413 -12.482 -34.142 607 HG21 VAL 84 3HG2 VAL 84 5.051 -10.357 -34.445 608 HG22 VAL 84 1HG2 VAL 84 3.562 -9.612 -33.862 609 HG23 VAL 84 2HG2 VAL 84 4.522 -10.624 -32.784 610 H GLY 85 H GLY 85 5.957 -14.113 -32.466 611 HA2 GLY 85 2HA GLY 85 8.042 -12.969 -34.151 612 HA3 GLY 85 3HA GLY 85 8.283 -13.882 -32.669
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