NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
496528 | 2l8v | 17429 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1H MET 1 -8.608 0.177 -14.892 2 H2 MET 1 2H MET 1 -9.999 0.245 -15.855 3 H3 MET 1 3H MET 1 -10.100 -0.337 -14.265 4 HA MET 1 HA MET 1 -9.426 2.430 -15.073 5 HB2 MET 1 2HB MET 1 -11.880 1.248 -13.756 6 HB3 MET 1 1HB MET 1 -11.562 2.974 -13.874 7 HG2 MET 1 2HG MET 1 -11.904 1.089 -16.197 8 HG3 MET 1 1HG MET 1 -13.127 2.197 -15.580 9 HE1 MET 1 3HE MET 1 -11.592 5.692 -16.409 10 HE2 MET 1 1HE MET 1 -11.383 4.801 -14.902 11 HE3 MET 1 2HE MET 1 -12.953 4.818 -15.703 12 HA PRO 2 HA PRO 2 -7.188 2.174 -11.211 13 HB2 PRO 2 2HB PRO 2 -6.764 5.050 -11.667 14 HB3 PRO 2 1HB PRO 2 -5.578 3.750 -11.521 15 HG2 PRO 2 2HG PRO 2 -6.083 4.950 -13.872 16 HG3 PRO 2 1HG PRO 2 -5.682 3.225 -13.764 17 HD2 PRO 2 2HD PRO 2 -8.351 4.534 -14.120 18 HD3 PRO 2 1HD PRO 2 -7.700 3.075 -14.898 19 H VAL 3 H VAL 3 -7.919 2.426 -9.186 20 HA VAL 3 HA VAL 3 -10.191 4.171 -8.687 21 HB VAL 3 HB VAL 3 -8.766 2.336 -6.748 22 HG11 VAL 3 1HG1 VAL 3 -10.082 4.072 -5.665 23 HG12 VAL 3 2HG1 VAL 3 -10.842 2.495 -5.450 24 HG13 VAL 3 3HG1 VAL 3 -11.488 3.633 -6.634 25 HG21 VAL 3 3HG2 VAL 3 -11.239 1.794 -8.391 26 HG22 VAL 3 1HG2 VAL 3 -10.543 0.723 -7.175 27 HG23 VAL 3 2HG2 VAL 3 -9.651 1.076 -8.654 28 H GLU 4 H GLU 4 -9.985 6.151 -7.817 29 HA GLU 4 HA GLU 4 -7.560 6.781 -6.296 30 HB2 GLU 4 2HB GLU 4 -7.378 8.949 -7.514 31 HB3 GLU 4 1HB GLU 4 -7.070 7.551 -8.538 32 HG2 GLU 4 2HG GLU 4 -9.332 7.705 -9.439 33 HG3 GLU 4 1HG GLU 4 -9.656 9.092 -8.402 34 H LEU 5 H LEU 5 -7.843 8.345 -4.705 35 HA LEU 5 HA LEU 5 -10.623 9.150 -4.233 36 HB2 LEU 5 2HB LEU 5 -9.468 8.024 -2.374 37 HB3 LEU 5 1HB LEU 5 -8.237 9.275 -2.384 38 HG LEU 5 HG LEU 5 -9.960 10.950 -1.784 39 HD11 LEU 5 1HD1 LEU 5 -11.895 9.823 -2.761 40 HD12 LEU 5 2HD1 LEU 5 -12.166 10.222 -1.065 41 HD13 LEU 5 3HD1 LEU 5 -11.784 8.565 -1.529 42 HD21 LEU 5 3HD2 LEU 5 -10.233 10.277 0.524 43 HD22 LEU 5 1HD2 LEU 5 -8.620 9.850 -0.048 44 HD23 LEU 5 2HD2 LEU 5 -9.859 8.604 0.104 45 H ARG 6 H ARG 6 -11.108 10.990 -5.165 46 HA ARG 6 HA ARG 6 -9.065 13.023 -5.580 47 HB2 ARG 6 2HB ARG 6 -11.943 12.883 -6.513 48 HB3 ARG 6 1HB ARG 6 -10.773 14.111 -6.989 49 HG2 ARG 6 2HG ARG 6 -9.376 12.403 -8.010 50 HG3 ARG 6 1HG ARG 6 -10.521 11.160 -7.516 51 HD2 ARG 6 2HD ARG 6 -12.234 12.167 -8.938 52 HD3 ARG 6 1HD ARG 6 -11.095 13.430 -9.420 53 HE ARG 6 HE ARG 6 -9.732 11.249 -10.102 54 HH11 ARG 6 1HH1 ARG 6 -13.086 12.088 -10.697 55 HH12 ARG 6 2HH1 ARG 6 -13.205 11.109 -12.129 56 HH21 ARG 6 1HH2 ARG 6 -9.896 9.941 -11.965 57 HH22 ARG 6 2HH2 ARG 6 -11.395 9.889 -12.845 58 H ALA 7 H ALA 7 -9.578 15.309 -5.057 59 HA ALA 7 HA ALA 7 -10.280 15.520 -2.307 60 HB1 ALA 7 3HB ALA 7 -8.603 16.971 -3.338 61 HB2 ALA 7 1HB ALA 7 -9.893 17.915 -2.592 62 HB3 ALA 7 2HB ALA 7 -9.852 17.707 -4.343 63 H ASN 8 H ASN 8 -11.932 16.129 -5.307 64 HA ASN 8 HA ASN 8 -14.352 16.897 -3.840 65 HB2 ASN 8 2HB ASN 8 -13.735 18.355 -5.718 66 HB3 ASN 8 1HB ASN 8 -13.729 16.975 -6.807 67 HD21 ASN 8 1HD2 ASN 8 -15.647 16.178 -7.576 68 HD22 ASN 8 2HD2 ASN 8 -17.163 16.992 -7.354 69 H TRP 9 H TRP 9 -14.843 14.859 -2.995 70 HA TRP 9 HA TRP 9 -15.448 12.778 -4.986 71 HB2 TRP 9 2HB TRP 9 -14.957 11.116 -3.192 72 HB3 TRP 9 1HB TRP 9 -13.560 12.073 -3.665 73 HD1 TRP 9 HD1 TRP 9 -12.492 13.671 -1.843 74 HE1 TRP 9 HE1 TRP 9 -12.765 13.848 0.706 75 HE3 TRP 9 HE3 TRP 9 -16.740 10.890 -1.286 76 HZ2 TRP 9 HZ2 TRP 9 -14.552 12.939 2.695 77 HZ3 TRP 9 HZ3 TRP 9 -17.669 10.591 0.968 78 HH2 TRP 9 HH2 TRP 9 -16.598 11.595 2.921 79 H SER 10 H SER 10 -17.263 11.539 -4.738 80 HA SER 10 HA SER 10 -19.277 12.467 -2.819 81 HB2 SER 10 2HB SER 10 -20.033 12.276 -5.149 82 HB3 SER 10 1HB SER 10 -19.488 10.601 -5.208 83 HG SER 10 HG SER 10 -21.857 11.270 -4.671 84 H GLU 11 H GLU 11 -20.418 10.781 -1.515 85 HA GLU 11 HA GLU 11 -18.544 9.190 -0.176 86 HB2 GLU 11 2HB GLU 11 -21.555 9.080 -0.158 87 HB3 GLU 11 1HB GLU 11 -20.553 8.062 0.869 88 HG2 GLU 11 2HG GLU 11 -19.498 10.218 1.705 89 HG3 GLU 11 1HG GLU 11 -20.834 11.047 0.909 90 H GLU 12 H GLU 12 -20.856 8.352 -2.713 91 HA GLU 12 HA GLU 12 -20.562 5.585 -2.705 92 HB2 GLU 12 2HB GLU 12 -21.155 7.549 -4.900 93 HB3 GLU 12 1HB GLU 12 -21.074 5.821 -5.215 94 HG2 GLU 12 2HG GLU 12 -22.875 7.049 -3.146 95 HG3 GLU 12 1HG GLU 12 -23.367 6.730 -4.810 96 H ASP 13 H ASP 13 -18.514 8.052 -4.127 97 HA ASP 13 HA ASP 13 -16.849 6.295 -5.608 98 HB2 ASP 13 2HB ASP 13 -17.028 8.751 -6.021 99 HB3 ASP 13 1HB ASP 13 -16.187 9.036 -4.501 100 H LEU 14 H LEU 14 -16.623 7.772 -2.407 101 HA LEU 14 HA LEU 14 -14.139 6.626 -1.703 102 HB2 LEU 14 2HB LEU 14 -15.054 8.574 -0.562 103 HB3 LEU 14 1HB LEU 14 -16.392 7.616 0.041 104 HG LEU 14 HG LEU 14 -14.789 6.254 1.355 105 HD11 LEU 14 1HD1 LEU 14 -12.781 8.286 0.397 106 HD12 LEU 14 2HD1 LEU 14 -12.799 6.566 0.008 107 HD13 LEU 14 3HD1 LEU 14 -12.507 7.092 1.666 108 HD21 LEU 14 3HD2 LEU 14 -14.339 7.959 3.036 109 HD22 LEU 14 1HD2 LEU 14 -15.961 8.129 2.366 110 HD23 LEU 14 2HD2 LEU 14 -14.676 9.222 1.852 111 H GLU 15 H GLU 15 -17.486 5.539 -1.274 112 HA GLU 15 HA GLU 15 -17.027 3.308 0.350 113 HB2 GLU 15 2HB GLU 15 -19.042 3.489 -1.902 114 HB3 GLU 15 1HB GLU 15 -19.109 2.398 -0.529 115 HG2 GLU 15 2HG GLU 15 -19.289 5.394 -0.365 116 HG3 GLU 15 1HG GLU 15 -20.660 4.294 -0.349 117 H THR 16 H THR 16 -16.704 3.780 -3.098 118 HA THR 16 HA THR 16 -16.121 1.106 -3.806 119 HB THR 16 HB THR 16 -15.195 3.635 -5.189 120 HG1 THR 16 HG1 THR 16 -17.404 3.788 -5.042 121 HG21 THR 16 3HG2 THR 16 -15.685 0.840 -6.234 122 HG22 THR 16 1HG2 THR 16 -14.112 1.608 -6.020 123 HG23 THR 16 2HG2 THR 16 -15.246 2.238 -7.215 124 H VAL 17 H VAL 17 -14.111 3.879 -2.918 125 HA VAL 17 HA VAL 17 -11.588 2.753 -3.352 126 HB VAL 17 HB VAL 17 -12.388 4.836 -1.312 127 HG11 VAL 17 1HG1 VAL 17 -9.666 4.192 -2.443 128 HG12 VAL 17 2HG1 VAL 17 -10.213 3.841 -0.803 129 HG13 VAL 17 3HG1 VAL 17 -10.044 5.513 -1.337 130 HG21 VAL 17 3HG2 VAL 17 -11.327 5.136 -4.121 131 HG22 VAL 17 1HG2 VAL 17 -11.639 6.454 -2.992 132 HG23 VAL 17 2HG2 VAL 17 -12.975 5.472 -3.592 133 H ILE 18 H ILE 18 -13.429 2.990 -0.286 134 HA ILE 18 HA ILE 18 -11.471 1.663 1.249 135 HB ILE 18 HB ILE 18 -13.219 1.368 2.968 136 HG12 ILE 18 2HG1 ILE 18 -15.069 2.666 0.955 137 HG13 ILE 18 1HG1 ILE 18 -15.118 0.968 1.415 138 HG21 ILE 18 1HG2 ILE 18 -13.083 4.096 1.700 139 HG22 ILE 18 2HG2 ILE 18 -11.970 3.427 2.893 140 HG23 ILE 18 3HG2 ILE 18 -13.641 3.770 3.342 141 HD11 ILE 18 3HD1 ILE 18 -16.828 2.222 2.572 142 HD12 ILE 18 1HD1 ILE 18 -15.610 3.311 3.234 143 HD13 ILE 18 2HD1 ILE 18 -15.632 1.614 3.716 144 H ARG 19 H ARG 19 -14.215 0.439 -0.587 145 HA ARG 19 HA ARG 19 -14.032 -2.207 0.492 146 HB2 ARG 19 2HB ARG 19 -15.539 -0.983 -1.797 147 HB3 ARG 19 1HB ARG 19 -15.521 -2.727 -1.557 148 HG2 ARG 19 2HG ARG 19 -16.538 -2.517 0.589 149 HG3 ARG 19 1HG ARG 19 -16.359 -0.764 0.562 150 HD2 ARG 19 2HD ARG 19 -17.954 -0.562 -1.208 151 HD3 ARG 19 1HD ARG 19 -18.016 -2.311 -1.419 152 HE ARG 19 HE ARG 19 -19.453 -2.464 0.362 153 HH11 ARG 19 1HH1 ARG 19 -18.046 0.751 0.307 154 HH12 ARG 19 2HH1 ARG 19 -19.121 1.375 1.522 155 HH21 ARG 19 1HH2 ARG 19 -20.860 -1.630 1.968 156 HH22 ARG 19 2HH2 ARG 19 -20.716 0.039 2.447 157 H ALA 20 H ALA 20 -12.388 -0.506 -1.998 158 HA ALA 20 HA ALA 20 -11.499 -2.852 -3.402 159 HB1 ALA 20 3HB ALA 20 -10.472 -0.016 -3.476 160 HB2 ALA 20 1HB ALA 20 -11.648 -0.733 -4.576 161 HB3 ALA 20 2HB ALA 20 -9.981 -1.310 -4.570 162 H VAL 21 H VAL 21 -10.310 -0.828 -0.793 163 HA VAL 21 HA VAL 21 -7.700 -2.083 -0.794 164 HB VAL 21 HB VAL 21 -8.847 -0.158 1.235 165 HG11 VAL 21 1HG1 VAL 21 -6.917 -1.405 2.048 166 HG12 VAL 21 2HG1 VAL 21 -6.506 0.290 1.787 167 HG13 VAL 21 3HG1 VAL 21 -5.997 -0.931 0.620 168 HG21 VAL 21 3HG2 VAL 21 -7.637 1.591 0.024 169 HG22 VAL 21 1HG2 VAL 21 -8.870 0.839 -0.989 170 HG23 VAL 21 2HG2 VAL 21 -7.172 0.416 -1.206 171 H TYR 22 H TYR 22 -10.599 -2.089 1.255 172 HA TYR 22 HA TYR 22 -9.582 -3.657 3.352 173 HB2 TYR 22 2HB TYR 22 -12.160 -2.649 2.508 174 HB3 TYR 22 1HB TYR 22 -12.300 -4.286 3.136 175 HD1 TYR 22 HD2 TYR 22 -11.583 -4.782 5.452 176 HD2 TYR 22 HD1 TYR 22 -11.716 -0.801 3.962 177 HE1 TYR 22 HE2 TYR 22 -11.528 -3.929 7.753 178 HE2 TYR 22 HE1 TYR 22 -11.659 0.066 6.264 179 HH TYR 22 HH TYR 22 -12.296 -0.777 8.569 180 H ARG 23 H ARG 23 -9.722 -5.867 3.812 181 HA ARG 23 HA ARG 23 -9.576 -7.535 1.457 182 HB2 ARG 23 2HB ARG 23 -9.294 -8.264 4.373 183 HB3 ARG 23 1HB ARG 23 -8.992 -9.345 3.023 184 HG2 ARG 23 2HG ARG 23 -7.191 -7.810 2.271 185 HG3 ARG 23 1HG ARG 23 -7.446 -6.867 3.743 186 HD2 ARG 23 2HD ARG 23 -6.579 -9.748 3.543 187 HD3 ARG 23 1HD ARG 23 -5.623 -8.384 4.125 188 HE ARG 23 HE ARG 23 -7.610 -8.293 5.857 189 HH11 ARG 23 1HH1 ARG 23 -5.964 -11.142 4.628 190 HH12 ARG 23 2HH1 ARG 23 -6.240 -12.073 6.066 191 HH21 ARG 23 1HH2 ARG 23 -7.942 -9.488 7.738 192 HH22 ARG 23 2HH2 ARG 23 -7.328 -11.117 7.863 193 H GLN 24 H GLN 24 -11.706 -7.537 0.685 194 HA GLN 24 HA GLN 24 -13.882 -8.553 2.197 195 HB2 GLN 24 2HB GLN 24 -14.291 -7.300 0.157 196 HB3 GLN 24 1HB GLN 24 -13.399 -8.479 -0.791 197 HG2 GLN 24 2HG GLN 24 -15.830 -8.684 -1.059 198 HG3 GLN 24 1HG GLN 24 -15.096 -10.146 -0.409 199 HE21 GLN 24 1HE2 GLN 24 -15.649 -10.838 1.615 200 HE22 GLN 24 2HE2 GLN 24 -16.917 -10.117 2.548 201 H VAL 25 H VAL 25 -13.656 -10.444 3.175 202 HA VAL 25 HA VAL 25 -12.071 -12.571 2.080 203 HB VAL 25 HB VAL 25 -12.811 -13.834 4.101 204 HG11 VAL 25 1HG1 VAL 25 -10.792 -12.484 4.155 205 HG12 VAL 25 2HG1 VAL 25 -11.615 -12.420 5.713 206 HG13 VAL 25 3HG1 VAL 25 -11.734 -11.060 4.594 207 HG21 VAL 25 3HG2 VAL 25 -14.298 -11.282 4.732 208 HG22 VAL 25 1HG2 VAL 25 -14.058 -12.626 5.848 209 HG23 VAL 25 2HG2 VAL 25 -15.020 -12.853 4.387 210 H LEU 26 H LEU 26 -13.262 -14.873 2.539 211 HA LEU 26 HA LEU 26 -15.061 -15.102 0.356 212 HB2 LEU 26 2HB LEU 26 -15.205 -17.518 1.139 213 HB3 LEU 26 1HB LEU 26 -13.635 -16.924 0.642 214 HG LEU 26 HG LEU 26 -13.245 -16.503 3.176 215 HD11 LEU 26 1HD1 LEU 26 -14.431 -18.025 4.650 216 HD12 LEU 26 2HD1 LEU 26 -15.447 -18.556 3.308 217 HD13 LEU 26 3HD1 LEU 26 -15.547 -16.893 3.887 218 HD21 LEU 26 3HD2 LEU 26 -12.424 -18.790 3.448 219 HD22 LEU 26 1HD2 LEU 26 -12.025 -18.134 1.862 220 HD23 LEU 26 2HD2 LEU 26 -13.347 -19.290 2.031 221 H GLY 27 H GLY 27 -15.547 -14.367 3.619 222 HA2 GLY 27 2HA GLY 27 -18.293 -15.278 3.718 223 HA3 GLY 27 1HA GLY 27 -17.474 -14.291 4.923 224 H ASN 28 H ASN 28 -19.825 -14.280 2.605 225 HA ASN 28 HA ASN 28 -19.446 -11.906 1.194 226 HB2 ASN 28 2HB ASN 28 -21.089 -13.628 0.564 227 HB3 ASN 28 1HB ASN 28 -22.063 -13.211 1.968 228 HD21 ASN 28 1HD2 ASN 28 -23.297 -11.357 1.938 229 HD22 ASN 28 2HD2 ASN 28 -23.565 -10.425 0.505 230 H ASP 29 H ASP 29 -21.741 -12.358 3.915 231 HA ASP 29 HA ASP 29 -21.236 -9.533 4.568 232 HB2 ASP 29 2HB ASP 29 -23.447 -9.838 3.452 233 HB3 ASP 29 1HB ASP 29 -23.933 -10.883 4.784 234 H TYR 30 H TYR 30 -19.706 -10.376 6.039 235 HA TYR 30 HA TYR 30 -20.960 -11.021 8.624 236 HB2 TYR 30 2HB TYR 30 -18.348 -12.111 7.543 237 HB3 TYR 30 1HB TYR 30 -18.859 -12.260 9.217 238 HD1 TYR 30 HD1 TYR 30 -21.080 -13.520 9.650 239 HD2 TYR 30 HD2 TYR 30 -18.914 -13.739 5.995 240 HE1 TYR 30 HE1 TYR 30 -22.189 -15.652 9.128 241 HE2 TYR 30 HE2 TYR 30 -20.024 -15.865 5.460 242 HH TYR 30 HH TYR 30 -21.090 -17.746 6.780 243 H VAL 31 H VAL 31 -20.150 -8.548 7.242 244 HA VAL 31 HA VAL 31 -18.722 -6.804 7.202 245 HB VAL 31 HB VAL 31 -20.111 -6.250 9.118 246 HG11 VAL 31 1HG1 VAL 31 -19.337 -6.535 11.418 247 HG12 VAL 31 2HG1 VAL 31 -17.989 -7.512 10.837 248 HG13 VAL 31 3HG1 VAL 31 -19.645 -8.079 10.623 249 HG21 VAL 31 3HG2 VAL 31 -18.600 -4.613 10.192 250 HG22 VAL 31 1HG2 VAL 31 -18.492 -4.630 8.431 251 HG23 VAL 31 2HG2 VAL 31 -17.239 -5.405 9.399 252 H MET 32 H MET 32 -17.186 -8.319 6.272 253 HA MET 32 HA MET 32 -15.074 -9.020 5.895 254 HB2 MET 32 2HB MET 32 -14.389 -7.163 8.179 255 HB3 MET 32 1HB MET 32 -13.232 -7.866 7.056 256 HG2 MET 32 2HG MET 32 -15.416 -5.903 6.432 257 HG3 MET 32 1HG MET 32 -13.675 -5.626 6.386 258 HE1 MET 32 3HE MET 32 -14.030 -4.580 3.927 259 HE2 MET 32 1HE MET 32 -15.753 -4.946 3.998 260 HE3 MET 32 2HE MET 32 -14.801 -5.455 2.604 261 H ALA 33 H ALA 33 -12.930 -9.693 7.478 262 HA ALA 33 HA ALA 33 -14.082 -11.743 9.252 263 HB1 ALA 33 3HB ALA 33 -12.668 -12.585 7.425 264 HB2 ALA 33 1HB ALA 33 -11.980 -12.944 9.008 265 HB3 ALA 33 2HB ALA 33 -11.322 -11.625 8.039 266 H SER 34 H SER 34 -14.428 -10.220 10.917 267 HA SER 34 HA SER 34 -13.996 -8.849 12.656 268 HB2 SER 34 2HB SER 34 -12.114 -9.619 14.163 269 HB3 SER 34 1HB SER 34 -13.317 -10.836 13.757 270 HG SER 34 HG SER 34 -10.650 -10.579 12.850 271 H GLU 35 H GLU 35 -12.817 -8.095 10.078 272 HA GLU 35 HA GLU 35 -10.397 -6.651 10.814 273 HB2 GLU 35 2HB GLU 35 -10.629 -7.969 8.669 274 HB3 GLU 35 1HB GLU 35 -11.803 -6.775 8.144 275 HG2 GLU 35 2HG GLU 35 -10.166 -5.072 8.052 276 HG3 GLU 35 1HG GLU 35 -8.980 -6.074 8.895 277 H ARG 36 H ARG 36 -10.878 -4.869 11.952 278 HA ARG 36 HA ARG 36 -12.863 -3.007 10.855 279 HB2 ARG 36 2HB ARG 36 -12.777 -3.971 13.717 280 HB3 ARG 36 1HB ARG 36 -13.734 -2.604 13.161 281 HG2 ARG 36 2HG ARG 36 -15.016 -4.062 11.705 282 HG3 ARG 36 1HG ARG 36 -14.030 -5.441 12.194 283 HD2 ARG 36 2HD ARG 36 -14.802 -5.158 14.504 284 HD3 ARG 36 1HD ARG 36 -15.795 -3.791 13.998 285 HE ARG 36 HE ARG 36 -16.805 -5.620 12.428 286 HH11 ARG 36 1HH1 ARG 36 -15.813 -6.011 15.768 287 HH12 ARG 36 2HH1 ARG 36 -16.994 -7.242 16.100 288 HH21 ARG 36 1HH2 ARG 36 -18.354 -7.247 12.872 289 HH22 ARG 36 2HH2 ARG 36 -18.429 -7.954 14.458 290 H LEU 37 H LEU 37 -11.523 -1.441 10.291 291 HA LEU 37 HA LEU 37 -9.683 -0.355 12.309 292 HB2 LEU 37 2HB LEU 37 -9.846 0.266 9.358 293 HB3 LEU 37 1HB LEU 37 -8.601 0.800 10.472 294 HG LEU 37 HG LEU 37 -9.086 -2.105 9.836 295 HD11 LEU 37 1HD1 LEU 37 -8.513 -0.875 7.793 296 HD12 LEU 37 2HD1 LEU 37 -7.221 -1.963 8.299 297 HD13 LEU 37 3HD1 LEU 37 -7.082 -0.230 8.597 298 HD21 LEU 37 3HD2 LEU 37 -6.812 -2.361 10.712 299 HD22 LEU 37 1HD2 LEU 37 -7.898 -1.671 11.919 300 HD23 LEU 37 2HD2 LEU 37 -6.756 -0.634 11.063 301 H VAL 38 H VAL 38 -11.805 0.377 13.296 302 HA VAL 38 HA VAL 38 -13.576 2.114 12.067 303 HB VAL 38 HB VAL 38 -14.071 1.002 14.178 304 HG11 VAL 38 1HG1 VAL 38 -13.179 1.877 16.302 305 HG12 VAL 38 2HG1 VAL 38 -12.073 2.903 15.389 306 HG13 VAL 38 3HG1 VAL 38 -11.934 1.147 15.287 307 HG21 VAL 38 3HG2 VAL 38 -14.215 4.004 14.388 308 HG22 VAL 38 1HG2 VAL 38 -15.169 2.863 15.334 309 HG23 VAL 38 2HG2 VAL 38 -15.384 2.956 13.585 310 H SER 39 H SER 39 -10.490 2.832 13.588 311 HA SER 39 HA SER 39 -10.916 5.664 13.624 312 HB2 SER 39 2HB SER 39 -8.363 4.063 13.914 313 HB3 SER 39 1HB SER 39 -8.538 5.783 14.263 314 HG SER 39 HG SER 39 -10.038 5.246 15.881 315 H ALA 40 H ALA 40 -9.094 3.416 11.561 316 HA ALA 40 HA ALA 40 -8.030 5.357 9.822 317 HB1 ALA 40 3HB ALA 40 -8.673 2.462 9.259 318 HB2 ALA 40 1HB ALA 40 -7.156 3.083 9.913 319 HB3 ALA 40 2HB ALA 40 -7.646 3.498 8.269 320 H GLU 41 H GLU 41 -11.027 3.481 9.719 321 HA GLU 41 HA GLU 41 -11.962 4.293 7.218 322 HB2 GLU 41 2HB GLU 41 -13.471 3.544 9.724 323 HB3 GLU 41 1HB GLU 41 -14.236 3.781 8.159 324 HG2 GLU 41 2HG GLU 41 -13.123 1.921 7.227 325 HG3 GLU 41 1HG GLU 41 -12.029 1.794 8.604 326 H SER 42 H SER 42 -12.559 5.731 10.418 327 HA SER 42 HA SER 42 -14.243 7.777 9.414 328 HB2 SER 42 2HB SER 42 -13.781 8.809 11.727 329 HB3 SER 42 1HB SER 42 -14.582 7.239 11.674 330 HG SER 42 HG SER 42 -12.787 6.268 12.389 331 H LEU 43 H LEU 43 -10.785 7.648 10.177 332 HA LEU 43 HA LEU 43 -10.326 10.421 9.795 333 HB2 LEU 43 2HB LEU 43 -8.448 8.068 9.654 334 HB3 LEU 43 1HB LEU 43 -7.925 9.738 9.560 335 HG LEU 43 HG LEU 43 -9.306 8.458 11.920 336 HD11 LEU 43 1HD1 LEU 43 -7.147 8.762 13.039 337 HD12 LEU 43 2HD1 LEU 43 -6.451 9.346 11.528 338 HD13 LEU 43 3HD1 LEU 43 -7.019 7.681 11.652 339 HD21 LEU 43 3HD2 LEU 43 -9.900 10.807 11.710 340 HD22 LEU 43 1HD2 LEU 43 -8.196 11.239 11.563 341 HD23 LEU 43 2HD2 LEU 43 -8.808 10.564 13.073 342 H LEU 44 H LEU 44 -10.174 7.629 7.619 343 HA LEU 44 HA LEU 44 -9.181 9.115 5.395 344 HB2 LEU 44 2HB LEU 44 -8.976 6.663 5.560 345 HB3 LEU 44 1HB LEU 44 -10.719 6.516 5.423 346 HG LEU 44 HG LEU 44 -10.548 7.599 3.156 347 HD11 LEU 44 1HD1 LEU 44 -7.604 7.065 3.517 348 HD12 LEU 44 2HD1 LEU 44 -8.352 8.661 3.523 349 HD13 LEU 44 3HD1 LEU 44 -8.397 7.670 2.063 350 HD21 LEU 44 3HD2 LEU 44 -10.807 5.193 3.402 351 HD22 LEU 44 1HD2 LEU 44 -9.061 5.009 3.572 352 HD23 LEU 44 2HD2 LEU 44 -9.745 5.569 2.046 353 H ARG 45 H ARG 45 -12.384 8.237 6.556 354 HA ARG 45 HA ARG 45 -13.791 9.174 4.274 355 HB2 ARG 45 2HB ARG 45 -14.597 7.533 6.064 356 HB3 ARG 45 1HB ARG 45 -14.924 8.946 7.059 357 HG2 ARG 45 2HG ARG 45 -16.603 9.710 5.616 358 HG3 ARG 45 1HG ARG 45 -16.079 8.650 4.307 359 HD2 ARG 45 2HD ARG 45 -16.711 6.704 5.746 360 HD3 ARG 45 1HD ARG 45 -17.404 7.849 6.892 361 HE ARG 45 HE ARG 45 -19.028 8.453 5.231 362 HH11 ARG 45 1HH1 ARG 45 -17.130 5.598 4.499 363 HH12 ARG 45 2HH1 ARG 45 -18.258 4.978 3.328 364 HH21 ARG 45 1HH2 ARG 45 -20.525 7.640 3.701 365 HH22 ARG 45 2HH2 ARG 45 -20.203 6.116 2.910 366 H ASN 46 H ASN 46 -12.378 10.736 6.971 367 HA ASN 46 HA ASN 46 -13.835 13.219 6.486 368 HB2 ASN 46 2HB ASN 46 -11.996 12.238 8.621 369 HB3 ASN 46 1HB ASN 46 -12.078 13.973 8.337 370 HD21 ASN 46 1HD2 ASN 46 -13.850 11.142 9.336 371 HD22 ASN 46 2HD2 ASN 46 -15.178 11.988 10.055 372 H GLY 47 H GLY 47 -11.315 11.644 5.123 373 HA2 GLY 47 2HA GLY 47 -9.673 12.279 3.662 374 HA3 GLY 47 1HA GLY 47 -10.445 13.857 3.619 375 H LYS 48 H LYS 48 -8.953 12.191 6.378 376 HA LYS 48 HA LYS 48 -7.149 14.499 6.629 377 HB2 LYS 48 2HB LYS 48 -7.988 12.497 8.733 378 HB3 LYS 48 1HB LYS 48 -6.906 13.859 8.995 379 HG2 LYS 48 2HG LYS 48 -8.819 15.343 8.240 380 HG3 LYS 48 1HG LYS 48 -9.846 13.914 8.372 381 HD2 LYS 48 2HD LYS 48 -9.986 15.212 10.413 382 HD3 LYS 48 1HD LYS 48 -9.165 13.685 10.739 383 HE2 LYS 48 2HE LYS 48 -7.012 14.787 10.669 384 HE3 LYS 48 1HE LYS 48 -7.774 16.309 10.220 385 HZ1 LYS 48 3HZ LYS 48 -8.876 16.373 12.355 386 HZ2 LYS 48 1HZ LYS 48 -7.199 16.220 12.576 387 HZ3 LYS 48 2HZ LYS 48 -8.208 14.874 12.787 388 H ILE 49 H ILE 49 -7.228 10.977 6.561 389 HA ILE 49 HA ILE 49 -4.291 10.974 6.506 390 HB ILE 49 HB ILE 49 -4.395 8.549 6.831 391 HG12 ILE 49 2HG1 ILE 49 -7.385 8.911 7.142 392 HG13 ILE 49 1HG1 ILE 49 -6.613 8.206 5.726 393 HG21 ILE 49 1HG2 ILE 49 -5.948 10.161 8.846 394 HG22 ILE 49 2HG2 ILE 49 -4.200 9.936 8.781 395 HG23 ILE 49 3HG2 ILE 49 -5.251 8.570 9.154 396 HD11 ILE 49 3HD1 ILE 49 -5.730 6.401 7.102 397 HD12 ILE 49 1HD1 ILE 49 -7.489 6.495 7.211 398 HD13 ILE 49 2HD1 ILE 49 -6.489 7.113 8.526 399 H THR 50 H THR 50 -3.203 9.767 4.871 400 HA THR 50 HA THR 50 -4.520 10.077 2.304 401 HB THR 50 HB THR 50 -2.305 9.490 1.358 402 HG1 THR 50 HG1 THR 50 -1.417 9.427 4.072 403 HG21 THR 50 3HG2 THR 50 -2.813 11.826 1.887 404 HG22 THR 50 1HG2 THR 50 -1.104 11.475 2.151 405 HG23 THR 50 2HG2 THR 50 -2.203 11.594 3.525 406 H VAL 51 H VAL 51 -4.406 8.361 0.657 407 HA VAL 51 HA VAL 51 -5.452 5.905 1.473 408 HB VAL 51 HB VAL 51 -3.973 6.496 -1.103 409 HG11 VAL 51 1HG1 VAL 51 -5.268 4.656 -2.047 410 HG12 VAL 51 2HG1 VAL 51 -5.993 4.344 -0.470 411 HG13 VAL 51 3HG1 VAL 51 -4.262 4.099 -0.709 412 HG21 VAL 51 3HG2 VAL 51 -6.908 6.726 -0.443 413 HG22 VAL 51 1HG2 VAL 51 -6.192 6.945 -2.041 414 HG23 VAL 51 2HG2 VAL 51 -5.797 8.063 -0.736 415 H ARG 52 H ARG 52 -2.156 6.937 0.910 416 HA ARG 52 HA ARG 52 -0.789 4.517 0.947 417 HB2 ARG 52 2HB ARG 52 0.112 7.090 2.254 418 HB3 ARG 52 1HB ARG 52 1.142 5.795 1.666 419 HG2 ARG 52 2HG ARG 52 -0.636 6.984 -0.349 420 HG3 ARG 52 1HG ARG 52 0.595 8.063 0.304 421 HD2 ARG 52 2HD ARG 52 1.447 6.975 -1.665 422 HD3 ARG 52 1HD ARG 52 2.315 6.390 -0.249 423 HE ARG 52 HE ARG 52 0.079 4.773 -1.149 424 HH11 ARG 52 1HH1 ARG 52 3.525 5.339 -1.221 425 HH12 ARG 52 2HH1 ARG 52 3.918 3.701 -1.645 426 HH21 ARG 52 1HH2 ARG 52 0.587 2.618 -1.772 427 HH22 ARG 52 2HH2 ARG 52 2.243 2.162 -1.990 428 H GLU 53 H GLU 53 -1.706 6.621 3.647 429 HA GLU 53 HA GLU 53 -0.608 4.964 5.670 430 HB2 GLU 53 2HB GLU 53 -2.718 7.119 5.878 431 HB3 GLU 53 1HB GLU 53 -1.782 6.456 7.214 432 HG2 GLU 53 2HG GLU 53 0.238 7.374 6.356 433 HG3 GLU 53 1HG GLU 53 -0.550 7.850 4.853 434 H PHE 54 H PHE 54 -3.773 5.244 4.182 435 HA PHE 54 HA PHE 54 -5.171 3.573 5.987 436 HB2 PHE 54 2HB PHE 54 -6.241 5.108 4.322 437 HB3 PHE 54 1HB PHE 54 -5.746 4.000 3.047 438 HD1 PHE 54 HD2 PHE 54 -7.627 4.014 6.262 439 HD2 PHE 54 HD1 PHE 54 -7.235 2.382 2.351 440 HE1 PHE 54 HE2 PHE 54 -9.702 2.732 6.592 441 HE2 PHE 54 HE1 PHE 54 -9.309 1.099 2.674 442 HZ PHE 54 HZ PHE 54 -10.546 1.274 4.799 443 H VAL 55 H VAL 55 -3.340 2.950 3.035 444 HA VAL 55 HA VAL 55 -3.817 0.221 2.760 445 HB VAL 55 HB VAL 55 -1.342 1.837 2.115 446 HG11 VAL 55 1HG1 VAL 55 -1.971 -0.995 1.288 447 HG12 VAL 55 2HG1 VAL 55 -0.716 -0.510 2.428 448 HG13 VAL 55 3HG1 VAL 55 -0.603 -0.029 0.734 449 HG21 VAL 55 3HG2 VAL 55 -2.147 1.652 -0.188 450 HG22 VAL 55 1HG2 VAL 55 -3.341 2.436 0.847 451 HG23 VAL 55 2HG2 VAL 55 -3.555 0.750 0.373 452 H ARG 56 H ARG 56 -1.414 1.918 4.754 453 HA ARG 56 HA ARG 56 -0.053 -0.289 5.778 454 HB2 ARG 56 2HB ARG 56 0.517 2.141 6.170 455 HB3 ARG 56 1HB ARG 56 -0.765 2.178 7.371 456 HG2 ARG 56 2HG ARG 56 0.377 0.436 8.650 457 HG3 ARG 56 1HG ARG 56 1.668 0.404 7.450 458 HD2 ARG 56 2HD ARG 56 2.457 1.730 9.238 459 HD3 ARG 56 1HD ARG 56 2.027 2.851 7.949 460 HE ARG 56 HE ARG 56 -0.184 2.543 9.653 461 HH11 ARG 56 1HH1 ARG 56 3.051 3.890 9.695 462 HH12 ARG 56 2HH1 ARG 56 2.680 5.088 10.899 463 HH21 ARG 56 1HH2 ARG 56 -0.679 4.128 11.215 464 HH22 ARG 56 2HH2 ARG 56 0.543 5.242 11.743 465 H ALA 57 H ALA 57 -2.907 1.365 7.048 466 HA ALA 57 HA ALA 57 -3.224 -0.146 9.368 467 HB1 ALA 57 3HB ALA 57 -5.334 1.276 7.749 468 HB2 ALA 57 1HB ALA 57 -4.333 1.993 9.012 469 HB3 ALA 57 2HB ALA 57 -5.503 0.738 9.420 470 H VAL 58 H VAL 58 -4.595 -0.627 6.129 471 HA VAL 58 HA VAL 58 -6.259 -2.799 6.953 472 HB VAL 58 HB VAL 58 -5.415 -1.999 4.164 473 HG11 VAL 58 1HG1 VAL 58 -6.212 -4.297 4.234 474 HG12 VAL 58 2HG1 VAL 58 -7.391 -3.257 3.432 475 HG13 VAL 58 3HG1 VAL 58 -7.663 -3.783 5.093 476 HG21 VAL 58 3HG2 VAL 58 -7.892 -1.314 5.742 477 HG22 VAL 58 1HG2 VAL 58 -7.592 -0.884 4.058 478 HG23 VAL 58 2HG2 VAL 58 -6.579 -0.208 5.335 479 H ALA 59 H ALA 59 -3.060 -2.556 5.479 480 HA ALA 59 HA ALA 59 -2.828 -5.264 4.725 481 HB1 ALA 59 3HB ALA 59 -0.615 -3.323 5.374 482 HB2 ALA 59 1HB ALA 59 -1.415 -3.482 3.811 483 HB3 ALA 59 2HB ALA 59 -0.460 -4.819 4.452 484 H LYS 60 H LYS 60 -2.123 -3.598 7.746 485 HA LYS 60 HA LYS 60 -1.260 -6.179 8.883 486 HB2 LYS 60 2HB LYS 60 -0.057 -4.900 10.599 487 HB3 LYS 60 1HB LYS 60 0.495 -4.492 8.982 488 HG2 LYS 60 2HG LYS 60 -0.855 -2.451 9.043 489 HG3 LYS 60 1HG LYS 60 -1.382 -2.860 10.676 490 HD2 LYS 60 2HD LYS 60 0.414 -1.256 10.805 491 HD3 LYS 60 1HD LYS 60 0.987 -2.812 11.407 492 HE2 LYS 60 2HE LYS 60 2.034 -3.253 9.233 493 HE3 LYS 60 1HE LYS 60 1.479 -1.684 8.651 494 HZ1 LYS 60 3HZ LYS 60 3.722 -1.428 9.320 495 HZ2 LYS 60 1HZ LYS 60 3.457 -2.223 10.800 496 HZ3 LYS 60 2HZ LYS 60 2.786 -0.695 10.525 497 H SER 61 H SER 61 -3.997 -4.893 8.531 498 HA SER 61 HA SER 61 -5.050 -3.958 10.924 499 HB2 SER 61 2HB SER 61 -7.258 -4.721 9.981 500 HB3 SER 61 1HB SER 61 -6.295 -3.737 8.878 501 HG SER 61 HG SER 61 -6.123 -5.379 7.562 502 H GLU 62 H GLU 62 -5.767 -7.177 9.640 503 HA GLU 62 HA GLU 62 -6.064 -8.194 12.357 504 HB2 GLU 62 2HB GLU 62 -7.771 -8.646 10.556 505 HB3 GLU 62 1HB GLU 62 -6.554 -9.599 9.719 506 HG2 GLU 62 2HG GLU 62 -8.080 -11.016 10.959 507 HG3 GLU 62 1HG GLU 62 -6.443 -11.134 11.603 508 H LEU 63 H LEU 63 -5.127 -10.490 12.680 509 HA LEU 63 HA LEU 63 -2.369 -10.498 12.550 510 HB2 LEU 63 2HB LEU 63 -4.358 -12.735 12.763 511 HB3 LEU 63 1HB LEU 63 -2.641 -13.072 12.691 512 HG LEU 63 HG LEU 63 -2.364 -11.594 14.719 513 HD11 LEU 63 1HD1 LEU 63 -5.369 -11.826 14.791 514 HD12 LEU 63 2HD1 LEU 63 -4.441 -10.342 14.576 515 HD13 LEU 63 3HD1 LEU 63 -4.356 -11.223 16.102 516 HD21 LEU 63 3HD2 LEU 63 -3.101 -13.322 16.268 517 HD22 LEU 63 1HD2 LEU 63 -2.353 -14.034 14.838 518 HD23 LEU 63 2HD2 LEU 63 -4.108 -14.033 15.007 519 H TYR 64 H TYR 64 -1.194 -10.278 10.803 520 HA TYR 64 HA TYR 64 -2.072 -10.979 8.211 521 HB2 TYR 64 2HB TYR 64 0.347 -10.402 7.591 522 HB3 TYR 64 1HB TYR 64 -0.638 -9.131 8.303 523 HD1 TYR 64 HD1 TYR 64 2.109 -11.514 8.944 524 HD2 TYR 64 HD2 TYR 64 -0.074 -8.166 10.410 525 HE1 TYR 64 HE1 TYR 64 3.826 -11.153 10.665 526 HE2 TYR 64 HE2 TYR 64 1.634 -7.800 12.139 527 HH TYR 64 HH TYR 64 3.380 -9.183 13.341 528 H LYS 65 H LYS 65 -0.550 -12.843 10.627 529 HA LYS 65 HA LYS 65 0.616 -14.717 8.768 530 HB2 LYS 65 2HB LYS 65 1.463 -14.326 11.137 531 HB3 LYS 65 1HB LYS 65 0.050 -15.220 11.690 532 HG2 LYS 65 2HG LYS 65 0.767 -17.185 10.498 533 HG3 LYS 65 1HG LYS 65 2.117 -16.299 9.786 534 HD2 LYS 65 2HD LYS 65 3.037 -17.546 11.559 535 HD3 LYS 65 1HD LYS 65 2.914 -15.892 12.160 536 HE2 LYS 65 2HE LYS 65 0.872 -16.460 13.352 537 HE3 LYS 65 1HE LYS 65 0.934 -18.100 12.707 538 HZ1 LYS 65 3HZ LYS 65 1.824 -18.206 14.862 539 HZ2 LYS 65 1HZ LYS 65 2.800 -16.834 14.631 540 HZ3 LYS 65 2HZ LYS 65 3.163 -18.277 13.822 541 H GLU 66 H GLU 66 -1.339 -14.844 7.536 542 HA GLU 66 HA GLU 66 -3.533 -16.374 8.719 543 HB2 GLU 66 2HB GLU 66 -3.971 -14.245 7.485 544 HB3 GLU 66 1HB GLU 66 -3.343 -15.002 6.031 545 HG2 GLU 66 2HG GLU 66 -5.141 -16.642 6.099 546 HG3 GLU 66 1HG GLU 66 -5.766 -15.894 7.570 547 H LYS 67 H LYS 67 -2.260 -16.334 5.411 548 HA LYS 67 HA LYS 67 -1.682 -19.207 5.636 549 HB2 LYS 67 2HB LYS 67 -3.097 -17.826 3.345 550 HB3 LYS 67 1HB LYS 67 -2.476 -19.468 3.271 551 HG2 LYS 67 2HG LYS 67 -4.002 -20.143 5.042 552 HG3 LYS 67 1HG LYS 67 -4.606 -18.488 5.163 553 HD2 LYS 67 2HD LYS 67 -5.356 -18.611 2.824 554 HD3 LYS 67 1HD LYS 67 -4.788 -20.279 2.739 555 HE2 LYS 67 2HE LYS 67 -6.878 -19.282 4.669 556 HE3 LYS 67 1HE LYS 67 -7.239 -20.051 3.124 557 HZ1 LYS 67 3HZ LYS 67 -5.986 -22.017 3.932 558 HZ2 LYS 67 1HZ LYS 67 -7.380 -21.680 4.835 559 HZ3 LYS 67 2HZ LYS 67 -5.856 -21.277 5.453 560 H PHE 68 H PHE 68 -1.243 -16.272 3.701 561 HA PHE 68 HA PHE 68 1.076 -17.266 2.381 562 HB2 PHE 68 2HB PHE 68 1.287 -14.907 1.533 563 HB3 PHE 68 1HB PHE 68 -0.239 -15.697 1.173 564 HD1 PHE 68 HD2 PHE 68 -2.230 -15.156 2.723 565 HD2 PHE 68 HD1 PHE 68 1.321 -12.815 2.533 566 HE1 PHE 68 HE2 PHE 68 -3.439 -13.248 3.697 567 HE2 PHE 68 HE1 PHE 68 0.116 -10.906 3.505 568 HZ PHE 68 HZ PHE 68 -2.266 -11.121 4.092 569 H LEU 69 H LEU 69 2.328 -17.915 4.160 570 HA LEU 69 HA LEU 69 4.447 -16.170 4.697 571 HB2 LEU 69 2HB LEU 69 2.697 -15.217 6.273 572 HB3 LEU 69 1HB LEU 69 2.789 -16.728 7.157 573 HG LEU 69 HG LEU 69 5.197 -16.300 7.584 574 HD11 LEU 69 1HD1 LEU 69 6.103 -14.074 7.141 575 HD12 LEU 69 2HD1 LEU 69 4.617 -13.636 6.296 576 HD13 LEU 69 3HD1 LEU 69 5.662 -14.900 5.647 577 HD21 LEU 69 3HD2 LEU 69 3.566 -15.669 9.261 578 HD22 LEU 69 1HD2 LEU 69 3.303 -14.121 8.457 579 HD23 LEU 69 2HD2 LEU 69 4.862 -14.473 9.201 580 H TYR 70 H TYR 70 2.855 -18.583 6.780 581 HA TYR 70 HA TYR 70 5.252 -20.234 6.604 582 HB2 TYR 70 2HB TYR 70 4.286 -21.548 8.426 583 HB3 TYR 70 1HB TYR 70 4.328 -19.840 8.839 584 HD1 TYR 70 HD1 TYR 70 2.258 -18.566 9.066 585 HD2 TYR 70 HD2 TYR 70 2.184 -22.709 8.106 586 HE1 TYR 70 HE1 TYR 70 -0.129 -18.655 9.655 587 HE2 TYR 70 HE2 TYR 70 -0.201 -22.808 8.685 588 HH TYR 70 HH TYR 70 -1.793 -21.567 10.105 589 H GLY 71 H GLY 71 1.964 -20.117 5.522 590 HA2 GLY 71 2HA GLY 71 2.170 -22.816 4.386 591 HA3 GLY 71 1HA GLY 71 0.707 -21.840 4.468 592 H ASN 72 H ASN 72 3.783 -20.601 3.441 593 HA ASN 72 HA ASN 72 3.290 -20.810 0.629 594 HB2 ASN 72 2HB ASN 72 1.753 -18.921 1.514 595 HB3 ASN 72 1HB ASN 72 3.236 -18.013 1.775 596 HD21 ASN 72 1HD2 ASN 72 1.065 -19.353 -0.587 597 HD22 ASN 72 2HD2 ASN 72 1.712 -18.495 -1.949 598 H PHE 73 H PHE 73 4.968 -18.847 -0.291 599 HA PHE 73 HA PHE 73 7.483 -19.454 1.118 600 HB2 PHE 73 2HB PHE 73 7.013 -18.875 -1.819 601 HB3 PHE 73 1HB PHE 73 8.595 -19.105 -1.084 602 HD1 PHE 73 HD2 PHE 73 9.260 -21.313 -0.242 603 HD2 PHE 73 HD1 PHE 73 5.591 -20.721 -2.316 604 HE1 PHE 73 HE2 PHE 73 9.075 -23.738 -0.598 605 HE2 PHE 73 HE1 PHE 73 5.398 -23.149 -2.674 606 HZ PHE 73 HZ PHE 73 7.142 -24.659 -1.816 607 H GLN 74 H GLN 74 8.883 -17.794 1.575 608 HA GLN 74 HA GLN 74 7.777 -15.291 2.127 609 HB2 GLN 74 2HB GLN 74 10.667 -16.123 1.863 610 HB3 GLN 74 1HB GLN 74 10.156 -14.559 2.484 611 HG2 GLN 74 2HG GLN 74 9.487 -17.238 3.686 612 HG3 GLN 74 1HG GLN 74 10.698 -16.104 4.282 613 HE21 GLN 74 1HE2 GLN 74 8.324 -17.182 5.595 614 HE22 GLN 74 2HE2 GLN 74 7.383 -15.811 6.063 615 H THR 75 H THR 75 9.776 -16.346 -0.575 616 HA THR 75 HA THR 75 10.155 -13.893 -1.854 617 HB THR 75 HB THR 75 10.325 -15.344 -3.946 618 HG1 THR 75 HG1 THR 75 10.389 -17.657 -3.386 619 HG21 THR 75 3HG2 THR 75 12.273 -14.788 -2.545 620 HG22 THR 75 1HG2 THR 75 12.399 -16.414 -3.217 621 HG23 THR 75 2HG2 THR 75 11.935 -16.191 -1.530 622 H ARG 76 H ARG 76 7.562 -16.266 -2.093 623 HA ARG 76 HA ARG 76 6.135 -14.974 -4.183 624 HB2 ARG 76 2HB ARG 76 6.032 -17.430 -3.375 625 HB3 ARG 76 1HB ARG 76 4.920 -16.837 -2.151 626 HG2 ARG 76 2HG ARG 76 3.626 -17.694 -3.944 627 HG3 ARG 76 1HG ARG 76 3.500 -15.934 -4.002 628 HD2 ARG 76 2HD ARG 76 5.230 -15.874 -5.734 629 HD3 ARG 76 1HD ARG 76 5.337 -17.631 -5.682 630 HE ARG 76 HE ARG 76 2.869 -17.510 -6.354 631 HH11 ARG 76 1HH1 ARG 76 5.339 -15.233 -7.294 632 HH12 ARG 76 2HH1 ARG 76 4.547 -14.761 -8.766 633 HH21 ARG 76 1HH2 ARG 76 1.808 -16.914 -8.328 634 HH22 ARG 76 2HH2 ARG 76 2.556 -15.744 -9.372 635 H VAL 77 H VAL 77 5.883 -14.982 -0.650 636 HA VAL 77 HA VAL 77 3.561 -13.444 -0.384 637 HB VAL 77 HB VAL 77 5.960 -13.533 1.459 638 HG11 VAL 77 1HG1 VAL 77 4.546 -11.603 1.931 639 HG12 VAL 77 2HG1 VAL 77 4.419 -12.807 3.212 640 HG13 VAL 77 3HG1 VAL 77 3.129 -12.651 2.019 641 HG21 VAL 77 3HG2 VAL 77 3.408 -15.139 1.462 642 HG22 VAL 77 1HG2 VAL 77 4.651 -15.192 2.710 643 HG23 VAL 77 2HG2 VAL 77 5.022 -15.735 1.073 644 H ILE 78 H ILE 78 6.960 -12.444 -0.571 645 HA ILE 78 HA ILE 78 6.550 -9.687 -0.301 646 HB ILE 78 HB ILE 78 8.712 -11.149 -1.827 647 HG12 ILE 78 2HG1 ILE 78 8.730 -9.930 0.942 648 HG13 ILE 78 1HG1 ILE 78 8.529 -11.647 0.604 649 HG21 ILE 78 1HG2 ILE 78 10.010 -9.077 -1.656 650 HG22 ILE 78 2HG2 ILE 78 8.621 -8.265 -0.934 651 HG23 ILE 78 3HG2 ILE 78 8.538 -8.840 -2.599 652 HD11 ILE 78 3HD1 ILE 78 10.748 -11.694 -0.416 653 HD12 ILE 78 1HD1 ILE 78 10.803 -11.149 1.260 654 HD13 ILE 78 2HD1 ILE 78 10.945 -9.980 -0.053 655 H GLU 79 H GLU 79 6.579 -11.747 -3.200 656 HA GLU 79 HA GLU 79 6.221 -9.667 -5.057 657 HB2 GLU 79 2HB GLU 79 6.938 -12.014 -5.598 658 HB3 GLU 79 1HB GLU 79 5.272 -12.523 -5.346 659 HG2 GLU 79 2HG GLU 79 4.523 -11.142 -7.151 660 HG3 GLU 79 1HG GLU 79 6.131 -10.455 -7.345 661 H LEU 80 H LEU 80 3.950 -11.624 -3.194 662 HA LEU 80 HA LEU 80 1.562 -10.701 -4.333 663 HB2 LEU 80 2HB LEU 80 2.129 -11.525 -1.486 664 HB3 LEU 80 1HB LEU 80 0.525 -11.263 -2.137 665 HG LEU 80 HG LEU 80 2.465 -13.386 -3.054 666 HD11 LEU 80 1HD1 LEU 80 -0.048 -13.560 -1.396 667 HD12 LEU 80 2HD1 LEU 80 1.600 -13.858 -0.843 668 HD13 LEU 80 3HD1 LEU 80 0.857 -14.937 -2.023 669 HD21 LEU 80 3HD2 LEU 80 1.017 -12.592 -4.862 670 HD22 LEU 80 1HD2 LEU 80 -0.401 -12.876 -3.853 671 HD23 LEU 80 2HD2 LEU 80 0.596 -14.234 -4.375 672 H ASN 81 H ASN 81 3.365 -9.468 -1.512 673 HA ASN 81 HA ASN 81 1.664 -7.278 -1.018 674 HB2 ASN 81 2HB ASN 81 4.603 -7.616 -0.385 675 HB3 ASN 81 1HB ASN 81 3.606 -6.297 0.213 676 HD21 ASN 81 1HD2 ASN 81 4.997 -8.086 1.864 677 HD22 ASN 81 2HD2 ASN 81 3.833 -9.010 2.749 678 H TYR 82 H TYR 82 4.586 -7.595 -2.970 679 HA TYR 82 HA TYR 82 4.933 -4.917 -3.659 680 HB2 TYR 82 2HB TYR 82 6.251 -7.226 -4.217 681 HB3 TYR 82 1HB TYR 82 5.508 -6.900 -5.777 682 HD1 TYR 82 HD1 TYR 82 7.924 -5.713 -3.288 683 HD2 TYR 82 HD2 TYR 82 6.220 -5.001 -7.122 684 HE1 TYR 82 HE1 TYR 82 9.735 -4.133 -3.793 685 HE2 TYR 82 HE2 TYR 82 8.027 -3.415 -7.638 686 HH TYR 82 HH TYR 82 9.646 -2.052 -6.550 687 H LYS 83 H LYS 83 3.079 -7.459 -5.320 688 HA LYS 83 HA LYS 83 2.232 -5.680 -7.412 689 HB2 LYS 83 2HB LYS 83 1.238 -8.443 -6.698 690 HB3 LYS 83 1HB LYS 83 0.875 -7.575 -8.182 691 HG2 LYS 83 2HG LYS 83 3.237 -7.599 -8.782 692 HG3 LYS 83 1HG LYS 83 3.606 -8.464 -7.289 693 HD2 LYS 83 2HD LYS 83 3.503 -10.042 -9.100 694 HD3 LYS 83 1HD LYS 83 2.112 -10.292 -8.043 695 HE2 LYS 83 2HE LYS 83 0.716 -9.004 -9.582 696 HE3 LYS 83 1HE LYS 83 2.108 -8.751 -10.636 697 HZ1 LYS 83 3HZ LYS 83 0.840 -10.540 -11.508 698 HZ2 LYS 83 1HZ LYS 83 0.776 -11.328 -10.006 699 HZ3 LYS 83 2HZ LYS 83 2.248 -11.208 -10.841 700 H HIS 84 H HIS 84 1.027 -6.440 -4.277 701 HA HIS 84 HA HIS 84 -1.679 -5.592 -4.990 702 HB2 HIS 84 2HB HIS 84 -1.127 -7.579 -3.435 703 HB3 HIS 84 1HB HIS 84 -0.791 -6.353 -2.216 704 HD1 HIS 84 HD1 HIS 84 -2.951 -4.589 -1.911 705 HD2 HIS 84 HD2 HIS 84 -3.705 -8.368 -3.463 706 HE1 HIS 84 HE1 HIS 84 -5.414 -4.973 -1.584 707 HE2 HIS 84 HE2 HIS 84 -5.879 -7.160 -2.754 708 H LEU 85 H LEU 85 1.140 -4.423 -3.288 709 HA LEU 85 HA LEU 85 -0.408 -2.149 -2.279 710 HB2 LEU 85 2HB LEU 85 2.406 -2.978 -1.579 711 HB3 LEU 85 1HB LEU 85 1.473 -1.711 -0.804 712 HG LEU 85 HG LEU 85 0.884 -4.670 -0.719 713 HD11 LEU 85 1HD1 LEU 85 1.363 -4.451 1.661 714 HD12 LEU 85 2HD1 LEU 85 1.759 -2.748 1.428 715 HD13 LEU 85 3HD1 LEU 85 2.758 -3.996 0.683 716 HD21 LEU 85 3HD2 LEU 85 -1.190 -3.407 -0.776 717 HD22 LEU 85 1HD2 LEU 85 -0.609 -2.364 0.523 718 HD23 LEU 85 2HD2 LEU 85 -0.918 -4.072 0.834 719 H LEU 86 H LEU 86 2.140 -2.969 -4.520 720 HA LEU 86 HA LEU 86 2.413 -0.109 -5.170 721 HB2 LEU 86 2HB LEU 86 4.303 -2.390 -5.748 722 HB3 LEU 86 1HB LEU 86 4.530 -0.741 -6.299 723 HG LEU 86 HG LEU 86 4.496 -1.656 -3.421 724 HD11 LEU 86 1HD1 LEU 86 6.506 -2.326 -4.640 725 HD12 LEU 86 2HD1 LEU 86 6.857 -1.085 -3.436 726 HD13 LEU 86 3HD1 LEU 86 6.756 -0.654 -5.143 727 HD21 LEU 86 3HD2 LEU 86 4.990 1.082 -4.586 728 HD22 LEU 86 1HD2 LEU 86 5.163 0.630 -2.890 729 HD23 LEU 86 2HD2 LEU 86 3.574 0.590 -3.655 730 H GLY 87 H GLY 87 1.162 -3.058 -6.220 731 HA2 GLY 87 2HA GLY 87 -0.210 -3.467 -8.022 732 HA3 GLY 87 1HA GLY 87 0.064 -1.814 -8.546 733 H ARG 88 H ARG 88 2.909 -3.628 -8.008 734 HA ARG 88 HA ARG 88 3.097 -4.478 -10.789 735 HB2 ARG 88 2HB ARG 88 3.879 -2.129 -10.768 736 HB3 ARG 88 1HB ARG 88 5.060 -2.541 -9.534 737 HG2 ARG 88 2HG ARG 88 6.133 -4.093 -11.120 738 HG3 ARG 88 1HG ARG 88 4.986 -3.577 -12.357 739 HD2 ARG 88 2HD ARG 88 6.879 -1.743 -10.904 740 HD3 ARG 88 1HD ARG 88 7.190 -2.445 -12.489 741 HE ARG 88 HE ARG 88 4.842 -1.216 -12.882 742 HH11 ARG 88 1HH1 ARG 88 7.792 -0.117 -11.356 743 HH12 ARG 88 2HH1 ARG 88 7.594 1.537 -11.859 744 HH21 ARG 88 1HH2 ARG 88 4.594 0.979 -13.575 745 HH22 ARG 88 2HH2 ARG 88 5.798 2.152 -13.127 746 H ALA 89 H ALA 89 4.895 -5.923 -11.168 747 HA ALA 89 HA ALA 89 5.665 -7.378 -8.751 748 HB1 ALA 89 3HB ALA 89 6.017 -8.102 -11.660 749 HB2 ALA 89 1HB ALA 89 4.706 -8.646 -10.612 750 HB3 ALA 89 2HB ALA 89 6.364 -9.148 -10.283 751 HA PRO 90 HA PRO 90 9.859 -5.998 -8.472 752 HB2 PRO 90 2HB PRO 90 10.667 -8.863 -8.526 753 HB3 PRO 90 1HB PRO 90 11.045 -7.607 -7.341 754 HG2 PRO 90 2HG PRO 90 9.251 -9.487 -6.783 755 HG3 PRO 90 1HG PRO 90 8.993 -7.808 -6.277 756 HD2 PRO 90 2HD PRO 90 7.754 -9.316 -8.540 757 HD3 PRO 90 1HD PRO 90 7.026 -8.121 -7.448 758 H TYR 91 H TYR 91 11.872 -5.896 -9.593 759 HA TYR 91 HA TYR 91 11.527 -6.514 -12.446 760 HB2 TYR 91 2HB TYR 91 13.645 -4.719 -11.263 761 HB3 TYR 91 1HB TYR 91 12.991 -4.709 -12.898 762 HD1 TYR 91 HD2 TYR 91 12.391 -3.743 -9.411 763 HD2 TYR 91 HD1 TYR 91 10.937 -3.533 -13.403 764 HE1 TYR 91 HE2 TYR 91 10.801 -2.002 -8.733 765 HE2 TYR 91 HE1 TYR 91 9.342 -1.785 -12.732 766 HH TYR 91 HH TYR 91 9.452 -0.312 -9.570 767 H ASP 92 H ASP 92 13.643 -6.911 -9.701 768 HA ASP 92 HA ASP 92 15.022 -9.090 -11.085 769 HB2 ASP 92 2HB ASP 92 16.436 -7.070 -11.363 770 HB3 ASP 92 1HB ASP 92 16.458 -6.857 -9.616 771 H GLU 93 H GLU 93 16.353 -10.356 -9.475 772 HA GLU 93 HA GLU 93 14.837 -11.236 -7.304 773 HB2 GLU 93 2HB GLU 93 16.592 -12.542 -8.453 774 HB3 GLU 93 1HB GLU 93 17.815 -11.479 -7.775 775 HG2 GLU 93 2HG GLU 93 17.116 -12.212 -5.512 776 HG3 GLU 93 1HG GLU 93 16.023 -13.368 -6.273 777 H SER 94 H SER 94 17.092 -8.640 -7.596 778 HA SER 94 HA SER 94 18.109 -8.450 -5.024 779 HB2 SER 94 2HB SER 94 17.578 -6.241 -7.015 780 HB3 SER 94 1HB SER 94 18.635 -6.113 -5.607 781 HG SER 94 HG SER 94 18.927 -7.834 -7.853 782 H GLU 95 H GLU 95 15.119 -6.988 -6.323 783 HA GLU 95 HA GLU 95 14.484 -5.496 -4.029 784 HB2 GLU 95 2HB GLU 95 12.619 -6.746 -6.052 785 HB3 GLU 95 1HB GLU 95 12.120 -5.596 -4.820 786 HG2 GLU 95 2HG GLU 95 12.354 -4.294 -6.717 787 HG3 GLU 95 1HG GLU 95 13.870 -4.034 -5.858 788 H VAL 96 H VAL 96 13.709 -8.821 -4.929 789 HA VAL 96 HA VAL 96 12.060 -9.379 -2.702 790 HB VAL 96 HB VAL 96 13.734 -11.342 -4.282 791 HG11 VAL 96 1HG1 VAL 96 11.252 -11.755 -2.619 792 HG12 VAL 96 2HG1 VAL 96 12.886 -12.267 -2.194 793 HG13 VAL 96 3HG1 VAL 96 12.067 -12.990 -3.579 794 HG21 VAL 96 3HG2 VAL 96 11.705 -11.691 -5.628 795 HG22 VAL 96 1HG2 VAL 96 12.329 -10.049 -5.775 796 HG23 VAL 96 2HG2 VAL 96 10.921 -10.369 -4.763 797 H ILE 97 H ILE 97 15.510 -9.904 -3.326 798 HA ILE 97 HA ILE 97 16.153 -11.143 -0.891 799 HB ILE 97 HB ILE 97 17.908 -9.411 -2.640 800 HG12 ILE 97 2HG1 ILE 97 16.999 -11.269 -3.891 801 HG13 ILE 97 1HG1 ILE 97 18.693 -11.592 -3.544 802 HG21 ILE 97 1HG2 ILE 97 19.793 -10.588 -1.607 803 HG22 ILE 97 2HG2 ILE 97 18.676 -11.420 -0.525 804 HG23 ILE 97 3HG2 ILE 97 18.866 -9.671 -0.420 805 HD11 ILE 97 3HD1 ILE 97 17.353 -13.588 -3.272 806 HD12 ILE 97 1HD1 ILE 97 16.334 -12.766 -2.090 807 HD13 ILE 97 2HD1 ILE 97 18.030 -13.081 -1.724 808 H PHE 98 H PHE 98 16.079 -7.726 -1.814 809 HA PHE 98 HA PHE 98 17.135 -6.646 0.545 810 HB2 PHE 98 2HB PHE 98 16.850 -5.295 -1.459 811 HB3 PHE 98 1HB PHE 98 15.104 -5.500 -1.386 812 HD1 PHE 98 HD1 PHE 98 17.985 -4.040 0.447 813 HD2 PHE 98 HD2 PHE 98 13.778 -3.999 -0.205 814 HE1 PHE 98 HE1 PHE 98 17.799 -1.994 1.799 815 HE2 PHE 98 HE2 PHE 98 13.586 -1.951 1.145 816 HZ PHE 98 HZ PHE 98 15.594 -0.944 2.147 817 H HIS 99 H HIS 99 13.806 -7.456 -0.350 818 HA HIS 99 HA HIS 99 12.698 -6.497 2.101 819 HB2 HIS 99 2HB HIS 99 11.613 -8.128 -0.176 820 HB3 HIS 99 1HB HIS 99 10.676 -7.904 1.299 821 HD1 HIS 99 HD1 HIS 99 9.262 -5.886 1.388 822 HD2 HIS 99 HD2 HIS 99 12.334 -5.501 -1.400 823 HE1 HIS 99 HE1 HIS 99 8.866 -3.684 0.228 824 HE2 HIS 99 HE2 HIS 99 10.812 -3.397 -1.347 825 H LEU 100 H LEU 100 13.898 -9.601 0.981 826 HA LEU 100 HA LEU 100 13.007 -11.171 3.145 827 HB2 LEU 100 2HB LEU 100 15.433 -11.401 1.371 828 HB3 LEU 100 1HB LEU 100 15.044 -12.588 2.600 829 HG LEU 100 HG LEU 100 13.266 -11.881 0.263 830 HD11 LEU 100 1HD1 LEU 100 13.897 -14.071 -0.618 831 HD12 LEU 100 2HD1 LEU 100 15.021 -14.290 0.724 832 HD13 LEU 100 3HD1 LEU 100 15.301 -13.015 -0.461 833 HD21 LEU 100 3HD2 LEU 100 13.058 -14.059 2.340 834 HD22 LEU 100 1HD2 LEU 100 12.002 -13.863 0.942 835 HD23 LEU 100 2HD2 LEU 100 12.018 -12.639 2.212 836 H ASP 101 H ASP 101 15.962 -9.280 2.675 837 HA ASP 101 HA ASP 101 17.162 -9.882 5.158 838 HB2 ASP 101 2HB ASP 101 18.264 -8.797 3.146 839 HB3 ASP 101 1HB ASP 101 17.466 -7.300 3.612 840 H LEU 102 H LEU 102 14.959 -7.331 4.128 841 HA LEU 102 HA LEU 102 14.845 -5.907 6.552 842 HB2 LEU 102 2HB LEU 102 14.035 -5.010 4.429 843 HB3 LEU 102 1HB LEU 102 12.772 -6.223 4.379 844 HG LEU 102 HG LEU 102 11.778 -5.216 6.425 845 HD11 LEU 102 1HD1 LEU 102 13.774 -4.191 7.349 846 HD12 LEU 102 2HD1 LEU 102 12.512 -2.983 7.103 847 HD13 LEU 102 3HD1 LEU 102 13.866 -3.089 5.976 848 HD21 LEU 102 3HD2 LEU 102 10.946 -4.636 4.219 849 HD22 LEU 102 1HD2 LEU 102 12.154 -3.360 4.079 850 HD23 LEU 102 2HD2 LEU 102 10.880 -3.239 5.294 851 H TYR 103 H TYR 103 12.937 -8.608 5.308 852 HA TYR 103 HA TYR 103 11.091 -8.791 7.415 853 HB2 TYR 103 2HB TYR 103 10.691 -9.946 5.338 854 HB3 TYR 103 1HB TYR 103 12.167 -10.887 5.519 855 HD1 TYR 103 HD1 TYR 103 8.859 -10.294 7.140 856 HD2 TYR 103 HD2 TYR 103 12.087 -12.992 6.503 857 HE1 TYR 103 HE1 TYR 103 7.587 -12.073 8.272 858 HE2 TYR 103 HE2 TYR 103 10.828 -14.773 7.631 859 HH TYR 103 HH TYR 103 9.020 -14.968 9.295 860 H GLU 104 H GLU 104 14.365 -9.963 7.073 861 HA GLU 104 HA GLU 104 14.262 -11.548 9.469 862 HB2 GLU 104 2HB GLU 104 16.523 -10.667 7.679 863 HB3 GLU 104 1HB GLU 104 16.761 -11.663 9.110 864 HG2 GLU 104 2HG GLU 104 14.995 -12.406 6.788 865 HG3 GLU 104 1HG GLU 104 16.659 -12.953 7.004 866 H ASN 105 H ASN 105 15.236 -8.299 8.587 867 HA ASN 105 HA ASN 105 16.577 -7.737 11.045 868 HB2 ASN 105 2HB ASN 105 15.441 -5.858 8.968 869 HB3 ASN 105 1HB ASN 105 16.415 -5.352 10.340 870 HD21 ASN 105 1HD2 ASN 105 18.068 -7.876 10.016 871 HD22 ASN 105 2HD2 ASN 105 19.138 -7.488 8.708 872 H GLU 106 H GLU 106 13.383 -6.761 9.773 873 HA GLU 106 HA GLU 106 12.650 -6.118 12.558 874 HB2 GLU 106 2HB GLU 106 11.678 -4.730 10.059 875 HB3 GLU 106 1HB GLU 106 11.237 -4.323 11.711 876 HG2 GLU 106 2HG GLU 106 13.575 -3.751 12.180 877 HG3 GLU 106 1HG GLU 106 13.987 -4.126 10.508 878 H GLY 107 H GLY 107 11.478 -7.319 9.432 879 HA2 GLY 107 2HA GLY 107 10.175 -9.429 9.728 880 HA3 GLY 107 1HA GLY 107 9.246 -8.545 10.927 881 H PHE 108 H PHE 108 7.411 -9.183 9.702 882 HA PHE 108 HA PHE 108 7.082 -8.428 6.956 883 HB2 PHE 108 2HB PHE 108 6.025 -10.432 8.022 884 HB3 PHE 108 1HB PHE 108 5.012 -9.352 8.967 885 HD1 PHE 108 HD1 PHE 108 5.709 -10.648 5.610 886 HD2 PHE 108 HD2 PHE 108 3.088 -8.283 7.995 887 HE1 PHE 108 HE1 PHE 108 4.040 -10.678 3.805 888 HE2 PHE 108 HE2 PHE 108 1.422 -8.310 6.189 889 HZ PHE 108 HZ PHE 108 1.892 -9.508 4.092 890 H ASP 109 H ASP 109 6.188 -7.119 10.070 891 HA ASP 109 HA ASP 109 4.249 -5.258 9.280 892 HB2 ASP 109 2HB ASP 109 4.985 -5.986 11.641 893 HB3 ASP 109 1HB ASP 109 6.238 -4.760 11.488 894 H ALA 110 H ALA 110 7.759 -4.949 9.585 895 HA ALA 110 HA ALA 110 7.875 -2.234 8.733 896 HB1 ALA 110 3HB ALA 110 9.621 -3.227 10.122 897 HB2 ALA 110 1HB ALA 110 10.285 -2.575 8.625 898 HB3 ALA 110 2HB ALA 110 10.057 -4.314 8.802 899 H ASP 111 H ASP 111 8.060 -5.346 7.114 900 HA ASP 111 HA ASP 111 8.961 -4.565 4.605 901 HB2 ASP 111 2HB ASP 111 8.543 -6.920 5.183 902 HB3 ASP 111 1HB ASP 111 6.813 -6.608 5.251 903 H ILE 112 H ILE 112 5.675 -4.576 5.909 904 HA ILE 112 HA ILE 112 4.327 -3.604 3.672 905 HB ILE 112 HB ILE 112 3.651 -3.184 6.587 906 HG12 ILE 112 2HG1 ILE 112 2.684 -5.291 4.643 907 HG13 ILE 112 1HG1 ILE 112 3.883 -5.559 5.905 908 HG21 ILE 112 1HG2 ILE 112 2.458 -1.623 5.123 909 HG22 ILE 112 2HG2 ILE 112 1.367 -2.807 5.843 910 HG23 ILE 112 3HG2 ILE 112 1.869 -2.981 4.162 911 HD11 ILE 112 3HD1 ILE 112 1.013 -4.769 6.330 912 HD12 ILE 112 1HD1 ILE 112 2.210 -5.028 7.599 913 HD13 ILE 112 2HD1 ILE 112 1.705 -6.372 6.575 914 H ASP 113 H ASP 113 5.647 -1.800 6.457 915 HA ASP 113 HA ASP 113 4.769 0.731 5.665 916 HB2 ASP 113 2HB ASP 113 7.049 -0.170 7.391 917 HB3 ASP 113 1HB ASP 113 6.811 1.540 7.041 918 H SER 114 H SER 114 7.340 -1.160 4.400 919 HA SER 114 HA SER 114 8.958 0.890 3.332 920 HB2 SER 114 2HB SER 114 8.593 -1.912 2.269 921 HB3 SER 114 1HB SER 114 9.981 -0.851 2.012 922 HG SER 114 HG SER 114 9.114 -2.060 4.426 923 H TYR 115 H TYR 115 6.055 -0.702 2.148 924 HA TYR 115 HA TYR 115 6.358 0.225 -0.562 925 HB2 TYR 115 2HB TYR 115 3.902 -0.891 0.815 926 HB3 TYR 115 1HB TYR 115 4.119 -0.699 -0.921 927 HD1 TYR 115 HD1 TYR 115 5.619 -2.204 -2.157 928 HD2 TYR 115 HD2 TYR 115 4.929 -2.709 2.008 929 HE1 TYR 115 HE1 TYR 115 6.571 -4.468 -2.278 930 HE2 TYR 115 HE2 TYR 115 5.878 -4.971 1.897 931 HH TYR 115 HH TYR 115 6.524 -6.636 0.511 932 H ILE 116 H ILE 116 5.478 1.718 2.273 933 HA ILE 116 HA ILE 116 3.391 3.412 1.135 934 HB ILE 116 HB ILE 116 4.561 3.527 3.908 935 HG12 ILE 116 2HG1 ILE 116 2.086 2.032 3.027 936 HG13 ILE 116 1HG1 ILE 116 3.644 1.266 3.332 937 HG21 ILE 116 1HG2 ILE 116 3.320 5.509 3.241 938 HG22 ILE 116 2HG2 ILE 116 2.432 4.607 4.470 939 HG23 ILE 116 3HG2 ILE 116 1.942 4.509 2.779 940 HD11 ILE 116 3HD1 ILE 116 2.006 2.796 5.326 941 HD12 ILE 116 1HD1 ILE 116 3.569 2.049 5.636 942 HD13 ILE 116 2HD1 ILE 116 2.176 1.042 5.238 943 H ASP 117 H ASP 117 6.458 3.844 2.876 944 HA ASP 117 HA ASP 117 6.455 6.670 2.421 945 HB2 ASP 117 2HB ASP 117 7.374 5.660 4.475 946 HB3 ASP 117 1HB ASP 117 8.632 4.880 3.524 947 H SER 118 H SER 118 7.340 4.064 0.537 948 HA SER 118 HA SER 118 9.633 4.754 -0.811 949 HB2 SER 118 2HB SER 118 8.337 2.677 -1.182 950 HB3 SER 118 1HB SER 118 7.106 3.612 -2.028 951 HG SER 118 HG SER 118 9.837 3.448 -2.802 952 HA PRO 119 HA PRO 119 8.380 8.839 -2.077 953 HB2 PRO 119 2HB PRO 119 10.723 9.474 -3.348 954 HB3 PRO 119 1HB PRO 119 10.480 9.573 -1.601 955 HG2 PRO 119 2HG PRO 119 11.791 7.429 -3.216 956 HG3 PRO 119 1HG PRO 119 12.276 8.115 -1.653 957 HD2 PRO 119 2HD PRO 119 11.022 5.735 -1.855 958 HD3 PRO 119 1HD PRO 119 10.764 6.825 -0.478 959 H GLU 120 H GLU 120 10.201 6.899 -4.497 960 HA GLU 120 HA GLU 120 9.195 8.506 -6.633 961 HB2 GLU 120 2HB GLU 120 10.296 6.902 -8.136 962 HB3 GLU 120 1HB GLU 120 11.368 7.465 -6.868 963 HG2 GLU 120 2HG GLU 120 9.895 4.878 -6.592 964 HG3 GLU 120 1HG GLU 120 11.387 4.982 -7.523 965 H TYR 121 H TYR 121 8.254 5.443 -5.210 966 HA TYR 121 HA TYR 121 6.446 4.730 -7.286 967 HB2 TYR 121 2HB TYR 121 6.773 3.792 -4.441 968 HB3 TYR 121 1HB TYR 121 5.472 3.198 -5.470 969 HD1 TYR 121 HD1 TYR 121 9.179 3.551 -5.362 970 HD2 TYR 121 HD2 TYR 121 5.857 1.377 -6.885 971 HE1 TYR 121 HE1 TYR 121 10.715 1.886 -6.309 972 HE2 TYR 121 HE2 TYR 121 7.386 -0.300 -7.836 973 HH TYR 121 HH TYR 121 10.794 -0.314 -7.102 974 H THR 122 H THR 122 6.089 6.446 -4.209 975 HA THR 122 HA THR 122 3.291 6.649 -4.250 976 HB THR 122 HB THR 122 5.325 8.528 -3.028 977 HG1 THR 122 HG1 THR 122 5.544 6.731 -1.870 978 HG21 THR 122 3HG2 THR 122 3.497 9.297 -1.592 979 HG22 THR 122 1HG2 THR 122 2.363 8.273 -2.473 980 HG23 THR 122 2HG2 THR 122 3.146 9.626 -3.288 981 H ASN 123 H ASN 123 5.766 8.941 -5.431 982 HA ASN 123 HA ASN 123 3.844 10.858 -6.272 983 HB2 ASN 123 2HB ASN 123 6.777 10.537 -6.885 984 HB3 ASN 123 1HB ASN 123 5.811 11.848 -7.552 985 HD21 ASN 123 1HD2 ASN 123 7.299 10.531 -4.730 986 HD22 ASN 123 2HD2 ASN 123 7.073 11.913 -3.711 987 H SER 124 H SER 124 5.648 8.338 -8.006 988 HA SER 124 HA SER 124 4.633 9.237 -10.544 989 HB2 SER 124 2HB SER 124 6.900 8.229 -10.283 990 HB3 SER 124 1HB SER 124 6.131 6.682 -9.928 991 HG SER 124 HG SER 124 5.670 8.169 -12.306 992 H PHE 125 H PHE 125 4.017 6.405 -8.441 993 HA PHE 125 HA PHE 125 2.209 5.322 -10.423 994 HB2 PHE 125 2HB PHE 125 3.614 3.753 -9.259 995 HB3 PHE 125 1HB PHE 125 3.028 4.314 -7.697 996 HD1 PHE 125 HD2 PHE 125 1.866 2.725 -10.856 997 HD2 PHE 125 HD1 PHE 125 1.258 3.240 -6.676 998 HE1 PHE 125 HE2 PHE 125 0.090 1.022 -10.909 999 HE2 PHE 125 HE1 PHE 125 -0.511 1.536 -6.719 1000 HZ PHE 125 HZ PHE 125 -1.101 0.427 -8.837 1001 H GLY 126 H GLY 126 1.929 6.814 -7.203 1002 HA2 GLY 126 2HA GLY 126 -0.461 8.034 -7.559 1003 HA3 GLY 126 1HA GLY 126 -0.931 6.385 -7.184 1004 H ASP 127 H ASP 127 -0.755 9.264 -5.880 1005 HA ASP 127 HA ASP 127 0.298 8.467 -3.274 1006 HB2 ASP 127 2HB ASP 127 -0.392 10.964 -2.782 1007 HB3 ASP 127 1HB ASP 127 1.072 10.608 -3.691 1008 H TRP 128 H TRP 128 -2.665 9.925 -4.610 1009 HA TRP 128 HA TRP 128 -4.193 8.762 -2.389 1010 HB2 TRP 128 2HB TRP 128 -4.892 10.847 -4.462 1011 HB3 TRP 128 1HB TRP 128 -6.074 10.161 -3.352 1012 HD1 TRP 128 HD1 TRP 128 -3.170 12.613 -3.499 1013 HE1 TRP 128 HE1 TRP 128 -3.110 13.971 -1.308 1014 HE3 TRP 128 HE3 TRP 128 -6.638 9.976 -0.819 1015 HZ2 TRP 128 HZ2 TRP 128 -4.366 13.916 1.222 1016 HZ3 TRP 128 HZ3 TRP 128 -7.149 10.692 1.477 1017 HH2 TRP 128 HH2 TRP 128 -6.034 12.622 2.475 1018 H VAL 129 H VAL 129 -3.038 7.390 -4.830 1019 HA VAL 129 HA VAL 129 -5.509 6.442 -6.103 1020 HB VAL 129 HB VAL 129 -2.637 6.082 -6.991 1021 HG11 VAL 129 1HG1 VAL 129 -5.212 5.371 -8.394 1022 HG12 VAL 129 2HG1 VAL 129 -4.041 4.234 -7.728 1023 HG13 VAL 129 3HG1 VAL 129 -3.596 5.260 -9.093 1024 HG21 VAL 129 3HG2 VAL 129 -3.208 7.668 -8.773 1025 HG22 VAL 129 1HG2 VAL 129 -3.360 8.397 -7.174 1026 HG23 VAL 129 2HG2 VAL 129 -4.803 7.892 -8.055 1027 H VAL 130 H VAL 130 -6.131 4.350 -5.984 1028 HA VAL 130 HA VAL 130 -4.839 2.656 -4.016 1029 HB VAL 130 HB VAL 130 -7.297 2.145 -5.707 1030 HG11 VAL 130 1HG1 VAL 130 -7.805 0.403 -4.045 1031 HG12 VAL 130 2HG1 VAL 130 -6.243 0.699 -3.282 1032 HG13 VAL 130 3HG1 VAL 130 -6.316 0.075 -4.931 1033 HG21 VAL 130 3HG2 VAL 130 -8.570 2.692 -3.682 1034 HG22 VAL 130 1HG2 VAL 130 -7.617 4.063 -4.249 1035 HG23 VAL 130 2HG2 VAL 130 -7.069 3.121 -2.862 1036 HA PRO 131 HA PRO 131 -2.087 0.764 -6.913 1037 HB2 PRO 131 2HB PRO 131 -2.008 -1.689 -5.536 1038 HB3 PRO 131 1HB PRO 131 -0.911 -0.322 -5.332 1039 HG2 PRO 131 2HG PRO 131 -3.295 -1.096 -3.722 1040 HG3 PRO 131 1HG PRO 131 -1.779 -0.336 -3.201 1041 HD2 PRO 131 2HD PRO 131 -4.035 1.079 -3.412 1042 HD3 PRO 131 1HD PRO 131 -2.465 1.779 -3.866 1043 H TYR 132 H TYR 132 -2.978 0.315 -8.803 1044 HA TYR 132 HA TYR 132 -4.747 -2.018 -9.026 1045 HB2 TYR 132 2HB TYR 132 -5.386 -1.134 -11.221 1046 HB3 TYR 132 1HB TYR 132 -5.644 0.079 -9.975 1047 HD1 TYR 132 HD2 TYR 132 -4.207 2.075 -9.868 1048 HD2 TYR 132 HD1 TYR 132 -3.735 -0.816 -12.954 1049 HE1 TYR 132 HE2 TYR 132 -2.871 3.683 -11.166 1050 HE2 TYR 132 HE1 TYR 132 -2.401 0.783 -14.259 1051 HH TYR 132 HH TYR 132 -1.337 3.828 -12.922 1052 H TYR 133 H TYR 133 -4.370 -3.342 -11.055 1053 HA TYR 133 HA TYR 133 -1.693 -4.244 -11.139 1054 HB2 TYR 133 2HB TYR 133 -3.413 -5.819 -11.633 1055 HB3 TYR 133 1HB TYR 133 -4.072 -4.801 -12.907 1056 HD1 TYR 133 HD1 TYR 133 -0.909 -6.603 -12.029 1057 HD2 TYR 133 HD2 TYR 133 -3.555 -5.305 -15.094 1058 HE1 TYR 133 HE1 TYR 133 0.437 -7.812 -13.698 1059 HE2 TYR 133 HE2 TYR 133 -2.224 -6.511 -16.767 1060 HH TYR 133 HH TYR 133 -0.024 -7.388 -17.088 1061 H ARG 134 H ARG 134 -0.195 -2.819 -11.762 1062 HA ARG 134 HA ARG 134 -0.591 -1.376 -14.277 1063 HB2 ARG 134 2HB ARG 134 0.193 -0.070 -12.333 1064 HB3 ARG 134 1HB ARG 134 1.609 -1.106 -12.212 1065 HG2 ARG 134 2HG ARG 134 2.197 0.961 -13.295 1066 HG3 ARG 134 1HG ARG 134 2.313 -0.367 -14.452 1067 HD2 ARG 134 2HD ARG 134 -0.049 0.255 -15.158 1068 HD3 ARG 134 1HD ARG 134 0.177 1.735 -14.227 1069 HE ARG 134 HE ARG 134 2.140 1.078 -16.293 1070 HH11 ARG 134 1HH1 ARG 134 -0.510 3.091 -15.194 1071 HH12 ARG 134 2HH1 ARG 134 -0.264 4.298 -16.425 1072 HH21 ARG 134 1HH2 ARG 134 2.458 2.646 -17.910 1073 HH22 ARG 134 2HH2 ARG 134 1.435 4.051 -17.960 1074 H GLY 135 H GLY 135 -0.325 -3.019 -15.753 1075 HA2 GLY 135 2HA GLY 135 1.873 -4.834 -15.700 1076 HA3 GLY 135 1HA GLY 135 0.790 -4.555 -17.058 1077 H LEU 136 H LEU 136 3.914 -4.342 -16.074 1078 HA LEU 136 HA LEU 136 4.588 -1.969 -17.619 1079 HB2 LEU 136 2HB LEU 136 5.769 -2.409 -15.509 1080 HB3 LEU 136 1HB LEU 136 6.332 -3.945 -16.136 1081 HG LEU 136 HG LEU 136 7.619 -2.735 -17.870 1082 HD11 LEU 136 1HD1 LEU 136 7.967 -0.307 -17.589 1083 HD12 LEU 136 2HD1 LEU 136 6.689 -0.289 -16.373 1084 HD13 LEU 136 3HD1 LEU 136 6.312 -0.714 -18.042 1085 HD21 LEU 136 3HD2 LEU 136 9.358 -1.897 -16.357 1086 HD22 LEU 136 1HD2 LEU 136 8.692 -3.432 -15.799 1087 HD23 LEU 136 2HD2 LEU 136 8.204 -1.927 -15.022 1088 H GLU 137 H GLU 137 4.523 -2.244 -19.763 1089 HA GLU 137 HA GLU 137 4.907 -4.844 -20.911 1090 HB2 GLU 137 2HB GLU 137 4.569 -3.648 -23.101 1091 HB3 GLU 137 1HB GLU 137 3.236 -3.541 -21.965 1092 HG2 GLU 137 2HG GLU 137 5.295 -1.374 -22.248 1093 HG3 GLU 137 1HG GLU 137 3.844 -1.446 -23.245 1094 H HIS 138 H HIS 138 6.752 -5.711 -21.293 1095 HA HIS 138 HA HIS 138 9.245 -4.501 -21.256 1096 HB2 HIS 138 2HB HIS 138 9.958 -6.578 -22.626 1097 HB3 HIS 138 1HB HIS 138 9.285 -6.827 -21.021 1098 HD1 HIS 138 HD1 HIS 138 7.621 -8.634 -20.909 1099 HD2 HIS 138 HD2 HIS 138 7.751 -6.893 -24.694 1100 HE1 HIS 138 HE1 HIS 138 5.958 -9.905 -22.304 1101 HE2 HIS 138 HE2 HIS 138 5.975 -8.777 -24.555 1102 H HIS 139 H HIS 139 10.494 -3.490 -22.691 1103 HA HIS 139 HA HIS 139 9.442 -3.155 -25.416 1104 HB2 HIS 139 2HB HIS 139 10.150 -0.710 -25.213 1105 HB3 HIS 139 1HB HIS 139 8.688 -1.186 -24.360 1106 HD1 HIS 139 HD1 HIS 139 8.731 -1.119 -21.787 1107 HD2 HIS 139 HD2 HIS 139 12.327 0.008 -23.551 1108 HE1 HIS 139 HE1 HIS 139 10.087 -0.065 -19.949 1109 HE2 HIS 139 HE2 HIS 139 12.237 0.673 -21.046 1110 H HIS 140 H HIS 140 11.009 -2.337 -26.941 1111 HA HIS 140 HA HIS 140 13.686 -3.346 -26.316 1112 HB2 HIS 140 2HB HIS 140 13.848 -3.045 -28.966 1113 HB3 HIS 140 1HB HIS 140 13.181 -4.490 -28.227 1114 HD1 HIS 140 HD1 HIS 140 12.347 -1.766 -30.557 1115 HD2 HIS 140 HD2 HIS 140 10.291 -4.578 -28.273 1116 HE1 HIS 140 HE1 HIS 140 10.022 -1.854 -31.502 1117 HE2 HIS 140 HE2 HIS 140 8.882 -3.722 -30.258 1118 H HIS 141 H HIS 141 14.422 -1.590 -25.208 1119 HA HIS 141 HA HIS 141 15.207 0.484 -24.760 1120 HB2 HIS 141 2HB HIS 141 16.747 -0.372 -26.648 1121 HB3 HIS 141 1HB HIS 141 15.880 0.759 -27.682 1122 HD1 HIS 141 HD1 HIS 141 16.241 3.327 -27.190 1123 HD2 HIS 141 HD2 HIS 141 18.573 0.763 -24.897 1124 HE1 HIS 141 HE1 HIS 141 18.013 4.764 -26.162 1125 HE2 HIS 141 HE2 HIS 141 19.544 3.158 -24.983 1126 H HIS 142 H HIS 142 14.627 1.628 -27.966 1127 HA HIS 142 HA HIS 142 11.976 2.591 -27.476 1128 HB2 HIS 142 2HB HIS 142 13.600 4.246 -26.312 1129 HB3 HIS 142 1HB HIS 142 14.054 4.724 -27.945 1130 HD1 HIS 142 HD1 HIS 142 12.715 6.590 -28.889 1131 HD2 HIS 142 HD2 HIS 142 10.643 4.537 -25.925 1132 HE1 HIS 142 HE1 HIS 142 10.574 7.858 -28.557 1133 HE2 HIS 142 HE2 HIS 142 9.248 6.482 -26.919 1134 H HIS 143 H HIS 143 13.745 1.021 -29.300 1135 HA HIS 143 HA HIS 143 13.118 2.407 -31.823 1136 HB2 HIS 143 2HB HIS 143 15.360 0.498 -31.144 1137 HB3 HIS 143 1HB HIS 143 14.869 0.808 -32.802 1138 HD1 HIS 143 HD1 HIS 143 15.956 2.743 -33.928 1139 HD2 HIS 143 HD2 HIS 143 16.356 2.897 -29.792 1140 HE1 HIS 143 HE1 HIS 143 17.526 4.652 -33.468 1141 HE2 HIS 143 HE2 HIS 143 17.797 4.701 -30.967 Start of MODEL 2 1 H1 MET 1 1H MET 1 -10.512 1.070 -14.586 2 H2 MET 1 2H MET 1 -9.193 1.776 -15.374 3 H3 MET 1 3H MET 1 -10.762 2.008 -15.975 4 HA MET 1 HA MET 1 -10.058 3.979 -14.849 5 HB2 MET 1 2HB MET 1 -12.402 3.514 -14.631 6 HB3 MET 1 1HB MET 1 -12.111 2.329 -13.366 7 HG2 MET 1 2HG MET 1 -12.999 4.344 -12.405 8 HG3 MET 1 1HG MET 1 -11.330 4.124 -11.884 9 HE1 MET 1 3HE MET 1 -11.445 7.981 -12.015 10 HE2 MET 1 1HE MET 1 -10.910 6.565 -11.111 11 HE3 MET 1 2HE MET 1 -12.632 6.844 -11.377 12 HA PRO 2 HA PRO 2 -7.124 3.088 -11.528 13 HB2 PRO 2 2HB PRO 2 -6.606 5.958 -11.640 14 HB3 PRO 2 1HB PRO 2 -5.506 4.619 -11.973 15 HG2 PRO 2 2HG PRO 2 -6.439 6.285 -13.903 16 HG3 PRO 2 1HG PRO 2 -6.001 4.595 -14.207 17 HD2 PRO 2 2HD PRO 2 -8.703 5.822 -13.859 18 HD3 PRO 2 1HD PRO 2 -8.183 4.529 -14.960 19 H VAL 3 H VAL 3 -8.055 2.870 -9.582 20 HA VAL 3 HA VAL 3 -10.186 4.530 -8.698 21 HB VAL 3 HB VAL 3 -8.534 2.628 -7.027 22 HG11 VAL 3 1HG1 VAL 3 -9.935 4.159 -5.734 23 HG12 VAL 3 2HG1 VAL 3 -10.517 2.498 -5.617 24 HG13 VAL 3 3HG1 VAL 3 -11.346 3.652 -6.662 25 HG21 VAL 3 3HG2 VAL 3 -9.414 1.496 -9.008 26 HG22 VAL 3 1HG2 VAL 3 -11.035 2.070 -8.618 27 HG23 VAL 3 2HG2 VAL 3 -10.217 0.940 -7.539 28 H GLU 4 H GLU 4 -9.640 6.633 -8.447 29 HA GLU 4 HA GLU 4 -7.476 7.230 -6.545 30 HB2 GLU 4 2HB GLU 4 -7.154 9.353 -7.646 31 HB3 GLU 4 1HB GLU 4 -7.060 8.077 -8.850 32 HG2 GLU 4 2HG GLU 4 -9.232 8.589 -9.677 33 HG3 GLU 4 1HG GLU 4 -9.545 9.686 -8.334 34 H LEU 5 H LEU 5 -7.836 8.871 -5.033 35 HA LEU 5 HA LEU 5 -10.636 9.753 -4.769 36 HB2 LEU 5 2HB LEU 5 -9.647 8.165 -3.000 37 HB3 LEU 5 1HB LEU 5 -8.659 9.527 -2.509 38 HG LEU 5 HG LEU 5 -10.887 10.791 -2.212 39 HD11 LEU 5 1HD1 LEU 5 -12.819 9.404 -1.758 40 HD12 LEU 5 2HD1 LEU 5 -11.907 7.958 -2.196 41 HD13 LEU 5 3HD1 LEU 5 -12.269 9.178 -3.419 42 HD21 LEU 5 3HD2 LEU 5 -11.142 9.884 0.038 43 HD22 LEU 5 1HD2 LEU 5 -9.443 10.091 -0.384 44 HD23 LEU 5 2HD2 LEU 5 -10.167 8.483 -0.413 45 H ARG 6 H ARG 6 -10.514 11.735 -5.730 46 HA ARG 6 HA ARG 6 -8.203 13.405 -5.251 47 HB2 ARG 6 2HB ARG 6 -9.221 14.966 -6.837 48 HB3 ARG 6 1HB ARG 6 -9.108 13.346 -7.500 49 HG2 ARG 6 2HG ARG 6 -11.528 13.044 -6.903 50 HG3 ARG 6 1HG ARG 6 -11.566 14.767 -6.513 51 HD2 ARG 6 2HD ARG 6 -10.664 15.191 -8.831 52 HD3 ARG 6 1HD ARG 6 -10.955 13.488 -9.173 53 HE ARG 6 HE ARG 6 -13.202 15.113 -8.234 54 HH11 ARG 6 1HH1 ARG 6 -11.587 13.459 -10.870 55 HH12 ARG 6 2HH1 ARG 6 -12.958 13.543 -11.934 56 HH21 ARG 6 1HH2 ARG 6 -15.004 15.231 -9.636 57 HH22 ARG 6 2HH2 ARG 6 -14.908 14.550 -11.234 58 H ALA 7 H ALA 7 -8.640 15.790 -4.706 59 HA ALA 7 HA ALA 7 -9.508 15.571 -1.985 60 HB1 ALA 7 3HB ALA 7 -8.481 18.014 -3.405 61 HB2 ALA 7 1HB ALA 7 -7.461 16.757 -2.700 62 HB3 ALA 7 2HB ALA 7 -8.518 17.718 -1.666 63 H ASN 8 H ASN 8 -11.668 15.422 -3.836 64 HA ASN 8 HA ASN 8 -13.515 16.922 -2.325 65 HB2 ASN 8 2HB ASN 8 -12.779 18.724 -3.918 66 HB3 ASN 8 1HB ASN 8 -13.354 17.718 -5.246 67 HD21 ASN 8 1HD2 ASN 8 -14.294 19.578 -2.438 68 HD22 ASN 8 2HD2 ASN 8 -15.962 19.756 -2.882 69 H TRP 9 H TRP 9 -14.065 14.722 -2.031 70 HA TRP 9 HA TRP 9 -14.999 13.310 -4.432 71 HB2 TRP 9 2HB TRP 9 -14.434 11.242 -3.233 72 HB3 TRP 9 1HB TRP 9 -13.034 12.307 -3.317 73 HD1 TRP 9 HD1 TRP 9 -15.783 11.315 -0.811 74 HE1 TRP 9 HE1 TRP 9 -14.850 11.494 1.574 75 HE3 TRP 9 HE3 TRP 9 -11.168 13.169 -1.910 76 HZ2 TRP 9 HZ2 TRP 9 -12.463 12.293 2.820 77 HZ3 TRP 9 HZ3 TRP 9 -9.612 13.593 -0.059 78 HH2 TRP 9 HH2 TRP 9 -10.244 13.169 2.256 79 H SER 10 H SER 10 -16.763 11.752 -4.066 80 HA SER 10 HA SER 10 -18.633 12.622 -1.983 81 HB2 SER 10 2HB SER 10 -19.069 10.648 -4.245 82 HB3 SER 10 1HB SER 10 -20.307 11.354 -3.204 83 HG SER 10 HG SER 10 -18.621 13.025 -4.702 84 H GLU 11 H GLU 11 -19.677 10.883 -0.670 85 HA GLU 11 HA GLU 11 -17.672 9.209 0.446 86 HB2 GLU 11 2HB GLU 11 -20.658 9.096 0.891 87 HB3 GLU 11 1HB GLU 11 -19.427 8.364 1.913 88 HG2 GLU 11 2HG GLU 11 -18.506 10.697 2.241 89 HG3 GLU 11 1HG GLU 11 -19.989 11.281 1.490 90 H GLU 12 H GLU 12 -20.095 8.765 -1.979 91 HA GLU 12 HA GLU 12 -20.048 5.958 -2.181 92 HB2 GLU 12 2HB GLU 12 -20.406 7.972 -4.415 93 HB3 GLU 12 1HB GLU 12 -20.896 6.285 -4.450 94 HG2 GLU 12 2HG GLU 12 -22.894 7.254 -3.987 95 HG3 GLU 12 1HG GLU 12 -22.307 6.996 -2.346 96 H ASP 13 H ASP 13 -17.988 8.482 -3.524 97 HA ASP 13 HA ASP 13 -16.358 6.778 -5.109 98 HB2 ASP 13 2HB ASP 13 -15.691 9.467 -3.876 99 HB3 ASP 13 1HB ASP 13 -14.730 8.652 -5.102 100 H LEU 14 H LEU 14 -16.193 7.995 -1.812 101 HA LEU 14 HA LEU 14 -13.722 6.926 -1.054 102 HB2 LEU 14 2HB LEU 14 -15.575 8.431 0.177 103 HB3 LEU 14 1HB LEU 14 -15.965 6.884 0.900 104 HG LEU 14 HG LEU 14 -14.508 8.041 2.388 105 HD11 LEU 14 1HD1 LEU 14 -12.615 6.542 2.576 106 HD12 LEU 14 2HD1 LEU 14 -12.881 5.973 0.928 107 HD13 LEU 14 3HD1 LEU 14 -14.079 5.643 2.179 108 HD21 LEU 14 3HD2 LEU 14 -12.596 8.354 0.083 109 HD22 LEU 14 1HD2 LEU 14 -12.304 8.846 1.751 110 HD23 LEU 14 2HD2 LEU 14 -13.567 9.637 0.808 111 H GLU 15 H GLU 15 -16.996 5.532 -0.870 112 HA GLU 15 HA GLU 15 -16.310 3.041 0.191 113 HB2 GLU 15 2HB GLU 15 -18.623 4.260 -0.972 114 HB3 GLU 15 1HB GLU 15 -18.424 2.654 -1.657 115 HG2 GLU 15 2HG GLU 15 -18.517 3.283 1.283 116 HG3 GLU 15 1HG GLU 15 -19.867 2.673 0.327 117 H THR 16 H THR 16 -16.351 4.178 -3.147 118 HA THR 16 HA THR 16 -15.772 1.757 -4.434 119 HB THR 16 HB THR 16 -14.861 4.530 -5.251 120 HG1 THR 16 HG1 THR 16 -17.149 4.397 -4.941 121 HG21 THR 16 3HG2 THR 16 -15.331 2.039 -6.897 122 HG22 THR 16 1HG2 THR 16 -13.756 2.731 -6.499 123 HG23 THR 16 2HG2 THR 16 -14.880 3.625 -7.524 124 H VAL 17 H VAL 17 -13.618 4.267 -3.122 125 HA VAL 17 HA VAL 17 -11.168 3.025 -3.714 126 HB VAL 17 HB VAL 17 -11.910 4.896 -1.458 127 HG11 VAL 17 1HG1 VAL 17 -9.167 4.081 -2.413 128 HG12 VAL 17 2HG1 VAL 17 -9.890 3.690 -0.853 129 HG13 VAL 17 3HG1 VAL 17 -9.509 5.364 -1.253 130 HG21 VAL 17 3HG2 VAL 17 -10.880 6.608 -2.863 131 HG22 VAL 17 1HG2 VAL 17 -12.224 5.821 -3.691 132 HG23 VAL 17 2HG2 VAL 17 -10.563 5.398 -4.108 133 H ILE 18 H ILE 18 -13.182 2.892 -0.799 134 HA ILE 18 HA ILE 18 -11.645 1.176 0.755 135 HB ILE 18 HB ILE 18 -14.650 1.432 0.576 136 HG12 ILE 18 2HG1 ILE 18 -12.683 2.582 2.563 137 HG13 ILE 18 1HG1 ILE 18 -13.377 3.470 1.211 138 HG21 ILE 18 1HG2 ILE 18 -13.011 0.112 2.733 139 HG22 ILE 18 2HG2 ILE 18 -14.055 -0.716 1.575 140 HG23 ILE 18 3HG2 ILE 18 -14.755 0.378 2.769 141 HD11 ILE 18 3HD1 ILE 18 -15.603 3.183 2.168 142 HD12 ILE 18 1HD1 ILE 18 -14.511 3.998 3.289 143 HD13 ILE 18 2HD1 ILE 18 -14.906 2.295 3.523 144 H ARG 19 H ARG 19 -14.254 0.353 -1.510 145 HA ARG 19 HA ARG 19 -14.080 -2.437 -1.210 146 HB2 ARG 19 2HB ARG 19 -15.169 -0.700 -3.420 147 HB3 ARG 19 1HB ARG 19 -15.296 -2.454 -3.442 148 HG2 ARG 19 2HG ARG 19 -16.721 -2.492 -1.590 149 HG3 ARG 19 1HG ARG 19 -16.297 -0.845 -1.120 150 HD2 ARG 19 2HD ARG 19 -18.547 -1.029 -2.131 151 HD3 ARG 19 1HD ARG 19 -17.474 0.058 -3.007 152 HE ARG 19 HE ARG 19 -17.114 -2.022 -4.497 153 HH11 ARG 19 1HH1 ARG 19 -20.098 -1.198 -2.870 154 HH12 ARG 19 2HH1 ARG 19 -21.118 -1.902 -4.090 155 HH21 ARG 19 1HH2 ARG 19 -18.438 -2.925 -6.133 156 HH22 ARG 19 2HH2 ARG 19 -20.169 -2.854 -5.979 157 H ALA 20 H ALA 20 -12.224 -0.205 -3.135 158 HA ALA 20 HA ALA 20 -11.123 -2.201 -4.876 159 HB1 ALA 20 3HB ALA 20 -11.294 0.130 -5.583 160 HB2 ALA 20 1HB ALA 20 -9.621 -0.429 -5.629 161 HB3 ALA 20 2HB ALA 20 -10.171 0.604 -4.308 162 H VAL 21 H VAL 21 -10.152 -0.650 -1.864 163 HA VAL 21 HA VAL 21 -7.522 -1.766 -1.829 164 HB VAL 21 HB VAL 21 -9.164 -0.672 0.464 165 HG11 VAL 21 1HG1 VAL 21 -7.373 -2.124 1.254 166 HG12 VAL 21 2HG1 VAL 21 -7.022 -0.437 1.629 167 HG13 VAL 21 3HG1 VAL 21 -6.204 -1.228 0.282 168 HG21 VAL 21 3HG2 VAL 21 -7.831 1.362 0.159 169 HG22 VAL 21 1HG2 VAL 21 -8.785 0.986 -1.276 170 HG23 VAL 21 2HG2 VAL 21 -7.055 0.636 -1.250 171 H TYR 22 H TYR 22 -10.558 -2.596 -0.170 172 HA TYR 22 HA TYR 22 -9.470 -4.940 1.066 173 HB2 TYR 22 2HB TYR 22 -12.306 -3.985 0.669 174 HB3 TYR 22 1HB TYR 22 -11.907 -5.474 1.514 175 HD1 TYR 22 HD2 TYR 22 -11.814 -1.818 1.652 176 HD2 TYR 22 HD1 TYR 22 -10.929 -5.415 3.738 177 HE1 TYR 22 HE2 TYR 22 -11.580 -0.542 3.735 178 HE2 TYR 22 HE1 TYR 22 -10.699 -4.145 5.834 179 HH TYR 22 HH TYR 22 -11.782 -0.966 6.175 180 H ARG 23 H ARG 23 -10.889 -4.224 -1.994 181 HA ARG 23 HA ARG 23 -11.383 -5.449 -3.839 182 HB2 ARG 23 2HB ARG 23 -9.627 -7.515 -2.494 183 HB3 ARG 23 1HB ARG 23 -10.142 -7.562 -4.177 184 HG2 ARG 23 2HG ARG 23 -8.927 -5.528 -4.647 185 HG3 ARG 23 1HG ARG 23 -8.484 -5.370 -2.947 186 HD2 ARG 23 2HD ARG 23 -7.256 -7.495 -3.094 187 HD3 ARG 23 1HD ARG 23 -7.661 -7.592 -4.808 188 HE ARG 23 HE ARG 23 -6.471 -5.162 -4.553 189 HH11 ARG 23 1HH1 ARG 23 -5.543 -8.425 -3.708 190 HH12 ARG 23 2HH1 ARG 23 -3.841 -8.139 -3.924 191 HH21 ARG 23 1HH2 ARG 23 -4.244 -4.767 -4.853 192 HH22 ARG 23 2HH2 ARG 23 -3.099 -6.048 -4.612 193 H GLN 24 H GLN 24 -13.130 -5.477 -1.619 194 HA GLN 24 HA GLN 24 -14.060 -8.150 -1.150 195 HB2 GLN 24 2HB GLN 24 -14.165 -6.478 0.618 196 HB3 GLN 24 1HB GLN 24 -15.207 -5.461 -0.366 197 HG2 GLN 24 2HG GLN 24 -16.448 -6.642 1.367 198 HG3 GLN 24 1HG GLN 24 -16.975 -7.107 -0.249 199 HE21 GLN 24 1HE2 GLN 24 -17.847 -9.028 0.482 200 HE22 GLN 24 2HE2 GLN 24 -16.863 -10.368 0.975 201 H VAL 25 H VAL 25 -14.407 -8.640 -3.427 202 HA VAL 25 HA VAL 25 -16.919 -7.632 -4.523 203 HB VAL 25 HB VAL 25 -14.991 -8.035 -6.040 204 HG11 VAL 25 1HG1 VAL 25 -15.402 -10.939 -5.350 205 HG12 VAL 25 2HG1 VAL 25 -14.008 -9.949 -4.912 206 HG13 VAL 25 3HG1 VAL 25 -14.333 -10.318 -6.607 207 HG21 VAL 25 3HG2 VAL 25 -16.214 -9.262 -7.782 208 HG22 VAL 25 1HG2 VAL 25 -17.238 -8.083 -6.960 209 HG23 VAL 25 2HG2 VAL 25 -17.380 -9.797 -6.572 210 H LEU 26 H LEU 26 -15.692 -10.100 -2.582 211 HA LEU 26 HA LEU 26 -18.192 -11.196 -1.917 212 HB2 LEU 26 2HB LEU 26 -17.719 -12.248 -4.221 213 HB3 LEU 26 1HB LEU 26 -16.431 -13.130 -3.428 214 HG LEU 26 HG LEU 26 -18.579 -14.401 -3.741 215 HD11 LEU 26 1HD1 LEU 26 -18.579 -15.413 -1.519 216 HD12 LEU 26 2HD1 LEU 26 -17.640 -14.056 -0.899 217 HD13 LEU 26 3HD1 LEU 26 -16.938 -15.135 -2.106 218 HD21 LEU 26 3HD2 LEU 26 -20.128 -12.577 -3.274 219 HD22 LEU 26 1HD2 LEU 26 -19.575 -12.525 -1.601 220 HD23 LEU 26 2HD2 LEU 26 -20.423 -13.948 -2.206 221 H GLY 27 H GLY 27 -14.723 -11.801 -2.217 222 HA2 GLY 27 2HA GLY 27 -13.181 -11.951 -0.478 223 HA3 GLY 27 1HA GLY 27 -14.512 -12.036 0.668 224 H ASN 28 H ASN 28 -15.364 -13.992 1.231 225 HA ASN 28 HA ASN 28 -14.497 -16.403 -0.110 226 HB2 ASN 28 2HB ASN 28 -12.659 -15.857 1.529 227 HB3 ASN 28 1HB ASN 28 -13.842 -16.021 2.821 228 HD21 ASN 28 1HD2 ASN 28 -13.613 -18.001 -0.095 229 HD22 ASN 28 2HD2 ASN 28 -13.230 -19.478 0.731 230 H ASP 29 H ASP 29 -15.756 -18.223 0.484 231 HA ASP 29 HA ASP 29 -18.376 -17.560 1.513 232 HB2 ASP 29 2HB ASP 29 -18.888 -19.947 0.944 233 HB3 ASP 29 1HB ASP 29 -18.287 -19.000 -0.410 234 H TYR 30 H TYR 30 -16.670 -17.122 3.496 235 HA TYR 30 HA TYR 30 -17.263 -19.242 5.430 236 HB2 TYR 30 2HB TYR 30 -14.897 -19.463 4.579 237 HB3 TYR 30 1HB TYR 30 -14.574 -17.859 5.218 238 HD1 TYR 30 HD1 TYR 30 -15.846 -21.194 6.335 239 HD2 TYR 30 HD2 TYR 30 -13.670 -17.676 7.334 240 HE1 TYR 30 HE1 TYR 30 -15.224 -22.197 8.495 241 HE2 TYR 30 HE2 TYR 30 -13.046 -18.667 9.493 242 HH TYR 30 HH TYR 30 -13.426 -21.953 10.192 243 H VAL 31 H VAL 31 -16.906 -18.338 7.716 244 HA VAL 31 HA VAL 31 -18.439 -16.027 8.066 245 HB VAL 31 HB VAL 31 -16.478 -17.130 10.085 246 HG11 VAL 31 1HG1 VAL 31 -18.072 -16.257 11.727 247 HG12 VAL 31 2HG1 VAL 31 -19.068 -15.620 10.419 248 HG13 VAL 31 3HG1 VAL 31 -17.447 -14.980 10.686 249 HG21 VAL 31 3HG2 VAL 31 -19.303 -18.026 9.517 250 HG22 VAL 31 1HG2 VAL 31 -18.319 -18.546 10.886 251 HG23 VAL 31 2HG2 VAL 31 -17.832 -18.961 9.242 252 H MET 32 H MET 32 -15.138 -16.240 9.344 253 HA MET 32 HA MET 32 -13.286 -14.953 9.121 254 HB2 MET 32 2HB MET 32 -13.640 -14.961 6.715 255 HB3 MET 32 1HB MET 32 -14.782 -13.633 6.852 256 HG2 MET 32 2HG MET 32 -13.035 -12.131 7.543 257 HG3 MET 32 1HG MET 32 -11.871 -13.454 7.601 258 HE1 MET 32 3HE MET 32 -13.780 -11.906 3.691 259 HE2 MET 32 1HE MET 32 -14.194 -11.301 5.295 260 HE3 MET 32 2HE MET 32 -14.642 -12.941 4.830 261 H ALA 33 H ALA 33 -16.373 -13.332 9.224 262 HA ALA 33 HA ALA 33 -17.190 -11.686 10.550 263 HB1 ALA 33 3HB ALA 33 -15.847 -12.647 12.366 264 HB2 ALA 33 1HB ALA 33 -15.964 -10.892 12.485 265 HB3 ALA 33 2HB ALA 33 -14.484 -11.639 11.879 266 H SER 34 H SER 34 -17.056 -9.341 10.901 267 HA SER 34 HA SER 34 -15.613 -8.064 8.704 268 HB2 SER 34 2HB SER 34 -17.743 -6.947 10.548 269 HB3 SER 34 1HB SER 34 -17.068 -6.128 9.142 270 HG SER 34 HG SER 34 -18.446 -8.619 9.062 271 H GLU 35 H GLU 35 -13.970 -6.629 9.003 272 HA GLU 35 HA GLU 35 -12.763 -6.691 11.627 273 HB2 GLU 35 2HB GLU 35 -11.444 -7.066 9.546 274 HB3 GLU 35 1HB GLU 35 -11.747 -5.396 9.092 275 HG2 GLU 35 2HG GLU 35 -9.515 -5.801 10.101 276 HG3 GLU 35 1HG GLU 35 -10.478 -4.580 10.932 277 H ARG 36 H ARG 36 -11.916 -4.770 12.637 278 HA ARG 36 HA ARG 36 -14.020 -2.751 12.709 279 HB2 ARG 36 2HB ARG 36 -11.791 -3.509 14.595 280 HB3 ARG 36 1HB ARG 36 -12.760 -2.063 14.832 281 HG2 ARG 36 2HG ARG 36 -13.633 -3.796 16.215 282 HG3 ARG 36 1HG ARG 36 -14.783 -3.490 14.917 283 HD2 ARG 36 2HD ARG 36 -14.537 -5.880 15.337 284 HD3 ARG 36 1HD ARG 36 -13.976 -5.455 13.721 285 HE ARG 36 HE ARG 36 -11.728 -5.801 14.439 286 HH11 ARG 36 1HH1 ARG 36 -14.156 -6.705 16.806 287 HH12 ARG 36 2HH1 ARG 36 -13.065 -7.695 17.735 288 HH21 ARG 36 1HH2 ARG 36 -10.301 -7.120 15.643 289 HH22 ARG 36 2HH2 ARG 36 -10.879 -7.933 17.066 290 H LEU 37 H LEU 37 -12.162 -2.665 10.505 291 HA LEU 37 HA LEU 37 -10.300 -0.522 11.111 292 HB2 LEU 37 2HB LEU 37 -10.951 -1.952 8.536 293 HB3 LEU 37 1HB LEU 37 -9.751 -0.682 8.674 294 HG LEU 37 HG LEU 37 -9.666 -3.366 10.051 295 HD11 LEU 37 1HD1 LEU 37 -7.702 -3.727 8.600 296 HD12 LEU 37 2HD1 LEU 37 -8.062 -2.209 7.777 297 HD13 LEU 37 3HD1 LEU 37 -9.206 -3.551 7.696 298 HD21 LEU 37 3HD2 LEU 37 -7.421 -2.687 10.782 299 HD22 LEU 37 1HD2 LEU 37 -8.677 -1.647 11.454 300 HD23 LEU 37 2HD2 LEU 37 -7.695 -1.083 10.104 301 H VAL 38 H VAL 38 -13.455 -0.482 10.861 302 HA VAL 38 HA VAL 38 -14.128 1.370 8.888 303 HB VAL 38 HB VAL 38 -15.800 0.083 10.141 304 HG11 VAL 38 1HG1 VAL 38 -16.484 0.782 12.391 305 HG12 VAL 38 2HG1 VAL 38 -15.130 1.910 12.441 306 HG13 VAL 38 3HG1 VAL 38 -14.831 0.175 12.353 307 HG21 VAL 38 3HG2 VAL 38 -16.154 3.074 10.317 308 HG22 VAL 38 1HG2 VAL 38 -17.456 1.889 10.458 309 HG23 VAL 38 2HG2 VAL 38 -16.557 2.036 8.949 310 H SER 39 H SER 39 -12.557 1.813 11.958 311 HA SER 39 HA SER 39 -12.916 4.564 12.323 312 HB2 SER 39 2HB SER 39 -10.461 2.915 12.976 313 HB3 SER 39 1HB SER 39 -10.902 4.461 13.700 314 HG SER 39 HG SER 39 -11.981 3.343 15.097 315 H ALA 40 H ALA 40 -10.400 2.780 10.553 316 HA ALA 40 HA ALA 40 -8.982 5.071 9.668 317 HB1 ALA 40 3HB ALA 40 -9.072 2.282 8.513 318 HB2 ALA 40 1HB ALA 40 -7.941 2.873 9.731 319 HB3 ALA 40 2HB ALA 40 -7.893 3.524 8.092 320 H GLU 41 H GLU 41 -11.522 3.076 8.254 321 HA GLU 41 HA GLU 41 -11.704 4.311 5.759 322 HB2 GLU 41 2HB GLU 41 -13.843 3.013 7.451 323 HB3 GLU 41 1HB GLU 41 -14.066 3.482 5.771 324 HG2 GLU 41 2HG GLU 41 -12.343 1.944 5.070 325 HG3 GLU 41 1HG GLU 41 -11.997 1.525 6.746 326 H SER 42 H SER 42 -13.203 5.158 8.849 327 HA SER 42 HA SER 42 -14.783 7.278 7.827 328 HB2 SER 42 2HB SER 42 -13.782 6.809 10.645 329 HB3 SER 42 1HB SER 42 -15.074 7.917 10.184 330 HG SER 42 HG SER 42 -15.044 5.086 9.967 331 H LEU 43 H LEU 43 -11.566 7.175 9.336 332 HA LEU 43 HA LEU 43 -11.121 9.949 9.419 333 HB2 LEU 43 2HB LEU 43 -9.137 7.695 9.108 334 HB3 LEU 43 1HB LEU 43 -8.709 9.357 9.465 335 HG LEU 43 HG LEU 43 -10.357 7.556 11.239 336 HD11 LEU 43 1HD1 LEU 43 -8.400 7.620 12.714 337 HD12 LEU 43 2HD1 LEU 43 -7.517 8.537 11.494 338 HD13 LEU 43 3HD1 LEU 43 -8.022 6.881 11.158 339 HD21 LEU 43 3HD2 LEU 43 -10.163 9.352 12.884 340 HD22 LEU 43 1HD2 LEU 43 -10.995 9.911 11.434 341 HD23 LEU 43 2HD2 LEU 43 -9.309 10.347 11.705 342 H LEU 44 H LEU 44 -10.592 7.565 6.880 343 HA LEU 44 HA LEU 44 -9.348 9.380 5.064 344 HB2 LEU 44 2HB LEU 44 -9.034 6.967 4.878 345 HB3 LEU 44 1HB LEU 44 -10.748 6.746 4.584 346 HG LEU 44 HG LEU 44 -10.511 8.037 2.471 347 HD11 LEU 44 1HD1 LEU 44 -8.265 8.419 1.577 348 HD12 LEU 44 2HD1 LEU 44 -7.568 7.890 3.108 349 HD13 LEU 44 3HD1 LEU 44 -8.553 9.353 3.045 350 HD21 LEU 44 3HD2 LEU 44 -10.475 5.614 2.433 351 HD22 LEU 44 1HD2 LEU 44 -8.739 5.615 2.753 352 HD23 LEU 44 2HD2 LEU 44 -9.357 6.262 1.233 353 H ARG 45 H ARG 45 -12.650 8.289 5.624 354 HA ARG 45 HA ARG 45 -13.743 9.441 3.271 355 HB2 ARG 45 2HB ARG 45 -14.714 7.576 4.770 356 HB3 ARG 45 1HB ARG 45 -15.323 8.884 5.772 357 HG2 ARG 45 2HG ARG 45 -16.600 9.755 3.897 358 HG3 ARG 45 1HG ARG 45 -15.947 8.489 2.855 359 HD2 ARG 45 2HD ARG 45 -17.983 7.592 3.442 360 HD3 ARG 45 1HD ARG 45 -16.923 6.890 4.665 361 HE ARG 45 HE ARG 45 -18.548 9.303 5.185 362 HH11 ARG 45 1HH1 ARG 45 -17.433 6.095 6.076 363 HH12 ARG 45 2HH1 ARG 45 -18.301 6.081 7.580 364 HH21 ARG 45 1HH2 ARG 45 -19.660 9.291 7.173 365 HH22 ARG 45 2HH2 ARG 45 -19.578 7.895 8.207 366 H ASN 46 H ASN 46 -13.247 10.617 6.528 367 HA ASN 46 HA ASN 46 -14.851 12.978 6.131 368 HB2 ASN 46 2HB ASN 46 -14.450 11.826 8.366 369 HB3 ASN 46 1HB ASN 46 -12.829 12.512 8.329 370 HD21 ASN 46 1HD2 ASN 46 -12.552 14.695 8.680 371 HD22 ASN 46 2HD2 ASN 46 -13.823 15.719 9.247 372 H GLY 47 H GLY 47 -11.577 12.042 5.597 373 HA2 GLY 47 2HA GLY 47 -10.152 13.241 4.141 374 HA3 GLY 47 1HA GLY 47 -11.058 14.703 4.502 375 H LYS 48 H LYS 48 -9.340 12.303 6.500 376 HA LYS 48 HA LYS 48 -7.808 14.543 7.638 377 HB2 LYS 48 2HB LYS 48 -9.299 13.504 9.281 378 HB3 LYS 48 1HB LYS 48 -8.586 11.931 8.950 379 HG2 LYS 48 2HG LYS 48 -6.478 12.631 9.861 380 HG3 LYS 48 1HG LYS 48 -7.064 14.283 10.049 381 HD2 LYS 48 2HD LYS 48 -8.266 11.893 11.442 382 HD3 LYS 48 1HD LYS 48 -7.049 12.949 12.161 383 HE2 LYS 48 2HE LYS 48 -9.769 13.823 11.187 384 HE3 LYS 48 1HE LYS 48 -9.331 13.534 12.869 385 HZ1 LYS 48 3HZ LYS 48 -7.629 15.295 12.629 386 HZ2 LYS 48 1HZ LYS 48 -9.215 15.864 12.427 387 HZ3 LYS 48 2HZ LYS 48 -8.223 15.627 11.077 388 H ILE 49 H ILE 49 -7.639 11.096 6.804 389 HA ILE 49 HA ILE 49 -4.719 11.362 6.591 390 HB ILE 49 HB ILE 49 -4.619 8.908 6.645 391 HG12 ILE 49 2HG1 ILE 49 -7.609 9.035 7.128 392 HG13 ILE 49 1HG1 ILE 49 -6.850 8.488 5.635 393 HG21 ILE 49 1HG2 ILE 49 -5.243 8.607 8.993 394 HG22 ILE 49 2HG2 ILE 49 -6.196 10.090 8.931 395 HG23 ILE 49 3HG2 ILE 49 -4.445 10.158 8.731 396 HD11 ILE 49 3HD1 ILE 49 -6.599 7.191 8.340 397 HD12 ILE 49 1HD1 ILE 49 -5.800 6.648 6.864 398 HD13 ILE 49 2HD1 ILE 49 -7.558 6.609 6.980 399 H THR 50 H THR 50 -3.695 10.181 4.777 400 HA THR 50 HA THR 50 -5.149 10.697 2.320 401 HB THR 50 HB THR 50 -3.022 10.206 1.194 402 HG1 THR 50 HG1 THR 50 -1.173 9.930 2.794 403 HG21 THR 50 3HG2 THR 50 -3.390 12.472 2.023 404 HG22 THR 50 1HG2 THR 50 -1.686 12.036 2.134 405 HG23 THR 50 2HG2 THR 50 -2.694 12.026 3.580 406 H VAL 51 H VAL 51 -4.731 8.985 0.512 407 HA VAL 51 HA VAL 51 -5.959 6.552 1.277 408 HB VAL 51 HB VAL 51 -4.480 7.236 -1.274 409 HG11 VAL 51 1HG1 VAL 51 -5.749 5.366 -2.267 410 HG12 VAL 51 2HG1 VAL 51 -6.343 4.941 -0.661 411 HG13 VAL 51 3HG1 VAL 51 -4.621 4.831 -1.022 412 HG21 VAL 51 3HG2 VAL 51 -6.716 7.614 -2.193 413 HG22 VAL 51 1HG2 VAL 51 -6.382 8.695 -0.842 414 HG23 VAL 51 2HG2 VAL 51 -7.421 7.290 -0.611 415 H ARG 52 H ARG 52 -2.619 7.511 0.683 416 HA ARG 52 HA ARG 52 -1.427 4.984 0.883 417 HB2 ARG 52 2HB ARG 52 -0.035 6.706 0.099 418 HB3 ARG 52 1HB ARG 52 -0.429 7.765 1.446 419 HG2 ARG 52 2HG ARG 52 0.985 6.655 2.904 420 HG3 ARG 52 1HG ARG 52 1.000 5.187 1.928 421 HD2 ARG 52 2HD ARG 52 3.127 6.469 1.863 422 HD3 ARG 52 1HD ARG 52 2.393 6.216 0.283 423 HE ARG 52 HE ARG 52 1.511 8.587 0.599 424 HH11 ARG 52 1HH1 ARG 52 4.529 7.440 1.976 425 HH12 ARG 52 2HH1 ARG 52 5.276 9.008 1.945 426 HH21 ARG 52 1HH2 ARG 52 2.507 10.627 0.521 427 HH22 ARG 52 2HH2 ARG 52 4.138 10.814 1.101 428 H GLU 53 H GLU 53 -2.276 7.337 3.402 429 HA GLU 53 HA GLU 53 -1.232 5.909 5.591 430 HB2 GLU 53 2HB GLU 53 -3.532 7.858 5.413 431 HB3 GLU 53 1HB GLU 53 -2.905 7.231 6.931 432 HG2 GLU 53 2HG GLU 53 -1.287 8.775 4.919 433 HG3 GLU 53 1HG GLU 53 -2.043 9.469 6.354 434 H PHE 54 H PHE 54 -4.341 5.770 3.954 435 HA PHE 54 HA PHE 54 -5.606 3.977 5.734 436 HB2 PHE 54 2HB PHE 54 -6.838 5.343 4.094 437 HB3 PHE 54 1HB PHE 54 -6.103 4.433 2.780 438 HD1 PHE 54 HD1 PHE 54 -8.273 4.045 5.767 439 HD2 PHE 54 HD2 PHE 54 -7.128 2.521 1.966 440 HE1 PHE 54 HE1 PHE 54 -10.126 2.432 5.862 441 HE2 PHE 54 HE2 PHE 54 -8.982 0.906 2.050 442 HZ PHE 54 HZ PHE 54 -10.485 0.862 4.003 443 H VAL 55 H VAL 55 -3.943 3.448 2.628 444 HA VAL 55 HA VAL 55 -4.149 0.661 2.572 445 HB VAL 55 HB VAL 55 -1.942 2.393 1.436 446 HG11 VAL 55 1HG1 VAL 55 -1.513 0.515 -0.083 447 HG12 VAL 55 2HG1 VAL 55 -2.700 -0.454 0.790 448 HG13 VAL 55 3HG1 VAL 55 -1.225 0.075 1.600 449 HG21 VAL 55 3HG2 VAL 55 -3.192 2.163 -0.675 450 HG22 VAL 55 1HG2 VAL 55 -4.119 3.004 0.566 451 HG23 VAL 55 2HG2 VAL 55 -4.471 1.316 0.193 452 H ARG 56 H ARG 56 -1.657 2.749 3.967 453 HA ARG 56 HA ARG 56 0.196 0.878 4.802 454 HB2 ARG 56 2HB ARG 56 0.585 3.261 5.004 455 HB3 ARG 56 1HB ARG 56 -0.720 3.413 6.171 456 HG2 ARG 56 2HG ARG 56 0.548 2.031 7.751 457 HG3 ARG 56 1HG ARG 56 1.863 1.919 6.582 458 HD2 ARG 56 2HD ARG 56 2.168 4.332 6.666 459 HD3 ARG 56 1HD ARG 56 0.813 4.478 7.785 460 HE ARG 56 HE ARG 56 2.189 3.130 9.361 461 HH11 ARG 56 1HH1 ARG 56 3.720 5.004 6.831 462 HH12 ARG 56 2HH1 ARG 56 5.258 5.065 7.638 463 HH21 ARG 56 1HH2 ARG 56 4.189 3.261 10.448 464 HH22 ARG 56 2HH2 ARG 56 5.513 4.103 9.702 465 H ALA 57 H ALA 57 -2.590 2.107 6.629 466 HA ALA 57 HA ALA 57 -2.244 0.509 8.901 467 HB1 ALA 57 3HB ALA 57 -3.692 2.488 8.849 468 HB2 ALA 57 1HB ALA 57 -4.546 1.066 9.451 469 HB3 ALA 57 2HB ALA 57 -4.820 1.625 7.801 470 H VAL 58 H VAL 58 -4.387 0.021 6.093 471 HA VAL 58 HA VAL 58 -5.516 -2.392 6.995 472 HB VAL 58 HB VAL 58 -5.191 -1.420 4.147 473 HG11 VAL 58 1HG1 VAL 58 -5.715 -3.800 4.220 474 HG12 VAL 58 2HG1 VAL 58 -7.098 -2.875 3.638 475 HG13 VAL 58 3HG1 VAL 58 -7.077 -3.481 5.294 476 HG21 VAL 58 3HG2 VAL 58 -7.457 -1.071 6.109 477 HG22 VAL 58 1HG2 VAL 58 -7.483 -0.579 4.415 478 HG23 VAL 58 2HG2 VAL 58 -6.362 0.189 5.539 479 H ALA 59 H ALA 59 -2.581 -1.742 5.178 480 HA ALA 59 HA ALA 59 -2.168 -4.361 4.206 481 HB1 ALA 59 3HB ALA 59 -1.086 -2.406 3.229 482 HB2 ALA 59 1HB ALA 59 0.093 -3.631 3.699 483 HB3 ALA 59 2HB ALA 59 -0.134 -2.196 4.700 484 H LYS 60 H LYS 60 -0.937 -2.717 7.129 485 HA LYS 60 HA LYS 60 0.435 -5.223 7.828 486 HB2 LYS 60 2HB LYS 60 1.678 -3.905 9.471 487 HB3 LYS 60 1HB LYS 60 1.810 -3.206 7.865 488 HG2 LYS 60 2HG LYS 60 0.247 -1.478 8.428 489 HG3 LYS 60 1HG LYS 60 -0.078 -2.229 9.991 490 HD2 LYS 60 2HD LYS 60 1.429 -0.385 10.323 491 HD3 LYS 60 1HD LYS 60 2.306 -1.890 10.595 492 HE2 LYS 60 2HE LYS 60 3.260 -1.741 8.346 493 HE3 LYS 60 1HE LYS 60 2.372 -0.245 8.065 494 HZ1 LYS 60 3HZ LYS 60 4.625 -0.711 9.935 495 HZ2 LYS 60 1HZ LYS 60 3.604 0.636 10.076 496 HZ3 LYS 60 2HZ LYS 60 4.520 0.416 8.670 497 H SER 61 H SER 61 -2.577 -4.312 8.268 498 HA SER 61 HA SER 61 -2.666 -4.755 11.159 499 HB2 SER 61 2HB SER 61 -5.114 -4.154 10.901 500 HB3 SER 61 1HB SER 61 -3.965 -2.870 10.527 501 HG SER 61 HG SER 61 -4.424 -3.028 8.435 502 H GLU 62 H GLU 62 -3.405 -6.360 8.162 503 HA GLU 62 HA GLU 62 -5.096 -8.323 9.402 504 HB2 GLU 62 2HB GLU 62 -5.023 -9.522 7.296 505 HB3 GLU 62 1HB GLU 62 -5.351 -7.823 7.016 506 HG2 GLU 62 2HG GLU 62 -3.077 -7.464 6.283 507 HG3 GLU 62 1HG GLU 62 -2.663 -9.135 6.668 508 H LEU 63 H LEU 63 -4.415 -10.743 9.092 509 HA LEU 63 HA LEU 63 -2.154 -11.038 10.824 510 HB2 LEU 63 2HB LEU 63 -3.916 -13.118 9.530 511 HB3 LEU 63 1HB LEU 63 -2.702 -13.451 10.749 512 HG LEU 63 HG LEU 63 -5.190 -11.782 11.142 513 HD11 LEU 63 1HD1 LEU 63 -5.892 -13.588 12.618 514 HD12 LEU 63 2HD1 LEU 63 -4.427 -14.489 12.228 515 HD13 LEU 63 3HD1 LEU 63 -5.631 -14.183 10.978 516 HD21 LEU 63 3HD2 LEU 63 -3.020 -12.551 13.089 517 HD22 LEU 63 1HD2 LEU 63 -4.523 -11.727 13.501 518 HD23 LEU 63 2HD2 LEU 63 -3.335 -10.931 12.470 519 H TYR 64 H TYR 64 -0.630 -10.110 9.282 520 HA TYR 64 HA TYR 64 0.117 -11.349 6.886 521 HB2 TYR 64 2HB TYR 64 2.255 -10.112 7.157 522 HB3 TYR 64 1HB TYR 64 0.836 -9.100 7.391 523 HD1 TYR 64 HD2 TYR 64 0.307 -8.201 9.601 524 HD2 TYR 64 HD1 TYR 64 3.746 -10.629 9.002 525 HE1 TYR 64 HE2 TYR 64 1.198 -7.464 11.769 526 HE2 TYR 64 HE1 TYR 64 4.644 -9.902 11.173 527 HH TYR 64 HH TYR 64 2.784 -8.308 13.487 528 H LYS 65 H LYS 65 0.743 -12.210 10.155 529 HA LYS 65 HA LYS 65 3.077 -13.812 9.613 530 HB2 LYS 65 2HB LYS 65 2.529 -12.576 11.784 531 HB3 LYS 65 1HB LYS 65 1.360 -13.848 12.097 532 HG2 LYS 65 2HG LYS 65 3.387 -14.302 13.293 533 HG3 LYS 65 1HG LYS 65 3.180 -15.503 12.017 534 HD2 LYS 65 2HD LYS 65 4.784 -14.370 10.622 535 HD3 LYS 65 1HD LYS 65 4.913 -13.047 11.782 536 HE2 LYS 65 2HE LYS 65 5.618 -15.908 12.414 537 HE3 LYS 65 1HE LYS 65 6.787 -14.712 11.857 538 HZ1 LYS 65 3HZ LYS 65 6.721 -14.985 14.295 539 HZ2 LYS 65 1HZ LYS 65 5.126 -14.411 14.306 540 HZ3 LYS 65 2HZ LYS 65 6.390 -13.397 13.799 541 H GLU 66 H GLU 66 -0.168 -14.193 9.073 542 HA GLU 66 HA GLU 66 0.024 -17.132 9.199 543 HB2 GLU 66 2HB GLU 66 -1.540 -16.262 10.877 544 HB3 GLU 66 1HB GLU 66 -2.418 -15.400 9.625 545 HG2 GLU 66 2HG GLU 66 -3.018 -17.538 8.587 546 HG3 GLU 66 1HG GLU 66 -2.161 -18.388 9.872 547 H LYS 67 H LYS 67 -1.854 -14.530 7.663 548 HA LYS 67 HA LYS 67 -2.815 -16.108 5.540 549 HB2 LYS 67 2HB LYS 67 -3.913 -14.077 6.364 550 HB3 LYS 67 1HB LYS 67 -2.566 -13.106 5.803 551 HG2 LYS 67 2HG LYS 67 -4.018 -14.766 3.814 552 HG3 LYS 67 1HG LYS 67 -4.799 -13.310 4.429 553 HD2 LYS 67 2HD LYS 67 -2.577 -12.137 3.869 554 HD3 LYS 67 1HD LYS 67 -2.240 -13.566 2.889 555 HE2 LYS 67 2HE LYS 67 -3.242 -11.759 1.564 556 HE3 LYS 67 1HE LYS 67 -4.268 -13.192 1.604 557 HZ1 LYS 67 3HZ LYS 67 -5.721 -12.181 3.129 558 HZ2 LYS 67 1HZ LYS 67 -5.424 -11.000 1.950 559 HZ3 LYS 67 2HZ LYS 67 -4.647 -10.907 3.462 560 H PHE 68 H PHE 68 -0.024 -13.933 5.769 561 HA PHE 68 HA PHE 68 0.638 -14.446 2.971 562 HB2 PHE 68 2HB PHE 68 1.866 -12.607 5.025 563 HB3 PHE 68 1HB PHE 68 2.500 -12.811 3.397 564 HD1 PHE 68 HD1 PHE 68 0.921 -12.271 1.453 565 HD2 PHE 68 HD2 PHE 68 0.230 -11.043 5.467 566 HE1 PHE 68 HE1 PHE 68 -0.584 -10.500 0.648 567 HE2 PHE 68 HE2 PHE 68 -1.272 -9.268 4.669 568 HZ PHE 68 HZ PHE 68 -1.682 -8.995 2.258 569 H LEU 69 H LEU 69 2.266 -14.599 6.124 570 HA LEU 69 HA LEU 69 4.657 -15.612 4.991 571 HB2 LEU 69 2HB LEU 69 4.401 -14.191 7.063 572 HB3 LEU 69 1HB LEU 69 3.890 -15.645 7.899 573 HG LEU 69 HG LEU 69 6.081 -16.683 7.340 574 HD11 LEU 69 1HD1 LEU 69 6.748 -13.912 6.357 575 HD12 LEU 69 2HD1 LEU 69 6.609 -15.363 5.363 576 HD13 LEU 69 3HD1 LEU 69 7.894 -15.238 6.565 577 HD21 LEU 69 3HD2 LEU 69 7.368 -15.406 8.965 578 HD22 LEU 69 1HD2 LEU 69 5.703 -15.622 9.503 579 HD23 LEU 69 2HD2 LEU 69 6.223 -14.074 8.837 580 H TYR 70 H TYR 70 1.812 -17.207 6.145 581 HA TYR 70 HA TYR 70 3.325 -19.728 6.273 582 HB2 TYR 70 2HB TYR 70 2.175 -19.025 8.398 583 HB3 TYR 70 1HB TYR 70 0.640 -19.200 7.555 584 HD1 TYR 70 HD1 TYR 70 3.596 -21.022 8.802 585 HD2 TYR 70 HD2 TYR 70 -0.331 -21.357 7.199 586 HE1 TYR 70 HE1 TYR 70 3.574 -23.413 9.373 587 HE2 TYR 70 HE2 TYR 70 -0.365 -23.750 7.769 588 HH TYR 70 HH TYR 70 1.238 -25.568 8.174 589 H GLY 71 H GLY 71 3.192 -20.632 4.317 590 HA2 GLY 71 2HA GLY 71 0.978 -22.009 3.478 591 HA3 GLY 71 1HA GLY 71 0.831 -20.446 2.693 592 H ASN 72 H ASN 72 3.121 -19.740 1.744 593 HA ASN 72 HA ASN 72 4.082 -22.043 0.184 594 HB2 ASN 72 2HB ASN 72 2.389 -20.502 -0.989 595 HB3 ASN 72 1HB ASN 72 3.674 -19.300 -1.008 596 HD21 ASN 72 1HD2 ASN 72 2.699 -22.471 -2.141 597 HD22 ASN 72 2HD2 ASN 72 3.790 -22.526 -3.497 598 H PHE 73 H PHE 73 5.957 -20.619 -1.375 599 HA PHE 73 HA PHE 73 8.115 -20.595 0.483 600 HB2 PHE 73 2HB PHE 73 8.039 -19.819 -2.437 601 HB3 PHE 73 1HB PHE 73 9.505 -20.040 -1.486 602 HD1 PHE 73 HD1 PHE 73 9.982 -22.317 -0.521 603 HD2 PHE 73 HD2 PHE 73 6.976 -21.632 -3.456 604 HE1 PHE 73 HE1 PHE 73 9.986 -24.714 -1.076 605 HE2 PHE 73 HE2 PHE 73 6.975 -24.026 -4.018 606 HZ PHE 73 HZ PHE 73 8.476 -25.571 -2.826 607 H GLN 74 H GLN 74 9.446 -18.950 1.106 608 HA GLN 74 HA GLN 74 8.336 -16.562 1.892 609 HB2 GLN 74 2HB GLN 74 10.440 -17.608 2.748 610 HB3 GLN 74 1HB GLN 74 11.266 -17.021 1.312 611 HG2 GLN 74 2HG GLN 74 11.704 -15.557 3.166 612 HG3 GLN 74 1HG GLN 74 10.721 -14.715 1.968 613 HE21 GLN 74 1HE2 GLN 74 9.944 -13.254 3.477 614 HE22 GLN 74 2HE2 GLN 74 8.789 -13.701 4.682 615 H THR 75 H THR 75 10.175 -17.221 -1.051 616 HA THR 75 HA THR 75 10.499 -14.621 -1.994 617 HB THR 75 HB THR 75 9.960 -17.009 -3.759 618 HG1 THR 75 HG1 THR 75 12.569 -16.405 -2.891 619 HG21 THR 75 3HG2 THR 75 11.641 -15.917 -5.203 620 HG22 THR 75 1HG2 THR 75 11.730 -14.581 -4.055 621 HG23 THR 75 2HG2 THR 75 10.230 -14.895 -4.927 622 H ARG 76 H ARG 76 7.766 -16.852 -2.287 623 HA ARG 76 HA ARG 76 6.358 -15.131 -4.125 624 HB2 ARG 76 2HB ARG 76 5.198 -17.484 -2.636 625 HB3 ARG 76 1HB ARG 76 4.635 -16.780 -4.144 626 HG2 ARG 76 2HG ARG 76 7.094 -18.442 -3.681 627 HG3 ARG 76 1HG ARG 76 5.703 -18.815 -4.693 628 HD2 ARG 76 2HD ARG 76 7.716 -16.620 -5.179 629 HD3 ARG 76 1HD ARG 76 7.645 -18.161 -6.027 630 HE ARG 76 HE ARG 76 5.685 -15.976 -6.265 631 HH11 ARG 76 1HH1 ARG 76 7.064 -18.972 -7.423 632 HH12 ARG 76 2HH1 ARG 76 6.327 -18.866 -8.989 633 HH21 ARG 76 1HH2 ARG 76 4.718 -15.805 -8.327 634 HH22 ARG 76 2HH2 ARG 76 4.963 -17.075 -9.501 635 H VAL 77 H VAL 77 6.533 -15.632 -0.705 636 HA VAL 77 HA VAL 77 4.169 -14.309 0.077 637 HB VAL 77 HB VAL 77 6.838 -14.409 1.507 638 HG11 VAL 77 1HG1 VAL 77 4.093 -13.801 2.602 639 HG12 VAL 77 2HG1 VAL 77 5.398 -12.635 2.379 640 HG13 VAL 77 3HG1 VAL 77 5.578 -13.948 3.543 641 HG21 VAL 77 3HG2 VAL 77 6.006 -16.633 1.071 642 HG22 VAL 77 1HG2 VAL 77 4.419 -16.198 1.708 643 HG23 VAL 77 2HG2 VAL 77 5.816 -16.260 2.783 644 H ILE 78 H ILE 78 7.389 -13.183 -0.776 645 HA ILE 78 HA ILE 78 7.001 -10.436 -0.273 646 HB ILE 78 HB ILE 78 8.775 -11.763 -2.335 647 HG12 ILE 78 2HG1 ILE 78 9.408 -10.792 0.460 648 HG13 ILE 78 1HG1 ILE 78 9.170 -12.476 0.011 649 HG21 ILE 78 1HG2 ILE 78 8.419 -9.407 -2.841 650 HG22 ILE 78 2HG2 ILE 78 10.070 -9.686 -2.285 651 HG23 ILE 78 3HG2 ILE 78 8.880 -8.972 -1.194 652 HD11 ILE 78 3HD1 ILE 78 11.527 -11.932 0.200 653 HD12 ILE 78 1HD1 ILE 78 11.343 -10.673 -1.021 654 HD13 ILE 78 2HD1 ILE 78 11.106 -12.365 -1.457 655 H GLU 79 H GLU 79 6.508 -12.416 -3.185 656 HA GLU 79 HA GLU 79 5.554 -10.446 -4.903 657 HB2 GLU 79 2HB GLU 79 6.062 -12.792 -5.551 658 HB3 GLU 79 1HB GLU 79 4.611 -13.315 -4.706 659 HG2 GLU 79 2HG GLU 79 3.312 -11.805 -6.225 660 HG3 GLU 79 1HG GLU 79 4.794 -11.592 -7.152 661 H LEU 80 H LEU 80 3.956 -12.211 -2.323 662 HA LEU 80 HA LEU 80 1.301 -11.555 -2.970 663 HB2 LEU 80 2HB LEU 80 2.569 -12.287 -0.336 664 HB3 LEU 80 1HB LEU 80 0.840 -12.098 -0.562 665 HG LEU 80 HG LEU 80 2.579 -14.134 -1.960 666 HD11 LEU 80 1HD1 LEU 80 0.497 -14.481 0.192 667 HD12 LEU 80 2HD1 LEU 80 2.242 -14.581 0.432 668 HD13 LEU 80 3HD1 LEU 80 1.423 -15.765 -0.588 669 HD21 LEU 80 3HD2 LEU 80 -0.409 -13.731 -2.032 670 HD22 LEU 80 1HD2 LEU 80 0.480 -15.045 -2.799 671 HD23 LEU 80 2HD2 LEU 80 0.710 -13.387 -3.351 672 H ASN 81 H ASN 81 3.614 -9.937 -0.760 673 HA ASN 81 HA ASN 81 1.609 -8.005 -0.046 674 HB2 ASN 81 2HB ASN 81 3.229 -6.945 1.360 675 HB3 ASN 81 1HB ASN 81 3.365 -8.679 1.568 676 HD21 ASN 81 1HD2 ASN 81 5.390 -8.573 2.400 677 HD22 ASN 81 2HD2 ASN 81 6.794 -8.135 1.493 678 H TYR 82 H TYR 82 4.132 -8.203 -2.414 679 HA TYR 82 HA TYR 82 4.300 -5.482 -3.093 680 HB2 TYR 82 2HB TYR 82 5.596 -7.754 -3.884 681 HB3 TYR 82 1HB TYR 82 4.597 -7.428 -5.297 682 HD1 TYR 82 HD1 TYR 82 4.594 -4.688 -5.780 683 HD2 TYR 82 HD2 TYR 82 7.752 -6.988 -4.104 684 HE1 TYR 82 HE1 TYR 82 6.211 -2.995 -6.521 685 HE2 TYR 82 HE2 TYR 82 9.379 -5.301 -4.843 686 HH TYR 82 HH TYR 82 9.589 -3.527 -6.489 687 H LYS 83 H LYS 83 2.277 -8.125 -4.350 688 HA LYS 83 HA LYS 83 0.882 -6.363 -6.150 689 HB2 LYS 83 2HB LYS 83 -0.431 -8.262 -6.777 690 HB3 LYS 83 1HB LYS 83 1.231 -8.804 -6.603 691 HG2 LYS 83 2HG LYS 83 0.710 -9.737 -4.413 692 HG3 LYS 83 1HG LYS 83 -0.956 -9.175 -4.567 693 HD2 LYS 83 2HD LYS 83 -0.917 -11.491 -5.147 694 HD3 LYS 83 1HD LYS 83 -1.142 -10.575 -6.639 695 HE2 LYS 83 2HE LYS 83 1.284 -10.767 -7.070 696 HE3 LYS 83 1HE LYS 83 1.433 -11.770 -5.629 697 HZ1 LYS 83 3HZ LYS 83 -0.228 -13.292 -6.705 698 HZ2 LYS 83 1HZ LYS 83 1.294 -13.224 -7.454 699 HZ3 LYS 83 2HZ LYS 83 -0.023 -12.395 -8.132 700 H HIS 84 H HIS 84 0.605 -7.223 -2.861 701 HA HIS 84 HA HIS 84 -2.186 -6.662 -2.532 702 HB2 HIS 84 2HB HIS 84 -0.832 -8.053 -0.952 703 HB3 HIS 84 1HB HIS 84 0.035 -6.603 -0.469 704 HD1 HIS 84 HD1 HIS 84 -1.622 -4.685 0.640 705 HD2 HIS 84 HD2 HIS 84 -2.982 -8.606 0.577 706 HE1 HIS 84 HE1 HIS 84 -3.382 -4.815 2.426 707 HE2 HIS 84 HE2 HIS 84 -3.950 -7.268 2.571 708 H LEU 85 H LEU 85 0.757 -4.823 -2.587 709 HA LEU 85 HA LEU 85 -0.607 -2.466 -1.515 710 HB2 LEU 85 2HB LEU 85 2.312 -3.050 -1.976 711 HB3 LEU 85 1HB LEU 85 1.692 -1.525 -1.367 712 HG LEU 85 HG LEU 85 1.226 -4.158 0.022 713 HD11 LEU 85 1HD1 LEU 85 3.312 -2.087 0.674 714 HD12 LEU 85 2HD1 LEU 85 3.641 -3.605 -0.157 715 HD13 LEU 85 3HD1 LEU 85 3.032 -3.622 1.495 716 HD21 LEU 85 3HD2 LEU 85 0.704 -2.705 1.928 717 HD22 LEU 85 1HD2 LEU 85 -0.365 -2.401 0.557 718 HD23 LEU 85 2HD2 LEU 85 0.958 -1.289 0.907 719 H LEU 86 H LEU 86 1.438 -3.412 -4.280 720 HA LEU 86 HA LEU 86 0.730 -0.845 -5.544 721 HB2 LEU 86 2HB LEU 86 3.131 -2.610 -6.004 722 HB3 LEU 86 1HB LEU 86 2.825 -1.072 -6.790 723 HG LEU 86 HG LEU 86 3.148 -1.337 -3.804 724 HD11 LEU 86 1HD1 LEU 86 5.181 -2.132 -4.830 725 HD12 LEU 86 2HD1 LEU 86 5.444 -0.523 -4.154 726 HD13 LEU 86 3HD1 LEU 86 5.229 -0.724 -5.894 727 HD21 LEU 86 3HD2 LEU 86 3.625 1.065 -3.955 728 HD22 LEU 86 1HD2 LEU 86 2.012 0.678 -4.557 729 HD23 LEU 86 2HD2 LEU 86 3.321 1.010 -5.692 730 H GLY 87 H GLY 87 -0.052 -4.039 -5.712 731 HA2 GLY 87 2HA GLY 87 -0.929 -5.415 -7.336 732 HA3 GLY 87 1HA GLY 87 -1.267 -3.943 -8.238 733 H ARG 88 H ARG 88 1.914 -4.971 -7.250 734 HA ARG 88 HA ARG 88 2.634 -5.479 -10.052 735 HB2 ARG 88 2HB ARG 88 3.417 -3.301 -9.780 736 HB3 ARG 88 1HB ARG 88 3.813 -3.544 -8.088 737 HG2 ARG 88 2HG ARG 88 5.743 -4.896 -8.729 738 HG3 ARG 88 1HG ARG 88 5.337 -4.669 -10.431 739 HD2 ARG 88 2HD ARG 88 5.933 -2.438 -10.409 740 HD3 ARG 88 1HD ARG 88 5.705 -2.285 -8.669 741 HE ARG 88 HE ARG 88 7.781 -3.948 -8.764 742 HH11 ARG 88 1HH1 ARG 88 7.183 -1.029 -10.585 743 HH12 ARG 88 2HH1 ARG 88 8.856 -0.560 -10.648 744 HH21 ARG 88 1HH2 ARG 88 9.989 -3.326 -8.798 745 HH22 ARG 88 2HH2 ARG 88 10.447 -1.862 -9.625 746 H ALA 89 H ALA 89 4.319 -6.961 -10.363 747 HA ALA 89 HA ALA 89 4.970 -8.588 -8.006 748 HB1 ALA 89 3HB ALA 89 3.900 -9.756 -9.893 749 HB2 ALA 89 1HB ALA 89 5.528 -10.360 -9.586 750 HB3 ALA 89 2HB ALA 89 5.234 -9.268 -10.940 751 HA PRO 90 HA PRO 90 9.231 -7.331 -7.910 752 HB2 PRO 90 2HB PRO 90 10.437 -9.853 -7.825 753 HB3 PRO 90 1HB PRO 90 9.891 -8.921 -6.427 754 HG2 PRO 90 2HG PRO 90 8.546 -11.163 -7.861 755 HG3 PRO 90 1HG PRO 90 8.547 -10.772 -6.132 756 HD2 PRO 90 2HD PRO 90 6.427 -10.255 -7.688 757 HD3 PRO 90 1HD PRO 90 6.895 -9.168 -6.365 758 H TYR 91 H TYR 91 10.272 -6.573 -9.624 759 HA TYR 91 HA TYR 91 9.968 -7.799 -12.203 760 HB2 TYR 91 2HB TYR 91 9.949 -5.381 -12.038 761 HB3 TYR 91 1HB TYR 91 11.540 -5.379 -11.285 762 HD1 TYR 91 HD2 TYR 91 9.712 -5.897 -14.444 763 HD2 TYR 91 HD1 TYR 91 13.529 -5.563 -12.599 764 HE1 TYR 91 HE2 TYR 91 10.760 -5.695 -16.660 765 HE2 TYR 91 HE1 TYR 91 14.584 -5.352 -14.806 766 HH TYR 91 HH TYR 91 13.952 -6.143 -17.217 767 H ASP 92 H ASP 92 12.596 -7.330 -9.902 768 HA ASP 92 HA ASP 92 14.115 -9.381 -11.369 769 HB2 ASP 92 2HB ASP 92 16.215 -8.222 -10.657 770 HB3 ASP 92 1HB ASP 92 15.245 -7.300 -11.800 771 H GLU 93 H GLU 93 16.075 -10.019 -9.753 772 HA GLU 93 HA GLU 93 14.623 -11.218 -7.544 773 HB2 GLU 93 2HB GLU 93 16.084 -12.560 -9.043 774 HB3 GLU 93 1HB GLU 93 17.473 -11.664 -8.446 775 HG2 GLU 93 2HG GLU 93 17.139 -12.541 -6.228 776 HG3 GLU 93 1HG GLU 93 15.656 -13.349 -6.741 777 H SER 94 H SER 94 16.752 -8.606 -8.080 778 HA SER 94 HA SER 94 18.042 -8.517 -5.564 779 HB2 SER 94 2HB SER 94 17.413 -6.242 -7.462 780 HB3 SER 94 1HB SER 94 18.601 -6.208 -6.159 781 HG SER 94 HG SER 94 19.831 -7.707 -7.242 782 H GLU 95 H GLU 95 15.008 -7.172 -6.804 783 HA GLU 95 HA GLU 95 14.218 -5.761 -4.513 784 HB2 GLU 95 2HB GLU 95 12.502 -7.274 -6.496 785 HB3 GLU 95 1HB GLU 95 11.888 -6.138 -5.305 786 HG2 GLU 95 2HG GLU 95 13.259 -4.366 -6.357 787 HG3 GLU 95 1HG GLU 95 13.727 -5.522 -7.603 788 H VAL 96 H VAL 96 13.978 -9.171 -5.331 789 HA VAL 96 HA VAL 96 12.476 -9.991 -3.077 790 HB VAL 96 HB VAL 96 14.448 -11.573 -4.743 791 HG11 VAL 96 1HG1 VAL 96 12.277 -12.541 -2.885 792 HG12 VAL 96 2HG1 VAL 96 14.013 -12.637 -2.588 793 HG13 VAL 96 3HG1 VAL 96 13.292 -13.555 -3.909 794 HG21 VAL 96 3HG2 VAL 96 12.667 -10.674 -6.111 795 HG22 VAL 96 1HG2 VAL 96 11.455 -11.269 -4.977 796 HG23 VAL 96 2HG2 VAL 96 12.434 -12.409 -5.901 797 H ILE 97 H ILE 97 15.953 -10.057 -3.780 798 HA ILE 97 HA ILE 97 16.898 -11.077 -1.383 799 HB ILE 97 HB ILE 97 18.185 -9.037 -3.200 800 HG12 ILE 97 2HG1 ILE 97 18.512 -12.039 -3.036 801 HG13 ILE 97 1HG1 ILE 97 17.558 -11.194 -4.253 802 HG21 ILE 97 1HG2 ILE 97 19.236 -9.032 -0.993 803 HG22 ILE 97 2HG2 ILE 97 20.310 -9.719 -2.212 804 HG23 ILE 97 3HG2 ILE 97 19.456 -10.778 -1.089 805 HD11 ILE 97 3HD1 ILE 97 20.528 -10.930 -3.852 806 HD12 ILE 97 1HD1 ILE 97 19.568 -10.113 -5.084 807 HD13 ILE 97 2HD1 ILE 97 19.727 -11.869 -5.113 808 H PHE 98 H PHE 98 16.261 -7.703 -2.276 809 HA PHE 98 HA PHE 98 17.146 -6.473 0.068 810 HB2 PHE 98 2HB PHE 98 16.585 -5.229 -1.968 811 HB3 PHE 98 1HB PHE 98 14.884 -5.640 -1.765 812 HD1 PHE 98 HD1 PHE 98 17.704 -3.825 -0.180 813 HD2 PHE 98 HD2 PHE 98 13.481 -4.297 -0.468 814 HE1 PHE 98 HE1 PHE 98 17.386 -1.796 1.174 815 HE2 PHE 98 HE2 PHE 98 13.161 -2.270 0.886 816 HZ PHE 98 HZ PHE 98 15.110 -1.014 1.708 817 H HIS 99 H HIS 99 13.997 -7.879 -0.726 818 HA HIS 99 HA HIS 99 12.788 -7.020 1.720 819 HB2 HIS 99 2HB HIS 99 11.932 -8.817 -0.519 820 HB3 HIS 99 1HB HIS 99 11.011 -8.782 0.984 821 HD1 HIS 99 HD1 HIS 99 10.192 -6.320 1.720 822 HD2 HIS 99 HD2 HIS 99 11.240 -6.847 -2.269 823 HE1 HIS 99 HE1 HIS 99 9.206 -4.355 0.495 824 HE2 HIS 99 HE2 HIS 99 9.599 -4.871 -1.939 825 H LEU 100 H LEU 100 14.364 -9.970 0.629 826 HA LEU 100 HA LEU 100 13.722 -11.607 2.810 827 HB2 LEU 100 2HB LEU 100 16.239 -11.508 1.143 828 HB3 LEU 100 1HB LEU 100 15.862 -12.787 2.283 829 HG LEU 100 HG LEU 100 14.231 -12.110 -0.167 830 HD11 LEU 100 1HD1 LEU 100 15.080 -14.209 -1.068 831 HD12 LEU 100 2HD1 LEU 100 16.101 -14.415 0.354 832 HD13 LEU 100 3HD1 LEU 100 16.390 -13.074 -0.753 833 HD21 LEU 100 3HD2 LEU 100 14.004 -14.426 1.751 834 HD22 LEU 100 1HD2 LEU 100 13.011 -14.141 0.323 835 HD23 LEU 100 2HD2 LEU 100 12.916 -13.038 1.695 836 H ASP 101 H ASP 101 16.484 -9.433 2.321 837 HA ASP 101 HA ASP 101 17.606 -9.807 4.895 838 HB2 ASP 101 2HB ASP 101 18.917 -8.915 3.035 839 HB3 ASP 101 1HB ASP 101 17.886 -7.490 2.968 840 H LEU 102 H LEU 102 15.271 -7.548 3.581 841 HA LEU 102 HA LEU 102 15.152 -5.752 5.734 842 HB2 LEU 102 2HB LEU 102 14.201 -5.457 3.412 843 HB3 LEU 102 1HB LEU 102 12.878 -6.497 3.898 844 HG LEU 102 HG LEU 102 12.198 -4.879 5.597 845 HD11 LEU 102 1HD1 LEU 102 13.266 -2.664 5.678 846 HD12 LEU 102 2HD1 LEU 102 14.505 -3.234 4.558 847 HD13 LEU 102 3HD1 LEU 102 14.368 -3.953 6.163 848 HD21 LEU 102 3HD2 LEU 102 12.621 -3.580 2.909 849 HD22 LEU 102 1HD2 LEU 102 11.401 -3.147 4.106 850 HD23 LEU 102 2HD2 LEU 102 11.325 -4.712 3.296 851 H TYR 103 H TYR 103 13.258 -8.677 5.024 852 HA TYR 103 HA TYR 103 11.583 -8.557 7.273 853 HB2 TYR 103 2HB TYR 103 11.043 -10.058 5.459 854 HB3 TYR 103 1HB TYR 103 12.550 -10.942 5.683 855 HD1 TYR 103 HD2 TYR 103 9.301 -10.158 7.300 856 HD2 TYR 103 HD1 TYR 103 12.679 -12.746 7.195 857 HE1 TYR 103 HE2 TYR 103 8.177 -11.678 8.871 858 HE2 TYR 103 HE1 TYR 103 11.566 -14.275 8.767 859 HH TYR 103 HH TYR 103 9.772 -14.104 10.549 860 H GLU 104 H GLU 104 14.743 -10.101 6.816 861 HA GLU 104 HA GLU 104 14.869 -11.456 9.257 862 HB2 GLU 104 2HB GLU 104 17.138 -10.279 7.643 863 HB3 GLU 104 1HB GLU 104 17.323 -11.447 8.944 864 HG2 GLU 104 2HG GLU 104 15.999 -13.064 7.646 865 HG3 GLU 104 1HG GLU 104 15.897 -11.892 6.331 866 H ASN 105 H ASN 105 15.959 -8.195 8.409 867 HA ASN 105 HA ASN 105 16.985 -7.810 11.102 868 HB2 ASN 105 2HB ASN 105 17.062 -6.027 8.662 869 HB3 ASN 105 1HB ASN 105 17.819 -5.644 10.204 870 HD21 ASN 105 1HD2 ASN 105 18.970 -6.042 7.535 871 HD22 ASN 105 2HD2 ASN 105 20.163 -7.278 7.724 872 H GLU 106 H GLU 106 14.589 -6.241 8.974 873 HA GLU 106 HA GLU 106 13.877 -4.441 11.156 874 HB2 GLU 106 2HB GLU 106 12.978 -4.504 8.276 875 HB3 GLU 106 1HB GLU 106 12.558 -3.259 9.445 876 HG2 GLU 106 2HG GLU 106 15.346 -3.911 8.520 877 HG3 GLU 106 1HG GLU 106 14.362 -2.566 7.945 878 H GLY 107 H GLY 107 12.465 -7.016 9.215 879 HA2 GLY 107 2HA GLY 107 10.814 -8.444 10.333 880 HA3 GLY 107 1HA GLY 107 10.130 -6.980 11.025 881 H PHE 108 H PHE 108 8.329 -8.479 9.858 882 HA PHE 108 HA PHE 108 8.115 -8.030 7.017 883 HB2 PHE 108 2HB PHE 108 7.234 -10.061 8.322 884 HB3 PHE 108 1HB PHE 108 5.911 -9.016 8.827 885 HD1 PHE 108 HD2 PHE 108 7.458 -10.771 6.027 886 HD2 PHE 108 HD1 PHE 108 4.194 -8.331 7.261 887 HE1 PHE 108 HE2 PHE 108 6.277 -11.306 3.938 888 HE2 PHE 108 HE1 PHE 108 3.007 -8.868 5.174 889 HZ PHE 108 HZ PHE 108 4.049 -10.356 3.510 890 H ASP 109 H ASP 109 6.925 -6.602 9.961 891 HA ASP 109 HA ASP 109 4.882 -4.993 8.878 892 HB2 ASP 109 2HB ASP 109 5.046 -3.682 10.914 893 HB3 ASP 109 1HB ASP 109 5.206 -5.388 11.315 894 H ALA 110 H ALA 110 8.356 -4.512 9.213 895 HA ALA 110 HA ALA 110 8.260 -1.850 8.089 896 HB1 ALA 110 3HB ALA 110 10.656 -3.607 8.610 897 HB2 ALA 110 1HB ALA 110 9.951 -2.488 9.779 898 HB3 ALA 110 2HB ALA 110 10.665 -1.872 8.288 899 H ASP 111 H ASP 111 8.701 -5.109 7.011 900 HA ASP 111 HA ASP 111 9.882 -4.668 4.513 901 HB2 ASP 111 2HB ASP 111 9.516 -6.907 5.599 902 HB3 ASP 111 1HB ASP 111 7.815 -6.780 5.157 903 H ILE 112 H ILE 112 6.478 -4.850 5.449 904 HA ILE 112 HA ILE 112 5.445 -3.985 2.944 905 HB ILE 112 HB ILE 112 4.285 -4.103 5.722 906 HG12 ILE 112 2HG1 ILE 112 3.716 -5.654 3.188 907 HG13 ILE 112 1HG1 ILE 112 4.621 -6.241 4.580 908 HG21 ILE 112 1HG2 ILE 112 2.091 -3.564 4.766 909 HG22 ILE 112 2HG2 ILE 112 2.863 -3.205 3.224 910 HG23 ILE 112 3HG2 ILE 112 3.223 -2.218 4.638 911 HD11 ILE 112 3HD1 ILE 112 2.624 -6.127 5.950 912 HD12 ILE 112 1HD1 ILE 112 2.338 -7.115 4.517 913 HD13 ILE 112 2HD1 ILE 112 1.710 -5.467 4.593 914 H ASP 113 H ASP 113 6.533 -2.366 5.839 915 HA ASP 113 HA ASP 113 5.270 0.119 5.393 916 HB2 ASP 113 2HB ASP 113 6.318 -0.813 7.556 917 HB3 ASP 113 1HB ASP 113 7.842 -0.199 6.921 918 H SER 114 H SER 114 8.282 -1.238 4.265 919 HA SER 114 HA SER 114 9.705 1.046 3.617 920 HB2 SER 114 2HB SER 114 10.921 -0.349 2.004 921 HB3 SER 114 1HB SER 114 10.650 -1.218 3.514 922 HG SER 114 HG SER 114 9.148 -2.480 2.546 923 H TYR 115 H TYR 115 7.068 -0.481 1.883 924 HA TYR 115 HA TYR 115 7.328 0.990 -0.533 925 HB2 TYR 115 2HB TYR 115 4.854 -0.248 0.695 926 HB3 TYR 115 1HB TYR 115 5.006 0.295 -0.970 927 HD1 TYR 115 HD1 TYR 115 6.058 -2.253 1.468 928 HD2 TYR 115 HD2 TYR 115 6.079 -1.075 -2.616 929 HE1 TYR 115 HE1 TYR 115 6.773 -4.514 0.827 930 HE2 TYR 115 HE2 TYR 115 6.801 -3.332 -3.269 931 HH TYR 115 HH TYR 115 6.660 -5.979 -1.181 932 H ILE 116 H ILE 116 5.173 1.341 2.253 933 HA ILE 116 HA ILE 116 3.860 3.673 1.386 934 HB ILE 116 HB ILE 116 4.248 2.587 4.180 935 HG12 ILE 116 2HG1 ILE 116 3.141 1.001 2.692 936 HG13 ILE 116 1HG1 ILE 116 2.000 1.630 3.875 937 HG21 ILE 116 1HG2 ILE 116 2.268 3.900 4.786 938 HG22 ILE 116 2HG2 ILE 116 2.269 4.623 3.179 939 HG23 ILE 116 3HG2 ILE 116 3.612 4.922 4.280 940 HD11 ILE 116 3HD1 ILE 116 2.233 2.478 0.997 941 HD12 ILE 116 1HD1 ILE 116 1.117 3.166 2.177 942 HD13 ILE 116 2HD1 ILE 116 0.964 1.474 1.702 943 H ASP 117 H ASP 117 6.777 3.128 3.213 944 HA ASP 117 HA ASP 117 7.054 5.823 4.139 945 HB2 ASP 117 2HB ASP 117 7.952 3.856 5.359 946 HB3 ASP 117 1HB ASP 117 9.092 3.587 4.047 947 H SER 118 H SER 118 7.485 4.443 1.132 948 HA SER 118 HA SER 118 9.692 6.210 0.390 949 HB2 SER 118 2HB SER 118 9.718 3.862 -0.422 950 HB3 SER 118 1HB SER 118 8.223 4.176 -1.306 951 HG SER 118 HG SER 118 10.788 4.776 -1.966 952 HA PRO 119 HA PRO 119 6.408 9.141 -0.542 953 HB2 PRO 119 2HB PRO 119 8.105 11.186 -1.216 954 HB3 PRO 119 1HB PRO 119 7.649 10.783 0.443 955 HG2 PRO 119 2HG PRO 119 10.120 10.051 -1.072 956 HG3 PRO 119 1HG PRO 119 9.955 10.579 0.613 957 HD2 PRO 119 2HD PRO 119 10.300 7.993 -0.046 958 HD3 PRO 119 1HD PRO 119 9.291 8.486 1.331 959 H GLU 120 H GLU 120 9.289 8.915 -2.639 960 HA GLU 120 HA GLU 120 8.053 10.094 -4.878 961 HB2 GLU 120 2HB GLU 120 10.469 10.039 -4.677 962 HB3 GLU 120 1HB GLU 120 10.463 8.281 -4.718 963 HG2 GLU 120 2HG GLU 120 9.664 8.301 -6.997 964 HG3 GLU 120 1HG GLU 120 9.559 10.061 -6.971 965 H TYR 121 H TYR 121 8.745 6.665 -4.176 966 HA TYR 121 HA TYR 121 7.637 5.788 -6.632 967 HB2 TYR 121 2HB TYR 121 8.365 4.260 -4.133 968 HB3 TYR 121 1HB TYR 121 7.859 3.503 -5.644 969 HD1 TYR 121 HD1 TYR 121 9.210 4.440 -7.773 970 HD2 TYR 121 HD2 TYR 121 10.645 4.413 -3.769 971 HE1 TYR 121 HE1 TYR 121 11.519 4.550 -8.608 972 HE2 TYR 121 HE2 TYR 121 12.959 4.521 -4.592 973 HH TYR 121 HH TYR 121 13.754 5.374 -7.710 974 H THR 122 H THR 122 6.245 6.407 -3.506 975 HA THR 122 HA THR 122 3.785 5.064 -4.157 976 HB THR 122 HB THR 122 4.291 7.161 -2.036 977 HG1 THR 122 HG1 THR 122 5.509 5.386 -1.503 978 HG21 THR 122 3HG2 THR 122 2.031 5.183 -2.369 979 HG22 THR 122 1HG2 THR 122 1.922 6.924 -2.631 980 HG23 THR 122 2HG2 THR 122 2.242 6.295 -1.016 981 H ASN 123 H ASN 123 5.050 8.362 -4.329 982 HA ASN 123 HA ASN 123 2.584 9.613 -4.938 983 HB2 ASN 123 2HB ASN 123 4.555 10.849 -4.091 984 HB3 ASN 123 1HB ASN 123 5.380 10.551 -5.616 985 HD21 ASN 123 1HD2 ASN 123 4.775 11.691 -7.441 986 HD22 ASN 123 2HD2 ASN 123 3.719 13.062 -7.381 987 H SER 124 H SER 124 5.080 8.129 -6.916 988 HA SER 124 HA SER 124 4.195 9.154 -9.395 989 HB2 SER 124 2HB SER 124 5.541 7.213 -10.329 990 HB3 SER 124 1HB SER 124 6.412 8.326 -9.277 991 HG SER 124 HG SER 124 6.311 5.763 -9.009 992 H PHE 125 H PHE 125 3.196 6.406 -7.480 993 HA PHE 125 HA PHE 125 1.481 5.428 -9.630 994 HB2 PHE 125 2HB PHE 125 2.821 4.060 -7.755 995 HB3 PHE 125 1HB PHE 125 1.320 4.309 -6.871 996 HD1 PHE 125 HD2 PHE 125 -0.855 3.798 -8.406 997 HD2 PHE 125 HD1 PHE 125 3.019 2.109 -8.909 998 HE1 PHE 125 HE2 PHE 125 -1.844 1.890 -9.599 999 HE2 PHE 125 HE1 PHE 125 2.035 0.198 -10.106 1000 HZ PHE 125 HZ PHE 125 -0.401 0.088 -10.450 1001 H GLY 126 H GLY 126 1.288 6.968 -6.462 1002 HA2 GLY 126 2HA GLY 126 -0.652 8.722 -6.739 1003 HA3 GLY 126 1HA GLY 126 -1.609 7.247 -6.720 1004 H ASP 127 H ASP 127 -0.475 9.709 -4.851 1005 HA ASP 127 HA ASP 127 -0.190 8.220 -2.373 1006 HB2 ASP 127 2HB ASP 127 1.092 10.292 -2.670 1007 HB3 ASP 127 1HB ASP 127 -0.393 11.200 -2.916 1008 H TRP 128 H TRP 128 -2.571 9.978 -4.170 1009 HA TRP 128 HA TRP 128 -4.624 9.232 -2.197 1010 HB2 TRP 128 2HB TRP 128 -4.547 11.404 -4.287 1011 HB3 TRP 128 1HB TRP 128 -6.054 10.889 -3.538 1012 HD1 TRP 128 HD1 TRP 128 -2.892 12.877 -2.846 1013 HE1 TRP 128 HE1 TRP 128 -3.171 14.143 -0.617 1014 HE3 TRP 128 HE3 TRP 128 -7.228 10.708 -1.229 1015 HZ2 TRP 128 HZ2 TRP 128 -4.994 14.201 1.540 1016 HZ3 TRP 128 HZ3 TRP 128 -8.172 11.422 0.930 1017 HH2 TRP 128 HH2 TRP 128 -7.076 13.132 2.283 1018 H VAL 129 H VAL 129 -3.247 7.736 -4.501 1019 HA VAL 129 HA VAL 129 -5.709 6.861 -5.867 1020 HB VAL 129 HB VAL 129 -2.884 6.759 -6.953 1021 HG11 VAL 129 1HG1 VAL 129 -5.500 6.045 -8.274 1022 HG12 VAL 129 2HG1 VAL 129 -4.267 4.904 -7.739 1023 HG13 VAL 129 3HG1 VAL 129 -3.912 6.035 -9.045 1024 HG21 VAL 129 3HG2 VAL 129 -5.193 8.530 -7.735 1025 HG22 VAL 129 1HG2 VAL 129 -3.652 8.422 -8.584 1026 HG23 VAL 129 2HG2 VAL 129 -3.705 9.038 -6.932 1027 H VAL 130 H VAL 130 -6.130 4.688 -5.896 1028 HA VAL 130 HA VAL 130 -4.608 3.049 -4.051 1029 HB VAL 130 HB VAL 130 -7.047 2.333 -5.692 1030 HG11 VAL 130 1HG1 VAL 130 -7.305 0.477 -4.114 1031 HG12 VAL 130 2HG1 VAL 130 -5.793 0.934 -3.330 1032 HG13 VAL 130 3HG1 VAL 130 -5.785 0.372 -5.001 1033 HG21 VAL 130 3HG2 VAL 130 -8.329 2.701 -3.655 1034 HG22 VAL 130 1HG2 VAL 130 -7.482 4.172 -4.132 1035 HG23 VAL 130 2HG2 VAL 130 -6.864 3.189 -2.804 1036 HA PRO 131 HA PRO 131 -2.242 1.432 -7.499 1037 HB2 PRO 131 2HB PRO 131 -0.772 -0.070 -5.484 1038 HB3 PRO 131 1HB PRO 131 -0.207 1.239 -6.525 1039 HG2 PRO 131 2HG PRO 131 -0.517 1.518 -3.842 1040 HG3 PRO 131 1HG PRO 131 -0.724 2.861 -4.984 1041 HD2 PRO 131 2HD PRO 131 -2.808 1.168 -3.651 1042 HD3 PRO 131 1HD PRO 131 -2.792 2.923 -3.929 1043 H TYR 132 H TYR 132 -3.871 0.148 -8.349 1044 HA TYR 132 HA TYR 132 -4.339 -2.471 -7.160 1045 HB2 TYR 132 2HB TYR 132 -6.089 -2.700 -8.894 1046 HB3 TYR 132 1HB TYR 132 -6.304 -1.248 -7.926 1047 HD1 TYR 132 HD1 TYR 132 -5.532 0.974 -8.920 1048 HD2 TYR 132 HD2 TYR 132 -5.944 -2.573 -11.236 1049 HE1 TYR 132 HE1 TYR 132 -5.612 2.329 -10.968 1050 HE2 TYR 132 HE2 TYR 132 -6.025 -1.225 -13.289 1051 HH TYR 132 HH TYR 132 -5.123 2.018 -13.400 1052 H TYR 133 H TYR 133 -4.623 -4.239 -9.047 1053 HA TYR 133 HA TYR 133 -2.032 -4.884 -9.862 1054 HB2 TYR 133 2HB TYR 133 -3.055 -6.684 -11.182 1055 HB3 TYR 133 1HB TYR 133 -3.772 -6.586 -9.581 1056 HD1 TYR 133 HD1 TYR 133 -6.077 -5.658 -9.321 1057 HD2 TYR 133 HD2 TYR 133 -4.363 -6.364 -13.150 1058 HE1 TYR 133 HE1 TYR 133 -8.313 -5.553 -10.339 1059 HE2 TYR 133 HE2 TYR 133 -6.594 -6.259 -14.176 1060 HH TYR 133 HH TYR 133 -9.327 -5.098 -12.516 1061 H ARG 134 H ARG 134 -0.839 -4.437 -11.610 1062 HA ARG 134 HA ARG 134 -1.720 -2.287 -13.307 1063 HB2 ARG 134 2HB ARG 134 0.847 -3.880 -13.377 1064 HB3 ARG 134 1HB ARG 134 0.551 -2.369 -14.224 1065 HG2 ARG 134 2HG ARG 134 0.224 -1.263 -12.024 1066 HG3 ARG 134 1HG ARG 134 0.690 -2.779 -11.247 1067 HD2 ARG 134 2HD ARG 134 2.629 -1.389 -11.335 1068 HD3 ARG 134 1HD ARG 134 2.838 -2.675 -12.523 1069 HE ARG 134 HE ARG 134 1.951 0.044 -13.260 1070 HH11 ARG 134 1HH1 ARG 134 4.005 -2.756 -13.768 1071 HH12 ARG 134 2HH1 ARG 134 4.703 -2.121 -15.230 1072 HH21 ARG 134 1HH2 ARG 134 2.895 0.876 -15.164 1073 HH22 ARG 134 2HH2 ARG 134 4.072 -0.082 -16.026 1074 H GLY 135 H GLY 135 -3.392 -4.373 -13.817 1075 HA2 GLY 135 2HA GLY 135 -4.363 -5.238 -15.747 1076 HA3 GLY 135 1HA GLY 135 -2.906 -4.823 -16.639 1077 H LEU 136 H LEU 136 -2.732 -6.665 -13.695 1078 HA LEU 136 HA LEU 136 -2.191 -9.084 -15.273 1079 HB2 LEU 136 2HB LEU 136 -0.112 -8.141 -14.406 1080 HB3 LEU 136 1HB LEU 136 -0.773 -8.131 -12.783 1081 HG LEU 136 HG LEU 136 -0.898 -10.603 -12.855 1082 HD11 LEU 136 1HD1 LEU 136 0.360 -11.788 -14.608 1083 HD12 LEU 136 2HD1 LEU 136 0.555 -10.265 -15.474 1084 HD13 LEU 136 3HD1 LEU 136 -1.055 -10.948 -15.243 1085 HD21 LEU 136 3HD2 LEU 136 1.825 -9.416 -13.378 1086 HD22 LEU 136 1HD2 LEU 136 1.509 -10.972 -12.606 1087 HD23 LEU 136 2HD2 LEU 136 0.997 -9.478 -11.822 1088 H GLU 137 H GLU 137 -4.224 -9.947 -14.984 1089 HA GLU 137 HA GLU 137 -4.634 -11.347 -12.527 1090 HB2 GLU 137 2HB GLU 137 -5.558 -9.179 -11.854 1091 HB3 GLU 137 1HB GLU 137 -6.615 -9.182 -13.258 1092 HG2 GLU 137 2HG GLU 137 -7.682 -11.249 -12.371 1093 HG3 GLU 137 1HG GLU 137 -6.708 -11.067 -10.915 1094 H HIS 138 H HIS 138 -5.108 -13.276 -13.369 1095 HA HIS 138 HA HIS 138 -6.759 -13.477 -15.744 1096 HB2 HIS 138 2HB HIS 138 -5.426 -15.578 -14.027 1097 HB3 HIS 138 1HB HIS 138 -6.449 -15.964 -15.407 1098 HD1 HIS 138 HD1 HIS 138 -3.176 -16.301 -14.898 1099 HD2 HIS 138 HD2 HIS 138 -5.203 -13.808 -17.546 1100 HE1 HIS 138 HE1 HIS 138 -1.525 -15.750 -16.714 1101 HE2 HIS 138 HE2 HIS 138 -2.815 -14.370 -18.383 1102 H HIS 139 H HIS 139 -8.837 -13.142 -15.464 1103 HA HIS 139 HA HIS 139 -10.267 -13.129 -13.121 1104 HB2 HIS 139 2HB HIS 139 -12.318 -13.242 -14.517 1105 HB3 HIS 139 1HB HIS 139 -11.143 -12.071 -15.097 1106 HD1 HIS 139 HD1 HIS 139 -13.239 -14.786 -16.230 1107 HD2 HIS 139 HD2 HIS 139 -9.607 -13.128 -17.405 1108 HE1 HIS 139 HE1 HIS 139 -12.845 -15.599 -18.582 1109 HE2 HIS 139 HE2 HIS 139 -10.639 -14.583 -19.279 1110 H HIS 140 H HIS 140 -9.711 -15.881 -15.256 1111 HA HIS 140 HA HIS 140 -10.888 -17.568 -13.146 1112 HB2 HIS 140 2HB HIS 140 -12.072 -17.516 -15.467 1113 HB3 HIS 140 1HB HIS 140 -10.699 -18.478 -16.007 1114 HD1 HIS 140 HD1 HIS 140 -10.715 -20.949 -15.432 1115 HD2 HIS 140 HD2 HIS 140 -13.707 -18.802 -13.491 1116 HE1 HIS 140 HE1 HIS 140 -12.206 -22.670 -14.361 1117 HE2 HIS 140 HE2 HIS 140 -14.052 -21.355 -13.258 1118 H HIS 141 H HIS 141 -9.533 -19.038 -12.286 1119 HA HIS 141 HA HIS 141 -6.971 -19.491 -13.645 1120 HB2 HIS 141 2HB HIS 141 -5.893 -19.356 -11.307 1121 HB3 HIS 141 1HB HIS 141 -6.298 -17.851 -12.118 1122 HD1 HIS 141 HD1 HIS 141 -6.726 -19.594 -8.948 1123 HD2 HIS 141 HD2 HIS 141 -8.794 -16.693 -11.105 1124 HE1 HIS 141 HE1 HIS 141 -8.250 -18.469 -7.297 1125 HE2 HIS 141 HE2 HIS 141 -9.438 -16.663 -8.608 1126 H HIS 142 H HIS 142 -5.678 -21.198 -12.294 1127 HA HIS 142 HA HIS 142 -7.199 -23.595 -12.405 1128 HB2 HIS 142 2HB HIS 142 -4.454 -23.067 -11.234 1129 HB3 HIS 142 1HB HIS 142 -5.151 -24.667 -11.445 1130 HD1 HIS 142 HD1 HIS 142 -3.155 -25.280 -13.001 1131 HD2 HIS 142 HD2 HIS 142 -5.565 -22.195 -14.412 1132 HE1 HIS 142 HE1 HIS 142 -2.502 -24.953 -15.411 1133 HE2 HIS 142 HE2 HIS 142 -3.847 -22.961 -16.187 1134 H HIS 143 H HIS 143 -5.306 -22.527 -9.621 1135 HA HIS 143 HA HIS 143 -7.609 -22.437 -7.886 1136 HB2 HIS 143 2HB HIS 143 -5.484 -24.559 -7.586 1137 HB3 HIS 143 1HB HIS 143 -6.396 -23.975 -6.201 1138 HD1 HIS 143 HD1 HIS 143 -6.500 -26.413 -8.885 1139 HD2 HIS 143 HD2 HIS 143 -9.291 -24.431 -6.523 1140 HE1 HIS 143 HE1 HIS 143 -8.627 -27.742 -9.089 1141 HE2 HIS 143 HE2 HIS 143 -10.349 -26.408 -7.818 Start of MODEL 3 1 H1 MET 1 1H MET 1 -9.327 7.268 -13.324 2 H2 MET 1 2H MET 1 -10.974 7.267 -12.930 3 H3 MET 1 3H MET 1 -10.438 8.064 -14.325 4 HA MET 1 HA MET 1 -11.531 5.953 -14.798 5 HB2 MET 1 2HB MET 1 -8.602 6.175 -15.509 6 HB3 MET 1 1HB MET 1 -9.688 5.002 -16.238 7 HG2 MET 1 2HG MET 1 -9.441 6.881 -17.701 8 HG3 MET 1 1HG MET 1 -11.084 6.848 -17.068 9 HE1 MET 1 3HE MET 1 -10.345 10.677 -17.484 10 HE2 MET 1 1HE MET 1 -11.451 9.358 -17.877 11 HE3 MET 1 2HE MET 1 -9.811 9.356 -18.525 12 HA PRO 2 HA PRO 2 -9.099 2.619 -12.389 13 HB2 PRO 2 2HB PRO 2 -6.864 3.247 -11.046 14 HB3 PRO 2 1HB PRO 2 -6.816 2.832 -12.765 15 HG2 PRO 2 2HG PRO 2 -6.781 5.533 -11.469 16 HG3 PRO 2 1HG PRO 2 -5.785 4.921 -12.802 17 HD2 PRO 2 2HD PRO 2 -7.982 6.484 -13.182 18 HD3 PRO 2 1HD PRO 2 -7.434 5.278 -14.363 19 H VAL 3 H VAL 3 -8.689 2.248 -9.900 20 HA VAL 3 HA VAL 3 -10.622 3.760 -8.476 21 HB VAL 3 HB VAL 3 -8.496 2.005 -7.243 22 HG11 VAL 3 1HG1 VAL 3 -9.720 3.382 -5.657 23 HG12 VAL 3 2HG1 VAL 3 -10.171 1.686 -5.477 24 HG13 VAL 3 3HG1 VAL 3 -11.251 2.803 -6.312 25 HG21 VAL 3 3HG2 VAL 3 -11.197 1.201 -8.317 26 HG22 VAL 3 1HG2 VAL 3 -10.089 0.159 -7.426 27 HG23 VAL 3 2HG2 VAL 3 -9.635 0.774 -9.016 28 H GLU 4 H GLU 4 -10.201 5.883 -8.286 29 HA GLU 4 HA GLU 4 -7.802 6.671 -6.808 30 HB2 GLU 4 2HB GLU 4 -7.562 8.658 -8.290 31 HB3 GLU 4 1HB GLU 4 -7.275 7.141 -9.128 32 HG2 GLU 4 2HG GLU 4 -9.565 7.244 -10.038 33 HG3 GLU 4 1HG GLU 4 -9.781 8.806 -9.254 34 H LEU 5 H LEU 5 -8.159 8.224 -5.280 35 HA LEU 5 HA LEU 5 -10.941 9.025 -4.906 36 HB2 LEU 5 2HB LEU 5 -9.586 8.028 -3.033 37 HB3 LEU 5 1HB LEU 5 -8.589 9.471 -3.064 38 HG LEU 5 HG LEU 5 -10.577 10.835 -2.508 39 HD11 LEU 5 1HD1 LEU 5 -12.281 9.386 -3.471 40 HD12 LEU 5 2HD1 LEU 5 -12.628 9.731 -1.776 41 HD13 LEU 5 3HD1 LEU 5 -11.955 8.166 -2.238 42 HD21 LEU 5 3HD2 LEU 5 -10.763 10.127 -0.182 43 HD22 LEU 5 1HD2 LEU 5 -9.093 10.044 -0.738 44 HD23 LEU 5 2HD2 LEU 5 -10.047 8.568 -0.590 45 H ARG 6 H ARG 6 -11.592 10.909 -5.667 46 HA ARG 6 HA ARG 6 -9.623 12.918 -6.430 47 HB2 ARG 6 2HB ARG 6 -12.622 12.958 -6.816 48 HB3 ARG 6 1HB ARG 6 -11.449 14.011 -7.588 49 HG2 ARG 6 2HG ARG 6 -11.691 11.041 -8.006 50 HG3 ARG 6 1HG ARG 6 -12.236 12.295 -9.118 51 HD2 ARG 6 2HD ARG 6 -9.386 11.814 -8.254 52 HD3 ARG 6 1HD ARG 6 -10.083 11.349 -9.804 53 HE ARG 6 HE ARG 6 -10.415 14.134 -9.347 54 HH11 ARG 6 1HH1 ARG 6 -8.029 11.730 -10.276 55 HH12 ARG 6 2HH1 ARG 6 -7.033 12.881 -11.124 56 HH21 ARG 6 1HH2 ARG 6 -9.104 15.628 -10.472 57 HH22 ARG 6 2HH2 ARG 6 -7.646 15.087 -11.242 58 H ALA 7 H ALA 7 -10.245 15.251 -5.978 59 HA ALA 7 HA ALA 7 -10.343 15.741 -3.224 60 HB1 ALA 7 3HB ALA 7 -9.397 17.318 -4.847 61 HB2 ALA 7 1HB ALA 7 -10.595 18.093 -3.808 62 HB3 ALA 7 2HB ALA 7 -11.016 17.649 -5.463 63 H ASN 8 H ASN 8 -12.868 16.350 -5.674 64 HA ASN 8 HA ASN 8 -14.883 16.409 -3.565 65 HB2 ASN 8 2HB ASN 8 -14.940 16.985 -6.512 66 HB3 ASN 8 1HB ASN 8 -16.439 16.682 -5.639 67 HD21 ASN 8 1HD2 ASN 8 -17.251 18.715 -5.869 68 HD22 ASN 8 2HD2 ASN 8 -16.579 20.104 -5.079 69 H TRP 9 H TRP 9 -14.435 14.191 -2.970 70 HA TRP 9 HA TRP 9 -15.202 12.112 -4.816 71 HB2 TRP 9 2HB TRP 9 -14.847 10.617 -2.807 72 HB3 TRP 9 1HB TRP 9 -13.438 11.532 -3.327 73 HD1 TRP 9 HD1 TRP 9 -12.433 13.291 -1.644 74 HE1 TRP 9 HE1 TRP 9 -12.864 13.797 0.842 75 HE3 TRP 9 HE3 TRP 9 -16.770 10.654 -1.015 76 HZ2 TRP 9 HZ2 TRP 9 -14.776 13.152 2.809 77 HZ3 TRP 9 HZ3 TRP 9 -17.832 10.649 1.204 78 HH2 TRP 9 HH2 TRP 9 -16.855 11.871 3.073 79 H SER 10 H SER 10 -16.795 10.430 -4.056 80 HA SER 10 HA SER 10 -19.031 11.659 -2.606 81 HB2 SER 10 2HB SER 10 -20.563 10.384 -4.175 82 HB3 SER 10 1HB SER 10 -19.700 11.743 -4.898 83 HG SER 10 HG SER 10 -18.481 10.391 -6.037 84 H GLU 11 H GLU 11 -20.728 9.704 -2.219 85 HA GLU 11 HA GLU 11 -19.480 8.258 -0.161 86 HB2 GLU 11 2HB GLU 11 -22.184 7.939 -1.458 87 HB3 GLU 11 1HB GLU 11 -21.690 7.083 -0.003 88 HG2 GLU 11 2HG GLU 11 -21.693 8.991 1.286 89 HG3 GLU 11 1HG GLU 11 -21.498 10.056 -0.104 90 H GLU 12 H GLU 12 -20.795 7.072 -3.273 91 HA GLU 12 HA GLU 12 -19.909 4.401 -2.719 92 HB2 GLU 12 2HB GLU 12 -21.903 5.054 -4.165 93 HB3 GLU 12 1HB GLU 12 -20.739 5.478 -5.414 94 HG2 GLU 12 2HG GLU 12 -20.258 2.833 -4.345 95 HG3 GLU 12 1HG GLU 12 -21.891 3.000 -4.984 96 H ASP 13 H ASP 13 -18.689 7.164 -4.458 97 HA ASP 13 HA ASP 13 -16.576 5.942 -5.856 98 HB2 ASP 13 2HB ASP 13 -17.380 8.264 -6.238 99 HB3 ASP 13 1HB ASP 13 -16.682 8.738 -4.695 100 H LEU 14 H LEU 14 -16.630 7.565 -2.693 101 HA LEU 14 HA LEU 14 -13.992 6.982 -1.940 102 HB2 LEU 14 2HB LEU 14 -15.309 8.632 -0.760 103 HB3 LEU 14 1HB LEU 14 -16.464 7.412 -0.262 104 HG LEU 14 HG LEU 14 -14.635 6.327 1.067 105 HD11 LEU 14 1HD1 LEU 14 -13.158 8.872 0.422 106 HD12 LEU 14 2HD1 LEU 14 -12.721 7.250 -0.116 107 HD13 LEU 14 3HD1 LEU 14 -12.658 7.656 1.599 108 HD21 LEU 14 3HD2 LEU 14 -14.744 7.935 2.891 109 HD22 LEU 14 1HD2 LEU 14 -16.311 7.765 2.100 110 HD23 LEU 14 2HD2 LEU 14 -15.306 9.177 1.772 111 H GLU 15 H GLU 15 -17.012 5.179 -1.402 112 HA GLU 15 HA GLU 15 -15.843 3.205 0.238 113 HB2 GLU 15 2HB GLU 15 -18.324 3.718 -0.035 114 HB3 GLU 15 1HB GLU 15 -18.253 2.763 -1.513 115 HG2 GLU 15 2HG GLU 15 -17.465 0.839 -0.220 116 HG3 GLU 15 1HG GLU 15 -17.572 1.795 1.255 117 H THR 16 H THR 16 -16.255 3.461 -3.260 118 HA THR 16 HA THR 16 -15.377 0.862 -3.907 119 HB THR 16 HB THR 16 -15.225 3.431 -5.500 120 HG1 THR 16 HG1 THR 16 -17.288 3.004 -5.715 121 HG21 THR 16 3HG2 THR 16 -14.803 0.584 -6.428 122 HG22 THR 16 1HG2 THR 16 -13.573 1.845 -6.355 123 HG23 THR 16 2HG2 THR 16 -14.925 1.997 -7.477 124 H VAL 17 H VAL 17 -13.662 3.888 -3.339 125 HA VAL 17 HA VAL 17 -11.056 3.032 -3.929 126 HB VAL 17 HB VAL 17 -12.062 5.082 -1.947 127 HG11 VAL 17 1HG1 VAL 17 -9.850 4.362 -1.244 128 HG12 VAL 17 2HG1 VAL 17 -9.778 5.990 -1.917 129 HG13 VAL 17 3HG1 VAL 17 -9.229 4.616 -2.874 130 HG21 VAL 17 3HG2 VAL 17 -12.591 5.631 -4.229 131 HG22 VAL 17 1HG2 VAL 17 -10.925 5.326 -4.727 132 HG23 VAL 17 2HG2 VAL 17 -11.294 6.685 -3.665 133 H ILE 18 H ILE 18 -12.777 3.146 -0.828 134 HA ILE 18 HA ILE 18 -10.828 1.907 0.750 135 HB ILE 18 HB ILE 18 -13.834 1.865 1.091 136 HG12 ILE 18 2HG1 ILE 18 -11.777 3.754 2.258 137 HG13 ILE 18 1HG1 ILE 18 -12.819 4.136 0.889 138 HG21 ILE 18 1HG2 ILE 18 -11.639 1.395 3.107 139 HG22 ILE 18 2HG2 ILE 18 -12.758 0.186 2.477 140 HG23 ILE 18 3HG2 ILE 18 -13.362 1.511 3.471 141 HD11 ILE 18 3HD1 ILE 18 -14.780 3.868 2.326 142 HD12 ILE 18 1HD1 ILE 18 -13.680 5.107 2.929 143 HD13 ILE 18 2HD1 ILE 18 -13.723 3.519 3.694 144 H ARG 19 H ARG 19 -13.555 0.554 -1.039 145 HA ARG 19 HA ARG 19 -13.370 -2.102 -0.195 146 HB2 ARG 19 2HB ARG 19 -15.252 -1.022 -1.479 147 HB3 ARG 19 1HB ARG 19 -14.257 -1.144 -2.920 148 HG2 ARG 19 2HG ARG 19 -15.796 -2.948 -2.940 149 HG3 ARG 19 1HG ARG 19 -14.202 -3.615 -2.582 150 HD2 ARG 19 2HD ARG 19 -14.752 -3.714 -0.219 151 HD3 ARG 19 1HD ARG 19 -16.320 -2.972 -0.534 152 HE ARG 19 HE ARG 19 -15.730 -5.483 -1.898 153 HH11 ARG 19 1HH1 ARG 19 -17.387 -3.818 0.692 154 HH12 ARG 19 2HH1 ARG 19 -18.513 -5.102 0.986 155 HH21 ARG 19 1HH2 ARG 19 -17.221 -7.177 -1.539 156 HH22 ARG 19 2HH2 ARG 19 -18.397 -7.035 -0.262 157 H ALA 20 H ALA 20 -11.663 -0.361 -2.730 158 HA ALA 20 HA ALA 20 -10.565 -2.655 -4.006 159 HB1 ALA 20 3HB ALA 20 -9.155 -1.094 -5.206 160 HB2 ALA 20 1HB ALA 20 -9.583 0.190 -4.074 161 HB3 ALA 20 2HB ALA 20 -10.811 -0.495 -5.137 162 H VAL 21 H VAL 21 -9.419 -0.456 -1.504 163 HA VAL 21 HA VAL 21 -6.775 -1.400 -1.348 164 HB VAL 21 HB VAL 21 -8.463 -0.219 0.868 165 HG11 VAL 21 1HG1 VAL 21 -5.466 -0.437 0.605 166 HG12 VAL 21 2HG1 VAL 21 -6.479 -1.354 1.722 167 HG13 VAL 21 3HG1 VAL 21 -6.331 0.395 1.896 168 HG21 VAL 21 3HG2 VAL 21 -8.348 1.252 -1.073 169 HG22 VAL 21 1HG2 VAL 21 -6.590 1.111 -1.091 170 HG23 VAL 21 2HG2 VAL 21 -7.398 1.907 0.260 171 H TYR 22 H TYR 22 -9.724 -2.379 0.347 172 HA TYR 22 HA TYR 22 -8.411 -4.358 1.936 173 HB2 TYR 22 2HB TYR 22 -11.317 -3.813 1.344 174 HB3 TYR 22 1HB TYR 22 -10.795 -5.146 2.366 175 HD1 TYR 22 HD2 TYR 22 -8.792 -4.133 4.078 176 HD2 TYR 22 HD1 TYR 22 -12.223 -2.109 2.597 177 HE1 TYR 22 HE2 TYR 22 -8.735 -2.630 6.020 178 HE2 TYR 22 HE1 TYR 22 -12.179 -0.602 4.539 179 HH TYR 22 HH TYR 22 -11.287 -0.705 6.924 180 H ARG 23 H ARG 23 -10.704 -4.600 -0.792 181 HA ARG 23 HA ARG 23 -11.252 -6.298 -2.202 182 HB2 ARG 23 2HB ARG 23 -8.797 -6.292 -2.717 183 HB3 ARG 23 1HB ARG 23 -8.569 -7.508 -1.469 184 HG2 ARG 23 2HG ARG 23 -8.875 -9.052 -3.024 185 HG3 ARG 23 1HG ARG 23 -10.561 -8.540 -3.127 186 HD2 ARG 23 2HD ARG 23 -8.297 -7.347 -4.724 187 HD3 ARG 23 1HD ARG 23 -9.394 -8.588 -5.320 188 HE ARG 23 HE ARG 23 -10.821 -6.316 -4.379 189 HH11 ARG 23 1HH1 ARG 23 -8.905 -7.462 -7.077 190 HH12 ARG 23 2HH1 ARG 23 -9.670 -6.423 -8.240 191 HH21 ARG 23 1HH2 ARG 23 -11.842 -4.949 -5.898 192 HH22 ARG 23 2HH2 ARG 23 -11.350 -4.993 -7.564 193 H GLN 24 H GLN 24 -11.354 -6.385 0.883 194 HA GLN 24 HA GLN 24 -11.655 -9.228 1.397 195 HB2 GLN 24 2HB GLN 24 -10.525 -7.810 3.059 196 HB3 GLN 24 1HB GLN 24 -11.969 -6.822 3.211 197 HG2 GLN 24 2HG GLN 24 -11.679 -8.395 5.068 198 HG3 GLN 24 1HG GLN 24 -13.181 -8.654 4.182 199 HE21 GLN 24 1HE2 GLN 24 -13.317 -10.749 4.977 200 HE22 GLN 24 2HE2 GLN 24 -12.322 -12.028 4.348 201 H VAL 25 H VAL 25 -13.456 -9.901 0.361 202 HA VAL 25 HA VAL 25 -15.885 -8.380 0.318 203 HB VAL 25 HB VAL 25 -15.511 -11.282 -0.432 204 HG11 VAL 25 1HG1 VAL 25 -17.576 -9.256 -1.273 205 HG12 VAL 25 2HG1 VAL 25 -17.834 -10.628 -0.194 206 HG13 VAL 25 3HG1 VAL 25 -17.440 -10.902 -1.891 207 HG21 VAL 25 3HG2 VAL 25 -13.902 -9.912 -1.640 208 HG22 VAL 25 1HG2 VAL 25 -15.195 -8.829 -2.158 209 HG23 VAL 25 2HG2 VAL 25 -15.162 -10.499 -2.725 210 H LEU 26 H LEU 26 -14.601 -11.010 2.228 211 HA LEU 26 HA LEU 26 -17.135 -11.616 3.463 212 HB2 LEU 26 2HB LEU 26 -14.339 -12.525 4.170 213 HB3 LEU 26 1HB LEU 26 -15.805 -13.122 4.918 214 HG LEU 26 HG LEU 26 -16.494 -13.921 2.595 215 HD11 LEU 26 1HD1 LEU 26 -13.557 -13.516 2.042 216 HD12 LEU 26 2HD1 LEU 26 -14.870 -12.582 1.324 217 HD13 LEU 26 3HD1 LEU 26 -14.728 -14.307 0.987 218 HD21 LEU 26 3HD2 LEU 26 -15.727 -15.400 4.391 219 HD22 LEU 26 1HD2 LEU 26 -14.059 -15.158 3.871 220 HD23 LEU 26 2HD2 LEU 26 -15.207 -15.966 2.804 221 H GLY 27 H GLY 27 -17.775 -9.675 4.422 222 HA2 GLY 27 2HA GLY 27 -16.013 -8.458 6.406 223 HA3 GLY 27 1HA GLY 27 -17.581 -7.854 5.889 224 H ASN 28 H ASN 28 -18.700 -10.626 6.263 225 HA ASN 28 HA ASN 28 -19.942 -11.702 7.825 226 HB2 ASN 28 2HB ASN 28 -17.435 -11.165 9.406 227 HB3 ASN 28 1HB ASN 28 -18.811 -11.985 10.131 228 HD21 ASN 28 1HD2 ASN 28 -17.987 -12.385 6.757 229 HD22 ASN 28 2HD2 ASN 28 -17.448 -14.027 6.885 230 H ASP 29 H ASP 29 -21.118 -9.587 7.418 231 HA ASP 29 HA ASP 29 -21.190 -7.529 9.332 232 HB2 ASP 29 2HB ASP 29 -23.490 -8.384 7.569 233 HB3 ASP 29 1HB ASP 29 -23.170 -6.778 8.210 234 H TYR 30 H TYR 30 -21.416 -8.289 11.422 235 HA TYR 30 HA TYR 30 -24.023 -8.597 12.396 236 HB2 TYR 30 2HB TYR 30 -23.704 -10.880 11.330 237 HB3 TYR 30 1HB TYR 30 -22.469 -11.186 12.545 238 HD1 TYR 30 HD1 TYR 30 -26.061 -10.358 12.124 239 HD2 TYR 30 HD2 TYR 30 -23.072 -11.967 14.685 240 HE1 TYR 30 HE1 TYR 30 -27.808 -11.101 13.684 241 HE2 TYR 30 HE2 TYR 30 -24.812 -12.719 16.251 242 HH TYR 30 HH TYR 30 -27.109 -12.168 16.852 243 H VAL 31 H VAL 31 -20.614 -9.348 12.917 244 HA VAL 31 HA VAL 31 -20.837 -8.253 15.619 245 HB VAL 31 HB VAL 31 -21.067 -10.720 15.794 246 HG11 VAL 31 1HG1 VAL 31 -18.287 -10.771 14.634 247 HG12 VAL 31 2HG1 VAL 31 -19.754 -11.385 13.874 248 HG13 VAL 31 3HG1 VAL 31 -19.130 -12.153 15.334 249 HG21 VAL 31 3HG2 VAL 31 -19.378 -11.057 17.528 250 HG22 VAL 31 1HG2 VAL 31 -20.110 -9.458 17.650 251 HG23 VAL 31 2HG2 VAL 31 -18.499 -9.641 16.954 252 H MET 32 H MET 32 -18.892 -7.442 16.469 253 HA MET 32 HA MET 32 -17.039 -6.432 14.574 254 HB2 MET 32 2HB MET 32 -15.816 -5.625 16.636 255 HB3 MET 32 1HB MET 32 -17.470 -5.068 16.452 256 HG2 MET 32 2HG MET 32 -17.241 -5.593 18.715 257 HG3 MET 32 1HG MET 32 -18.131 -6.943 18.019 258 HE1 MET 32 3HE MET 32 -16.743 -7.005 20.870 259 HE2 MET 32 1HE MET 32 -15.981 -8.596 20.856 260 HE3 MET 32 2HE MET 32 -17.606 -8.391 20.203 261 H ALA 33 H ALA 33 -14.596 -6.618 15.933 262 HA ALA 33 HA ALA 33 -12.711 -7.863 16.098 263 HB1 ALA 33 3HB ALA 33 -12.751 -10.254 16.447 264 HB2 ALA 33 1HB ALA 33 -14.453 -10.322 15.992 265 HB3 ALA 33 2HB ALA 33 -13.966 -9.481 17.463 266 H SER 34 H SER 34 -15.051 -9.151 13.754 267 HA SER 34 HA SER 34 -13.142 -9.760 11.754 268 HB2 SER 34 2HB SER 34 -15.983 -8.834 11.264 269 HB3 SER 34 1HB SER 34 -15.013 -9.924 10.273 270 HG SER 34 HG SER 34 -16.708 -10.621 12.101 271 H GLU 35 H GLU 35 -15.090 -6.921 12.504 272 HA GLU 35 HA GLU 35 -13.545 -5.281 10.649 273 HB2 GLU 35 2HB GLU 35 -15.952 -4.936 10.604 274 HB3 GLU 35 1HB GLU 35 -15.982 -4.675 12.342 275 HG2 GLU 35 2HG GLU 35 -16.180 -2.589 11.086 276 HG3 GLU 35 1HG GLU 35 -14.734 -2.621 12.096 277 H ARG 36 H ARG 36 -11.704 -4.497 11.409 278 HA ARG 36 HA ARG 36 -11.652 -3.352 14.109 279 HB2 ARG 36 2HB ARG 36 -9.716 -5.372 12.995 280 HB3 ARG 36 1HB ARG 36 -9.256 -4.273 14.287 281 HG2 ARG 36 2HG ARG 36 -11.077 -5.166 15.674 282 HG3 ARG 36 1HG ARG 36 -11.489 -6.294 14.380 283 HD2 ARG 36 2HD ARG 36 -10.115 -7.349 16.119 284 HD3 ARG 36 1HD ARG 36 -9.302 -7.332 14.555 285 HE ARG 36 HE ARG 36 -8.606 -5.077 16.178 286 HH11 ARG 36 1HH1 ARG 36 -7.934 -8.468 15.649 287 HH12 ARG 36 2HH1 ARG 36 -6.292 -8.365 16.207 288 HH21 ARG 36 1HH2 ARG 36 -6.467 -4.948 16.978 289 HH22 ARG 36 2HH2 ARG 36 -5.463 -6.373 16.979 290 H LEU 37 H LEU 37 -11.547 -2.607 11.061 291 HA LEU 37 HA LEU 37 -9.259 -0.764 11.334 292 HB2 LEU 37 2HB LEU 37 -10.226 -2.256 8.910 293 HB3 LEU 37 1HB LEU 37 -9.185 -0.851 8.793 294 HG LEU 37 HG LEU 37 -8.500 -3.408 10.238 295 HD11 LEU 37 1HD1 LEU 37 -6.892 -3.744 8.433 296 HD12 LEU 37 2HD1 LEU 37 -7.493 -2.295 7.626 297 HD13 LEU 37 3HD1 LEU 37 -8.546 -3.698 7.818 298 HD21 LEU 37 3HD2 LEU 37 -6.263 -2.433 10.418 299 HD22 LEU 37 1HD2 LEU 37 -7.465 -1.457 11.262 300 HD23 LEU 37 2HD2 LEU 37 -6.857 -0.941 9.689 301 H VAL 38 H VAL 38 -12.394 -0.808 11.596 302 HA VAL 38 HA VAL 38 -13.452 1.080 9.847 303 HB VAL 38 HB VAL 38 -14.830 -0.245 11.393 304 HG11 VAL 38 1HG1 VAL 38 -13.744 1.561 13.546 305 HG12 VAL 38 2HG1 VAL 38 -13.418 -0.163 13.370 306 HG13 VAL 38 3HG1 VAL 38 -15.050 0.393 13.745 307 HG21 VAL 38 3HG2 VAL 38 -16.421 1.503 12.026 308 HG22 VAL 38 1HG2 VAL 38 -15.784 1.763 10.403 309 HG23 VAL 38 2HG2 VAL 38 -15.183 2.728 11.750 310 H SER 39 H SER 39 -11.357 1.483 12.599 311 HA SER 39 HA SER 39 -11.609 4.231 13.042 312 HB2 SER 39 2HB SER 39 -9.018 2.683 13.198 313 HB3 SER 39 1HB SER 39 -9.504 4.084 14.154 314 HG SER 39 HG SER 39 -9.686 2.026 15.257 315 H ALA 40 H ALA 40 -9.460 2.426 10.860 316 HA ALA 40 HA ALA 40 -8.191 4.713 9.760 317 HB1 ALA 40 3HB ALA 40 -8.448 1.926 8.632 318 HB2 ALA 40 1HB ALA 40 -7.155 2.510 9.677 319 HB3 ALA 40 2HB ALA 40 -7.341 3.170 8.053 320 H GLU 41 H GLU 41 -10.972 2.762 8.825 321 HA GLU 41 HA GLU 41 -11.534 3.956 6.359 322 HB2 GLU 41 2HB GLU 41 -12.613 1.893 7.336 323 HB3 GLU 41 1HB GLU 41 -13.574 2.956 8.353 324 HG2 GLU 41 2HG GLU 41 -13.707 3.667 5.540 325 HG3 GLU 41 1HG GLU 41 -14.258 2.024 5.859 326 H SER 42 H SER 42 -12.549 4.832 9.635 327 HA SER 42 HA SER 42 -14.157 7.034 8.903 328 HB2 SER 42 2HB SER 42 -12.686 6.563 11.507 329 HB3 SER 42 1HB SER 42 -14.054 7.649 11.264 330 HG SER 42 HG SER 42 -14.149 4.846 10.793 331 H LEU 43 H LEU 43 -10.717 6.663 9.443 332 HA LEU 43 HA LEU 43 -10.065 9.415 9.640 333 HB2 LEU 43 2HB LEU 43 -8.392 7.102 8.648 334 HB3 LEU 43 1HB LEU 43 -7.776 8.699 9.020 335 HG LEU 43 HG LEU 43 -9.039 6.819 11.019 336 HD11 LEU 43 1HD1 LEU 43 -6.789 6.541 11.893 337 HD12 LEU 43 2HD1 LEU 43 -6.149 7.587 10.626 338 HD13 LEU 43 3HD1 LEU 43 -6.862 6.030 10.206 339 HD21 LEU 43 3HD2 LEU 43 -7.622 9.453 11.418 340 HD22 LEU 43 1HD2 LEU 43 -8.250 8.400 12.687 341 HD23 LEU 43 2HD2 LEU 43 -9.361 9.188 11.567 342 H LEU 44 H LEU 44 -10.198 7.163 6.907 343 HA LEU 44 HA LEU 44 -9.388 9.142 4.994 344 HB2 LEU 44 2HB LEU 44 -9.000 6.703 4.716 345 HB3 LEU 44 1HB LEU 44 -10.730 6.475 4.537 346 HG LEU 44 HG LEU 44 -10.672 7.915 2.509 347 HD11 LEU 44 1HD1 LEU 44 -8.679 9.213 3.069 348 HD12 LEU 44 2HD1 LEU 44 -8.532 8.448 1.488 349 HD13 LEU 44 3HD1 LEU 44 -7.684 7.768 2.876 350 HD21 LEU 44 3HD2 LEU 44 -10.584 5.496 2.294 351 HD22 LEU 44 1HD2 LEU 44 -8.828 5.531 2.463 352 HD23 LEU 44 2HD2 LEU 44 -9.595 6.269 1.056 353 H ARG 45 H ARG 45 -12.424 7.849 6.171 354 HA ARG 45 HA ARG 45 -14.106 8.982 4.208 355 HB2 ARG 45 2HB ARG 45 -14.664 7.159 5.902 356 HB3 ARG 45 1HB ARG 45 -14.875 8.452 7.074 357 HG2 ARG 45 2HG ARG 45 -16.647 9.413 5.729 358 HG3 ARG 45 1HG ARG 45 -16.412 8.167 4.501 359 HD2 ARG 45 2HD ARG 45 -18.258 7.464 5.794 360 HD3 ARG 45 1HD ARG 45 -16.894 6.474 6.313 361 HE ARG 45 HE ARG 45 -17.754 8.854 7.830 362 HH11 ARG 45 1HH1 ARG 45 -16.767 5.486 7.710 363 HH12 ARG 45 2HH1 ARG 45 -17.043 5.225 9.412 364 HH21 ARG 45 1HH2 ARG 45 -18.090 8.504 10.068 365 HH22 ARG 45 2HH2 ARG 45 -17.773 6.932 10.741 366 H ASN 46 H ASN 46 -12.857 10.167 7.278 367 HA ASN 46 HA ASN 46 -14.236 12.678 7.135 368 HB2 ASN 46 2HB ASN 46 -13.525 11.838 9.301 369 HB3 ASN 46 1HB ASN 46 -11.848 11.788 8.772 370 HD21 ASN 46 1HD2 ASN 46 -14.521 13.858 9.636 371 HD22 ASN 46 2HD2 ASN 46 -13.570 15.268 9.977 372 H GLY 47 H GLY 47 -11.198 11.390 6.029 373 HA2 GLY 47 2HA GLY 47 -9.916 12.221 4.269 374 HA3 GLY 47 1HA GLY 47 -10.810 13.731 4.356 375 H LYS 48 H LYS 48 -9.327 12.230 7.152 376 HA LYS 48 HA LYS 48 -7.587 14.569 7.386 377 HB2 LYS 48 2HB LYS 48 -7.270 13.909 9.712 378 HB3 LYS 48 1HB LYS 48 -8.970 14.098 9.315 379 HG2 LYS 48 2HG LYS 48 -9.277 11.728 9.235 380 HG3 LYS 48 1HG LYS 48 -7.542 11.455 9.437 381 HD2 LYS 48 2HD LYS 48 -8.585 11.135 11.562 382 HD3 LYS 48 1HD LYS 48 -7.684 12.652 11.611 383 HE2 LYS 48 2HE LYS 48 -9.758 13.891 11.206 384 HE3 LYS 48 1HE LYS 48 -10.656 12.373 11.168 385 HZ1 LYS 48 3HZ LYS 48 -10.795 13.513 13.321 386 HZ2 LYS 48 1HZ LYS 48 -9.114 13.369 13.504 387 HZ3 LYS 48 2HZ LYS 48 -10.083 11.979 13.460 388 H ILE 49 H ILE 49 -7.431 11.477 6.243 389 HA ILE 49 HA ILE 49 -4.501 11.565 6.388 390 HB ILE 49 HB ILE 49 -4.348 9.145 6.469 391 HG12 ILE 49 2HG1 ILE 49 -7.346 9.060 6.843 392 HG13 ILE 49 1HG1 ILE 49 -6.561 8.781 5.292 393 HG21 ILE 49 1HG2 ILE 49 -6.111 10.225 8.665 394 HG22 ILE 49 2HG2 ILE 49 -4.352 10.295 8.601 395 HG23 ILE 49 3HG2 ILE 49 -5.164 8.738 8.757 396 HD11 ILE 49 3HD1 ILE 49 -7.113 6.688 6.363 397 HD12 ILE 49 1HD1 ILE 49 -6.190 7.150 7.793 398 HD13 ILE 49 2HD1 ILE 49 -5.363 6.876 6.260 399 H THR 50 H THR 50 -3.508 10.303 4.584 400 HA THR 50 HA THR 50 -5.047 10.687 2.135 401 HB THR 50 HB THR 50 -2.864 10.292 0.999 402 HG1 THR 50 HG1 THR 50 -1.024 10.469 2.640 403 HG21 THR 50 3HG2 THR 50 -1.808 12.394 1.712 404 HG22 THR 50 1HG2 THR 50 -2.814 12.408 3.161 405 HG23 THR 50 2HG2 THR 50 -3.558 12.569 1.571 406 H VAL 51 H VAL 51 -4.553 8.932 0.410 407 HA VAL 51 HA VAL 51 -5.532 6.454 1.391 408 HB VAL 51 HB VAL 51 -4.366 7.127 -1.324 409 HG11 VAL 51 1HG1 VAL 51 -5.532 5.126 -2.121 410 HG12 VAL 51 2HG1 VAL 51 -6.027 4.753 -0.471 411 HG13 VAL 51 3HG1 VAL 51 -4.320 4.714 -0.907 412 HG21 VAL 51 3HG2 VAL 51 -7.220 7.014 -0.352 413 HG22 VAL 51 1HG2 VAL 51 -6.718 7.285 -2.022 414 HG23 VAL 51 2HG2 VAL 51 -6.320 8.469 -0.776 415 H ARG 52 H ARG 52 -2.363 7.719 0.635 416 HA ARG 52 HA ARG 52 -0.805 5.427 0.592 417 HB2 ARG 52 2HB ARG 52 -0.058 7.833 0.249 418 HB3 ARG 52 1HB ARG 52 -0.039 7.992 2.001 419 HG2 ARG 52 2HG ARG 52 1.526 5.938 1.933 420 HG3 ARG 52 1HG ARG 52 1.734 6.361 0.233 421 HD2 ARG 52 2HD ARG 52 2.366 8.049 2.645 422 HD3 ARG 52 1HD ARG 52 3.499 7.386 1.470 423 HE ARG 52 HE ARG 52 1.541 9.167 0.322 424 HH11 ARG 52 1HH1 ARG 52 4.701 8.945 1.841 425 HH12 ARG 52 2HH1 ARG 52 5.213 10.504 1.279 426 HH21 ARG 52 1HH2 ARG 52 2.216 11.208 -0.396 427 HH22 ARG 52 2HH2 ARG 52 3.809 11.793 0.012 428 H GLU 53 H GLU 53 -1.769 7.392 3.385 429 HA GLU 53 HA GLU 53 -0.555 5.765 5.353 430 HB2 GLU 53 2HB GLU 53 -1.226 8.171 5.614 431 HB3 GLU 53 1HB GLU 53 -2.901 7.647 5.675 432 HG2 GLU 53 2HG GLU 53 -2.158 8.024 7.895 433 HG3 GLU 53 1HG GLU 53 -2.346 6.288 7.668 434 H PHE 54 H PHE 54 -3.800 5.910 3.986 435 HA PHE 54 HA PHE 54 -5.109 4.193 5.759 436 HB2 PHE 54 2HB PHE 54 -6.273 5.612 4.118 437 HB3 PHE 54 1HB PHE 54 -5.643 4.620 2.809 438 HD1 PHE 54 HD1 PHE 54 -7.720 4.399 5.892 439 HD2 PHE 54 HD2 PHE 54 -6.882 2.841 2.022 440 HE1 PHE 54 HE1 PHE 54 -9.686 2.933 6.062 441 HE2 PHE 54 HE2 PHE 54 -8.847 1.367 2.187 442 HZ PHE 54 HZ PHE 54 -10.251 1.414 4.209 443 H VAL 55 H VAL 55 -3.525 3.443 2.654 444 HA VAL 55 HA VAL 55 -4.050 0.683 2.682 445 HB VAL 55 HB VAL 55 -1.706 2.115 1.412 446 HG11 VAL 55 1HG1 VAL 55 -1.314 -0.285 1.583 447 HG12 VAL 55 2HG1 VAL 55 -1.601 0.184 -0.093 448 HG13 VAL 55 3HG1 VAL 55 -2.877 -0.605 0.834 449 HG21 VAL 55 3HG2 VAL 55 -3.823 3.008 0.642 450 HG22 VAL 55 1HG2 VAL 55 -4.411 1.381 0.303 451 HG23 VAL 55 2HG2 VAL 55 -3.072 2.047 -0.634 452 H ARG 56 H ARG 56 -1.336 2.551 3.957 453 HA ARG 56 HA ARG 56 0.280 0.434 4.818 454 HB2 ARG 56 2HB ARG 56 1.201 2.621 4.777 455 HB3 ARG 56 1HB ARG 56 -0.065 3.259 5.811 456 HG2 ARG 56 2HG ARG 56 0.815 1.956 7.686 457 HG3 ARG 56 1HG ARG 56 2.092 1.328 6.640 458 HD2 ARG 56 2HD ARG 56 3.320 3.166 6.907 459 HD3 ARG 56 1HD ARG 56 1.953 4.209 6.517 460 HE ARG 56 HE ARG 56 1.379 3.520 9.025 461 HH11 ARG 56 1HH1 ARG 56 4.416 4.535 7.618 462 HH12 ARG 56 2HH1 ARG 56 4.941 5.389 9.040 463 HH21 ARG 56 1HH2 ARG 56 2.052 4.639 10.894 464 HH22 ARG 56 2HH2 ARG 56 3.602 5.429 10.918 465 H ALA 57 H ALA 57 -2.211 2.254 6.580 466 HA ALA 57 HA ALA 57 -1.984 0.974 9.041 467 HB1 ALA 57 3HB ALA 57 -4.254 1.791 9.483 468 HB2 ALA 57 1HB ALA 57 -4.453 2.154 7.769 469 HB3 ALA 57 2HB ALA 57 -3.255 3.028 8.721 470 H VAL 58 H VAL 58 -3.945 0.141 6.216 471 HA VAL 58 HA VAL 58 -5.320 -2.018 7.421 472 HB VAL 58 HB VAL 58 -4.732 -1.503 4.502 473 HG11 VAL 58 1HG1 VAL 58 -5.269 -3.842 4.883 474 HG12 VAL 58 2HG1 VAL 58 -6.603 -3.033 4.060 475 HG13 VAL 58 3HG1 VAL 58 -6.710 -3.381 5.787 476 HG21 VAL 58 3HG2 VAL 58 -7.184 -0.900 6.152 477 HG22 VAL 58 1HG2 VAL 58 -6.998 -0.608 4.424 478 HG23 VAL 58 2HG2 VAL 58 -6.010 0.285 5.579 479 H ALA 59 H ALA 59 -2.429 -1.881 5.366 480 HA ALA 59 HA ALA 59 -2.144 -4.643 4.994 481 HB1 ALA 59 3HB ALA 59 0.092 -4.142 4.197 482 HB2 ALA 59 1HB ALA 59 0.001 -2.531 4.907 483 HB3 ALA 59 2HB ALA 59 -1.070 -2.971 3.575 484 H LYS 60 H LYS 60 -1.114 -2.606 7.650 485 HA LYS 60 HA LYS 60 0.632 -4.709 8.680 486 HB2 LYS 60 2HB LYS 60 0.026 -1.954 9.764 487 HB3 LYS 60 1HB LYS 60 1.200 -3.072 10.439 488 HG2 LYS 60 2HG LYS 60 2.423 -2.974 8.262 489 HG3 LYS 60 1HG LYS 60 1.313 -1.690 7.771 490 HD2 LYS 60 2HD LYS 60 2.003 -0.363 9.721 491 HD3 LYS 60 1HD LYS 60 3.122 -1.644 10.188 492 HE2 LYS 60 2HE LYS 60 4.222 -1.334 7.939 493 HE3 LYS 60 1HE LYS 60 3.235 0.117 7.750 494 HZ1 LYS 60 3HZ LYS 60 5.311 0.803 8.629 495 HZ2 LYS 60 1HZ LYS 60 5.299 -0.417 9.814 496 HZ3 LYS 60 2HZ LYS 60 4.210 0.875 9.918 497 H SER 61 H SER 61 -2.558 -4.595 8.714 498 HA SER 61 HA SER 61 -2.788 -4.879 11.633 499 HB2 SER 61 2HB SER 61 -4.805 -3.795 9.681 500 HB3 SER 61 1HB SER 61 -5.159 -4.147 11.373 501 HG SER 61 HG SER 61 -3.724 -2.073 10.243 502 H GLU 62 H GLU 62 -2.284 -7.208 11.299 503 HA GLU 62 HA GLU 62 -3.151 -9.092 12.217 504 HB2 GLU 62 2HB GLU 62 -4.759 -7.436 13.229 505 HB3 GLU 62 1HB GLU 62 -5.883 -7.864 11.947 506 HG2 GLU 62 2HG GLU 62 -6.500 -9.126 13.831 507 HG3 GLU 62 1HG GLU 62 -5.701 -10.245 12.728 508 H LEU 63 H LEU 63 -5.531 -8.071 9.757 509 HA LEU 63 HA LEU 63 -6.879 -10.399 9.473 510 HB2 LEU 63 2HB LEU 63 -6.227 -8.451 7.272 511 HB3 LEU 63 1HB LEU 63 -7.509 -9.647 7.212 512 HG LEU 63 HG LEU 63 -7.347 -7.337 9.155 513 HD11 LEU 63 1HD1 LEU 63 -7.849 -6.617 6.886 514 HD12 LEU 63 2HD1 LEU 63 -9.271 -6.472 7.919 515 HD13 LEU 63 3HD1 LEU 63 -9.142 -7.811 6.780 516 HD21 LEU 63 3HD2 LEU 63 -8.431 -9.319 10.118 517 HD22 LEU 63 1HD2 LEU 63 -9.528 -9.383 8.737 518 HD23 LEU 63 2HD2 LEU 63 -9.581 -8.011 9.844 519 H TYR 64 H TYR 64 -6.201 -12.374 9.194 520 HA TYR 64 HA TYR 64 -5.439 -14.248 8.183 521 HB2 TYR 64 2HB TYR 64 -5.325 -12.410 5.798 522 HB3 TYR 64 1HB TYR 64 -5.038 -14.146 5.712 523 HD1 TYR 64 HD1 TYR 64 -6.909 -15.667 6.645 524 HD2 TYR 64 HD2 TYR 64 -7.495 -11.591 5.582 525 HE1 TYR 64 HE1 TYR 64 -9.323 -16.074 6.450 526 HE2 TYR 64 HE2 TYR 64 -9.914 -11.984 5.382 527 HH TYR 64 HH TYR 64 -11.429 -13.948 4.933 528 H LYS 65 H LYS 65 -3.545 -12.261 9.396 529 HA LYS 65 HA LYS 65 -1.320 -12.162 9.849 530 HB2 LYS 65 2HB LYS 65 -1.656 -14.694 9.781 531 HB3 LYS 65 1HB LYS 65 -0.975 -14.632 8.165 532 HG2 LYS 65 2HG LYS 65 1.113 -13.822 9.006 533 HG3 LYS 65 1HG LYS 65 0.438 -13.645 10.629 534 HD2 LYS 65 2HD LYS 65 0.035 -16.090 10.680 535 HD3 LYS 65 1HD LYS 65 0.818 -16.222 9.106 536 HE2 LYS 65 2HE LYS 65 2.900 -15.462 10.008 537 HE3 LYS 65 1HE LYS 65 2.146 -15.090 11.559 538 HZ1 LYS 65 3HZ LYS 65 3.328 -17.173 11.685 539 HZ2 LYS 65 1HZ LYS 65 2.459 -17.796 10.366 540 HZ3 LYS 65 2HZ LYS 65 1.662 -17.458 11.825 541 H GLU 66 H GLU 66 -1.341 -10.244 8.584 542 HA GLU 66 HA GLU 66 -0.563 -8.825 6.993 543 HB2 GLU 66 2HB GLU 66 1.444 -11.063 6.796 544 HB3 GLU 66 1HB GLU 66 1.579 -9.613 5.815 545 HG2 GLU 66 2HG GLU 66 2.974 -9.502 7.815 546 HG3 GLU 66 1HG GLU 66 1.747 -8.239 7.795 547 H LYS 67 H LYS 67 -2.738 -10.235 6.250 548 HA LYS 67 HA LYS 67 -4.070 -10.663 4.489 549 HB2 LYS 67 2HB LYS 67 -3.045 -8.919 3.192 550 HB3 LYS 67 1HB LYS 67 -1.664 -9.942 2.811 551 HG2 LYS 67 2HG LYS 67 -2.939 -11.321 1.399 552 HG3 LYS 67 1HG LYS 67 -4.462 -10.671 2.005 553 HD2 LYS 67 2HD LYS 67 -3.990 -8.535 0.950 554 HD3 LYS 67 1HD LYS 67 -2.420 -9.129 0.398 555 HE2 LYS 67 2HE LYS 67 -4.236 -9.175 -1.339 556 HE3 LYS 67 1HE LYS 67 -3.440 -10.721 -1.048 557 HZ1 LYS 67 3HZ LYS 67 -5.285 -11.438 0.278 558 HZ2 LYS 67 1HZ LYS 67 -5.879 -10.897 -1.215 559 HZ3 LYS 67 2HZ LYS 67 -6.036 -9.919 0.161 560 H PHE 68 H PHE 68 -0.821 -12.057 3.977 561 HA PHE 68 HA PHE 68 -1.763 -14.647 4.543 562 HB2 PHE 68 2HB PHE 68 -2.527 -14.079 2.040 563 HB3 PHE 68 1HB PHE 68 -0.889 -14.639 1.703 564 HD1 PHE 68 HD2 PHE 68 -3.837 -15.608 3.747 565 HD2 PHE 68 HD1 PHE 68 -0.602 -16.893 1.300 566 HE1 PHE 68 HE2 PHE 68 -4.609 -17.923 3.966 567 HE2 PHE 68 HE1 PHE 68 -1.368 -19.224 1.513 568 HZ PHE 68 HZ PHE 68 -3.373 -19.742 2.847 569 H LEU 69 H LEU 69 -0.008 -14.366 5.910 570 HA LEU 69 HA LEU 69 2.667 -14.311 4.768 571 HB2 LEU 69 2HB LEU 69 2.078 -12.944 6.754 572 HB3 LEU 69 1HB LEU 69 1.726 -14.409 7.645 573 HG LEU 69 HG LEU 69 4.093 -15.073 7.482 574 HD11 LEU 69 1HD1 LEU 69 4.655 -13.979 5.385 575 HD12 LEU 69 2HD1 LEU 69 5.751 -13.464 6.668 576 HD13 LEU 69 3HD1 LEU 69 4.450 -12.398 6.137 577 HD21 LEU 69 3HD2 LEU 69 3.638 -12.297 8.567 578 HD22 LEU 69 1HD2 LEU 69 4.977 -13.365 8.997 579 HD23 LEU 69 2HD2 LEU 69 3.322 -13.812 9.410 580 H TYR 70 H TYR 70 3.914 -16.046 4.526 581 HA TYR 70 HA TYR 70 4.649 -18.186 4.455 582 HB2 TYR 70 2HB TYR 70 2.919 -18.538 6.909 583 HB3 TYR 70 1HB TYR 70 3.996 -19.775 6.271 584 HD1 TYR 70 HD1 TYR 70 6.489 -19.215 6.133 585 HD2 TYR 70 HD2 TYR 70 3.710 -16.924 8.393 586 HE1 TYR 70 HE1 TYR 70 8.341 -18.283 7.457 587 HE2 TYR 70 HE2 TYR 70 5.551 -15.986 9.720 588 HH TYR 70 HH TYR 70 7.819 -16.502 10.341 589 H GLY 71 H GLY 71 3.613 -20.611 4.572 590 HA2 GLY 71 2HA GLY 71 1.383 -21.679 4.133 591 HA3 GLY 71 1HA GLY 71 1.173 -20.434 2.910 592 H ASN 72 H ASN 72 4.126 -20.697 2.286 593 HA ASN 72 HA ASN 72 4.497 -23.303 1.196 594 HB2 ASN 72 2HB ASN 72 2.789 -22.607 -0.386 595 HB3 ASN 72 1HB ASN 72 3.648 -21.106 -0.708 596 HD21 ASN 72 1HD2 ASN 72 5.225 -24.212 -0.349 597 HD22 ASN 72 2HD2 ASN 72 5.736 -24.350 -1.993 598 H PHE 73 H PHE 73 5.223 -19.928 0.328 599 HA PHE 73 HA PHE 73 8.033 -20.355 0.915 600 HB2 PHE 73 2HB PHE 73 7.161 -20.776 -1.680 601 HB3 PHE 73 1HB PHE 73 7.690 -19.097 -1.713 602 HD1 PHE 73 HD1 PHE 73 8.900 -22.336 -0.305 603 HD2 PHE 73 HD2 PHE 73 9.844 -18.759 -2.404 604 HE1 PHE 73 HE1 PHE 73 11.228 -23.097 -0.543 605 HE2 PHE 73 HE2 PHE 73 12.175 -19.505 -2.637 606 HZ PHE 73 HZ PHE 73 12.871 -21.678 -1.710 607 H GLN 74 H GLN 74 9.132 -18.403 1.295 608 HA GLN 74 HA GLN 74 7.457 -16.341 2.304 609 HB2 GLN 74 2HB GLN 74 9.742 -17.046 3.163 610 HB3 GLN 74 1HB GLN 74 10.428 -16.148 1.819 611 HG2 GLN 74 2HG GLN 74 10.483 -14.809 3.817 612 HG3 GLN 74 1HG GLN 74 9.357 -14.104 2.657 613 HE21 GLN 74 1HE2 GLN 74 9.682 -15.772 5.700 614 HE22 GLN 74 2HE2 GLN 74 8.064 -15.481 6.245 615 H THR 75 H THR 75 9.051 -16.864 -0.713 616 HA THR 75 HA THR 75 9.209 -14.236 -1.678 617 HB THR 75 HB THR 75 9.143 -15.370 -3.952 618 HG1 THR 75 HG1 THR 75 8.254 -17.293 -3.871 619 HG21 THR 75 3HG2 THR 75 11.246 -14.919 -2.765 620 HG22 THR 75 1HG2 THR 75 11.325 -16.441 -3.652 621 HG23 THR 75 2HG2 THR 75 11.089 -16.450 -1.905 622 H ARG 76 H ARG 76 6.556 -16.555 -1.628 623 HA ARG 76 HA ARG 76 4.868 -15.210 -3.463 624 HB2 ARG 76 2HB ARG 76 4.128 -17.080 -1.202 625 HB3 ARG 76 1HB ARG 76 3.043 -16.568 -2.487 626 HG2 ARG 76 2HG ARG 76 4.547 -17.625 -4.130 627 HG3 ARG 76 1HG ARG 76 5.549 -18.206 -2.799 628 HD2 ARG 76 2HD ARG 76 4.120 -19.995 -3.418 629 HD3 ARG 76 1HD ARG 76 3.514 -19.354 -1.893 630 HE ARG 76 HE ARG 76 2.243 -18.227 -4.228 631 HH11 ARG 76 1HH1 ARG 76 2.165 -20.787 -1.836 632 HH12 ARG 76 2HH1 ARG 76 0.508 -21.200 -2.130 633 HH21 ARG 76 1HH2 ARG 76 0.062 -18.816 -4.656 634 HH22 ARG 76 2HH2 ARG 76 -0.670 -20.111 -3.749 635 H VAL 77 H VAL 77 5.420 -14.898 -0.026 636 HA VAL 77 HA VAL 77 3.241 -13.208 0.578 637 HB VAL 77 HB VAL 77 5.967 -13.262 1.893 638 HG11 VAL 77 1HG1 VAL 77 4.703 -11.280 2.492 639 HG12 VAL 77 2HG1 VAL 77 4.778 -12.390 3.861 640 HG13 VAL 77 3HG1 VAL 77 3.302 -12.271 2.904 641 HG21 VAL 77 3HG2 VAL 77 3.469 -14.825 2.538 642 HG22 VAL 77 1HG2 VAL 77 4.947 -14.811 3.498 643 HG23 VAL 77 2HG2 VAL 77 4.964 -15.475 1.864 644 H ILE 78 H ILE 78 6.574 -12.575 -0.436 645 HA ILE 78 HA ILE 78 6.383 -9.763 -0.473 646 HB ILE 78 HB ILE 78 8.170 -11.546 -2.137 647 HG12 ILE 78 2HG1 ILE 78 8.641 -10.123 0.492 648 HG13 ILE 78 1HG1 ILE 78 8.471 -11.862 0.269 649 HG21 ILE 78 1HG2 ILE 78 9.599 -9.541 -2.373 650 HG22 ILE 78 2HG2 ILE 78 8.352 -8.579 -1.580 651 HG23 ILE 78 3HG2 ILE 78 8.025 -9.339 -3.137 652 HD11 ILE 78 3HD1 ILE 78 10.519 -11.902 -1.041 653 HD12 ILE 78 1HD1 ILE 78 10.796 -11.210 0.556 654 HD13 ILE 78 2HD1 ILE 78 10.681 -10.155 -0.852 655 H GLU 79 H GLU 79 5.585 -12.242 -2.857 656 HA GLU 79 HA GLU 79 5.123 -10.568 -5.047 657 HB2 GLU 79 2HB GLU 79 5.154 -13.111 -5.026 658 HB3 GLU 79 1HB GLU 79 3.507 -13.034 -4.411 659 HG2 GLU 79 2HG GLU 79 3.092 -11.519 -6.472 660 HG3 GLU 79 1HG GLU 79 4.568 -12.258 -7.083 661 H LEU 80 H LEU 80 2.875 -11.743 -2.549 662 HA LEU 80 HA LEU 80 0.613 -10.328 -3.461 663 HB2 LEU 80 2HB LEU 80 1.294 -11.233 -0.659 664 HB3 LEU 80 1HB LEU 80 -0.293 -10.723 -1.200 665 HG LEU 80 HG LEU 80 1.197 -13.148 -2.217 666 HD11 LEU 80 1HD1 LEU 80 -0.463 -14.431 -0.987 667 HD12 LEU 80 2HD1 LEU 80 -1.185 -12.940 -0.381 668 HD13 LEU 80 3HD1 LEU 80 0.450 -13.388 0.103 669 HD21 LEU 80 3HD2 LEU 80 -1.624 -12.213 -2.737 670 HD22 LEU 80 1HD2 LEU 80 -0.887 -13.697 -3.342 671 HD23 LEU 80 2HD2 LEU 80 -0.289 -12.130 -3.888 672 H ASN 81 H ASN 81 3.041 -9.571 -1.019 673 HA ASN 81 HA ASN 81 2.076 -7.125 -0.105 674 HB2 ASN 81 2HB ASN 81 3.947 -8.460 0.875 675 HB3 ASN 81 1HB ASN 81 4.964 -7.970 -0.470 676 HD21 ASN 81 1HD2 ASN 81 5.464 -7.552 2.300 677 HD22 ASN 81 2HD2 ASN 81 5.542 -5.848 2.552 678 H TYR 82 H TYR 82 4.576 -7.702 -2.544 679 HA TYR 82 HA TYR 82 5.046 -5.074 -3.316 680 HB2 TYR 82 2HB TYR 82 6.266 -7.344 -3.819 681 HB3 TYR 82 1HB TYR 82 5.251 -7.358 -5.252 682 HD1 TYR 82 HD1 TYR 82 5.360 -5.174 -6.710 683 HD2 TYR 82 HD2 TYR 82 8.325 -6.344 -3.902 684 HE1 TYR 82 HE1 TYR 82 7.009 -3.798 -7.892 685 HE2 TYR 82 HE2 TYR 82 9.991 -4.966 -5.069 686 HH TYR 82 HH TYR 82 10.337 -4.017 -7.368 687 H LYS 83 H LYS 83 2.846 -7.488 -4.695 688 HA LYS 83 HA LYS 83 2.183 -5.907 -6.963 689 HB2 LYS 83 2HB LYS 83 2.147 -8.407 -6.864 690 HB3 LYS 83 1HB LYS 83 0.703 -8.300 -5.871 691 HG2 LYS 83 2HG LYS 83 -0.545 -7.335 -7.663 692 HG3 LYS 83 1HG LYS 83 0.910 -7.163 -8.650 693 HD2 LYS 83 2HD LYS 83 -0.295 -9.775 -7.728 694 HD3 LYS 83 1HD LYS 83 -0.435 -9.093 -9.351 695 HE2 LYS 83 2HE LYS 83 2.023 -9.186 -9.566 696 HE3 LYS 83 1HE LYS 83 2.116 -9.937 -7.974 697 HZ1 LYS 83 3HZ LYS 83 2.235 -11.561 -9.773 698 HZ2 LYS 83 1HZ LYS 83 0.709 -11.077 -10.333 699 HZ3 LYS 83 2HZ LYS 83 0.860 -11.816 -8.814 700 H HIS 84 H HIS 84 0.773 -6.247 -3.766 701 HA HIS 84 HA HIS 84 -1.687 -4.960 -4.656 702 HB2 HIS 84 2HB HIS 84 -1.717 -6.898 -3.060 703 HB3 HIS 84 1HB HIS 84 -0.984 -5.846 -1.856 704 HD1 HIS 84 HD1 HIS 84 -4.204 -6.508 -3.647 705 HD2 HIS 84 HD2 HIS 84 -2.727 -3.937 -0.721 706 HE1 HIS 84 HE1 HIS 84 -6.225 -5.441 -2.589 707 HE2 HIS 84 HE2 HIS 84 -5.321 -3.957 -0.768 708 H LEU 85 H LEU 85 1.233 -4.151 -2.907 709 HA LEU 85 HA LEU 85 0.036 -1.697 -1.896 710 HB2 LEU 85 2HB LEU 85 2.832 -2.782 -1.577 711 HB3 LEU 85 1HB LEU 85 2.235 -1.311 -0.833 712 HG LEU 85 HG LEU 85 1.382 -4.138 -0.248 713 HD11 LEU 85 1HD1 LEU 85 2.112 -3.557 2.017 714 HD12 LEU 85 2HD1 LEU 85 2.600 -1.963 1.444 715 HD13 LEU 85 3HD1 LEU 85 3.423 -3.404 0.847 716 HD21 LEU 85 3HD2 LEU 85 -0.204 -3.180 1.353 717 HD22 LEU 85 1HD2 LEU 85 -0.606 -2.742 -0.307 718 HD23 LEU 85 2HD2 LEU 85 0.173 -1.565 0.749 719 H LEU 86 H LEU 86 2.155 -2.717 -4.468 720 HA LEU 86 HA LEU 86 2.664 0.112 -5.100 721 HB2 LEU 86 2HB LEU 86 4.182 -2.327 -6.020 722 HB3 LEU 86 1HB LEU 86 4.575 -0.666 -6.419 723 HG LEU 86 HG LEU 86 4.686 -1.909 -3.672 724 HD11 LEU 86 1HD1 LEU 86 6.861 -0.948 -5.519 725 HD12 LEU 86 2HD1 LEU 86 6.486 -2.629 -5.139 726 HD13 LEU 86 3HD1 LEU 86 7.092 -1.554 -3.879 727 HD21 LEU 86 3HD2 LEU 86 4.003 0.428 -3.545 728 HD22 LEU 86 1HD2 LEU 86 5.373 0.891 -4.555 729 HD23 LEU 86 2HD2 LEU 86 5.651 0.218 -2.949 730 H GLY 87 H GLY 87 1.026 -2.702 -6.145 731 HA2 GLY 87 2HA GLY 87 -0.341 -3.040 -7.986 732 HA3 GLY 87 1HA GLY 87 0.017 -1.394 -8.496 733 H ARG 88 H ARG 88 2.695 -3.302 -7.785 734 HA ARG 88 HA ARG 88 3.207 -3.881 -10.618 735 HB2 ARG 88 2HB ARG 88 4.502 -1.951 -10.234 736 HB3 ARG 88 1HB ARG 88 4.907 -2.433 -8.597 737 HG2 ARG 88 2HG ARG 88 6.407 -4.150 -9.468 738 HG3 ARG 88 1HG ARG 88 5.983 -3.683 -11.117 739 HD2 ARG 88 2HD ARG 88 7.123 -1.690 -10.993 740 HD3 ARG 88 1HD ARG 88 6.982 -1.595 -9.239 741 HE ARG 88 HE ARG 88 8.704 -3.354 -9.136 742 HH11 ARG 88 1HH1 ARG 88 8.392 -1.511 -12.099 743 HH12 ARG 88 2HH1 ARG 88 10.059 -1.722 -12.547 744 HH21 ARG 88 1HH2 ARG 88 10.897 -3.628 -9.725 745 HH22 ARG 88 2HH2 ARG 88 11.467 -2.924 -11.212 746 H ALA 89 H ALA 89 4.591 -5.722 -10.968 747 HA ALA 89 HA ALA 89 4.519 -7.572 -8.685 748 HB1 ALA 89 3HB ALA 89 4.729 -9.355 -10.346 749 HB2 ALA 89 1HB ALA 89 4.820 -8.152 -11.632 750 HB3 ALA 89 2HB ALA 89 3.342 -8.320 -10.684 751 HA PRO 90 HA PRO 90 8.894 -7.634 -7.992 752 HB2 PRO 90 2HB PRO 90 8.601 -10.599 -8.250 753 HB3 PRO 90 1HB PRO 90 9.393 -9.654 -6.983 754 HG2 PRO 90 2HG PRO 90 6.999 -10.732 -6.568 755 HG3 PRO 90 1HG PRO 90 7.391 -9.119 -5.946 756 HD2 PRO 90 2HD PRO 90 5.682 -9.895 -8.257 757 HD3 PRO 90 1HD PRO 90 5.527 -8.519 -7.146 758 H TYR 91 H TYR 91 10.338 -7.148 -9.507 759 HA TYR 91 HA TYR 91 10.001 -8.368 -12.166 760 HB2 TYR 91 2HB TYR 91 9.584 -5.908 -11.896 761 HB3 TYR 91 1HB TYR 91 11.275 -5.719 -11.451 762 HD1 TYR 91 HD1 TYR 91 9.080 -6.916 -14.203 763 HD2 TYR 91 HD2 TYR 91 12.882 -5.351 -13.108 764 HE1 TYR 91 HE1 TYR 91 9.644 -6.649 -16.578 765 HE2 TYR 91 HE2 TYR 91 13.464 -5.085 -15.485 766 HH TYR 91 HH TYR 91 12.848 -5.857 -17.637 767 H ASP 92 H ASP 92 12.341 -7.549 -9.672 768 HA ASP 92 HA ASP 92 14.337 -9.129 -11.162 769 HB2 ASP 92 2HB ASP 92 14.890 -6.712 -11.252 770 HB3 ASP 92 1HB ASP 92 14.925 -6.675 -9.492 771 H GLU 93 H GLU 93 15.824 -10.312 -9.902 772 HA GLU 93 HA GLU 93 14.695 -11.582 -7.663 773 HB2 GLU 93 2HB GLU 93 16.353 -12.582 -9.241 774 HB3 GLU 93 1HB GLU 93 17.597 -11.581 -8.506 775 HG2 GLU 93 2HG GLU 93 17.826 -13.674 -7.499 776 HG3 GLU 93 1HG GLU 93 16.981 -12.684 -6.310 777 H SER 94 H SER 94 16.997 -8.927 -7.928 778 HA SER 94 HA SER 94 18.012 -9.068 -5.299 779 HB2 SER 94 2HB SER 94 19.117 -7.801 -7.116 780 HB3 SER 94 1HB SER 94 17.799 -6.632 -7.089 781 HG SER 94 HG SER 94 18.510 -6.657 -4.651 782 H GLU 95 H GLU 95 15.132 -7.631 -6.645 783 HA GLU 95 HA GLU 95 14.420 -5.953 -4.501 784 HB2 GLU 95 2HB GLU 95 12.547 -7.506 -6.303 785 HB3 GLU 95 1HB GLU 95 12.158 -6.055 -5.390 786 HG2 GLU 95 2HG GLU 95 13.704 -4.767 -6.766 787 HG3 GLU 95 1HG GLU 95 14.117 -6.225 -7.671 788 H VAL 96 H VAL 96 13.693 -9.333 -5.208 789 HA VAL 96 HA VAL 96 12.081 -9.817 -2.945 790 HB VAL 96 HB VAL 96 13.720 -11.791 -4.545 791 HG11 VAL 96 1HG1 VAL 96 11.361 -12.227 -2.719 792 HG12 VAL 96 2HG1 VAL 96 13.027 -12.720 -2.411 793 HG13 VAL 96 3HG1 VAL 96 12.116 -13.458 -3.730 794 HG21 VAL 96 3HG2 VAL 96 11.654 -12.201 -5.788 795 HG22 VAL 96 1HG2 VAL 96 12.190 -10.528 -5.956 796 HG23 VAL 96 2HG2 VAL 96 10.852 -10.922 -4.875 797 H ILE 97 H ILE 97 15.518 -10.475 -3.591 798 HA ILE 97 HA ILE 97 16.091 -11.765 -1.173 799 HB ILE 97 HB ILE 97 17.979 -10.138 -2.884 800 HG12 ILE 97 2HG1 ILE 97 16.863 -11.880 -4.181 801 HG13 ILE 97 1HG1 ILE 97 18.550 -12.306 -3.919 802 HG21 ILE 97 1HG2 ILE 97 19.744 -11.519 -1.901 803 HG22 ILE 97 2HG2 ILE 97 18.553 -12.302 -0.863 804 HG23 ILE 97 3HG2 ILE 97 18.896 -10.583 -0.670 805 HD11 ILE 97 3HD1 ILE 97 17.077 -14.230 -3.671 806 HD12 ILE 97 1HD1 ILE 97 16.210 -13.402 -2.377 807 HD13 ILE 97 2HD1 ILE 97 17.902 -13.848 -2.160 808 H PHE 98 H PHE 98 16.359 -8.335 -2.053 809 HA PHE 98 HA PHE 98 17.502 -7.440 0.345 810 HB2 PHE 98 2HB PHE 98 17.466 -6.020 -1.617 811 HB3 PHE 98 1HB PHE 98 15.705 -5.996 -1.613 812 HD1 PHE 98 HD2 PHE 98 18.658 -5.018 0.421 813 HD2 PHE 98 HD1 PHE 98 14.559 -4.320 -0.483 814 HE1 PHE 98 HE2 PHE 98 18.691 -3.011 1.839 815 HE2 PHE 98 HE1 PHE 98 14.587 -2.310 0.936 816 HZ PHE 98 HZ PHE 98 16.656 -1.653 2.100 817 H HIS 99 H HIS 99 14.126 -7.893 -0.592 818 HA HIS 99 HA HIS 99 13.137 -6.711 1.821 819 HB2 HIS 99 2HB HIS 99 11.853 -8.124 -0.490 820 HB3 HIS 99 1HB HIS 99 10.926 -7.777 0.971 821 HD1 HIS 99 HD1 HIS 99 10.485 -5.301 1.541 822 HD2 HIS 99 HD2 HIS 99 12.439 -5.901 -2.079 823 HE1 HIS 99 HE1 HIS 99 10.402 -3.081 0.344 824 HE2 HIS 99 HE2 HIS 99 11.786 -3.417 -1.742 825 H LEU 100 H LEU 100 13.882 -9.979 0.773 826 HA LEU 100 HA LEU 100 12.743 -11.386 2.920 827 HB2 LEU 100 2HB LEU 100 15.275 -11.910 1.355 828 HB3 LEU 100 1HB LEU 100 14.619 -13.030 2.532 829 HG LEU 100 HG LEU 100 13.179 -12.136 0.033 830 HD11 LEU 100 1HD1 LEU 100 13.667 -14.382 -0.802 831 HD12 LEU 100 2HD1 LEU 100 14.631 -14.708 0.637 832 HD13 LEU 100 3HD1 LEU 100 15.145 -13.468 -0.505 833 HD21 LEU 100 3HD2 LEU 100 12.547 -14.280 2.059 834 HD22 LEU 100 1HD2 LEU 100 11.655 -13.979 0.566 835 HD23 LEU 100 2HD2 LEU 100 11.675 -12.764 1.844 836 H ASP 101 H ASP 101 15.789 -9.666 2.580 837 HA ASP 101 HA ASP 101 16.890 -10.356 5.094 838 HB2 ASP 101 2HB ASP 101 18.165 -9.406 3.150 839 HB3 ASP 101 1HB ASP 101 17.410 -7.850 3.475 840 H LEU 102 H LEU 102 15.097 -7.514 3.963 841 HA LEU 102 HA LEU 102 15.109 -6.072 6.355 842 HB2 LEU 102 2HB LEU 102 14.491 -5.148 4.158 843 HB3 LEU 102 1HB LEU 102 13.019 -6.097 4.176 844 HG LEU 102 HG LEU 102 12.185 -4.821 6.083 845 HD11 LEU 102 1HD1 LEU 102 14.753 -3.263 5.838 846 HD12 LEU 102 2HD1 LEU 102 14.296 -4.315 7.178 847 HD13 LEU 102 3HD1 LEU 102 13.386 -2.836 6.866 848 HD21 LEU 102 3HD2 LEU 102 11.673 -4.021 3.850 849 HD22 LEU 102 1HD2 LEU 102 13.175 -3.097 3.818 850 HD23 LEU 102 2HD2 LEU 102 11.896 -2.663 4.952 851 H TYR 103 H TYR 103 12.757 -8.408 5.095 852 HA TYR 103 HA TYR 103 10.855 -8.213 7.116 853 HB2 TYR 103 2HB TYR 103 10.266 -9.406 5.148 854 HB3 TYR 103 1HB TYR 103 11.624 -10.514 5.323 855 HD1 TYR 103 HD1 TYR 103 8.407 -9.517 6.902 856 HD2 TYR 103 HD2 TYR 103 11.364 -12.539 6.468 857 HE1 TYR 103 HE1 TYR 103 6.979 -11.083 8.150 858 HE2 TYR 103 HE2 TYR 103 9.946 -14.115 7.710 859 HH TYR 103 HH TYR 103 8.146 -14.103 9.306 860 H GLU 104 H GLU 104 13.564 -10.551 6.901 861 HA GLU 104 HA GLU 104 12.773 -11.760 9.377 862 HB2 GLU 104 2HB GLU 104 15.252 -12.169 7.708 863 HB3 GLU 104 1HB GLU 104 14.807 -13.144 9.102 864 HG2 GLU 104 2HG GLU 104 12.653 -13.664 7.869 865 HG3 GLU 104 1HG GLU 104 13.417 -12.951 6.449 866 H ASN 105 H ASN 105 14.771 -9.099 8.595 867 HA ASN 105 HA ASN 105 16.331 -9.406 11.035 868 HB2 ASN 105 2HB ASN 105 16.594 -7.631 8.638 869 HB3 ASN 105 1HB ASN 105 17.418 -7.218 10.140 870 HD21 ASN 105 1HD2 ASN 105 18.437 -8.064 7.484 871 HD22 ASN 105 2HD2 ASN 105 19.450 -9.432 7.807 872 H GLU 106 H GLU 106 14.023 -7.072 9.623 873 HA GLU 106 HA GLU 106 14.045 -5.716 12.228 874 HB2 GLU 106 2HB GLU 106 13.193 -4.713 9.518 875 HB3 GLU 106 1HB GLU 106 12.915 -3.829 11.014 876 HG2 GLU 106 2HG GLU 106 15.505 -4.209 11.314 877 HG3 GLU 106 1HG GLU 106 15.448 -4.351 9.557 878 H GLY 107 H GLY 107 11.847 -7.203 9.882 879 HA2 GLY 107 2HA GLY 107 10.090 -8.432 11.327 880 HA3 GLY 107 1HA GLY 107 9.666 -6.800 11.814 881 H PHE 108 H PHE 108 7.823 -8.474 10.714 882 HA PHE 108 HA PHE 108 7.500 -8.402 7.956 883 HB2 PHE 108 2HB PHE 108 5.102 -8.846 8.395 884 HB3 PHE 108 1HB PHE 108 6.169 -9.882 9.331 885 HD1 PHE 108 HD2 PHE 108 6.503 -9.398 11.763 886 HD2 PHE 108 HD1 PHE 108 3.537 -7.432 9.438 887 HE1 PHE 108 HE2 PHE 108 5.335 -8.742 13.824 888 HE2 PHE 108 HE1 PHE 108 2.360 -6.768 11.493 889 HZ PHE 108 HZ PHE 108 3.258 -7.421 13.690 890 H ASP 109 H ASP 109 6.273 -6.075 10.371 891 HA ASP 109 HA ASP 109 4.876 -4.585 8.367 892 HB2 ASP 109 2HB ASP 109 3.923 -3.443 10.081 893 HB3 ASP 109 1HB ASP 109 4.564 -4.770 11.046 894 H ALA 110 H ALA 110 8.048 -4.527 9.733 895 HA ALA 110 HA ALA 110 8.792 -1.907 8.960 896 HB1 ALA 110 3HB ALA 110 10.090 -3.168 10.584 897 HB2 ALA 110 1HB ALA 110 11.101 -2.704 9.216 898 HB3 ALA 110 2HB ALA 110 10.507 -4.359 9.351 899 H ASP 111 H ASP 111 8.872 -5.047 7.353 900 HA ASP 111 HA ASP 111 10.127 -4.135 4.977 901 HB2 ASP 111 2HB ASP 111 10.064 -6.517 5.484 902 HB3 ASP 111 1HB ASP 111 8.301 -6.509 5.423 903 H ILE 112 H ILE 112 6.734 -4.866 5.726 904 HA ILE 112 HA ILE 112 5.514 -3.964 3.416 905 HB ILE 112 HB ILE 112 4.511 -3.731 6.263 906 HG12 ILE 112 2HG1 ILE 112 4.020 -5.848 4.157 907 HG13 ILE 112 1HG1 ILE 112 5.083 -6.022 5.549 908 HG21 ILE 112 1HG2 ILE 112 3.238 -2.257 4.818 909 HG22 ILE 112 2HG2 ILE 112 2.258 -3.650 5.281 910 HG23 ILE 112 3HG2 ILE 112 2.976 -3.571 3.671 911 HD11 ILE 112 3HD1 ILE 112 2.928 -7.122 5.879 912 HD12 ILE 112 1HD1 ILE 112 2.113 -5.572 5.677 913 HD13 ILE 112 2HD1 ILE 112 3.193 -5.827 7.047 914 H ASP 113 H ASP 113 6.813 -2.155 6.087 915 HA ASP 113 HA ASP 113 5.572 0.323 5.639 916 HB2 ASP 113 2HB ASP 113 6.842 -0.417 7.695 917 HB3 ASP 113 1HB ASP 113 8.325 -0.103 6.797 918 H SER 114 H SER 114 8.512 -1.106 4.303 919 HA SER 114 HA SER 114 9.627 1.270 3.286 920 HB2 SER 114 2HB SER 114 11.094 -0.163 1.969 921 HB3 SER 114 1HB SER 114 10.922 -0.808 3.599 922 HG SER 114 HG SER 114 9.451 -2.333 2.793 923 H TYR 115 H TYR 115 7.159 -0.841 2.037 924 HA TYR 115 HA TYR 115 7.255 0.014 -0.670 925 HB2 TYR 115 2HB TYR 115 4.980 -1.172 0.940 926 HB3 TYR 115 1HB TYR 115 4.953 -0.946 -0.805 927 HD1 TYR 115 HD2 TYR 115 6.876 -2.642 1.891 928 HD2 TYR 115 HD1 TYR 115 5.731 -2.646 -2.201 929 HE1 TYR 115 HE2 TYR 115 7.942 -4.836 1.608 930 HE2 TYR 115 HE1 TYR 115 6.795 -4.844 -2.501 931 HH TYR 115 HH TYR 115 7.908 -6.728 0.172 932 H ILE 116 H ILE 116 5.283 0.973 2.105 933 HA ILE 116 HA ILE 116 3.848 2.997 0.671 934 HB ILE 116 HB ILE 116 4.130 2.559 3.654 935 HG12 ILE 116 2HG1 ILE 116 3.169 0.607 2.523 936 HG13 ILE 116 1HG1 ILE 116 1.949 1.429 3.493 937 HG21 ILE 116 1HG2 ILE 116 3.386 4.819 3.112 938 HG22 ILE 116 2HG2 ILE 116 2.095 3.884 3.864 939 HG23 ILE 116 3HG2 ILE 116 2.085 4.157 2.123 940 HD11 ILE 116 3HD1 ILE 116 2.274 1.597 0.504 941 HD12 ILE 116 1HD1 ILE 116 1.088 2.497 1.450 942 HD13 ILE 116 2HD1 ILE 116 1.012 0.737 1.386 943 H ASP 117 H ASP 117 6.822 2.817 2.387 944 HA ASP 117 HA ASP 117 7.035 5.588 3.060 945 HB2 ASP 117 2HB ASP 117 8.170 3.814 4.345 946 HB3 ASP 117 1HB ASP 117 9.170 3.445 2.944 947 H SER 118 H SER 118 7.611 3.785 0.205 948 HA SER 118 HA SER 118 9.783 5.188 -0.898 949 HB2 SER 118 2HB SER 118 9.074 4.233 -3.051 950 HB3 SER 118 1HB SER 118 9.012 3.022 -1.773 951 HG SER 118 HG SER 118 6.819 3.111 -1.770 952 HA PRO 119 HA PRO 119 7.513 9.024 -1.342 953 HB2 PRO 119 2HB PRO 119 9.644 10.530 -2.139 954 HB3 PRO 119 1HB PRO 119 9.312 10.120 -0.454 955 HG2 PRO 119 2HG PRO 119 11.258 8.894 -2.359 956 HG3 PRO 119 1HG PRO 119 11.442 9.235 -0.629 957 HD2 PRO 119 2HD PRO 119 10.905 6.755 -1.614 958 HD3 PRO 119 1HD PRO 119 10.385 7.297 -0.007 959 H GLU 120 H GLU 120 10.019 8.317 -3.778 960 HA GLU 120 HA GLU 120 8.977 9.862 -5.829 961 HB2 GLU 120 2HB GLU 120 11.235 9.012 -5.902 962 HB3 GLU 120 1HB GLU 120 10.656 7.354 -5.950 963 HG2 GLU 120 2HG GLU 120 9.604 7.844 -8.142 964 HG3 GLU 120 1HG GLU 120 10.349 9.441 -8.095 965 H TYR 121 H TYR 121 8.577 6.347 -5.346 966 HA TYR 121 HA TYR 121 6.972 6.014 -7.638 967 HB2 TYR 121 2HB TYR 121 8.245 4.189 -6.488 968 HB3 TYR 121 1HB TYR 121 7.032 4.213 -5.213 969 HD1 TYR 121 HD2 TYR 121 7.355 3.824 -8.905 970 HD2 TYR 121 HD1 TYR 121 5.165 2.827 -5.398 971 HE1 TYR 121 HE2 TYR 121 5.974 2.274 -10.221 972 HE2 TYR 121 HE1 TYR 121 3.773 1.278 -6.704 973 HH TYR 121 HH TYR 121 3.146 0.717 -8.845 974 H THR 122 H THR 122 6.086 6.216 -4.184 975 HA THR 122 HA THR 122 3.346 5.813 -4.590 976 HB THR 122 HB THR 122 4.693 7.328 -2.352 977 HG1 THR 122 HG1 THR 122 5.467 5.340 -2.109 978 HG21 THR 122 3HG2 THR 122 2.270 7.755 -2.483 979 HG22 THR 122 1HG2 THR 122 2.696 6.815 -1.052 980 HG23 THR 122 2HG2 THR 122 1.972 6.017 -2.448 981 H ASN 123 H ASN 123 5.179 8.880 -4.283 982 HA ASN 123 HA ASN 123 2.820 10.465 -4.353 983 HB2 ASN 123 2HB ASN 123 4.177 12.227 -3.932 984 HB3 ASN 123 1HB ASN 123 5.370 10.976 -3.604 985 HD21 ASN 123 1HD2 ASN 123 4.375 13.501 -5.729 986 HD22 ASN 123 2HD2 ASN 123 5.795 13.510 -6.723 987 H SER 124 H SER 124 4.901 9.181 -6.845 988 HA SER 124 HA SER 124 3.763 10.889 -8.882 989 HB2 SER 124 2HB SER 124 6.131 10.101 -8.974 990 HB3 SER 124 1HB SER 124 5.536 8.461 -9.225 991 HG SER 124 HG SER 124 4.689 10.554 -10.905 992 H PHE 125 H PHE 125 3.393 7.567 -7.753 993 HA PHE 125 HA PHE 125 1.702 6.761 -9.922 994 HB2 PHE 125 2HB PHE 125 3.103 5.192 -8.556 995 HB3 PHE 125 1HB PHE 125 2.022 5.478 -7.197 996 HD1 PHE 125 HD2 PHE 125 2.334 3.961 -10.526 997 HD2 PHE 125 HD1 PHE 125 -0.131 4.445 -7.089 998 HE1 PHE 125 HE2 PHE 125 0.883 2.130 -11.308 999 HE2 PHE 125 HE1 PHE 125 -1.585 2.621 -7.864 1000 HZ PHE 125 HZ PHE 125 -1.079 1.463 -9.978 1001 H GLY 126 H GLY 126 1.201 7.912 -6.617 1002 HA2 GLY 126 2HA GLY 126 -1.043 9.332 -6.904 1003 HA3 GLY 126 1HA GLY 126 -1.683 7.695 -6.895 1004 H ASP 127 H ASP 127 -1.157 10.293 -5.020 1005 HA ASP 127 HA ASP 127 -0.504 8.833 -2.576 1006 HB2 ASP 127 2HB ASP 127 0.500 11.073 -2.999 1007 HB3 ASP 127 1HB ASP 127 -1.114 11.773 -2.987 1008 H TRP 128 H TRP 128 -3.146 10.243 -4.295 1009 HA TRP 128 HA TRP 128 -5.006 9.336 -2.198 1010 HB2 TRP 128 2HB TRP 128 -5.412 11.338 -4.431 1011 HB3 TRP 128 1HB TRP 128 -6.696 10.770 -3.367 1012 HD1 TRP 128 HD1 TRP 128 -3.684 13.091 -3.455 1013 HE1 TRP 128 HE1 TRP 128 -3.703 14.566 -1.348 1014 HE3 TRP 128 HE3 TRP 128 -7.453 10.786 -0.894 1015 HZ2 TRP 128 HZ2 TRP 128 -5.140 14.734 1.080 1016 HZ3 TRP 128 HZ3 TRP 128 -8.091 11.664 1.312 1017 HH2 TRP 128 HH2 TRP 128 -6.957 13.598 2.277 1018 H VAL 129 H VAL 129 -3.548 8.153 -4.742 1019 HA VAL 129 HA VAL 129 -5.916 6.935 -5.982 1020 HB VAL 129 HB VAL 129 -3.043 6.917 -6.942 1021 HG11 VAL 129 1HG1 VAL 129 -5.565 6.024 -8.335 1022 HG12 VAL 129 2HG1 VAL 129 -4.315 4.962 -7.686 1023 HG13 VAL 129 3HG1 VAL 129 -3.944 6.043 -9.030 1024 HG21 VAL 129 3HG2 VAL 129 -5.405 8.540 -7.884 1025 HG22 VAL 129 1HG2 VAL 129 -3.831 8.478 -8.677 1026 HG23 VAL 129 2HG2 VAL 129 -3.976 9.153 -7.054 1027 H VAL 130 H VAL 130 -6.201 4.725 -5.948 1028 HA VAL 130 HA VAL 130 -4.801 3.318 -3.847 1029 HB VAL 130 HB VAL 130 -7.023 2.399 -5.685 1030 HG11 VAL 130 1HG1 VAL 130 -7.339 0.560 -4.109 1031 HG12 VAL 130 2HG1 VAL 130 -5.944 1.107 -3.178 1032 HG13 VAL 130 3HG1 VAL 130 -5.727 0.511 -4.825 1033 HG21 VAL 130 3HG2 VAL 130 -7.079 3.383 -2.835 1034 HG22 VAL 130 1HG2 VAL 130 -8.457 2.715 -3.713 1035 HG23 VAL 130 2HG2 VAL 130 -7.716 4.221 -4.249 1036 HA PRO 131 HA PRO 131 -1.752 1.436 -6.515 1037 HB2 PRO 131 2HB PRO 131 -1.228 -0.672 -4.802 1038 HB3 PRO 131 1HB PRO 131 -0.464 0.918 -4.716 1039 HG2 PRO 131 2HG PRO 131 -2.767 -0.167 -3.149 1040 HG3 PRO 131 1HG PRO 131 -1.420 0.848 -2.603 1041 HD2 PRO 131 2HD PRO 131 -3.851 1.875 -3.055 1042 HD3 PRO 131 1HD PRO 131 -2.377 2.783 -3.460 1043 H TYR 132 H TYR 132 -3.133 0.768 -8.153 1044 HA TYR 132 HA TYR 132 -4.431 -1.841 -7.857 1045 HB2 TYR 132 2HB TYR 132 -5.636 -1.284 -9.907 1046 HB3 TYR 132 1HB TYR 132 -5.795 0.034 -8.752 1047 HD1 TYR 132 HD1 TYR 132 -4.353 2.100 -9.070 1048 HD2 TYR 132 HD2 TYR 132 -4.729 -0.910 -12.054 1049 HE1 TYR 132 HE1 TYR 132 -3.526 3.680 -10.761 1050 HE2 TYR 132 HE2 TYR 132 -3.900 0.664 -13.751 1051 HH TYR 132 HH TYR 132 -2.427 3.613 -12.960 1052 H TYR 133 H TYR 133 -4.047 -3.486 -9.451 1053 HA TYR 133 HA TYR 133 -1.384 -3.817 -10.238 1054 HB2 TYR 133 2HB TYR 133 -2.890 -5.733 -10.016 1055 HB3 TYR 133 1HB TYR 133 -3.871 -5.143 -11.355 1056 HD1 TYR 133 HD1 TYR 133 -0.603 -6.596 -10.447 1057 HD2 TYR 133 HD2 TYR 133 -3.220 -5.518 -13.625 1058 HE1 TYR 133 HE1 TYR 133 0.809 -7.840 -12.027 1059 HE2 TYR 133 HE2 TYR 133 -1.816 -6.762 -15.212 1060 HH TYR 133 HH TYR 133 0.390 -8.997 -14.377 1061 H ARG 134 H ARG 134 -0.319 -2.617 -11.644 1062 HA ARG 134 HA ARG 134 -1.626 -1.012 -13.605 1063 HB2 ARG 134 2HB ARG 134 0.520 -0.463 -12.395 1064 HB3 ARG 134 1HB ARG 134 1.320 -1.649 -13.414 1065 HG2 ARG 134 2HG ARG 134 0.778 -0.368 -15.391 1066 HG3 ARG 134 1HG ARG 134 -0.134 0.788 -14.415 1067 HD2 ARG 134 2HD ARG 134 1.939 1.315 -13.173 1068 HD3 ARG 134 1HD ARG 134 2.826 0.232 -14.243 1069 HE ARG 134 HE ARG 134 1.404 2.175 -15.749 1070 HH11 ARG 134 1HH1 ARG 134 4.209 1.819 -13.664 1071 HH12 ARG 134 2HH1 ARG 134 5.098 3.097 -14.439 1072 HH21 ARG 134 1HH2 ARG 134 2.562 3.866 -16.741 1073 HH22 ARG 134 2HH2 ARG 134 4.161 4.265 -16.191 1074 H GLY 135 H GLY 135 1.009 -3.341 -14.186 1075 HA2 GLY 135 2HA GLY 135 1.238 -5.018 -15.739 1076 HA3 GLY 135 1HA GLY 135 -0.502 -4.960 -15.970 1077 H LEU 136 H LEU 136 -1.369 -3.655 -17.585 1078 HA LEU 136 HA LEU 136 0.598 -2.751 -19.580 1079 HB2 LEU 136 2HB LEU 136 -0.643 -4.728 -20.311 1080 HB3 LEU 136 1HB LEU 136 -2.159 -3.903 -20.010 1081 HG LEU 136 HG LEU 136 -1.556 -2.247 -21.766 1082 HD11 LEU 136 1HD1 LEU 136 0.719 -4.151 -22.299 1083 HD12 LEU 136 2HD1 LEU 136 0.862 -2.497 -21.703 1084 HD13 LEU 136 3HD1 LEU 136 0.243 -2.799 -23.326 1085 HD21 LEU 136 3HD2 LEU 136 -3.025 -4.118 -22.273 1086 HD22 LEU 136 1HD2 LEU 136 -1.629 -5.132 -22.635 1087 HD23 LEU 136 2HD2 LEU 136 -1.995 -3.740 -23.656 1088 H GLU 137 H GLU 137 0.524 -0.689 -20.149 1089 HA GLU 137 HA GLU 137 -1.314 1.112 -18.939 1090 HB2 GLU 137 2HB GLU 137 0.924 1.373 -20.901 1091 HB3 GLU 137 1HB GLU 137 -0.186 2.720 -20.687 1092 HG2 GLU 137 2HG GLU 137 1.415 1.416 -18.500 1093 HG3 GLU 137 1HG GLU 137 1.823 2.929 -19.311 1094 H HIS 138 H HIS 138 -3.394 0.950 -19.534 1095 HA HIS 138 HA HIS 138 -3.977 1.433 -22.383 1096 HB2 HIS 138 2HB HIS 138 -4.985 -0.659 -21.451 1097 HB3 HIS 138 1HB HIS 138 -5.860 0.322 -20.281 1098 HD1 HIS 138 HD1 HIS 138 -6.007 -0.945 -23.721 1099 HD2 HIS 138 HD2 HIS 138 -7.889 2.007 -21.472 1100 HE1 HIS 138 HE1 HIS 138 -8.038 -0.273 -25.040 1101 HE2 HIS 138 HE2 HIS 138 -9.042 1.652 -23.763 1102 H HIS 139 H HIS 139 -4.052 3.587 -22.579 1103 HA HIS 139 HA HIS 139 -5.809 5.094 -20.811 1104 HB2 HIS 139 2HB HIS 139 -4.065 6.795 -20.335 1105 HB3 HIS 139 1HB HIS 139 -3.690 5.229 -19.629 1106 HD1 HIS 139 HD1 HIS 139 -1.279 4.722 -19.811 1107 HD2 HIS 139 HD2 HIS 139 -2.638 6.940 -23.070 1108 HE1 HIS 139 HE1 HIS 139 0.719 5.054 -21.297 1109 HE2 HIS 139 HE2 HIS 139 -0.182 6.175 -23.363 1110 H HIS 140 H HIS 140 -5.957 7.415 -21.537 1111 HA HIS 140 HA HIS 140 -5.735 7.544 -24.472 1112 HB2 HIS 140 2HB HIS 140 -8.022 7.831 -23.585 1113 HB3 HIS 140 1HB HIS 140 -7.472 9.186 -22.607 1114 HD1 HIS 140 HD1 HIS 140 -8.550 11.175 -23.632 1115 HD2 HIS 140 HD2 HIS 140 -6.922 8.638 -26.504 1116 HE1 HIS 140 HE1 HIS 140 -8.822 12.366 -25.827 1117 HE2 HIS 140 HE2 HIS 140 -7.739 10.869 -27.536 1118 H HIS 141 H HIS 141 -4.364 8.917 -25.357 1119 HA HIS 141 HA HIS 141 -2.321 10.215 -24.137 1120 HB2 HIS 141 2HB HIS 141 -2.351 9.931 -26.515 1121 HB3 HIS 141 1HB HIS 141 -3.791 10.925 -26.679 1122 HD1 HIS 141 HD1 HIS 141 -3.152 12.977 -27.855 1123 HD2 HIS 141 HD2 HIS 141 -0.260 11.839 -25.096 1124 HE1 HIS 141 HE1 HIS 141 -1.413 14.788 -27.916 1125 HE2 HIS 141 HE2 HIS 141 0.184 14.205 -26.056 1126 H HIS 142 H HIS 142 -2.163 11.778 -22.710 1127 HA HIS 142 HA HIS 142 -4.365 13.687 -22.385 1128 HB2 HIS 142 2HB HIS 142 -1.971 13.133 -20.611 1129 HB3 HIS 142 1HB HIS 142 -3.263 14.268 -20.244 1130 HD1 HIS 142 HD1 HIS 142 -5.544 13.268 -19.496 1131 HD2 HIS 142 HD2 HIS 142 -2.547 10.456 -20.158 1132 HE1 HIS 142 HE1 HIS 142 -6.385 11.126 -18.488 1133 HE2 HIS 142 HE2 HIS 142 -4.486 9.488 -18.751 1134 H HIS 143 H HIS 143 -3.447 15.920 -21.541 1135 HA HIS 143 HA HIS 143 -1.680 16.900 -23.644 1136 HB2 HIS 143 2HB HIS 143 -3.820 18.086 -23.146 1137 HB3 HIS 143 1HB HIS 143 -3.199 18.458 -21.541 1138 HD1 HIS 143 HD1 HIS 143 -1.682 20.450 -21.311 1139 HD2 HIS 143 HD2 HIS 143 -2.447 19.452 -25.274 1140 HE1 HIS 143 HE1 HIS 143 -0.760 22.350 -22.681 1141 HE2 HIS 143 HE2 HIS 143 -1.374 21.798 -25.066 Start of MODEL 4 1 H1 MET 1 1H MET 1 -10.603 5.648 -16.613 2 H2 MET 1 2H MET 1 -8.969 5.213 -16.688 3 H3 MET 1 3H MET 1 -9.482 6.697 -17.331 4 HA MET 1 HA MET 1 -8.368 7.001 -15.224 5 HB2 MET 1 2HB MET 1 -10.127 8.290 -14.074 6 HB3 MET 1 1HB MET 1 -10.124 8.590 -15.805 7 HG2 MET 1 2HG MET 1 -12.050 7.159 -16.093 8 HG3 MET 1 1HG MET 1 -12.020 6.729 -14.383 9 HE1 MET 1 3HE MET 1 -13.011 10.079 -12.648 10 HE2 MET 1 1HE MET 1 -11.371 9.523 -12.980 11 HE3 MET 1 2HE MET 1 -12.594 8.379 -12.429 12 HA PRO 2 HA PRO 2 -9.052 3.649 -12.369 13 HB2 PRO 2 2HB PRO 2 -7.154 4.317 -10.589 14 HB3 PRO 2 1HB PRO 2 -6.743 3.676 -12.185 15 HG2 PRO 2 2HG PRO 2 -6.693 6.498 -11.201 16 HG3 PRO 2 1HG PRO 2 -5.549 5.658 -12.263 17 HD2 PRO 2 2HD PRO 2 -7.538 7.361 -13.137 18 HD3 PRO 2 1HD PRO 2 -6.779 6.102 -14.130 19 H VAL 3 H VAL 3 -9.314 3.498 -9.888 20 HA VAL 3 HA VAL 3 -11.324 5.418 -9.107 21 HB VAL 3 HB VAL 3 -10.141 3.166 -7.466 22 HG11 VAL 3 1HG1 VAL 3 -11.334 4.847 -6.146 23 HG12 VAL 3 2HG1 VAL 3 -12.213 3.318 -6.180 24 HG13 VAL 3 3HG1 VAL 3 -12.745 4.664 -7.185 25 HG21 VAL 3 3HG2 VAL 3 -12.593 3.154 -9.225 26 HG22 VAL 3 1HG2 VAL 3 -12.065 1.839 -8.177 27 HG23 VAL 3 2HG2 VAL 3 -11.078 2.315 -9.559 28 H GLU 4 H GLU 4 -10.947 7.227 -7.986 29 HA GLU 4 HA GLU 4 -8.472 7.481 -6.440 30 HB2 GLU 4 2HB GLU 4 -8.023 8.288 -8.732 31 HB3 GLU 4 1HB GLU 4 -9.373 9.403 -8.592 32 HG2 GLU 4 2HG GLU 4 -8.123 10.358 -6.573 33 HG3 GLU 4 1HG GLU 4 -6.729 9.477 -7.202 34 H LEU 5 H LEU 5 -8.661 8.787 -4.669 35 HA LEU 5 HA LEU 5 -11.239 10.123 -4.221 36 HB2 LEU 5 2HB LEU 5 -10.478 8.645 -2.429 37 HB3 LEU 5 1HB LEU 5 -8.957 9.510 -2.329 38 HG LEU 5 HG LEU 5 -10.161 11.522 -1.560 39 HD11 LEU 5 1HD1 LEU 5 -12.494 11.448 -0.966 40 HD12 LEU 5 2HD1 LEU 5 -12.599 9.753 -1.467 41 HD13 LEU 5 3HD1 LEU 5 -12.316 11.012 -2.669 42 HD21 LEU 5 3HD2 LEU 5 -9.229 9.978 0.065 43 HD22 LEU 5 1HD2 LEU 5 -10.711 9.021 0.032 44 HD23 LEU 5 2HD2 LEU 5 -10.738 10.667 0.665 45 H ARG 6 H ARG 6 -11.330 12.206 -4.771 46 HA ARG 6 HA ARG 6 -8.826 13.750 -4.634 47 HB2 ARG 6 2HB ARG 6 -9.695 15.018 -6.639 48 HB3 ARG 6 1HB ARG 6 -9.148 13.374 -6.929 49 HG2 ARG 6 2HG ARG 6 -11.473 12.609 -6.918 50 HG3 ARG 6 1HG ARG 6 -12.007 14.272 -6.644 51 HD2 ARG 6 2HD ARG 6 -12.138 13.597 -9.019 52 HD3 ARG 6 1HD ARG 6 -11.063 14.967 -8.744 53 HE ARG 6 HE ARG 6 -9.398 12.814 -8.647 54 HH11 ARG 6 1HH1 ARG 6 -11.708 14.008 -11.005 55 HH12 ARG 6 2HH1 ARG 6 -10.846 13.344 -12.366 56 HH21 ARG 6 1HH2 ARG 6 -8.271 11.944 -10.422 57 HH22 ARG 6 2HH2 ARG 6 -8.903 12.159 -12.030 58 H ALA 7 H ALA 7 -9.764 16.226 -5.323 59 HA ALA 7 HA ALA 7 -10.807 17.117 -2.853 60 HB1 ALA 7 3HB ALA 7 -9.293 18.468 -4.203 61 HB2 ALA 7 1HB ALA 7 -10.790 19.335 -3.863 62 HB3 ALA 7 2HB ALA 7 -10.528 18.616 -5.452 63 H ASN 8 H ASN 8 -12.377 15.775 -5.488 64 HA ASN 8 HA ASN 8 -14.896 17.160 -5.082 65 HB2 ASN 8 2HB ASN 8 -14.040 16.118 -7.304 66 HB3 ASN 8 1HB ASN 8 -14.544 14.581 -6.608 67 HD21 ASN 8 1HD2 ASN 8 -15.590 17.632 -7.889 68 HD22 ASN 8 2HD2 ASN 8 -17.268 17.226 -8.040 69 H TRP 9 H TRP 9 -13.644 15.955 -2.838 70 HA TRP 9 HA TRP 9 -14.392 13.479 -1.996 71 HB2 TRP 9 2HB TRP 9 -13.116 15.560 -0.901 72 HB3 TRP 9 1HB TRP 9 -14.654 15.723 -0.082 73 HD1 TRP 9 HD1 TRP 9 -11.671 13.411 -0.370 74 HE1 TRP 9 HE1 TRP 9 -11.634 11.857 1.693 75 HE3 TRP 9 HE3 TRP 9 -16.173 14.686 1.666 76 HZ2 TRP 9 HZ2 TRP 9 -13.309 11.266 3.895 77 HZ3 TRP 9 HZ3 TRP 9 -16.885 13.585 3.750 78 HH2 TRP 9 HH2 TRP 9 -15.481 11.911 4.837 79 H SER 10 H SER 10 -16.314 12.570 -2.042 80 HA SER 10 HA SER 10 -18.638 13.949 -0.963 81 HB2 SER 10 2HB SER 10 -18.721 14.419 -3.369 82 HB3 SER 10 1HB SER 10 -18.526 12.703 -3.726 83 HG SER 10 HG SER 10 -20.761 13.817 -3.627 84 H GLU 11 H GLU 11 -20.523 12.321 -0.892 85 HA GLU 11 HA GLU 11 -19.835 10.026 0.540 86 HB2 GLU 11 2HB GLU 11 -22.339 10.624 -1.051 87 HB3 GLU 11 1HB GLU 11 -22.183 9.307 0.102 88 HG2 GLU 11 2HG GLU 11 -21.933 10.822 1.918 89 HG3 GLU 11 1HG GLU 11 -21.808 12.199 0.822 90 H GLU 12 H GLU 12 -20.839 10.385 -2.838 91 HA GLU 12 HA GLU 12 -20.502 7.704 -3.591 92 HB2 GLU 12 2HB GLU 12 -20.357 10.241 -5.225 93 HB3 GLU 12 1HB GLU 12 -20.373 8.626 -5.919 94 HG2 GLU 12 2HG GLU 12 -22.554 9.755 -4.181 95 HG3 GLU 12 1HG GLU 12 -22.572 9.748 -5.945 96 H ASP 13 H ASP 13 -18.315 10.482 -3.914 97 HA ASP 13 HA ASP 13 -16.233 9.237 -5.270 98 HB2 ASP 13 2HB ASP 13 -16.618 11.747 -4.613 99 HB3 ASP 13 1HB ASP 13 -15.671 11.329 -3.190 100 H LEU 14 H LEU 14 -16.428 9.883 -1.784 101 HA LEU 14 HA LEU 14 -14.088 8.524 -1.076 102 HB2 LEU 14 2HB LEU 14 -15.130 10.143 0.384 103 HB3 LEU 14 1HB LEU 14 -16.561 9.142 0.534 104 HG LEU 14 HG LEU 14 -15.082 7.394 1.614 105 HD11 LEU 14 1HD1 LEU 14 -12.935 8.222 0.834 106 HD12 LEU 14 2HD1 LEU 14 -12.988 8.169 2.596 107 HD13 LEU 14 3HD1 LEU 14 -13.162 9.709 1.754 108 HD21 LEU 14 3HD2 LEU 14 -15.096 8.533 3.788 109 HD22 LEU 14 1HD2 LEU 14 -16.604 8.762 2.904 110 HD23 LEU 14 2HD2 LEU 14 -15.414 10.063 2.971 111 H GLU 15 H GLU 15 -17.478 7.416 -0.999 112 HA GLU 15 HA GLU 15 -16.930 4.969 0.259 113 HB2 GLU 15 2HB GLU 15 -19.181 6.236 -0.142 114 HB3 GLU 15 1HB GLU 15 -19.231 5.296 -1.627 115 HG2 GLU 15 2HG GLU 15 -20.491 4.165 0.049 116 HG3 GLU 15 1HG GLU 15 -19.030 3.238 -0.287 117 H THR 16 H THR 16 -17.152 5.857 -3.174 118 HA THR 16 HA THR 16 -16.919 3.283 -4.258 119 HB THR 16 HB THR 16 -15.822 5.857 -5.419 120 HG1 THR 16 HG1 THR 16 -18.023 6.092 -5.087 121 HG21 THR 16 3HG2 THR 16 -16.610 3.278 -6.780 122 HG22 THR 16 1HG2 THR 16 -14.954 3.825 -6.513 123 HG23 THR 16 2HG2 THR 16 -16.026 4.739 -7.575 124 H VAL 17 H VAL 17 -14.483 5.587 -3.181 125 HA VAL 17 HA VAL 17 -12.205 4.159 -4.033 126 HB VAL 17 HB VAL 17 -12.539 6.166 -1.797 127 HG11 VAL 17 1HG1 VAL 17 -10.122 6.508 -1.949 128 HG12 VAL 17 2HG1 VAL 17 -10.010 5.183 -3.107 129 HG13 VAL 17 3HG1 VAL 17 -10.512 4.863 -1.447 130 HG21 VAL 17 3HG2 VAL 17 -11.682 7.772 -3.399 131 HG22 VAL 17 1HG2 VAL 17 -13.134 6.993 -4.023 132 HG23 VAL 17 2HG2 VAL 17 -11.546 6.507 -4.619 133 H ILE 18 H ILE 18 -13.781 4.362 -0.844 134 HA ILE 18 HA ILE 18 -12.101 2.540 0.474 135 HB ILE 18 HB ILE 18 -14.996 3.190 1.058 136 HG12 ILE 18 2HG1 ILE 18 -12.437 4.331 2.210 137 HG13 ILE 18 1HG1 ILE 18 -13.488 5.151 1.059 138 HG21 ILE 18 1HG2 ILE 18 -12.907 1.947 2.851 139 HG22 ILE 18 2HG2 ILE 18 -14.273 1.102 2.122 140 HG23 ILE 18 3HG2 ILE 18 -14.556 2.373 3.311 141 HD11 ILE 18 3HD1 ILE 18 -14.254 4.317 3.847 142 HD12 ILE 18 1HD1 ILE 18 -15.278 5.177 2.698 143 HD13 ILE 18 2HD1 ILE 18 -13.826 5.951 3.334 144 H ARG 19 H ARG 19 -15.185 2.039 -1.214 145 HA ARG 19 HA ARG 19 -15.373 -0.718 -0.628 146 HB2 ARG 19 2HB ARG 19 -16.592 0.905 -2.864 147 HB3 ARG 19 1HB ARG 19 -17.006 -0.770 -2.520 148 HG2 ARG 19 2HG ARG 19 -17.862 -0.179 -0.360 149 HG3 ARG 19 1HG ARG 19 -17.306 1.483 -0.548 150 HD2 ARG 19 2HD ARG 19 -19.661 1.424 -0.964 151 HD3 ARG 19 1HD ARG 19 -18.834 1.713 -2.493 152 HE ARG 19 HE ARG 19 -19.141 -0.790 -2.835 153 HH11 ARG 19 1HH1 ARG 19 -21.372 1.196 -1.008 154 HH12 ARG 19 2HH1 ARG 19 -22.743 0.173 -1.328 155 HH21 ARG 19 1HH2 ARG 19 -20.939 -2.115 -3.269 156 HH22 ARG 19 2HH2 ARG 19 -22.496 -1.694 -2.623 157 H ALA 20 H ALA 20 -13.819 1.042 -3.266 158 HA ALA 20 HA ALA 20 -13.235 -1.193 -4.887 159 HB1 ALA 20 3HB ALA 20 -13.044 1.112 -5.686 160 HB2 ALA 20 1HB ALA 20 -11.541 0.220 -5.928 161 HB3 ALA 20 2HB ALA 20 -11.678 1.374 -4.602 162 H VAL 21 H VAL 21 -11.730 0.113 -2.029 163 HA VAL 21 HA VAL 21 -9.328 -1.418 -2.196 164 HB VAL 21 HB VAL 21 -10.631 -0.082 0.185 165 HG11 VAL 21 1HG1 VAL 21 -9.085 -1.818 0.908 166 HG12 VAL 21 2HG1 VAL 21 -8.428 -0.217 1.246 167 HG13 VAL 21 3HG1 VAL 21 -7.825 -1.147 -0.128 168 HG21 VAL 21 3HG2 VAL 21 -8.991 1.693 -0.197 169 HG22 VAL 21 1HG2 VAL 21 -10.051 1.479 -1.591 170 HG23 VAL 21 2HG2 VAL 21 -8.406 0.846 -1.629 171 H TYR 22 H TYR 22 -12.482 -1.902 -0.678 172 HA TYR 22 HA TYR 22 -11.589 -4.523 0.300 173 HB2 TYR 22 2HB TYR 22 -14.069 -2.933 0.991 174 HB3 TYR 22 1HB TYR 22 -13.686 -4.524 1.635 175 HD1 TYR 22 HD2 TYR 22 -11.363 -4.710 2.855 176 HD2 TYR 22 HD1 TYR 22 -13.426 -1.055 2.170 177 HE1 TYR 22 HE2 TYR 22 -10.094 -3.661 4.679 178 HE2 TYR 22 HE1 TYR 22 -12.163 0.005 3.991 179 HH TYR 22 HH TYR 22 -9.412 -1.388 5.370 180 H ARG 23 H ARG 23 -14.901 -3.657 -0.488 181 HA ARG 23 HA ARG 23 -14.870 -5.479 -2.784 182 HB2 ARG 23 2HB ARG 23 -16.754 -5.610 -0.427 183 HB3 ARG 23 1HB ARG 23 -17.133 -6.341 -1.981 184 HG2 ARG 23 2HG ARG 23 -15.174 -7.774 -1.801 185 HG3 ARG 23 1HG ARG 23 -14.750 -7.019 -0.263 186 HD2 ARG 23 2HD ARG 23 -16.745 -7.864 0.769 187 HD3 ARG 23 1HD ARG 23 -17.345 -8.463 -0.776 188 HE ARG 23 HE ARG 23 -15.131 -9.866 -0.626 189 HH11 ARG 23 1HH1 ARG 23 -17.355 -9.104 1.971 190 HH12 ARG 23 2HH1 ARG 23 -17.046 -10.575 2.840 191 HH21 ARG 23 1HH2 ARG 23 -14.738 -11.816 0.519 192 HH22 ARG 23 2HH2 ARG 23 -15.568 -12.110 2.020 193 H GLN 24 H GLN 24 -15.414 -4.210 -4.421 194 HA GLN 24 HA GLN 24 -16.575 -1.668 -4.072 195 HB2 GLN 24 2HB GLN 24 -14.979 -2.384 -5.896 196 HB3 GLN 24 1HB GLN 24 -16.338 -3.177 -6.675 197 HG2 GLN 24 2HG GLN 24 -17.493 -1.024 -6.830 198 HG3 GLN 24 1HG GLN 24 -16.102 -0.236 -6.088 199 HE21 GLN 24 1HE2 GLN 24 -14.169 -0.076 -7.265 200 HE22 GLN 24 2HE2 GLN 24 -14.131 -0.263 -8.982 201 H VAL 25 H VAL 25 -17.912 -3.974 -6.411 202 HA VAL 25 HA VAL 25 -20.590 -3.215 -5.453 203 HB VAL 25 HB VAL 25 -19.966 -4.388 -8.166 204 HG11 VAL 25 1HG1 VAL 25 -22.118 -3.465 -8.791 205 HG12 VAL 25 2HG1 VAL 25 -22.309 -2.760 -7.184 206 HG13 VAL 25 3HG1 VAL 25 -22.295 -4.513 -7.384 207 HG21 VAL 25 3HG2 VAL 25 -18.696 -2.307 -7.909 208 HG22 VAL 25 1HG2 VAL 25 -20.174 -1.462 -7.448 209 HG23 VAL 25 2HG2 VAL 25 -20.006 -2.123 -9.075 210 H LEU 26 H LEU 26 -19.385 -5.077 -3.965 211 HA LEU 26 HA LEU 26 -20.735 -7.575 -4.745 212 HB2 LEU 26 2HB LEU 26 -18.134 -7.238 -3.243 213 HB3 LEU 26 1HB LEU 26 -19.020 -8.746 -3.300 214 HG LEU 26 HG LEU 26 -17.306 -8.973 -4.882 215 HD11 LEU 26 1HD1 LEU 26 -18.448 -9.145 -7.020 216 HD12 LEU 26 2HD1 LEU 26 -19.761 -8.138 -6.411 217 HD13 LEU 26 3HD1 LEU 26 -19.468 -9.726 -5.703 218 HD21 LEU 26 3HD2 LEU 26 -16.579 -6.674 -5.048 219 HD22 LEU 26 1HD2 LEU 26 -18.040 -6.247 -5.939 220 HD23 LEU 26 2HD2 LEU 26 -16.852 -7.333 -6.662 221 H GLY 27 H GLY 27 -22.431 -7.941 -3.488 222 HA2 GLY 27 2HA GLY 27 -22.545 -6.682 -0.847 223 HA3 GLY 27 1HA GLY 27 -23.900 -7.376 -1.724 224 H ASN 28 H ASN 28 -23.772 -7.992 0.837 225 HA ASN 28 HA ASN 28 -23.024 -10.829 0.797 226 HB2 ASN 28 2HB ASN 28 -21.213 -9.619 1.978 227 HB3 ASN 28 1HB ASN 28 -22.399 -8.937 3.084 228 HD21 ASN 28 1HD2 ASN 28 -22.371 -12.248 1.860 229 HD22 ASN 28 2HD2 ASN 28 -22.103 -12.990 3.402 230 H ASP 29 H ASP 29 -24.419 -12.145 1.936 231 HA ASP 29 HA ASP 29 -27.067 -11.230 2.237 232 HB2 ASP 29 2HB ASP 29 -25.716 -13.774 3.141 233 HB3 ASP 29 1HB ASP 29 -27.439 -13.481 3.345 234 H TYR 30 H TYR 30 -24.953 -12.554 4.809 235 HA TYR 30 HA TYR 30 -26.526 -11.051 6.756 236 HB2 TYR 30 2HB TYR 30 -24.330 -13.089 7.161 237 HB3 TYR 30 1HB TYR 30 -25.243 -12.318 8.453 238 HD1 TYR 30 HD1 TYR 30 -27.847 -12.603 8.312 239 HD2 TYR 30 HD2 TYR 30 -25.053 -15.129 6.337 240 HE1 TYR 30 HE1 TYR 30 -29.554 -14.367 8.167 241 HE2 TYR 30 HE2 TYR 30 -26.749 -16.901 6.192 242 HH TYR 30 HH TYR 30 -30.059 -16.342 6.836 243 H VAL 31 H VAL 31 -25.609 -9.058 5.739 244 HA VAL 31 HA VAL 31 -22.871 -8.421 6.135 245 HB VAL 31 HB VAL 31 -24.056 -7.257 4.415 246 HG11 VAL 31 1HG1 VAL 31 -26.306 -7.351 5.288 247 HG12 VAL 31 2HG1 VAL 31 -25.886 -5.686 4.881 248 HG13 VAL 31 3HG1 VAL 31 -25.887 -6.208 6.565 249 HG21 VAL 31 3HG2 VAL 31 -23.436 -5.344 6.661 250 HG22 VAL 31 1HG2 VAL 31 -23.554 -4.927 4.953 251 HG23 VAL 31 2HG2 VAL 31 -22.275 -6.007 5.510 252 H MET 32 H MET 32 -25.832 -7.512 7.872 253 HA MET 32 HA MET 32 -26.248 -6.864 9.994 254 HB2 MET 32 2HB MET 32 -23.526 -8.062 10.532 255 HB3 MET 32 1HB MET 32 -24.659 -7.556 11.777 256 HG2 MET 32 2HG MET 32 -26.276 -9.199 10.994 257 HG3 MET 32 1HG MET 32 -25.168 -9.689 9.715 258 HE1 MET 32 3HE MET 32 -22.354 -9.601 11.224 259 HE2 MET 32 1HE MET 32 -22.842 -10.917 10.156 260 HE3 MET 32 2HE MET 32 -22.222 -11.274 11.767 261 H ALA 33 H ALA 33 -22.747 -6.299 9.985 262 HA ALA 33 HA ALA 33 -23.219 -3.410 10.040 263 HB1 ALA 33 3HB ALA 33 -21.551 -4.855 12.097 264 HB2 ALA 33 1HB ALA 33 -23.118 -4.100 12.385 265 HB3 ALA 33 2HB ALA 33 -21.727 -3.106 11.949 266 H SER 34 H SER 34 -20.941 -6.072 9.880 267 HA SER 34 HA SER 34 -18.914 -6.357 8.946 268 HB2 SER 34 2HB SER 34 -18.696 -5.533 6.598 269 HB3 SER 34 1HB SER 34 -20.197 -6.400 6.909 270 HG SER 34 HG SER 34 -20.602 -3.814 7.406 271 H GLU 35 H GLU 35 -18.091 -5.061 10.795 272 HA GLU 35 HA GLU 35 -17.148 -2.407 10.201 273 HB2 GLU 35 2HB GLU 35 -16.545 -4.274 12.496 274 HB3 GLU 35 1HB GLU 35 -15.939 -2.627 12.376 275 HG2 GLU 35 2HG GLU 35 -18.246 -1.795 12.355 276 HG3 GLU 35 1HG GLU 35 -18.831 -3.449 12.524 277 H ARG 36 H ARG 36 -15.668 -2.226 8.672 278 HA ARG 36 HA ARG 36 -13.508 -4.205 8.550 279 HB2 ARG 36 2HB ARG 36 -13.178 -3.485 6.207 280 HB3 ARG 36 1HB ARG 36 -14.799 -4.093 6.493 281 HG2 ARG 36 2HG ARG 36 -14.162 -1.156 6.507 282 HG3 ARG 36 1HG ARG 36 -14.574 -2.031 5.033 283 HD2 ARG 36 2HD ARG 36 -16.750 -2.394 5.704 284 HD3 ARG 36 1HD ARG 36 -16.360 -2.238 7.416 285 HE ARG 36 HE ARG 36 -15.871 0.240 6.252 286 HH11 ARG 36 1HH1 ARG 36 -18.625 -1.880 6.799 287 HH12 ARG 36 2HH1 ARG 36 -19.763 -0.573 6.891 288 HH21 ARG 36 1HH2 ARG 36 -17.357 1.949 6.436 289 HH22 ARG 36 2HH2 ARG 36 -19.052 1.599 6.684 290 H LEU 37 H LEU 37 -12.175 -3.330 10.106 291 HA LEU 37 HA LEU 37 -10.561 -1.987 10.990 292 HB2 LEU 37 2HB LEU 37 -10.244 -1.213 8.087 293 HB3 LEU 37 1HB LEU 37 -9.083 -0.856 9.351 294 HG LEU 37 HG LEU 37 -9.878 -3.645 8.510 295 HD11 LEU 37 1HD1 LEU 37 -7.454 -2.001 7.798 296 HD12 LEU 37 2HD1 LEU 37 -8.715 -2.557 6.695 297 HD13 LEU 37 3HD1 LEU 37 -7.643 -3.725 7.470 298 HD21 LEU 37 3HD2 LEU 37 -7.930 -4.325 9.815 299 HD22 LEU 37 1HD2 LEU 37 -9.109 -3.484 10.822 300 HD23 LEU 37 2HD2 LEU 37 -7.653 -2.648 10.282 301 H VAL 38 H VAL 38 -12.826 -0.916 11.609 302 HA VAL 38 HA VAL 38 -13.617 1.459 10.344 303 HB VAL 38 HB VAL 38 -14.959 1.911 12.380 304 HG11 VAL 38 1HG1 VAL 38 -15.090 -0.923 11.361 305 HG12 VAL 38 2HG1 VAL 38 -15.803 0.489 10.582 306 HG13 VAL 38 3HG1 VAL 38 -16.397 -0.045 12.155 307 HG21 VAL 38 3HG2 VAL 38 -13.650 -0.600 13.425 308 HG22 VAL 38 1HG2 VAL 38 -14.990 0.259 14.185 309 HG23 VAL 38 2HG2 VAL 38 -13.410 1.032 14.053 310 H SER 39 H SER 39 -11.194 0.900 12.776 311 HA SER 39 HA SER 39 -10.933 3.543 13.722 312 HB2 SER 39 2HB SER 39 -8.528 2.731 14.210 313 HB3 SER 39 1HB SER 39 -9.854 1.860 14.982 314 HG SER 39 HG SER 39 -8.028 0.998 13.124 315 H ALA 40 H ALA 40 -9.295 1.780 11.128 316 HA ALA 40 HA ALA 40 -7.759 4.010 10.238 317 HB1 ALA 40 3HB ALA 40 -7.018 1.722 9.839 318 HB2 ALA 40 1HB ALA 40 -7.197 2.603 8.320 319 HB3 ALA 40 2HB ALA 40 -8.424 1.436 8.814 320 H GLU 41 H GLU 41 -10.813 2.516 9.217 321 HA GLU 41 HA GLU 41 -11.160 4.131 6.932 322 HB2 GLU 41 2HB GLU 41 -12.439 2.021 7.422 323 HB3 GLU 41 1HB GLU 41 -13.389 2.941 8.585 324 HG2 GLU 41 2HG GLU 41 -14.067 4.471 6.768 325 HG3 GLU 41 1HG GLU 41 -13.189 3.461 5.626 326 H SER 42 H SER 42 -11.997 4.627 10.327 327 HA SER 42 HA SER 42 -13.478 6.993 9.988 328 HB2 SER 42 2HB SER 42 -11.735 6.083 12.287 329 HB3 SER 42 1HB SER 42 -12.765 7.514 12.345 330 HG SER 42 HG SER 42 -13.515 4.794 12.111 331 H LEU 43 H LEU 43 -9.998 6.446 10.402 332 HA LEU 43 HA LEU 43 -9.177 9.106 10.467 333 HB2 LEU 43 2HB LEU 43 -7.770 6.693 9.332 334 HB3 LEU 43 1HB LEU 43 -7.001 8.246 9.592 335 HG LEU 43 HG LEU 43 -8.198 6.525 11.765 336 HD11 LEU 43 1HD1 LEU 43 -5.892 6.083 12.415 337 HD12 LEU 43 2HD1 LEU 43 -5.312 7.005 11.029 338 HD13 LEU 43 3HD1 LEU 43 -6.207 5.506 10.780 339 HD21 LEU 43 3HD2 LEU 43 -6.560 9.056 11.904 340 HD22 LEU 43 1HD2 LEU 43 -7.066 8.082 13.283 341 HD23 LEU 43 2HD2 LEU 43 -8.272 8.903 12.294 342 H LEU 44 H LEU 44 -10.046 7.067 7.744 343 HA LEU 44 HA LEU 44 -9.222 9.055 5.812 344 HB2 LEU 44 2HB LEU 44 -9.088 6.631 5.338 345 HB3 LEU 44 1HB LEU 44 -10.838 6.537 5.419 346 HG LEU 44 HG LEU 44 -10.977 8.096 3.491 347 HD11 LEU 44 1HD1 LEU 44 -8.989 8.559 2.178 348 HD12 LEU 44 2HD1 LEU 44 -7.991 7.724 3.368 349 HD13 LEU 44 3HD1 LEU 44 -8.827 9.214 3.808 350 HD21 LEU 44 3HD2 LEU 44 -11.111 5.693 3.140 351 HD22 LEU 44 1HD2 LEU 44 -9.354 5.597 3.030 352 HD23 LEU 44 2HD2 LEU 44 -10.268 6.472 1.801 353 H ARG 45 H ARG 45 -12.301 7.751 7.017 354 HA ARG 45 HA ARG 45 -13.907 9.286 5.241 355 HB2 ARG 45 2HB ARG 45 -14.558 7.098 6.292 356 HB3 ARG 45 1HB ARG 45 -14.778 7.955 7.810 357 HG2 ARG 45 2HG ARG 45 -16.530 9.307 6.829 358 HG3 ARG 45 1HG ARG 45 -16.278 8.534 5.263 359 HD2 ARG 45 2HD ARG 45 -17.189 7.158 7.791 360 HD3 ARG 45 1HD ARG 45 -18.224 7.610 6.439 361 HE ARG 45 HE ARG 45 -16.248 5.442 6.488 362 HH11 ARG 45 1HH1 ARG 45 -18.773 7.172 4.753 363 HH12 ARG 45 2HH1 ARG 45 -18.991 5.903 3.572 364 HH21 ARG 45 1HH2 ARG 45 -16.563 3.787 4.953 365 HH22 ARG 45 2HH2 ARG 45 -17.708 4.013 3.653 366 H ASN 46 H ASN 46 -12.539 9.945 8.374 367 HA ASN 46 HA ASN 46 -14.238 12.307 8.658 368 HB2 ASN 46 2HB ASN 46 -12.120 11.164 10.492 369 HB3 ASN 46 1HB ASN 46 -13.017 12.643 10.820 370 HD21 ASN 46 1HD2 ASN 46 -15.267 12.502 11.216 371 HD22 ASN 46 2HD2 ASN 46 -15.982 11.019 11.758 372 H GLY 47 H GLY 47 -11.529 11.531 6.990 373 HA2 GLY 47 2HA GLY 47 -10.309 12.928 5.621 374 HA3 GLY 47 1HA GLY 47 -11.073 14.300 6.398 375 H LYS 48 H LYS 48 -8.898 11.708 7.586 376 HA LYS 48 HA LYS 48 -7.086 13.857 8.462 377 HB2 LYS 48 2HB LYS 48 -7.718 11.187 9.680 378 HB3 LYS 48 1HB LYS 48 -6.222 12.026 10.063 379 HG2 LYS 48 2HG LYS 48 -7.530 13.950 10.858 380 HG3 LYS 48 1HG LYS 48 -9.013 13.054 10.521 381 HD2 LYS 48 2HD LYS 48 -8.635 11.530 12.224 382 HD3 LYS 48 1HD LYS 48 -6.902 11.858 12.267 383 HE2 LYS 48 2HE LYS 48 -7.935 12.788 14.228 384 HE3 LYS 48 1HE LYS 48 -7.383 14.092 13.181 385 HZ1 LYS 48 3HZ LYS 48 -9.581 14.512 14.109 386 HZ2 LYS 48 1HZ LYS 48 -10.184 13.113 13.361 387 HZ3 LYS 48 2HZ LYS 48 -9.636 14.412 12.420 388 H ILE 49 H ILE 49 -7.143 10.528 7.167 389 HA ILE 49 HA ILE 49 -4.265 10.792 6.641 390 HB ILE 49 HB ILE 49 -4.182 8.369 6.426 391 HG12 ILE 49 2HG1 ILE 49 -7.115 8.380 7.169 392 HG13 ILE 49 1HG1 ILE 49 -6.508 8.106 5.539 393 HG21 ILE 49 1HG2 ILE 49 -5.579 9.295 8.934 394 HG22 ILE 49 2HG2 ILE 49 -3.844 9.351 8.617 395 HG23 ILE 49 3HG2 ILE 49 -4.663 7.796 8.766 396 HD11 ILE 49 3HD1 ILE 49 -7.066 6.014 6.632 397 HD12 ILE 49 1HD1 ILE 49 -5.952 6.388 7.949 398 HD13 ILE 49 2HD1 ILE 49 -5.331 6.113 6.321 399 H THR 50 H THR 50 -3.517 9.446 4.728 400 HA THR 50 HA THR 50 -4.969 10.354 2.368 401 HB THR 50 HB THR 50 -2.859 9.620 1.185 402 HG1 THR 50 HG1 THR 50 -1.668 9.516 3.755 403 HG21 THR 50 3HG2 THR 50 -3.222 11.954 1.844 404 HG22 THR 50 1HG2 THR 50 -1.521 11.508 1.984 405 HG23 THR 50 2HG2 THR 50 -2.526 11.615 3.429 406 H VAL 51 H VAL 51 -4.516 8.665 0.408 407 HA VAL 51 HA VAL 51 -6.102 6.372 1.132 408 HB VAL 51 HB VAL 51 -4.923 7.182 -1.530 409 HG11 VAL 51 1HG1 VAL 51 -6.389 5.484 -2.520 410 HG12 VAL 51 2HG1 VAL 51 -6.859 4.951 -0.906 411 HG13 VAL 51 3HG1 VAL 51 -5.192 4.757 -1.447 412 HG21 VAL 51 3HG2 VAL 51 -7.249 7.735 -2.087 413 HG22 VAL 51 1HG2 VAL 51 -6.661 8.678 -0.718 414 HG23 VAL 51 2HG2 VAL 51 -7.737 7.306 -0.448 415 H ARG 52 H ARG 52 -2.745 6.938 0.109 416 HA ARG 52 HA ARG 52 -1.997 4.221 0.016 417 HB2 ARG 52 2HB ARG 52 0.318 5.000 0.304 418 HB3 ARG 52 1HB ARG 52 -0.543 5.935 -0.907 419 HG2 ARG 52 2HG ARG 52 -0.775 7.783 0.571 420 HG3 ARG 52 1HG ARG 52 -0.183 6.836 1.937 421 HD2 ARG 52 2HD ARG 52 2.009 6.716 0.990 422 HD3 ARG 52 1HD ARG 52 1.449 7.430 -0.523 423 HE ARG 52 HE ARG 52 0.910 9.439 0.948 424 HH11 ARG 52 1HH1 ARG 52 3.637 7.283 1.483 425 HH12 ARG 52 2HH1 ARG 52 4.569 8.488 2.320 426 HH21 ARG 52 1HH2 ARG 52 2.153 11.006 2.042 427 HH22 ARG 52 2HH2 ARG 52 3.743 10.589 2.628 428 H GLU 53 H GLU 53 -2.374 6.464 2.673 429 HA GLU 53 HA GLU 53 -1.174 4.855 4.677 430 HB2 GLU 53 2HB GLU 53 -1.664 7.275 4.935 431 HB3 GLU 53 1HB GLU 53 -3.382 6.902 4.948 432 HG2 GLU 53 2HG GLU 53 -2.587 7.248 7.192 433 HG3 GLU 53 1HG GLU 53 -3.060 5.565 6.972 434 H PHE 54 H PHE 54 -4.465 5.206 3.456 435 HA PHE 54 HA PHE 54 -5.723 3.379 5.176 436 HB2 PHE 54 2HB PHE 54 -6.840 5.034 3.622 437 HB3 PHE 54 1HB PHE 54 -6.474 3.935 2.300 438 HD1 PHE 54 HD1 PHE 54 -8.181 4.041 5.598 439 HD2 PHE 54 HD2 PHE 54 -8.003 2.306 1.717 440 HE1 PHE 54 HE1 PHE 54 -10.284 2.844 6.041 441 HE2 PHE 54 HE2 PHE 54 -10.104 1.103 2.153 442 HZ PHE 54 HZ PHE 54 -11.248 1.376 4.317 443 H VAL 55 H VAL 55 -4.119 2.973 2.047 444 HA VAL 55 HA VAL 55 -4.514 0.214 1.749 445 HB VAL 55 HB VAL 55 -2.207 1.939 0.822 446 HG11 VAL 55 1HG1 VAL 55 -1.459 -0.374 0.956 447 HG12 VAL 55 2HG1 VAL 55 -1.661 0.108 -0.728 448 HG13 VAL 55 3HG1 VAL 55 -2.878 -0.902 0.052 449 HG21 VAL 55 3HG2 VAL 55 -3.313 1.748 -1.370 450 HG22 VAL 55 1HG2 VAL 55 -4.332 2.547 -0.172 451 HG23 VAL 55 2HG2 VAL 55 -4.635 0.865 -0.608 452 H ARG 56 H ARG 56 -1.970 2.023 3.432 453 HA ARG 56 HA ARG 56 -0.308 -0.124 4.079 454 HB2 ARG 56 2HB ARG 56 0.360 2.232 4.345 455 HB3 ARG 56 1HB ARG 56 -0.779 2.403 5.671 456 HG2 ARG 56 2HG ARG 56 0.486 1.095 7.105 457 HG3 ARG 56 1HG ARG 56 1.363 0.323 5.785 458 HD2 ARG 56 2HD ARG 56 2.853 1.830 6.893 459 HD3 ARG 56 1HD ARG 56 2.461 2.501 5.315 460 HE ARG 56 HE ARG 56 0.745 3.866 6.708 461 HH11 ARG 56 1HH1 ARG 56 3.881 2.827 7.880 462 HH12 ARG 56 2HH1 ARG 56 4.161 4.282 8.798 463 HH21 ARG 56 1HH2 ARG 56 1.125 5.794 7.891 464 HH22 ARG 56 2HH2 ARG 56 2.611 5.969 8.798 465 H ALA 57 H ALA 57 -3.059 1.232 5.843 466 HA ALA 57 HA ALA 57 -2.888 -0.352 8.136 467 HB1 ALA 57 3HB ALA 57 -5.377 0.704 6.793 468 HB2 ALA 57 1HB ALA 57 -4.376 1.579 7.951 469 HB3 ALA 57 2HB ALA 57 -5.258 0.139 8.460 470 H VAL 58 H VAL 58 -4.702 -0.922 5.135 471 HA VAL 58 HA VAL 58 -5.644 -3.493 5.968 472 HB VAL 58 HB VAL 58 -5.555 -2.464 3.131 473 HG11 VAL 58 1HG1 VAL 58 -6.165 -4.804 3.343 474 HG12 VAL 58 2HG1 VAL 58 -7.570 -3.851 2.863 475 HG13 VAL 58 3HG1 VAL 58 -7.403 -4.397 4.532 476 HG21 VAL 58 3HG2 VAL 58 -6.547 -0.740 4.530 477 HG22 VAL 58 1HG2 VAL 58 -7.647 -1.923 5.236 478 HG23 VAL 58 2HG2 VAL 58 -7.779 -1.507 3.528 479 H ALA 59 H ALA 59 -2.738 -2.351 4.555 480 HA ALA 59 HA ALA 59 -1.976 -4.943 3.494 481 HB1 ALA 59 3HB ALA 59 -0.381 -2.398 3.748 482 HB2 ALA 59 1HB ALA 59 -1.260 -2.936 2.318 483 HB3 ALA 59 2HB ALA 59 0.130 -3.855 2.896 484 H LYS 60 H LYS 60 -1.955 -3.421 6.491 485 HA LYS 60 HA LYS 60 0.228 -5.156 7.441 486 HB2 LYS 60 2HB LYS 60 0.492 -2.650 7.663 487 HB3 LYS 60 1HB LYS 60 -0.844 -2.681 8.803 488 HG2 LYS 60 2HG LYS 60 0.440 -4.130 10.284 489 HG3 LYS 60 1HG LYS 60 1.775 -4.136 9.130 490 HD2 LYS 60 2HD LYS 60 0.668 -1.666 10.460 491 HD3 LYS 60 1HD LYS 60 2.092 -2.548 11.014 492 HE2 LYS 60 2HE LYS 60 3.207 -2.107 8.890 493 HE3 LYS 60 1HE LYS 60 1.772 -1.270 8.298 494 HZ1 LYS 60 3HZ LYS 60 3.522 0.242 9.116 495 HZ2 LYS 60 1HZ LYS 60 3.348 -0.425 10.669 496 HZ3 LYS 60 2HZ LYS 60 2.057 0.415 9.960 497 H SER 61 H SER 61 -2.909 -5.378 7.140 498 HA SER 61 HA SER 61 -3.199 -7.103 9.407 499 HB2 SER 61 2HB SER 61 -5.232 -5.974 10.314 500 HB3 SER 61 1HB SER 61 -3.761 -5.030 10.532 501 HG SER 61 HG SER 61 -4.442 -3.982 8.464 502 H GLU 62 H GLU 62 -5.541 -8.002 9.427 503 HA GLU 62 HA GLU 62 -7.135 -9.220 8.382 504 HB2 GLU 62 2HB GLU 62 -6.862 -7.054 6.296 505 HB3 GLU 62 1HB GLU 62 -8.053 -8.343 6.199 506 HG2 GLU 62 2HG GLU 62 -7.831 -6.296 8.394 507 HG3 GLU 62 1HG GLU 62 -9.034 -6.320 7.104 508 H LEU 63 H LEU 63 -7.613 -10.397 6.187 509 HA LEU 63 HA LEU 63 -7.008 -11.828 4.533 510 HB2 LEU 63 2HB LEU 63 -5.588 -9.796 3.843 511 HB3 LEU 63 1HB LEU 63 -4.234 -10.667 4.530 512 HG LEU 63 HG LEU 63 -5.915 -11.985 2.425 513 HD11 LEU 63 1HD1 LEU 63 -4.439 -11.041 0.710 514 HD12 LEU 63 2HD1 LEU 63 -3.686 -10.013 1.929 515 HD13 LEU 63 3HD1 LEU 63 -5.386 -9.788 1.513 516 HD21 LEU 63 3HD2 LEU 63 -4.198 -13.297 3.597 517 HD22 LEU 63 1HD2 LEU 63 -2.977 -12.123 3.105 518 HD23 LEU 63 2HD2 LEU 63 -3.812 -13.088 1.889 519 H TYR 64 H TYR 64 -5.160 -11.503 7.379 520 HA TYR 64 HA TYR 64 -4.631 -13.063 8.936 521 HB2 TYR 64 2HB TYR 64 -5.226 -15.159 6.842 522 HB3 TYR 64 1HB TYR 64 -4.892 -15.472 8.542 523 HD1 TYR 64 HD2 TYR 64 -6.485 -13.785 10.095 524 HD2 TYR 64 HD1 TYR 64 -7.427 -15.431 6.287 525 HE1 TYR 64 HE2 TYR 64 -8.882 -13.564 10.597 526 HE2 TYR 64 HE1 TYR 64 -9.825 -15.203 6.773 527 HH TYR 64 HH TYR 64 -11.286 -15.091 8.820 528 H LYS 65 H LYS 65 -3.044 -15.175 8.999 529 HA LYS 65 HA LYS 65 -0.888 -15.873 8.893 530 HB2 LYS 65 2HB LYS 65 -0.737 -14.303 6.319 531 HB3 LYS 65 1HB LYS 65 0.474 -15.440 6.900 532 HG2 LYS 65 2HG LYS 65 -2.359 -16.059 6.086 533 HG3 LYS 65 1HG LYS 65 -0.877 -16.531 5.252 534 HD2 LYS 65 2HD LYS 65 -1.371 -17.365 8.088 535 HD3 LYS 65 1HD LYS 65 -2.084 -18.267 6.750 536 HE2 LYS 65 2HE LYS 65 0.859 -17.704 7.094 537 HE3 LYS 65 1HE LYS 65 0.062 -19.212 7.538 538 HZ1 LYS 65 3HZ LYS 65 0.510 -18.094 4.842 539 HZ2 LYS 65 1HZ LYS 65 -0.699 -19.252 5.115 540 HZ3 LYS 65 2HZ LYS 65 0.920 -19.628 5.437 541 H GLU 66 H GLU 66 -1.745 -12.611 9.002 542 HA GLU 66 HA GLU 66 -0.922 -10.835 10.129 543 HB2 GLU 66 2HB GLU 66 1.165 -12.759 11.160 544 HB3 GLU 66 1HB GLU 66 0.890 -11.133 11.768 545 HG2 GLU 66 2HG GLU 66 -1.427 -11.832 12.361 546 HG3 GLU 66 1HG GLU 66 -0.976 -13.481 11.921 547 H LYS 67 H LYS 67 2.098 -12.553 9.420 548 HA LYS 67 HA LYS 67 3.186 -10.166 8.165 549 HB2 LYS 67 2HB LYS 67 4.415 -12.900 8.619 550 HB3 LYS 67 1HB LYS 67 5.271 -11.482 8.033 551 HG2 LYS 67 2HG LYS 67 4.905 -10.346 10.140 552 HG3 LYS 67 1HG LYS 67 3.949 -11.706 10.729 553 HD2 LYS 67 2HD LYS 67 5.888 -13.152 10.634 554 HD3 LYS 67 1HD LYS 67 6.858 -11.854 9.938 555 HE2 LYS 67 2HE LYS 67 6.535 -10.535 11.987 556 HE3 LYS 67 1HE LYS 67 5.589 -11.851 12.677 557 HZ1 LYS 67 3HZ LYS 67 8.431 -12.087 11.835 558 HZ2 LYS 67 1HZ LYS 67 7.511 -13.263 12.641 559 HZ3 LYS 67 2HZ LYS 67 7.920 -11.820 13.432 560 H PHE 68 H PHE 68 1.032 -12.154 7.158 561 HA PHE 68 HA PHE 68 0.258 -12.964 5.199 562 HB2 PHE 68 2HB PHE 68 2.169 -10.882 4.136 563 HB3 PHE 68 1HB PHE 68 0.976 -11.724 3.146 564 HD1 PHE 68 HD1 PHE 68 -1.445 -11.472 3.685 565 HD2 PHE 68 HD2 PHE 68 1.550 -9.059 5.498 566 HE1 PHE 68 HE1 PHE 68 -3.169 -9.867 4.396 567 HE2 PHE 68 HE2 PHE 68 -0.166 -7.444 6.197 568 HZ PHE 68 HZ PHE 68 -2.532 -7.848 5.647 569 H LEU 69 H LEU 69 2.090 -14.540 6.360 570 HA LEU 69 HA LEU 69 4.207 -15.442 4.777 571 HB2 LEU 69 2HB LEU 69 2.465 -16.862 6.787 572 HB3 LEU 69 1HB LEU 69 3.831 -17.636 6.001 573 HG LEU 69 HG LEU 69 4.670 -16.981 8.065 574 HD11 LEU 69 1HD1 LEU 69 6.144 -16.296 6.251 575 HD12 LEU 69 2HD1 LEU 69 6.272 -15.204 7.629 576 HD13 LEU 69 3HD1 LEU 69 5.358 -14.717 6.203 577 HD21 LEU 69 3HD2 LEU 69 2.748 -15.599 8.711 578 HD22 LEU 69 1HD2 LEU 69 3.381 -14.285 7.718 579 HD23 LEU 69 2HD2 LEU 69 4.292 -14.846 9.120 580 H TYR 70 H TYR 70 4.274 -16.569 2.945 581 HA TYR 70 HA TYR 70 1.861 -17.705 1.817 582 HB2 TYR 70 2HB TYR 70 3.421 -16.578 0.312 583 HB3 TYR 70 1HB TYR 70 4.718 -17.666 0.798 584 HD1 TYR 70 HD2 TYR 70 1.487 -17.479 -0.995 585 HD2 TYR 70 HD1 TYR 70 4.966 -19.796 -0.212 586 HE1 TYR 70 HE2 TYR 70 0.841 -19.039 -2.782 587 HE2 TYR 70 HE1 TYR 70 4.332 -21.364 -1.995 588 HH TYR 70 HH TYR 70 2.154 -22.075 -3.125 589 H GLY 71 H GLY 71 4.755 -18.748 3.457 590 HA2 GLY 71 2HA GLY 71 3.914 -21.035 4.555 591 HA3 GLY 71 1HA GLY 71 4.270 -21.553 2.911 592 H ASN 72 H ASN 72 5.948 -22.886 3.512 593 HA ASN 72 HA ASN 72 8.085 -22.257 5.177 594 HB2 ASN 72 2HB ASN 72 7.669 -24.534 4.482 595 HB3 ASN 72 1HB ASN 72 7.951 -24.118 2.796 596 HD21 ASN 72 1HD2 ASN 72 10.032 -23.926 2.047 597 HD22 ASN 72 2HD2 ASN 72 11.418 -24.387 2.976 598 H PHE 73 H PHE 73 7.705 -21.726 1.703 599 HA PHE 73 HA PHE 73 10.396 -20.745 1.415 600 HB2 PHE 73 2HB PHE 73 8.091 -20.656 -0.543 601 HB3 PHE 73 1HB PHE 73 9.778 -20.319 -0.918 602 HD1 PHE 73 HD1 PHE 73 11.462 -22.194 -0.626 603 HD2 PHE 73 HD2 PHE 73 7.254 -22.822 -0.629 604 HE1 PHE 73 HE1 PHE 73 11.822 -24.573 -1.125 605 HE2 PHE 73 HE2 PHE 73 7.607 -25.205 -1.126 606 HZ PHE 73 HZ PHE 73 9.894 -26.082 -1.376 607 H GLN 74 H GLN 74 10.722 -18.907 2.558 608 HA GLN 74 HA GLN 74 8.880 -16.777 2.784 609 HB2 GLN 74 2HB GLN 74 11.884 -16.767 3.133 610 HB3 GLN 74 1HB GLN 74 10.800 -15.484 3.655 611 HG2 GLN 74 2HG GLN 74 10.853 -18.316 4.670 612 HG3 GLN 74 1HG GLN 74 11.400 -16.875 5.529 613 HE21 GLN 74 1HE2 GLN 74 9.344 -18.860 6.218 614 HE22 GLN 74 2HE2 GLN 74 7.888 -17.962 6.456 615 H THR 75 H THR 75 11.219 -17.621 0.397 616 HA THR 75 HA THR 75 11.547 -15.190 -0.935 617 HB THR 75 HB THR 75 11.758 -16.898 -2.963 618 HG1 THR 75 HG1 THR 75 11.974 -18.996 -2.298 619 HG21 THR 75 3HG2 THR 75 14.061 -17.326 -2.303 620 HG22 THR 75 1HG2 THR 75 13.682 -16.923 -0.628 621 HG23 THR 75 2HG2 THR 75 13.617 -15.674 -1.873 622 H ARG 76 H ARG 76 9.095 -17.735 -1.312 623 HA ARG 76 HA ARG 76 7.765 -16.408 -3.464 624 HB2 ARG 76 2HB ARG 76 6.608 -18.543 -1.670 625 HB3 ARG 76 1HB ARG 76 6.087 -18.115 -3.293 626 HG2 ARG 76 2HG ARG 76 8.582 -18.757 -3.877 627 HG3 ARG 76 1HG ARG 76 8.421 -19.717 -2.407 628 HD2 ARG 76 2HD ARG 76 7.764 -21.183 -4.099 629 HD3 ARG 76 1HD ARG 76 6.235 -20.579 -3.457 630 HE ARG 76 HE ARG 76 6.750 -18.860 -5.483 631 HH11 ARG 76 1HH1 ARG 76 6.573 -22.348 -5.258 632 HH12 ARG 76 2HH1 ARG 76 6.223 -22.572 -6.945 633 HH21 ARG 76 1HH2 ARG 76 6.294 -19.150 -7.712 634 HH22 ARG 76 2HH2 ARG 76 6.056 -20.759 -8.335 635 H VAL 77 H VAL 77 7.669 -16.200 -0.031 636 HA VAL 77 HA VAL 77 5.174 -14.875 0.268 637 HB VAL 77 HB VAL 77 7.656 -14.506 1.969 638 HG11 VAL 77 1HG1 VAL 77 5.935 -12.858 2.423 639 HG12 VAL 77 2HG1 VAL 77 6.059 -14.001 3.764 640 HG13 VAL 77 3HG1 VAL 77 4.732 -14.137 2.610 641 HG21 VAL 77 3HG2 VAL 77 5.481 -16.579 2.214 642 HG22 VAL 77 1HG2 VAL 77 6.762 -16.296 3.392 643 HG23 VAL 77 2HG2 VAL 77 7.162 -16.871 1.774 644 H ILE 78 H ILE 78 8.386 -13.907 -0.685 645 HA ILE 78 HA ILE 78 8.011 -11.101 -0.629 646 HB ILE 78 HB ILE 78 9.824 -12.708 -2.445 647 HG12 ILE 78 2HG1 ILE 78 10.316 -13.173 -0.114 648 HG13 ILE 78 1HG1 ILE 78 11.584 -12.157 -0.790 649 HG21 ILE 78 1HG2 ILE 78 11.125 -10.621 -2.616 650 HG22 ILE 78 2HG2 ILE 78 9.865 -9.783 -1.708 651 HG23 ILE 78 3HG2 ILE 78 9.503 -10.468 -3.292 652 HD11 ILE 78 3HD1 ILE 78 10.984 -11.464 1.456 653 HD12 ILE 78 1HD1 ILE 78 9.313 -11.222 0.949 654 HD13 ILE 78 2HD1 ILE 78 10.594 -10.205 0.284 655 H GLU 79 H GLU 79 7.858 -13.439 -3.344 656 HA GLU 79 HA GLU 79 6.859 -11.740 -5.294 657 HB2 GLU 79 2HB GLU 79 6.403 -14.669 -4.826 658 HB3 GLU 79 1HB GLU 79 5.603 -13.838 -6.150 659 HG2 GLU 79 2HG GLU 79 7.477 -14.741 -7.141 660 HG3 GLU 79 1HG GLU 79 7.957 -13.077 -6.819 661 H LEU 80 H LEU 80 5.090 -13.460 -2.783 662 HA LEU 80 HA LEU 80 2.477 -12.999 -3.550 663 HB2 LEU 80 2HB LEU 80 3.455 -14.305 -1.535 664 HB3 LEU 80 1HB LEU 80 3.372 -12.778 -0.683 665 HG LEU 80 HG LEU 80 1.001 -14.214 -1.890 666 HD11 LEU 80 1HD1 LEU 80 0.388 -14.711 0.429 667 HD12 LEU 80 2HD1 LEU 80 1.911 -14.007 0.974 668 HD13 LEU 80 3HD1 LEU 80 1.919 -15.460 -0.025 669 HD21 LEU 80 3HD2 LEU 80 1.136 -11.800 -0.087 670 HD22 LEU 80 1HD2 LEU 80 -0.339 -12.643 -0.562 671 HD23 LEU 80 2HD2 LEU 80 0.633 -11.815 -1.778 672 H ASN 81 H ASN 81 4.437 -10.962 -1.355 673 HA ASN 81 HA ASN 81 2.347 -8.974 -1.355 674 HB2 ASN 81 2HB ASN 81 4.968 -9.181 0.095 675 HB3 ASN 81 1HB ASN 81 3.984 -7.717 0.152 676 HD21 ASN 81 1HD2 ASN 81 4.313 -10.982 1.200 677 HD22 ASN 81 2HD2 ASN 81 2.952 -10.996 2.267 678 H TYR 82 H TYR 82 5.305 -9.466 -3.056 679 HA TYR 82 HA TYR 82 5.719 -6.827 -3.984 680 HB2 TYR 82 2HB TYR 82 7.070 -9.112 -4.304 681 HB3 TYR 82 1HB TYR 82 6.164 -9.151 -5.810 682 HD1 TYR 82 HD2 TYR 82 6.279 -6.881 -7.207 683 HD2 TYR 82 HD1 TYR 82 9.120 -8.092 -4.281 684 HE1 TYR 82 HE2 TYR 82 7.967 -5.431 -8.253 685 HE2 TYR 82 HE1 TYR 82 10.813 -6.646 -5.319 686 HH TYR 82 HH TYR 82 10.212 -4.228 -7.326 687 H LYS 83 H LYS 83 3.722 -9.502 -5.106 688 HA LYS 83 HA LYS 83 2.532 -7.978 -7.253 689 HB2 LYS 83 2HB LYS 83 2.961 -10.442 -7.358 690 HB3 LYS 83 1HB LYS 83 1.751 -10.670 -6.108 691 HG2 LYS 83 2HG LYS 83 0.029 -9.807 -7.590 692 HG3 LYS 83 1HG LYS 83 1.238 -9.520 -8.845 693 HD2 LYS 83 2HD LYS 83 0.576 -12.213 -7.645 694 HD3 LYS 83 1HD LYS 83 -0.012 -11.620 -9.199 695 HE2 LYS 83 2HE LYS 83 2.187 -11.590 -10.109 696 HE3 LYS 83 1HE LYS 83 2.911 -11.864 -8.526 697 HZ1 LYS 83 3HZ LYS 83 2.067 -14.072 -8.492 698 HZ2 LYS 83 1HZ LYS 83 2.852 -13.854 -9.974 699 HZ3 LYS 83 2HZ LYS 83 1.158 -13.832 -9.900 700 H HIS 84 H HIS 84 2.064 -8.337 -3.944 701 HA HIS 84 HA HIS 84 -0.792 -7.924 -3.907 702 HB2 HIS 84 2HB HIS 84 0.214 -9.334 -2.217 703 HB3 HIS 84 1HB HIS 84 1.291 -8.040 -1.717 704 HD1 HIS 84 HD1 HIS 84 0.537 -7.842 0.672 705 HD2 HIS 84 HD2 HIS 84 -2.617 -7.606 -2.039 706 HE1 HIS 84 HE1 HIS 84 -1.471 -7.167 2.026 707 HE2 HIS 84 HE2 HIS 84 -3.396 -7.241 0.402 708 H LEU 85 H LEU 85 2.104 -5.997 -3.121 709 HA LEU 85 HA LEU 85 0.353 -3.647 -2.776 710 HB2 LEU 85 2HB LEU 85 3.183 -4.181 -1.895 711 HB3 LEU 85 1HB LEU 85 2.421 -2.604 -1.787 712 HG LEU 85 HG LEU 85 1.445 -5.105 -0.411 713 HD11 LEU 85 1HD1 LEU 85 3.530 -4.302 0.535 714 HD12 LEU 85 2HD1 LEU 85 2.188 -3.990 1.635 715 HD13 LEU 85 3HD1 LEU 85 2.863 -2.676 0.669 716 HD21 LEU 85 3HD2 LEU 85 -0.103 -3.616 0.734 717 HD22 LEU 85 1HD2 LEU 85 -0.354 -3.544 -1.011 718 HD23 LEU 85 2HD2 LEU 85 0.507 -2.243 -0.190 719 H LEU 86 H LEU 86 2.613 -4.986 -4.991 720 HA LEU 86 HA LEU 86 2.771 -2.361 -6.328 721 HB2 LEU 86 2HB LEU 86 4.729 -4.652 -6.487 722 HB3 LEU 86 1HB LEU 86 4.836 -3.173 -7.423 723 HG LEU 86 HG LEU 86 4.994 -3.330 -4.410 724 HD11 LEU 86 1HD1 LEU 86 6.944 -4.332 -5.438 725 HD12 LEU 86 2HD1 LEU 86 7.363 -2.769 -4.737 726 HD13 LEU 86 3HD1 LEU 86 7.147 -2.924 -6.479 727 HD21 LEU 86 3HD2 LEU 86 5.685 -0.995 -4.543 728 HD22 LEU 86 1HD2 LEU 86 4.066 -1.215 -5.208 729 HD23 LEU 86 2HD2 LEU 86 5.445 -1.013 -6.289 730 H GLY 87 H GLY 87 1.374 -5.352 -6.469 731 HA2 GLY 87 2HA GLY 87 0.097 -6.407 -8.043 732 HA3 GLY 87 1HA GLY 87 0.037 -4.856 -8.853 733 H ARG 88 H ARG 88 3.031 -6.651 -8.371 734 HA ARG 88 HA ARG 88 2.942 -7.967 -10.894 735 HB2 ARG 88 2HB ARG 88 5.085 -6.626 -11.679 736 HB3 ARG 88 1HB ARG 88 3.464 -6.093 -12.090 737 HG2 ARG 88 2HG ARG 88 4.709 -4.192 -11.415 738 HG3 ARG 88 1HG ARG 88 3.551 -4.551 -10.137 739 HD2 ARG 88 2HD ARG 88 5.571 -4.046 -9.043 740 HD3 ARG 88 1HD ARG 88 5.421 -5.802 -8.980 741 HE ARG 88 HE ARG 88 7.144 -5.984 -10.590 742 HH11 ARG 88 1HH1 ARG 88 6.525 -2.701 -9.561 743 HH12 ARG 88 2HH1 ARG 88 8.041 -2.082 -10.142 744 HH21 ARG 88 1HH2 ARG 88 9.158 -5.174 -11.349 745 HH22 ARG 88 2HH2 ARG 88 9.549 -3.492 -11.143 746 H ALA 89 H ALA 89 5.137 -8.924 -11.458 747 HA ALA 89 HA ALA 89 6.078 -10.265 -9.101 748 HB1 ALA 89 3HB ALA 89 5.756 -11.439 -11.229 749 HB2 ALA 89 1HB ALA 89 7.414 -11.587 -10.646 750 HB3 ALA 89 2HB ALA 89 7.035 -10.466 -11.954 751 HA PRO 90 HA PRO 90 9.749 -7.989 -8.085 752 HB2 PRO 90 2HB PRO 90 11.218 -10.567 -8.122 753 HB3 PRO 90 1HB PRO 90 11.048 -9.386 -6.819 754 HG2 PRO 90 2HG PRO 90 9.736 -11.705 -6.742 755 HG3 PRO 90 1HG PRO 90 8.983 -10.205 -6.165 756 HD2 PRO 90 2HD PRO 90 8.556 -11.675 -8.737 757 HD3 PRO 90 1HD PRO 90 7.374 -10.849 -7.699 758 H TYR 91 H TYR 91 10.765 -6.804 -9.569 759 HA TYR 91 HA TYR 91 11.566 -8.014 -12.081 760 HB2 TYR 91 2HB TYR 91 10.400 -5.717 -11.759 761 HB3 TYR 91 1HB TYR 91 12.007 -5.133 -11.342 762 HD1 TYR 91 HD1 TYR 91 9.992 -6.682 -14.011 763 HD2 TYR 91 HD2 TYR 91 13.624 -4.700 -13.034 764 HE1 TYR 91 HE1 TYR 91 10.483 -6.424 -16.404 765 HE2 TYR 91 HE2 TYR 91 14.126 -4.431 -15.427 766 HH TYR 91 HH TYR 91 13.506 -5.628 -17.571 767 H ASP 92 H ASP 92 12.989 -6.807 -9.157 768 HA ASP 92 HA ASP 92 15.656 -7.390 -10.249 769 HB2 ASP 92 2HB ASP 92 15.562 -5.048 -9.758 770 HB3 ASP 92 1HB ASP 92 14.810 -5.343 -8.193 771 H GLU 93 H GLU 93 16.987 -8.712 -9.085 772 HA GLU 93 HA GLU 93 15.652 -10.499 -7.283 773 HB2 GLU 93 2HB GLU 93 17.241 -11.293 -8.979 774 HB3 GLU 93 1HB GLU 93 18.537 -10.412 -8.182 775 HG2 GLU 93 2HG GLU 93 18.408 -11.831 -6.263 776 HG3 GLU 93 1HG GLU 93 16.954 -12.616 -6.881 777 H SER 94 H SER 94 17.896 -7.836 -6.953 778 HA SER 94 HA SER 94 18.670 -8.450 -4.283 779 HB2 SER 94 2HB SER 94 19.963 -6.934 -5.810 780 HB3 SER 94 1HB SER 94 18.685 -5.733 -5.618 781 HG SER 94 HG SER 94 20.656 -6.551 -3.832 782 H GLU 95 H GLU 95 15.984 -6.765 -5.760 783 HA GLU 95 HA GLU 95 14.843 -5.528 -3.542 784 HB2 GLU 95 2HB GLU 95 13.551 -6.930 -5.886 785 HB3 GLU 95 1HB GLU 95 12.627 -6.052 -4.675 786 HG2 GLU 95 2HG GLU 95 14.797 -4.836 -6.365 787 HG3 GLU 95 1HG GLU 95 13.076 -4.767 -6.743 788 H VAL 96 H VAL 96 14.557 -8.883 -4.644 789 HA VAL 96 HA VAL 96 12.841 -9.820 -2.635 790 HB VAL 96 HB VAL 96 15.052 -11.366 -4.006 791 HG11 VAL 96 1HG1 VAL 96 12.522 -12.308 -2.659 792 HG12 VAL 96 2HG1 VAL 96 14.165 -12.517 -2.055 793 HG13 VAL 96 3HG1 VAL 96 13.663 -13.330 -3.536 794 HG21 VAL 96 3HG2 VAL 96 13.569 -10.286 -5.622 795 HG22 VAL 96 1HG2 VAL 96 12.171 -11.004 -4.823 796 HG23 VAL 96 2HG2 VAL 96 13.355 -12.036 -5.626 797 H ILE 97 H ILE 97 16.377 -9.786 -2.813 798 HA ILE 97 HA ILE 97 16.939 -10.917 -0.324 799 HB ILE 97 HB ILE 97 18.541 -8.825 -1.794 800 HG12 ILE 97 2HG1 ILE 97 18.709 -11.845 -1.917 801 HG13 ILE 97 1HG1 ILE 97 18.002 -10.823 -3.165 802 HG21 ILE 97 1HG2 ILE 97 20.459 -9.769 -0.590 803 HG22 ILE 97 2HG2 ILE 97 19.367 -10.835 0.295 804 HG23 ILE 97 3HG2 ILE 97 19.261 -9.088 0.511 805 HD11 ILE 97 3HD1 ILE 97 20.250 -11.519 -3.754 806 HD12 ILE 97 1HD1 ILE 97 20.876 -10.787 -2.277 807 HD13 ILE 97 2HD1 ILE 97 20.168 -9.773 -3.533 808 H PHE 98 H PHE 98 16.663 -7.493 -1.238 809 HA PHE 98 HA PHE 98 17.199 -6.361 1.249 810 HB2 PHE 98 2HB PHE 98 17.176 -5.009 -0.744 811 HB3 PHE 98 1HB PHE 98 15.477 -5.367 -1.027 812 HD1 PHE 98 HD2 PHE 98 17.781 -3.692 1.356 813 HD2 PHE 98 HD1 PHE 98 13.817 -3.980 -0.169 814 HE1 PHE 98 HE2 PHE 98 17.147 -1.684 2.630 815 HE2 PHE 98 HE1 PHE 98 13.178 -1.974 1.100 816 HZ PHE 98 HZ PHE 98 14.842 -0.825 2.504 817 H HIS 99 H HIS 99 14.082 -7.367 -0.135 818 HA HIS 99 HA HIS 99 12.627 -6.407 2.133 819 HB2 HIS 99 2HB HIS 99 11.849 -8.071 -0.250 820 HB3 HIS 99 1HB HIS 99 10.722 -7.765 1.072 821 HD1 HIS 99 HD1 HIS 99 10.195 -5.194 1.560 822 HD2 HIS 99 HD2 HIS 99 12.067 -6.014 -2.068 823 HE1 HIS 99 HE1 HIS 99 9.931 -3.113 0.169 824 HE2 HIS 99 HE2 HIS 99 11.306 -3.540 -1.901 825 H LEU 100 H LEU 100 14.089 -9.465 1.270 826 HA LEU 100 HA LEU 100 12.944 -10.959 3.399 827 HB2 LEU 100 2HB LEU 100 15.485 -11.252 1.815 828 HB3 LEU 100 1HB LEU 100 15.109 -12.329 3.147 829 HG LEU 100 HG LEU 100 13.369 -11.961 0.705 830 HD11 LEU 100 1HD1 LEU 100 15.302 -14.173 1.408 831 HD12 LEU 100 2HD1 LEU 100 15.486 -13.000 0.103 832 HD13 LEU 100 3HD1 LEU 100 14.180 -14.181 0.046 833 HD21 LEU 100 3HD2 LEU 100 13.268 -13.937 2.983 834 HD22 LEU 100 1HD2 LEU 100 12.254 -13.988 1.540 835 HD23 LEU 100 2HD2 LEU 100 12.118 -12.638 2.667 836 H ASP 101 H ASP 101 15.950 -9.122 3.066 837 HA ASP 101 HA ASP 101 16.970 -9.532 5.642 838 HB2 ASP 101 2HB ASP 101 18.285 -8.585 3.797 839 HB3 ASP 101 1HB ASP 101 17.288 -7.136 3.819 840 H LEU 102 H LEU 102 14.878 -6.989 4.369 841 HA LEU 102 HA LEU 102 14.673 -5.483 6.739 842 HB2 LEU 102 2HB LEU 102 14.080 -4.729 4.426 843 HB3 LEU 102 1HB LEU 102 12.639 -5.721 4.521 844 HG LEU 102 HG LEU 102 11.768 -4.351 6.333 845 HD11 LEU 102 1HD1 LEU 102 13.891 -3.785 7.401 846 HD12 LEU 102 2HD1 LEU 102 12.938 -2.339 7.066 847 HD13 LEU 102 3HD1 LEU 102 14.307 -2.752 6.034 848 HD21 LEU 102 3HD2 LEU 102 12.761 -2.745 3.980 849 HD22 LEU 102 1HD2 LEU 102 11.496 -2.230 5.096 850 HD23 LEU 102 2HD2 LEU 102 11.249 -3.649 4.080 851 H TYR 103 H TYR 103 12.516 -7.948 5.345 852 HA TYR 103 HA TYR 103 10.586 -8.008 7.346 853 HB2 TYR 103 2HB TYR 103 10.055 -9.179 5.393 854 HB3 TYR 103 1HB TYR 103 11.587 -10.043 5.380 855 HD1 TYR 103 HD1 TYR 103 8.435 -9.765 7.377 856 HD2 TYR 103 HD2 TYR 103 11.662 -12.234 6.115 857 HE1 TYR 103 HE1 TYR 103 7.375 -11.700 8.463 858 HE2 TYR 103 HE2 TYR 103 10.609 -14.171 7.198 859 HH TYR 103 HH TYR 103 9.030 -14.612 9.008 860 H GLU 104 H GLU 104 13.608 -9.853 7.113 861 HA GLU 104 HA GLU 104 13.199 -11.419 9.420 862 HB2 GLU 104 2HB GLU 104 15.674 -10.610 7.909 863 HB3 GLU 104 1HB GLU 104 15.745 -11.647 9.326 864 HG2 GLU 104 2HG GLU 104 14.075 -12.273 6.910 865 HG3 GLU 104 1HG GLU 104 15.738 -12.824 7.114 866 H ASN 105 H ASN 105 15.053 -8.408 8.965 867 HA ASN 105 HA ASN 105 15.881 -8.445 11.723 868 HB2 ASN 105 2HB ASN 105 16.373 -6.504 9.474 869 HB3 ASN 105 1HB ASN 105 16.944 -6.217 11.114 870 HD21 ASN 105 1HD2 ASN 105 17.314 -8.106 8.237 871 HD22 ASN 105 2HD2 ASN 105 18.805 -8.868 8.685 872 H GLU 106 H GLU 106 13.963 -6.107 9.782 873 HA GLU 106 HA GLU 106 13.298 -4.777 12.299 874 HB2 GLU 106 2HB GLU 106 12.874 -3.888 9.446 875 HB3 GLU 106 1HB GLU 106 12.443 -2.947 10.867 876 HG2 GLU 106 2HG GLU 106 14.912 -3.171 11.520 877 HG3 GLU 106 1HG GLU 106 15.162 -3.666 9.846 878 H GLY 107 H GLY 107 11.940 -7.016 10.205 879 HA2 GLY 107 2HA GLY 107 9.934 -8.135 10.836 880 HA3 GLY 107 1HA GLY 107 9.364 -6.638 11.556 881 H PHE 108 H PHE 108 7.717 -8.081 9.953 882 HA PHE 108 HA PHE 108 7.876 -7.222 7.218 883 HB2 PHE 108 2HB PHE 108 6.870 -9.395 7.983 884 HB3 PHE 108 1HB PHE 108 5.528 -8.474 8.652 885 HD1 PHE 108 HD2 PHE 108 7.337 -9.192 5.499 886 HD2 PHE 108 HD1 PHE 108 3.716 -7.889 7.315 887 HE1 PHE 108 HE2 PHE 108 6.222 -9.264 3.311 888 HE2 PHE 108 HE1 PHE 108 2.595 -7.961 5.128 889 HZ PHE 108 HZ PHE 108 3.845 -8.647 3.124 890 H ASP 109 H ASP 109 6.311 -6.151 10.133 891 HA ASP 109 HA ASP 109 4.389 -4.412 9.101 892 HB2 ASP 109 2HB ASP 109 6.078 -4.070 11.599 893 HB3 ASP 109 1HB ASP 109 4.590 -3.198 11.250 894 H ALA 110 H ALA 110 7.817 -3.903 9.812 895 HA ALA 110 HA ALA 110 7.871 -1.175 9.011 896 HB1 ALA 110 3HB ALA 110 10.300 -1.395 9.118 897 HB2 ALA 110 1HB ALA 110 10.146 -3.147 9.249 898 HB3 ALA 110 2HB ALA 110 9.540 -2.107 10.540 899 H ASP 111 H ASP 111 8.467 -4.246 7.390 900 HA ASP 111 HA ASP 111 9.534 -3.259 4.996 901 HB2 ASP 111 2HB ASP 111 9.464 -5.670 5.619 902 HB3 ASP 111 1HB ASP 111 7.731 -5.673 5.314 903 H ILE 112 H ILE 112 6.166 -3.855 5.938 904 HA ILE 112 HA ILE 112 4.909 -3.032 3.597 905 HB ILE 112 HB ILE 112 3.980 -2.764 6.462 906 HG12 ILE 112 2HG1 ILE 112 4.381 -5.068 5.708 907 HG13 ILE 112 1HG1 ILE 112 2.668 -4.769 5.985 908 HG21 ILE 112 1HG2 ILE 112 2.760 -1.184 5.067 909 HG22 ILE 112 2HG2 ILE 112 1.714 -2.508 5.580 910 HG23 ILE 112 3HG2 ILE 112 2.357 -2.478 3.938 911 HD11 ILE 112 3HD1 ILE 112 2.319 -4.524 3.590 912 HD12 ILE 112 1HD1 ILE 112 3.023 -6.092 3.985 913 HD13 ILE 112 2HD1 ILE 112 4.037 -4.817 3.306 914 H ASP 113 H ASP 113 5.964 -1.116 6.383 915 HA ASP 113 HA ASP 113 4.896 1.349 5.597 916 HB2 ASP 113 2HB ASP 113 7.370 0.736 7.225 917 HB3 ASP 113 1HB ASP 113 6.683 2.346 7.049 918 H SER 114 H SER 114 7.781 -0.322 4.600 919 HA SER 114 HA SER 114 9.222 1.820 3.511 920 HB2 SER 114 2HB SER 114 9.270 -1.024 2.511 921 HB3 SER 114 1HB SER 114 10.575 0.165 2.462 922 HG SER 114 HG SER 114 9.596 -1.340 4.605 923 H TYR 115 H TYR 115 6.834 -0.364 2.045 924 HA TYR 115 HA TYR 115 7.095 0.529 -0.617 925 HB2 TYR 115 2HB TYR 115 4.696 -0.643 0.810 926 HB3 TYR 115 1HB TYR 115 4.784 -0.389 -0.928 927 HD1 TYR 115 HD1 TYR 115 6.103 -2.341 1.892 928 HD2 TYR 115 HD2 TYR 115 6.003 -1.889 -2.331 929 HE1 TYR 115 HE1 TYR 115 7.083 -4.577 1.639 930 HE2 TYR 115 HE2 TYR 115 6.989 -4.127 -2.601 931 HH TYR 115 HH TYR 115 7.406 -6.285 0.120 932 H ILE 116 H ILE 116 4.947 1.528 1.984 933 HA ILE 116 HA ILE 116 3.443 3.346 0.392 934 HB ILE 116 HB ILE 116 3.653 3.175 3.403 935 HG12 ILE 116 2HG1 ILE 116 3.017 1.025 2.396 936 HG13 ILE 116 1HG1 ILE 116 1.670 1.735 3.275 937 HG21 ILE 116 1HG2 ILE 116 1.527 4.384 1.637 938 HG22 ILE 116 2HG2 ILE 116 2.645 5.257 2.685 939 HG23 ILE 116 3HG2 ILE 116 1.417 4.205 3.390 940 HD11 ILE 116 3HD1 ILE 116 2.054 1.744 0.291 941 HD12 ILE 116 1HD1 ILE 116 0.721 2.517 1.151 942 HD13 ILE 116 2HD1 ILE 116 0.908 0.763 1.204 943 H ASP 117 H ASP 117 6.380 3.588 2.207 944 HA ASP 117 HA ASP 117 6.297 6.451 2.501 945 HB2 ASP 117 2HB ASP 117 7.493 5.035 4.126 946 HB3 ASP 117 1HB ASP 117 8.604 4.522 2.859 947 H SER 118 H SER 118 7.503 4.183 0.166 948 HA SER 118 HA SER 118 9.617 5.585 -0.959 949 HB2 SER 118 2HB SER 118 7.682 3.690 -2.305 950 HB3 SER 118 1HB SER 118 9.243 4.180 -2.962 951 HG SER 118 HG SER 118 8.864 2.862 -0.465 952 HA PRO 119 HA PRO 119 7.227 9.078 -2.452 953 HB2 PRO 119 2HB PRO 119 9.396 10.492 -3.351 954 HB3 PRO 119 1HB PRO 119 8.852 10.474 -1.669 955 HG2 PRO 119 2HG PRO 119 11.062 8.940 -2.967 956 HG3 PRO 119 1HG PRO 119 11.015 9.704 -1.370 957 HD2 PRO 119 2HD PRO 119 10.693 7.044 -1.717 958 HD3 PRO 119 1HD PRO 119 9.880 7.941 -0.419 959 H GLU 120 H GLU 120 9.879 7.673 -4.378 960 HA GLU 120 HA GLU 120 9.280 8.740 -6.857 961 HB2 GLU 120 2HB GLU 120 11.294 7.444 -6.460 962 HB3 GLU 120 1HB GLU 120 10.347 5.992 -6.185 963 HG2 GLU 120 2HG GLU 120 11.203 5.751 -8.343 964 HG3 GLU 120 1HG GLU 120 9.530 6.251 -8.576 965 H TYR 121 H TYR 121 8.129 5.646 -5.543 966 HA TYR 121 HA TYR 121 6.560 5.101 -7.870 967 HB2 TYR 121 2HB TYR 121 6.511 3.694 -5.195 968 HB3 TYR 121 1HB TYR 121 5.937 3.056 -6.736 969 HD1 TYR 121 HD2 TYR 121 7.699 2.832 -8.625 970 HD2 TYR 121 HD1 TYR 121 8.700 3.289 -4.515 971 HE1 TYR 121 HE2 TYR 121 9.940 1.932 -9.077 972 HE2 TYR 121 HE1 TYR 121 10.948 2.395 -4.958 973 HH TYR 121 HH TYR 121 12.193 2.045 -8.096 974 H THR 122 H THR 122 5.878 6.259 -4.609 975 HA THR 122 HA THR 122 3.066 6.067 -4.788 976 HB THR 122 HB THR 122 4.718 7.941 -3.080 977 HG1 THR 122 HG1 THR 122 5.273 5.967 -2.372 978 HG21 THR 122 3HG2 THR 122 1.861 7.005 -2.765 979 HG22 THR 122 1HG2 THR 122 2.367 8.627 -3.241 980 HG23 THR 122 2HG2 THR 122 2.750 8.022 -1.630 981 H ASN 123 H ASN 123 5.333 8.689 -5.546 982 HA ASN 123 HA ASN 123 3.244 10.581 -6.054 983 HB2 ASN 123 2HB ASN 123 5.478 11.281 -5.299 984 HB3 ASN 123 1HB ASN 123 6.170 10.694 -6.807 985 HD21 ASN 123 1HD2 ASN 123 4.162 13.136 -5.331 986 HD22 ASN 123 2HD2 ASN 123 4.213 14.256 -6.652 987 H SER 124 H SER 124 4.999 8.267 -8.005 988 HA SER 124 HA SER 124 4.191 9.472 -10.489 989 HB2 SER 124 2HB SER 124 5.080 7.291 -11.462 990 HB3 SER 124 1HB SER 124 6.239 8.285 -10.581 991 HG SER 124 HG SER 124 6.367 6.818 -9.054 992 H PHE 125 H PHE 125 3.053 6.797 -8.469 993 HA PHE 125 HA PHE 125 1.037 6.060 -10.412 994 HB2 PHE 125 2HB PHE 125 2.112 4.341 -9.014 995 HB3 PHE 125 1HB PHE 125 1.457 5.107 -7.571 996 HD1 PHE 125 HD2 PHE 125 0.624 3.189 -10.592 997 HD2 PHE 125 HD1 PHE 125 -0.821 4.779 -6.919 998 HE1 PHE 125 HE2 PHE 125 -1.403 1.820 -10.804 999 HE2 PHE 125 HE1 PHE 125 -2.858 3.408 -7.127 1000 HZ PHE 125 HZ PHE 125 -3.148 1.929 -9.070 1001 H GLY 126 H GLY 126 1.182 7.737 -7.304 1002 HA2 GLY 126 2HA GLY 126 -0.423 9.609 -7.081 1003 HA3 GLY 126 1HA GLY 126 -1.642 8.506 -7.703 1004 H ASP 127 H ASP 127 -0.752 9.983 -5.018 1005 HA ASP 127 HA ASP 127 -0.627 7.999 -3.011 1006 HB2 ASP 127 2HB ASP 127 -0.009 10.411 -2.737 1007 HB3 ASP 127 1HB ASP 127 -1.716 10.821 -2.807 1008 H TRP 128 H TRP 128 -3.295 9.774 -4.465 1009 HA TRP 128 HA TRP 128 -5.193 8.556 -2.624 1010 HB2 TRP 128 2HB TRP 128 -5.553 10.752 -4.672 1011 HB3 TRP 128 1HB TRP 128 -6.780 10.211 -3.531 1012 HD1 TRP 128 HD1 TRP 128 -3.503 12.193 -3.687 1013 HE1 TRP 128 HE1 TRP 128 -3.252 13.557 -1.514 1014 HE3 TRP 128 HE3 TRP 128 -7.465 10.292 -1.074 1015 HZ2 TRP 128 HZ2 TRP 128 -4.568 13.795 0.966 1016 HZ3 TRP 128 HZ3 TRP 128 -7.902 11.144 1.189 1017 HH2 TRP 128 HH2 TRP 128 -6.481 12.861 2.189 1018 H VAL 129 H VAL 129 -3.883 7.224 -5.071 1019 HA VAL 129 HA VAL 129 -6.323 6.581 -6.575 1020 HB VAL 129 HB VAL 129 -3.452 5.937 -7.277 1021 HG11 VAL 129 1HG1 VAL 129 -5.991 5.669 -8.884 1022 HG12 VAL 129 2HG1 VAL 129 -5.001 4.350 -8.259 1023 HG13 VAL 129 3HG1 VAL 129 -4.361 5.420 -9.507 1024 HG21 VAL 129 3HG2 VAL 129 -3.845 8.338 -7.337 1025 HG22 VAL 129 1HG2 VAL 129 -5.270 8.093 -8.350 1026 HG23 VAL 129 2HG2 VAL 129 -3.667 7.696 -8.970 1027 H VAL 130 H VAL 130 -7.201 4.579 -6.542 1028 HA VAL 130 HA VAL 130 -6.328 2.758 -4.498 1029 HB VAL 130 HB VAL 130 -8.545 2.469 -6.533 1030 HG11 VAL 130 1HG1 VAL 130 -9.424 0.730 -5.041 1031 HG12 VAL 130 2HG1 VAL 130 -7.987 0.881 -4.029 1032 HG13 VAL 130 3HG1 VAL 130 -7.841 0.300 -5.688 1033 HG21 VAL 130 3HG2 VAL 130 -8.607 3.362 -3.654 1034 HG22 VAL 130 1HG2 VAL 130 -10.022 3.068 -4.664 1035 HG23 VAL 130 2HG2 VAL 130 -8.903 4.368 -5.073 1036 HA PRO 131 HA PRO 131 -3.310 0.403 -6.748 1037 HB2 PRO 131 2HB PRO 131 -4.598 -1.697 -5.048 1038 HB3 PRO 131 1HB PRO 131 -2.883 -1.401 -5.358 1039 HG2 PRO 131 2HG PRO 131 -4.003 -0.592 -3.093 1040 HG3 PRO 131 1HG PRO 131 -2.799 0.411 -3.922 1041 HD2 PRO 131 2HD PRO 131 -5.734 0.786 -3.697 1042 HD3 PRO 131 1HD PRO 131 -4.454 1.994 -3.923 1043 H TYR 132 H TYR 132 -3.594 -0.252 -8.791 1044 HA TYR 132 HA TYR 132 -5.509 -2.440 -9.232 1045 HB2 TYR 132 2HB TYR 132 -5.790 -1.743 -11.540 1046 HB3 TYR 132 1HB TYR 132 -6.188 -0.408 -10.473 1047 HD1 TYR 132 HD1 TYR 132 -3.205 -1.722 -12.319 1048 HD2 TYR 132 HD2 TYR 132 -5.456 1.683 -11.138 1049 HE1 TYR 132 HE1 TYR 132 -1.711 -0.302 -13.641 1050 HE2 TYR 132 HE2 TYR 132 -3.964 3.130 -12.458 1051 HH TYR 132 HH TYR 132 -1.716 3.114 -13.403 1052 H TYR 133 H TYR 133 -4.763 -3.904 -11.111 1053 HA TYR 133 HA TYR 133 -2.181 -4.885 -10.462 1054 HB2 TYR 133 2HB TYR 133 -4.146 -6.230 -11.343 1055 HB3 TYR 133 1HB TYR 133 -3.765 -5.584 -12.936 1056 HD1 TYR 133 HD2 TYR 133 -2.393 -7.597 -10.143 1057 HD2 TYR 133 HD1 TYR 133 -2.078 -6.571 -14.258 1058 HE1 TYR 133 HE2 TYR 133 -0.755 -9.401 -10.460 1059 HE2 TYR 133 HE1 TYR 133 -0.440 -8.374 -14.587 1060 HH TYR 133 HH TYR 133 1.135 -9.695 -13.293 1061 H ARG 134 H ARG 134 -0.256 -4.755 -11.513 1062 HA ARG 134 HA ARG 134 1.410 -3.862 -12.762 1063 HB2 ARG 134 2HB ARG 134 -0.225 -4.175 -14.736 1064 HB3 ARG 134 1HB ARG 134 -0.531 -2.450 -14.570 1065 HG2 ARG 134 2HG ARG 134 1.982 -2.141 -14.752 1066 HG3 ARG 134 1HG ARG 134 2.041 -3.824 -15.269 1067 HD2 ARG 134 2HD ARG 134 0.451 -3.257 -17.090 1068 HD3 ARG 134 1HD ARG 134 0.569 -1.563 -16.610 1069 HE ARG 134 HE ARG 134 2.538 -3.124 -18.040 1070 HH11 ARG 134 1HH1 ARG 134 1.959 -0.197 -16.173 1071 HH12 ARG 134 2HH1 ARG 134 3.401 0.582 -16.750 1072 HH21 ARG 134 1HH2 ARG 134 4.413 -2.106 -18.756 1073 HH22 ARG 134 2HH2 ARG 134 4.797 -0.496 -18.210 1074 H GLY 135 H GLY 135 -0.324 -2.515 -10.662 1075 HA2 GLY 135 2HA GLY 135 1.197 -0.009 -10.771 1076 HA3 GLY 135 1HA GLY 135 -0.529 0.054 -10.427 1077 H LEU 136 H LEU 136 -1.203 -1.531 -8.648 1078 HA LEU 136 HA LEU 136 0.828 -1.896 -6.590 1079 HB2 LEU 136 2HB LEU 136 -1.740 -0.383 -6.080 1080 HB3 LEU 136 1HB LEU 136 -0.610 -0.897 -4.847 1081 HG LEU 136 HG LEU 136 -0.013 1.124 -7.013 1082 HD11 LEU 136 1HD1 LEU 136 -0.591 1.498 -4.078 1083 HD12 LEU 136 2HD1 LEU 136 -1.648 1.957 -5.414 1084 HD13 LEU 136 3HD1 LEU 136 -0.093 2.762 -5.202 1085 HD21 LEU 136 3HD2 LEU 136 1.992 -0.041 -6.306 1086 HD22 LEU 136 1HD2 LEU 136 1.589 0.244 -4.612 1087 HD23 LEU 136 2HD2 LEU 136 1.993 1.601 -5.664 1088 H GLU 137 H GLU 137 -2.542 -2.279 -7.578 1089 HA GLU 137 HA GLU 137 -4.009 -3.997 -7.518 1090 HB2 GLU 137 2HB GLU 137 -2.112 -5.340 -8.343 1091 HB3 GLU 137 1HB GLU 137 -1.640 -5.682 -6.687 1092 HG2 GLU 137 2HG GLU 137 -2.853 -7.532 -7.757 1093 HG3 GLU 137 1HG GLU 137 -3.660 -6.927 -6.311 1094 H HIS 138 H HIS 138 -5.362 -5.164 -6.080 1095 HA HIS 138 HA HIS 138 -4.693 -5.430 -3.306 1096 HB2 HIS 138 2HB HIS 138 -5.269 -2.906 -3.792 1097 HB3 HIS 138 1HB HIS 138 -6.930 -3.492 -3.769 1098 HD1 HIS 138 HD1 HIS 138 -7.955 -4.029 -1.505 1099 HD2 HIS 138 HD2 HIS 138 -3.896 -3.135 -1.303 1100 HE1 HIS 138 HE1 HIS 138 -7.429 -3.818 0.946 1101 HE2 HIS 138 HE2 HIS 138 -5.010 -3.112 1.032 1102 H HIS 139 H HIS 139 -5.948 -6.820 -5.706 1103 HA HIS 139 HA HIS 139 -8.680 -7.300 -5.151 1104 HB2 HIS 139 2HB HIS 139 -6.610 -8.595 -6.848 1105 HB3 HIS 139 1HB HIS 139 -8.038 -9.544 -6.455 1106 HD1 HIS 139 HD1 HIS 139 -6.960 -6.459 -8.301 1107 HD2 HIS 139 HD2 HIS 139 -10.359 -8.796 -7.769 1108 HE1 HIS 139 HE1 HIS 139 -8.612 -5.668 -10.034 1109 HE2 HIS 139 HE2 HIS 139 -10.719 -6.967 -9.569 1110 H HIS 140 H HIS 140 -9.639 -9.316 -4.471 1111 HA HIS 140 HA HIS 140 -8.230 -10.525 -2.212 1112 HB2 HIS 140 2HB HIS 140 -11.119 -10.748 -3.108 1113 HB3 HIS 140 1HB HIS 140 -10.445 -11.564 -1.704 1114 HD1 HIS 140 HD1 HIS 140 -10.685 -10.351 0.443 1115 HD2 HIS 140 HD2 HIS 140 -10.926 -7.802 -2.834 1116 HE1 HIS 140 HE1 HIS 140 -11.251 -8.089 1.382 1117 HE2 HIS 140 HE2 HIS 140 -11.600 -6.623 -0.641 1118 H HIS 141 H HIS 141 -7.244 -12.438 -2.457 1119 HA HIS 141 HA HIS 141 -7.780 -13.885 -4.955 1120 HB2 HIS 141 2HB HIS 141 -5.427 -13.007 -4.235 1121 HB3 HIS 141 1HB HIS 141 -5.409 -14.431 -3.202 1122 HD1 HIS 141 HD1 HIS 141 -5.904 -13.577 -6.878 1123 HD2 HIS 141 HD2 HIS 141 -4.503 -16.666 -4.461 1124 HE1 HIS 141 HE1 HIS 141 -4.955 -15.294 -8.450 1125 HE2 HIS 141 HE2 HIS 141 -4.263 -17.222 -6.982 1126 H HIS 142 H HIS 142 -8.974 -13.976 -2.047 1127 HA HIS 142 HA HIS 142 -9.014 -16.916 -1.897 1128 HB2 HIS 142 2HB HIS 142 -8.132 -15.824 0.145 1129 HB3 HIS 142 1HB HIS 142 -9.634 -14.922 0.298 1130 HD1 HIS 142 HD1 HIS 142 -8.110 -18.245 0.945 1131 HD2 HIS 142 HD2 HIS 142 -11.864 -16.461 1.161 1132 HE1 HIS 142 HE1 HIS 142 -9.548 -19.836 2.267 1133 HE2 HIS 142 HE2 HIS 142 -11.810 -18.730 2.406 1134 H HIS 143 H HIS 143 -10.770 -17.695 -2.847 1135 HA HIS 143 HA HIS 143 -13.140 -16.143 -3.227 1136 HB2 HIS 143 2HB HIS 143 -14.105 -18.120 -4.256 1137 HB3 HIS 143 1HB HIS 143 -12.467 -17.887 -4.845 1138 HD1 HIS 143 HD1 HIS 143 -14.653 -20.324 -3.155 1139 HD2 HIS 143 HD2 HIS 143 -10.584 -19.815 -3.826 1140 HE1 HIS 143 HE1 HIS 143 -13.604 -22.555 -2.677 1141 HE2 HIS 143 HE2 HIS 143 -11.186 -22.279 -3.331 Start of MODEL 5 1 H1 MET 1 1H MET 1 -11.831 5.028 -16.536 2 H2 MET 1 2H MET 1 -12.123 4.130 -15.127 3 H3 MET 1 3H MET 1 -10.708 3.874 -16.019 4 HA MET 1 HA MET 1 -9.896 6.054 -15.491 5 HB2 MET 1 2HB MET 1 -12.074 7.190 -15.372 6 HB3 MET 1 1HB MET 1 -12.475 6.295 -13.912 7 HG2 MET 1 2HG MET 1 -10.505 7.367 -12.810 8 HG3 MET 1 1HG MET 1 -10.318 8.368 -14.248 9 HE1 MET 1 3HE MET 1 -12.102 10.166 -15.043 10 HE2 MET 1 1HE MET 1 -13.642 10.443 -14.229 11 HE3 MET 1 2HE MET 1 -13.349 8.919 -15.067 12 HA PRO 2 HA PRO 2 -8.068 3.709 -12.155 13 HB2 PRO 2 2HB PRO 2 -6.744 6.307 -11.571 14 HB3 PRO 2 1HB PRO 2 -6.027 4.713 -11.835 15 HG2 PRO 2 2HG PRO 2 -5.875 6.599 -13.707 16 HG3 PRO 2 1HG PRO 2 -6.142 4.900 -14.146 17 HD2 PRO 2 2HD PRO 2 -8.101 7.161 -14.025 18 HD3 PRO 2 1HD PRO 2 -7.973 5.845 -15.211 19 H VAL 3 H VAL 3 -8.764 3.375 -10.124 20 HA VAL 3 HA VAL 3 -10.719 5.082 -8.969 21 HB VAL 3 HB VAL 3 -9.239 2.783 -7.674 22 HG11 VAL 3 1HG1 VAL 3 -11.178 2.655 -6.192 23 HG12 VAL 3 2HG1 VAL 3 -11.870 4.078 -6.974 24 HG13 VAL 3 3HG1 VAL 3 -10.367 4.216 -6.062 25 HG21 VAL 3 3HG2 VAL 3 -10.334 2.069 -9.729 26 HG22 VAL 3 1HG2 VAL 3 -11.850 2.789 -9.188 27 HG23 VAL 3 2HG2 VAL 3 -11.166 1.415 -8.319 28 H GLU 4 H GLU 4 -10.348 6.887 -7.893 29 HA GLU 4 HA GLU 4 -8.000 7.080 -6.165 30 HB2 GLU 4 2HB GLU 4 -7.552 9.379 -7.014 31 HB3 GLU 4 1HB GLU 4 -7.257 8.123 -8.210 32 HG2 GLU 4 2HG GLU 4 -9.183 8.666 -9.424 33 HG3 GLU 4 1HG GLU 4 -9.864 9.595 -8.090 34 H LEU 5 H LEU 5 -8.152 8.748 -4.575 35 HA LEU 5 HA LEU 5 -10.901 9.515 -3.947 36 HB2 LEU 5 2HB LEU 5 -9.474 8.542 -2.165 37 HB3 LEU 5 1HB LEU 5 -8.370 9.891 -2.337 38 HG LEU 5 HG LEU 5 -10.234 11.422 -1.668 39 HD11 LEU 5 1HD1 LEU 5 -12.191 10.442 -0.576 40 HD12 LEU 5 2HD1 LEU 5 -11.644 8.833 -1.044 41 HD13 LEU 5 3HD1 LEU 5 -12.108 10.000 -2.282 42 HD21 LEU 5 3HD2 LEU 5 -9.525 9.260 0.306 43 HD22 LEU 5 1HD2 LEU 5 -10.119 10.873 0.701 44 HD23 LEU 5 2HD2 LEU 5 -8.545 10.676 -0.070 45 H ARG 6 H ARG 6 -11.507 11.249 -5.069 46 HA ARG 6 HA ARG 6 -9.552 13.289 -5.790 47 HB2 ARG 6 2HB ARG 6 -11.180 14.053 -7.380 48 HB3 ARG 6 1HB ARG 6 -11.137 12.295 -7.471 49 HG2 ARG 6 2HG ARG 6 -13.130 12.268 -5.943 50 HG3 ARG 6 1HG ARG 6 -13.218 14.017 -6.152 51 HD2 ARG 6 2HD ARG 6 -14.734 13.087 -7.704 52 HD3 ARG 6 1HD ARG 6 -13.325 13.595 -8.636 53 HE ARG 6 HE ARG 6 -12.707 11.316 -8.899 54 HH11 ARG 6 1HH1 ARG 6 -15.773 11.800 -7.291 55 HH12 ARG 6 2HH1 ARG 6 -16.336 10.172 -7.547 56 HH21 ARG 6 1HH2 ARG 6 -13.431 9.153 -9.268 57 HH22 ARG 6 2HH2 ARG 6 -15.005 8.674 -8.695 58 H ALA 7 H ALA 7 -10.222 15.592 -5.646 59 HA ALA 7 HA ALA 7 -11.165 16.233 -3.000 60 HB1 ALA 7 3HB ALA 7 -9.327 17.475 -4.028 61 HB2 ALA 7 1HB ALA 7 -10.671 18.547 -3.631 62 HB3 ALA 7 2HB ALA 7 -10.411 18.038 -5.299 63 H ASN 8 H ASN 8 -13.178 14.960 -4.073 64 HA ASN 8 HA ASN 8 -15.421 16.515 -3.749 65 HB2 ASN 8 2HB ASN 8 -14.809 17.621 -5.888 66 HB3 ASN 8 1HB ASN 8 -14.839 16.056 -6.693 67 HD21 ASN 8 1HD2 ASN 8 -16.446 16.583 -8.104 68 HD22 ASN 8 2HD2 ASN 8 -18.094 16.837 -7.626 69 H TRP 9 H TRP 9 -15.480 14.482 -2.566 70 HA TRP 9 HA TRP 9 -16.294 12.212 -4.264 71 HB2 TRP 9 2HB TRP 9 -15.320 10.713 -2.546 72 HB3 TRP 9 1HB TRP 9 -14.118 11.745 -3.312 73 HD1 TRP 9 HD1 TRP 9 -12.896 13.551 -1.795 74 HE1 TRP 9 HE1 TRP 9 -12.736 13.858 0.755 75 HE3 TRP 9 HE3 TRP 9 -16.675 10.420 -0.354 76 HZ2 TRP 9 HZ2 TRP 9 -14.031 12.896 3.070 77 HZ3 TRP 9 HZ3 TRP 9 -17.146 10.166 2.048 78 HH2 TRP 9 HH2 TRP 9 -15.848 11.379 3.722 79 H SER 10 H SER 10 -17.799 10.746 -3.404 80 HA SER 10 HA SER 10 -19.362 11.745 -1.117 81 HB2 SER 10 2HB SER 10 -20.491 10.130 -3.405 82 HB3 SER 10 1HB SER 10 -21.368 11.075 -2.200 83 HG SER 10 HG SER 10 -19.697 12.058 -4.276 84 H GLU 11 H GLU 11 -20.877 9.680 -0.453 85 HA GLU 11 HA GLU 11 -19.128 7.901 0.814 86 HB2 GLU 11 2HB GLU 11 -22.084 7.662 0.250 87 HB3 GLU 11 1HB GLU 11 -21.194 6.574 1.305 88 HG2 GLU 11 2HG GLU 11 -21.398 9.548 1.717 89 HG3 GLU 11 1HG GLU 11 -22.438 8.355 2.495 90 H GLU 12 H GLU 12 -20.981 7.592 -2.177 91 HA GLU 12 HA GLU 12 -20.443 4.877 -2.682 92 HB2 GLU 12 2HB GLU 12 -20.722 6.957 -4.844 93 HB3 GLU 12 1HB GLU 12 -21.177 5.262 -4.906 94 HG2 GLU 12 2HG GLU 12 -23.227 6.191 -4.659 95 HG3 GLU 12 1HG GLU 12 -22.800 5.989 -2.959 96 H ASP 13 H ASP 13 -18.720 7.822 -3.609 97 HA ASP 13 HA ASP 13 -16.766 6.576 -5.223 98 HB2 ASP 13 2HB ASP 13 -16.514 9.157 -3.663 99 HB3 ASP 13 1HB ASP 13 -15.490 8.654 -5.003 100 H LEU 14 H LEU 14 -16.799 7.523 -1.820 101 HA LEU 14 HA LEU 14 -14.154 6.750 -1.250 102 HB2 LEU 14 2HB LEU 14 -15.547 8.229 0.178 103 HB3 LEU 14 1HB LEU 14 -16.504 6.834 0.638 104 HG LEU 14 HG LEU 14 -14.550 5.818 1.702 105 HD11 LEU 14 1HD1 LEU 14 -13.125 8.363 0.941 106 HD12 LEU 14 2HD1 LEU 14 -12.818 6.762 0.264 107 HD13 LEU 14 3HD1 LEU 14 -12.482 7.080 1.965 108 HD21 LEU 14 3HD2 LEU 14 -14.363 7.355 3.570 109 HD22 LEU 14 1HD2 LEU 14 -16.028 7.284 2.995 110 HD23 LEU 14 2HD2 LEU 14 -15.010 8.665 2.581 111 H GLU 15 H GLU 15 -17.238 5.007 -0.914 112 HA GLU 15 HA GLU 15 -16.240 2.625 0.154 113 HB2 GLU 15 2HB GLU 15 -18.617 3.132 0.058 114 HB3 GLU 15 1HB GLU 15 -18.584 3.096 -1.698 115 HG2 GLU 15 2HG GLU 15 -19.525 1.061 -1.060 116 HG3 GLU 15 1HG GLU 15 -17.859 0.681 -1.486 117 H THR 16 H THR 16 -16.481 3.756 -3.174 118 HA THR 16 HA THR 16 -15.643 1.428 -4.484 119 HB THR 16 HB THR 16 -15.140 4.309 -5.274 120 HG1 THR 16 HG1 THR 16 -17.369 3.829 -5.023 121 HG21 THR 16 3HG2 THR 16 -15.208 1.833 -7.008 122 HG22 THR 16 1HG2 THR 16 -13.737 2.669 -6.507 123 HG23 THR 16 2HG2 THR 16 -14.907 3.486 -7.540 124 H VAL 17 H VAL 17 -13.826 4.070 -3.006 125 HA VAL 17 HA VAL 17 -11.240 3.124 -3.709 126 HB VAL 17 HB VAL 17 -12.070 4.901 -1.405 127 HG11 VAL 17 1HG1 VAL 17 -9.867 4.011 -1.004 128 HG12 VAL 17 2HG1 VAL 17 -9.730 5.707 -1.474 129 HG13 VAL 17 3HG1 VAL 17 -9.360 4.435 -2.641 130 HG21 VAL 17 3HG2 VAL 17 -11.436 6.762 -2.858 131 HG22 VAL 17 1HG2 VAL 17 -12.740 5.810 -3.565 132 HG23 VAL 17 2HG2 VAL 17 -11.091 5.626 -4.164 133 H ILE 18 H ILE 18 -13.309 2.711 -0.862 134 HA ILE 18 HA ILE 18 -11.601 1.299 0.814 135 HB ILE 18 HB ILE 18 -14.550 0.726 0.466 136 HG12 ILE 18 2HG1 ILE 18 -14.219 3.123 0.798 137 HG13 ILE 18 1HG1 ILE 18 -14.945 2.395 2.223 138 HG21 ILE 18 1HG2 ILE 18 -13.407 -0.924 1.824 139 HG22 ILE 18 2HG2 ILE 18 -14.464 0.069 2.829 140 HG23 ILE 18 3HG2 ILE 18 -12.722 0.350 2.832 141 HD11 ILE 18 3HD1 ILE 18 -12.058 3.170 1.898 142 HD12 ILE 18 1HD1 ILE 18 -12.760 2.399 3.322 143 HD13 ILE 18 2HD1 ILE 18 -13.281 4.016 2.847 144 H ARG 19 H ARG 19 -13.978 -0.066 -1.466 145 HA ARG 19 HA ARG 19 -13.096 -2.728 -1.043 146 HB2 ARG 19 2HB ARG 19 -14.943 -1.464 -3.044 147 HB3 ARG 19 1HB ARG 19 -14.534 -3.172 -3.130 148 HG2 ARG 19 2HG ARG 19 -15.387 -3.476 -0.848 149 HG3 ARG 19 1HG ARG 19 -15.836 -1.771 -0.805 150 HD2 ARG 19 2HD ARG 19 -17.452 -2.065 -2.517 151 HD3 ARG 19 1HD ARG 19 -16.858 -3.685 -2.887 152 HE ARG 19 HE ARG 19 -17.586 -4.045 -0.377 153 HH11 ARG 19 1HH1 ARG 19 -19.274 -2.290 -2.905 154 HH12 ARG 19 2HH1 ARG 19 -20.848 -2.637 -2.261 155 HH21 ARG 19 1HH2 ARG 19 -19.662 -4.512 0.446 156 HH22 ARG 19 2HH2 ARG 19 -21.067 -3.901 -0.377 157 H ALA 20 H ALA 20 -12.037 -0.232 -3.191 158 HA ALA 20 HA ALA 20 -10.804 -1.925 -5.118 159 HB1 ALA 20 3HB ALA 20 -11.332 0.440 -5.562 160 HB2 ALA 20 1HB ALA 20 -9.641 0.053 -5.880 161 HB3 ALA 20 2HB ALA 20 -10.086 0.915 -4.408 162 H VAL 21 H VAL 21 -9.829 -0.642 -2.017 163 HA VAL 21 HA VAL 21 -7.096 -1.584 -2.339 164 HB VAL 21 HB VAL 21 -8.434 -0.384 0.097 165 HG11 VAL 21 1HG1 VAL 21 -6.495 -1.728 0.689 166 HG12 VAL 21 2HG1 VAL 21 -6.142 -0.015 0.901 167 HG13 VAL 21 3HG1 VAL 21 -5.517 -0.876 -0.506 168 HG21 VAL 21 3HG2 VAL 21 -7.287 1.679 -0.500 169 HG22 VAL 21 1HG2 VAL 21 -8.362 1.167 -1.802 170 HG23 VAL 21 2HG2 VAL 21 -6.622 0.909 -1.942 171 H TYR 22 H TYR 22 -10.018 -2.426 -0.536 172 HA TYR 22 HA TYR 22 -8.767 -4.571 0.898 173 HB2 TYR 22 2HB TYR 22 -11.580 -3.590 0.605 174 HB3 TYR 22 1HB TYR 22 -11.286 -5.178 1.303 175 HD1 TYR 22 HD1 TYR 22 -10.088 -5.394 3.431 176 HD2 TYR 22 HD2 TYR 22 -11.064 -1.580 1.827 177 HE1 TYR 22 HE1 TYR 22 -9.679 -4.374 5.628 178 HE2 TYR 22 HE2 TYR 22 -10.661 -0.546 4.022 179 HH TYR 22 HH TYR 22 -9.038 -2.074 6.495 180 H ARG 23 H ARG 23 -11.361 -4.621 -1.568 181 HA ARG 23 HA ARG 23 -10.659 -7.445 -2.033 182 HB2 ARG 23 2HB ARG 23 -13.343 -6.203 -2.632 183 HB3 ARG 23 1HB ARG 23 -12.945 -7.907 -2.468 184 HG2 ARG 23 2HG ARG 23 -12.590 -7.624 -0.085 185 HG3 ARG 23 1HG ARG 23 -12.916 -5.897 -0.227 186 HD2 ARG 23 2HD ARG 23 -14.971 -6.641 0.453 187 HD3 ARG 23 1HD ARG 23 -15.164 -6.745 -1.295 188 HE ARG 23 HE ARG 23 -14.417 -9.083 0.338 189 HH11 ARG 23 1HH1 ARG 23 -16.403 -7.581 -2.131 190 HH12 ARG 23 2HH1 ARG 23 -17.317 -9.026 -2.447 191 HH21 ARG 23 1HH2 ARG 23 -15.618 -10.968 -0.055 192 HH22 ARG 23 2HH2 ARG 23 -16.842 -10.968 -1.297 193 H GLN 24 H GLN 24 -9.038 -6.257 -3.492 194 HA GLN 24 HA GLN 24 -10.142 -5.218 -5.966 195 HB2 GLN 24 2HB GLN 24 -8.025 -4.362 -4.798 196 HB3 GLN 24 1HB GLN 24 -7.242 -5.820 -5.393 197 HG2 GLN 24 2HG GLN 24 -7.864 -5.132 -7.702 198 HG3 GLN 24 1HG GLN 24 -8.467 -3.617 -7.032 199 HE21 GLN 24 1HE2 GLN 24 -6.974 -2.204 -6.011 200 HE22 GLN 24 2HE2 GLN 24 -5.297 -2.231 -6.441 201 H VAL 25 H VAL 25 -7.743 -7.719 -5.212 202 HA VAL 25 HA VAL 25 -8.963 -9.448 -7.250 203 HB VAL 25 HB VAL 25 -6.886 -8.381 -8.135 204 HG11 VAL 25 1HG1 VAL 25 -5.510 -9.904 -5.928 205 HG12 VAL 25 2HG1 VAL 25 -5.632 -8.151 -6.073 206 HG13 VAL 25 3HG1 VAL 25 -4.704 -9.072 -7.258 207 HG21 VAL 25 3HG2 VAL 25 -6.723 -11.360 -7.713 208 HG22 VAL 25 1HG2 VAL 25 -5.833 -10.448 -8.930 209 HG23 VAL 25 2HG2 VAL 25 -7.594 -10.527 -9.003 210 H LEU 26 H LEU 26 -8.932 -11.659 -6.754 211 HA LEU 26 HA LEU 26 -9.166 -13.429 -5.355 212 HB2 LEU 26 2HB LEU 26 -6.594 -12.233 -4.429 213 HB3 LEU 26 1HB LEU 26 -7.322 -13.486 -3.448 214 HG LEU 26 HG LEU 26 -7.299 -14.979 -5.453 215 HD11 LEU 26 1HD1 LEU 26 -7.216 -13.290 -7.192 216 HD12 LEU 26 2HD1 LEU 26 -5.834 -14.379 -7.318 217 HD13 LEU 26 3HD1 LEU 26 -5.627 -12.768 -6.631 218 HD21 LEU 26 3HD2 LEU 26 -5.597 -15.124 -3.717 219 HD22 LEU 26 1HD2 LEU 26 -4.637 -13.897 -4.545 220 HD23 LEU 26 2HD2 LEU 26 -4.909 -15.464 -5.307 221 H GLY 27 H GLY 27 -10.776 -11.229 -4.803 222 HA2 GLY 27 2HA GLY 27 -10.701 -10.600 -1.992 223 HA3 GLY 27 1HA GLY 27 -11.950 -10.129 -3.135 224 H ASN 28 H ASN 28 -10.759 -13.328 -2.215 225 HA ASN 28 HA ASN 28 -13.520 -14.169 -1.757 226 HB2 ASN 28 2HB ASN 28 -10.983 -15.820 -1.952 227 HB3 ASN 28 1HB ASN 28 -12.607 -16.467 -1.762 228 HD21 ASN 28 1HD2 ASN 28 -12.626 -17.609 -3.632 229 HD22 ASN 28 2HD2 ASN 28 -12.637 -16.876 -5.198 230 H ASP 29 H ASP 29 -14.046 -13.473 0.237 231 HA ASP 29 HA ASP 29 -12.484 -13.282 2.495 232 HB2 ASP 29 2HB ASP 29 -15.426 -13.844 2.176 233 HB3 ASP 29 1HB ASP 29 -14.683 -13.666 3.764 234 H TYR 30 H TYR 30 -14.651 -15.966 1.695 235 HA TYR 30 HA TYR 30 -14.583 -18.192 2.095 236 HB2 TYR 30 2HB TYR 30 -12.037 -17.619 1.428 237 HB3 TYR 30 1HB TYR 30 -11.781 -18.203 3.069 238 HD1 TYR 30 HD2 TYR 30 -12.933 -19.092 -0.293 239 HD2 TYR 30 HD1 TYR 30 -12.098 -20.537 3.618 240 HE1 TYR 30 HE2 TYR 30 -13.048 -21.398 -1.131 241 HE2 TYR 30 HE1 TYR 30 -12.213 -22.851 2.792 242 HH TYR 30 HH TYR 30 -13.245 -24.090 0.913 243 H VAL 31 H VAL 31 -12.193 -17.210 4.522 244 HA VAL 31 HA VAL 31 -13.783 -18.424 6.628 245 HB VAL 31 HB VAL 31 -11.282 -18.679 6.472 246 HG11 VAL 31 1HG1 VAL 31 -11.282 -15.794 7.339 247 HG12 VAL 31 2HG1 VAL 31 -10.684 -16.436 5.810 248 HG13 VAL 31 3HG1 VAL 31 -9.874 -16.855 7.319 249 HG21 VAL 31 3HG2 VAL 31 -12.453 -19.177 8.532 250 HG22 VAL 31 1HG2 VAL 31 -12.346 -17.488 9.027 251 HG23 VAL 31 2HG2 VAL 31 -10.880 -18.456 8.872 252 H MET 32 H MET 32 -13.780 -15.576 5.070 253 HA MET 32 HA MET 32 -14.933 -13.657 5.343 254 HB2 MET 32 2HB MET 32 -15.690 -14.813 8.030 255 HB3 MET 32 1HB MET 32 -16.315 -13.297 7.395 256 HG2 MET 32 2HG MET 32 -17.279 -14.497 5.492 257 HG3 MET 32 1HG MET 32 -16.671 -16.014 6.155 258 HE1 MET 32 3HE MET 32 -19.120 -17.042 6.008 259 HE2 MET 32 1HE MET 32 -19.714 -15.520 5.351 260 HE3 MET 32 2HE MET 32 -20.544 -16.274 6.712 261 H ALA 33 H ALA 33 -13.625 -11.976 5.358 262 HA ALA 33 HA ALA 33 -11.815 -11.501 7.577 263 HB1 ALA 33 3HB ALA 33 -11.064 -11.051 5.285 264 HB2 ALA 33 1HB ALA 33 -11.036 -9.587 6.271 265 HB3 ALA 33 2HB ALA 33 -12.337 -9.844 5.108 266 H SER 34 H SER 34 -13.197 -11.128 9.292 267 HA SER 34 HA SER 34 -15.447 -9.357 9.017 268 HB2 SER 34 2HB SER 34 -14.339 -10.686 11.499 269 HB3 SER 34 1HB SER 34 -15.945 -9.978 11.313 270 HG SER 34 HG SER 34 -15.241 -11.890 9.433 271 H GLU 35 H GLU 35 -12.168 -9.083 10.138 272 HA GLU 35 HA GLU 35 -12.764 -6.735 11.727 273 HB2 GLU 35 2HB GLU 35 -10.148 -8.123 11.152 274 HB3 GLU 35 1HB GLU 35 -10.322 -6.724 12.206 275 HG2 GLU 35 2HG GLU 35 -11.441 -9.485 12.600 276 HG3 GLU 35 1HG GLU 35 -10.245 -8.645 13.585 277 H ARG 36 H ARG 36 -13.464 -5.242 10.270 278 HA ARG 36 HA ARG 36 -11.726 -4.311 8.155 279 HB2 ARG 36 2HB ARG 36 -14.163 -4.118 7.902 280 HB3 ARG 36 1HB ARG 36 -14.248 -3.120 9.346 281 HG2 ARG 36 2HG ARG 36 -12.722 -1.495 8.133 282 HG3 ARG 36 1HG ARG 36 -13.060 -2.432 6.678 283 HD2 ARG 36 2HD ARG 36 -15.180 -1.200 8.427 284 HD3 ARG 36 1HD ARG 36 -14.511 -0.419 6.997 285 HE ARG 36 HE ARG 36 -15.586 -3.052 6.510 286 HH11 ARG 36 1HH1 ARG 36 -16.298 0.381 6.718 287 HH12 ARG 36 2HH1 ARG 36 -17.691 0.264 5.680 288 HH21 ARG 36 1HH2 ARG 36 -17.405 -3.182 5.129 289 HH22 ARG 36 2HH2 ARG 36 -18.308 -1.738 4.761 290 H LEU 37 H LEU 37 -10.434 -2.445 8.249 291 HA LEU 37 HA LEU 37 -9.616 -1.660 10.887 292 HB2 LEU 37 2HB LEU 37 -8.752 -0.750 8.148 293 HB3 LEU 37 1HB LEU 37 -8.141 -0.018 9.617 294 HG LEU 37 HG LEU 37 -7.434 -2.421 10.268 295 HD11 LEU 37 1HD1 LEU 37 -8.665 -3.571 8.498 296 HD12 LEU 37 2HD1 LEU 37 -6.930 -3.883 8.391 297 HD13 LEU 37 3HD1 LEU 37 -7.694 -2.739 7.285 298 HD21 LEU 37 3HD2 LEU 37 -6.065 -0.922 8.046 299 HD22 LEU 37 1HD2 LEU 37 -5.315 -2.143 9.073 300 HD23 LEU 37 2HD2 LEU 37 -5.881 -0.626 9.774 301 H VAL 38 H VAL 38 -11.440 -0.765 11.773 302 HA VAL 38 HA VAL 38 -12.967 1.324 10.665 303 HB VAL 38 HB VAL 38 -12.483 0.767 13.602 304 HG11 VAL 38 1HG1 VAL 38 -14.661 1.809 13.940 305 HG12 VAL 38 2HG1 VAL 38 -14.789 2.122 12.210 306 HG13 VAL 38 3HG1 VAL 38 -13.542 2.928 13.162 307 HG21 VAL 38 3HG2 VAL 38 -13.224 -1.252 12.471 308 HG22 VAL 38 1HG2 VAL 38 -14.567 -0.371 11.744 309 HG23 VAL 38 2HG2 VAL 38 -14.511 -0.609 13.491 310 H SER 39 H SER 39 -10.005 1.237 12.509 311 HA SER 39 HA SER 39 -9.732 3.932 13.179 312 HB2 SER 39 2HB SER 39 -7.249 3.389 13.116 313 HB3 SER 39 1HB SER 39 -8.231 2.325 14.124 314 HG SER 39 HG SER 39 -7.248 0.836 12.969 315 H ALA 40 H ALA 40 -8.366 2.212 10.384 316 HA ALA 40 HA ALA 40 -7.390 4.497 9.070 317 HB1 ALA 40 3HB ALA 40 -8.140 1.815 7.911 318 HB2 ALA 40 1HB ALA 40 -6.572 2.259 8.584 319 HB3 ALA 40 2HB ALA 40 -7.154 3.045 7.116 320 H GLU 41 H GLU 41 -10.455 2.734 8.756 321 HA GLU 41 HA GLU 41 -11.406 4.057 6.485 322 HB2 GLU 41 2HB GLU 41 -12.430 2.007 7.500 323 HB3 GLU 41 1HB GLU 41 -13.116 3.033 8.755 324 HG2 GLU 41 2HG GLU 41 -14.051 4.371 6.699 325 HG3 GLU 41 1HG GLU 41 -13.819 2.833 5.874 326 H SER 42 H SER 42 -12.054 4.775 9.928 327 HA SER 42 HA SER 42 -13.720 6.975 9.413 328 HB2 SER 42 2HB SER 42 -13.216 7.590 11.822 329 HB3 SER 42 1HB SER 42 -13.826 5.958 11.570 330 HG SER 42 HG SER 42 -11.868 5.124 11.985 331 H LEU 43 H LEU 43 -10.229 6.761 9.893 332 HA LEU 43 HA LEU 43 -9.719 9.530 10.029 333 HB2 LEU 43 2HB LEU 43 -7.942 7.291 9.051 334 HB3 LEU 43 1HB LEU 43 -7.399 8.923 9.384 335 HG LEU 43 HG LEU 43 -8.541 7.016 11.425 336 HD11 LEU 43 1HD1 LEU 43 -6.333 6.337 10.636 337 HD12 LEU 43 2HD1 LEU 43 -6.264 6.928 12.295 338 HD13 LEU 43 3HD1 LEU 43 -5.712 7.953 10.971 339 HD21 LEU 43 3HD2 LEU 43 -9.024 9.352 11.955 340 HD22 LEU 43 1HD2 LEU 43 -7.318 9.750 11.755 341 HD23 LEU 43 2HD2 LEU 43 -7.825 8.681 13.061 342 H LEU 44 H LEU 44 -10.053 7.325 7.306 343 HA LEU 44 HA LEU 44 -9.269 9.339 5.382 344 HB2 LEU 44 2HB LEU 44 -8.844 6.895 5.070 345 HB3 LEU 44 1HB LEU 44 -10.575 6.649 4.931 346 HG LEU 44 HG LEU 44 -10.569 8.152 2.935 347 HD11 LEU 44 1HD1 LEU 44 -8.442 8.636 1.850 348 HD12 LEU 44 2HD1 LEU 44 -7.576 7.926 3.212 349 HD13 LEU 44 3HD1 LEU 44 -8.530 9.393 3.440 350 HD21 LEU 44 3HD2 LEU 44 -10.563 5.737 2.668 351 HD22 LEU 44 1HD2 LEU 44 -8.804 5.711 2.794 352 HD23 LEU 44 2HD2 LEU 44 -9.576 6.497 1.418 353 H ARG 45 H ARG 45 -12.196 7.987 6.705 354 HA ARG 45 HA ARG 45 -13.980 8.909 4.713 355 HB2 ARG 45 2HB ARG 45 -14.300 7.051 6.462 356 HB3 ARG 45 1HB ARG 45 -14.750 8.341 7.566 357 HG2 ARG 45 2HG ARG 45 -16.658 8.896 6.306 358 HG3 ARG 45 1HG ARG 45 -16.113 7.951 4.918 359 HD2 ARG 45 2HD ARG 45 -16.254 5.918 6.430 360 HD3 ARG 45 1HD ARG 45 -17.107 6.953 7.575 361 HE ARG 45 HE ARG 45 -18.523 7.316 5.315 362 HH11 ARG 45 1HH1 ARG 45 -17.446 4.398 6.972 363 HH12 ARG 45 2HH1 ARG 45 -18.803 3.464 6.416 364 HH21 ARG 45 1HH2 ARG 45 -20.284 6.068 4.603 365 HH22 ARG 45 2HH2 ARG 45 -20.394 4.386 5.070 366 H ASN 46 H ASN 46 -12.561 10.462 7.480 367 HA ASN 46 HA ASN 46 -14.403 12.720 7.161 368 HB2 ASN 46 2HB ASN 46 -13.727 13.529 9.249 369 HB3 ASN 46 1HB ASN 46 -13.720 11.784 9.473 370 HD21 ASN 46 1HD2 ASN 46 -11.792 10.725 9.802 371 HD22 ASN 46 2HD2 ASN 46 -10.320 11.569 10.138 372 H GLY 47 H GLY 47 -11.510 11.625 5.963 373 HA2 GLY 47 2HA GLY 47 -10.151 12.649 4.393 374 HA3 GLY 47 1HA GLY 47 -10.992 14.160 4.696 375 H LYS 48 H LYS 48 -9.449 12.221 7.197 376 HA LYS 48 HA LYS 48 -7.784 14.492 7.883 377 HB2 LYS 48 2HB LYS 48 -8.914 13.365 9.684 378 HB3 LYS 48 1HB LYS 48 -8.258 11.812 9.190 379 HG2 LYS 48 2HG LYS 48 -6.009 12.589 9.774 380 HG3 LYS 48 1HG LYS 48 -6.692 14.132 10.298 381 HD2 LYS 48 2HD LYS 48 -7.840 13.136 12.088 382 HD3 LYS 48 1HD LYS 48 -7.630 11.514 11.429 383 HE2 LYS 48 2HE LYS 48 -6.131 11.777 13.270 384 HE3 LYS 48 1HE LYS 48 -5.190 11.748 11.781 385 HZ1 LYS 48 3HZ LYS 48 -5.957 14.195 13.283 386 HZ2 LYS 48 1HZ LYS 48 -5.025 14.150 11.863 387 HZ3 LYS 48 2HZ LYS 48 -4.425 13.469 13.294 388 H ILE 49 H ILE 49 -7.433 11.171 6.744 389 HA ILE 49 HA ILE 49 -4.563 11.682 6.308 390 HB ILE 49 HB ILE 49 -4.228 9.262 6.219 391 HG12 ILE 49 2HG1 ILE 49 -7.149 9.015 6.973 392 HG13 ILE 49 1HG1 ILE 49 -6.498 8.690 5.369 393 HG21 ILE 49 1HG2 ILE 49 -5.690 10.151 8.703 394 HG22 ILE 49 2HG2 ILE 49 -3.971 10.360 8.366 395 HG23 ILE 49 3HG2 ILE 49 -4.637 8.742 8.586 396 HD11 ILE 49 3HD1 ILE 49 -5.122 6.891 6.319 397 HD12 ILE 49 1HD1 ILE 49 -6.848 6.630 6.575 398 HD13 ILE 49 2HD1 ILE 49 -5.836 7.203 7.901 399 H THR 50 H THR 50 -3.755 10.214 4.406 400 HA THR 50 HA THR 50 -5.573 10.688 2.137 401 HB THR 50 HB THR 50 -3.099 10.099 1.055 402 HG1 THR 50 HG1 THR 50 -2.368 10.451 3.383 403 HG21 THR 50 3HG2 THR 50 -2.999 12.516 0.545 404 HG22 THR 50 1HG2 THR 50 -4.309 12.790 1.693 405 HG23 THR 50 2HG2 THR 50 -4.593 11.822 0.246 406 H VAL 51 H VAL 51 -4.764 9.093 0.227 407 HA VAL 51 HA VAL 51 -5.620 6.507 1.045 408 HB VAL 51 HB VAL 51 -4.330 7.305 -1.575 409 HG11 VAL 51 1HG1 VAL 51 -5.505 5.380 -2.504 410 HG12 VAL 51 2HG1 VAL 51 -6.137 4.984 -0.905 411 HG13 VAL 51 3HG1 VAL 51 -4.404 4.888 -1.216 412 HG21 VAL 51 3HG2 VAL 51 -7.241 7.291 -0.786 413 HG22 VAL 51 1HG2 VAL 51 -6.621 7.578 -2.413 414 HG23 VAL 51 2HG2 VAL 51 -6.253 8.714 -1.116 415 H ARG 52 H ARG 52 -2.564 8.065 0.594 416 HA ARG 52 HA ARG 52 -0.773 5.981 0.441 417 HB2 ARG 52 2HB ARG 52 0.002 8.235 0.289 418 HB3 ARG 52 1HB ARG 52 -0.606 8.624 1.889 419 HG2 ARG 52 2HG ARG 52 1.098 7.344 2.942 420 HG3 ARG 52 1HG ARG 52 1.604 6.640 1.406 421 HD2 ARG 52 2HD ARG 52 3.092 8.454 2.268 422 HD3 ARG 52 1HD ARG 52 2.467 8.728 0.645 423 HE ARG 52 HE ARG 52 0.737 10.161 1.856 424 HH11 ARG 52 1HH1 ARG 52 4.059 9.768 2.922 425 HH12 ARG 52 2HH1 ARG 52 4.111 11.316 3.716 426 HH21 ARG 52 1HH2 ARG 52 0.829 12.205 2.850 427 HH22 ARG 52 2HH2 ARG 52 2.280 12.699 3.676 428 H GLU 53 H GLU 53 -2.089 7.426 3.441 429 HA GLU 53 HA GLU 53 -0.873 5.510 5.150 430 HB2 GLU 53 2HB GLU 53 -3.241 7.334 5.613 431 HB3 GLU 53 1HB GLU 53 -2.519 6.331 6.859 432 HG2 GLU 53 2HG GLU 53 -1.690 8.534 7.123 433 HG3 GLU 53 1HG GLU 53 -0.378 7.539 6.496 434 H PHE 54 H PHE 54 -4.032 5.761 3.619 435 HA PHE 54 HA PHE 54 -5.320 3.705 5.020 436 HB2 PHE 54 2HB PHE 54 -6.480 5.392 3.624 437 HB3 PHE 54 1HB PHE 54 -5.834 4.618 2.181 438 HD1 PHE 54 HD1 PHE 54 -7.877 3.873 5.201 439 HD2 PHE 54 HD2 PHE 54 -7.077 2.995 1.117 440 HE1 PHE 54 HE1 PHE 54 -9.834 2.385 5.143 441 HE2 PHE 54 HE2 PHE 54 -9.032 1.502 1.050 442 HZ PHE 54 HZ PHE 54 -10.414 1.197 3.065 443 H VAL 55 H VAL 55 -3.592 3.613 1.898 444 HA VAL 55 HA VAL 55 -3.997 0.879 1.398 445 HB VAL 55 HB VAL 55 -1.711 2.655 0.522 446 HG11 VAL 55 1HG1 VAL 55 -1.042 0.319 0.389 447 HG12 VAL 55 2HG1 VAL 55 -1.311 0.974 -1.228 448 HG13 VAL 55 3HG1 VAL 55 -2.522 -0.072 -0.486 449 HG21 VAL 55 3HG2 VAL 55 -2.934 2.772 -1.594 450 HG22 VAL 55 1HG2 VAL 55 -3.901 3.395 -0.256 451 HG23 VAL 55 2HG2 VAL 55 -4.223 1.786 -0.903 452 H ARG 56 H ARG 56 -1.303 2.562 3.018 453 HA ARG 56 HA ARG 56 0.245 0.292 3.590 454 HB2 ARG 56 2HB ARG 56 0.893 2.738 3.886 455 HB3 ARG 56 1HB ARG 56 -0.009 2.701 5.395 456 HG2 ARG 56 2HG ARG 56 1.667 0.493 5.535 457 HG3 ARG 56 1HG ARG 56 2.654 1.761 4.811 458 HD2 ARG 56 2HD ARG 56 2.976 1.991 7.121 459 HD3 ARG 56 1HD ARG 56 1.827 3.259 6.694 460 HE ARG 56 HE ARG 56 0.098 1.523 7.481 461 HH11 ARG 56 1HH1 ARG 56 3.313 1.874 8.821 462 HH12 ARG 56 2HH1 ARG 56 2.855 1.321 10.408 463 HH21 ARG 56 1HH2 ARG 56 -0.499 0.742 9.569 464 HH22 ARG 56 2HH2 ARG 56 0.704 0.666 10.820 465 H ALA 57 H ALA 57 -2.382 1.831 5.364 466 HA ALA 57 HA ALA 57 -2.242 0.292 7.705 467 HB1 ALA 57 3HB ALA 57 -4.658 1.607 6.473 468 HB2 ALA 57 1HB ALA 57 -3.496 2.387 7.545 469 HB3 ALA 57 2HB ALA 57 -4.506 1.073 8.148 470 H VAL 58 H VAL 58 -4.409 -0.064 4.892 471 HA VAL 58 HA VAL 58 -5.609 -2.457 5.776 472 HB VAL 58 HB VAL 58 -5.311 -1.415 2.949 473 HG11 VAL 58 1HG1 VAL 58 -5.862 -3.798 2.984 474 HG12 VAL 58 2HG1 VAL 58 -7.226 -2.836 2.413 475 HG13 VAL 58 3HG1 VAL 58 -7.221 -3.469 4.059 476 HG21 VAL 58 3HG2 VAL 58 -7.543 -1.101 4.951 477 HG22 VAL 58 1HG2 VAL 58 -7.586 -0.557 3.273 478 HG23 VAL 58 2HG2 VAL 58 -6.443 0.166 4.407 479 H ALA 59 H ALA 59 -2.735 -1.825 3.835 480 HA ALA 59 HA ALA 59 -2.281 -4.419 2.880 481 HB1 ALA 59 3HB ALA 59 -0.188 -2.368 3.578 482 HB2 ALA 59 1HB ALA 59 -1.107 -2.397 2.073 483 HB3 ALA 59 2HB ALA 59 -0.012 -3.724 2.466 484 H LYS 60 H LYS 60 -1.537 -2.930 5.965 485 HA LYS 60 HA LYS 60 -0.115 -5.317 6.881 486 HB2 LYS 60 2HB LYS 60 -0.689 -2.640 8.139 487 HB3 LYS 60 1HB LYS 60 0.034 -3.966 9.031 488 HG2 LYS 60 2HG LYS 60 1.962 -3.940 7.593 489 HG3 LYS 60 1HG LYS 60 1.217 -2.704 6.569 490 HD2 LYS 60 2HD LYS 60 1.405 -1.059 8.208 491 HD3 LYS 60 1HD LYS 60 1.575 -2.241 9.507 492 HE2 LYS 60 2HE LYS 60 3.685 -1.156 9.097 493 HE3 LYS 60 1HE LYS 60 3.781 -2.851 8.634 494 HZ1 LYS 60 3HZ LYS 60 3.202 -1.934 6.304 495 HZ2 LYS 60 1HZ LYS 60 4.787 -1.796 6.887 496 HZ3 LYS 60 2HZ LYS 60 3.759 -0.456 6.929 497 H SER 61 H SER 61 -3.240 -3.871 7.023 498 HA SER 61 HA SER 61 -5.000 -3.956 8.457 499 HB2 SER 61 2HB SER 61 -4.108 -6.840 8.756 500 HB3 SER 61 1HB SER 61 -5.712 -6.208 9.132 501 HG SER 61 HG SER 61 -4.620 -5.847 6.561 502 H GLU 62 H GLU 62 -4.136 -6.366 10.626 503 HA GLU 62 HA GLU 62 -2.008 -5.208 12.018 504 HB2 GLU 62 2HB GLU 62 -3.107 -4.520 14.105 505 HB3 GLU 62 1HB GLU 62 -3.566 -3.505 12.752 506 HG2 GLU 62 2HG GLU 62 -5.698 -4.649 12.591 507 HG3 GLU 62 1HG GLU 62 -5.236 -5.721 13.915 508 H LEU 63 H LEU 63 -1.064 -7.076 12.327 509 HA LEU 63 HA LEU 63 -0.606 -9.167 13.085 510 HB2 LEU 63 2HB LEU 63 -1.198 -7.963 15.218 511 HB3 LEU 63 1HB LEU 63 -2.805 -8.647 15.086 512 HG LEU 63 HG LEU 63 -1.813 -10.920 15.225 513 HD11 LEU 63 1HD1 LEU 63 0.739 -9.417 15.785 514 HD12 LEU 63 2HD1 LEU 63 0.404 -10.404 14.361 515 HD13 LEU 63 3HD1 LEU 63 0.507 -11.157 15.952 516 HD21 LEU 63 3HD2 LEU 63 -1.320 -10.831 17.607 517 HD22 LEU 63 1HD2 LEU 63 -2.690 -9.792 17.215 518 HD23 LEU 63 2HD2 LEU 63 -1.102 -9.084 17.510 519 H TYR 64 H TYR 64 -2.749 -8.817 11.045 520 HA TYR 64 HA TYR 64 -4.618 -10.979 11.621 521 HB2 TYR 64 2HB TYR 64 -4.993 -8.647 10.335 522 HB3 TYR 64 1HB TYR 64 -4.564 -9.652 8.955 523 HD1 TYR 64 HD1 TYR 64 -6.929 -9.366 11.794 524 HD2 TYR 64 HD2 TYR 64 -6.160 -11.108 7.989 525 HE1 TYR 64 HE1 TYR 64 -9.247 -10.173 11.703 526 HE2 TYR 64 HE2 TYR 64 -8.480 -11.923 7.889 527 HH TYR 64 HH TYR 64 -10.318 -12.452 9.406 528 H LYS 65 H LYS 65 -1.868 -11.624 11.407 529 HA LYS 65 HA LYS 65 -1.243 -12.624 8.779 530 HB2 LYS 65 2HB LYS 65 0.802 -13.472 9.878 531 HB3 LYS 65 1HB LYS 65 0.525 -11.772 10.230 532 HG2 LYS 65 2HG LYS 65 -0.277 -12.275 12.418 533 HG3 LYS 65 1HG LYS 65 -0.274 -14.004 12.075 534 HD2 LYS 65 2HD LYS 65 2.177 -13.917 11.810 535 HD3 LYS 65 1HD LYS 65 2.139 -12.206 12.244 536 HE2 LYS 65 2HE LYS 65 1.277 -12.728 14.429 537 HE3 LYS 65 1HE LYS 65 1.112 -14.429 13.999 538 HZ1 LYS 65 3HZ LYS 65 3.483 -14.621 13.832 539 HZ2 LYS 65 1HZ LYS 65 3.092 -13.963 15.346 540 HZ3 LYS 65 2HZ LYS 65 3.691 -12.961 14.117 541 H GLU 66 H GLU 66 -3.489 -13.704 10.693 542 HA GLU 66 HA GLU 66 -2.789 -16.268 11.549 543 HB2 GLU 66 2HB GLU 66 -5.188 -16.654 11.805 544 HB3 GLU 66 1HB GLU 66 -4.719 -15.076 12.423 545 HG2 GLU 66 2HG GLU 66 -5.674 -13.961 10.570 546 HG3 GLU 66 1HG GLU 66 -5.856 -15.467 9.670 547 H LYS 67 H LYS 67 -3.668 -15.179 8.372 548 HA LYS 67 HA LYS 67 -4.122 -17.978 7.584 549 HB2 LYS 67 2HB LYS 67 -6.104 -16.398 7.467 550 HB3 LYS 67 1HB LYS 67 -5.262 -15.589 6.150 551 HG2 LYS 67 2HG LYS 67 -6.855 -17.148 5.248 552 HG3 LYS 67 1HG LYS 67 -5.218 -17.719 4.909 553 HD2 LYS 67 2HD LYS 67 -5.372 -19.225 6.863 554 HD3 LYS 67 1HD LYS 67 -7.035 -18.693 7.118 555 HE2 LYS 67 2HE LYS 67 -7.054 -20.791 5.947 556 HE3 LYS 67 1HE LYS 67 -7.597 -19.519 4.853 557 HZ1 LYS 67 3HZ LYS 67 -5.370 -19.468 3.893 558 HZ2 LYS 67 1HZ LYS 67 -6.065 -21.005 3.749 559 HZ3 LYS 67 2HZ LYS 67 -4.872 -20.713 4.925 560 H PHE 68 H PHE 68 -3.134 -14.864 6.087 561 HA PHE 68 HA PHE 68 -2.082 -16.222 3.821 562 HB2 PHE 68 2HB PHE 68 -1.384 -14.049 3.016 563 HB3 PHE 68 1HB PHE 68 -3.009 -13.943 3.676 564 HD1 PHE 68 HD1 PHE 68 -3.370 -12.836 5.874 565 HD2 PHE 68 HD2 PHE 68 0.403 -12.779 3.905 566 HE1 PHE 68 HE1 PHE 68 -2.666 -10.942 7.278 567 HE2 PHE 68 HE2 PHE 68 1.115 -10.892 5.314 568 HZ PHE 68 HZ PHE 68 -0.425 -9.971 7.001 569 H LEU 69 H LEU 69 -0.631 -14.995 6.769 570 HA LEU 69 HA LEU 69 2.042 -15.514 5.736 571 HB2 LEU 69 2HB LEU 69 1.563 -13.498 7.128 572 HB3 LEU 69 1HB LEU 69 1.222 -14.558 8.482 573 HG LEU 69 HG LEU 69 3.566 -15.393 8.367 574 HD11 LEU 69 1HD1 LEU 69 3.977 -14.908 6.006 575 HD12 LEU 69 2HD1 LEU 69 5.195 -14.163 7.038 576 HD13 LEU 69 3HD1 LEU 69 3.903 -13.180 6.346 577 HD21 LEU 69 3HD2 LEU 69 2.921 -13.598 9.909 578 HD22 LEU 69 1HD2 LEU 69 3.296 -12.404 8.667 579 HD23 LEU 69 2HD2 LEU 69 4.581 -13.406 9.342 580 H TYR 70 H TYR 70 -0.409 -17.057 7.533 581 HA TYR 70 HA TYR 70 1.381 -18.915 8.844 582 HB2 TYR 70 2HB TYR 70 -0.755 -18.146 9.896 583 HB3 TYR 70 1HB TYR 70 -1.636 -18.999 8.637 584 HD1 TYR 70 HD2 TYR 70 0.829 -19.542 11.372 585 HD2 TYR 70 HD1 TYR 70 -2.217 -21.244 8.938 586 HE1 TYR 70 HE2 TYR 70 0.884 -21.583 12.739 587 HE2 TYR 70 HE1 TYR 70 -2.168 -23.291 10.299 588 HH TYR 70 HH TYR 70 -0.574 -24.475 11.781 589 H GLY 71 H GLY 71 2.392 -19.568 6.856 590 HA2 GLY 71 2HA GLY 71 2.260 -21.922 5.856 591 HA3 GLY 71 1HA GLY 71 0.751 -21.330 5.165 592 H ASN 72 H ASN 72 1.978 -21.965 3.157 593 HA ASN 72 HA ASN 72 3.133 -21.447 1.261 594 HB2 ASN 72 2HB ASN 72 2.727 -18.591 2.199 595 HB3 ASN 72 1HB ASN 72 3.147 -19.087 0.563 596 HD21 ASN 72 1HD2 ASN 72 0.657 -18.718 2.888 597 HD22 ASN 72 2HD2 ASN 72 -0.674 -19.126 1.859 598 H PHE 73 H PHE 73 4.865 -19.201 0.797 599 HA PHE 73 HA PHE 73 6.962 -19.498 2.820 600 HB2 PHE 73 2HB PHE 73 7.223 -19.851 -0.156 601 HB3 PHE 73 1HB PHE 73 8.590 -19.275 0.790 602 HD1 PHE 73 HD2 PHE 73 6.366 -22.110 0.135 603 HD2 PHE 73 HD1 PHE 73 9.761 -20.727 2.292 604 HE1 PHE 73 HE2 PHE 73 6.940 -24.430 0.718 605 HE2 PHE 73 HE1 PHE 73 10.339 -23.042 2.872 606 HZ PHE 73 HZ PHE 73 8.928 -24.900 2.087 607 H GLN 74 H GLN 74 8.534 -17.707 2.758 608 HA GLN 74 HA GLN 74 7.200 -15.266 2.930 609 HB2 GLN 74 2HB GLN 74 10.141 -15.889 2.751 610 HB3 GLN 74 1HB GLN 74 9.518 -14.268 3.045 611 HG2 GLN 74 2HG GLN 74 9.010 -16.682 4.768 612 HG3 GLN 74 1HG GLN 74 10.155 -15.386 5.115 613 HE21 GLN 74 1HE2 GLN 74 7.807 -16.323 6.611 614 HE22 GLN 74 2HE2 GLN 74 6.810 -14.925 6.820 615 H THR 75 H THR 75 9.099 -16.603 0.276 616 HA THR 75 HA THR 75 9.240 -14.280 -1.298 617 HB THR 75 HB THR 75 9.524 -15.886 -3.218 618 HG1 THR 75 HG1 THR 75 8.814 -17.844 -2.910 619 HG21 THR 75 3HG2 THR 75 11.454 -15.121 -1.955 620 HG22 THR 75 1HG2 THR 75 11.650 -16.821 -2.380 621 HG23 THR 75 2HG2 THR 75 11.183 -16.371 -0.740 622 H ARG 76 H ARG 76 6.810 -16.823 -1.060 623 HA ARG 76 HA ARG 76 5.098 -15.986 -3.141 624 HB2 ARG 76 2HB ARG 76 5.164 -18.068 -1.324 625 HB3 ARG 76 1HB ARG 76 3.782 -17.138 -0.779 626 HG2 ARG 76 2HG ARG 76 4.145 -18.197 -3.575 627 HG3 ARG 76 1HG ARG 76 3.188 -18.970 -2.312 628 HD2 ARG 76 2HD ARG 76 1.496 -17.824 -3.266 629 HD3 ARG 76 1HD ARG 76 2.114 -16.501 -2.278 630 HE ARG 76 HE ARG 76 3.523 -16.305 -4.599 631 HH11 ARG 76 1HH1 ARG 76 0.099 -16.459 -3.857 632 HH12 ARG 76 2HH1 ARG 76 -0.368 -15.463 -5.203 633 HH21 ARG 76 1HH2 ARG 76 2.909 -15.023 -6.390 634 HH22 ARG 76 2HH2 ARG 76 1.221 -14.650 -6.634 635 H VAL 77 H VAL 77 5.397 -15.093 0.246 636 HA VAL 77 HA VAL 77 3.074 -13.470 0.396 637 HB VAL 77 HB VAL 77 5.588 -13.299 2.072 638 HG11 VAL 77 1HG1 VAL 77 4.195 -11.313 2.279 639 HG12 VAL 77 2HG1 VAL 77 4.133 -12.272 3.757 640 HG13 VAL 77 3HG1 VAL 77 2.787 -12.319 2.620 641 HG21 VAL 77 3HG2 VAL 77 3.056 -14.879 2.519 642 HG22 VAL 77 1HG2 VAL 77 4.377 -14.710 3.676 643 HG23 VAL 77 2HG2 VAL 77 4.649 -15.538 2.143 644 H ILE 78 H ILE 78 6.461 -12.818 -0.372 645 HA ILE 78 HA ILE 78 6.325 -10.027 -0.605 646 HB ILE 78 HB ILE 78 8.037 -11.964 -2.181 647 HG12 ILE 78 2HG1 ILE 78 8.653 -10.381 0.324 648 HG13 ILE 78 1HG1 ILE 78 8.304 -12.107 0.278 649 HG21 ILE 78 1HG2 ILE 78 8.354 -8.990 -1.769 650 HG22 ILE 78 2HG2 ILE 78 7.943 -9.797 -3.281 651 HG23 ILE 78 3HG2 ILE 78 9.530 -10.046 -2.553 652 HD11 ILE 78 3HD1 ILE 78 10.644 -10.741 -1.033 653 HD12 ILE 78 1HD1 ILE 78 10.303 -12.470 -1.072 654 HD13 ILE 78 2HD1 ILE 78 10.688 -11.682 0.458 655 H GLU 79 H GLU 79 5.614 -12.596 -2.932 656 HA GLU 79 HA GLU 79 5.004 -10.945 -5.125 657 HB2 GLU 79 2HB GLU 79 3.908 -13.657 -4.369 658 HB3 GLU 79 1HB GLU 79 3.656 -12.882 -5.926 659 HG2 GLU 79 2HG GLU 79 6.047 -12.930 -6.356 660 HG3 GLU 79 1HG GLU 79 6.325 -13.667 -4.776 661 H LEU 80 H LEU 80 3.088 -12.100 -2.415 662 HA LEU 80 HA LEU 80 0.573 -11.207 -3.342 663 HB2 LEU 80 2HB LEU 80 1.584 -11.785 -0.559 664 HB3 LEU 80 1HB LEU 80 -0.089 -11.413 -0.924 665 HG LEU 80 HG LEU 80 1.394 -13.762 -2.095 666 HD11 LEU 80 1HD1 LEU 80 -0.535 -13.707 0.219 667 HD12 LEU 80 2HD1 LEU 80 1.206 -13.956 0.347 668 HD13 LEU 80 3HD1 LEU 80 0.206 -15.139 -0.496 669 HD21 LEU 80 3HD2 LEU 80 -1.542 -13.088 -1.984 670 HD22 LEU 80 1HD2 LEU 80 -0.834 -14.542 -2.688 671 HD23 LEU 80 2HD2 LEU 80 -0.513 -12.965 -3.410 672 H ASN 81 H ASN 81 2.756 -9.782 -0.875 673 HA ASN 81 HA ASN 81 0.977 -7.654 -0.369 674 HB2 ASN 81 2HB ASN 81 2.849 -6.621 0.921 675 HB3 ASN 81 1HB ASN 81 2.459 -8.266 1.390 676 HD21 ASN 81 1HD2 ASN 81 4.486 -8.474 2.366 677 HD22 ASN 81 2HD2 ASN 81 5.931 -8.678 1.442 678 H TYR 82 H TYR 82 3.791 -7.872 -2.517 679 HA TYR 82 HA TYR 82 3.645 -5.058 -3.081 680 HB2 TYR 82 2HB TYR 82 5.343 -7.287 -4.139 681 HB3 TYR 82 1HB TYR 82 5.335 -5.707 -4.923 682 HD1 TYR 82 HD2 TYR 82 5.460 -3.703 -3.108 683 HD2 TYR 82 HD1 TYR 82 7.038 -7.619 -2.608 684 HE1 TYR 82 HE2 TYR 82 7.026 -2.843 -1.422 685 HE2 TYR 82 HE1 TYR 82 8.603 -6.775 -0.910 686 HH TYR 82 HH TYR 82 8.292 -3.941 0.640 687 H LYS 83 H LYS 83 2.300 -7.943 -4.512 688 HA LYS 83 HA LYS 83 1.486 -6.606 -6.916 689 HB2 LYS 83 2HB LYS 83 1.711 -9.131 -6.592 690 HB3 LYS 83 1HB LYS 83 0.188 -9.057 -5.717 691 HG2 LYS 83 2HG LYS 83 -0.990 -8.350 -7.647 692 HG3 LYS 83 1HG LYS 83 0.508 -8.061 -8.534 693 HD2 LYS 83 2HD LYS 83 -0.492 -10.752 -7.594 694 HD3 LYS 83 1HD LYS 83 -0.584 -10.140 -9.247 695 HE2 LYS 83 2HE LYS 83 1.857 -10.021 -9.341 696 HE3 LYS 83 1HE LYS 83 1.955 -10.615 -7.686 697 HZ1 LYS 83 3HZ LYS 83 2.341 -12.414 -9.217 698 HZ2 LYS 83 1HZ LYS 83 0.887 -12.095 -10.032 699 HZ3 LYS 83 2HZ LYS 83 0.854 -12.666 -8.440 700 H HIS 84 H HIS 84 0.493 -6.625 -3.684 701 HA HIS 84 HA HIS 84 -2.133 -5.497 -4.266 702 HB2 HIS 84 2HB HIS 84 -1.904 -7.129 -2.433 703 HB3 HIS 84 1HB HIS 84 -0.766 -6.062 -1.622 704 HD1 HIS 84 HD1 HIS 84 -2.104 -5.566 0.458 705 HD2 HIS 84 HD2 HIS 84 -4.250 -4.877 -3.044 706 HE1 HIS 84 HE1 HIS 84 -4.232 -4.425 1.169 707 HE2 HIS 84 HE2 HIS 84 -5.584 -4.186 -0.942 708 H LEU 85 H LEU 85 1.080 -4.496 -3.419 709 HA LEU 85 HA LEU 85 0.192 -1.828 -2.625 710 HB2 LEU 85 2HB LEU 85 2.918 -3.115 -2.626 711 HB3 LEU 85 1HB LEU 85 2.632 -1.445 -2.178 712 HG LEU 85 HG LEU 85 1.459 -3.834 -0.758 713 HD11 LEU 85 1HD1 LEU 85 3.875 -3.704 -0.461 714 HD12 LEU 85 2HD1 LEU 85 3.028 -3.294 1.030 715 HD13 LEU 85 3HD1 LEU 85 3.731 -2.018 0.036 716 HD21 LEU 85 3HD2 LEU 85 0.837 -2.182 0.954 717 HD22 LEU 85 1HD2 LEU 85 0.038 -1.880 -0.588 718 HD23 LEU 85 2HD2 LEU 85 1.415 -0.892 -0.102 719 H LEU 86 H LEU 86 2.411 -3.281 -4.998 720 HA LEU 86 HA LEU 86 2.440 -0.749 -6.476 721 HB2 LEU 86 2HB LEU 86 4.052 -3.281 -6.842 722 HB3 LEU 86 1HB LEU 86 4.238 -1.824 -7.800 723 HG LEU 86 HG LEU 86 4.729 -1.973 -4.823 724 HD11 LEU 86 1HD1 LEU 86 7.095 -1.918 -5.379 725 HD12 LEU 86 2HD1 LEU 86 6.709 -1.960 -7.100 726 HD13 LEU 86 3HD1 LEU 86 6.330 -3.345 -6.076 727 HD21 LEU 86 3HD2 LEU 86 5.340 0.161 -6.863 728 HD22 LEU 86 1HD2 LEU 86 5.824 0.190 -5.168 729 HD23 LEU 86 2HD2 LEU 86 4.114 0.247 -5.599 730 H GLY 87 H GLY 87 0.966 -3.793 -6.438 731 HA2 GLY 87 2HA GLY 87 -0.620 -4.697 -7.867 732 HA3 GLY 87 1HA GLY 87 -0.360 -3.340 -8.957 733 H ARG 88 H ARG 88 2.365 -5.143 -7.827 734 HA ARG 88 HA ARG 88 2.519 -6.772 -10.217 735 HB2 ARG 88 2HB ARG 88 3.321 -4.591 -11.000 736 HB3 ARG 88 1HB ARG 88 4.482 -4.532 -9.683 737 HG2 ARG 88 2HG ARG 88 5.633 -6.477 -10.609 738 HG3 ARG 88 1HG ARG 88 4.468 -6.530 -11.935 739 HD2 ARG 88 2HD ARG 88 6.306 -4.226 -11.306 740 HD3 ARG 88 1HD ARG 88 6.563 -5.420 -12.578 741 HE ARG 88 HE ARG 88 4.065 -4.344 -13.036 742 HH11 ARG 88 1HH1 ARG 88 7.308 -3.079 -12.762 743 HH12 ARG 88 2HH1 ARG 88 7.080 -1.863 -13.982 744 HH21 ARG 88 1HH2 ARG 88 3.732 -2.712 -14.595 745 HH22 ARG 88 2HH2 ARG 88 5.036 -1.639 -14.998 746 H ALA 89 H ALA 89 3.954 -8.472 -10.013 747 HA ALA 89 HA ALA 89 4.885 -9.124 -7.384 748 HB1 ALA 89 3HB ALA 89 5.755 -11.149 -8.441 749 HB2 ALA 89 1HB ALA 89 5.423 -10.466 -10.033 750 HB3 ALA 89 2HB ALA 89 4.092 -10.836 -8.937 751 HA PRO 90 HA PRO 90 9.066 -7.622 -7.246 752 HB2 PRO 90 2HB PRO 90 10.419 -10.073 -6.941 753 HB3 PRO 90 1HB PRO 90 9.848 -9.018 -5.647 754 HG2 PRO 90 2HG PRO 90 8.588 -11.454 -6.799 755 HG3 PRO 90 1HG PRO 90 8.563 -10.854 -5.131 756 HD2 PRO 90 2HD PRO 90 6.426 -10.615 -6.716 757 HD3 PRO 90 1HD PRO 90 6.870 -9.325 -5.578 758 H TYR 91 H TYR 91 10.951 -7.446 -8.504 759 HA TYR 91 HA TYR 91 10.535 -8.545 -11.206 760 HB2 TYR 91 2HB TYR 91 10.256 -6.140 -11.103 761 HB3 TYR 91 1HB TYR 91 11.818 -5.959 -10.314 762 HD1 TYR 91 HD2 TYR 91 10.260 -7.132 -13.493 763 HD2 TYR 91 HD1 TYR 91 13.728 -5.577 -11.585 764 HE1 TYR 91 HE2 TYR 91 11.338 -6.860 -15.688 765 HE2 TYR 91 HE1 TYR 91 14.813 -5.294 -13.771 766 HH TYR 91 HH TYR 91 14.675 -6.196 -16.029 767 H ASP 92 H ASP 92 12.988 -7.916 -8.733 768 HA ASP 92 HA ASP 92 14.862 -9.514 -10.356 769 HB2 ASP 92 2HB ASP 92 15.502 -7.159 -10.537 770 HB3 ASP 92 1HB ASP 92 15.542 -7.021 -8.783 771 H GLU 93 H GLU 93 16.246 -10.874 -9.240 772 HA GLU 93 HA GLU 93 15.188 -11.973 -6.880 773 HB2 GLU 93 2HB GLU 93 16.454 -13.274 -8.517 774 HB3 GLU 93 1HB GLU 93 17.908 -12.371 -8.124 775 HG2 GLU 93 2HG GLU 93 17.850 -13.258 -5.855 776 HG3 GLU 93 1HG GLU 93 16.389 -14.166 -6.249 777 H SER 94 H SER 94 17.806 -9.690 -7.426 778 HA SER 94 HA SER 94 19.012 -9.962 -4.881 779 HB2 SER 94 2HB SER 94 19.098 -7.523 -6.669 780 HB3 SER 94 1HB SER 94 20.295 -8.022 -5.471 781 HG SER 94 HG SER 94 19.762 -9.064 -8.018 782 H GLU 95 H GLU 95 16.487 -7.800 -6.130 783 HA GLU 95 HA GLU 95 16.335 -6.365 -3.659 784 HB2 GLU 95 2HB GLU 95 14.250 -5.365 -4.619 785 HB3 GLU 95 1HB GLU 95 15.693 -5.143 -5.593 786 HG2 GLU 95 2HG GLU 95 14.303 -5.723 -7.252 787 HG3 GLU 95 1HG GLU 95 14.731 -7.354 -6.746 788 H VAL 96 H VAL 96 14.748 -9.180 -5.022 789 HA VAL 96 HA VAL 96 12.748 -9.528 -3.087 790 HB VAL 96 HB VAL 96 14.376 -11.649 -4.511 791 HG11 VAL 96 1HG1 VAL 96 11.775 -11.934 -3.010 792 HG12 VAL 96 2HG1 VAL 96 13.342 -12.554 -2.490 793 HG13 VAL 96 3HG1 VAL 96 12.577 -13.200 -3.942 794 HG21 VAL 96 3HG2 VAL 96 12.419 -11.836 -5.979 795 HG22 VAL 96 1HG2 VAL 96 13.133 -10.224 -6.039 796 HG23 VAL 96 2HG2 VAL 96 11.654 -10.501 -5.118 797 H ILE 97 H ILE 97 16.148 -10.536 -3.113 798 HA ILE 97 HA ILE 97 16.229 -11.794 -0.617 799 HB ILE 97 HB ILE 97 18.432 -10.223 -1.964 800 HG12 ILE 97 2HG1 ILE 97 17.600 -11.986 -3.417 801 HG13 ILE 97 1HG1 ILE 97 19.183 -12.435 -2.794 802 HG21 ILE 97 1HG2 ILE 97 18.569 -12.306 0.207 803 HG22 ILE 97 2HG2 ILE 97 18.930 -10.587 0.373 804 HG23 ILE 97 3HG2 ILE 97 19.958 -11.613 -0.627 805 HD11 ILE 97 3HD1 ILE 97 17.660 -14.324 -2.824 806 HD12 ILE 97 1HD1 ILE 97 16.537 -13.449 -1.785 807 HD13 ILE 97 2HD1 ILE 97 18.124 -13.914 -1.171 808 H PHE 98 H PHE 98 16.512 -8.402 -1.518 809 HA PHE 98 HA PHE 98 17.248 -7.339 0.959 810 HB2 PHE 98 2HB PHE 98 17.305 -5.962 -1.016 811 HB3 PHE 98 1HB PHE 98 15.575 -6.158 -1.265 812 HD1 PHE 98 HD1 PHE 98 18.077 -4.739 1.077 813 HD2 PHE 98 HD2 PHE 98 14.067 -4.641 -0.350 814 HE1 PHE 98 HE1 PHE 98 17.672 -2.683 2.365 815 HE2 PHE 98 HE2 PHE 98 13.655 -2.586 0.938 816 HZ PHE 98 HZ PHE 98 15.457 -1.603 2.297 817 H HIS 99 H HIS 99 14.045 -8.143 -0.332 818 HA HIS 99 HA HIS 99 12.560 -7.056 1.822 819 HB2 HIS 99 2HB HIS 99 11.768 -9.354 0.012 820 HB3 HIS 99 1HB HIS 99 10.682 -8.391 1.010 821 HD1 HIS 99 HD1 HIS 99 11.000 -5.634 0.368 822 HD2 HIS 99 HD2 HIS 99 11.663 -8.534 -2.539 823 HE1 HIS 99 HE1 HIS 99 10.961 -4.414 -1.845 824 HE2 HIS 99 HE2 HIS 99 11.572 -6.166 -3.566 825 H LEU 100 H LEU 100 13.841 -10.286 1.184 826 HA LEU 100 HA LEU 100 12.817 -11.556 3.473 827 HB2 LEU 100 2HB LEU 100 15.376 -12.114 1.964 828 HB3 LEU 100 1HB LEU 100 14.629 -13.200 3.124 829 HG LEU 100 HG LEU 100 13.373 -12.325 0.519 830 HD11 LEU 100 1HD1 LEU 100 13.809 -14.600 -0.235 831 HD12 LEU 100 2HD1 LEU 100 14.651 -14.948 1.274 832 HD13 LEU 100 3HD1 LEU 100 15.311 -13.760 0.150 833 HD21 LEU 100 3HD2 LEU 100 12.515 -14.393 2.541 834 HD22 LEU 100 1HD2 LEU 100 11.735 -14.073 0.993 835 HD23 LEU 100 2HD2 LEU 100 11.733 -12.839 2.252 836 H ASP 101 H ASP 101 15.836 -9.828 2.889 837 HA ASP 101 HA ASP 101 17.000 -10.213 5.420 838 HB2 ASP 101 2HB ASP 101 18.356 -9.441 3.594 839 HB3 ASP 101 1HB ASP 101 17.339 -8.022 3.369 840 H LEU 102 H LEU 102 14.995 -7.569 4.153 841 HA LEU 102 HA LEU 102 15.026 -6.017 6.515 842 HB2 LEU 102 2HB LEU 102 14.436 -5.185 4.246 843 HB3 LEU 102 1HB LEU 102 12.934 -6.081 4.337 844 HG LEU 102 HG LEU 102 12.140 -4.675 6.144 845 HD11 LEU 102 1HD1 LEU 102 14.812 -3.287 5.947 846 HD12 LEU 102 2HD1 LEU 102 14.266 -4.299 7.285 847 HD13 LEU 102 3HD1 LEU 102 13.451 -2.772 6.944 848 HD21 LEU 102 3HD2 LEU 102 11.848 -3.911 3.812 849 HD22 LEU 102 1HD2 LEU 102 13.339 -2.981 3.955 850 HD23 LEU 102 2HD2 LEU 102 11.945 -2.574 4.959 851 H TYR 103 H TYR 103 12.919 -8.585 5.353 852 HA TYR 103 HA TYR 103 10.931 -8.427 7.337 853 HB2 TYR 103 2HB TYR 103 10.651 -9.750 5.300 854 HB3 TYR 103 1HB TYR 103 11.943 -10.833 5.802 855 HD1 TYR 103 HD1 TYR 103 8.498 -9.736 6.540 856 HD2 TYR 103 HD2 TYR 103 11.523 -12.623 7.328 857 HE1 TYR 103 HE1 TYR 103 6.842 -11.151 7.676 858 HE2 TYR 103 HE2 TYR 103 9.871 -14.049 8.465 859 HH TYR 103 HH TYR 103 7.712 -13.858 9.568 860 H GLU 104 H GLU 104 14.040 -10.094 7.252 861 HA GLU 104 HA GLU 104 13.577 -11.323 9.823 862 HB2 GLU 104 2HB GLU 104 15.979 -11.305 7.997 863 HB3 GLU 104 1HB GLU 104 15.929 -12.157 9.537 864 HG2 GLU 104 2HG GLU 104 14.000 -13.450 8.724 865 HG3 GLU 104 1HG GLU 104 14.141 -12.638 7.166 866 H ASN 105 H ASN 105 14.891 -8.377 8.679 867 HA ASN 105 HA ASN 105 16.448 -7.858 11.058 868 HB2 ASN 105 2HB ASN 105 15.881 -6.416 8.539 869 HB3 ASN 105 1HB ASN 105 16.165 -5.406 9.951 870 HD21 ASN 105 1HD2 ASN 105 17.542 -7.652 7.709 871 HD22 ASN 105 2HD2 ASN 105 19.191 -7.409 8.181 872 H GLU 106 H GLU 106 13.503 -6.428 9.644 873 HA GLU 106 HA GLU 106 12.853 -5.399 12.331 874 HB2 GLU 106 2HB GLU 106 12.125 -4.297 9.613 875 HB3 GLU 106 1HB GLU 106 11.571 -3.636 11.143 876 HG2 GLU 106 2HG GLU 106 14.468 -3.868 10.388 877 HG3 GLU 106 1HG GLU 106 13.490 -2.434 10.081 878 H GLY 107 H GLY 107 11.560 -6.932 9.424 879 HA2 GLY 107 2HA GLY 107 9.850 -8.697 10.042 880 HA3 GLY 107 1HA GLY 107 9.030 -7.386 10.876 881 H PHE 108 H PHE 108 7.407 -8.479 9.237 882 HA PHE 108 HA PHE 108 7.650 -7.647 6.517 883 HB2 PHE 108 2HB PHE 108 5.263 -8.346 6.307 884 HB3 PHE 108 1HB PHE 108 6.305 -9.594 6.965 885 HD1 PHE 108 HD2 PHE 108 3.642 -7.179 7.755 886 HD2 PHE 108 HD1 PHE 108 5.971 -10.452 9.166 887 HE1 PHE 108 HE2 PHE 108 2.099 -7.459 9.650 888 HE2 PHE 108 HE1 PHE 108 4.424 -10.741 11.057 889 HZ PHE 108 HZ PHE 108 2.487 -9.242 11.301 890 H ASP 109 H ASP 109 6.533 -6.189 9.418 891 HA ASP 109 HA ASP 109 4.878 -4.203 8.366 892 HB2 ASP 109 2HB ASP 109 5.754 -2.810 10.373 893 HB3 ASP 109 1HB ASP 109 4.829 -4.268 10.690 894 H ALA 110 H ALA 110 8.374 -4.041 9.012 895 HA ALA 110 HA ALA 110 8.773 -1.515 7.860 896 HB1 ALA 110 3HB ALA 110 10.377 -2.574 9.363 897 HB2 ALA 110 1HB ALA 110 11.136 -2.073 7.854 898 HB3 ALA 110 2HB ALA 110 10.749 -3.773 8.123 899 H ASP 111 H ASP 111 8.970 -4.766 6.419 900 HA ASP 111 HA ASP 111 10.032 -3.906 3.950 901 HB2 ASP 111 2HB ASP 111 10.027 -6.277 4.717 902 HB3 ASP 111 1HB ASP 111 8.292 -6.337 4.410 903 H ILE 112 H ILE 112 6.720 -4.176 5.117 904 HA ILE 112 HA ILE 112 5.550 -3.412 2.618 905 HB ILE 112 HB ILE 112 4.419 -3.410 5.420 906 HG12 ILE 112 2HG1 ILE 112 3.959 -5.266 3.074 907 HG13 ILE 112 1HG1 ILE 112 4.956 -5.628 4.479 908 HG21 ILE 112 1HG2 ILE 112 3.247 -1.745 4.099 909 HG22 ILE 112 2HG2 ILE 112 2.211 -3.147 4.375 910 HG23 ILE 112 3HG2 ILE 112 2.991 -2.921 2.810 911 HD11 ILE 112 3HD1 ILE 112 1.984 -5.149 4.481 912 HD12 ILE 112 1HD1 ILE 112 2.971 -5.472 5.907 913 HD13 ILE 112 2HD1 ILE 112 2.799 -6.703 4.657 914 H ASP 113 H ASP 113 6.816 -1.712 5.404 915 HA ASP 113 HA ASP 113 5.583 0.796 4.838 916 HB2 ASP 113 2HB ASP 113 7.859 -0.026 6.620 917 HB3 ASP 113 1HB ASP 113 7.525 1.679 6.334 918 H SER 114 H SER 114 8.313 -0.832 3.525 919 HA SER 114 HA SER 114 9.921 1.311 2.743 920 HB2 SER 114 2HB SER 114 10.867 -0.202 1.083 921 HB3 SER 114 1HB SER 114 10.587 -1.073 2.592 922 HG SER 114 HG SER 114 9.224 -2.323 1.593 923 H TYR 115 H TYR 115 7.026 -0.038 1.287 924 HA TYR 115 HA TYR 115 7.124 1.321 -1.177 925 HB2 TYR 115 2HB TYR 115 5.623 -0.506 -1.041 926 HB3 TYR 115 1HB TYR 115 4.864 0.122 0.418 927 HD1 TYR 115 HD1 TYR 115 5.425 1.212 -3.131 928 HD2 TYR 115 HD2 TYR 115 2.772 1.017 0.189 929 HE1 TYR 115 HE1 TYR 115 3.671 2.289 -4.475 930 HE2 TYR 115 HE2 TYR 115 1.006 2.082 -1.148 931 HH TYR 115 HH TYR 115 0.762 3.474 -3.090 932 H ILE 116 H ILE 116 6.094 2.301 2.003 933 HA ILE 116 HA ILE 116 4.912 4.771 0.983 934 HB ILE 116 HB ILE 116 5.199 3.809 3.838 935 HG12 ILE 116 2HG1 ILE 116 3.778 2.319 2.500 936 HG13 ILE 116 1HG1 ILE 116 2.829 3.206 3.685 937 HG21 ILE 116 1HG2 ILE 116 4.961 6.230 3.682 938 HG22 ILE 116 2HG2 ILE 116 3.510 5.496 4.368 939 HG23 ILE 116 3HG2 ILE 116 3.517 6.032 2.688 940 HD11 ILE 116 3HD1 ILE 116 3.033 3.842 0.753 941 HD12 ILE 116 1HD1 ILE 116 2.087 4.744 1.939 942 HD13 ILE 116 2HD1 ILE 116 1.671 3.071 1.565 943 H ASP 117 H ASP 117 7.821 3.555 2.293 944 HA ASP 117 HA ASP 117 8.830 5.993 3.387 945 HB2 ASP 117 2HB ASP 117 9.601 3.835 4.220 946 HB3 ASP 117 1HB ASP 117 10.223 3.419 2.628 947 H SER 118 H SER 118 8.848 4.489 0.268 948 HA SER 118 HA SER 118 10.939 6.196 -0.786 949 HB2 SER 118 2HB SER 118 9.047 4.390 -2.311 950 HB3 SER 118 1HB SER 118 10.612 5.001 -2.847 951 HG SER 118 HG SER 118 10.089 3.122 -0.780 952 HA PRO 119 HA PRO 119 7.671 9.287 -0.795 953 HB2 PRO 119 2HB PRO 119 9.228 11.357 -1.745 954 HB3 PRO 119 1HB PRO 119 9.107 10.880 -0.050 955 HG2 PRO 119 2HG PRO 119 11.209 10.218 -2.064 956 HG3 PRO 119 1HG PRO 119 11.384 10.601 -0.342 957 HD2 PRO 119 2HD PRO 119 11.534 8.078 -1.262 958 HD3 PRO 119 1HD PRO 119 10.824 8.460 0.321 959 H GLU 120 H GLU 120 9.919 9.254 -3.564 960 HA GLU 120 HA GLU 120 8.252 10.545 -5.375 961 HB2 GLU 120 2HB GLU 120 10.625 10.214 -5.804 962 HB3 GLU 120 1HB GLU 120 10.387 8.475 -5.909 963 HG2 GLU 120 2HG GLU 120 9.052 8.739 -7.903 964 HG3 GLU 120 1HG GLU 120 9.155 10.494 -7.772 965 H TYR 121 H TYR 121 8.637 7.063 -4.780 966 HA TYR 121 HA TYR 121 6.894 6.286 -6.863 967 HB2 TYR 121 2HB TYR 121 7.881 4.794 -4.431 968 HB3 TYR 121 1HB TYR 121 6.897 4.055 -5.694 969 HD1 TYR 121 HD1 TYR 121 7.810 4.265 -8.120 970 HD2 TYR 121 HD2 TYR 121 10.209 4.780 -4.645 971 HE1 TYR 121 HE1 TYR 121 9.825 3.824 -9.456 972 HE2 TYR 121 HE2 TYR 121 12.235 4.340 -5.973 973 HH TYR 121 HH TYR 121 12.295 4.430 -9.301 974 H THR 122 H THR 122 6.379 6.628 -3.347 975 HA THR 122 HA THR 122 3.726 5.708 -3.331 976 HB THR 122 HB THR 122 4.632 7.875 -1.464 977 HG1 THR 122 HG1 THR 122 5.422 5.131 -1.300 978 HG21 THR 122 3HG2 THR 122 2.378 6.968 -1.220 979 HG22 THR 122 1HG2 THR 122 3.386 6.526 0.160 980 HG23 THR 122 2HG2 THR 122 3.038 5.336 -1.095 981 H ASN 123 H ASN 123 4.975 9.051 -3.431 982 HA ASN 123 HA ASN 123 2.424 10.258 -3.375 983 HB2 ASN 123 2HB ASN 123 4.763 11.255 -2.849 984 HB3 ASN 123 1HB ASN 123 4.853 11.570 -4.573 985 HD21 ASN 123 1HD2 ASN 123 1.950 12.141 -4.750 986 HD22 ASN 123 2HD2 ASN 123 1.761 13.722 -4.064 987 H SER 124 H SER 124 4.340 8.997 -6.007 988 HA SER 124 HA SER 124 3.181 10.529 -8.071 989 HB2 SER 124 2HB SER 124 4.597 7.868 -8.125 990 HB3 SER 124 1HB SER 124 4.072 8.721 -9.578 991 HG SER 124 HG SER 124 6.081 9.384 -7.732 992 H PHE 125 H PHE 125 2.356 7.202 -6.936 993 HA PHE 125 HA PHE 125 -0.127 7.553 -8.481 994 HB2 PHE 125 2HB PHE 125 -0.007 5.391 -9.419 995 HB3 PHE 125 1HB PHE 125 1.589 6.096 -9.634 996 HD1 PHE 125 HD1 PHE 125 3.457 5.368 -8.115 997 HD2 PHE 125 HD2 PHE 125 -0.317 3.406 -8.223 998 HE1 PHE 125 HE1 PHE 125 4.454 3.390 -7.042 999 HE2 PHE 125 HE2 PHE 125 0.666 1.430 -7.148 1000 HZ PHE 125 HZ PHE 125 3.059 1.419 -6.552 1001 H GLY 126 H GLY 126 1.188 6.761 -5.461 1002 HA2 GLY 126 2HA GLY 126 -1.302 5.333 -4.751 1003 HA3 GLY 126 1HA GLY 126 0.262 4.879 -4.099 1004 H ASP 127 H ASP 127 -0.646 8.229 -4.485 1005 HA ASP 127 HA ASP 127 -0.718 8.477 -1.565 1006 HB2 ASP 127 2HB ASP 127 0.887 9.890 -2.867 1007 HB3 ASP 127 1HB ASP 127 -0.493 10.686 -3.617 1008 H TRP 128 H TRP 128 -2.436 9.685 -4.438 1009 HA TRP 128 HA TRP 128 -4.870 9.892 -2.797 1010 HB2 TRP 128 2HB TRP 128 -4.064 11.289 -5.347 1011 HB3 TRP 128 1HB TRP 128 -5.714 11.308 -4.738 1012 HD1 TRP 128 HD1 TRP 128 -2.375 12.984 -4.319 1013 HE1 TRP 128 HE1 TRP 128 -2.564 14.845 -2.548 1014 HE3 TRP 128 HE3 TRP 128 -6.996 11.852 -2.432 1015 HZ2 TRP 128 HZ2 TRP 128 -4.416 15.707 -0.601 1016 HZ3 TRP 128 HZ3 TRP 128 -7.901 13.243 -0.615 1017 HH2 TRP 128 HH2 TRP 128 -6.638 15.129 0.281 1018 H VAL 129 H VAL 129 -3.370 8.128 -5.283 1019 HA VAL 129 HA VAL 129 -5.940 7.205 -6.366 1020 HB VAL 129 HB VAL 129 -3.181 6.757 -7.527 1021 HG11 VAL 129 1HG1 VAL 129 -4.818 5.110 -8.259 1022 HG12 VAL 129 2HG1 VAL 129 -4.390 6.190 -9.584 1023 HG13 VAL 129 3HG1 VAL 129 -5.923 6.399 -8.739 1024 HG21 VAL 129 3HG2 VAL 129 -5.232 8.836 -8.279 1025 HG22 VAL 129 1HG2 VAL 129 -3.721 8.521 -9.135 1026 HG23 VAL 129 2HG2 VAL 129 -3.688 9.139 -7.484 1027 H VAL 130 H VAL 130 -6.397 4.993 -6.492 1028 HA VAL 130 HA VAL 130 -5.064 3.351 -4.503 1029 HB VAL 130 HB VAL 130 -7.417 2.726 -6.302 1030 HG11 VAL 130 1HG1 VAL 130 -6.273 0.701 -5.614 1031 HG12 VAL 130 2HG1 VAL 130 -7.825 0.844 -4.789 1032 HG13 VAL 130 3HG1 VAL 130 -6.331 1.218 -3.929 1033 HG21 VAL 130 3HG2 VAL 130 -7.324 3.535 -3.397 1034 HG22 VAL 130 1HG2 VAL 130 -8.772 3.040 -4.276 1035 HG23 VAL 130 2HG2 VAL 130 -7.920 4.515 -4.737 1036 HA PRO 131 HA PRO 131 -2.387 1.565 -7.615 1037 HB2 PRO 131 2HB PRO 131 -1.705 -0.324 -5.471 1038 HB3 PRO 131 1HB PRO 131 -0.667 0.809 -6.339 1039 HG2 PRO 131 2HG PRO 131 -1.350 1.201 -3.767 1040 HG3 PRO 131 1HG PRO 131 -1.128 2.549 -4.899 1041 HD2 PRO 131 2HD PRO 131 -3.663 1.287 -3.920 1042 HD3 PRO 131 1HD PRO 131 -3.283 3.004 -4.178 1043 H TYR 132 H TYR 132 -3.397 0.366 -9.100 1044 HA TYR 132 HA TYR 132 -4.624 -2.162 -8.248 1045 HB2 TYR 132 2HB TYR 132 -5.843 -2.111 -10.411 1046 HB3 TYR 132 1HB TYR 132 -6.217 -0.731 -9.389 1047 HD1 TYR 132 HD2 TYR 132 -5.327 1.514 -9.968 1048 HD2 TYR 132 HD1 TYR 132 -4.794 -1.838 -12.539 1049 HE1 TYR 132 HE2 TYR 132 -4.778 3.030 -11.825 1050 HE2 TYR 132 HE1 TYR 132 -4.240 -0.333 -14.400 1051 HH TYR 132 HH TYR 132 -4.770 2.129 -15.000 1052 H TYR 133 H TYR 133 -4.345 -3.992 -9.795 1053 HA TYR 133 HA TYR 133 -1.599 -4.460 -10.043 1054 HB2 TYR 133 2HB TYR 133 -2.174 -6.607 -11.013 1055 HB3 TYR 133 1HB TYR 133 -3.217 -6.258 -9.644 1056 HD1 TYR 133 HD2 TYR 133 -5.602 -5.583 -10.067 1057 HD2 TYR 133 HD1 TYR 133 -3.062 -7.004 -13.168 1058 HE1 TYR 133 HE2 TYR 133 -7.575 -6.080 -11.451 1059 HE2 TYR 133 HE1 TYR 133 -5.025 -7.506 -14.557 1060 HH TYR 133 HH TYR 133 -8.162 -6.388 -13.803 1061 H ARG 134 H ARG 134 -0.191 -4.131 -11.524 1062 HA ARG 134 HA ARG 134 -0.954 -3.757 -14.316 1063 HB2 ARG 134 2HB ARG 134 0.446 -1.726 -12.598 1064 HB3 ARG 134 1HB ARG 134 0.763 -1.802 -14.326 1065 HG2 ARG 134 2HG ARG 134 -1.444 -1.234 -14.869 1066 HG3 ARG 134 1HG ARG 134 -2.019 -1.557 -13.233 1067 HD2 ARG 134 2HD ARG 134 -0.058 0.625 -13.919 1068 HD3 ARG 134 1HD ARG 134 -1.803 0.870 -13.829 1069 HE ARG 134 HE ARG 134 -0.675 -0.330 -11.467 1070 HH11 ARG 134 1HH1 ARG 134 -1.391 2.697 -13.081 1071 HH12 ARG 134 2HH1 ARG 134 -1.476 3.611 -11.606 1072 HH21 ARG 134 1HH2 ARG 134 -0.759 0.877 -9.527 1073 HH22 ARG 134 2HH2 ARG 134 -1.087 2.581 -9.593 1074 H GLY 135 H GLY 135 -0.012 -5.956 -14.138 1075 HA2 GLY 135 2HA GLY 135 2.844 -6.129 -13.595 1076 HA3 GLY 135 1HA GLY 135 1.768 -7.466 -13.969 1077 H LEU 136 H LEU 136 1.049 -5.231 -16.193 1078 HA LEU 136 HA LEU 136 3.219 -5.980 -18.024 1079 HB2 LEU 136 2HB LEU 136 1.233 -7.311 -18.551 1080 HB3 LEU 136 1HB LEU 136 0.264 -5.852 -18.646 1081 HG LEU 136 HG LEU 136 1.640 -5.112 -20.576 1082 HD11 LEU 136 1HD1 LEU 136 2.835 -7.869 -20.333 1083 HD12 LEU 136 2HD1 LEU 136 3.677 -6.330 -20.131 1084 HD13 LEU 136 3HD1 LEU 136 3.043 -6.789 -21.712 1085 HD21 LEU 136 3HD2 LEU 136 -0.502 -6.232 -20.902 1086 HD22 LEU 136 1HD2 LEU 136 0.310 -7.798 -20.891 1087 HD23 LEU 136 2HD2 LEU 136 0.638 -6.643 -22.184 1088 H GLU 137 H GLU 137 4.301 -4.116 -18.226 1089 HA GLU 137 HA GLU 137 2.808 -1.612 -18.398 1090 HB2 GLU 137 2HB GLU 137 4.986 -0.508 -18.228 1091 HB3 GLU 137 1HB GLU 137 4.760 -1.655 -16.918 1092 HG2 GLU 137 2HG GLU 137 6.229 -2.469 -19.388 1093 HG3 GLU 137 1HG GLU 137 7.038 -1.522 -18.142 1094 H HIS 138 H HIS 138 3.634 -0.018 -20.054 1095 HA HIS 138 HA HIS 138 3.993 -1.392 -22.623 1096 HB2 HIS 138 2HB HIS 138 2.932 1.370 -21.985 1097 HB3 HIS 138 1HB HIS 138 3.265 0.808 -23.620 1098 HD1 HIS 138 HD1 HIS 138 0.449 1.623 -23.113 1099 HD2 HIS 138 HD2 HIS 138 1.810 -2.236 -22.342 1100 HE1 HIS 138 HE1 HIS 138 -1.600 0.160 -23.118 1101 HE2 HIS 138 HE2 HIS 138 -0.760 -2.176 -22.661 1102 H HIS 139 H HIS 139 5.125 0.416 -24.195 1103 HA HIS 139 HA HIS 139 7.119 1.292 -24.825 1104 HB2 HIS 139 2HB HIS 139 7.466 1.845 -21.868 1105 HB3 HIS 139 1HB HIS 139 8.613 2.353 -23.102 1106 HD1 HIS 139 HD1 HIS 139 8.270 4.630 -23.965 1107 HD2 HIS 139 HD2 HIS 139 4.774 3.025 -22.386 1108 HE1 HIS 139 HE1 HIS 139 6.573 6.483 -24.047 1109 HE2 HIS 139 HE2 HIS 139 4.416 5.430 -23.267 1110 H HIS 140 H HIS 140 7.018 -1.269 -24.946 1111 HA HIS 140 HA HIS 140 8.887 -2.732 -23.401 1112 HB2 HIS 140 2HB HIS 140 7.104 -3.827 -24.722 1113 HB3 HIS 140 1HB HIS 140 7.876 -3.285 -26.206 1114 HD1 HIS 140 HD1 HIS 140 8.925 -5.238 -27.293 1115 HD2 HIS 140 HD2 HIS 140 9.397 -5.331 -23.157 1116 HE1 HIS 140 HE1 HIS 140 10.304 -7.287 -26.810 1117 HE2 HIS 140 HE2 HIS 140 10.757 -7.199 -24.333 1118 H HIS 141 H HIS 141 9.158 -0.626 -26.135 1119 HA HIS 141 HA HIS 141 11.872 -1.317 -26.773 1120 HB2 HIS 141 2HB HIS 141 10.252 -0.149 -28.338 1121 HB3 HIS 141 1HB HIS 141 10.447 1.292 -27.348 1122 HD1 HIS 141 HD1 HIS 141 12.994 2.263 -27.267 1123 HD2 HIS 141 HD2 HIS 141 12.101 -0.453 -30.288 1124 HE1 HIS 141 HE1 HIS 141 14.779 2.568 -29.005 1125 HE2 HIS 141 HE2 HIS 141 14.094 1.067 -30.910 1126 H HIS 142 H HIS 142 13.551 -0.881 -25.507 1127 HA HIS 142 HA HIS 142 13.328 0.645 -23.142 1128 HB2 HIS 142 2HB HIS 142 15.692 -0.491 -24.623 1129 HB3 HIS 142 1HB HIS 142 15.895 0.463 -23.158 1130 HD1 HIS 142 HD1 HIS 142 16.244 -1.022 -21.215 1131 HD2 HIS 142 HD2 HIS 142 13.572 -2.657 -23.956 1132 HE1 HIS 142 HE1 HIS 142 15.501 -3.210 -20.223 1133 HE2 HIS 142 HE2 HIS 142 13.719 -4.063 -21.790 1134 H HIS 143 H HIS 143 14.756 2.529 -22.599 1135 HA HIS 143 HA HIS 143 14.036 4.588 -24.487 1136 HB2 HIS 143 2HB HIS 143 15.390 4.781 -21.786 1137 HB3 HIS 143 1HB HIS 143 14.796 6.145 -22.725 1138 HD1 HIS 143 HD1 HIS 143 12.073 5.957 -23.245 1139 HD2 HIS 143 HD2 HIS 143 13.588 3.860 -19.990 1140 HE1 HIS 143 HE1 HIS 143 10.097 5.463 -21.777 1141 HE2 HIS 143 HE2 HIS 143 11.070 4.400 -19.713 Start of MODEL 6 1 H1 MET 1 1H MET 1 -10.756 4.196 -16.233 2 H2 MET 1 2H MET 1 -11.774 5.502 -16.601 3 H3 MET 1 3H MET 1 -12.438 4.013 -16.131 4 HA MET 1 HA MET 1 -10.827 5.850 -14.464 5 HB2 MET 1 2HB MET 1 -12.885 5.984 -13.097 6 HB3 MET 1 1HB MET 1 -13.103 6.620 -14.718 7 HG2 MET 1 2HG MET 1 -14.278 4.641 -15.399 8 HG3 MET 1 1HG MET 1 -13.937 3.863 -13.856 9 HE1 MET 1 3HE MET 1 -16.683 7.555 -14.261 10 HE2 MET 1 1HE MET 1 -15.853 6.813 -15.630 11 HE3 MET 1 2HE MET 1 -14.926 7.636 -14.375 12 HA PRO 2 HA PRO 2 -10.109 2.089 -12.130 13 HB2 PRO 2 2HB PRO 2 -7.898 2.936 -10.890 14 HB3 PRO 2 1HB PRO 2 -7.877 2.536 -12.610 15 HG2 PRO 2 2HG PRO 2 -7.823 5.186 -11.284 16 HG3 PRO 2 1HG PRO 2 -7.144 4.693 -12.844 17 HD2 PRO 2 2HD PRO 2 -9.615 6.037 -12.367 18 HD3 PRO 2 1HD PRO 2 -8.988 5.445 -13.917 19 H VAL 3 H VAL 3 -9.673 1.752 -9.686 20 HA VAL 3 HA VAL 3 -11.544 3.301 -8.176 21 HB VAL 3 HB VAL 3 -9.494 1.372 -7.066 22 HG11 VAL 3 1HG1 VAL 3 -10.606 2.806 -5.422 23 HG12 VAL 3 2HG1 VAL 3 -11.080 1.119 -5.237 24 HG13 VAL 3 3HG1 VAL 3 -12.179 2.261 -6.012 25 HG21 VAL 3 3HG2 VAL 3 -12.280 0.772 -8.064 26 HG22 VAL 3 1HG2 VAL 3 -11.210 -0.360 -7.239 27 HG23 VAL 3 2HG2 VAL 3 -10.773 0.265 -8.829 28 H GLU 4 H GLU 4 -10.993 5.366 -7.913 29 HA GLU 4 HA GLU 4 -8.467 5.995 -6.575 30 HB2 GLU 4 2HB GLU 4 -8.048 6.352 -8.954 31 HB3 GLU 4 1HB GLU 4 -9.507 7.319 -9.094 32 HG2 GLU 4 2HG GLU 4 -8.519 9.002 -7.611 33 HG3 GLU 4 1HG GLU 4 -7.050 8.030 -7.511 34 H LEU 5 H LEU 5 -8.671 7.624 -5.073 35 HA LEU 5 HA LEU 5 -11.362 8.567 -4.543 36 HB2 LEU 5 2HB LEU 5 -9.860 7.858 -2.691 37 HB3 LEU 5 1HB LEU 5 -8.787 9.189 -3.085 38 HG LEU 5 HG LEU 5 -10.640 10.777 -2.572 39 HD11 LEU 5 1HD1 LEU 5 -12.520 9.280 -2.958 40 HD12 LEU 5 2HD1 LEU 5 -12.578 9.963 -1.332 41 HD13 LEU 5 3HD1 LEU 5 -12.036 8.302 -1.572 42 HD21 LEU 5 3HD2 LEU 5 -10.481 10.568 -0.156 43 HD22 LEU 5 1HD2 LEU 5 -8.919 10.252 -0.913 44 HD23 LEU 5 2HD2 LEU 5 -9.901 8.910 -0.324 45 H ARG 6 H ARG 6 -12.145 10.441 -5.232 46 HA ARG 6 HA ARG 6 -10.461 12.159 -6.819 47 HB2 ARG 6 2HB ARG 6 -13.359 12.546 -6.038 48 HB3 ARG 6 1HB ARG 6 -12.501 13.372 -7.334 49 HG2 ARG 6 2HG ARG 6 -12.200 11.194 -8.469 50 HG3 ARG 6 1HG ARG 6 -13.174 10.438 -7.208 51 HD2 ARG 6 2HD ARG 6 -14.059 12.587 -9.128 52 HD3 ARG 6 1HD ARG 6 -14.536 10.892 -9.157 53 HE ARG 6 HE ARG 6 -15.178 12.156 -6.676 54 HH11 ARG 6 1HH1 ARG 6 -16.236 11.654 -9.972 55 HH12 ARG 6 2HH1 ARG 6 -17.906 11.988 -9.626 56 HH21 ARG 6 1HH2 ARG 6 -17.400 12.610 -6.214 57 HH22 ARG 6 2HH2 ARG 6 -18.566 12.540 -7.498 58 H ALA 7 H ALA 7 -10.012 14.347 -6.436 59 HA ALA 7 HA ALA 7 -9.444 15.132 -3.815 60 HB1 ALA 7 3HB ALA 7 -9.964 16.957 -6.163 61 HB2 ALA 7 1HB ALA 7 -8.435 16.138 -5.839 62 HB3 ALA 7 2HB ALA 7 -9.046 17.343 -4.707 63 H ASN 8 H ASN 8 -12.105 16.172 -5.930 64 HA ASN 8 HA ASN 8 -13.685 16.946 -3.601 65 HB2 ASN 8 2HB ASN 8 -14.370 17.019 -6.555 66 HB3 ASN 8 1HB ASN 8 -15.400 17.620 -5.263 67 HD21 ASN 8 1HD2 ASN 8 -14.245 18.993 -7.553 68 HD22 ASN 8 2HD2 ASN 8 -13.311 20.307 -6.910 69 H TRP 9 H TRP 9 -13.787 14.848 -2.701 70 HA TRP 9 HA TRP 9 -14.948 12.726 -4.292 71 HB2 TRP 9 2HB TRP 9 -14.555 11.318 -2.278 72 HB3 TRP 9 1HB TRP 9 -13.099 12.099 -2.881 73 HD1 TRP 9 HD1 TRP 9 -11.868 13.786 -1.284 74 HE1 TRP 9 HE1 TRP 9 -12.168 14.404 1.196 75 HE3 TRP 9 HE3 TRP 9 -16.410 11.596 -0.439 76 HZ2 TRP 9 HZ2 TRP 9 -14.082 14.020 3.237 77 HZ3 TRP 9 HZ3 TRP 9 -17.408 11.769 1.804 78 HH2 TRP 9 HH2 TRP 9 -16.265 12.956 3.603 79 H SER 10 H SER 10 -16.746 11.517 -3.638 80 HA SER 10 HA SER 10 -18.691 12.986 -1.997 81 HB2 SER 10 2HB SER 10 -19.389 10.985 -4.145 82 HB3 SER 10 1HB SER 10 -20.419 12.222 -3.422 83 HG SER 10 HG SER 10 -19.635 13.668 -4.755 84 H GLU 11 H GLU 11 -20.355 11.434 -1.010 85 HA GLU 11 HA GLU 11 -19.122 9.621 0.685 86 HB2 GLU 11 2HB GLU 11 -22.014 9.543 -0.207 87 HB3 GLU 11 1HB GLU 11 -21.359 8.811 1.249 88 HG2 GLU 11 2HG GLU 11 -22.287 10.720 2.092 89 HG3 GLU 11 1HG GLU 11 -20.630 11.249 1.811 90 H GLU 12 H GLU 12 -20.908 8.982 -2.315 91 HA GLU 12 HA GLU 12 -20.586 6.172 -2.253 92 HB2 GLU 12 2HB GLU 12 -22.312 7.271 -3.586 93 HB3 GLU 12 1HB GLU 12 -21.082 8.035 -4.583 94 HG2 GLU 12 2HG GLU 12 -20.362 5.829 -5.368 95 HG3 GLU 12 1HG GLU 12 -21.623 5.080 -4.387 96 H ASP 13 H ASP 13 -18.623 8.770 -3.526 97 HA ASP 13 HA ASP 13 -16.863 7.203 -5.098 98 HB2 ASP 13 2HB ASP 13 -17.126 9.683 -5.286 99 HB3 ASP 13 1HB ASP 13 -16.306 9.843 -3.737 100 H LEU 14 H LEU 14 -16.541 8.604 -1.848 101 HA LEU 14 HA LEU 14 -14.124 7.400 -1.127 102 HB2 LEU 14 2HB LEU 14 -15.188 9.213 0.141 103 HB3 LEU 14 1HB LEU 14 -16.482 8.131 0.615 104 HG LEU 14 HG LEU 14 -14.793 6.742 1.830 105 HD11 LEU 14 1HD1 LEU 14 -12.979 9.074 1.233 106 HD12 LEU 14 2HD1 LEU 14 -12.805 7.433 0.606 107 HD13 LEU 14 3HD1 LEU 14 -12.625 7.743 2.334 108 HD21 LEU 14 3HD2 LEU 14 -14.572 8.307 3.710 109 HD22 LEU 14 1HD2 LEU 14 -16.190 8.333 3.008 110 HD23 LEU 14 2HD2 LEU 14 -15.054 9.631 2.647 111 H GLU 15 H GLU 15 -17.454 6.277 -0.793 112 HA GLU 15 HA GLU 15 -17.013 3.915 0.609 113 HB2 GLU 15 2HB GLU 15 -19.242 4.849 0.207 114 HB3 GLU 15 1HB GLU 15 -19.087 4.507 -1.511 115 HG2 GLU 15 2HG GLU 15 -19.047 2.134 -1.068 116 HG3 GLU 15 1HG GLU 15 -19.103 2.436 0.668 117 H THR 16 H THR 16 -17.018 4.515 -2.885 118 HA THR 16 HA THR 16 -16.636 1.903 -3.766 119 HB THR 16 HB THR 16 -15.629 4.470 -5.012 120 HG1 THR 16 HG1 THR 16 -17.871 4.494 -4.796 121 HG21 THR 16 3HG2 THR 16 -16.070 1.746 -6.247 122 HG22 THR 16 1HG2 THR 16 -14.507 2.513 -5.965 123 HG23 THR 16 2HG2 THR 16 -15.637 3.215 -7.123 124 H VAL 17 H VAL 17 -14.261 4.346 -2.818 125 HA VAL 17 HA VAL 17 -11.967 2.885 -3.558 126 HB VAL 17 HB VAL 17 -12.236 5.014 -1.429 127 HG11 VAL 17 1HG1 VAL 17 -10.170 3.758 -1.167 128 HG12 VAL 17 2HG1 VAL 17 -9.829 5.375 -1.782 129 HG13 VAL 17 3HG1 VAL 17 -9.791 3.990 -2.872 130 HG21 VAL 17 3HG2 VAL 17 -11.484 6.561 -3.168 131 HG22 VAL 17 1HG2 VAL 17 -13.004 5.780 -3.612 132 HG23 VAL 17 2HG2 VAL 17 -11.490 5.245 -4.342 133 H ILE 18 H ILE 18 -13.403 3.381 -0.319 134 HA ILE 18 HA ILE 18 -11.522 1.697 0.955 135 HB ILE 18 HB ILE 18 -12.999 1.806 2.932 136 HG12 ILE 18 2HG1 ILE 18 -14.819 3.415 1.123 137 HG13 ILE 18 1HG1 ILE 18 -15.168 1.806 1.742 138 HG21 ILE 18 1HG2 ILE 18 -12.540 4.439 1.534 139 HG22 ILE 18 2HG2 ILE 18 -11.368 3.561 2.516 140 HG23 ILE 18 3HG2 ILE 18 -12.820 4.230 3.262 141 HD11 ILE 18 3HD1 ILE 18 -15.188 2.678 4.012 142 HD12 ILE 18 1HD1 ILE 18 -16.347 3.526 2.989 143 HD13 ILE 18 2HD1 ILE 18 -14.811 4.288 3.399 144 H ARG 19 H ARG 19 -14.703 1.074 -0.413 145 HA ARG 19 HA ARG 19 -15.067 -1.467 0.800 146 HB2 ARG 19 2HB ARG 19 -16.929 -0.144 -0.126 147 HB3 ARG 19 1HB ARG 19 -16.282 -0.367 -1.744 148 HG2 ARG 19 2HG ARG 19 -16.795 -2.658 -1.752 149 HG3 ARG 19 1HG ARG 19 -17.060 -2.686 -0.008 150 HD2 ARG 19 2HD ARG 19 -19.176 -2.764 -1.220 151 HD3 ARG 19 1HD ARG 19 -19.039 -1.286 -0.271 152 HE ARG 19 HE ARG 19 -18.193 -0.995 -3.013 153 HH11 ARG 19 1HH1 ARG 19 -20.916 -0.896 -0.807 154 HH12 ARG 19 2HH1 ARG 19 -21.875 0.127 -1.825 155 HH21 ARG 19 1HH2 ARG 19 -19.463 0.356 -4.362 156 HH22 ARG 19 2HH2 ARG 19 -21.064 0.819 -3.858 157 H ALA 20 H ALA 20 -13.607 -0.403 -2.229 158 HA ALA 20 HA ALA 20 -13.276 -2.992 -3.342 159 HB1 ALA 20 3HB ALA 20 -13.220 -0.971 -4.706 160 HB2 ALA 20 1HB ALA 20 -11.745 -1.916 -4.908 161 HB3 ALA 20 2HB ALA 20 -11.732 -0.464 -3.906 162 H VAL 21 H VAL 21 -11.320 -0.999 -1.209 163 HA VAL 21 HA VAL 21 -8.938 -2.516 -1.368 164 HB VAL 21 HB VAL 21 -9.935 -0.773 0.896 165 HG11 VAL 21 1HG1 VAL 21 -7.577 -0.667 1.586 166 HG12 VAL 21 2HG1 VAL 21 -7.177 -1.861 0.350 167 HG13 VAL 21 3HG1 VAL 21 -8.229 -2.303 1.694 168 HG21 VAL 21 3HG2 VAL 21 -9.697 0.452 -1.187 169 HG22 VAL 21 1HG2 VAL 21 -8.065 -0.185 -1.395 170 HG23 VAL 21 2HG2 VAL 21 -8.420 0.911 -0.060 171 H TYR 22 H TYR 22 -11.739 -2.704 0.809 172 HA TYR 22 HA TYR 22 -10.584 -4.857 2.331 173 HB2 TYR 22 2HB TYR 22 -13.365 -3.683 2.292 174 HB3 TYR 22 1HB TYR 22 -12.882 -4.999 3.354 175 HD1 TYR 22 HD1 TYR 22 -10.467 -4.370 4.562 176 HD2 TYR 22 HD2 TYR 22 -13.501 -1.649 3.346 177 HE1 TYR 22 HE1 TYR 22 -9.681 -2.754 6.235 178 HE2 TYR 22 HE2 TYR 22 -12.716 -0.024 5.016 179 HH TYR 22 HH TYR 22 -9.758 -0.318 6.614 180 H ARG 23 H ARG 23 -13.512 -4.665 0.296 181 HA ARG 23 HA ARG 23 -13.079 -7.419 -0.551 182 HB2 ARG 23 2HB ARG 23 -15.392 -6.494 1.126 183 HB3 ARG 23 1HB ARG 23 -15.568 -7.846 0.020 184 HG2 ARG 23 2HG ARG 23 -13.508 -7.718 2.206 185 HG3 ARG 23 1HG ARG 23 -15.087 -8.495 2.365 186 HD2 ARG 23 2HD ARG 23 -12.898 -9.223 0.419 187 HD3 ARG 23 1HD ARG 23 -13.405 -10.149 1.832 188 HE ARG 23 HE ARG 23 -15.365 -9.629 -0.281 189 HH11 ARG 23 1HH1 ARG 23 -13.312 -11.890 1.431 190 HH12 ARG 23 2HH1 ARG 23 -14.091 -13.292 0.766 191 HH21 ARG 23 1HH2 ARG 23 -16.395 -11.478 -1.152 192 HH22 ARG 23 2HH2 ARG 23 -15.842 -13.058 -0.687 193 H GLN 24 H GLN 24 -12.962 -6.865 -2.696 194 HA GLN 24 HA GLN 24 -14.918 -5.252 -3.975 195 HB2 GLN 24 2HB GLN 24 -14.036 -6.278 -6.088 196 HB3 GLN 24 1HB GLN 24 -12.813 -5.514 -5.086 197 HG2 GLN 24 2HG GLN 24 -12.121 -7.700 -4.251 198 HG3 GLN 24 1HG GLN 24 -13.362 -8.473 -5.238 199 HE21 GLN 24 1HE2 GLN 24 -10.459 -8.819 -5.276 200 HE22 GLN 24 2HE2 GLN 24 -9.965 -8.441 -6.894 201 H VAL 25 H VAL 25 -16.964 -5.745 -4.081 202 HA VAL 25 HA VAL 25 -18.922 -6.864 -4.199 203 HB VAL 25 HB VAL 25 -17.272 -9.187 -5.217 204 HG11 VAL 25 1HG1 VAL 25 -19.395 -10.122 -5.989 205 HG12 VAL 25 2HG1 VAL 25 -20.264 -8.786 -5.233 206 HG13 VAL 25 3HG1 VAL 25 -19.381 -9.942 -4.235 207 HG21 VAL 25 3HG2 VAL 25 -18.127 -8.534 -7.414 208 HG22 VAL 25 1HG2 VAL 25 -17.205 -7.225 -6.676 209 HG23 VAL 25 2HG2 VAL 25 -18.968 -7.167 -6.686 210 H LEU 26 H LEU 26 -19.371 -6.804 -2.082 211 HA LEU 26 HA LEU 26 -18.707 -9.220 -0.532 212 HB2 LEU 26 2HB LEU 26 -18.971 -7.706 1.501 213 HB3 LEU 26 1HB LEU 26 -17.516 -7.522 0.549 214 HG LEU 26 HG LEU 26 -18.667 -5.548 -0.579 215 HD11 LEU 26 1HD1 LEU 26 -20.509 -5.858 1.784 216 HD12 LEU 26 2HD1 LEU 26 -20.953 -6.003 0.084 217 HD13 LEU 26 3HD1 LEU 26 -20.428 -4.447 0.730 218 HD21 LEU 26 3HD2 LEU 26 -16.875 -5.310 1.056 219 HD22 LEU 26 1HD2 LEU 26 -18.057 -5.376 2.364 220 HD23 LEU 26 2HD2 LEU 26 -18.077 -4.029 1.225 221 H GLY 27 H GLY 27 -21.027 -7.962 -2.239 222 HA2 GLY 27 2HA GLY 27 -23.210 -9.022 -2.129 223 HA3 GLY 27 1HA GLY 27 -23.137 -8.849 -0.380 224 H ASN 28 H ASN 28 -25.153 -7.930 -2.305 225 HA ASN 28 HA ASN 28 -25.092 -5.075 -1.568 226 HB2 ASN 28 2HB ASN 28 -26.301 -4.538 -3.635 227 HB3 ASN 28 1HB ASN 28 -24.757 -5.300 -3.994 228 HD21 ASN 28 1HD2 ASN 28 -24.720 -7.275 -5.000 229 HD22 ASN 28 2HD2 ASN 28 -26.136 -8.042 -5.637 230 H ASP 29 H ASP 29 -26.668 -8.040 -1.326 231 HA ASP 29 HA ASP 29 -29.349 -6.949 -1.109 232 HB2 ASP 29 2HB ASP 29 -30.104 -9.201 -0.890 233 HB3 ASP 29 1HB ASP 29 -28.861 -9.197 -2.134 234 H TYR 30 H TYR 30 -26.722 -7.755 0.976 235 HA TYR 30 HA TYR 30 -28.418 -7.079 3.272 236 HB2 TYR 30 2HB TYR 30 -28.086 -9.581 3.080 237 HB3 TYR 30 1HB TYR 30 -26.373 -9.298 3.372 238 HD1 TYR 30 HD1 TYR 30 -29.738 -9.142 4.840 239 HD2 TYR 30 HD2 TYR 30 -25.565 -8.759 5.575 240 HE1 TYR 30 HE1 TYR 30 -30.167 -9.182 7.257 241 HE2 TYR 30 HE2 TYR 30 -25.984 -8.796 7.998 242 HH TYR 30 HH TYR 30 -27.936 -8.219 9.530 243 H VAL 31 H VAL 31 -25.072 -7.743 2.283 244 HA VAL 31 HA VAL 31 -23.143 -6.575 2.561 245 HB VAL 31 HB VAL 31 -24.906 -4.314 3.526 246 HG11 VAL 31 1HG1 VAL 31 -22.018 -4.298 2.648 247 HG12 VAL 31 2HG1 VAL 31 -22.611 -4.043 4.289 248 HG13 VAL 31 3HG1 VAL 31 -22.984 -2.872 3.024 249 HG21 VAL 31 3HG2 VAL 31 -23.722 -4.853 0.805 250 HG22 VAL 31 1HG2 VAL 31 -24.615 -3.406 1.269 251 HG23 VAL 31 2HG2 VAL 31 -25.426 -4.972 1.242 252 H MET 32 H MET 32 -21.856 -7.347 4.092 253 HA MET 32 HA MET 32 -22.644 -7.180 6.898 254 HB2 MET 32 2HB MET 32 -20.437 -8.645 5.460 255 HB3 MET 32 1HB MET 32 -20.468 -8.507 7.213 256 HG2 MET 32 2HG MET 32 -22.631 -9.736 5.521 257 HG3 MET 32 1HG MET 32 -21.404 -10.625 6.424 258 HE1 MET 32 3HE MET 32 -23.249 -12.053 7.666 259 HE2 MET 32 1HE MET 32 -24.497 -11.216 6.744 260 HE3 MET 32 2HE MET 32 -24.639 -11.350 8.496 261 H ALA 33 H ALA 33 -21.796 -5.785 8.308 262 HA ALA 33 HA ALA 33 -20.127 -3.675 7.291 263 HB1 ALA 33 3HB ALA 33 -21.172 -4.116 10.082 264 HB2 ALA 33 1HB ALA 33 -21.988 -3.206 8.811 265 HB3 ALA 33 2HB ALA 33 -20.452 -2.632 9.461 266 H SER 34 H SER 34 -19.797 -5.598 10.274 267 HA SER 34 HA SER 34 -17.998 -6.301 11.450 268 HB2 SER 34 2HB SER 34 -17.575 -7.634 9.367 269 HB3 SER 34 1HB SER 34 -16.527 -6.336 8.800 270 HG SER 34 HG SER 34 -16.157 -7.756 11.237 271 H GLU 35 H GLU 35 -17.716 -4.474 12.651 272 HA GLU 35 HA GLU 35 -16.331 -2.160 11.673 273 HB2 GLU 35 2HB GLU 35 -17.022 -2.907 14.523 274 HB3 GLU 35 1HB GLU 35 -16.578 -1.309 13.940 275 HG2 GLU 35 2HG GLU 35 -19.042 -2.830 13.120 276 HG3 GLU 35 1HG GLU 35 -18.987 -1.552 14.331 277 H ARG 36 H ARG 36 -14.231 -2.354 11.218 278 HA ARG 36 HA ARG 36 -12.502 -3.679 13.210 279 HB2 ARG 36 2HB ARG 36 -12.274 -3.695 10.196 280 HB3 ARG 36 1HB ARG 36 -11.036 -4.305 11.284 281 HG2 ARG 36 2HG ARG 36 -12.425 -6.063 12.031 282 HG3 ARG 36 1HG ARG 36 -13.851 -5.350 11.275 283 HD2 ARG 36 2HD ARG 36 -12.878 -7.291 10.041 284 HD3 ARG 36 1HD ARG 36 -13.020 -5.812 9.090 285 HE ARG 36 HE ARG 36 -10.477 -5.781 10.149 286 HH11 ARG 36 1HH1 ARG 36 -12.307 -7.921 8.085 287 HH12 ARG 36 2HH1 ARG 36 -10.922 -8.466 7.192 288 HH21 ARG 36 1HH2 ARG 36 -8.644 -6.457 8.985 289 HH22 ARG 36 2HH2 ARG 36 -8.818 -7.638 7.713 290 H LEU 37 H LEU 37 -11.813 -1.810 10.276 291 HA LEU 37 HA LEU 37 -10.032 -0.111 11.871 292 HB2 LEU 37 2HB LEU 37 -10.210 -0.527 8.882 293 HB3 LEU 37 1HB LEU 37 -9.051 0.515 9.686 294 HG LEU 37 HG LEU 37 -9.217 -2.479 10.042 295 HD11 LEU 37 1HD1 LEU 37 -8.489 -1.866 7.797 296 HD12 LEU 37 2HD1 LEU 37 -7.158 -2.543 8.737 297 HD13 LEU 37 3HD1 LEU 37 -7.261 -0.801 8.481 298 HD21 LEU 37 3HD2 LEU 37 -7.163 -0.482 10.987 299 HD22 LEU 37 1HD2 LEU 37 -7.081 -2.231 11.189 300 HD23 LEU 37 2HD2 LEU 37 -8.343 -1.308 12.006 301 H VAL 38 H VAL 38 -12.649 0.449 12.257 302 HA VAL 38 HA VAL 38 -13.850 2.274 10.513 303 HB VAL 38 HB VAL 38 -15.174 3.037 12.460 304 HG11 VAL 38 1HG1 VAL 38 -14.831 0.046 12.307 305 HG12 VAL 38 2HG1 VAL 38 -15.799 1.028 11.209 306 HG13 VAL 38 3HG1 VAL 38 -16.251 0.902 12.909 307 HG21 VAL 38 3HG2 VAL 38 -14.836 2.003 14.651 308 HG22 VAL 38 1HG2 VAL 38 -13.422 2.941 14.165 309 HG23 VAL 38 2HG2 VAL 38 -13.397 1.182 14.045 310 H SER 39 H SER 39 -11.329 2.689 12.863 311 HA SER 39 HA SER 39 -11.354 5.487 13.072 312 HB2 SER 39 2HB SER 39 -8.849 5.058 13.598 313 HB3 SER 39 1HB SER 39 -10.062 4.346 14.663 314 HG SER 39 HG SER 39 -8.329 2.900 13.923 315 H ALA 40 H ALA 40 -9.523 3.307 10.961 316 HA ALA 40 HA ALA 40 -8.053 5.266 9.606 317 HB1 ALA 40 3HB ALA 40 -7.553 3.532 7.977 318 HB2 ALA 40 1HB ALA 40 -8.865 2.539 8.611 319 HB3 ALA 40 2HB ALA 40 -7.460 2.890 9.616 320 H GLU 41 H GLU 41 -11.157 3.721 8.759 321 HA GLU 41 HA GLU 41 -11.310 5.014 6.236 322 HB2 GLU 41 2HB GLU 41 -13.625 4.195 6.152 323 HB3 GLU 41 1HB GLU 41 -12.497 2.934 6.619 324 HG2 GLU 41 2HG GLU 41 -14.074 2.499 8.154 325 HG3 GLU 41 1HG GLU 41 -13.248 3.776 9.047 326 H SER 42 H SER 42 -12.273 5.941 9.460 327 HA SER 42 HA SER 42 -13.793 8.218 8.608 328 HB2 SER 42 2HB SER 42 -12.521 7.614 11.289 329 HB3 SER 42 1HB SER 42 -13.671 8.911 10.977 330 HG SER 42 HG SER 42 -14.491 6.387 10.167 331 H LEU 43 H LEU 43 -10.463 7.647 9.667 332 HA LEU 43 HA LEU 43 -9.610 10.325 9.674 333 HB2 LEU 43 2HB LEU 43 -8.002 7.843 9.078 334 HB3 LEU 43 1HB LEU 43 -7.330 9.419 9.453 335 HG LEU 43 HG LEU 43 -8.956 7.691 11.319 336 HD11 LEU 43 1HD1 LEU 43 -6.888 7.484 12.573 337 HD12 LEU 43 2HD1 LEU 43 -6.041 8.456 11.369 338 HD13 LEU 43 3HD1 LEU 43 -6.684 6.873 10.931 339 HD21 LEU 43 3HD2 LEU 43 -9.401 10.039 11.732 340 HD22 LEU 43 1HD2 LEU 43 -7.672 10.378 11.776 341 HD23 LEU 43 2HD2 LEU 43 -8.402 9.365 13.020 342 H LEU 44 H LEU 44 -9.714 7.906 7.109 343 HA LEU 44 HA LEU 44 -8.472 9.462 5.106 344 HB2 LEU 44 2HB LEU 44 -8.819 7.024 4.959 345 HB3 LEU 44 1HB LEU 44 -10.546 7.287 4.818 346 HG LEU 44 HG LEU 44 -10.176 8.476 2.682 347 HD11 LEU 44 1HD1 LEU 44 -7.990 8.345 1.596 348 HD12 LEU 44 2HD1 LEU 44 -7.306 7.633 3.057 349 HD13 LEU 44 3HD1 LEU 44 -7.916 9.288 3.084 350 HD21 LEU 44 3HD2 LEU 44 -9.003 5.701 2.841 351 HD22 LEU 44 1HD2 LEU 44 -9.553 6.491 1.363 352 HD23 LEU 44 2HD2 LEU 44 -10.706 6.113 2.642 353 H ARG 45 H ARG 45 -11.852 9.069 6.077 354 HA ARG 45 HA ARG 45 -13.049 10.674 4.124 355 HB2 ARG 45 2HB ARG 45 -14.266 9.220 5.746 356 HB3 ARG 45 1HB ARG 45 -13.905 10.385 7.013 357 HG2 ARG 45 2HG ARG 45 -15.074 12.082 5.446 358 HG3 ARG 45 1HG ARG 45 -15.745 10.643 4.674 359 HD2 ARG 45 2HD ARG 45 -17.304 11.404 6.321 360 HD3 ARG 45 1HD ARG 45 -16.568 9.912 6.906 361 HE ARG 45 HE ARG 45 -15.005 11.816 8.009 362 HH11 ARG 45 1HH1 ARG 45 -18.481 11.365 7.937 363 HH12 ARG 45 2HH1 ARG 45 -18.732 12.136 9.477 364 HH21 ARG 45 1HH2 ARG 45 -15.336 12.859 10.001 365 HH22 ARG 45 2HH2 ARG 45 -16.950 13.010 10.635 366 H ASN 46 H ASN 46 -11.596 11.507 7.237 367 HA ASN 46 HA ASN 46 -12.372 14.273 7.051 368 HB2 ASN 46 2HB ASN 46 -10.419 12.943 8.946 369 HB3 ASN 46 1HB ASN 46 -11.068 14.570 9.112 370 HD21 ASN 46 1HD2 ASN 46 -11.237 12.407 10.979 371 HD22 ASN 46 2HD2 ASN 46 -12.916 12.067 11.227 372 H GLY 47 H GLY 47 -10.070 12.528 5.483 373 HA2 GLY 47 2HA GLY 47 -8.321 13.164 4.137 374 HA3 GLY 47 1HA GLY 47 -8.726 14.835 4.502 375 H LYS 48 H LYS 48 -8.026 12.545 7.026 376 HA LYS 48 HA LYS 48 -5.797 14.212 7.860 377 HB2 LYS 48 2HB LYS 48 -7.549 13.427 9.469 378 HB3 LYS 48 1HB LYS 48 -6.974 11.786 9.229 379 HG2 LYS 48 2HG LYS 48 -4.862 12.303 10.198 380 HG3 LYS 48 1HG LYS 48 -5.250 14.023 10.259 381 HD2 LYS 48 2HD LYS 48 -6.633 11.824 11.793 382 HD3 LYS 48 1HD LYS 48 -5.510 13.010 12.454 383 HE2 LYS 48 2HE LYS 48 -8.165 13.645 11.168 384 HE3 LYS 48 1HE LYS 48 -7.865 13.583 12.904 385 HZ1 LYS 48 3HZ LYS 48 -6.484 15.427 11.023 386 HZ2 LYS 48 1HZ LYS 48 -6.348 15.414 12.713 387 HZ3 LYS 48 2HZ LYS 48 -7.815 15.850 11.978 388 H ILE 49 H ILE 49 -6.426 11.060 6.537 389 HA ILE 49 HA ILE 49 -3.520 10.648 6.324 390 HB ILE 49 HB ILE 49 -3.873 8.222 6.343 391 HG12 ILE 49 2HG1 ILE 49 -6.736 8.845 7.095 392 HG13 ILE 49 1HG1 ILE 49 -6.220 8.264 5.515 393 HG21 ILE 49 1HG2 ILE 49 -4.988 9.635 8.762 394 HG22 ILE 49 2HG2 ILE 49 -3.291 9.293 8.426 395 HG23 ILE 49 3HG2 ILE 49 -4.414 7.968 8.737 396 HD11 ILE 49 3HD1 ILE 49 -5.935 6.786 8.123 397 HD12 ILE 49 1HD1 ILE 49 -5.412 6.203 6.542 398 HD13 ILE 49 2HD1 ILE 49 -7.126 6.463 6.863 399 H THR 50 H THR 50 -2.869 9.472 4.386 400 HA THR 50 HA THR 50 -4.539 10.198 2.122 401 HB THR 50 HB THR 50 -2.480 9.408 0.826 402 HG1 THR 50 HG1 THR 50 -0.588 9.187 2.038 403 HG21 THR 50 3HG2 THR 50 -2.216 11.704 2.772 404 HG22 THR 50 1HG2 THR 50 -2.974 11.767 1.181 405 HG23 THR 50 2HG2 THR 50 -1.240 11.480 1.321 406 H VAL 51 H VAL 51 -4.168 8.451 0.200 407 HA VAL 51 HA VAL 51 -5.738 6.228 1.101 408 HB VAL 51 HB VAL 51 -4.517 6.739 -1.621 409 HG11 VAL 51 1HG1 VAL 51 -6.165 5.110 -2.438 410 HG12 VAL 51 2HG1 VAL 51 -6.649 4.778 -0.775 411 HG13 VAL 51 3HG1 VAL 51 -5.019 4.377 -1.315 412 HG21 VAL 51 3HG2 VAL 51 -6.773 7.475 -2.242 413 HG22 VAL 51 1HG2 VAL 51 -6.094 8.476 -0.960 414 HG23 VAL 51 2HG2 VAL 51 -7.301 7.248 -0.574 415 H ARG 52 H ARG 52 -2.373 6.751 0.229 416 HA ARG 52 HA ARG 52 -1.591 4.033 0.215 417 HB2 ARG 52 2HB ARG 52 -0.270 6.138 -0.532 418 HB3 ARG 52 1HB ARG 52 0.214 6.247 1.155 419 HG2 ARG 52 2HG ARG 52 1.919 5.093 -0.055 420 HG3 ARG 52 1HG ARG 52 1.098 3.931 0.992 421 HD2 ARG 52 2HD ARG 52 1.408 2.901 -1.146 422 HD3 ARG 52 1HD ARG 52 -0.307 3.273 -0.967 423 HE ARG 52 HE ARG 52 1.556 4.939 -2.533 424 HH11 ARG 52 1HH1 ARG 52 -1.572 3.416 -2.116 425 HH12 ARG 52 2HH1 ARG 52 -2.220 4.038 -3.599 426 HH21 ARG 52 1HH2 ARG 52 0.714 5.752 -4.491 427 HH22 ARG 52 2HH2 ARG 52 -0.912 5.366 -4.962 428 H GLU 53 H GLU 53 -1.976 6.418 2.757 429 HA GLU 53 HA GLU 53 -0.884 4.905 4.878 430 HB2 GLU 53 2HB GLU 53 -2.892 7.154 4.810 431 HB3 GLU 53 1HB GLU 53 -2.316 6.438 6.309 432 HG2 GLU 53 2HG GLU 53 -0.534 7.699 4.239 433 HG3 GLU 53 1HG GLU 53 -1.145 8.523 5.673 434 H PHE 54 H PHE 54 -4.147 5.200 3.566 435 HA PHE 54 HA PHE 54 -5.480 3.620 5.451 436 HB2 PHE 54 2HB PHE 54 -6.594 5.026 3.722 437 HB3 PHE 54 1HB PHE 54 -6.084 3.874 2.494 438 HD1 PHE 54 HD1 PHE 54 -8.136 4.212 5.564 439 HD2 PHE 54 HD2 PHE 54 -7.375 1.992 2.014 440 HE1 PHE 54 HE1 PHE 54 -10.185 2.909 5.943 441 HE2 PHE 54 HE2 PHE 54 -9.426 0.684 2.389 442 HZ PHE 54 HZ PHE 54 -10.835 1.144 4.354 443 H VAL 55 H VAL 55 -3.850 2.749 2.425 444 HA VAL 55 HA VAL 55 -4.383 -0.013 2.507 445 HB VAL 55 HB VAL 55 -2.002 1.408 1.290 446 HG11 VAL 55 1HG1 VAL 55 -1.813 -0.570 -0.156 447 HG12 VAL 55 2HG1 VAL 55 -3.088 -1.360 0.772 448 HG13 VAL 55 3HG1 VAL 55 -1.553 -0.961 1.545 449 HG21 VAL 55 3HG2 VAL 55 -4.110 2.236 0.414 450 HG22 VAL 55 1HG2 VAL 55 -4.636 0.589 0.071 451 HG23 VAL 55 2HG2 VAL 55 -3.267 1.279 -0.804 452 H ARG 56 H ARG 56 -1.700 1.910 3.809 453 HA ARG 56 HA ARG 56 -0.121 -0.223 4.713 454 HB2 ARG 56 2HB ARG 56 0.739 2.060 4.565 455 HB3 ARG 56 1HB ARG 56 -0.364 2.578 5.830 456 HG2 ARG 56 2HG ARG 56 0.818 1.493 7.493 457 HG3 ARG 56 1HG ARG 56 1.608 0.399 6.362 458 HD2 ARG 56 2HD ARG 56 3.221 1.984 7.166 459 HD3 ARG 56 1HD ARG 56 2.892 2.318 5.470 460 HE ARG 56 HE ARG 56 1.400 4.154 6.332 461 HH11 ARG 56 1HH1 ARG 56 4.163 2.979 8.166 462 HH12 ARG 56 2HH1 ARG 56 4.399 4.495 8.983 463 HH21 ARG 56 1HH2 ARG 56 1.739 6.126 7.388 464 HH22 ARG 56 2HH2 ARG 56 3.014 6.273 8.568 465 H ALA 57 H ALA 57 -2.720 1.570 6.300 466 HA ALA 57 HA ALA 57 -2.489 0.358 8.831 467 HB1 ALA 57 3HB ALA 57 -4.935 1.538 7.521 468 HB2 ALA 57 1HB ALA 57 -3.737 2.422 8.464 469 HB3 ALA 57 2HB ALA 57 -4.743 1.198 9.240 470 H VAL 58 H VAL 58 -4.356 -0.529 5.961 471 HA VAL 58 HA VAL 58 -5.783 -2.648 7.202 472 HB VAL 58 HB VAL 58 -5.193 -2.213 4.266 473 HG11 VAL 58 1HG1 VAL 58 -5.828 -4.529 4.747 474 HG12 VAL 58 2HG1 VAL 58 -7.091 -3.689 3.848 475 HG13 VAL 58 3HG1 VAL 58 -7.273 -3.960 5.582 476 HG21 VAL 58 3HG2 VAL 58 -7.474 -1.288 4.189 477 HG22 VAL 58 1HG2 VAL 58 -6.406 -0.346 5.233 478 HG23 VAL 58 2HG2 VAL 58 -7.583 -1.451 5.943 479 H ALA 59 H ALA 59 -2.803 -2.510 5.307 480 HA ALA 59 HA ALA 59 -2.521 -5.305 5.005 481 HB1 ALA 59 3HB ALA 59 -0.303 -4.818 4.189 482 HB2 ALA 59 1HB ALA 59 -0.392 -3.185 4.848 483 HB3 ALA 59 2HB ALA 59 -1.463 -3.664 3.531 484 H LYS 60 H LYS 60 -1.149 -3.049 7.405 485 HA LYS 60 HA LYS 60 0.384 -5.256 8.543 486 HB2 LYS 60 2HB LYS 60 1.537 -3.618 9.872 487 HB3 LYS 60 1HB LYS 60 1.472 -3.052 8.208 488 HG2 LYS 60 2HG LYS 60 -0.102 -1.404 8.708 489 HG3 LYS 60 1HG LYS 60 -0.552 -2.169 10.234 490 HD2 LYS 60 2HD LYS 60 0.782 -0.193 10.657 491 HD3 LYS 60 1HD LYS 60 1.678 -1.636 11.129 492 HE2 LYS 60 2HE LYS 60 2.911 -1.540 9.008 493 HE3 LYS 60 1HE LYS 60 2.033 -0.075 8.574 494 HZ1 LYS 60 3HZ LYS 60 4.065 0.649 9.443 495 HZ2 LYS 60 1HZ LYS 60 4.012 -0.443 10.745 496 HZ3 LYS 60 2HZ LYS 60 2.956 0.882 10.710 497 H SER 61 H SER 61 -2.705 -4.518 8.885 498 HA SER 61 HA SER 61 -2.800 -4.320 11.771 499 HB2 SER 61 2HB SER 61 -5.271 -4.334 11.469 500 HB3 SER 61 1HB SER 61 -4.466 -3.067 10.547 501 HG SER 61 HG SER 61 -4.792 -4.198 8.685 502 H GLU 62 H GLU 62 -4.742 -6.511 9.750 503 HA GLU 62 HA GLU 62 -3.676 -8.795 11.199 504 HB2 GLU 62 2HB GLU 62 -5.981 -9.569 11.797 505 HB3 GLU 62 1HB GLU 62 -5.434 -8.151 12.676 506 HG2 GLU 62 2HG GLU 62 -6.741 -6.732 11.146 507 HG3 GLU 62 1HG GLU 62 -7.337 -8.184 10.345 508 H LEU 63 H LEU 63 -2.936 -9.784 9.408 509 HA LEU 63 HA LEU 63 -4.963 -10.579 7.423 510 HB2 LEU 63 2HB LEU 63 -1.946 -10.556 7.223 511 HB3 LEU 63 1HB LEU 63 -3.011 -11.215 5.996 512 HG LEU 63 HG LEU 63 -2.903 -8.324 6.863 513 HD11 LEU 63 1HD1 LEU 63 -1.989 -9.667 4.324 514 HD12 LEU 63 2HD1 LEU 63 -0.944 -9.018 5.587 515 HD13 LEU 63 3HD1 LEU 63 -1.967 -7.933 4.646 516 HD21 LEU 63 3HD2 LEU 63 -5.154 -9.007 6.182 517 HD22 LEU 63 1HD2 LEU 63 -4.505 -9.651 4.674 518 HD23 LEU 63 2HD2 LEU 63 -4.427 -7.920 5.000 519 H TYR 64 H TYR 64 -2.630 -11.633 9.765 520 HA TYR 64 HA TYR 64 -2.276 -13.590 10.835 521 HB2 TYR 64 2HB TYR 64 -5.014 -14.251 9.737 522 HB3 TYR 64 1HB TYR 64 -4.163 -15.214 10.940 523 HD1 TYR 64 HD1 TYR 64 -3.232 -13.645 12.973 524 HD2 TYR 64 HD2 TYR 64 -6.657 -12.863 10.570 525 HE1 TYR 64 HE1 TYR 64 -4.164 -12.245 14.766 526 HE2 TYR 64 HE2 TYR 64 -7.599 -11.464 12.360 527 HH TYR 64 HH TYR 64 -5.763 -10.431 15.054 528 H LYS 65 H LYS 65 -3.007 -16.259 10.103 529 HA LYS 65 HA LYS 65 -1.098 -16.576 7.916 530 HB2 LYS 65 2HB LYS 65 -2.228 -18.572 9.880 531 HB3 LYS 65 1HB LYS 65 -1.157 -19.005 8.558 532 HG2 LYS 65 2HG LYS 65 0.229 -18.871 10.425 533 HG3 LYS 65 1HG LYS 65 0.494 -17.350 9.573 534 HD2 LYS 65 2HD LYS 65 -0.944 -16.182 11.117 535 HD3 LYS 65 1HD LYS 65 -1.397 -17.698 11.899 536 HE2 LYS 65 2HE LYS 65 1.363 -16.483 11.840 537 HE3 LYS 65 1HE LYS 65 0.257 -16.474 13.214 538 HZ1 LYS 65 3HZ LYS 65 1.800 -18.226 13.540 539 HZ2 LYS 65 1HZ LYS 65 1.563 -18.831 11.972 540 HZ3 LYS 65 2HZ LYS 65 0.323 -18.950 13.121 541 H GLU 66 H GLU 66 -2.651 -15.835 6.333 542 HA GLU 66 HA GLU 66 -4.893 -17.557 5.726 543 HB2 GLU 66 2HB GLU 66 -4.859 -15.060 5.357 544 HB3 GLU 66 1HB GLU 66 -3.721 -15.329 4.045 545 HG2 GLU 66 2HG GLU 66 -5.996 -15.011 3.230 546 HG3 GLU 66 1HG GLU 66 -5.378 -16.611 2.831 547 H LYS 67 H LYS 67 -2.405 -18.841 5.837 548 HA LYS 67 HA LYS 67 -1.300 -20.535 4.850 549 HB2 LYS 67 2HB LYS 67 -3.229 -20.190 2.553 550 HB3 LYS 67 1HB LYS 67 -2.186 -21.578 2.826 551 HG2 LYS 67 2HG LYS 67 -3.371 -21.949 4.989 552 HG3 LYS 67 1HG LYS 67 -4.496 -20.675 4.524 553 HD2 LYS 67 2HD LYS 67 -5.634 -22.541 3.818 554 HD3 LYS 67 1HD LYS 67 -4.753 -22.115 2.350 555 HE2 LYS 67 2HE LYS 67 -3.802 -24.134 4.381 556 HE3 LYS 67 1HE LYS 67 -4.695 -24.544 2.921 557 HZ1 LYS 67 3HZ LYS 67 -2.916 -23.725 1.578 558 HZ2 LYS 67 1HZ LYS 67 -2.272 -24.811 2.707 559 HZ3 LYS 67 2HZ LYS 67 -2.075 -23.146 2.929 560 H PHE 68 H PHE 68 -1.326 -17.472 3.501 561 HA PHE 68 HA PHE 68 0.436 -18.072 1.286 562 HB2 PHE 68 2HB PHE 68 0.334 -15.731 0.771 563 HB3 PHE 68 1HB PHE 68 -1.288 -16.246 1.214 564 HD1 PHE 68 HD2 PHE 68 -2.105 -15.732 3.570 565 HD2 PHE 68 HD1 PHE 68 1.386 -13.977 1.883 566 HE1 PHE 68 HE2 PHE 68 -2.207 -13.929 5.242 567 HE2 PHE 68 HE1 PHE 68 1.291 -12.172 3.550 568 HZ PHE 68 HZ PHE 68 -0.510 -12.145 5.234 569 H LEU 69 H LEU 69 0.942 -17.968 4.492 570 HA LEU 69 HA LEU 69 3.549 -16.631 4.259 571 HB2 LEU 69 2HB LEU 69 1.954 -15.523 5.770 572 HB3 LEU 69 1HB LEU 69 1.840 -16.992 6.720 573 HG LEU 69 HG LEU 69 4.222 -16.787 7.312 574 HD11 LEU 69 1HD1 LEU 69 4.070 -14.191 5.790 575 HD12 LEU 69 2HD1 LEU 69 5.029 -15.607 5.355 576 HD13 LEU 69 3HD1 LEU 69 5.409 -14.697 6.819 577 HD21 LEU 69 3HD2 LEU 69 2.527 -15.848 8.782 578 HD22 LEU 69 1HD2 LEU 69 2.572 -14.330 7.883 579 HD23 LEU 69 2HD2 LEU 69 3.986 -14.856 8.798 580 H TYR 70 H TYR 70 2.083 -19.062 6.459 581 HA TYR 70 HA TYR 70 4.576 -20.170 7.133 582 HB2 TYR 70 2HB TYR 70 3.386 -21.835 8.360 583 HB3 TYR 70 1HB TYR 70 2.477 -20.338 8.508 584 HD1 TYR 70 HD1 TYR 70 0.344 -20.066 7.217 585 HD2 TYR 70 HD2 TYR 70 2.441 -23.763 7.358 586 HE1 TYR 70 HE1 TYR 70 -1.675 -21.236 6.442 587 HE2 TYR 70 HE2 TYR 70 0.428 -24.943 6.584 588 HH TYR 70 HH TYR 70 -2.021 -24.602 6.586 589 H GLY 71 H GLY 71 2.297 -20.981 4.601 590 HA2 GLY 71 2HA GLY 71 4.059 -23.204 3.799 591 HA3 GLY 71 1HA GLY 71 2.342 -23.124 3.427 592 H ASN 72 H ASN 72 5.111 -20.920 3.068 593 HA ASN 72 HA ASN 72 4.962 -20.931 0.214 594 HB2 ASN 72 2HB ASN 72 2.979 -19.555 0.727 595 HB3 ASN 72 1HB ASN 72 3.983 -18.472 1.681 596 HD21 ASN 72 1HD2 ASN 72 3.463 -16.710 0.435 597 HD22 ASN 72 2HD2 ASN 72 4.093 -16.490 -1.165 598 H PHE 73 H PHE 73 6.918 -20.399 -0.553 599 HA PHE 73 HA PHE 73 9.095 -19.746 1.052 600 HB2 PHE 73 2HB PHE 73 8.685 -19.340 -1.914 601 HB3 PHE 73 1HB PHE 73 10.230 -19.103 -1.105 602 HD1 PHE 73 HD1 PHE 73 11.318 -21.059 0.020 603 HD2 PHE 73 HD2 PHE 73 7.955 -21.475 -2.549 604 HE1 PHE 73 HE1 PHE 73 11.832 -23.449 -0.256 605 HE2 PHE 73 HE2 PHE 73 8.461 -23.867 -2.828 606 HZ PHE 73 HZ PHE 73 10.401 -24.857 -1.681 607 H GLN 74 H GLN 74 10.124 -17.871 1.589 608 HA GLN 74 HA GLN 74 8.500 -15.633 2.037 609 HB2 GLN 74 2HB GLN 74 10.487 -16.228 3.396 610 HB3 GLN 74 1HB GLN 74 11.523 -15.749 2.059 611 HG2 GLN 74 2HG GLN 74 11.368 -14.023 3.789 612 HG3 GLN 74 1HG GLN 74 10.761 -13.466 2.230 613 HE21 GLN 74 1HE2 GLN 74 9.501 -11.857 3.152 614 HE22 GLN 74 2HE2 GLN 74 8.064 -12.203 4.046 615 H THR 75 H THR 75 10.641 -16.429 -0.596 616 HA THR 75 HA THR 75 10.916 -13.901 -1.767 617 HB THR 75 HB THR 75 11.160 -15.274 -3.930 618 HG1 THR 75 HG1 THR 75 10.529 -17.282 -3.766 619 HG21 THR 75 3HG2 THR 75 13.072 -14.521 -2.614 620 HG22 THR 75 1HG2 THR 75 13.348 -16.150 -3.234 621 HG23 THR 75 2HG2 THR 75 12.898 -15.913 -1.544 622 H ARG 76 H ARG 76 8.356 -16.314 -1.979 623 HA ARG 76 HA ARG 76 6.910 -14.773 -3.954 624 HB2 ARG 76 2HB ARG 76 6.741 -17.138 -4.197 625 HB3 ARG 76 1HB ARG 76 6.284 -17.348 -2.512 626 HG2 ARG 76 2HG ARG 76 4.121 -16.805 -2.885 627 HG3 ARG 76 1HG ARG 76 4.515 -15.655 -4.166 628 HD2 ARG 76 2HD ARG 76 4.791 -18.630 -4.497 629 HD3 ARG 76 1HD ARG 76 3.304 -17.761 -4.879 630 HE ARG 76 HE ARG 76 4.812 -16.389 -6.410 631 HH11 ARG 76 1HH1 ARG 76 5.408 -19.775 -5.679 632 HH12 ARG 76 2HH1 ARG 76 6.186 -20.087 -7.198 633 HH21 ARG 76 1HH2 ARG 76 5.824 -16.799 -8.383 634 HH22 ARG 76 2HH2 ARG 76 6.424 -18.390 -8.750 635 H VAL 77 H VAL 77 6.972 -15.140 -0.493 636 HA VAL 77 HA VAL 77 4.488 -13.942 0.093 637 HB VAL 77 HB VAL 77 7.063 -13.710 1.674 638 HG11 VAL 77 1HG1 VAL 77 5.400 -12.041 2.322 639 HG12 VAL 77 2HG1 VAL 77 5.613 -13.254 3.585 640 HG13 VAL 77 3HG1 VAL 77 4.198 -13.315 2.535 641 HG21 VAL 77 3HG2 VAL 77 4.806 -15.697 1.922 642 HG22 VAL 77 1HG2 VAL 77 6.207 -15.582 2.990 643 HG23 VAL 77 2HG2 VAL 77 6.419 -16.038 1.299 644 H ILE 78 H ILE 78 7.715 -12.576 -0.406 645 HA ILE 78 HA ILE 78 7.011 -9.855 -0.268 646 HB ILE 78 HB ILE 78 9.210 -11.113 -1.922 647 HG12 ILE 78 2HG1 ILE 78 9.424 -9.993 0.876 648 HG13 ILE 78 1HG1 ILE 78 9.173 -11.708 0.550 649 HG21 ILE 78 1HG2 ILE 78 10.320 -8.937 -1.683 650 HG22 ILE 78 2HG2 ILE 78 8.902 -8.312 -0.842 651 HG23 ILE 78 3HG2 ILE 78 8.780 -8.798 -2.533 652 HD11 ILE 78 3HD1 ILE 78 11.512 -11.209 0.973 653 HD12 ILE 78 1HD1 ILE 78 11.522 -10.062 -0.366 654 HD13 ILE 78 2HD1 ILE 78 11.275 -11.779 -0.679 655 H GLU 79 H GLU 79 7.109 -12.155 -2.936 656 HA GLU 79 HA GLU 79 6.496 -10.507 -5.069 657 HB2 GLU 79 2HB GLU 79 7.165 -12.862 -5.274 658 HB3 GLU 79 1HB GLU 79 5.638 -13.364 -4.568 659 HG2 GLU 79 2HG GLU 79 4.449 -12.412 -6.475 660 HG3 GLU 79 1HG GLU 79 5.986 -11.920 -7.180 661 H LEU 80 H LEU 80 4.339 -12.130 -2.767 662 HA LEU 80 HA LEU 80 1.918 -11.335 -3.985 663 HB2 LEU 80 2HB LEU 80 2.510 -12.071 -1.118 664 HB3 LEU 80 1HB LEU 80 0.898 -11.856 -1.773 665 HG LEU 80 HG LEU 80 2.878 -13.947 -2.682 666 HD11 LEU 80 1HD1 LEU 80 0.378 -14.213 -1.019 667 HD12 LEU 80 2HD1 LEU 80 2.033 -14.365 -0.427 668 HD13 LEU 80 3HD1 LEU 80 1.399 -15.535 -1.584 669 HD21 LEU 80 3HD2 LEU 80 1.008 -14.857 -3.952 670 HD22 LEU 80 1HD2 LEU 80 1.375 -13.213 -4.470 671 HD23 LEU 80 2HD2 LEU 80 -0.015 -13.520 -3.429 672 H ASN 81 H ASN 81 3.859 -9.882 -1.385 673 HA ASN 81 HA ASN 81 2.114 -7.793 -0.736 674 HB2 ASN 81 2HB ASN 81 5.131 -7.900 -0.625 675 HB3 ASN 81 1HB ASN 81 4.180 -6.569 0.022 676 HD21 ASN 81 1HD2 ASN 81 5.955 -8.181 1.501 677 HD22 ASN 81 2HD2 ASN 81 5.025 -9.028 2.686 678 H TYR 82 H TYR 82 4.890 -7.756 -2.959 679 HA TYR 82 HA TYR 82 4.550 -5.157 -3.915 680 HB2 TYR 82 2HB TYR 82 6.073 -7.519 -4.667 681 HB3 TYR 82 1HB TYR 82 5.557 -6.603 -6.077 682 HD1 TYR 82 HD2 TYR 82 7.552 -6.457 -2.969 683 HD2 TYR 82 HD1 TYR 82 6.499 -4.472 -6.579 684 HE1 TYR 82 HE2 TYR 82 9.404 -4.871 -2.633 685 HE2 TYR 82 HE1 TYR 82 8.342 -2.881 -6.253 686 HH TYR 82 HH TYR 82 10.814 -3.345 -3.955 687 H LYS 83 H LYS 83 3.111 -8.191 -5.006 688 HA LYS 83 HA LYS 83 2.101 -7.018 -7.419 689 HB2 LYS 83 2HB LYS 83 2.837 -9.462 -6.960 690 HB3 LYS 83 1HB LYS 83 1.214 -9.665 -6.323 691 HG2 LYS 83 2HG LYS 83 0.224 -9.228 -8.411 692 HG3 LYS 83 1HG LYS 83 1.730 -8.595 -9.076 693 HD2 LYS 83 2HD LYS 83 2.727 -10.862 -8.804 694 HD3 LYS 83 1HD LYS 83 1.137 -11.453 -8.317 695 HE2 LYS 83 2HE LYS 83 1.670 -10.073 -10.942 696 HE3 LYS 83 1HE LYS 83 1.741 -11.822 -10.733 697 HZ1 LYS 83 3HZ LYS 83 -0.664 -10.270 -9.994 698 HZ2 LYS 83 1HZ LYS 83 -0.530 -11.932 -10.280 699 HZ3 LYS 83 2HZ LYS 83 -0.421 -10.835 -11.575 700 H HIS 84 H HIS 84 0.787 -7.693 -4.226 701 HA HIS 84 HA HIS 84 -1.909 -7.106 -5.190 702 HB2 HIS 84 2HB HIS 84 -1.490 -9.031 -3.647 703 HB3 HIS 84 1HB HIS 84 -1.065 -7.873 -2.391 704 HD1 HIS 84 HD1 HIS 84 -3.973 -9.317 -4.229 705 HD2 HIS 84 HD2 HIS 84 -3.256 -6.456 -1.292 706 HE1 HIS 84 HE1 HIS 84 -6.214 -8.823 -3.199 707 HE2 HIS 84 HE2 HIS 84 -5.785 -6.960 -1.554 708 H LEU 85 H LEU 85 0.596 -5.658 -3.189 709 HA LEU 85 HA LEU 85 -1.255 -3.608 -2.249 710 HB2 LEU 85 2HB LEU 85 1.675 -4.010 -1.653 711 HB3 LEU 85 1HB LEU 85 0.640 -2.814 -0.897 712 HG LEU 85 HG LEU 85 0.293 -5.805 -0.662 713 HD11 LEU 85 1HD1 LEU 85 1.037 -5.497 1.641 714 HD12 LEU 85 2HD1 LEU 85 1.325 -3.786 1.325 715 HD13 LEU 85 3HD1 LEU 85 2.287 -5.011 0.497 716 HD21 LEU 85 3HD2 LEU 85 -1.133 -3.537 0.728 717 HD22 LEU 85 1HD2 LEU 85 -1.354 -5.255 1.051 718 HD23 LEU 85 2HD2 LEU 85 -1.821 -4.585 -0.512 719 H LEU 86 H LEU 86 1.476 -3.935 -4.437 720 HA LEU 86 HA LEU 86 1.250 -1.066 -5.055 721 HB2 LEU 86 2HB LEU 86 3.515 -2.984 -5.607 722 HB3 LEU 86 1HB LEU 86 3.492 -1.291 -6.060 723 HG LEU 86 HG LEU 86 3.445 -2.347 -3.231 724 HD11 LEU 86 1HD1 LEU 86 5.635 -0.998 -4.805 725 HD12 LEU 86 2HD1 LEU 86 5.607 -2.684 -4.287 726 HD13 LEU 86 3HD1 LEU 86 5.700 -1.392 -3.089 727 HD21 LEU 86 3HD2 LEU 86 3.578 0.473 -4.289 728 HD22 LEU 86 1HD2 LEU 86 3.767 0.005 -2.601 729 HD23 LEU 86 2HD2 LEU 86 2.227 -0.257 -3.421 730 H GLY 87 H GLY 87 0.323 -4.048 -6.158 731 HA2 GLY 87 2HA GLY 87 -0.589 -4.792 -8.123 732 HA3 GLY 87 1HA GLY 87 -0.787 -3.097 -8.543 733 H ARG 88 H ARG 88 2.068 -5.189 -8.097 734 HA ARG 88 HA ARG 88 2.789 -5.109 -10.853 735 HB2 ARG 88 2HB ARG 88 4.845 -3.716 -10.542 736 HB3 ARG 88 1HB ARG 88 3.341 -2.813 -10.406 737 HG2 ARG 88 2HG ARG 88 3.564 -3.166 -7.886 738 HG3 ARG 88 1HG ARG 88 5.230 -3.638 -8.231 739 HD2 ARG 88 2HD ARG 88 5.059 -1.270 -7.637 740 HD3 ARG 88 1HD ARG 88 5.644 -1.495 -9.287 741 HE ARG 88 HE ARG 88 2.778 -1.043 -8.941 742 HH11 ARG 88 1HH1 ARG 88 5.917 0.298 -9.685 743 HH12 ARG 88 2HH1 ARG 88 5.285 1.632 -10.611 744 HH21 ARG 88 1HH2 ARG 88 1.921 0.721 -10.133 745 HH22 ARG 88 2HH2 ARG 88 3.001 1.874 -10.850 746 H ALA 89 H ALA 89 5.200 -5.817 -11.069 747 HA ALA 89 HA ALA 89 5.636 -7.950 -9.095 748 HB1 ALA 89 3HB ALA 89 6.772 -7.612 -11.878 749 HB2 ALA 89 1HB ALA 89 5.426 -8.663 -11.435 750 HB3 ALA 89 2HB ALA 89 7.043 -8.991 -10.812 751 HA PRO 90 HA PRO 90 9.317 -6.118 -7.394 752 HB2 PRO 90 2HB PRO 90 11.151 -8.185 -7.857 753 HB3 PRO 90 1HB PRO 90 10.140 -7.996 -6.423 754 HG2 PRO 90 2HG PRO 90 9.723 -9.709 -8.826 755 HG3 PRO 90 1HG PRO 90 9.323 -10.034 -7.130 756 HD2 PRO 90 2HD PRO 90 7.430 -9.366 -8.901 757 HD3 PRO 90 1HD PRO 90 7.368 -8.783 -7.223 758 H TYR 91 H TYR 91 10.723 -4.699 -8.236 759 HA TYR 91 HA TYR 91 11.019 -4.483 -11.048 760 HB2 TYR 91 2HB TYR 91 12.559 -3.038 -8.883 761 HB3 TYR 91 1HB TYR 91 12.425 -2.547 -10.567 762 HD1 TYR 91 HD1 TYR 91 10.062 -1.982 -11.436 763 HD2 TYR 91 HD2 TYR 91 11.035 -2.261 -7.302 764 HE1 TYR 91 HE1 TYR 91 8.077 -0.638 -10.880 765 HE2 TYR 91 HE2 TYR 91 9.053 -0.921 -6.737 766 HH TYR 91 HH TYR 91 7.570 0.689 -7.771 767 H ASP 92 H ASP 92 13.270 -5.311 -8.452 768 HA ASP 92 HA ASP 92 15.027 -6.594 -10.430 769 HB2 ASP 92 2HB ASP 92 15.844 -4.291 -9.633 770 HB3 ASP 92 1HB ASP 92 16.064 -5.034 -8.053 771 H GLU 93 H GLU 93 16.318 -8.343 -9.500 772 HA GLU 93 HA GLU 93 14.809 -9.786 -7.527 773 HB2 GLU 93 2HB GLU 93 15.947 -10.852 -9.501 774 HB3 GLU 93 1HB GLU 93 17.486 -10.535 -8.713 775 HG2 GLU 93 2HG GLU 93 16.973 -12.007 -6.924 776 HG3 GLU 93 1HG GLU 93 15.297 -12.160 -7.448 777 H SER 94 H SER 94 17.638 -7.777 -7.554 778 HA SER 94 HA SER 94 18.773 -8.550 -5.087 779 HB2 SER 94 2HB SER 94 18.779 -5.764 -6.278 780 HB3 SER 94 1HB SER 94 19.970 -6.462 -5.179 781 HG SER 94 HG SER 94 19.552 -6.936 -7.918 782 H GLU 95 H GLU 95 16.101 -6.467 -5.955 783 HA GLU 95 HA GLU 95 15.571 -5.281 -3.484 784 HB2 GLU 95 2HB GLU 95 14.015 -5.908 -5.918 785 HB3 GLU 95 1HB GLU 95 13.070 -5.704 -4.449 786 HG2 GLU 95 2HG GLU 95 15.061 -3.690 -5.453 787 HG3 GLU 95 1HG GLU 95 13.336 -3.642 -5.815 788 H VAL 96 H VAL 96 14.414 -8.352 -4.842 789 HA VAL 96 HA VAL 96 12.856 -9.188 -2.683 790 HB VAL 96 HB VAL 96 14.470 -10.946 -4.544 791 HG11 VAL 96 1HG1 VAL 96 12.001 -11.576 -2.928 792 HG12 VAL 96 2HG1 VAL 96 13.640 -12.106 -2.547 793 HG13 VAL 96 3HG1 VAL 96 12.850 -12.674 -4.018 794 HG21 VAL 96 3HG2 VAL 96 13.015 -9.396 -5.762 795 HG22 VAL 96 1HG2 VAL 96 11.633 -9.948 -4.817 796 HG23 VAL 96 2HG2 VAL 96 12.456 -11.061 -5.910 797 H ILE 97 H ILE 97 16.293 -9.687 -3.356 798 HA ILE 97 HA ILE 97 16.922 -11.315 -1.174 799 HB ILE 97 HB ILE 97 18.690 -9.240 -2.480 800 HG12 ILE 97 2HG1 ILE 97 17.774 -10.777 -4.139 801 HG13 ILE 97 1HG1 ILE 97 19.486 -11.102 -3.890 802 HG21 ILE 97 1HG2 ILE 97 19.398 -11.696 -0.883 803 HG22 ILE 97 2HG2 ILE 97 19.597 -10.020 -0.369 804 HG23 ILE 97 3HG2 ILE 97 20.543 -10.647 -1.717 805 HD11 ILE 97 3HD1 ILE 97 18.915 -13.006 -2.474 806 HD12 ILE 97 1HD1 ILE 97 18.218 -13.158 -4.087 807 HD13 ILE 97 2HD1 ILE 97 17.201 -12.675 -2.729 808 H PHE 98 H PHE 98 17.014 -7.765 -1.465 809 HA PHE 98 HA PHE 98 17.835 -7.241 1.170 810 HB2 PHE 98 2HB PHE 98 17.956 -5.488 -0.479 811 HB3 PHE 98 1HB PHE 98 16.218 -5.562 -0.759 812 HD1 PHE 98 HD2 PHE 98 18.682 -4.915 1.962 813 HD2 PHE 98 HD1 PHE 98 14.840 -4.076 0.335 814 HE1 PHE 98 HE2 PHE 98 18.323 -3.209 3.700 815 HE2 PHE 98 HE1 PHE 98 14.471 -2.373 2.071 816 HZ PHE 98 HZ PHE 98 16.213 -1.939 3.758 817 H HIS 99 H HIS 99 14.602 -7.607 -0.241 818 HA HIS 99 HA HIS 99 13.205 -6.891 2.120 819 HB2 HIS 99 2HB HIS 99 12.376 -8.384 -0.359 820 HB3 HIS 99 1HB HIS 99 11.270 -8.141 0.990 821 HD1 HIS 99 HD1 HIS 99 10.502 -5.692 1.474 822 HD2 HIS 99 HD2 HIS 99 12.804 -6.154 -1.961 823 HE1 HIS 99 HE1 HIS 99 10.245 -3.544 0.173 824 HE2 HIS 99 HE2 HIS 99 11.808 -3.779 -1.800 825 H LEU 100 H LEU 100 14.584 -9.903 1.004 826 HA LEU 100 HA LEU 100 13.389 -11.654 2.851 827 HB2 LEU 100 2HB LEU 100 16.178 -11.677 1.686 828 HB3 LEU 100 1HB LEU 100 15.472 -13.005 2.585 829 HG LEU 100 HG LEU 100 14.370 -11.939 -0.015 830 HD11 LEU 100 1HD1 LEU 100 15.302 -13.959 -1.019 831 HD12 LEU 100 2HD1 LEU 100 16.053 -14.380 0.521 832 HD13 LEU 100 3HD1 LEU 100 16.567 -12.932 -0.345 833 HD21 LEU 100 3HD2 LEU 100 12.688 -13.003 1.383 834 HD22 LEU 100 1HD2 LEU 100 13.727 -14.415 1.584 835 HD23 LEU 100 2HD2 LEU 100 13.073 -14.019 -0.006 836 H ASP 101 H ASP 101 16.365 -9.747 3.039 837 HA ASP 101 HA ASP 101 16.979 -10.373 5.731 838 HB2 ASP 101 2HB ASP 101 18.694 -9.473 4.293 839 HB3 ASP 101 1HB ASP 101 17.753 -8.016 3.999 840 H LEU 102 H LEU 102 15.130 -7.782 4.228 841 HA LEU 102 HA LEU 102 14.679 -6.183 6.471 842 HB2 LEU 102 2HB LEU 102 14.194 -5.548 4.128 843 HB3 LEU 102 1HB LEU 102 12.841 -6.660 4.125 844 HG LEU 102 HG LEU 102 11.710 -5.321 5.832 845 HD11 LEU 102 1HD1 LEU 102 14.085 -3.481 5.583 846 HD12 LEU 102 2HD1 LEU 102 13.673 -4.459 6.992 847 HD13 LEU 102 3HD1 LEU 102 12.610 -3.146 6.488 848 HD21 LEU 102 3HD2 LEU 102 12.673 -3.702 3.479 849 HD22 LEU 102 1HD2 LEU 102 11.244 -3.355 4.453 850 HD23 LEU 102 2HD2 LEU 102 11.312 -4.825 3.479 851 H TYR 103 H TYR 103 12.794 -8.914 5.198 852 HA TYR 103 HA TYR 103 10.746 -8.881 7.111 853 HB2 TYR 103 2HB TYR 103 10.464 -10.236 5.160 854 HB3 TYR 103 1HB TYR 103 11.931 -11.146 5.501 855 HD1 TYR 103 HD2 TYR 103 8.541 -10.443 6.905 856 HD2 TYR 103 HD1 TYR 103 11.802 -13.165 6.646 857 HE1 TYR 103 HE2 TYR 103 7.228 -12.127 8.128 858 HE2 TYR 103 HE1 TYR 103 10.497 -14.853 7.864 859 HH TYR 103 HH TYR 103 8.586 -14.859 9.509 860 H GLU 104 H GLU 104 13.918 -10.448 7.141 861 HA GLU 104 HA GLU 104 13.502 -11.776 9.624 862 HB2 GLU 104 2HB GLU 104 16.007 -11.112 8.078 863 HB3 GLU 104 1HB GLU 104 16.016 -12.036 9.575 864 HG2 GLU 104 2HG GLU 104 14.525 -12.819 7.081 865 HG3 GLU 104 1HG GLU 104 16.102 -13.447 7.558 866 H ASN 105 H ASN 105 14.799 -8.634 8.728 867 HA ASN 105 HA ASN 105 15.855 -8.120 11.364 868 HB2 ASN 105 2HB ASN 105 15.606 -6.479 8.861 869 HB3 ASN 105 1HB ASN 105 16.055 -5.728 10.384 870 HD21 ASN 105 1HD2 ASN 105 17.002 -8.956 9.366 871 HD22 ASN 105 2HD2 ASN 105 18.685 -8.605 9.199 872 H GLU 106 H GLU 106 13.189 -6.693 9.445 873 HA GLU 106 HA GLU 106 12.390 -5.232 11.861 874 HB2 GLU 106 2HB GLU 106 11.583 -4.806 8.984 875 HB3 GLU 106 1HB GLU 106 11.161 -3.766 10.337 876 HG2 GLU 106 2HG GLU 106 13.942 -4.282 9.310 877 HG3 GLU 106 1HG GLU 106 12.978 -2.838 9.010 878 H GLY 107 H GLY 107 11.130 -7.441 9.420 879 HA2 GLY 107 2HA GLY 107 9.487 -9.068 10.362 880 HA3 GLY 107 1HA GLY 107 8.676 -7.669 11.048 881 H PHE 108 H PHE 108 7.072 -9.176 9.645 882 HA PHE 108 HA PHE 108 7.152 -8.680 6.824 883 HB2 PHE 108 2HB PHE 108 5.113 -9.913 6.668 884 HB3 PHE 108 1HB PHE 108 6.107 -10.713 7.876 885 HD1 PHE 108 HD2 PHE 108 5.548 -10.458 10.286 886 HD2 PHE 108 HD1 PHE 108 2.991 -9.015 7.202 887 HE1 PHE 108 HE2 PHE 108 3.689 -10.330 11.888 888 HE2 PHE 108 HE1 PHE 108 1.127 -8.886 8.803 889 HZ PHE 108 HZ PHE 108 1.477 -9.543 11.149 890 H ASP 109 H ASP 109 5.523 -7.179 9.548 891 HA ASP 109 HA ASP 109 3.719 -5.663 7.914 892 HB2 ASP 109 2HB ASP 109 2.838 -4.820 9.882 893 HB3 ASP 109 1HB ASP 109 3.516 -6.341 10.444 894 H ALA 110 H ALA 110 6.928 -5.264 9.121 895 HA ALA 110 HA ALA 110 7.085 -2.449 8.548 896 HB1 ALA 110 3HB ALA 110 9.487 -2.727 9.016 897 HB2 ALA 110 1HB ALA 110 9.239 -4.467 9.157 898 HB3 ALA 110 2HB ALA 110 8.467 -3.371 10.305 899 H ASP 111 H ASP 111 7.955 -5.468 6.935 900 HA ASP 111 HA ASP 111 9.350 -4.411 4.750 901 HB2 ASP 111 2HB ASP 111 9.180 -6.838 5.202 902 HB3 ASP 111 1HB ASP 111 7.472 -6.794 4.773 903 H ILE 112 H ILE 112 5.911 -4.901 5.297 904 HA ILE 112 HA ILE 112 4.998 -3.847 2.849 905 HB ILE 112 HB ILE 112 3.661 -4.055 5.547 906 HG12 ILE 112 2HG1 ILE 112 3.330 -5.703 3.032 907 HG13 ILE 112 1HG1 ILE 112 4.285 -6.180 4.430 908 HG21 ILE 112 1HG2 ILE 112 2.593 -2.271 4.295 909 HG22 ILE 112 2HG2 ILE 112 1.533 -3.677 4.393 910 HG23 ILE 112 3HG2 ILE 112 2.409 -3.338 2.901 911 HD11 ILE 112 3HD1 ILE 112 1.312 -5.729 4.381 912 HD12 ILE 112 1HD1 ILE 112 2.257 -6.175 5.801 913 HD13 ILE 112 2HD1 ILE 112 2.138 -7.287 4.437 914 H ASP 113 H ASP 113 5.678 -2.398 5.972 915 HA ASP 113 HA ASP 113 4.643 0.170 5.504 916 HB2 ASP 113 2HB ASP 113 5.437 -0.871 7.709 917 HB3 ASP 113 1HB ASP 113 7.066 -0.433 7.202 918 H SER 114 H SER 114 7.647 -1.361 4.653 919 HA SER 114 HA SER 114 9.205 0.883 4.044 920 HB2 SER 114 2HB SER 114 9.335 -1.805 2.669 921 HB3 SER 114 1HB SER 114 10.643 -0.635 2.864 922 HG SER 114 HG SER 114 9.312 -2.032 4.958 923 H TYR 115 H TYR 115 6.703 -0.750 2.224 924 HA TYR 115 HA TYR 115 7.328 0.362 -0.324 925 HB2 TYR 115 2HB TYR 115 4.612 -0.554 0.654 926 HB3 TYR 115 1HB TYR 115 5.138 -0.405 -1.016 927 HD1 TYR 115 HD1 TYR 115 7.920 -1.713 -0.501 928 HD2 TYR 115 HD2 TYR 115 3.942 -2.836 0.497 929 HE1 TYR 115 HE1 TYR 115 8.590 -4.078 -0.498 930 HE2 TYR 115 HE2 TYR 115 4.606 -5.201 0.508 931 HH TYR 115 HH TYR 115 7.522 -6.303 0.813 932 H ILE 116 H ILE 116 5.539 1.415 2.450 933 HA ILE 116 HA ILE 116 4.167 3.564 1.094 934 HB ILE 116 HB ILE 116 4.388 3.142 4.069 935 HG12 ILE 116 2HG1 ILE 116 3.693 1.024 3.025 936 HG13 ILE 116 1HG1 ILE 116 2.382 1.745 3.948 937 HG21 ILE 116 1HG2 ILE 116 2.252 4.412 2.360 938 HG22 ILE 116 2HG2 ILE 116 3.420 5.263 3.368 939 HG23 ILE 116 3HG2 ILE 116 2.198 4.236 4.115 940 HD11 ILE 116 3HD1 ILE 116 2.696 1.841 0.958 941 HD12 ILE 116 1HD1 ILE 116 1.375 2.555 1.882 942 HD13 ILE 116 2HD1 ILE 116 1.591 0.805 1.859 943 H ASP 117 H ASP 117 7.040 3.082 2.979 944 HA ASP 117 HA ASP 117 7.514 5.839 3.568 945 HB2 ASP 117 2HB ASP 117 8.474 4.121 4.993 946 HB3 ASP 117 1HB ASP 117 9.344 3.424 3.630 947 H SER 118 H SER 118 7.895 3.909 0.800 948 HA SER 118 HA SER 118 10.067 5.369 -0.378 949 HB2 SER 118 2HB SER 118 8.063 3.474 -1.627 950 HB3 SER 118 1HB SER 118 9.537 4.062 -2.399 951 HG SER 118 HG SER 118 9.297 2.377 -0.127 952 HA PRO 119 HA PRO 119 7.252 8.747 -1.040 953 HB2 PRO 119 2HB PRO 119 9.103 10.533 -1.920 954 HB3 PRO 119 1HB PRO 119 8.881 10.116 -0.218 955 HG2 PRO 119 2HG PRO 119 10.930 9.145 -2.160 956 HG3 PRO 119 1HG PRO 119 11.121 9.576 -0.451 957 HD2 PRO 119 2HD PRO 119 10.940 7.012 -1.330 958 HD3 PRO 119 1HD PRO 119 10.383 7.525 0.273 959 H GLU 120 H GLU 120 9.779 8.370 -3.574 960 HA GLU 120 HA GLU 120 8.284 9.671 -5.566 961 HB2 GLU 120 2HB GLU 120 10.732 9.282 -5.676 962 HB3 GLU 120 1HB GLU 120 10.421 7.575 -5.961 963 HG2 GLU 120 2HG GLU 120 10.899 8.626 -8.049 964 HG3 GLU 120 1HG GLU 120 9.191 8.186 -8.017 965 H TYR 121 H TYR 121 8.525 6.267 -4.687 966 HA TYR 121 HA TYR 121 7.109 5.228 -6.879 967 HB2 TYR 121 2HB TYR 121 7.468 4.143 -4.081 968 HB3 TYR 121 1HB TYR 121 6.727 3.238 -5.398 969 HD1 TYR 121 HD2 TYR 121 9.870 4.674 -4.134 970 HD2 TYR 121 HD1 TYR 121 8.056 2.324 -7.184 971 HE1 TYR 121 HE2 TYR 121 12.093 3.937 -4.881 972 HE2 TYR 121 HE1 TYR 121 10.275 1.575 -7.934 973 HH TYR 121 HH TYR 121 13.139 2.190 -6.097 974 H THR 122 H THR 122 6.018 6.406 -3.723 975 HA THR 122 HA THR 122 3.272 5.804 -4.201 976 HB THR 122 HB THR 122 4.534 7.772 -2.280 977 HG1 THR 122 HG1 THR 122 5.121 5.854 -1.495 978 HG21 THR 122 3HG2 THR 122 1.725 6.659 -2.351 979 HG22 THR 122 1HG2 THR 122 2.188 8.327 -2.686 980 HG23 THR 122 2HG2 THR 122 2.401 7.661 -1.067 981 H ASN 123 H ASN 123 5.300 8.657 -4.668 982 HA ASN 123 HA ASN 123 3.163 10.427 -5.269 983 HB2 ASN 123 2HB ASN 123 5.280 11.276 -4.440 984 HB3 ASN 123 1HB ASN 123 6.120 10.645 -5.854 985 HD21 ASN 123 1HD2 ASN 123 6.073 11.781 -7.752 986 HD22 ASN 123 2HD2 ASN 123 5.372 13.356 -7.894 987 H SER 124 H SER 124 5.554 8.813 -7.370 988 HA SER 124 HA SER 124 4.510 9.946 -9.762 989 HB2 SER 124 2HB SER 124 6.851 9.181 -9.542 990 HB3 SER 124 1HB SER 124 6.286 7.515 -9.418 991 HG SER 124 HG SER 124 5.289 7.903 -11.539 992 H PHE 125 H PHE 125 3.524 7.285 -7.853 993 HA PHE 125 HA PHE 125 2.128 5.977 -10.042 994 HB2 PHE 125 2HB PHE 125 3.131 4.545 -8.366 995 HB3 PHE 125 1HB PHE 125 2.267 5.380 -7.081 996 HD1 PHE 125 HD1 PHE 125 1.414 3.677 -10.298 997 HD2 PHE 125 HD2 PHE 125 0.515 4.240 -6.178 998 HE1 PHE 125 HE1 PHE 125 -0.435 2.060 -10.482 999 HE2 PHE 125 HE2 PHE 125 -1.329 2.626 -6.352 1000 HZ PHE 125 HZ PHE 125 -1.805 1.534 -8.507 1001 H GLY 126 H GLY 126 1.488 8.151 -7.395 1002 HA2 GLY 126 2HA GLY 126 -0.432 9.566 -7.343 1003 HA3 GLY 126 1HA GLY 126 -1.309 8.355 -8.276 1004 H ASP 127 H ASP 127 -0.787 9.612 -5.226 1005 HA ASP 127 HA ASP 127 -0.890 7.376 -3.555 1006 HB2 ASP 127 2HB ASP 127 -0.273 9.553 -2.707 1007 HB3 ASP 127 1HB ASP 127 -1.870 10.193 -3.089 1008 H TRP 128 H TRP 128 -3.455 9.155 -5.144 1009 HA TRP 128 HA TRP 128 -5.522 8.118 -3.441 1010 HB2 TRP 128 2HB TRP 128 -5.870 9.556 -6.072 1011 HB3 TRP 128 1HB TRP 128 -7.033 9.423 -4.759 1012 HD1 TRP 128 HD1 TRP 128 -4.338 11.625 -6.069 1013 HE1 TRP 128 HE1 TRP 128 -3.891 13.569 -4.442 1014 HE3 TRP 128 HE3 TRP 128 -6.952 9.907 -2.018 1015 HZ2 TRP 128 HZ2 TRP 128 -4.557 14.276 -1.789 1016 HZ3 TRP 128 HZ3 TRP 128 -6.992 11.280 0.023 1017 HH2 TRP 128 HH2 TRP 128 -5.821 13.415 0.132 1018 H VAL 129 H VAL 129 -3.819 6.764 -5.935 1019 HA VAL 129 HA VAL 129 -6.073 5.337 -7.110 1020 HB VAL 129 HB VAL 129 -3.149 4.939 -7.751 1021 HG11 VAL 129 1HG1 VAL 129 -5.651 4.336 -9.332 1022 HG12 VAL 129 2HG1 VAL 129 -4.630 3.156 -8.510 1023 HG13 VAL 129 3HG1 VAL 129 -3.995 4.069 -9.877 1024 HG21 VAL 129 3HG2 VAL 129 -3.668 7.279 -8.094 1025 HG22 VAL 129 1HG2 VAL 129 -5.098 6.850 -9.034 1026 HG23 VAL 129 2HG2 VAL 129 -3.491 6.467 -9.650 1027 H VAL 130 H VAL 130 -6.768 3.504 -6.292 1028 HA VAL 130 HA VAL 130 -5.348 1.959 -4.360 1029 HB VAL 130 HB VAL 130 -7.777 1.298 -6.053 1030 HG11 VAL 130 1HG1 VAL 130 -8.233 -0.490 -4.433 1031 HG12 VAL 130 2HG1 VAL 130 -6.685 -0.166 -3.651 1032 HG13 VAL 130 3HG1 VAL 130 -6.727 -0.766 -5.310 1033 HG21 VAL 130 3HG2 VAL 130 -9.036 1.780 -4.015 1034 HG22 VAL 130 1HG2 VAL 130 -8.102 3.179 -4.543 1035 HG23 VAL 130 2HG2 VAL 130 -7.537 2.202 -3.188 1036 HA PRO 131 HA PRO 131 -2.160 -0.300 -6.307 1037 HB2 PRO 131 2HB PRO 131 -3.924 -2.658 -5.814 1038 HB3 PRO 131 1HB PRO 131 -2.202 -2.451 -5.476 1039 HG2 PRO 131 2HG PRO 131 -4.300 -2.074 -3.651 1040 HG3 PRO 131 1HG PRO 131 -2.623 -1.553 -3.438 1041 HD2 PRO 131 2HD PRO 131 -4.871 0.121 -3.667 1042 HD3 PRO 131 1HD PRO 131 -3.174 0.626 -3.803 1043 H TYR 132 H TYR 132 -2.353 0.432 -8.390 1044 HA TYR 132 HA TYR 132 -4.174 -0.896 -10.221 1045 HB2 TYR 132 2HB TYR 132 -3.739 1.629 -10.179 1046 HB3 TYR 132 1HB TYR 132 -2.167 1.258 -10.874 1047 HD1 TYR 132 HD1 TYR 132 -2.024 0.281 -13.150 1048 HD2 TYR 132 HD2 TYR 132 -5.710 1.574 -11.479 1049 HE1 TYR 132 HE1 TYR 132 -3.023 0.305 -15.397 1050 HE2 TYR 132 HE2 TYR 132 -6.723 1.605 -13.711 1051 HH TYR 132 HH TYR 132 -6.092 1.735 -16.030 1052 H TYR 133 H TYR 133 -3.524 -2.415 -11.620 1053 HA TYR 133 HA TYR 133 -0.904 -3.511 -11.248 1054 HB2 TYR 133 2HB TYR 133 -3.328 -4.387 -12.792 1055 HB3 TYR 133 1HB TYR 133 -1.781 -5.211 -12.979 1056 HD1 TYR 133 HD1 TYR 133 -4.510 -4.443 -10.622 1057 HD2 TYR 133 HD2 TYR 133 -0.898 -6.603 -11.248 1058 HE1 TYR 133 HE1 TYR 133 -4.945 -5.750 -8.585 1059 HE2 TYR 133 HE2 TYR 133 -1.324 -7.915 -9.216 1060 HH TYR 133 HH TYR 133 -2.563 -7.685 -7.127 1061 H ARG 134 H ARG 134 0.609 -2.258 -12.090 1062 HA ARG 134 HA ARG 134 0.709 -2.186 -15.030 1063 HB2 ARG 134 2HB ARG 134 0.390 0.123 -14.080 1064 HB3 ARG 134 1HB ARG 134 1.903 -0.077 -13.208 1065 HG2 ARG 134 2HG ARG 134 2.861 -0.591 -15.586 1066 HG3 ARG 134 1HG ARG 134 1.429 0.282 -16.128 1067 HD2 ARG 134 2HD ARG 134 3.547 1.313 -14.248 1068 HD3 ARG 134 1HD ARG 134 3.341 1.780 -15.932 1069 HE ARG 134 HE ARG 134 0.945 2.306 -14.568 1070 HH11 ARG 134 1HH1 ARG 134 4.254 3.451 -14.753 1071 HH12 ARG 134 2HH1 ARG 134 3.872 5.046 -14.170 1072 HH21 ARG 134 1HH2 ARG 134 0.426 4.405 -13.842 1073 HH22 ARG 134 2HH2 ARG 134 1.684 5.606 -13.681 1074 H GLY 135 H GLY 135 1.857 -4.145 -14.991 1075 HA2 GLY 135 2HA GLY 135 4.630 -3.882 -14.076 1076 HA3 GLY 135 1HA GLY 135 3.672 -5.186 -13.393 1077 H LEU 136 H LEU 136 4.412 -6.989 -14.240 1078 HA LEU 136 HA LEU 136 5.284 -7.051 -17.022 1079 HB2 LEU 136 2HB LEU 136 6.806 -7.945 -15.351 1080 HB3 LEU 136 1HB LEU 136 5.573 -9.055 -14.782 1081 HG LEU 136 HG LEU 136 5.621 -10.175 -17.008 1082 HD11 LEU 136 1HD1 LEU 136 7.475 -9.726 -18.518 1083 HD12 LEU 136 2HD1 LEU 136 8.019 -8.411 -17.477 1084 HD13 LEU 136 3HD1 LEU 136 6.470 -8.290 -18.313 1085 HD21 LEU 136 3HD2 LEU 136 8.251 -10.045 -15.541 1086 HD22 LEU 136 1HD2 LEU 136 7.741 -11.331 -16.634 1087 HD23 LEU 136 2HD2 LEU 136 6.876 -11.066 -15.120 1088 H GLU 137 H GLU 137 3.727 -7.473 -18.441 1089 HA GLU 137 HA GLU 137 1.620 -9.368 -17.837 1090 HB2 GLU 137 2HB GLU 137 2.238 -7.571 -20.157 1091 HB3 GLU 137 1HB GLU 137 1.095 -8.892 -20.352 1092 HG2 GLU 137 2HG GLU 137 0.856 -6.768 -18.238 1093 HG3 GLU 137 1HG GLU 137 0.068 -6.689 -19.814 1094 H HIS 138 H HIS 138 3.604 -9.127 -20.764 1095 HA HIS 138 HA HIS 138 4.567 -10.701 -22.087 1096 HB2 HIS 138 2HB HIS 138 6.067 -10.732 -20.039 1097 HB3 HIS 138 1HB HIS 138 5.185 -12.157 -19.508 1098 HD1 HIS 138 HD1 HIS 138 7.910 -11.053 -21.715 1099 HD2 HIS 138 HD2 HIS 138 5.592 -14.467 -21.189 1100 HE1 HIS 138 HE1 HIS 138 9.133 -12.898 -22.913 1101 HE2 HIS 138 HE2 HIS 138 7.826 -14.983 -22.381 1102 H HIS 139 H HIS 139 2.407 -11.209 -22.843 1103 HA HIS 139 HA HIS 139 0.815 -13.185 -21.589 1104 HB2 HIS 139 2HB HIS 139 0.680 -11.942 -24.332 1105 HB3 HIS 139 1HB HIS 139 -0.501 -13.112 -23.749 1106 HD1 HIS 139 HD1 HIS 139 -1.155 -10.107 -24.476 1107 HD2 HIS 139 HD2 HIS 139 -0.513 -11.616 -20.655 1108 HE1 HIS 139 HE1 HIS 139 -2.311 -8.514 -22.915 1109 HE2 HIS 139 HE2 HIS 139 -1.715 -9.324 -20.601 1110 H HIS 140 H HIS 140 -0.119 -14.960 -23.151 1111 HA HIS 140 HA HIS 140 0.118 -16.923 -24.265 1112 HB2 HIS 140 2HB HIS 140 2.955 -16.044 -24.850 1113 HB3 HIS 140 1HB HIS 140 2.181 -17.479 -25.510 1114 HD1 HIS 140 HD1 HIS 140 2.949 -14.133 -26.396 1115 HD2 HIS 140 HD2 HIS 140 -0.320 -16.632 -27.011 1116 HE1 HIS 140 HE1 HIS 140 1.677 -13.126 -28.314 1117 HE2 HIS 140 HE2 HIS 140 -0.380 -14.556 -28.560 1118 H HIS 141 H HIS 141 2.983 -16.101 -22.318 1119 HA HIS 141 HA HIS 141 2.935 -18.864 -21.301 1120 HB2 HIS 141 2HB HIS 141 5.037 -18.106 -22.405 1121 HB3 HIS 141 1HB HIS 141 5.207 -16.874 -21.160 1122 HD1 HIS 141 HD1 HIS 141 5.071 -20.650 -21.489 1123 HD2 HIS 141 HD2 HIS 141 6.547 -17.726 -18.926 1124 HE1 HIS 141 HE1 HIS 141 6.481 -21.872 -19.803 1125 HE2 HIS 141 HE2 HIS 141 7.509 -20.069 -18.380 1126 H HIS 142 H HIS 142 3.016 -15.474 -20.287 1127 HA HIS 142 HA HIS 142 2.686 -16.392 -17.504 1128 HB2 HIS 142 2HB HIS 142 4.783 -15.200 -17.783 1129 HB3 HIS 142 1HB HIS 142 3.955 -13.851 -18.551 1130 HD1 HIS 142 HD1 HIS 142 2.950 -12.085 -17.051 1131 HD2 HIS 142 HD2 HIS 142 4.354 -15.391 -14.951 1132 HE1 HIS 142 HE1 HIS 142 2.876 -11.431 -14.622 1133 HE2 HIS 142 HE2 HIS 142 3.863 -13.389 -13.382 1134 H HIS 143 H HIS 143 1.043 -15.624 -16.299 1135 HA HIS 143 HA HIS 143 -0.169 -13.130 -16.599 1136 HB2 HIS 143 2HB HIS 143 -1.204 -14.252 -18.607 1137 HB3 HIS 143 1HB HIS 143 -1.976 -15.386 -17.499 1138 HD1 HIS 143 HD1 HIS 143 -3.913 -14.478 -16.032 1139 HD2 HIS 143 HD2 HIS 143 -2.317 -11.688 -18.664 1140 HE1 HIS 143 HE1 HIS 143 -5.557 -12.575 -16.079 1141 HE2 HIS 143 HE2 HIS 143 -4.655 -10.980 -17.807 Start of MODEL 7 1 H1 MET 1 1H MET 1 -12.101 -0.101 -13.355 2 H2 MET 1 2H MET 1 -10.616 -0.856 -13.669 3 H3 MET 1 3H MET 1 -11.565 -0.282 -14.954 4 HA MET 1 HA MET 1 -9.717 1.194 -14.538 5 HB2 MET 1 2HB MET 1 -11.968 2.044 -15.294 6 HB3 MET 1 1HB MET 1 -12.317 2.438 -13.616 7 HG2 MET 1 2HG MET 1 -11.604 4.418 -14.752 8 HG3 MET 1 1HG MET 1 -10.355 3.938 -13.602 9 HE1 MET 1 3HE MET 1 -8.534 5.446 -14.721 10 HE2 MET 1 1HE MET 1 -9.742 6.038 -15.858 11 HE3 MET 1 2HE MET 1 -8.186 5.457 -16.451 12 HA PRO 2 HA PRO 2 -8.286 1.346 -10.307 13 HB2 PRO 2 2HB PRO 2 -6.674 3.575 -10.664 14 HB3 PRO 2 1HB PRO 2 -6.186 1.907 -10.981 15 HG2 PRO 2 2HG PRO 2 -7.145 3.996 -12.886 16 HG3 PRO 2 1HG PRO 2 -5.866 2.786 -13.099 17 HD2 PRO 2 2HD PRO 2 -8.280 2.477 -14.216 18 HD3 PRO 2 1HD PRO 2 -7.381 1.090 -13.563 19 H VAL 3 H VAL 3 -9.366 2.172 -8.657 20 HA VAL 3 HA VAL 3 -11.044 4.489 -9.008 21 HB VAL 3 HB VAL 3 -10.604 2.852 -6.504 22 HG11 VAL 3 1HG1 VAL 3 -12.778 3.734 -5.822 23 HG12 VAL 3 2HG1 VAL 3 -12.861 4.686 -7.304 24 HG13 VAL 3 3HG1 VAL 3 -11.620 5.037 -6.102 25 HG21 VAL 3 3HG2 VAL 3 -12.699 2.531 -8.653 26 HG22 VAL 3 1HG2 VAL 3 -12.630 1.633 -7.135 27 HG23 VAL 3 2HG2 VAL 3 -11.358 1.430 -8.340 28 H GLU 4 H GLU 4 -10.487 6.497 -8.539 29 HA GLU 4 HA GLU 4 -8.078 6.985 -6.935 30 HB2 GLU 4 2HB GLU 4 -8.073 9.213 -7.905 31 HB3 GLU 4 1HB GLU 4 -8.221 8.027 -9.195 32 HG2 GLU 4 2HG GLU 4 -10.522 8.483 -9.479 33 HG3 GLU 4 1HG GLU 4 -10.593 9.420 -7.991 34 H LEU 5 H LEU 5 -8.130 8.616 -5.262 35 HA LEU 5 HA LEU 5 -10.848 9.335 -4.390 36 HB2 LEU 5 2HB LEU 5 -9.586 7.991 -2.739 37 HB3 LEU 5 1HB LEU 5 -8.333 9.220 -2.721 38 HG LEU 5 HG LEU 5 -9.916 10.850 -1.813 39 HD11 LEU 5 1HD1 LEU 5 -12.143 10.155 -1.101 40 HD12 LEU 5 2HD1 LEU 5 -11.880 8.564 -1.817 41 HD13 LEU 5 3HD1 LEU 5 -11.949 9.994 -2.846 42 HD21 LEU 5 3HD2 LEU 5 -9.935 8.276 -0.242 43 HD22 LEU 5 1HD2 LEU 5 -10.177 9.901 0.399 44 HD23 LEU 5 2HD2 LEU 5 -8.612 9.443 -0.273 45 H ARG 6 H ARG 6 -11.207 11.205 -5.378 46 HA ARG 6 HA ARG 6 -9.134 13.207 -5.595 47 HB2 ARG 6 2HB ARG 6 -10.905 14.510 -6.778 48 HB3 ARG 6 1HB ARG 6 -10.559 12.945 -7.497 49 HG2 ARG 6 2HG ARG 6 -12.546 12.053 -6.237 50 HG3 ARG 6 1HG ARG 6 -12.939 13.729 -5.842 51 HD2 ARG 6 2HD ARG 6 -14.185 13.022 -7.791 52 HD3 ARG 6 1HD ARG 6 -13.011 14.260 -8.234 53 HE ARG 6 HE ARG 6 -11.613 12.451 -9.135 54 HH11 ARG 6 1HH1 ARG 6 -15.005 11.795 -8.582 55 HH12 ARG 6 2HH1 ARG 6 -15.086 10.514 -9.746 56 HH21 ARG 6 1HH2 ARG 6 -11.722 10.772 -10.706 57 HH22 ARG 6 2HH2 ARG 6 -13.237 9.959 -10.972 58 H ALA 7 H ALA 7 -9.519 15.437 -4.852 59 HA ALA 7 HA ALA 7 -9.992 15.392 -2.067 60 HB1 ALA 7 3HB ALA 7 -9.561 17.781 -2.131 61 HB2 ALA 7 1HB ALA 7 -9.730 17.781 -3.886 62 HB3 ALA 7 2HB ALA 7 -8.393 16.915 -3.128 63 H ASN 8 H ASN 8 -11.956 16.421 -4.793 64 HA ASN 8 HA ASN 8 -14.172 16.895 -2.925 65 HB2 ASN 8 2HB ASN 8 -13.730 18.673 -4.632 66 HB3 ASN 8 1HB ASN 8 -14.092 17.497 -5.893 67 HD21 ASN 8 1HD2 ASN 8 -15.856 18.623 -6.665 68 HD22 ASN 8 2HD2 ASN 8 -17.338 18.772 -5.780 69 H TRP 9 H TRP 9 -14.591 14.749 -2.456 70 HA TRP 9 HA TRP 9 -15.328 13.009 -4.700 71 HB2 TRP 9 2HB TRP 9 -15.272 11.214 -2.858 72 HB3 TRP 9 1HB TRP 9 -13.735 11.904 -3.369 73 HD1 TRP 9 HD1 TRP 9 -12.299 13.113 -1.575 74 HE1 TRP 9 HE1 TRP 9 -12.538 13.521 0.951 75 HE3 TRP 9 HE3 TRP 9 -17.173 11.675 -0.980 76 HZ2 TRP 9 HZ2 TRP 9 -14.523 13.270 2.927 77 HZ3 TRP 9 HZ3 TRP 9 -18.163 11.792 1.268 78 HH2 TRP 9 HH2 TRP 9 -16.865 12.573 3.180 79 H SER 10 H SER 10 -17.184 11.600 -4.423 80 HA SER 10 HA SER 10 -19.333 12.799 -2.826 81 HB2 SER 10 2HB SER 10 -19.511 10.680 -4.994 82 HB3 SER 10 1HB SER 10 -20.861 11.521 -4.233 83 HG SER 10 HG SER 10 -19.615 13.491 -5.072 84 H GLU 11 H GLU 11 -20.676 11.290 -1.543 85 HA GLU 11 HA GLU 11 -19.053 9.766 0.159 86 HB2 GLU 11 2HB GLU 11 -21.221 10.788 0.791 87 HB3 GLU 11 1HB GLU 11 -22.048 9.574 -0.175 88 HG2 GLU 11 2HG GLU 11 -21.368 7.830 1.276 89 HG3 GLU 11 1HG GLU 11 -20.242 8.891 2.128 90 H GLU 12 H GLU 12 -21.292 8.717 -2.393 91 HA GLU 12 HA GLU 12 -20.908 5.952 -2.146 92 HB2 GLU 12 2HB GLU 12 -22.681 6.897 -3.521 93 HB3 GLU 12 1HB GLU 12 -21.497 7.622 -4.598 94 HG2 GLU 12 2HG GLU 12 -20.709 5.282 -5.106 95 HG3 GLU 12 1HG GLU 12 -22.138 4.712 -4.244 96 H ASP 13 H ASP 13 -19.189 8.348 -4.095 97 HA ASP 13 HA ASP 13 -17.476 6.550 -5.421 98 HB2 ASP 13 2HB ASP 13 -18.005 8.974 -6.023 99 HB3 ASP 13 1HB ASP 13 -16.831 9.431 -4.795 100 H LEU 14 H LEU 14 -17.180 8.367 -2.420 101 HA LEU 14 HA LEU 14 -14.531 7.730 -1.759 102 HB2 LEU 14 2HB LEU 14 -15.710 9.434 -0.551 103 HB3 LEU 14 1HB LEU 14 -16.943 8.299 -0.041 104 HG LEU 14 HG LEU 14 -15.156 7.098 1.271 105 HD11 LEU 14 1HD1 LEU 14 -13.584 9.589 0.643 106 HD12 LEU 14 2HD1 LEU 14 -13.203 7.948 0.121 107 HD13 LEU 14 3HD1 LEU 14 -13.141 8.365 1.833 108 HD21 LEU 14 3HD2 LEU 14 -15.245 8.647 3.124 109 HD22 LEU 14 1HD2 LEU 14 -16.798 8.603 2.293 110 HD23 LEU 14 2HD2 LEU 14 -15.701 9.960 2.038 111 H GLU 15 H GLU 15 -17.574 6.065 -0.953 112 HA GLU 15 HA GLU 15 -16.344 4.003 0.542 113 HB2 GLU 15 2HB GLU 15 -18.995 3.941 -0.912 114 HB3 GLU 15 1HB GLU 15 -18.483 2.834 0.356 115 HG2 GLU 15 2HG GLU 15 -18.274 4.851 1.855 116 HG3 GLU 15 1HG GLU 15 -19.106 5.756 0.592 117 H THR 16 H THR 16 -16.922 4.463 -2.860 118 HA THR 16 HA THR 16 -16.414 1.843 -3.748 119 HB THR 16 HB THR 16 -15.707 4.426 -5.163 120 HG1 THR 16 HG1 THR 16 -18.007 4.043 -4.419 121 HG21 THR 16 3HG2 THR 16 -16.303 1.674 -6.259 122 HG22 THR 16 1HG2 THR 16 -14.707 2.417 -6.167 123 HG23 THR 16 2HG2 THR 16 -15.947 3.117 -7.208 124 H VAL 17 H VAL 17 -14.290 4.549 -2.952 125 HA VAL 17 HA VAL 17 -11.833 3.353 -3.678 126 HB VAL 17 HB VAL 17 -12.347 5.411 -1.522 127 HG11 VAL 17 1HG1 VAL 17 -9.827 4.739 -3.031 128 HG12 VAL 17 2HG1 VAL 17 -10.143 4.424 -1.324 129 HG13 VAL 17 3HG1 VAL 17 -10.020 6.084 -1.908 130 HG21 VAL 17 3HG2 VAL 17 -13.250 6.157 -3.643 131 HG22 VAL 17 1HG2 VAL 17 -11.722 5.797 -4.443 132 HG23 VAL 17 2HG2 VAL 17 -11.803 7.079 -3.235 133 H ILE 18 H ILE 18 -13.495 3.648 -0.561 134 HA ILE 18 HA ILE 18 -11.668 2.252 1.020 135 HB ILE 18 HB ILE 18 -14.671 2.404 1.364 136 HG12 ILE 18 2HG1 ILE 18 -12.503 4.181 2.508 137 HG13 ILE 18 1HG1 ILE 18 -13.539 4.612 1.152 138 HG21 ILE 18 1HG2 ILE 18 -12.481 1.769 3.334 139 HG22 ILE 18 2HG2 ILE 18 -13.746 0.679 2.767 140 HG23 ILE 18 3HG2 ILE 18 -14.164 2.072 3.765 141 HD11 ILE 18 3HD1 ILE 18 -14.457 4.046 3.962 142 HD12 ILE 18 1HD1 ILE 18 -15.494 4.482 2.604 143 HD13 ILE 18 2HD1 ILE 18 -14.308 5.636 3.212 144 H ARG 19 H ARG 19 -14.519 1.079 -0.734 145 HA ARG 19 HA ARG 19 -14.333 -1.603 0.178 146 HB2 ARG 19 2HB ARG 19 -16.388 -0.494 -0.727 147 HB3 ARG 19 1HB ARG 19 -15.674 -0.583 -2.330 148 HG2 ARG 19 2HG ARG 19 -15.593 -3.051 -2.096 149 HG3 ARG 19 1HG ARG 19 -16.457 -2.892 -0.565 150 HD2 ARG 19 2HD ARG 19 -18.017 -3.411 -2.340 151 HD3 ARG 19 1HD ARG 19 -18.301 -1.773 -1.749 152 HE ARG 19 HE ARG 19 -16.529 -1.768 -3.973 153 HH11 ARG 19 1HH1 ARG 19 -19.921 -2.066 -3.125 154 HH12 ARG 19 2HH1 ARG 19 -20.474 -1.521 -4.685 155 HH21 ARG 19 1HH2 ARG 19 -17.260 -1.040 -5.992 156 HH22 ARG 19 2HH2 ARG 19 -18.967 -0.934 -6.306 157 H ALA 20 H ALA 20 -12.781 0.146 -2.381 158 HA ALA 20 HA ALA 20 -11.965 -2.142 -3.884 159 HB1 ALA 20 3HB ALA 20 -12.067 0.100 -4.879 160 HB2 ALA 20 1HB ALA 20 -10.464 -0.617 -5.041 161 HB3 ALA 20 2HB ALA 20 -10.755 0.622 -3.821 162 H VAL 21 H VAL 21 -10.658 -0.318 -1.190 163 HA VAL 21 HA VAL 21 -8.108 -1.641 -1.230 164 HB VAL 21 HB VAL 21 -9.375 -0.056 1.012 165 HG11 VAL 21 1HG1 VAL 21 -7.071 0.246 1.797 166 HG12 VAL 21 2HG1 VAL 21 -6.500 -0.807 0.503 167 HG13 VAL 21 3HG1 VAL 21 -7.537 -1.455 1.772 168 HG21 VAL 21 3HG2 VAL 21 -8.004 1.818 0.185 169 HG22 VAL 21 1HG2 VAL 21 -9.225 1.307 -0.982 170 HG23 VAL 21 2HG2 VAL 21 -7.539 0.841 -1.207 171 H TYR 22 H TYR 22 -11.023 -1.857 0.814 172 HA TYR 22 HA TYR 22 -10.583 -4.677 1.203 173 HB2 TYR 22 2HB TYR 22 -10.224 -4.724 3.526 174 HB3 TYR 22 1HB TYR 22 -9.161 -3.441 2.972 175 HD1 TYR 22 HD1 TYR 22 -10.557 -1.036 2.910 176 HD2 TYR 22 HD2 TYR 22 -11.237 -4.321 5.528 177 HE1 TYR 22 HE1 TYR 22 -11.575 0.485 4.551 178 HE2 TYR 22 HE2 TYR 22 -12.257 -2.809 7.171 179 HH TYR 22 HH TYR 22 -13.228 0.324 6.437 180 H ARG 23 H ARG 23 -12.363 -5.229 3.198 181 HA ARG 23 HA ARG 23 -14.543 -5.224 3.861 182 HB2 ARG 23 2HB ARG 23 -14.460 -2.858 4.234 183 HB3 ARG 23 1HB ARG 23 -14.564 -2.523 2.515 184 HG2 ARG 23 2HG ARG 23 -16.688 -2.035 3.279 185 HG3 ARG 23 1HG ARG 23 -16.860 -3.669 2.640 186 HD2 ARG 23 2HD ARG 23 -18.003 -3.385 4.790 187 HD3 ARG 23 1HD ARG 23 -16.723 -4.590 4.873 188 HE ARG 23 HE ARG 23 -15.992 -3.367 6.644 189 HH11 ARG 23 1HH1 ARG 23 -17.143 -1.030 4.257 190 HH12 ARG 23 2HH1 ARG 23 -16.574 0.331 5.170 191 HH21 ARG 23 1HH2 ARG 23 -15.334 -1.576 7.831 192 HH22 ARG 23 2HH2 ARG 23 -15.526 0.028 7.163 193 H GLN 24 H GLN 24 -15.071 -7.005 2.664 194 HA GLN 24 HA GLN 24 -16.604 -6.449 0.215 195 HB2 GLN 24 2HB GLN 24 -14.851 -8.832 0.839 196 HB3 GLN 24 1HB GLN 24 -15.996 -8.789 -0.494 197 HG2 GLN 24 2HG GLN 24 -13.726 -6.844 -0.170 198 HG3 GLN 24 1HG GLN 24 -13.637 -8.324 -1.124 199 HE21 GLN 24 1HE2 GLN 24 -15.004 -5.136 -0.896 200 HE22 GLN 24 2HE2 GLN 24 -15.565 -5.054 -2.531 201 H VAL 25 H VAL 25 -18.306 -8.166 -0.163 202 HA VAL 25 HA VAL 25 -19.823 -8.596 2.206 203 HB VAL 25 HB VAL 25 -20.205 -9.869 -0.516 204 HG11 VAL 25 1HG1 VAL 25 -22.542 -10.168 0.213 205 HG12 VAL 25 2HG1 VAL 25 -22.100 -9.575 1.813 206 HG13 VAL 25 3HG1 VAL 25 -21.406 -11.080 1.208 207 HG21 VAL 25 3HG2 VAL 25 -20.245 -7.425 -0.633 208 HG22 VAL 25 1HG2 VAL 25 -21.460 -7.383 0.644 209 HG23 VAL 25 2HG2 VAL 25 -21.846 -8.108 -0.916 210 H LEU 26 H LEU 26 -17.653 -10.555 0.268 211 HA LEU 26 HA LEU 26 -17.982 -12.843 2.036 212 HB2 LEU 26 2HB LEU 26 -17.677 -13.241 -0.365 213 HB3 LEU 26 1HB LEU 26 -16.138 -12.400 -0.318 214 HG LEU 26 HG LEU 26 -15.297 -14.157 1.253 215 HD11 LEU 26 1HD1 LEU 26 -16.525 -16.256 1.417 216 HD12 LEU 26 2HD1 LEU 26 -17.867 -15.549 0.517 217 HD13 LEU 26 3HD1 LEU 26 -17.446 -14.922 2.111 218 HD21 LEU 26 3HD2 LEU 26 -15.015 -15.872 -0.477 219 HD22 LEU 26 1HD2 LEU 26 -14.759 -14.244 -1.107 220 HD23 LEU 26 2HD2 LEU 26 -16.269 -15.093 -1.443 221 H GLY 27 H GLY 27 -16.578 -13.410 3.611 222 HA2 GLY 27 2HA GLY 27 -13.877 -12.604 3.754 223 HA3 GLY 27 1HA GLY 27 -14.845 -11.528 4.754 224 H ASN 28 H ASN 28 -16.519 -12.820 6.103 225 HA ASN 28 HA ASN 28 -15.701 -15.447 6.921 226 HB2 ASN 28 2HB ASN 28 -15.375 -14.875 9.304 227 HB3 ASN 28 1HB ASN 28 -14.146 -14.146 8.279 228 HD21 ASN 28 1HD2 ASN 28 -14.072 -11.938 8.061 229 HD22 ASN 28 2HD2 ASN 28 -14.964 -10.864 9.084 230 H ASP 29 H ASP 29 -17.121 -15.956 9.049 231 HA ASP 29 HA ASP 29 -19.807 -15.768 8.076 232 HB2 ASP 29 2HB ASP 29 -18.537 -17.089 10.461 233 HB3 ASP 29 1HB ASP 29 -20.286 -17.056 10.255 234 H TYR 30 H TYR 30 -18.378 -13.321 9.190 235 HA TYR 30 HA TYR 30 -18.974 -11.379 10.185 236 HB2 TYR 30 2HB TYR 30 -21.748 -12.580 10.302 237 HB3 TYR 30 1HB TYR 30 -21.341 -10.873 10.452 238 HD1 TYR 30 HD2 TYR 30 -19.906 -9.949 8.383 239 HD2 TYR 30 HD1 TYR 30 -22.509 -13.311 8.260 240 HE1 TYR 30 HE2 TYR 30 -20.114 -9.696 5.945 241 HE2 TYR 30 HE1 TYR 30 -22.718 -13.070 5.825 242 HH TYR 30 HH TYR 30 -20.665 -11.086 3.990 243 H VAL 31 H VAL 31 -18.131 -13.706 11.762 244 HA VAL 31 HA VAL 31 -19.541 -13.487 14.275 245 HB VAL 31 HB VAL 31 -17.835 -15.075 15.122 246 HG11 VAL 31 1HG1 VAL 31 -19.114 -15.864 12.506 247 HG12 VAL 31 2HG1 VAL 31 -19.875 -15.915 14.095 248 HG13 VAL 31 3HG1 VAL 31 -18.517 -16.980 13.735 249 HG21 VAL 31 3HG2 VAL 31 -15.934 -14.349 13.783 250 HG22 VAL 31 1HG2 VAL 31 -16.732 -14.914 12.316 251 HG23 VAL 31 2HG2 VAL 31 -16.231 -16.072 13.549 252 H MET 32 H MET 32 -17.196 -11.727 12.707 253 HA MET 32 HA MET 32 -15.593 -10.997 14.969 254 HB2 MET 32 2HB MET 32 -14.584 -9.352 13.471 255 HB3 MET 32 1HB MET 32 -14.685 -10.921 12.686 256 HG2 MET 32 2HG MET 32 -16.733 -10.144 11.518 257 HG3 MET 32 1HG MET 32 -16.475 -8.549 12.221 258 HE1 MET 32 3HE MET 32 -16.800 -8.902 9.108 259 HE2 MET 32 1HE MET 32 -15.490 -7.879 8.520 260 HE3 MET 32 2HE MET 32 -16.466 -7.359 9.895 261 H ALA 33 H ALA 33 -15.957 -9.441 16.418 262 HA ALA 33 HA ALA 33 -18.382 -7.824 16.105 263 HB1 ALA 33 3HB ALA 33 -18.170 -9.135 18.162 264 HB2 ALA 33 1HB ALA 33 -18.211 -7.405 18.498 265 HB3 ALA 33 2HB ALA 33 -16.680 -8.280 18.556 266 H SER 34 H SER 34 -18.170 -5.875 15.327 267 HA SER 34 HA SER 34 -17.416 -3.795 14.853 268 HB2 SER 34 2HB SER 34 -16.953 -3.684 17.338 269 HB3 SER 34 1HB SER 34 -15.301 -4.181 16.986 270 HG SER 34 HG SER 34 -16.600 -1.756 16.482 271 H GLU 35 H GLU 35 -15.009 -2.684 14.482 272 HA GLU 35 HA GLU 35 -13.501 -4.621 12.863 273 HB2 GLU 35 2HB GLU 35 -14.319 -1.822 12.051 274 HB3 GLU 35 1HB GLU 35 -13.227 -2.857 11.138 275 HG2 GLU 35 2HG GLU 35 -14.996 -4.459 10.768 276 HG3 GLU 35 1HG GLU 35 -16.094 -3.512 11.771 277 H ARG 36 H ARG 36 -11.269 -4.095 12.552 278 HA ARG 36 HA ARG 36 -10.208 -2.652 14.842 279 HB2 ARG 36 2HB ARG 36 -8.092 -3.662 14.310 280 HB3 ARG 36 1HB ARG 36 -9.342 -4.892 14.209 281 HG2 ARG 36 2HG ARG 36 -9.362 -4.546 11.732 282 HG3 ARG 36 1HG ARG 36 -7.947 -3.510 11.932 283 HD2 ARG 36 2HD ARG 36 -7.155 -5.678 11.364 284 HD3 ARG 36 1HD ARG 36 -6.819 -5.436 13.080 285 HE ARG 36 HE ARG 36 -8.985 -7.111 11.984 286 HH11 ARG 36 1HH1 ARG 36 -6.837 -6.232 14.598 287 HH12 ARG 36 2HH1 ARG 36 -7.283 -7.584 15.590 288 HH21 ARG 36 1HH2 ARG 36 -9.560 -8.908 13.278 289 HH22 ARG 36 2HH2 ARG 36 -8.822 -9.108 14.841 290 H LEU 37 H LEU 37 -10.779 -2.064 11.530 291 HA LEU 37 HA LEU 37 -8.898 0.208 11.564 292 HB2 LEU 37 2HB LEU 37 -10.068 -1.275 9.208 293 HB3 LEU 37 1HB LEU 37 -8.977 0.095 9.104 294 HG LEU 37 HG LEU 37 -8.266 -2.555 10.367 295 HD11 LEU 37 1HD1 LEU 37 -6.958 -2.970 8.361 296 HD12 LEU 37 2HD1 LEU 37 -7.541 -1.463 7.653 297 HD13 LEU 37 3HD1 LEU 37 -8.666 -2.785 7.965 298 HD21 LEU 37 3HD2 LEU 37 -5.983 -1.700 10.276 299 HD22 LEU 37 1HD2 LEU 37 -7.013 -0.648 11.246 300 HD23 LEU 37 2HD2 LEU 37 -6.570 -0.178 9.605 301 H VAL 38 H VAL 38 -11.866 -0.168 12.405 302 HA VAL 38 HA VAL 38 -13.465 1.258 10.582 303 HB VAL 38 HB VAL 38 -14.466 -0.167 12.281 304 HG11 VAL 38 1HG1 VAL 38 -13.507 1.880 14.277 305 HG12 VAL 38 2HG1 VAL 38 -12.937 0.219 14.123 306 HG13 VAL 38 3HG1 VAL 38 -14.597 0.538 14.628 307 HG21 VAL 38 3HG2 VAL 38 -15.834 1.603 11.335 308 HG22 VAL 38 1HG2 VAL 38 -15.280 2.722 12.580 309 HG23 VAL 38 2HG2 VAL 38 -16.264 1.327 13.022 310 H SER 39 H SER 39 -11.560 2.341 13.376 311 HA SER 39 HA SER 39 -12.469 5.026 13.290 312 HB2 SER 39 2HB SER 39 -9.888 3.899 14.410 313 HB3 SER 39 1HB SER 39 -10.544 5.500 14.755 314 HG SER 39 HG SER 39 -11.113 4.041 16.398 315 H ALA 40 H ALA 40 -9.851 3.292 11.730 316 HA ALA 40 HA ALA 40 -8.522 5.537 10.638 317 HB1 ALA 40 3HB ALA 40 -7.453 3.341 10.809 318 HB2 ALA 40 1HB ALA 40 -7.436 3.932 9.146 319 HB3 ALA 40 2HB ALA 40 -8.591 2.691 9.630 320 H GLU 41 H GLU 41 -11.072 3.400 9.442 321 HA GLU 41 HA GLU 41 -11.343 4.520 6.882 322 HB2 GLU 41 2HB GLU 41 -12.373 2.385 7.534 323 HB3 GLU 41 1HB GLU 41 -13.458 3.241 8.623 324 HG2 GLU 41 2HG GLU 41 -14.340 4.474 6.634 325 HG3 GLU 41 1HG GLU 41 -13.379 3.396 5.623 326 H SER 42 H SER 42 -12.964 5.280 9.947 327 HA SER 42 HA SER 42 -14.664 7.280 8.984 328 HB2 SER 42 2HB SER 42 -13.395 7.057 11.724 329 HB3 SER 42 1HB SER 42 -14.807 8.033 11.317 330 HG SER 42 HG SER 42 -15.330 5.616 10.444 331 H LEU 43 H LEU 43 -11.308 7.455 10.126 332 HA LEU 43 HA LEU 43 -11.058 10.257 10.012 333 HB2 LEU 43 2HB LEU 43 -8.980 8.098 9.681 334 HB3 LEU 43 1HB LEU 43 -8.606 9.805 9.815 335 HG LEU 43 HG LEU 43 -9.946 8.123 11.937 336 HD11 LEU 43 1HD1 LEU 43 -7.879 8.441 13.182 337 HD12 LEU 43 2HD1 LEU 43 -7.183 9.323 11.822 338 HD13 LEU 43 3HD1 LEU 43 -7.574 7.612 11.654 339 HD21 LEU 43 3HD2 LEU 43 -10.749 10.424 11.971 340 HD22 LEU 43 1HD2 LEU 43 -9.087 11.016 11.979 341 HD23 LEU 43 2HD2 LEU 43 -9.705 10.102 13.355 342 H LEU 44 H LEU 44 -10.699 7.763 7.550 343 HA LEU 44 HA LEU 44 -9.745 9.526 5.513 344 HB2 LEU 44 2HB LEU 44 -9.470 7.060 5.432 345 HB3 LEU 44 1HB LEU 44 -11.203 6.895 5.228 346 HG LEU 44 HG LEU 44 -10.997 8.215 3.099 347 HD11 LEU 44 1HD1 LEU 44 -8.883 9.321 3.575 348 HD12 LEU 44 2HD1 LEU 44 -8.787 8.392 2.079 349 HD13 LEU 44 3HD1 LEU 44 -8.051 7.766 3.553 350 HD21 LEU 44 3HD2 LEU 44 -11.220 5.808 3.050 351 HD22 LEU 44 1HD2 LEU 44 -9.483 5.615 3.298 352 HD23 LEU 44 2HD2 LEU 44 -10.087 6.331 1.803 353 H ARG 45 H ARG 45 -12.896 8.359 6.543 354 HA ARG 45 HA ARG 45 -14.431 9.511 4.478 355 HB2 ARG 45 2HB ARG 45 -15.096 7.723 6.200 356 HB3 ARG 45 1HB ARG 45 -15.383 9.057 7.303 357 HG2 ARG 45 2HG ARG 45 -16.732 8.933 4.631 358 HG3 ARG 45 1HG ARG 45 -17.371 8.073 6.031 359 HD2 ARG 45 2HD ARG 45 -17.531 10.162 7.261 360 HD3 ARG 45 1HD ARG 45 -16.830 11.034 5.899 361 HE ARG 45 HE ARG 45 -19.133 9.640 5.050 362 HH11 ARG 45 1HH1 ARG 45 -18.186 12.368 7.014 363 HH12 ARG 45 2HH1 ARG 45 -19.643 13.268 6.709 364 HH21 ARG 45 1HH2 ARG 45 -21.078 10.816 4.637 365 HH22 ARG 45 2HH2 ARG 45 -21.282 12.381 5.374 366 H ASN 46 H ASN 46 -13.244 10.739 7.548 367 HA ASN 46 HA ASN 46 -14.620 13.253 7.341 368 HB2 ASN 46 2HB ASN 46 -12.268 12.455 9.075 369 HB3 ASN 46 1HB ASN 46 -13.182 13.950 9.233 370 HD21 ASN 46 1HD2 ASN 46 -15.756 12.667 8.711 371 HD22 ASN 46 2HD2 ASN 46 -16.132 11.747 10.130 372 H GLY 47 H GLY 47 -12.114 11.961 5.636 373 HA2 GLY 47 2HA GLY 47 -10.639 12.861 4.126 374 HA3 GLY 47 1HA GLY 47 -11.438 14.406 4.376 375 H LYS 48 H LYS 48 -9.898 12.517 6.903 376 HA LYS 48 HA LYS 48 -8.243 14.843 7.497 377 HB2 LYS 48 2HB LYS 48 -9.627 13.790 9.274 378 HB3 LYS 48 1HB LYS 48 -8.669 12.324 9.115 379 HG2 LYS 48 2HG LYS 48 -6.691 13.485 9.853 380 HG3 LYS 48 1HG LYS 48 -7.567 15.015 9.896 381 HD2 LYS 48 2HD LYS 48 -8.167 12.591 11.592 382 HD3 LYS 48 1HD LYS 48 -7.318 14.039 12.135 383 HE2 LYS 48 2HE LYS 48 -10.176 13.876 11.178 384 HE3 LYS 48 1HE LYS 48 -9.638 14.121 12.839 385 HZ1 LYS 48 3HZ LYS 48 -9.385 15.993 10.554 386 HZ2 LYS 48 1HZ LYS 48 -8.541 16.206 12.011 387 HZ3 LYS 48 2HZ LYS 48 -10.236 16.227 11.999 388 H ILE 49 H ILE 49 -7.887 11.370 6.854 389 HA ILE 49 HA ILE 49 -4.975 11.700 6.817 390 HB ILE 49 HB ILE 49 -4.859 9.244 6.731 391 HG12 ILE 49 2HG1 ILE 49 -7.876 9.335 6.977 392 HG13 ILE 49 1HG1 ILE 49 -6.999 8.878 5.519 393 HG21 ILE 49 1HG2 ILE 49 -5.708 8.819 9.004 394 HG22 ILE 49 2HG2 ILE 49 -6.599 10.339 8.939 395 HG23 ILE 49 3HG2 ILE 49 -4.836 10.346 8.887 396 HD11 ILE 49 3HD1 ILE 49 -7.787 6.919 6.681 397 HD12 ILE 49 1HD1 ILE 49 -6.965 7.427 8.156 398 HD13 ILE 49 2HD1 ILE 49 -6.025 6.980 6.733 399 H THR 50 H THR 50 -3.917 10.150 5.095 400 HA THR 50 HA THR 50 -5.002 10.969 2.501 401 HB THR 50 HB THR 50 -2.767 10.355 1.616 402 HG1 THR 50 HG1 THR 50 -1.164 10.099 3.517 403 HG21 THR 50 3HG2 THR 50 -3.175 12.651 2.364 404 HG22 THR 50 1HG2 THR 50 -1.505 12.173 2.665 405 HG23 THR 50 2HG2 THR 50 -2.664 12.216 3.994 406 H VAL 51 H VAL 51 -4.576 9.304 0.685 407 HA VAL 51 HA VAL 51 -5.825 6.833 1.318 408 HB VAL 51 HB VAL 51 -4.290 7.629 -1.166 409 HG11 VAL 51 1HG1 VAL 51 -4.405 5.199 -0.929 410 HG12 VAL 51 2HG1 VAL 51 -5.416 5.759 -2.262 411 HG13 VAL 51 3HG1 VAL 51 -6.154 5.299 -0.727 412 HG21 VAL 51 3HG2 VAL 51 -7.245 7.586 -0.582 413 HG22 VAL 51 1HG2 VAL 51 -6.509 7.977 -2.135 414 HG23 VAL 51 2HG2 VAL 51 -6.237 9.024 -0.742 415 H ARG 52 H ARG 52 -2.479 7.785 0.686 416 HA ARG 52 HA ARG 52 -1.213 5.329 0.881 417 HB2 ARG 52 2HB ARG 52 -0.030 7.364 0.263 418 HB3 ARG 52 1HB ARG 52 -0.291 8.037 1.866 419 HG2 ARG 52 2HG ARG 52 1.076 6.195 2.804 420 HG3 ARG 52 1HG ARG 52 1.413 5.663 1.155 421 HD2 ARG 52 2HD ARG 52 1.949 8.441 1.295 422 HD3 ARG 52 1HD ARG 52 2.719 7.676 2.684 423 HE ARG 52 HE ARG 52 3.155 6.456 0.075 424 HH11 ARG 52 1HH1 ARG 52 4.389 8.461 2.674 425 HH12 ARG 52 2HH1 ARG 52 6.049 8.305 2.158 426 HH21 ARG 52 1HH2 ARG 52 5.320 6.290 -0.612 427 HH22 ARG 52 2HH2 ARG 52 6.566 7.090 0.303 428 H GLU 53 H GLU 53 -2.157 7.575 3.457 429 HA GLU 53 HA GLU 53 -1.182 6.092 5.631 430 HB2 GLU 53 2HB GLU 53 -1.796 8.405 5.899 431 HB3 GLU 53 1HB GLU 53 -3.453 8.071 5.419 432 HG2 GLU 53 2HG GLU 53 -3.340 8.392 7.795 433 HG3 GLU 53 1HG GLU 53 -3.751 6.715 7.439 434 H PHE 54 H PHE 54 -4.350 6.131 4.056 435 HA PHE 54 HA PHE 54 -5.631 4.313 5.763 436 HB2 PHE 54 2HB PHE 54 -6.761 5.783 4.095 437 HB3 PHE 54 1HB PHE 54 -6.152 4.742 2.813 438 HD1 PHE 54 HD2 PHE 54 -8.134 4.580 5.962 439 HD2 PHE 54 HD1 PHE 54 -7.482 3.026 2.055 440 HE1 PHE 54 HE2 PHE 54 -10.124 3.153 6.200 441 HE2 PHE 54 HE1 PHE 54 -9.467 1.595 2.287 442 HZ PHE 54 HZ PHE 54 -10.794 1.659 4.364 443 H VAL 55 H VAL 55 -3.864 3.810 2.723 444 HA VAL 55 HA VAL 55 -4.138 1.026 2.569 445 HB VAL 55 HB VAL 55 -1.872 2.785 1.598 446 HG11 VAL 55 1HG1 VAL 55 -1.094 0.484 1.833 447 HG12 VAL 55 2HG1 VAL 55 -1.258 0.920 0.132 448 HG13 VAL 55 3HG1 VAL 55 -2.480 -0.089 0.906 449 HG21 VAL 55 3HG2 VAL 55 -4.066 3.264 0.609 450 HG22 VAL 55 1HG2 VAL 55 -4.210 1.573 0.130 451 HG23 VAL 55 2HG2 VAL 55 -2.947 2.584 -0.573 452 H ARG 56 H ARG 56 -1.723 3.026 4.225 453 HA ARG 56 HA ARG 56 0.008 1.019 5.081 454 HB2 ARG 56 2HB ARG 56 0.495 3.417 5.320 455 HB3 ARG 56 1HB ARG 56 -0.766 3.561 6.536 456 HG2 ARG 56 2HG ARG 56 0.460 2.117 8.034 457 HG3 ARG 56 1HG ARG 56 1.687 1.835 6.800 458 HD2 ARG 56 2HD ARG 56 2.572 3.450 8.297 459 HD3 ARG 56 1HD ARG 56 2.136 4.303 6.818 460 HE ARG 56 HE ARG 56 0.219 5.207 7.970 461 HH11 ARG 56 1HH1 ARG 56 2.596 3.587 9.978 462 HH12 ARG 56 2HH1 ARG 56 2.073 4.359 11.443 463 HH21 ARG 56 1HH2 ARG 56 -0.467 6.231 9.885 464 HH22 ARG 56 2HH2 ARG 56 0.353 5.894 11.386 465 H ALA 57 H ALA 57 -2.825 2.364 6.748 466 HA ALA 57 HA ALA 57 -2.681 0.785 9.053 467 HB1 ALA 57 3HB ALA 57 -5.135 1.954 7.741 468 HB2 ALA 57 1HB ALA 57 -4.072 2.787 8.879 469 HB3 ALA 57 2HB ALA 57 -5.017 1.397 9.410 470 H VAL 58 H VAL 58 -4.403 0.232 5.995 471 HA VAL 58 HA VAL 58 -5.650 -2.176 6.896 472 HB VAL 58 HB VAL 58 -5.278 -1.231 4.048 473 HG11 VAL 58 1HG1 VAL 58 -5.893 -3.574 4.178 474 HG12 VAL 58 2HG1 VAL 58 -7.257 -2.619 3.591 475 HG13 VAL 58 3HG1 VAL 58 -7.229 -3.185 5.262 476 HG21 VAL 58 3HG2 VAL 58 -6.405 0.467 5.384 477 HG22 VAL 58 1HG2 VAL 58 -7.557 -0.737 5.962 478 HG23 VAL 58 2HG2 VAL 58 -7.531 -0.290 4.255 479 H ALA 59 H ALA 59 -2.728 -1.441 5.058 480 HA ALA 59 HA ALA 59 -2.217 -4.103 4.227 481 HB1 ALA 59 3HB ALA 59 -0.288 -1.810 4.545 482 HB2 ALA 59 1HB ALA 59 -1.234 -2.177 3.103 483 HB3 ALA 59 2HB ALA 59 0.011 -3.301 3.650 484 H LYS 60 H LYS 60 -1.667 -2.436 7.221 485 HA LYS 60 HA LYS 60 0.235 -4.471 8.091 486 HB2 LYS 60 2HB LYS 60 -0.748 -1.962 9.448 487 HB3 LYS 60 1HB LYS 60 0.351 -3.112 10.199 488 HG2 LYS 60 2HG LYS 60 1.783 -2.743 8.069 489 HG3 LYS 60 1HG LYS 60 0.826 -1.271 7.900 490 HD2 LYS 60 2HD LYS 60 1.532 -0.530 10.103 491 HD3 LYS 60 1HD LYS 60 2.419 -2.038 10.348 492 HE2 LYS 60 2HE LYS 60 3.795 -1.463 8.347 493 HE3 LYS 60 1HE LYS 60 2.993 0.105 8.308 494 HZ1 LYS 60 3HZ LYS 60 4.701 -0.964 10.493 495 HZ2 LYS 60 1HZ LYS 60 3.837 0.496 10.577 496 HZ3 LYS 60 2HZ LYS 60 5.078 0.305 9.433 497 H SER 61 H SER 61 -2.849 -4.758 7.710 498 HA SER 61 HA SER 61 -3.436 -5.850 10.361 499 HB2 SER 61 2HB SER 61 -5.722 -6.169 9.564 500 HB3 SER 61 1HB SER 61 -5.206 -4.514 9.248 501 HG SER 61 HG SER 61 -4.799 -5.139 7.078 502 H GLU 62 H GLU 62 -4.007 -8.083 10.643 503 HA GLU 62 HA GLU 62 -2.514 -9.758 8.792 504 HB2 GLU 62 2HB GLU 62 -3.519 -11.395 10.829 505 HB3 GLU 62 1HB GLU 62 -1.881 -10.789 10.660 506 HG2 GLU 62 2HG GLU 62 -2.566 -10.273 12.848 507 HG3 GLU 62 1HG GLU 62 -2.608 -8.759 11.950 508 H LEU 63 H LEU 63 -4.014 -9.624 7.071 509 HA LEU 63 HA LEU 63 -6.619 -10.833 7.389 510 HB2 LEU 63 2HB LEU 63 -6.165 -8.971 5.793 511 HB3 LEU 63 1HB LEU 63 -5.152 -10.057 4.862 512 HG LEU 63 HG LEU 63 -7.118 -11.487 4.415 513 HD11 LEU 63 1HD1 LEU 63 -9.357 -10.646 4.937 514 HD12 LEU 63 2HD1 LEU 63 -8.642 -9.316 5.848 515 HD13 LEU 63 3HD1 LEU 63 -8.424 -10.978 6.397 516 HD21 LEU 63 3HD2 LEU 63 -6.487 -9.749 2.824 517 HD22 LEU 63 1HD2 LEU 63 -7.501 -8.587 3.681 518 HD23 LEU 63 2HD2 LEU 63 -8.234 -9.970 2.868 519 H TYR 64 H TYR 64 -6.800 -12.936 7.610 520 HA TYR 64 HA TYR 64 -6.618 -15.172 7.308 521 HB2 TYR 64 2HB TYR 64 -5.011 -14.376 4.881 522 HB3 TYR 64 1HB TYR 64 -5.335 -16.052 5.312 523 HD1 TYR 64 HD2 TYR 64 -7.762 -16.792 5.454 524 HD2 TYR 64 HD1 TYR 64 -6.576 -13.125 3.663 525 HE1 TYR 64 HE2 TYR 64 -9.905 -16.694 4.255 526 HE2 TYR 64 HE1 TYR 64 -8.715 -13.014 2.457 527 HH TYR 64 HH TYR 64 -11.356 -15.010 3.221 528 H LYS 65 H LYS 65 -3.469 -13.789 6.452 529 HA LYS 65 HA LYS 65 -2.232 -14.927 8.835 530 HB2 LYS 65 2HB LYS 65 -2.133 -16.629 6.916 531 HB3 LYS 65 1HB LYS 65 -1.030 -15.504 6.137 532 HG2 LYS 65 2HG LYS 65 0.040 -17.374 7.418 533 HG3 LYS 65 1HG LYS 65 0.581 -15.752 7.850 534 HD2 LYS 65 2HD LYS 65 -0.875 -15.766 9.801 535 HD3 LYS 65 1HD LYS 65 -1.489 -17.358 9.348 536 HE2 LYS 65 2HE LYS 65 0.490 -18.419 9.888 537 HE3 LYS 65 1HE LYS 65 1.442 -16.948 9.720 538 HZ1 LYS 65 3HZ LYS 65 1.193 -17.634 12.033 539 HZ2 LYS 65 1HZ LYS 65 -0.492 -17.493 11.912 540 HZ3 LYS 65 2HZ LYS 65 0.489 -16.112 11.765 541 H GLU 66 H GLU 66 -0.338 -13.845 9.385 542 HA GLU 66 HA GLU 66 -0.312 -11.147 9.047 543 HB2 GLU 66 2HB GLU 66 2.100 -12.893 9.572 544 HB3 GLU 66 1HB GLU 66 2.023 -11.164 9.862 545 HG2 GLU 66 2HG GLU 66 1.683 -12.076 11.957 546 HG3 GLU 66 1HG GLU 66 0.051 -11.708 11.407 547 H LYS 67 H LYS 67 -0.439 -10.233 7.064 548 HA LYS 67 HA LYS 67 0.286 -9.308 5.115 549 HB2 LYS 67 2HB LYS 67 2.419 -9.045 6.448 550 HB3 LYS 67 1HB LYS 67 2.981 -10.540 5.717 551 HG2 LYS 67 2HG LYS 67 3.916 -8.628 4.578 552 HG3 LYS 67 1HG LYS 67 2.830 -9.511 3.503 553 HD2 LYS 67 2HD LYS 67 1.065 -7.881 3.936 554 HD3 LYS 67 1HD LYS 67 2.129 -7.008 5.041 555 HE2 LYS 67 2HE LYS 67 2.666 -7.461 2.111 556 HE3 LYS 67 1HE LYS 67 2.012 -5.976 2.801 557 HZ1 LYS 67 3HZ LYS 67 4.419 -5.872 2.401 558 HZ2 LYS 67 1HZ LYS 67 4.666 -7.148 3.488 559 HZ3 LYS 67 2HZ LYS 67 4.042 -5.673 4.037 560 H PHE 68 H PHE 68 -0.890 -11.934 5.227 561 HA PHE 68 HA PHE 68 -1.386 -13.721 3.929 562 HB2 PHE 68 2HB PHE 68 0.073 -12.065 1.875 563 HB3 PHE 68 1HB PHE 68 -0.661 -13.620 1.489 564 HD1 PHE 68 HD2 PHE 68 -3.153 -13.690 2.792 565 HD2 PHE 68 HD1 PHE 68 -1.201 -10.333 1.050 566 HE1 PHE 68 HE2 PHE 68 -5.332 -12.598 2.483 567 HE2 PHE 68 HE1 PHE 68 -3.382 -9.228 0.738 568 HZ PHE 68 HZ PHE 68 -5.447 -10.362 1.451 569 H LEU 69 H LEU 69 0.766 -13.762 5.614 570 HA LEU 69 HA LEU 69 3.131 -14.900 4.726 571 HB2 LEU 69 2HB LEU 69 2.788 -13.988 6.926 572 HB3 LEU 69 1HB LEU 69 1.559 -15.184 7.280 573 HG LEU 69 HG LEU 69 3.312 -16.938 7.232 574 HD11 LEU 69 1HD1 LEU 69 5.661 -16.269 7.302 575 HD12 LEU 69 2HD1 LEU 69 5.200 -14.591 7.014 576 HD13 LEU 69 3HD1 LEU 69 4.922 -15.806 5.768 577 HD21 LEU 69 3HD2 LEU 69 2.512 -15.621 9.250 578 HD22 LEU 69 1HD2 LEU 69 4.022 -14.720 9.123 579 HD23 LEU 69 2HD2 LEU 69 4.060 -16.463 9.411 580 H TYR 70 H TYR 70 3.873 -17.035 4.657 581 HA TYR 70 HA TYR 70 1.944 -19.204 4.961 582 HB2 TYR 70 2HB TYR 70 1.833 -18.820 2.591 583 HB3 TYR 70 1HB TYR 70 3.586 -18.712 2.467 584 HD1 TYR 70 HD2 TYR 70 1.044 -21.179 3.716 585 HD2 TYR 70 HD1 TYR 70 4.640 -20.524 1.542 586 HE1 TYR 70 HE2 TYR 70 1.180 -23.586 3.223 587 HE2 TYR 70 HE1 TYR 70 4.787 -22.925 1.047 588 HH TYR 70 HH TYR 70 2.225 -25.079 1.538 589 H GLY 71 H GLY 71 5.290 -18.175 4.542 590 HA2 GLY 71 2HA GLY 71 7.109 -18.912 5.834 591 HA3 GLY 71 1HA GLY 71 6.143 -20.281 6.372 592 H ASN 72 H ASN 72 8.825 -20.403 5.423 593 HA ASN 72 HA ASN 72 10.123 -21.766 4.153 594 HB2 ASN 72 2HB ASN 72 8.287 -23.443 4.452 595 HB3 ASN 72 1HB ASN 72 7.559 -22.853 2.963 596 HD21 ASN 72 1HD2 ASN 72 8.588 -23.277 0.990 597 HD22 ASN 72 2HD2 ASN 72 9.800 -24.504 0.835 598 H PHE 73 H PHE 73 7.409 -21.192 1.906 599 HA PHE 73 HA PHE 73 9.279 -20.154 -0.070 600 HB2 PHE 73 2HB PHE 73 6.283 -20.586 -0.204 601 HB3 PHE 73 1HB PHE 73 7.269 -20.012 -1.541 602 HD1 PHE 73 HD2 PHE 73 9.192 -21.554 -2.303 603 HD2 PHE 73 HD1 PHE 73 5.909 -22.852 0.074 604 HE1 PHE 73 HE2 PHE 73 9.613 -23.879 -2.996 605 HE2 PHE 73 HE1 PHE 73 6.319 -25.177 -0.619 606 HZ PHE 73 HZ PHE 73 8.177 -25.692 -2.157 607 H GLN 74 H GLN 74 9.649 -18.421 1.711 608 HA GLN 74 HA GLN 74 7.648 -16.486 2.196 609 HB2 GLN 74 2HB GLN 74 9.690 -16.885 3.612 610 HB3 GLN 74 1HB GLN 74 10.630 -16.047 2.384 611 HG2 GLN 74 2HG GLN 74 10.141 -14.500 4.124 612 HG3 GLN 74 1HG GLN 74 9.181 -14.059 2.713 613 HE21 GLN 74 1HE2 GLN 74 8.709 -13.359 5.455 614 HE22 GLN 74 2HE2 GLN 74 7.161 -13.994 5.879 615 H THR 75 H THR 75 9.905 -16.920 -0.390 616 HA THR 75 HA THR 75 10.035 -14.347 -1.446 617 HB THR 75 HB THR 75 10.421 -15.498 -3.649 618 HG1 THR 75 HG1 THR 75 9.506 -17.413 -3.737 619 HG21 THR 75 3HG2 THR 75 11.964 -16.585 -1.291 620 HG22 THR 75 1HG2 THR 75 12.258 -15.041 -2.091 621 HG23 THR 75 2HG2 THR 75 12.522 -16.552 -2.963 622 H ARG 76 H ARG 76 7.488 -16.731 -1.545 623 HA ARG 76 HA ARG 76 5.973 -15.603 -3.654 624 HB2 ARG 76 2HB ARG 76 5.634 -17.896 -2.892 625 HB3 ARG 76 1HB ARG 76 5.105 -17.317 -1.319 626 HG2 ARG 76 2HG ARG 76 3.073 -16.558 -2.136 627 HG3 ARG 76 1HG ARG 76 3.653 -16.489 -3.802 628 HD2 ARG 76 2HD ARG 76 3.198 -19.006 -2.201 629 HD3 ARG 76 1HD ARG 76 2.118 -18.374 -3.444 630 HE ARG 76 HE ARG 76 4.748 -18.701 -4.463 631 HH11 ARG 76 1HH1 ARG 76 1.895 -20.552 -3.579 632 HH12 ARG 76 2HH1 ARG 76 2.246 -21.837 -4.700 633 HH21 ARG 76 1HH2 ARG 76 5.187 -20.369 -5.922 634 HH22 ARG 76 2HH2 ARG 76 4.113 -21.733 -6.028 635 H VAL 77 H VAL 77 6.051 -15.075 -0.177 636 HA VAL 77 HA VAL 77 3.821 -13.330 -0.020 637 HB VAL 77 HB VAL 77 6.252 -13.426 1.787 638 HG11 VAL 77 1HG1 VAL 77 4.930 -11.424 2.146 639 HG12 VAL 77 2HG1 VAL 77 4.720 -12.540 3.499 640 HG13 VAL 77 3HG1 VAL 77 3.461 -12.394 2.272 641 HG21 VAL 77 3HG2 VAL 77 3.646 -14.929 1.990 642 HG22 VAL 77 1HG2 VAL 77 4.944 -14.942 3.185 643 HG23 VAL 77 2HG2 VAL 77 5.214 -15.623 1.580 644 H ILE 78 H ILE 78 7.213 -12.903 -0.751 645 HA ILE 78 HA ILE 78 7.264 -10.076 -0.784 646 HB ILE 78 HB ILE 78 8.948 -12.005 -2.396 647 HG12 ILE 78 2HG1 ILE 78 9.489 -10.733 0.296 648 HG13 ILE 78 1HG1 ILE 78 9.049 -12.420 0.043 649 HG21 ILE 78 1HG2 ILE 78 9.046 -9.733 -3.261 650 HG22 ILE 78 2HG2 ILE 78 10.573 -10.174 -2.496 651 HG23 ILE 78 3HG2 ILE 78 9.435 -9.123 -1.653 652 HD11 ILE 78 3HD1 ILE 78 11.109 -12.770 -1.211 653 HD12 ILE 78 1HD1 ILE 78 11.438 -12.162 0.411 654 HD13 ILE 78 2HD1 ILE 78 11.545 -11.076 -0.976 655 H GLU 79 H GLU 79 6.616 -12.512 -3.293 656 HA GLU 79 HA GLU 79 6.255 -10.733 -5.436 657 HB2 GLU 79 2HB GLU 79 4.956 -13.423 -4.969 658 HB3 GLU 79 1HB GLU 79 4.986 -12.563 -6.501 659 HG2 GLU 79 2HG GLU 79 7.449 -12.710 -6.506 660 HG3 GLU 79 1HG GLU 79 7.372 -13.637 -5.008 661 H LEU 80 H LEU 80 4.040 -11.908 -2.959 662 HA LEU 80 HA LEU 80 1.664 -10.818 -3.994 663 HB2 LEU 80 2HB LEU 80 2.465 -11.301 -1.120 664 HB3 LEU 80 1HB LEU 80 0.834 -10.956 -1.660 665 HG LEU 80 HG LEU 80 2.439 -13.384 -2.461 666 HD11 LEU 80 1HD1 LEU 80 0.896 -14.617 -1.016 667 HD12 LEU 80 2HD1 LEU 80 0.166 -13.096 -0.502 668 HD13 LEU 80 3HD1 LEU 80 1.848 -13.446 -0.104 669 HD21 LEU 80 3HD2 LEU 80 -0.440 -12.644 -2.966 670 HD22 LEU 80 1HD2 LEU 80 0.306 -14.191 -3.364 671 HD23 LEU 80 2HD2 LEU 80 0.845 -12.717 -4.170 672 H ASN 81 H ASN 81 4.160 -9.464 -1.894 673 HA ASN 81 HA ASN 81 3.057 -6.973 -1.314 674 HB2 ASN 81 2HB ASN 81 5.822 -8.025 -1.599 675 HB3 ASN 81 1HB ASN 81 5.632 -6.280 -1.667 676 HD21 ASN 81 1HD2 ASN 81 5.496 -9.104 0.310 677 HD22 ASN 81 2HD2 ASN 81 5.381 -8.278 1.826 678 H TYR 82 H TYR 82 5.163 -7.878 -4.012 679 HA TYR 82 HA TYR 82 5.182 -5.310 -5.167 680 HB2 TYR 82 2HB TYR 82 6.030 -8.029 -6.124 681 HB3 TYR 82 1HB TYR 82 6.096 -6.632 -7.196 682 HD1 TYR 82 HD2 TYR 82 7.022 -7.356 -3.642 683 HD2 TYR 82 HD1 TYR 82 8.179 -5.671 -7.371 684 HE1 TYR 82 HE2 TYR 82 9.168 -6.683 -2.662 685 HE2 TYR 82 HE1 TYR 82 10.334 -4.991 -6.397 686 HH TYR 82 HH TYR 82 11.435 -4.662 -4.413 687 H LYS 83 H LYS 83 3.110 -8.102 -5.692 688 HA LYS 83 HA LYS 83 2.005 -7.046 -8.109 689 HB2 LYS 83 2HB LYS 83 2.025 -9.473 -7.621 690 HB3 LYS 83 1HB LYS 83 0.868 -9.201 -6.320 691 HG2 LYS 83 2HG LYS 83 -0.754 -8.352 -7.937 692 HG3 LYS 83 1HG LYS 83 0.407 -8.613 -9.237 693 HD2 LYS 83 2HD LYS 83 0.415 -11.029 -8.675 694 HD3 LYS 83 1HD LYS 83 -0.853 -10.718 -7.486 695 HE2 LYS 83 2HE LYS 83 -2.300 -9.852 -9.264 696 HE3 LYS 83 1HE LYS 83 -1.034 -10.171 -10.447 697 HZ1 LYS 83 3HZ LYS 83 -2.600 -11.940 -10.519 698 HZ2 LYS 83 1HZ LYS 83 -2.520 -12.174 -8.844 699 HZ3 LYS 83 2HZ LYS 83 -1.184 -12.548 -9.812 700 H HIS 84 H HIS 84 0.821 -7.208 -4.731 701 HA HIS 84 HA HIS 84 -1.632 -5.910 -5.626 702 HB2 HIS 84 2HB HIS 84 -1.503 -7.948 -4.034 703 HB3 HIS 84 1HB HIS 84 -1.126 -6.757 -2.793 704 HD1 HIS 84 HD1 HIS 84 -3.041 -5.110 -2.113 705 HD2 HIS 84 HD2 HIS 84 -4.142 -7.959 -4.930 706 HE1 HIS 84 HE1 HIS 84 -5.553 -5.032 -2.210 707 HE2 HIS 84 HE2 HIS 84 -6.188 -6.662 -4.025 708 H LEU 85 H LEU 85 1.266 -5.073 -3.887 709 HA LEU 85 HA LEU 85 -0.023 -2.610 -2.939 710 HB2 LEU 85 2HB LEU 85 2.653 -3.810 -2.234 711 HB3 LEU 85 1HB LEU 85 2.069 -2.273 -1.629 712 HG LEU 85 HG LEU 85 0.835 -4.975 -1.089 713 HD11 LEU 85 1HD1 LEU 85 2.934 -4.605 0.097 714 HD12 LEU 85 2HD1 LEU 85 1.562 -4.582 1.206 715 HD13 LEU 85 3HD1 LEU 85 2.322 -3.069 0.712 716 HD21 LEU 85 3HD2 LEU 85 -0.638 -3.761 0.448 717 HD22 LEU 85 1HD2 LEU 85 -0.871 -3.238 -1.220 718 HD23 LEU 85 2HD2 LEU 85 0.051 -2.233 -0.101 719 H LEU 86 H LEU 86 2.821 -3.694 -4.771 720 HA LEU 86 HA LEU 86 3.461 -0.952 -5.455 721 HB2 LEU 86 2HB LEU 86 4.791 -3.520 -6.315 722 HB3 LEU 86 1HB LEU 86 5.399 -1.904 -6.622 723 HG LEU 86 HG LEU 86 5.119 -3.230 -3.923 724 HD11 LEU 86 1HD1 LEU 86 6.984 -4.072 -5.215 725 HD12 LEU 86 2HD1 LEU 86 7.564 -3.056 -3.895 726 HD13 LEU 86 3HD1 LEU 86 7.529 -2.427 -5.542 727 HD21 LEU 86 3HD2 LEU 86 6.119 -0.474 -4.628 728 HD22 LEU 86 1HD2 LEU 86 6.214 -1.228 -3.037 729 HD23 LEU 86 2HD2 LEU 86 4.641 -0.855 -3.743 730 H GLY 87 H GLY 87 1.891 -3.690 -6.883 731 HA2 GLY 87 2HA GLY 87 0.515 -3.749 -8.736 732 HA3 GLY 87 1HA GLY 87 0.893 -2.056 -9.024 733 H ARG 88 H ARG 88 3.407 -4.455 -8.673 734 HA ARG 88 HA ARG 88 3.775 -4.786 -11.516 735 HB2 ARG 88 2HB ARG 88 4.694 -2.553 -11.246 736 HB3 ARG 88 1HB ARG 88 5.682 -3.088 -9.896 737 HG2 ARG 88 2HG ARG 88 7.004 -2.811 -11.911 738 HG3 ARG 88 1HG ARG 88 6.989 -4.495 -11.393 739 HD2 ARG 88 2HD ARG 88 5.421 -5.078 -13.093 740 HD3 ARG 88 1HD ARG 88 5.153 -3.384 -13.501 741 HE ARG 88 HE ARG 88 7.254 -3.321 -14.564 742 HH11 ARG 88 1HH1 ARG 88 6.572 -6.481 -13.250 743 HH12 ARG 88 2HH1 ARG 88 7.694 -7.305 -14.288 744 HH21 ARG 88 1HH2 ARG 88 8.717 -4.380 -15.945 745 HH22 ARG 88 2HH2 ARG 88 8.916 -6.107 -15.824 746 H ALA 89 H ALA 89 4.792 -6.666 -11.902 747 HA ALA 89 HA ALA 89 5.600 -8.412 -9.841 748 HB1 ALA 89 3HB ALA 89 4.824 -9.228 -11.997 749 HB2 ALA 89 1HB ALA 89 6.447 -9.832 -11.669 750 HB3 ALA 89 2HB ALA 89 6.214 -8.499 -12.799 751 HA PRO 90 HA PRO 90 9.727 -7.318 -8.770 752 HB2 PRO 90 2HB PRO 90 10.456 -10.164 -9.254 753 HB3 PRO 90 1HB PRO 90 10.691 -9.169 -7.812 754 HG2 PRO 90 2HG PRO 90 8.785 -11.015 -7.875 755 HG3 PRO 90 1HG PRO 90 8.496 -9.444 -7.105 756 HD2 PRO 90 2HD PRO 90 7.581 -10.448 -9.768 757 HD3 PRO 90 1HD PRO 90 6.720 -9.443 -8.586 758 H TYR 91 H TYR 91 11.756 -6.883 -9.604 759 HA TYR 91 HA TYR 91 11.952 -7.237 -12.512 760 HB2 TYR 91 2HB TYR 91 13.318 -5.300 -10.639 761 HB3 TYR 91 1HB TYR 91 13.672 -5.418 -12.357 762 HD1 TYR 91 HD1 TYR 91 11.157 -4.404 -9.871 763 HD2 TYR 91 HD2 TYR 91 12.161 -4.543 -14.002 764 HE1 TYR 91 HE1 TYR 91 9.344 -2.818 -10.361 765 HE2 TYR 91 HE2 TYR 91 10.347 -2.963 -14.502 766 HH TYR 91 HH TYR 91 8.583 -1.330 -11.977 767 H ASP 92 H ASP 92 14.175 -7.215 -9.694 768 HA ASP 92 HA ASP 92 15.703 -9.312 -11.089 769 HB2 ASP 92 2HB ASP 92 17.795 -8.271 -10.688 770 HB3 ASP 92 1HB ASP 92 16.756 -7.031 -11.373 771 H GLU 93 H GLU 93 17.751 -9.536 -9.126 772 HA GLU 93 HA GLU 93 16.227 -11.212 -7.307 773 HB2 GLU 93 2HB GLU 93 18.226 -12.021 -8.590 774 HB3 GLU 93 1HB GLU 93 19.222 -10.976 -7.589 775 HG2 GLU 93 2HG GLU 93 19.386 -13.135 -6.667 776 HG3 GLU 93 1HG GLU 93 18.331 -12.217 -5.593 777 H SER 94 H SER 94 18.176 -8.294 -7.151 778 HA SER 94 HA SER 94 18.979 -8.517 -4.455 779 HB2 SER 94 2HB SER 94 19.511 -6.107 -4.612 780 HB3 SER 94 1HB SER 94 20.119 -7.013 -5.995 781 HG SER 94 HG SER 94 18.420 -6.231 -7.238 782 H GLU 95 H GLU 95 16.104 -7.190 -5.935 783 HA GLU 95 HA GLU 95 15.097 -5.845 -3.663 784 HB2 GLU 95 2HB GLU 95 12.915 -5.963 -4.881 785 HB3 GLU 95 1HB GLU 95 14.235 -5.299 -5.836 786 HG2 GLU 95 2HG GLU 95 14.523 -7.610 -6.806 787 HG3 GLU 95 1HG GLU 95 12.999 -8.026 -6.025 788 H VAL 96 H VAL 96 14.750 -9.135 -4.870 789 HA VAL 96 HA VAL 96 12.850 -10.012 -2.964 790 HB VAL 96 HB VAL 96 14.931 -11.652 -4.430 791 HG11 VAL 96 1HG1 VAL 96 13.988 -12.863 -2.553 792 HG12 VAL 96 2HG1 VAL 96 13.370 -13.523 -4.068 793 HG13 VAL 96 3HG1 VAL 96 12.356 -12.465 -3.088 794 HG21 VAL 96 3HG2 VAL 96 13.154 -12.101 -6.057 795 HG22 VAL 96 1HG2 VAL 96 13.543 -10.383 -5.979 796 HG23 VAL 96 2HG2 VAL 96 12.087 -10.996 -5.192 797 H ILE 97 H ILE 97 16.381 -10.259 -3.136 798 HA ILE 97 HA ILE 97 16.863 -11.540 -0.709 799 HB ILE 97 HB ILE 97 18.575 -9.453 -2.069 800 HG12 ILE 97 2HG1 ILE 97 18.626 -12.472 -2.285 801 HG13 ILE 97 1HG1 ILE 97 17.972 -11.383 -3.504 802 HG21 ILE 97 1HG2 ILE 97 19.239 -9.838 0.255 803 HG22 ILE 97 2HG2 ILE 97 20.442 -10.469 -0.869 804 HG23 ILE 97 3HG2 ILE 97 19.331 -11.571 -0.058 805 HD11 ILE 97 3HD1 ILE 97 20.834 -11.493 -2.590 806 HD12 ILE 97 1HD1 ILE 97 20.182 -10.417 -3.827 807 HD13 ILE 97 2HD1 ILE 97 20.194 -12.161 -4.091 808 H PHE 98 H PHE 98 16.508 -8.104 -1.458 809 HA PHE 98 HA PHE 98 17.108 -6.986 1.003 810 HB2 PHE 98 2HB PHE 98 16.764 -5.592 -0.935 811 HB3 PHE 98 1HB PHE 98 15.089 -6.114 -1.075 812 HD1 PHE 98 HD1 PHE 98 17.405 -4.389 1.275 813 HD2 PHE 98 HD2 PHE 98 13.418 -4.835 -0.143 814 HE1 PHE 98 HE1 PHE 98 16.698 -2.497 2.678 815 HE2 PHE 98 HE2 PHE 98 12.704 -2.944 1.256 816 HZ PHE 98 HZ PHE 98 14.344 -1.772 2.670 817 H HIS 99 H HIS 99 13.917 -8.121 -0.146 818 HA HIS 99 HA HIS 99 12.601 -7.396 2.274 819 HB2 HIS 99 2HB HIS 99 11.803 -9.151 -0.034 820 HB3 HIS 99 1HB HIS 99 10.777 -8.963 1.384 821 HD1 HIS 99 HD1 HIS 99 9.241 -7.002 1.407 822 HD2 HIS 99 HD2 HIS 99 12.285 -6.608 -1.413 823 HE1 HIS 99 HE1 HIS 99 8.701 -4.920 0.102 824 HE2 HIS 99 HE2 HIS 99 10.439 -4.831 -1.728 825 H LEU 100 H LEU 100 14.236 -10.302 1.192 826 HA LEU 100 HA LEU 100 13.326 -12.008 3.259 827 HB2 LEU 100 2HB LEU 100 15.897 -12.026 1.679 828 HB3 LEU 100 1HB LEU 100 15.414 -13.304 2.778 829 HG LEU 100 HG LEU 100 13.850 -12.479 0.331 830 HD11 LEU 100 1HD1 LEU 100 15.996 -13.442 -0.299 831 HD12 LEU 100 2HD1 LEU 100 14.677 -14.556 -0.662 832 HD13 LEU 100 3HD1 LEU 100 15.696 -14.826 0.752 833 HD21 LEU 100 3HD2 LEU 100 12.644 -14.577 0.715 834 HD22 LEU 100 1HD2 LEU 100 12.470 -13.467 2.075 835 HD23 LEU 100 2HD2 LEU 100 13.574 -14.838 2.191 836 H ASP 101 H ASP 101 16.281 -10.062 2.931 837 HA ASP 101 HA ASP 101 17.307 -10.592 5.506 838 HB2 ASP 101 2HB ASP 101 18.626 -9.654 3.613 839 HB3 ASP 101 1HB ASP 101 17.752 -8.137 3.789 840 H LEU 102 H LEU 102 15.193 -8.091 4.254 841 HA LEU 102 HA LEU 102 14.989 -6.480 6.538 842 HB2 LEU 102 2HB LEU 102 14.231 -5.845 4.282 843 HB3 LEU 102 1HB LEU 102 12.944 -7.027 4.385 844 HG LEU 102 HG LEU 102 11.954 -5.751 6.261 845 HD11 LEU 102 1HD1 LEU 102 14.073 -3.713 5.595 846 HD12 LEU 102 2HD1 LEU 102 14.013 -4.688 7.064 847 HD13 LEU 102 3HD1 LEU 102 12.744 -3.508 6.735 848 HD21 LEU 102 3HD2 LEU 102 11.187 -5.406 3.975 849 HD22 LEU 102 1HD2 LEU 102 12.431 -4.178 3.734 850 HD23 LEU 102 2HD2 LEU 102 11.131 -3.902 4.893 851 H TYR 103 H TYR 103 13.147 -9.320 5.500 852 HA TYR 103 HA TYR 103 11.281 -9.213 7.643 853 HB2 TYR 103 2HB TYR 103 10.741 -10.386 5.569 854 HB3 TYR 103 1HB TYR 103 12.052 -11.527 5.853 855 HD1 TYR 103 HD2 TYR 103 8.892 -10.283 7.394 856 HD2 TYR 103 HD1 TYR 103 11.623 -13.517 6.975 857 HE1 TYR 103 HE2 TYR 103 7.365 -11.730 8.667 858 HE2 TYR 103 HE1 TYR 103 10.106 -14.970 8.250 859 HH TYR 103 HH TYR 103 8.318 -14.766 9.888 860 H GLU 104 H GLU 104 14.415 -10.733 7.218 861 HA GLU 104 HA GLU 104 14.258 -12.383 9.525 862 HB2 GLU 104 2HB GLU 104 16.644 -11.317 8.010 863 HB3 GLU 104 1HB GLU 104 16.765 -12.465 9.335 864 HG2 GLU 104 2HG GLU 104 15.336 -14.025 8.043 865 HG3 GLU 104 1HG GLU 104 15.396 -12.892 6.692 866 H ASN 105 H ASN 105 15.549 -9.131 8.953 867 HA ASN 105 HA ASN 105 16.533 -8.958 11.663 868 HB2 ASN 105 2HB ASN 105 16.488 -6.924 9.432 869 HB3 ASN 105 1HB ASN 105 17.225 -6.651 11.007 870 HD21 ASN 105 1HD2 ASN 105 18.493 -6.595 8.442 871 HD22 ASN 105 2HD2 ASN 105 19.726 -7.807 8.464 872 H GLU 106 H GLU 106 14.118 -7.085 9.775 873 HA GLU 106 HA GLU 106 13.212 -5.973 12.335 874 HB2 GLU 106 2HB GLU 106 12.654 -4.950 9.550 875 HB3 GLU 106 1HB GLU 106 12.235 -4.152 11.061 876 HG2 GLU 106 2HG GLU 106 14.728 -4.174 11.568 877 HG3 GLU 106 1HG GLU 106 14.950 -4.582 9.869 878 H GLY 107 H GLY 107 12.051 -7.673 9.468 879 HA2 GLY 107 2HA GLY 107 10.407 -9.416 9.916 880 HA3 GLY 107 1HA GLY 107 9.648 -8.322 11.060 881 H PHE 108 H PHE 108 7.785 -9.110 9.720 882 HA PHE 108 HA PHE 108 7.525 -8.272 7.025 883 HB2 PHE 108 2HB PHE 108 5.183 -8.992 7.231 884 HB3 PHE 108 1HB PHE 108 6.293 -10.201 7.865 885 HD1 PHE 108 HD1 PHE 108 6.462 -10.565 10.301 886 HD2 PHE 108 HD2 PHE 108 3.593 -7.906 8.623 887 HE1 PHE 108 HE1 PHE 108 5.196 -10.607 12.409 888 HE2 PHE 108 HE2 PHE 108 2.321 -7.940 10.731 889 HZ PHE 108 HZ PHE 108 3.123 -9.293 12.627 890 H ASP 109 H ASP 109 7.060 -6.652 10.018 891 HA ASP 109 HA ASP 109 5.077 -4.798 9.245 892 HB2 ASP 109 2HB ASP 109 5.887 -5.211 11.604 893 HB3 ASP 109 1HB ASP 109 7.323 -4.274 11.201 894 H ALA 110 H ALA 110 8.623 -4.616 9.220 895 HA ALA 110 HA ALA 110 8.737 -2.088 7.920 896 HB1 ALA 110 3HB ALA 110 10.849 -4.235 8.152 897 HB2 ALA 110 1HB ALA 110 10.596 -2.899 9.275 898 HB3 ALA 110 2HB ALA 110 11.124 -2.575 7.623 899 H ASP 111 H ASP 111 8.591 -5.410 6.858 900 HA ASP 111 HA ASP 111 9.200 -5.124 4.155 901 HB2 ASP 111 2HB ASP 111 8.902 -7.320 5.060 902 HB3 ASP 111 1HB ASP 111 7.262 -6.953 5.586 903 H ILE 112 H ILE 112 6.290 -4.356 5.943 904 HA ILE 112 HA ILE 112 4.692 -3.706 3.658 905 HB ILE 112 HB ILE 112 4.345 -2.821 6.531 906 HG12 ILE 112 2HG1 ILE 112 3.030 -5.147 5.116 907 HG13 ILE 112 1HG1 ILE 112 4.437 -5.311 6.160 908 HG21 ILE 112 1HG2 ILE 112 2.395 -2.892 4.230 909 HG22 ILE 112 2HG2 ILE 112 3.059 -1.453 5.003 910 HG23 ILE 112 3HG2 ILE 112 1.981 -2.520 5.903 911 HD11 ILE 112 3HD1 ILE 112 1.734 -4.289 6.990 912 HD12 ILE 112 1HD1 ILE 112 3.144 -4.454 8.036 913 HD13 ILE 112 2HD1 ILE 112 2.398 -5.888 7.332 914 H ASP 113 H ASP 113 6.661 -1.891 5.959 915 HA ASP 113 HA ASP 113 5.980 0.685 5.066 916 HB2 ASP 113 2HB ASP 113 8.094 -0.445 6.800 917 HB3 ASP 113 1HB ASP 113 8.415 1.139 6.102 918 H SER 114 H SER 114 8.027 -1.663 3.645 919 HA SER 114 HA SER 114 9.892 -0.190 2.258 920 HB2 SER 114 2HB SER 114 8.288 -2.527 1.197 921 HB3 SER 114 1HB SER 114 9.817 -1.949 0.539 922 HG SER 114 HG SER 114 9.591 -2.704 3.252 923 H TYR 115 H TYR 115 6.462 -0.612 1.486 924 HA TYR 115 HA TYR 115 6.608 0.899 -0.955 925 HB2 TYR 115 2HB TYR 115 4.892 -0.761 -0.805 926 HB3 TYR 115 1HB TYR 115 4.306 -0.112 0.720 927 HD1 TYR 115 HD1 TYR 115 4.622 0.707 -2.898 928 HD2 TYR 115 HD2 TYR 115 2.568 1.448 0.754 929 HE1 TYR 115 HE1 TYR 115 2.974 2.073 -4.109 930 HE2 TYR 115 HE2 TYR 115 0.913 2.812 -0.446 931 HH TYR 115 HH TYR 115 0.598 2.813 -3.792 932 H ILE 116 H ILE 116 6.084 1.576 2.385 933 HA ILE 116 HA ILE 116 4.739 4.099 1.958 934 HB ILE 116 HB ILE 116 5.791 3.027 4.572 935 HG12 ILE 116 2HG1 ILE 116 3.082 2.445 3.358 936 HG13 ILE 116 1HG1 ILE 116 4.428 1.311 3.333 937 HG21 ILE 116 1HG2 ILE 116 5.004 5.331 4.605 938 HG22 ILE 116 2HG2 ILE 116 3.908 4.290 5.514 939 HG23 ILE 116 3HG2 ILE 116 3.471 4.829 3.893 940 HD11 ILE 116 3HD1 ILE 116 3.095 2.404 5.797 941 HD12 ILE 116 1HD1 ILE 116 4.428 1.250 5.767 942 HD13 ILE 116 2HD1 ILE 116 2.855 0.799 5.111 943 H ASP 117 H ASP 117 7.951 2.994 2.216 944 HA ASP 117 HA ASP 117 8.961 5.546 3.201 945 HB2 ASP 117 2HB ASP 117 9.865 3.333 4.008 946 HB3 ASP 117 1HB ASP 117 10.559 3.107 2.406 947 H SER 118 H SER 118 8.052 4.338 0.280 948 HA SER 118 HA SER 118 10.140 5.810 -1.177 949 HB2 SER 118 2HB SER 118 8.179 3.766 -2.250 950 HB3 SER 118 1HB SER 118 9.512 4.504 -3.138 951 HG SER 118 HG SER 118 9.588 2.611 -1.052 952 HA PRO 119 HA PRO 119 6.550 8.672 -1.245 953 HB2 PRO 119 2HB PRO 119 8.046 10.887 -1.842 954 HB3 PRO 119 1HB PRO 119 7.774 10.289 -0.203 955 HG2 PRO 119 2HG PRO 119 10.140 9.911 -1.991 956 HG3 PRO 119 1HG PRO 119 10.089 10.230 -0.246 957 HD2 PRO 119 2HD PRO 119 10.538 7.763 -1.253 958 HD3 PRO 119 1HD PRO 119 9.666 8.022 0.271 959 H GLU 120 H GLU 120 9.231 8.823 -3.572 960 HA GLU 120 HA GLU 120 7.845 10.022 -5.673 961 HB2 GLU 120 2HB GLU 120 9.607 8.889 -7.120 962 HB3 GLU 120 1HB GLU 120 10.192 9.949 -5.847 963 HG2 GLU 120 2HG GLU 120 10.735 8.060 -4.458 964 HG3 GLU 120 1HG GLU 120 10.019 6.955 -5.628 965 H TYR 121 H TYR 121 8.331 6.581 -4.956 966 HA TYR 121 HA TYR 121 7.055 5.599 -7.251 967 HB2 TYR 121 2HB TYR 121 8.546 4.302 -5.663 968 HB3 TYR 121 1HB TYR 121 7.159 4.188 -4.585 969 HD1 TYR 121 HD2 TYR 121 8.467 3.214 -7.893 970 HD2 TYR 121 HD1 TYR 121 5.402 2.624 -5.002 971 HE1 TYR 121 HE2 TYR 121 7.702 1.230 -9.119 972 HE2 TYR 121 HE1 TYR 121 4.627 0.634 -6.224 973 HH TYR 121 HH TYR 121 4.725 -0.335 -8.435 974 H THR 122 H THR 122 5.822 6.265 -3.984 975 HA THR 122 HA THR 122 3.194 5.350 -4.446 976 HB THR 122 HB THR 122 4.015 7.542 -2.532 977 HG1 THR 122 HG1 THR 122 4.398 4.771 -2.483 978 HG21 THR 122 3HG2 THR 122 2.092 6.754 -1.223 979 HG22 THR 122 1HG2 THR 122 1.720 5.579 -2.485 980 HG23 THR 122 2HG2 THR 122 1.599 7.306 -2.825 981 H ASN 123 H ASN 123 4.708 8.529 -4.808 982 HA ASN 123 HA ASN 123 2.338 9.964 -5.324 983 HB2 ASN 123 2HB ASN 123 4.488 10.992 -4.635 984 HB3 ASN 123 1HB ASN 123 5.147 10.625 -6.224 985 HD21 ASN 123 1HD2 ASN 123 1.830 11.668 -5.718 986 HD22 ASN 123 2HD2 ASN 123 2.025 13.223 -6.464 987 H SER 124 H SER 124 4.626 8.331 -7.486 988 HA SER 124 HA SER 124 3.290 9.192 -9.868 989 HB2 SER 124 2HB SER 124 5.197 6.873 -9.479 990 HB3 SER 124 1HB SER 124 4.744 7.604 -11.019 991 HG SER 124 HG SER 124 5.585 9.605 -9.624 992 H PHE 125 H PHE 125 3.166 6.311 -7.826 993 HA PHE 125 HA PHE 125 1.589 4.791 -9.667 994 HB2 PHE 125 2HB PHE 125 3.117 3.718 -8.078 995 HB3 PHE 125 1HB PHE 125 2.168 4.335 -6.732 996 HD1 PHE 125 HD2 PHE 125 1.674 2.332 -9.842 997 HD2 PHE 125 HD1 PHE 125 0.697 2.900 -5.741 998 HE1 PHE 125 HE2 PHE 125 0.291 0.299 -9.892 999 HE2 PHE 125 HE1 PHE 125 -0.682 0.867 -5.784 1000 HZ PHE 125 HZ PHE 125 -0.888 -0.435 -7.863 1001 H GLY 126 H GLY 126 0.891 6.699 -6.771 1002 HA2 GLY 126 2HA GLY 126 -1.461 7.748 -7.257 1003 HA3 GLY 126 1HA GLY 126 -1.957 6.075 -7.048 1004 H ASP 127 H ASP 127 -0.307 8.760 -5.439 1005 HA ASP 127 HA ASP 127 -0.404 7.612 -2.845 1006 HB2 ASP 127 2HB ASP 127 0.018 9.995 -2.086 1007 HB3 ASP 127 1HB ASP 127 1.204 9.324 -3.199 1008 H TRP 128 H TRP 128 -2.734 9.128 -4.806 1009 HA TRP 128 HA TRP 128 -4.651 8.973 -2.585 1010 HB2 TRP 128 2HB TRP 128 -4.403 11.081 -4.719 1011 HB3 TRP 128 1HB TRP 128 -5.954 10.758 -3.951 1012 HD1 TRP 128 HD1 TRP 128 -2.492 12.216 -3.205 1013 HE1 TRP 128 HE1 TRP 128 -2.623 13.570 -1.019 1014 HE3 TRP 128 HE3 TRP 128 -7.231 10.954 -1.754 1015 HZ2 TRP 128 HZ2 TRP 128 -4.482 14.035 1.048 1016 HZ3 TRP 128 HZ3 TRP 128 -8.109 11.900 0.347 1017 HH2 TRP 128 HH2 TRP 128 -6.763 13.404 1.713 1018 H VAL 129 H VAL 129 -3.812 6.997 -4.587 1019 HA VAL 129 HA VAL 129 -6.434 6.518 -5.839 1020 HB VAL 129 HB VAL 129 -3.754 6.012 -7.161 1021 HG11 VAL 129 1HG1 VAL 129 -6.542 5.571 -8.217 1022 HG12 VAL 129 2HG1 VAL 129 -5.400 4.312 -7.752 1023 HG13 VAL 129 3HG1 VAL 129 -5.046 5.361 -9.127 1024 HG21 VAL 129 3HG2 VAL 129 -4.445 7.709 -8.781 1025 HG22 VAL 129 1HG2 VAL 129 -4.324 8.380 -7.156 1026 HG23 VAL 129 2HG2 VAL 129 -5.908 8.010 -7.845 1027 H VAL 130 H VAL 130 -7.058 4.327 -5.957 1028 HA VAL 130 HA VAL 130 -5.953 2.622 -3.955 1029 HB VAL 130 HB VAL 130 -7.962 1.974 -6.127 1030 HG11 VAL 130 1HG1 VAL 130 -6.942 -0.048 -5.244 1031 HG12 VAL 130 2HG1 VAL 130 -8.605 0.092 -4.673 1032 HG13 VAL 130 3HG1 VAL 130 -7.264 0.485 -3.594 1033 HG21 VAL 130 3HG2 VAL 130 -8.377 2.758 -3.245 1034 HG22 VAL 130 1HG2 VAL 130 -9.642 2.293 -4.383 1035 HG23 VAL 130 2HG2 VAL 130 -8.713 3.767 -4.653 1036 HA PRO 131 HA PRO 131 -2.583 0.886 -6.285 1037 HB2 PRO 131 2HB PRO 131 -3.014 -1.347 -4.360 1038 HB3 PRO 131 1HB PRO 131 -1.533 -0.466 -4.754 1039 HG2 PRO 131 2HG PRO 131 -2.808 0.003 -2.472 1040 HG3 PRO 131 1HG PRO 131 -2.084 1.333 -3.395 1041 HD2 PRO 131 2HD PRO 131 -4.951 0.520 -3.173 1042 HD3 PRO 131 1HD PRO 131 -4.241 2.146 -3.251 1043 H TYR 132 H TYR 132 -2.698 -0.151 -8.135 1044 HA TYR 132 HA TYR 132 -4.366 -2.553 -8.358 1045 HB2 TYR 132 2HB TYR 132 -5.089 -1.881 -10.594 1046 HB3 TYR 132 1HB TYR 132 -5.568 -0.667 -9.416 1047 HD1 TYR 132 HD1 TYR 132 -4.016 1.403 -9.192 1048 HD2 TYR 132 HD2 TYR 132 -3.939 -1.249 -12.518 1049 HE1 TYR 132 HE1 TYR 132 -2.933 3.144 -10.547 1050 HE2 TYR 132 HE2 TYR 132 -2.854 0.485 -13.882 1051 HH TYR 132 HH TYR 132 -1.503 3.288 -12.554 1052 H TYR 133 H TYR 133 -3.475 -4.196 -9.598 1053 HA TYR 133 HA TYR 133 -0.635 -3.929 -10.010 1054 HB2 TYR 133 2HB TYR 133 -0.912 -6.423 -10.720 1055 HB3 TYR 133 1HB TYR 133 -1.024 -5.963 -9.029 1056 HD1 TYR 133 HD1 TYR 133 -3.016 -6.923 -12.002 1057 HD2 TYR 133 HD2 TYR 133 -2.994 -6.360 -7.787 1058 HE1 TYR 133 HE1 TYR 133 -5.182 -8.079 -11.843 1059 HE2 TYR 133 HE2 TYR 133 -5.164 -7.506 -7.615 1060 HH TYR 133 HH TYR 133 -7.065 -8.105 -8.955 1061 H ARG 134 H ARG 134 0.050 -3.005 -11.729 1062 HA ARG 134 HA ARG 134 0.652 -2.659 -13.867 1063 HB2 ARG 134 2HB ARG 134 0.733 -5.142 -13.969 1064 HB3 ARG 134 1HB ARG 134 -0.930 -5.143 -14.541 1065 HG2 ARG 134 2HG ARG 134 -0.320 -4.041 -16.556 1066 HG3 ARG 134 1HG ARG 134 1.309 -3.729 -15.960 1067 HD2 ARG 134 2HD ARG 134 1.305 -5.577 -17.540 1068 HD3 ARG 134 1HD ARG 134 1.761 -6.127 -15.929 1069 HE ARG 134 HE ARG 134 -0.357 -7.191 -15.723 1070 HH11 ARG 134 1HH1 ARG 134 0.252 -5.824 -18.881 1071 HH12 ARG 134 2HH1 ARG 134 -0.930 -6.808 -19.683 1072 HH21 ARG 134 1HH2 ARG 134 -1.911 -8.482 -16.750 1073 HH22 ARG 134 2HH2 ARG 134 -2.199 -8.311 -18.458 1074 H GLY 135 H GLY 135 -2.610 -4.012 -14.402 1075 HA2 GLY 135 2HA GLY 135 -4.570 -2.881 -14.919 1076 HA3 GLY 135 1HA GLY 135 -3.679 -1.369 -14.872 1077 H LEU 136 H LEU 136 -2.589 -0.655 -16.723 1078 HA LEU 136 HA LEU 136 -2.526 -0.115 -18.913 1079 HB2 LEU 136 2HB LEU 136 -2.506 -3.092 -19.025 1080 HB3 LEU 136 1HB LEU 136 -2.743 -2.209 -20.519 1081 HG LEU 136 HG LEU 136 -0.598 -1.045 -20.174 1082 HD11 LEU 136 1HD1 LEU 136 0.944 -1.789 -18.443 1083 HD12 LEU 136 2HD1 LEU 136 -0.303 -2.842 -17.775 1084 HD13 LEU 136 3HD1 LEU 136 -0.517 -1.092 -17.742 1085 HD21 LEU 136 3HD2 LEU 136 -0.384 -4.044 -20.012 1086 HD22 LEU 136 1HD2 LEU 136 0.856 -2.942 -20.613 1087 HD23 LEU 136 2HD2 LEU 136 -0.673 -3.105 -21.477 1088 H GLU 137 H GLU 137 -4.580 -2.813 -19.729 1089 HA GLU 137 HA GLU 137 -6.732 -3.020 -20.381 1090 HB2 GLU 137 2HB GLU 137 -7.187 -1.999 -18.153 1091 HB3 GLU 137 1HB GLU 137 -7.229 -0.422 -18.927 1092 HG2 GLU 137 2HG GLU 137 -9.467 -1.219 -18.576 1093 HG3 GLU 137 1HG GLU 137 -9.121 -1.173 -20.304 1094 H HIS 138 H HIS 138 -6.402 0.528 -20.464 1095 HA HIS 138 HA HIS 138 -7.804 0.753 -22.917 1096 HB2 HIS 138 2HB HIS 138 -7.172 3.135 -22.846 1097 HB3 HIS 138 1HB HIS 138 -7.802 2.582 -21.301 1098 HD1 HIS 138 HD1 HIS 138 -4.565 3.599 -22.968 1099 HD2 HIS 138 HD2 HIS 138 -6.063 2.839 -19.161 1100 HE1 HIS 138 HE1 HIS 138 -2.791 4.384 -21.374 1101 HE2 HIS 138 HE2 HIS 138 -3.614 3.684 -19.096 1102 H HIS 139 H HIS 139 -7.011 1.690 -24.910 1103 HA HIS 139 HA HIS 139 -4.732 0.434 -25.955 1104 HB2 HIS 139 2HB HIS 139 -4.974 1.987 -27.891 1105 HB3 HIS 139 1HB HIS 139 -6.453 1.146 -27.467 1106 HD1 HIS 139 HD1 HIS 139 -7.262 3.268 -29.059 1107 HD2 HIS 139 HD2 HIS 139 -6.209 4.080 -25.119 1108 HE1 HIS 139 HE1 HIS 139 -8.342 5.471 -28.509 1109 HE2 HIS 139 HE2 HIS 139 -7.898 5.799 -26.049 1110 H HIS 140 H HIS 140 -2.751 1.423 -26.782 1111 HA HIS 140 HA HIS 140 -1.852 3.706 -25.184 1112 HB2 HIS 140 2HB HIS 140 0.092 2.521 -24.321 1113 HB3 HIS 140 1HB HIS 140 -1.386 1.716 -23.817 1114 HD1 HIS 140 HD1 HIS 140 1.811 0.796 -24.643 1115 HD2 HIS 140 HD2 HIS 140 -1.887 -0.430 -26.110 1116 HE1 HIS 140 HE1 HIS 140 2.200 -1.477 -25.655 1117 HE2 HIS 140 HE2 HIS 140 -0.072 -2.249 -26.439 1118 H HIS 141 H HIS 141 -2.368 3.431 -27.968 1119 HA HIS 141 HA HIS 141 -1.489 4.105 -29.945 1120 HB2 HIS 141 2HB HIS 141 0.512 5.179 -27.995 1121 HB3 HIS 141 1HB HIS 141 0.818 5.317 -29.722 1122 HD1 HIS 141 HD1 HIS 141 -1.420 6.598 -27.002 1123 HD2 HIS 141 HD2 HIS 141 -0.793 7.153 -31.079 1124 HE1 HIS 141 HE1 HIS 141 -2.694 8.680 -27.613 1125 HE2 HIS 141 HE2 HIS 141 -2.085 9.126 -30.016 1126 H HIS 142 H HIS 142 1.540 4.261 -30.278 1127 HA HIS 142 HA HIS 142 3.195 3.032 -31.187 1128 HB2 HIS 142 2HB HIS 142 1.893 0.849 -29.583 1129 HB3 HIS 142 1HB HIS 142 3.228 0.503 -30.677 1130 HD1 HIS 142 HD1 HIS 142 5.541 1.668 -30.108 1131 HD2 HIS 142 HD2 HIS 142 2.611 1.961 -27.167 1132 HE1 HIS 142 HE1 HIS 142 6.750 2.365 -28.014 1133 HE2 HIS 142 HE2 HIS 142 4.991 2.339 -26.208 1134 H HIS 143 H HIS 143 1.133 3.738 -32.735 1135 HA HIS 143 HA HIS 143 1.263 1.678 -34.771 1136 HB2 HIS 143 2HB HIS 143 -0.875 1.252 -33.550 1137 HB3 HIS 143 1HB HIS 143 -1.396 2.883 -33.956 1138 HD1 HIS 143 HD1 HIS 143 -0.597 -0.431 -35.576 1139 HD2 HIS 143 HD2 HIS 143 -2.501 3.160 -36.453 1140 HE1 HIS 143 HE1 HIS 143 -1.770 -0.801 -37.777 1141 HE2 HIS 143 HE2 HIS 143 -2.767 1.441 -38.365 Start of MODEL 8 1 H1 MET 1 1H MET 1 -11.090 1.460 -14.768 2 H2 MET 1 2H MET 1 -9.518 1.386 -15.408 3 H3 MET 1 3H MET 1 -10.766 2.104 -16.303 4 HA MET 1 HA MET 1 -9.283 3.745 -15.299 5 HB2 MET 1 2HB MET 1 -11.684 4.235 -15.754 6 HB3 MET 1 1HB MET 1 -12.072 3.719 -14.119 7 HG2 MET 1 2HG MET 1 -12.009 6.110 -14.195 8 HG3 MET 1 1HG MET 1 -10.641 5.531 -13.246 9 HE1 MET 1 3HE MET 1 -10.902 8.511 -14.421 10 HE2 MET 1 1HE MET 1 -9.244 8.771 -14.963 11 HE3 MET 1 2HE MET 1 -9.553 7.951 -13.432 12 HA PRO 2 HA PRO 2 -7.591 2.523 -11.358 13 HB2 PRO 2 2HB PRO 2 -6.890 5.409 -11.219 14 HB3 PRO 2 1HB PRO 2 -5.853 3.992 -11.042 15 HG2 PRO 2 2HG PRO 2 -5.781 5.465 -13.257 16 HG3 PRO 2 1HG PRO 2 -5.638 3.698 -13.331 17 HD2 PRO 2 2HD PRO 2 -7.980 5.440 -13.965 18 HD3 PRO 2 1HD PRO 2 -7.426 3.958 -14.768 19 H VAL 3 H VAL 3 -8.380 2.496 -9.327 20 HA VAL 3 HA VAL 3 -10.750 3.974 -8.701 21 HB VAL 3 HB VAL 3 -9.073 2.295 -6.826 22 HG11 VAL 3 1HG1 VAL 3 -10.651 3.712 -5.672 23 HG12 VAL 3 2HG1 VAL 3 -11.197 2.036 -5.600 24 HG13 VAL 3 3HG1 VAL 3 -11.958 3.166 -6.722 25 HG21 VAL 3 3HG2 VAL 3 -11.378 1.449 -8.581 26 HG22 VAL 3 1HG2 VAL 3 -10.579 0.444 -7.369 27 HG23 VAL 3 2HG2 VAL 3 -9.688 0.990 -8.791 28 H GLU 4 H GLU 4 -10.596 6.071 -8.265 29 HA GLU 4 HA GLU 4 -8.277 7.016 -6.713 30 HB2 GLU 4 2HB GLU 4 -8.626 9.198 -7.801 31 HB3 GLU 4 1HB GLU 4 -8.352 7.928 -8.989 32 HG2 GLU 4 2HG GLU 4 -10.661 7.837 -9.540 33 HG3 GLU 4 1HG GLU 4 -11.085 8.895 -8.196 34 H LEU 5 H LEU 5 -8.612 8.434 -5.002 35 HA LEU 5 HA LEU 5 -11.413 8.974 -4.292 36 HB2 LEU 5 2HB LEU 5 -9.963 7.921 -2.548 37 HB3 LEU 5 1HB LEU 5 -8.939 9.344 -2.595 38 HG LEU 5 HG LEU 5 -10.931 10.710 -1.912 39 HD11 LEU 5 1HD1 LEU 5 -12.667 9.165 -2.642 40 HD12 LEU 5 2HD1 LEU 5 -12.835 9.548 -0.928 41 HD13 LEU 5 3HD1 LEU 5 -12.153 7.999 -1.423 42 HD21 LEU 5 3HD2 LEU 5 -10.825 10.075 0.428 43 HD22 LEU 5 1HD2 LEU 5 -9.221 10.020 -0.302 44 HD23 LEU 5 2HD2 LEU 5 -10.109 8.523 -0.006 45 H ARG 6 H ARG 6 -11.989 10.731 -5.384 46 HA ARG 6 HA ARG 6 -10.063 12.854 -5.854 47 HB2 ARG 6 2HB ARG 6 -11.888 13.777 -7.319 48 HB3 ARG 6 1HB ARG 6 -11.252 12.208 -7.793 49 HG2 ARG 6 2HG ARG 6 -13.190 11.128 -6.728 50 HG3 ARG 6 1HG ARG 6 -13.836 12.726 -6.337 51 HD2 ARG 6 2HD ARG 6 -14.868 11.855 -8.361 52 HD3 ARG 6 1HD ARG 6 -13.900 13.284 -8.707 53 HE ARG 6 HE ARG 6 -12.131 11.413 -9.280 54 HH11 ARG 6 1HH1 ARG 6 -15.539 11.557 -10.052 55 HH12 ARG 6 2HH1 ARG 6 -15.394 10.601 -11.494 56 HH21 ARG 6 1HH2 ARG 6 -11.916 10.183 -11.211 57 HH22 ARG 6 2HH2 ARG 6 -13.332 9.840 -12.158 58 H ALA 7 H ALA 7 -11.005 15.141 -5.794 59 HA ALA 7 HA ALA 7 -11.508 15.785 -3.105 60 HB1 ALA 7 3HB ALA 7 -10.405 17.299 -4.696 61 HB2 ALA 7 1HB ALA 7 -11.757 18.072 -3.870 62 HB3 ALA 7 2HB ALA 7 -11.941 17.518 -5.533 63 H ASN 8 H ASN 8 -13.653 15.446 -5.880 64 HA ASN 8 HA ASN 8 -15.942 15.794 -4.060 65 HB2 ASN 8 2HB ASN 8 -15.884 15.887 -7.086 66 HB3 ASN 8 1HB ASN 8 -17.326 16.065 -6.093 67 HD21 ASN 8 1HD2 ASN 8 -17.551 17.927 -4.806 68 HD22 ASN 8 2HD2 ASN 8 -16.675 19.380 -5.167 69 H TRP 9 H TRP 9 -15.434 13.647 -3.229 70 HA TRP 9 HA TRP 9 -16.033 11.439 -5.032 71 HB2 TRP 9 2HB TRP 9 -15.414 10.001 -3.086 72 HB3 TRP 9 1HB TRP 9 -14.129 11.080 -3.607 73 HD1 TRP 9 HD1 TRP 9 -13.354 12.978 -1.920 74 HE1 TRP 9 HE1 TRP 9 -13.745 13.339 0.598 75 HE3 TRP 9 HE3 TRP 9 -17.196 9.685 -1.214 76 HZ2 TRP 9 HZ2 TRP 9 -15.452 12.361 2.615 77 HZ3 TRP 9 HZ3 TRP 9 -18.152 9.459 1.040 78 HH2 TRP 9 HH2 TRP 9 -17.297 10.770 2.915 79 H SER 10 H SER 10 -17.478 9.698 -4.204 80 HA SER 10 HA SER 10 -19.777 10.823 -2.748 81 HB2 SER 10 2HB SER 10 -19.864 8.912 -5.101 82 HB3 SER 10 1HB SER 10 -21.261 9.503 -4.203 83 HG SER 10 HG SER 10 -19.487 11.376 -5.287 84 H GLU 11 H GLU 11 -21.226 9.000 -1.885 85 HA GLU 11 HA GLU 11 -19.751 7.522 -0.033 86 HB2 GLU 11 2HB GLU 11 -22.581 6.987 -0.950 87 HB3 GLU 11 1HB GLU 11 -21.854 6.435 0.553 88 HG2 GLU 11 2HG GLU 11 -22.369 9.294 -0.223 89 HG3 GLU 11 1HG GLU 11 -23.303 8.341 0.928 90 H GLU 12 H GLU 12 -21.499 6.354 -2.917 91 HA GLU 12 HA GLU 12 -20.702 3.663 -2.660 92 HB2 GLU 12 2HB GLU 12 -21.398 3.408 -4.989 93 HB3 GLU 12 1HB GLU 12 -22.571 4.358 -4.087 94 HG2 GLU 12 2HG GLU 12 -21.758 6.393 -5.062 95 HG3 GLU 12 1HG GLU 12 -20.439 5.532 -5.855 96 H ASP 13 H ASP 13 -19.164 6.443 -4.066 97 HA ASP 13 HA ASP 13 -17.155 5.024 -5.508 98 HB2 ASP 13 2HB ASP 13 -17.912 7.376 -5.985 99 HB3 ASP 13 1HB ASP 13 -17.080 7.884 -4.521 100 H LEU 14 H LEU 14 -17.397 6.527 -2.340 101 HA LEU 14 HA LEU 14 -14.776 6.021 -1.446 102 HB2 LEU 14 2HB LEU 14 -16.312 7.562 -0.322 103 HB3 LEU 14 1HB LEU 14 -17.357 6.223 0.108 104 HG LEU 14 HG LEU 14 -15.553 5.295 1.528 105 HD11 LEU 14 1HD1 LEU 14 -13.642 6.243 0.347 106 HD12 LEU 14 2HD1 LEU 14 -13.613 6.673 2.057 107 HD13 LEU 14 3HD1 LEU 14 -14.120 7.863 0.859 108 HD21 LEU 14 3HD2 LEU 14 -16.299 8.153 2.143 109 HD22 LEU 14 1HD2 LEU 14 -15.746 6.947 3.307 110 HD23 LEU 14 2HD2 LEU 14 -17.290 6.733 2.476 111 H GLU 15 H GLU 15 -17.772 4.131 -1.222 112 HA GLU 15 HA GLU 15 -16.828 1.889 0.124 113 HB2 GLU 15 2HB GLU 15 -18.750 1.898 -2.219 114 HB3 GLU 15 1HB GLU 15 -18.583 0.622 -1.024 115 HG2 GLU 15 2HG GLU 15 -19.485 3.426 -0.415 116 HG3 GLU 15 1HG GLU 15 -20.561 2.057 -0.689 117 H THR 16 H THR 16 -16.658 2.723 -3.292 118 HA THR 16 HA THR 16 -15.437 0.368 -4.207 119 HB THR 16 HB THR 16 -15.194 3.155 -5.360 120 HG1 THR 16 HG1 THR 16 -17.356 2.678 -5.273 121 HG21 THR 16 3HG2 THR 16 -14.884 0.437 -6.647 122 HG22 THR 16 1HG2 THR 16 -13.587 1.591 -6.332 123 HG23 THR 16 2HG2 THR 16 -14.852 1.981 -7.497 124 H VAL 17 H VAL 17 -14.070 3.441 -3.076 125 HA VAL 17 HA VAL 17 -11.375 2.856 -3.606 126 HB VAL 17 HB VAL 17 -12.530 4.667 -1.477 127 HG11 VAL 17 1HG1 VAL 17 -10.200 4.067 -1.003 128 HG12 VAL 17 2HG1 VAL 17 -10.349 5.762 -1.466 129 HG13 VAL 17 3HG1 VAL 17 -9.741 4.580 -2.626 130 HG21 VAL 17 3HG2 VAL 17 -12.095 6.461 -3.087 131 HG22 VAL 17 1HG2 VAL 17 -13.223 5.272 -3.742 132 HG23 VAL 17 2HG2 VAL 17 -11.538 5.271 -4.263 133 H ILE 18 H ILE 18 -13.231 2.505 -0.570 134 HA ILE 18 HA ILE 18 -11.020 1.562 0.917 135 HB ILE 18 HB ILE 18 -12.646 0.829 2.616 136 HG12 ILE 18 2HG1 ILE 18 -14.748 1.762 0.645 137 HG13 ILE 18 1HG1 ILE 18 -14.428 0.081 1.057 138 HG21 ILE 18 1HG2 ILE 18 -13.121 3.566 1.445 139 HG22 ILE 18 2HG2 ILE 18 -11.889 3.116 2.624 140 HG23 ILE 18 3HG2 ILE 18 -13.594 3.069 3.070 141 HD11 ILE 18 3HD1 ILE 18 -15.391 2.205 2.956 142 HD12 ILE 18 1HD1 ILE 18 -15.092 0.515 3.360 143 HD13 ILE 18 2HD1 ILE 18 -16.376 0.938 2.227 144 H ARG 19 H ARG 19 -13.480 -0.135 -0.972 145 HA ARG 19 HA ARG 19 -12.641 -2.723 -0.057 146 HB2 ARG 19 2HB ARG 19 -14.336 -1.955 -2.440 147 HB3 ARG 19 1HB ARG 19 -14.079 -3.600 -1.875 148 HG2 ARG 19 2HG ARG 19 -15.092 -2.924 0.307 149 HG3 ARG 19 1HG ARG 19 -15.498 -1.374 -0.433 150 HD2 ARG 19 2HD ARG 19 -17.434 -2.731 -0.608 151 HD3 ARG 19 1HD ARG 19 -16.714 -2.673 -2.217 152 HE ARG 19 HE ARG 19 -15.975 -4.934 -0.543 153 HH11 ARG 19 1HH1 ARG 19 -18.031 -3.724 -3.116 154 HH12 ARG 19 2HH1 ARG 19 -18.416 -5.314 -3.717 155 HH21 ARG 19 1HH2 ARG 19 -16.510 -7.001 -1.286 156 HH22 ARG 19 2HH2 ARG 19 -17.578 -7.189 -2.651 157 H ALA 20 H ALA 20 -11.727 -0.568 -2.638 158 HA ALA 20 HA ALA 20 -10.336 -2.455 -4.228 159 HB1 ALA 20 3HB ALA 20 -9.235 -0.540 -5.239 160 HB2 ALA 20 1HB ALA 20 -9.793 0.499 -3.927 161 HB3 ALA 20 2HB ALA 20 -10.957 -0.217 -5.041 162 H VAL 21 H VAL 21 -9.537 -0.631 -1.365 163 HA VAL 21 HA VAL 21 -6.769 -1.366 -1.332 164 HB VAL 21 HB VAL 21 -8.520 -0.416 0.947 165 HG11 VAL 21 1HG1 VAL 21 -6.493 -1.529 1.728 166 HG12 VAL 21 2HG1 VAL 21 -6.428 0.205 2.041 167 HG13 VAL 21 3HG1 VAL 21 -5.513 -0.482 0.699 168 HG21 VAL 21 3HG2 VAL 21 -7.540 1.790 0.513 169 HG22 VAL 21 1HG2 VAL 21 -8.464 1.201 -0.868 170 HG23 VAL 21 2HG2 VAL 21 -6.702 1.136 -0.893 171 H TYR 22 H TYR 22 -9.731 -2.596 0.191 172 HA TYR 22 HA TYR 22 -8.517 -5.204 0.372 173 HB2 TYR 22 2HB TYR 22 -8.914 -5.518 2.770 174 HB3 TYR 22 1HB TYR 22 -7.761 -4.223 2.480 175 HD1 TYR 22 HD1 TYR 22 -8.653 -1.808 2.599 176 HD2 TYR 22 HD2 TYR 22 -10.787 -5.160 4.124 177 HE1 TYR 22 HE1 TYR 22 -9.973 -0.308 4.033 178 HE2 TYR 22 HE2 TYR 22 -12.115 -3.667 5.557 179 HH TYR 22 HH TYR 22 -12.150 -0.293 5.177 180 H ARG 23 H ARG 23 -9.979 -6.612 -0.294 181 HA ARG 23 HA ARG 23 -12.809 -6.089 0.318 182 HB2 ARG 23 2HB ARG 23 -11.512 -7.463 -2.017 183 HB3 ARG 23 1HB ARG 23 -13.162 -7.869 -1.564 184 HG2 ARG 23 2HG ARG 23 -13.679 -5.404 -1.716 185 HG3 ARG 23 1HG ARG 23 -12.092 -5.208 -2.456 186 HD2 ARG 23 2HD ARG 23 -14.265 -7.020 -3.498 187 HD3 ARG 23 1HD ARG 23 -13.955 -5.387 -4.087 188 HE ARG 23 HE ARG 23 -11.743 -7.284 -4.189 189 HH11 ARG 23 1HH1 ARG 23 -14.263 -5.532 -5.875 190 HH12 ARG 23 2HH1 ARG 23 -13.622 -5.866 -7.454 191 HH21 ARG 23 1HH2 ARG 23 -10.890 -7.736 -6.270 192 HH22 ARG 23 2HH2 ARG 23 -11.708 -7.115 -7.681 193 H GLN 24 H GLN 24 -10.695 -7.380 1.962 194 HA GLN 24 HA GLN 24 -11.117 -10.139 2.175 195 HB2 GLN 24 2HB GLN 24 -10.388 -8.109 4.298 196 HB3 GLN 24 1HB GLN 24 -10.334 -9.848 4.540 197 HG2 GLN 24 2HG GLN 24 -8.737 -8.362 2.464 198 HG3 GLN 24 1HG GLN 24 -8.132 -8.846 4.047 199 HE21 GLN 24 1HE2 GLN 24 -7.646 -10.994 4.438 200 HE22 GLN 24 2HE2 GLN 24 -7.601 -12.181 3.174 201 H VAL 25 H VAL 25 -12.735 -11.329 2.985 202 HA VAL 25 HA VAL 25 -15.172 -9.903 3.683 203 HB VAL 25 HB VAL 25 -14.757 -12.867 3.245 204 HG11 VAL 25 1HG1 VAL 25 -17.277 -11.217 3.354 205 HG12 VAL 25 2HG1 VAL 25 -16.740 -12.382 4.564 206 HG13 VAL 25 3HG1 VAL 25 -17.188 -12.931 2.947 207 HG21 VAL 25 3HG2 VAL 25 -14.212 -11.636 1.228 208 HG22 VAL 25 1HG2 VAL 25 -15.730 -10.744 1.338 209 HG23 VAL 25 2HG2 VAL 25 -15.748 -12.481 1.029 210 H LEU 26 H LEU 26 -12.936 -12.258 5.048 211 HA LEU 26 HA LEU 26 -12.512 -12.924 7.179 212 HB2 LEU 26 2HB LEU 26 -12.636 -10.411 7.526 213 HB3 LEU 26 1HB LEU 26 -14.282 -10.648 8.072 214 HG LEU 26 HG LEU 26 -13.433 -12.075 9.915 215 HD11 LEU 26 1HD1 LEU 26 -11.037 -12.033 10.431 216 HD12 LEU 26 2HD1 LEU 26 -10.731 -11.193 8.909 217 HD13 LEU 26 3HD1 LEU 26 -11.364 -12.839 8.897 218 HD21 LEU 26 3HD2 LEU 26 -12.490 -10.232 11.229 219 HD22 LEU 26 1HD2 LEU 26 -13.895 -9.726 10.292 220 HD23 LEU 26 2HD2 LEU 26 -12.274 -9.299 9.747 221 H GLY 27 H GLY 27 -14.041 -13.141 9.458 222 HA2 GLY 27 2HA GLY 27 -16.192 -14.912 8.545 223 HA3 GLY 27 1HA GLY 27 -15.433 -14.940 10.130 224 H ASN 28 H ASN 28 -17.262 -14.802 11.336 225 HA ASN 28 HA ASN 28 -18.845 -12.326 11.034 226 HB2 ASN 28 2HB ASN 28 -19.952 -14.654 10.685 227 HB3 ASN 28 1HB ASN 28 -19.823 -14.808 12.432 228 HD21 ASN 28 1HD2 ASN 28 -21.306 -13.084 9.807 229 HD22 ASN 28 2HD2 ASN 28 -22.589 -12.364 10.735 230 H ASP 29 H ASP 29 -16.320 -13.052 12.540 231 HA ASP 29 HA ASP 29 -17.044 -12.986 15.315 232 HB2 ASP 29 2HB ASP 29 -14.375 -12.682 13.928 233 HB3 ASP 29 1HB ASP 29 -14.577 -12.695 15.677 234 H TYR 30 H TYR 30 -18.411 -11.050 15.032 235 HA TYR 30 HA TYR 30 -17.111 -8.500 14.682 236 HB2 TYR 30 2HB TYR 30 -19.323 -7.547 15.137 237 HB3 TYR 30 1HB TYR 30 -19.435 -8.840 13.951 238 HD1 TYR 30 HD1 TYR 30 -20.076 -11.202 14.909 239 HD2 TYR 30 HD2 TYR 30 -20.778 -7.532 16.946 240 HE1 TYR 30 HE1 TYR 30 -21.803 -12.295 16.270 241 HE2 TYR 30 HE2 TYR 30 -22.506 -8.621 18.315 242 HH TYR 30 HH TYR 30 -24.064 -10.675 18.026 243 H VAL 31 H VAL 31 -17.256 -10.653 17.191 244 HA VAL 31 HA VAL 31 -17.396 -8.594 19.273 245 HB VAL 31 HB VAL 31 -17.580 -10.497 20.866 246 HG11 VAL 31 1HG1 VAL 31 -19.886 -11.070 20.278 247 HG12 VAL 31 2HG1 VAL 31 -19.628 -10.435 18.654 248 HG13 VAL 31 3HG1 VAL 31 -19.562 -9.353 20.046 249 HG21 VAL 31 3HG2 VAL 31 -16.455 -12.206 19.549 250 HG22 VAL 31 1HG2 VAL 31 -17.745 -12.152 18.347 251 HG23 VAL 31 2HG2 VAL 31 -18.085 -12.730 19.979 252 H MET 32 H MET 32 -15.000 -9.671 17.462 253 HA MET 32 HA MET 32 -13.171 -10.270 19.659 254 HB2 MET 32 2HB MET 32 -11.528 -10.871 17.977 255 HB3 MET 32 1HB MET 32 -13.040 -11.711 17.681 256 HG2 MET 32 2HG MET 32 -13.577 -10.097 15.918 257 HG3 MET 32 1HG MET 32 -12.039 -9.287 16.209 258 HE1 MET 32 3HE MET 32 -12.770 -10.168 13.325 259 HE2 MET 32 1HE MET 32 -11.288 -10.968 12.799 260 HE3 MET 32 2HE MET 32 -11.201 -9.486 13.754 261 H ALA 33 H ALA 33 -13.625 -7.869 17.097 262 HA ALA 33 HA ALA 33 -12.860 -5.747 16.816 263 HB1 ALA 33 3HB ALA 33 -12.613 -5.818 19.820 264 HB2 ALA 33 1HB ALA 33 -14.084 -5.454 18.916 265 HB3 ALA 33 2HB ALA 33 -12.692 -4.374 18.810 266 H SER 34 H SER 34 -10.877 -7.902 16.729 267 HA SER 34 HA SER 34 -8.507 -7.299 18.066 268 HB2 SER 34 2HB SER 34 -8.682 -8.571 15.333 269 HB3 SER 34 1HB SER 34 -7.486 -8.868 16.599 270 HG SER 34 HG SER 34 -8.782 -10.292 17.433 271 H GLU 35 H GLU 35 -9.829 -6.081 15.061 272 HA GLU 35 HA GLU 35 -7.863 -3.933 15.098 273 HB2 GLU 35 2HB GLU 35 -6.884 -5.558 13.566 274 HB3 GLU 35 1HB GLU 35 -8.397 -5.681 12.683 275 HG2 GLU 35 2HG GLU 35 -6.871 -4.334 11.433 276 HG3 GLU 35 1HG GLU 35 -8.175 -3.314 12.033 277 H ARG 36 H ARG 36 -8.804 -2.019 14.672 278 HA ARG 36 HA ARG 36 -11.506 -2.078 13.498 279 HB2 ARG 36 2HB ARG 36 -10.380 -0.038 15.427 280 HB3 ARG 36 1HB ARG 36 -11.990 -0.008 14.722 281 HG2 ARG 36 2HG ARG 36 -12.409 -2.212 15.848 282 HG3 ARG 36 1HG ARG 36 -10.882 -1.979 16.702 283 HD2 ARG 36 2HD ARG 36 -11.777 0.223 17.500 284 HD3 ARG 36 1HD ARG 36 -13.335 -0.232 16.811 285 HE ARG 36 HE ARG 36 -12.013 -1.488 19.115 286 HH11 ARG 36 1HH1 ARG 36 -14.823 -1.186 17.035 287 HH12 ARG 36 2HH1 ARG 36 -15.887 -1.973 18.166 288 HH21 ARG 36 1HH2 ARG 36 -13.400 -2.535 20.574 289 HH22 ARG 36 2HH2 ARG 36 -15.075 -2.780 20.156 290 H LEU 37 H LEU 37 -11.000 -1.737 11.383 291 HA LEU 37 HA LEU 37 -9.181 0.407 10.675 292 HB2 LEU 37 2HB LEU 37 -10.731 -1.572 9.015 293 HB3 LEU 37 1HB LEU 37 -9.755 -0.293 8.317 294 HG LEU 37 HG LEU 37 -8.746 -2.533 10.070 295 HD11 LEU 37 1HD1 LEU 37 -9.340 -3.277 7.837 296 HD12 LEU 37 2HD1 LEU 37 -7.587 -3.260 8.041 297 HD13 LEU 37 3HD1 LEU 37 -8.381 -1.973 7.133 298 HD21 LEU 37 3HD2 LEU 37 -7.254 -0.295 8.704 299 HD22 LEU 37 1HD2 LEU 37 -6.521 -1.653 9.560 300 HD23 LEU 37 2HD2 LEU 37 -7.494 -0.475 10.442 301 H VAL 38 H VAL 38 -12.362 0.220 11.514 302 HA VAL 38 HA VAL 38 -13.586 2.050 9.772 303 HB VAL 38 HB VAL 38 -15.172 2.509 11.610 304 HG11 VAL 38 1HG1 VAL 38 -14.517 -0.421 11.308 305 HG12 VAL 38 2HG1 VAL 38 -15.454 0.542 10.166 306 HG13 VAL 38 3HG1 VAL 38 -16.071 0.261 11.794 307 HG21 VAL 38 3HG2 VAL 38 -13.614 2.466 13.485 308 HG22 VAL 38 1HG2 VAL 38 -13.359 0.737 13.249 309 HG23 VAL 38 2HG2 VAL 38 -14.942 1.334 13.749 310 H SER 39 H SER 39 -11.393 2.446 12.443 311 HA SER 39 HA SER 39 -11.667 5.243 12.775 312 HB2 SER 39 2HB SER 39 -9.205 3.559 13.290 313 HB3 SER 39 1HB SER 39 -9.632 5.090 14.054 314 HG SER 39 HG SER 39 -10.589 3.916 15.497 315 H ALA 40 H ALA 40 -9.755 3.197 10.657 316 HA ALA 40 HA ALA 40 -8.188 5.318 9.555 317 HB1 ALA 40 3HB ALA 40 -8.775 2.563 8.457 318 HB2 ALA 40 1HB ALA 40 -7.405 3.006 9.476 319 HB3 ALA 40 2HB ALA 40 -7.543 3.673 7.851 320 H GLU 41 H GLU 41 -11.189 3.681 8.730 321 HA GLU 41 HA GLU 41 -11.711 4.898 6.269 322 HB2 GLU 41 2HB GLU 41 -13.632 3.987 8.415 323 HB3 GLU 41 1HB GLU 41 -14.117 4.466 6.796 324 HG2 GLU 41 2HG GLU 41 -12.782 2.634 5.864 325 HG3 GLU 41 1HG GLU 41 -12.330 2.147 7.500 326 H SER 42 H SER 42 -12.626 5.914 9.559 327 HA SER 42 HA SER 42 -14.008 8.232 8.721 328 HB2 SER 42 2HB SER 42 -13.753 8.920 11.147 329 HB3 SER 42 1HB SER 42 -14.515 7.353 10.878 330 HG SER 42 HG SER 42 -13.053 6.719 12.256 331 H LEU 43 H LEU 43 -10.651 7.698 9.732 332 HA LEU 43 HA LEU 43 -9.832 10.385 9.720 333 HB2 LEU 43 2HB LEU 43 -8.320 7.841 9.176 334 HB3 LEU 43 1HB LEU 43 -7.544 9.412 9.205 335 HG LEU 43 HG LEU 43 -9.003 8.138 11.524 336 HD11 LEU 43 1HD1 LEU 43 -6.766 7.959 12.515 337 HD12 LEU 43 2HD1 LEU 43 -6.062 8.553 11.011 338 HD13 LEU 43 3HD1 LEU 43 -6.911 7.008 11.036 339 HD21 LEU 43 3HD2 LEU 43 -7.394 10.686 11.381 340 HD22 LEU 43 1HD2 LEU 43 -8.119 9.992 12.831 341 HD23 LEU 43 2HD2 LEU 43 -9.149 10.587 11.528 342 H LEU 44 H LEU 44 -10.019 8.008 7.112 343 HA LEU 44 HA LEU 44 -8.885 9.743 5.137 344 HB2 LEU 44 2HB LEU 44 -8.837 7.277 4.966 345 HB3 LEU 44 1HB LEU 44 -10.581 7.266 4.793 346 HG LEU 44 HG LEU 44 -10.349 8.555 2.685 347 HD11 LEU 44 1HD1 LEU 44 -8.150 8.743 1.646 348 HD12 LEU 44 2HD1 LEU 44 -7.401 8.074 3.095 349 HD13 LEU 44 3HD1 LEU 44 -8.214 9.638 3.165 350 HD21 LEU 44 3HD2 LEU 44 -9.467 6.690 1.350 351 HD22 LEU 44 1HD2 LEU 44 -10.563 6.139 2.619 352 HD23 LEU 44 2HD2 LEU 44 -8.821 5.961 2.820 353 H ARG 45 H ARG 45 -12.161 8.750 6.005 354 HA ARG 45 HA ARG 45 -13.528 10.125 3.966 355 HB2 ARG 45 2HB ARG 45 -14.558 8.337 5.233 356 HB3 ARG 45 1HB ARG 45 -14.413 9.256 6.721 357 HG2 ARG 45 2HG ARG 45 -16.061 10.826 5.993 358 HG3 ARG 45 1HG ARG 45 -16.100 10.108 4.379 359 HD2 ARG 45 2HD ARG 45 -17.009 8.060 5.252 360 HD3 ARG 45 1HD ARG 45 -16.826 8.634 6.908 361 HE ARG 45 HE ARG 45 -18.617 10.171 6.528 362 HH11 ARG 45 1HH1 ARG 45 -18.134 7.836 3.950 363 HH12 ARG 45 2HH1 ARG 45 -19.740 8.032 3.313 364 HH21 ARG 45 1HH2 ARG 45 -20.735 10.386 5.675 365 HH22 ARG 45 2HH2 ARG 45 -21.197 9.452 4.283 366 H ASN 46 H ASN 46 -12.437 11.131 7.155 367 HA ASN 46 HA ASN 46 -13.776 13.679 7.016 368 HB2 ASN 46 2HB ASN 46 -13.142 12.353 9.140 369 HB3 ASN 46 1HB ASN 46 -11.522 12.997 8.895 370 HD21 ASN 46 1HD2 ASN 46 -14.799 13.728 9.737 371 HD22 ASN 46 2HD2 ASN 46 -14.517 15.338 10.304 372 H GLY 47 H GLY 47 -10.953 12.367 5.714 373 HA2 GLY 47 2HA GLY 47 -9.467 13.344 4.243 374 HA3 GLY 47 1HA GLY 47 -10.239 14.893 4.546 375 H LYS 48 H LYS 48 -8.992 12.901 7.129 376 HA LYS 48 HA LYS 48 -7.210 15.087 7.854 377 HB2 LYS 48 2HB LYS 48 -7.742 12.532 9.377 378 HB3 LYS 48 1HB LYS 48 -6.996 14.001 9.992 379 HG2 LYS 48 2HG LYS 48 -9.152 15.183 9.522 380 HG3 LYS 48 1HG LYS 48 -9.859 13.604 9.177 381 HD2 LYS 48 2HD LYS 48 -10.380 14.113 11.437 382 HD3 LYS 48 1HD LYS 48 -9.108 12.891 11.468 383 HE2 LYS 48 2HE LYS 48 -7.435 14.607 11.875 384 HE3 LYS 48 1HE LYS 48 -8.673 15.861 11.779 385 HZ1 LYS 48 3HZ LYS 48 -9.767 14.731 13.702 386 HZ2 LYS 48 1HZ LYS 48 -8.259 15.427 14.057 387 HZ3 LYS 48 2HZ LYS 48 -8.393 13.751 13.845 388 H ILE 49 H ILE 49 -7.098 11.872 6.588 389 HA ILE 49 HA ILE 49 -4.189 12.147 6.329 390 HB ILE 49 HB ILE 49 -4.011 9.639 6.475 391 HG12 ILE 49 2HG1 ILE 49 -5.946 8.717 8.033 392 HG13 ILE 49 1HG1 ILE 49 -6.890 9.951 7.210 393 HG21 ILE 49 1HG2 ILE 49 -4.014 9.576 8.920 394 HG22 ILE 49 2HG2 ILE 49 -4.942 11.076 8.953 395 HG23 ILE 49 3HG2 ILE 49 -3.302 11.068 8.304 396 HD11 ILE 49 3HD1 ILE 49 -7.130 7.792 6.139 397 HD12 ILE 49 1HD1 ILE 49 -5.385 7.706 5.890 398 HD13 ILE 49 2HD1 ILE 49 -6.334 8.942 5.062 399 H THR 50 H THR 50 -3.347 10.738 4.499 400 HA THR 50 HA THR 50 -5.203 11.054 2.250 401 HB THR 50 HB THR 50 -3.264 10.859 0.798 402 HG1 THR 50 HG1 THR 50 -1.723 10.475 3.181 403 HG21 THR 50 3HG2 THR 50 -1.979 12.819 1.523 404 HG22 THR 50 1HG2 THR 50 -2.679 12.683 3.135 405 HG23 THR 50 2HG2 THR 50 -3.710 13.068 1.757 406 H VAL 51 H VAL 51 -4.836 9.323 0.466 407 HA VAL 51 HA VAL 51 -5.691 6.824 1.422 408 HB VAL 51 HB VAL 51 -4.423 7.439 -1.259 409 HG11 VAL 51 1HG1 VAL 51 -5.732 5.511 -2.061 410 HG12 VAL 51 2HG1 VAL 51 -6.251 5.193 -0.407 411 HG13 VAL 51 3HG1 VAL 51 -4.547 5.051 -0.837 412 HG21 VAL 51 3HG2 VAL 51 -6.300 8.927 -0.814 413 HG22 VAL 51 1HG2 VAL 51 -7.322 7.543 -0.427 414 HG23 VAL 51 2HG2 VAL 51 -6.713 7.757 -2.067 415 H ARG 52 H ARG 52 -2.556 8.167 0.817 416 HA ARG 52 HA ARG 52 -0.978 5.881 0.643 417 HB2 ARG 52 2HB ARG 52 -0.352 8.338 0.296 418 HB3 ARG 52 1HB ARG 52 -0.174 8.435 2.040 419 HG2 ARG 52 2HG ARG 52 1.331 6.421 0.405 420 HG3 ARG 52 1HG ARG 52 1.921 8.065 0.649 421 HD2 ARG 52 2HD ARG 52 1.284 6.076 2.823 422 HD3 ARG 52 1HD ARG 52 2.899 6.486 2.250 423 HE ARG 52 HE ARG 52 1.095 8.438 3.560 424 HH11 ARG 52 1HH1 ARG 52 4.263 7.004 3.092 425 HH12 ARG 52 2HH1 ARG 52 5.054 8.115 4.159 426 HH21 ARG 52 1HH2 ARG 52 2.144 9.866 4.987 427 HH22 ARG 52 2HH2 ARG 52 3.863 9.737 5.233 428 H GLU 53 H GLU 53 -1.943 7.751 3.529 429 HA GLU 53 HA GLU 53 -0.690 6.019 5.391 430 HB2 GLU 53 2HB GLU 53 -2.955 7.987 5.729 431 HB3 GLU 53 1HB GLU 53 -2.256 7.088 7.065 432 HG2 GLU 53 2HG GLU 53 -1.197 9.147 7.160 433 HG3 GLU 53 1HG GLU 53 -0.026 8.112 6.348 434 H PHE 54 H PHE 54 -3.916 6.153 4.008 435 HA PHE 54 HA PHE 54 -5.173 4.285 5.677 436 HB2 PHE 54 2HB PHE 54 -6.354 5.813 4.112 437 HB3 PHE 54 1HB PHE 54 -5.759 4.854 2.761 438 HD1 PHE 54 HD1 PHE 54 -7.843 4.684 5.815 439 HD2 PHE 54 HD2 PHE 54 -6.926 2.972 2.033 440 HE1 PHE 54 HE1 PHE 54 -9.818 3.232 6.000 441 HE2 PHE 54 HE2 PHE 54 -8.900 1.514 2.208 442 HZ PHE 54 HZ PHE 54 -10.351 1.644 4.192 443 H VAL 55 H VAL 55 -3.486 3.860 2.582 444 HA VAL 55 HA VAL 55 -3.923 1.101 2.323 445 HB VAL 55 HB VAL 55 -1.633 2.777 1.283 446 HG11 VAL 55 1HG1 VAL 55 -2.459 -0.014 0.489 447 HG12 VAL 55 2HG1 VAL 55 -0.988 0.421 1.361 448 HG13 VAL 55 3HG1 VAL 55 -1.223 0.962 -0.302 449 HG21 VAL 55 3HG2 VAL 55 -2.879 2.680 -0.832 450 HG22 VAL 55 1HG2 VAL 55 -3.804 3.467 0.447 451 HG23 VAL 55 2HG2 VAL 55 -4.174 1.806 -0.014 452 H ARG 56 H ARG 56 -1.224 2.871 3.837 453 HA ARG 56 HA ARG 56 0.325 0.626 4.497 454 HB2 ARG 56 2HB ARG 56 1.256 2.864 4.637 455 HB3 ARG 56 1HB ARG 56 0.122 3.291 5.915 456 HG2 ARG 56 2HG ARG 56 1.152 1.626 7.383 457 HG3 ARG 56 1HG ARG 56 2.284 1.199 6.102 458 HD2 ARG 56 2HD ARG 56 3.174 3.482 6.136 459 HD3 ARG 56 1HD ARG 56 2.051 3.897 7.432 460 HE ARG 56 HE ARG 56 3.231 2.150 8.768 461 HH11 ARG 56 1HH1 ARG 56 4.863 3.801 6.140 462 HH12 ARG 56 2HH1 ARG 56 6.452 3.470 6.762 463 HH21 ARG 56 1HH2 ARG 56 5.334 1.715 9.574 464 HH22 ARG 56 2HH2 ARG 56 6.714 2.319 8.697 465 H ALA 57 H ALA 57 -2.202 2.307 6.310 466 HA ALA 57 HA ALA 57 -2.001 0.965 8.733 467 HB1 ALA 57 3HB ALA 57 -4.530 1.977 7.432 468 HB2 ALA 57 1HB ALA 57 -3.398 2.957 8.366 469 HB3 ALA 57 2HB ALA 57 -4.292 1.653 9.149 470 H VAL 58 H VAL 58 -4.138 0.199 5.984 471 HA VAL 58 HA VAL 58 -5.158 -2.170 7.177 472 HB VAL 58 HB VAL 58 -5.178 -1.445 4.248 473 HG11 VAL 58 1HG1 VAL 58 -5.771 -3.747 4.640 474 HG12 VAL 58 2HG1 VAL 58 -7.224 -2.840 4.213 475 HG13 VAL 58 3HG1 VAL 58 -6.914 -3.274 5.895 476 HG21 VAL 58 3HG2 VAL 58 -7.165 -0.732 6.404 477 HG22 VAL 58 1HG2 VAL 58 -7.385 -0.452 4.677 478 HG23 VAL 58 2HG2 VAL 58 -6.104 0.388 5.550 479 H ALA 59 H ALA 59 -2.413 -1.469 5.142 480 HA ALA 59 HA ALA 59 -1.874 -4.017 4.135 481 HB1 ALA 59 3HB ALA 59 0.128 -1.903 4.907 482 HB2 ALA 59 1HB ALA 59 -0.736 -1.986 3.370 483 HB3 ALA 59 2HB ALA 59 0.404 -3.258 3.812 484 H LYS 60 H LYS 60 -1.106 -2.560 7.246 485 HA LYS 60 HA LYS 60 0.196 -5.064 8.055 486 HB2 LYS 60 2HB LYS 60 1.053 -3.778 9.978 487 HB3 LYS 60 1HB LYS 60 1.519 -3.080 8.436 488 HG2 LYS 60 2HG LYS 60 -0.657 -1.629 8.853 489 HG3 LYS 60 1HG LYS 60 -0.289 -2.021 10.532 490 HD2 LYS 60 2HD LYS 60 1.514 -0.652 8.542 491 HD3 LYS 60 1HD LYS 60 0.773 0.063 9.974 492 HE2 LYS 60 2HE LYS 60 2.722 -2.233 10.080 493 HE3 LYS 60 1HE LYS 60 3.208 -0.543 10.182 494 HZ1 LYS 60 3HZ LYS 60 1.337 -1.894 12.057 495 HZ2 LYS 60 1HZ LYS 60 1.883 -0.292 12.167 496 HZ3 LYS 60 2HZ LYS 60 2.974 -1.577 12.362 497 H SER 61 H SER 61 -2.814 -4.200 7.903 498 HA SER 61 HA SER 61 -3.587 -5.042 10.595 499 HB2 SER 61 2HB SER 61 -5.222 -4.023 8.264 500 HB3 SER 61 1HB SER 61 -5.904 -4.527 9.810 501 HG SER 61 HG SER 61 -4.936 -2.845 10.804 502 H GLU 62 H GLU 62 -4.033 -5.971 7.199 503 HA GLU 62 HA GLU 62 -4.899 -8.637 8.115 504 HB2 GLU 62 2HB GLU 62 -6.339 -6.770 6.557 505 HB3 GLU 62 1HB GLU 62 -5.827 -8.039 5.454 506 HG2 GLU 62 2HG GLU 62 -7.382 -8.436 8.005 507 HG3 GLU 62 1HG GLU 62 -8.034 -8.492 6.367 508 H LEU 63 H LEU 63 -4.872 -10.016 5.788 509 HA LEU 63 HA LEU 63 -3.538 -11.181 4.384 510 HB2 LEU 63 2HB LEU 63 -2.255 -8.485 4.207 511 HB3 LEU 63 1HB LEU 63 -1.455 -9.864 3.479 512 HG LEU 63 HG LEU 63 -3.497 -10.276 2.117 513 HD11 LEU 63 1HD1 LEU 63 -5.138 -9.182 3.558 514 HD12 LEU 63 2HD1 LEU 63 -5.174 -8.523 1.922 515 HD13 LEU 63 3HD1 LEU 63 -4.396 -7.617 3.219 516 HD21 LEU 63 3HD2 LEU 63 -1.603 -9.064 1.194 517 HD22 LEU 63 1HD2 LEU 63 -2.244 -7.549 1.832 518 HD23 LEU 63 2HD2 LEU 63 -3.121 -8.416 0.572 519 H TYR 64 H TYR 64 -3.034 -10.994 7.321 520 HA TYR 64 HA TYR 64 -0.199 -11.598 7.482 521 HB2 TYR 64 2HB TYR 64 -0.649 -11.880 9.929 522 HB3 TYR 64 1HB TYR 64 -1.054 -10.288 9.303 523 HD1 TYR 64 HD1 TYR 64 -2.414 -13.433 10.639 524 HD2 TYR 64 HD2 TYR 64 -3.339 -9.528 9.222 525 HE1 TYR 64 HE1 TYR 64 -4.681 -13.635 11.573 526 HE2 TYR 64 HE2 TYR 64 -5.602 -9.721 10.153 527 HH TYR 64 HH TYR 64 -7.183 -11.504 10.758 528 H LYS 65 H LYS 65 -3.179 -13.270 7.124 529 HA LYS 65 HA LYS 65 -1.892 -15.765 6.773 530 HB2 LYS 65 2HB LYS 65 -1.987 -15.394 9.359 531 HB3 LYS 65 1HB LYS 65 -3.691 -15.786 9.177 532 HG2 LYS 65 2HG LYS 65 -2.551 -17.778 9.784 533 HG3 LYS 65 1HG LYS 65 -2.996 -17.923 8.081 534 HD2 LYS 65 2HD LYS 65 -0.745 -17.311 7.414 535 HD3 LYS 65 1HD LYS 65 -0.289 -17.063 9.100 536 HE2 LYS 65 2HE LYS 65 -1.093 -19.662 7.804 537 HE3 LYS 65 1HE LYS 65 0.523 -19.209 8.344 538 HZ1 LYS 65 3HZ LYS 65 -1.863 -19.762 10.022 539 HZ2 LYS 65 1HZ LYS 65 -0.467 -19.020 10.634 540 HZ3 LYS 65 2HZ LYS 65 -0.387 -20.588 10.007 541 H GLU 66 H GLU 66 -3.178 -17.099 5.609 542 HA GLU 66 HA GLU 66 -5.957 -17.377 6.000 543 HB2 GLU 66 2HB GLU 66 -5.911 -15.200 4.696 544 HB3 GLU 66 1HB GLU 66 -5.250 -16.112 3.344 545 HG2 GLU 66 2HG GLU 66 -7.260 -17.570 3.430 546 HG3 GLU 66 1HG GLU 66 -7.931 -16.491 4.648 547 H LYS 67 H LYS 67 -4.362 -17.517 2.832 548 HA LYS 67 HA LYS 67 -3.801 -20.367 3.299 549 HB2 LYS 67 2HB LYS 67 -4.912 -19.114 0.786 550 HB3 LYS 67 1HB LYS 67 -4.194 -20.717 0.822 551 HG2 LYS 67 2HG LYS 67 -6.332 -21.347 1.108 552 HG3 LYS 67 1HG LYS 67 -5.981 -20.993 2.799 553 HD2 LYS 67 2HD LYS 67 -8.055 -19.949 2.266 554 HD3 LYS 67 1HD LYS 67 -6.843 -18.673 2.394 555 HE2 LYS 67 2HE LYS 67 -6.619 -18.656 -0.050 556 HE3 LYS 67 1HE LYS 67 -7.849 -19.914 -0.167 557 HZ1 LYS 67 3HZ LYS 67 -9.404 -18.355 0.932 558 HZ2 LYS 67 1HZ LYS 67 -8.860 -17.806 -0.579 559 HZ3 LYS 67 2HZ LYS 67 -8.217 -17.145 0.843 560 H PHE 68 H PHE 68 -2.302 -17.769 3.414 561 HA PHE 68 HA PHE 68 -0.046 -18.584 1.727 562 HB2 PHE 68 2HB PHE 68 0.517 -16.071 1.658 563 HB3 PHE 68 1HB PHE 68 -0.775 -16.652 0.614 564 HD1 PHE 68 HD2 PHE 68 -0.223 -15.119 3.966 565 HD2 PHE 68 HD1 PHE 68 -2.814 -15.592 0.627 566 HE1 PHE 68 HE2 PHE 68 -1.761 -13.459 4.925 567 HE2 PHE 68 HE1 PHE 68 -4.354 -13.928 1.579 568 HZ PHE 68 HZ PHE 68 -3.827 -12.859 3.732 569 H LEU 69 H LEU 69 1.990 -17.337 2.538 570 HA LEU 69 HA LEU 69 3.572 -17.016 4.111 571 HB2 LEU 69 2HB LEU 69 1.961 -15.364 5.027 572 HB3 LEU 69 1HB LEU 69 1.295 -16.622 6.053 573 HG LEU 69 HG LEU 69 3.543 -16.854 7.123 574 HD11 LEU 69 1HD1 LEU 69 4.901 -15.958 5.315 575 HD12 LEU 69 2HD1 LEU 69 5.168 -15.054 6.805 576 HD13 LEU 69 3HD1 LEU 69 4.161 -14.371 5.529 577 HD21 LEU 69 3HD2 LEU 69 2.275 -14.123 7.254 578 HD22 LEU 69 1HD2 LEU 69 3.357 -14.819 8.463 579 HD23 LEU 69 2HD2 LEU 69 1.777 -15.547 8.167 580 H TYR 70 H TYR 70 3.764 -19.366 3.601 581 HA TYR 70 HA TYR 70 4.646 -20.693 5.872 582 HB2 TYR 70 2HB TYR 70 3.139 -22.647 5.964 583 HB3 TYR 70 1HB TYR 70 2.292 -21.166 6.387 584 HD1 TYR 70 HD1 TYR 70 2.709 -23.753 3.794 585 HD2 TYR 70 HD2 TYR 70 0.479 -20.361 5.062 586 HE1 TYR 70 HE1 TYR 70 0.988 -24.265 2.113 587 HE2 TYR 70 HE2 TYR 70 -1.240 -20.857 3.382 588 HH TYR 70 HH TYR 70 -1.438 -22.042 1.247 589 H GLY 71 H GLY 71 5.285 -23.045 5.278 590 HA2 GLY 71 2HA GLY 71 6.264 -24.536 3.825 591 HA3 GLY 71 1HA GLY 71 5.249 -23.858 2.562 592 H ASN 72 H ASN 72 7.257 -21.674 4.259 593 HA ASN 72 HA ASN 72 9.096 -20.469 3.732 594 HB2 ASN 72 2HB ASN 72 10.134 -22.770 3.680 595 HB3 ASN 72 1HB ASN 72 9.907 -22.764 1.936 596 HD21 ASN 72 1HD2 ASN 72 11.600 -21.286 4.615 597 HD22 ASN 72 2HD2 ASN 72 12.879 -20.587 3.668 598 H PHE 73 H PHE 73 6.604 -20.698 1.909 599 HA PHE 73 HA PHE 73 7.616 -19.723 -0.621 600 HB2 PHE 73 2HB PHE 73 4.829 -20.047 0.492 601 HB3 PHE 73 1HB PHE 73 5.145 -19.314 -1.078 602 HD1 PHE 73 HD1 PHE 73 6.467 -20.705 -2.774 603 HD2 PHE 73 HD2 PHE 73 4.613 -22.352 0.685 604 HE1 PHE 73 HE1 PHE 73 6.511 -22.933 -3.817 605 HE2 PHE 73 HE2 PHE 73 4.653 -24.582 -0.353 606 HZ PHE 73 HZ PHE 73 5.604 -24.876 -2.605 607 H GLN 74 H GLN 74 8.617 -18.178 1.353 608 HA GLN 74 HA GLN 74 7.058 -15.929 2.066 609 HB2 GLN 74 2HB GLN 74 10.068 -16.173 1.931 610 HB3 GLN 74 1HB GLN 74 9.163 -14.962 2.830 611 HG2 GLN 74 2HG GLN 74 9.195 -17.928 3.345 612 HG3 GLN 74 1HG GLN 74 9.972 -16.681 4.319 613 HE21 GLN 74 1HE2 GLN 74 8.704 -15.350 5.613 614 HE22 GLN 74 2HE2 GLN 74 7.074 -15.749 6.021 615 H THR 75 H THR 75 8.936 -16.735 -0.720 616 HA THR 75 HA THR 75 9.361 -14.188 -1.810 617 HB THR 75 HB THR 75 9.368 -15.453 -4.025 618 HG1 THR 75 HG1 THR 75 9.584 -17.905 -3.148 619 HG21 THR 75 3HG2 THR 75 11.420 -15.070 -2.775 620 HG22 THR 75 1HG2 THR 75 11.436 -16.683 -3.485 621 HG23 THR 75 2HG2 THR 75 11.095 -16.479 -1.767 622 H ARG 76 H ARG 76 6.563 -16.304 -1.799 623 HA ARG 76 HA ARG 76 5.074 -14.801 -3.722 624 HB2 ARG 76 2HB ARG 76 4.233 -16.872 -1.691 625 HB3 ARG 76 1HB ARG 76 3.133 -16.144 -2.856 626 HG2 ARG 76 2HG ARG 76 5.602 -17.722 -3.548 627 HG3 ARG 76 1HG ARG 76 3.947 -18.335 -3.584 628 HD2 ARG 76 2HD ARG 76 3.347 -16.835 -5.338 629 HD3 ARG 76 1HD ARG 76 4.863 -15.946 -5.178 630 HE ARG 76 HE ARG 76 5.935 -18.123 -5.906 631 HH11 ARG 76 1HH1 ARG 76 2.723 -17.139 -6.915 632 HH12 ARG 76 2HH1 ARG 76 2.768 -18.051 -8.396 633 HH21 ARG 76 1HH2 ARG 76 6.020 -19.280 -7.868 634 HH22 ARG 76 2HH2 ARG 76 4.641 -19.291 -8.933 635 H VAL 77 H VAL 77 5.552 -14.673 -0.286 636 HA VAL 77 HA VAL 77 3.403 -12.907 0.313 637 HB VAL 77 HB VAL 77 6.029 -13.223 1.788 638 HG11 VAL 77 1HG1 VAL 77 3.366 -12.148 2.718 639 HG12 VAL 77 2HG1 VAL 77 4.817 -11.194 2.411 640 HG13 VAL 77 3HG1 VAL 77 4.796 -12.371 3.723 641 HG21 VAL 77 3HG2 VAL 77 3.401 -14.656 2.153 642 HG22 VAL 77 1HG2 VAL 77 4.786 -14.782 3.238 643 HG23 VAL 77 2HG2 VAL 77 4.911 -15.362 1.577 644 H ILE 78 H ILE 78 6.779 -12.494 -0.611 645 HA ILE 78 HA ILE 78 6.927 -9.694 -0.522 646 HB ILE 78 HB ILE 78 8.286 -11.479 -2.554 647 HG12 ILE 78 2HG1 ILE 78 8.735 -12.335 -0.324 648 HG13 ILE 78 1HG1 ILE 78 10.177 -11.552 -0.958 649 HG21 ILE 78 1HG2 ILE 78 9.016 -8.759 -1.474 650 HG22 ILE 78 2HG2 ILE 78 8.456 -9.130 -3.104 651 HG23 ILE 78 3HG2 ILE 78 10.020 -9.727 -2.554 652 HD11 ILE 78 3HD1 ILE 78 9.696 -9.579 0.391 653 HD12 ILE 78 1HD1 ILE 78 9.846 -11.028 1.384 654 HD13 ILE 78 2HD1 ILE 78 8.251 -10.366 1.025 655 H GLU 79 H GLU 79 5.909 -11.906 -3.098 656 HA GLU 79 HA GLU 79 5.310 -9.984 -5.042 657 HB2 GLU 79 2HB GLU 79 5.486 -12.468 -5.396 658 HB3 GLU 79 1HB GLU 79 3.908 -12.631 -4.638 659 HG2 GLU 79 2HG GLU 79 2.966 -11.163 -6.384 660 HG3 GLU 79 1HG GLU 79 4.543 -11.142 -7.166 661 H LEU 80 H LEU 80 3.385 -11.361 -2.417 662 HA LEU 80 HA LEU 80 0.919 -10.212 -3.062 663 HB2 LEU 80 2HB LEU 80 2.101 -10.951 -0.388 664 HB3 LEU 80 1HB LEU 80 0.444 -10.419 -0.591 665 HG LEU 80 HG LEU 80 1.625 -12.874 -1.891 666 HD11 LEU 80 1HD1 LEU 80 -0.189 -12.639 0.508 667 HD12 LEU 80 2HD1 LEU 80 1.505 -13.129 0.533 668 HD13 LEU 80 3HD1 LEU 80 0.304 -14.143 -0.270 669 HD21 LEU 80 3HD2 LEU 80 -0.695 -13.411 -2.427 670 HD22 LEU 80 1HD2 LEU 80 -0.209 -11.881 -3.154 671 HD23 LEU 80 2HD2 LEU 80 -1.218 -11.888 -1.709 672 H ASN 81 H ASN 81 3.482 -8.985 -0.897 673 HA ASN 81 HA ASN 81 2.156 -6.572 -0.292 674 HB2 ASN 81 2HB ASN 81 5.078 -7.316 -0.149 675 HB3 ASN 81 1HB ASN 81 4.460 -5.755 0.385 676 HD21 ASN 81 1HD2 ASN 81 5.795 -7.577 2.061 677 HD22 ASN 81 2HD2 ASN 81 4.666 -8.139 3.245 678 H TYR 82 H TYR 82 4.615 -7.350 -2.725 679 HA TYR 82 HA TYR 82 4.924 -4.810 -3.833 680 HB2 TYR 82 2HB TYR 82 5.426 -7.578 -4.670 681 HB3 TYR 82 1HB TYR 82 5.155 -6.466 -6.007 682 HD1 TYR 82 HD1 TYR 82 7.147 -6.731 -2.850 683 HD2 TYR 82 HD2 TYR 82 6.951 -5.296 -6.850 684 HE1 TYR 82 HE1 TYR 82 9.476 -5.948 -2.678 685 HE2 TYR 82 HE2 TYR 82 9.271 -4.513 -6.690 686 HH TYR 82 HH TYR 82 10.974 -4.073 -5.273 687 H LYS 83 H LYS 83 2.635 -7.364 -4.679 688 HA LYS 83 HA LYS 83 1.473 -5.992 -6.878 689 HB2 LYS 83 2HB LYS 83 1.534 -8.497 -6.396 690 HB3 LYS 83 1HB LYS 83 0.224 -8.211 -5.264 691 HG2 LYS 83 2HG LYS 83 -1.185 -7.397 -7.084 692 HG3 LYS 83 1HG LYS 83 0.138 -7.667 -8.224 693 HD2 LYS 83 2HD LYS 83 -1.258 -9.772 -6.569 694 HD3 LYS 83 1HD LYS 83 -1.410 -9.535 -8.310 695 HE2 LYS 83 2HE LYS 83 0.886 -10.143 -8.653 696 HE3 LYS 83 1HE LYS 83 1.186 -10.179 -6.919 697 HZ1 LYS 83 3HZ LYS 83 -0.448 -12.030 -6.789 698 HZ2 LYS 83 1HZ LYS 83 0.946 -12.404 -7.683 699 HZ3 LYS 83 2HZ LYS 83 -0.509 -12.051 -8.483 700 H HIS 84 H HIS 84 0.737 -6.180 -3.456 701 HA HIS 84 HA HIS 84 -1.883 -4.990 -3.797 702 HB2 HIS 84 2HB HIS 84 -1.575 -6.745 -2.124 703 HB3 HIS 84 1HB HIS 84 -0.371 -5.769 -1.295 704 HD1 HIS 84 HD1 HIS 84 -1.404 -5.069 0.846 705 HD2 HIS 84 HD2 HIS 84 -4.075 -4.784 -2.329 706 HE1 HIS 84 HE1 HIS 84 -3.497 -4.062 1.812 707 HE2 HIS 84 HE2 HIS 84 -5.130 -3.970 -0.110 708 H LEU 85 H LEU 85 1.322 -3.950 -2.789 709 HA LEU 85 HA LEU 85 0.190 -1.430 -1.813 710 HB2 LEU 85 2HB LEU 85 2.979 -2.535 -1.524 711 HB3 LEU 85 1HB LEU 85 2.402 -1.038 -0.818 712 HG LEU 85 HG LEU 85 1.416 -3.810 -0.142 713 HD11 LEU 85 1HD1 LEU 85 3.632 -3.341 0.745 714 HD12 LEU 85 2HD1 LEU 85 2.431 -3.380 2.037 715 HD13 LEU 85 3HD1 LEU 85 3.043 -1.835 1.446 716 HD21 LEU 85 3HD2 LEU 85 0.138 -2.669 1.629 717 HD22 LEU 85 1HD2 LEU 85 -0.394 -2.217 0.008 718 HD23 LEU 85 2HD2 LEU 85 0.617 -1.116 0.942 719 H LEU 86 H LEU 86 2.471 -2.653 -4.223 720 HA LEU 86 HA LEU 86 2.821 0.118 -5.150 721 HB2 LEU 86 2HB LEU 86 4.609 -2.278 -5.545 722 HB3 LEU 86 1HB LEU 86 4.883 -0.704 -6.263 723 HG LEU 86 HG LEU 86 4.884 -1.317 -3.305 724 HD11 LEU 86 1HD1 LEU 86 6.829 -2.205 -4.486 725 HD12 LEU 86 2HD1 LEU 86 7.271 -0.856 -3.439 726 HD13 LEU 86 3HD1 LEU 86 7.137 -0.614 -5.182 727 HD21 LEU 86 3HD2 LEU 86 5.448 1.259 -4.776 728 HD22 LEU 86 1HD2 LEU 86 5.668 0.990 -3.047 729 HD23 LEU 86 2HD2 LEU 86 4.052 0.930 -3.749 730 H GLY 87 H GLY 87 1.384 -2.834 -5.939 731 HA2 GLY 87 2HA GLY 87 0.130 -3.453 -7.763 732 HA3 GLY 87 1HA GLY 87 0.325 -1.815 -8.366 733 H ARG 88 H ARG 88 3.053 -3.859 -7.634 734 HA ARG 88 HA ARG 88 3.480 -4.401 -10.474 735 HB2 ARG 88 2HB ARG 88 5.893 -3.657 -10.187 736 HB3 ARG 88 1HB ARG 88 4.696 -2.372 -10.255 737 HG2 ARG 88 2HG ARG 88 4.739 -2.260 -7.782 738 HG3 ARG 88 1HG ARG 88 6.025 -3.466 -7.786 739 HD2 ARG 88 2HD ARG 88 6.308 -0.946 -9.372 740 HD3 ARG 88 1HD ARG 88 6.624 -0.942 -7.639 741 HE ARG 88 HE ARG 88 8.069 -3.059 -8.760 742 HH11 ARG 88 1HH1 ARG 88 8.009 0.445 -8.961 743 HH12 ARG 88 2HH1 ARG 88 9.724 0.580 -9.201 744 HH21 ARG 88 1HH2 ARG 88 10.321 -2.863 -9.040 745 HH22 ARG 88 2HH2 ARG 88 11.030 -1.284 -9.224 746 H ALA 89 H ALA 89 4.949 -6.097 -10.878 747 HA ALA 89 HA ALA 89 5.250 -7.943 -8.635 748 HB1 ALA 89 3HB ALA 89 5.656 -8.362 -11.599 749 HB2 ALA 89 1HB ALA 89 4.219 -8.805 -10.678 750 HB3 ALA 89 2HB ALA 89 5.754 -9.614 -10.361 751 HA PRO 90 HA PRO 90 9.618 -7.407 -8.028 752 HB2 PRO 90 2HB PRO 90 10.428 -10.075 -8.392 753 HB3 PRO 90 1HB PRO 90 9.978 -9.313 -6.866 754 HG2 PRO 90 2HG PRO 90 8.355 -11.029 -8.679 755 HG3 PRO 90 1HG PRO 90 8.325 -10.913 -6.910 756 HD2 PRO 90 2HD PRO 90 6.401 -9.811 -8.410 757 HD3 PRO 90 1HD PRO 90 6.993 -9.010 -6.937 758 H TYR 91 H TYR 91 10.912 -6.525 -9.461 759 HA TYR 91 HA TYR 91 10.812 -7.305 -12.251 760 HB2 TYR 91 2HB TYR 91 10.817 -4.931 -11.608 761 HB3 TYR 91 1HB TYR 91 12.366 -5.140 -10.806 762 HD1 TYR 91 HD2 TYR 91 14.418 -5.521 -12.168 763 HD2 TYR 91 HD1 TYR 91 10.673 -4.595 -13.963 764 HE1 TYR 91 HE2 TYR 91 15.577 -4.887 -14.240 765 HE2 TYR 91 HE1 TYR 91 11.825 -3.957 -16.041 766 HH TYR 91 HH TYR 91 14.123 -3.142 -16.705 767 H ASP 92 H ASP 92 13.100 -7.278 -9.579 768 HA ASP 92 HA ASP 92 14.871 -9.048 -11.115 769 HB2 ASP 92 2HB ASP 92 15.730 -6.705 -11.173 770 HB3 ASP 92 1HB ASP 92 15.812 -6.726 -9.414 771 H GLU 93 H GLU 93 16.292 -10.342 -9.784 772 HA GLU 93 HA GLU 93 15.055 -11.568 -7.603 773 HB2 GLU 93 2HB GLU 93 17.218 -12.696 -7.247 774 HB3 GLU 93 1HB GLU 93 16.766 -12.675 -8.948 775 HG2 GLU 93 2HG GLU 93 18.277 -10.806 -9.336 776 HG3 GLU 93 1HG GLU 93 18.727 -10.807 -7.632 777 H SER 94 H SER 94 17.302 -8.877 -7.737 778 HA SER 94 HA SER 94 18.201 -8.862 -5.093 779 HB2 SER 94 2HB SER 94 19.158 -7.468 -6.904 780 HB3 SER 94 1HB SER 94 17.702 -6.473 -6.892 781 HG SER 94 HG SER 94 19.278 -6.873 -4.565 782 H GLU 95 H GLU 95 15.283 -7.468 -6.528 783 HA GLU 95 HA GLU 95 14.394 -6.029 -4.295 784 HB2 GLU 95 2HB GLU 95 12.761 -7.388 -6.445 785 HB3 GLU 95 1HB GLU 95 12.137 -6.209 -5.305 786 HG2 GLU 95 2HG GLU 95 13.900 -4.623 -6.253 787 HG3 GLU 95 1HG GLU 95 14.056 -5.794 -7.564 788 H VAL 96 H VAL 96 13.905 -9.378 -5.264 789 HA VAL 96 HA VAL 96 12.055 -10.014 -3.204 790 HB VAL 96 HB VAL 96 13.858 -11.931 -4.691 791 HG11 VAL 96 1HG1 VAL 96 12.774 -12.913 -2.751 792 HG12 VAL 96 2HG1 VAL 96 12.073 -13.557 -4.237 793 HG13 VAL 96 3HG1 VAL 96 11.206 -12.331 -3.311 794 HG21 VAL 96 3HG2 VAL 96 12.024 -12.186 -6.290 795 HG22 VAL 96 1HG2 VAL 96 12.636 -10.533 -6.274 796 HG23 VAL 96 2HG2 VAL 96 11.119 -10.921 -5.459 797 H ILE 97 H ILE 97 15.527 -10.693 -3.606 798 HA ILE 97 HA ILE 97 15.878 -12.048 -1.179 799 HB ILE 97 HB ILE 97 17.918 -10.457 -2.736 800 HG12 ILE 97 2HG1 ILE 97 17.179 -13.393 -2.822 801 HG13 ILE 97 1HG1 ILE 97 16.807 -12.201 -4.062 802 HG21 ILE 97 1HG2 ILE 97 19.575 -11.900 -1.629 803 HG22 ILE 97 2HG2 ILE 97 18.292 -12.609 -0.650 804 HG23 ILE 97 3HG2 ILE 97 18.693 -10.900 -0.474 805 HD11 ILE 97 3HD1 ILE 97 19.169 -11.903 -4.509 806 HD12 ILE 97 1HD1 ILE 97 18.703 -13.596 -4.672 807 HD13 ILE 97 2HD1 ILE 97 19.565 -13.055 -3.233 808 H PHE 98 H PHE 98 16.189 -8.602 -1.958 809 HA PHE 98 HA PHE 98 17.219 -7.717 0.481 810 HB2 PHE 98 2HB PHE 98 17.145 -6.232 -1.412 811 HB3 PHE 98 1HB PHE 98 15.390 -6.338 -1.492 812 HD1 PHE 98 HD2 PHE 98 18.167 -5.186 0.689 813 HD2 PHE 98 HD1 PHE 98 14.067 -4.789 -0.376 814 HE1 PHE 98 HE2 PHE 98 17.984 -3.214 2.146 815 HE2 PHE 98 HE1 PHE 98 13.875 -2.814 1.080 816 HZ PHE 98 HZ PHE 98 15.836 -2.025 2.343 817 H HIS 99 H HIS 99 13.806 -7.863 -0.549 818 HA HIS 99 HA HIS 99 12.803 -6.991 1.941 819 HB2 HIS 99 2HB HIS 99 11.494 -8.342 -0.413 820 HB3 HIS 99 1HB HIS 99 10.593 -7.825 1.013 821 HD1 HIS 99 HD1 HIS 99 11.928 -6.589 -2.156 822 HD2 HIS 99 HD2 HIS 99 10.792 -4.963 1.478 823 HE1 HIS 99 HE1 HIS 99 11.681 -4.124 -2.570 824 HE2 HIS 99 HE2 HIS 99 11.243 -3.140 -0.299 825 H LEU 100 H LEU 100 13.371 -10.229 0.616 826 HA LEU 100 HA LEU 100 12.154 -11.718 2.662 827 HB2 LEU 100 2HB LEU 100 14.584 -12.299 0.971 828 HB3 LEU 100 1HB LEU 100 13.916 -13.459 2.100 829 HG LEU 100 HG LEU 100 12.453 -12.317 -0.282 830 HD11 LEU 100 1HD1 LEU 100 14.276 -13.802 -0.937 831 HD12 LEU 100 2HD1 LEU 100 12.708 -14.555 -1.230 832 HD13 LEU 100 3HD1 LEU 100 13.673 -15.038 0.166 833 HD21 LEU 100 3HD2 LEU 100 11.695 -14.463 1.696 834 HD22 LEU 100 1HD2 LEU 100 10.805 -14.070 0.226 835 HD23 LEU 100 2HD2 LEU 100 10.937 -12.879 1.522 836 H ASP 101 H ASP 101 15.503 -10.611 2.346 837 HA ASP 101 HA ASP 101 16.459 -11.591 4.791 838 HB2 ASP 101 2HB ASP 101 17.908 -10.858 2.946 839 HB3 ASP 101 1HB ASP 101 17.388 -9.195 3.186 840 H LEU 102 H LEU 102 15.095 -8.451 3.922 841 HA LEU 102 HA LEU 102 15.380 -7.186 6.413 842 HB2 LEU 102 2HB LEU 102 14.886 -5.939 4.403 843 HB3 LEU 102 1HB LEU 102 13.364 -6.783 4.205 844 HG LEU 102 HG LEU 102 12.525 -5.714 6.275 845 HD11 LEU 102 1HD1 LEU 102 15.112 -4.173 6.162 846 HD12 LEU 102 2HD1 LEU 102 14.646 -5.337 7.403 847 HD13 LEU 102 3HD1 LEU 102 13.749 -3.829 7.225 848 HD21 LEU 102 3HD2 LEU 102 13.546 -3.825 4.161 849 HD22 LEU 102 1HD2 LEU 102 12.255 -3.478 5.311 850 HD23 LEU 102 2HD2 LEU 102 12.041 -4.744 4.102 851 H TYR 103 H TYR 103 12.600 -8.919 5.017 852 HA TYR 103 HA TYR 103 10.828 -8.631 7.135 853 HB2 TYR 103 2HB TYR 103 10.017 -9.476 5.056 854 HB3 TYR 103 1HB TYR 103 11.137 -10.833 5.093 855 HD1 TYR 103 HD1 TYR 103 8.037 -9.460 6.548 856 HD2 TYR 103 HD2 TYR 103 10.630 -12.830 6.328 857 HE1 TYR 103 HE1 TYR 103 6.324 -10.850 7.635 858 HE2 TYR 103 HE2 TYR 103 8.921 -14.224 7.414 859 HH TYR 103 HH TYR 103 6.957 -13.840 8.970 860 H GLU 104 H GLU 104 13.172 -11.250 6.554 861 HA GLU 104 HA GLU 104 12.339 -12.750 8.805 862 HB2 GLU 104 2HB GLU 104 14.927 -12.857 7.266 863 HB3 GLU 104 1HB GLU 104 14.416 -14.046 8.457 864 HG2 GLU 104 2HG GLU 104 12.350 -14.366 7.010 865 HG3 GLU 104 1HG GLU 104 13.219 -13.461 5.771 866 H ASN 105 H ASN 105 14.762 -10.238 8.396 867 HA ASN 105 HA ASN 105 15.923 -10.797 10.985 868 HB2 ASN 105 2HB ASN 105 16.500 -8.808 8.826 869 HB3 ASN 105 1HB ASN 105 17.144 -8.546 10.444 870 HD21 ASN 105 1HD2 ASN 105 17.321 -10.419 7.559 871 HD22 ASN 105 2HD2 ASN 105 18.725 -11.342 7.989 872 H GLU 106 H GLU 106 14.190 -7.982 9.594 873 HA GLU 106 HA GLU 106 14.012 -6.925 12.300 874 HB2 GLU 106 2HB GLU 106 13.427 -5.684 9.620 875 HB3 GLU 106 1HB GLU 106 13.135 -4.867 11.151 876 HG2 GLU 106 2HG GLU 106 15.786 -5.828 10.095 877 HG3 GLU 106 1HG GLU 106 15.248 -4.155 10.262 878 H GLY 107 H GLY 107 11.842 -8.012 9.717 879 HA2 GLY 107 2HA GLY 107 9.974 -9.321 10.832 880 HA3 GLY 107 1HA GLY 107 9.660 -7.827 11.697 881 H PHE 108 H PHE 108 7.580 -8.748 10.545 882 HA PHE 108 HA PHE 108 7.147 -8.199 7.815 883 HB2 PHE 108 2HB PHE 108 5.715 -9.683 9.145 884 HB3 PHE 108 1HB PHE 108 5.193 -8.320 10.125 885 HD1 PHE 108 HD2 PHE 108 5.163 -9.620 6.643 886 HD2 PHE 108 HD1 PHE 108 3.312 -7.097 9.531 887 HE1 PHE 108 HE2 PHE 108 3.281 -9.244 5.105 888 HE2 PHE 108 HE1 PHE 108 1.429 -6.715 7.995 889 HZ PHE 108 HZ PHE 108 1.409 -7.790 5.779 890 H ASP 109 H ASP 109 6.753 -6.272 10.734 891 HA ASP 109 HA ASP 109 5.363 -4.094 9.650 892 HB2 ASP 109 2HB ASP 109 5.774 -4.566 12.093 893 HB3 ASP 109 1HB ASP 109 7.421 -3.990 11.868 894 H ALA 110 H ALA 110 8.785 -4.856 9.771 895 HA ALA 110 HA ALA 110 9.728 -2.340 8.865 896 HB1 ALA 110 3HB ALA 110 11.127 -3.935 10.106 897 HB2 ALA 110 1HB ALA 110 11.861 -3.443 8.581 898 HB3 ALA 110 2HB ALA 110 11.093 -5.024 8.718 899 H ASP 111 H ASP 111 9.012 -5.406 7.223 900 HA ASP 111 HA ASP 111 9.961 -4.639 4.686 901 HB2 ASP 111 2HB ASP 111 9.414 -6.988 5.301 902 HB3 ASP 111 1HB ASP 111 7.702 -6.571 5.268 903 H ILE 112 H ILE 112 6.681 -4.544 6.048 904 HA ILE 112 HA ILE 112 5.346 -3.438 3.870 905 HB ILE 112 HB ILE 112 4.803 -3.073 6.819 906 HG12 ILE 112 2HG1 ILE 112 4.728 -5.401 6.035 907 HG13 ILE 112 1HG1 ILE 112 3.126 -4.825 6.486 908 HG21 ILE 112 1HG2 ILE 112 3.727 -1.292 5.550 909 HG22 ILE 112 2HG2 ILE 112 2.537 -2.420 6.198 910 HG23 ILE 112 3HG2 ILE 112 2.977 -2.488 4.492 911 HD11 ILE 112 3HD1 ILE 112 4.197 -5.070 3.685 912 HD12 ILE 112 1HD1 ILE 112 2.597 -4.473 4.126 913 HD13 ILE 112 2HD1 ILE 112 3.037 -6.147 4.463 914 H ASP 113 H ASP 113 7.093 -1.831 6.487 915 HA ASP 113 HA ASP 113 6.431 0.815 5.924 916 HB2 ASP 113 2HB ASP 113 7.596 0.230 7.959 917 HB3 ASP 113 1HB ASP 113 8.987 -0.350 7.050 918 H SER 114 H SER 114 8.788 -1.294 4.426 919 HA SER 114 HA SER 114 10.413 0.573 3.154 920 HB2 SER 114 2HB SER 114 9.663 -2.143 2.073 921 HB3 SER 114 1HB SER 114 11.157 -1.249 1.785 922 HG SER 114 HG SER 114 10.302 -2.631 4.063 923 H TYR 115 H TYR 115 7.313 -0.770 2.144 924 HA TYR 115 HA TYR 115 7.546 0.226 -0.551 925 HB2 TYR 115 2HB TYR 115 5.077 -0.820 0.855 926 HB3 TYR 115 1HB TYR 115 5.324 -0.673 -0.882 927 HD1 TYR 115 HD1 TYR 115 6.831 -2.236 -2.057 928 HD2 TYR 115 HD2 TYR 115 6.004 -2.648 2.091 929 HE1 TYR 115 HE1 TYR 115 7.746 -4.518 -2.103 930 HE2 TYR 115 HE2 TYR 115 6.913 -4.928 2.055 931 HH TYR 115 HH TYR 115 7.694 -6.584 0.788 932 H ILE 116 H ILE 116 6.308 1.350 2.454 933 HA ILE 116 HA ILE 116 4.677 3.425 1.211 934 HB ILE 116 HB ILE 116 5.109 2.851 4.149 935 HG12 ILE 116 2HG1 ILE 116 4.156 0.891 3.040 936 HG13 ILE 116 1HG1 ILE 116 2.956 1.663 4.071 937 HG21 ILE 116 1HG2 ILE 116 2.997 4.452 2.717 938 HG22 ILE 116 2HG2 ILE 116 4.269 5.080 3.764 939 HG23 ILE 116 3HG2 ILE 116 2.988 4.073 4.437 940 HD11 ILE 116 3HD1 ILE 116 2.006 0.928 1.950 941 HD12 ILE 116 1HD1 ILE 116 3.145 1.956 1.080 942 HD13 ILE 116 2HD1 ILE 116 1.921 2.681 2.125 943 H ASP 117 H ASP 117 7.777 2.956 2.536 944 HA ASP 117 HA ASP 117 8.180 5.689 3.395 945 HB2 ASP 117 2HB ASP 117 9.136 3.765 4.633 946 HB3 ASP 117 1HB ASP 117 10.138 3.388 3.238 947 H SER 118 H SER 118 8.062 4.364 0.435 948 HA SER 118 HA SER 118 10.123 6.170 -0.624 949 HB2 SER 118 2HB SER 118 9.607 4.965 -2.818 950 HB3 SER 118 1HB SER 118 10.400 4.006 -1.568 951 HG SER 118 HG SER 118 7.587 4.060 -1.836 952 HA PRO 119 HA PRO 119 6.322 8.663 -0.621 953 HB2 PRO 119 2HB PRO 119 7.667 10.993 -1.314 954 HB3 PRO 119 1HB PRO 119 7.359 10.432 0.329 955 HG2 PRO 119 2HG PRO 119 9.821 10.188 -1.329 956 HG3 PRO 119 1HG PRO 119 9.657 10.474 0.415 957 HD2 PRO 119 2HD PRO 119 10.337 8.066 -0.567 958 HD3 PRO 119 1HD PRO 119 9.318 8.235 0.879 959 H GLU 120 H GLU 120 8.814 9.170 -3.148 960 HA GLU 120 HA GLU 120 6.917 10.358 -4.909 961 HB2 GLU 120 2HB GLU 120 9.348 10.876 -4.964 962 HB3 GLU 120 1HB GLU 120 9.643 9.266 -5.609 963 HG2 GLU 120 2HG GLU 120 8.430 9.758 -7.601 964 HG3 GLU 120 1HG GLU 120 7.872 11.295 -6.943 965 H TYR 121 H TYR 121 8.296 7.138 -4.597 966 HA TYR 121 HA TYR 121 7.181 6.054 -6.941 967 HB2 TYR 121 2HB TYR 121 8.231 4.918 -4.393 968 HB3 TYR 121 1HB TYR 121 7.261 3.871 -5.427 969 HD1 TYR 121 HD1 TYR 121 10.402 5.759 -5.159 970 HD2 TYR 121 HD2 TYR 121 8.073 3.141 -7.567 971 HE1 TYR 121 HE1 TYR 121 12.365 5.328 -6.582 972 HE2 TYR 121 HE2 TYR 121 10.021 2.704 -8.995 973 HH TYR 121 HH TYR 121 12.134 3.702 -9.600 974 H THR 122 H THR 122 5.819 6.752 -3.811 975 HA THR 122 HA THR 122 3.399 5.284 -4.355 976 HB THR 122 HB THR 122 3.888 7.324 -2.179 977 HG1 THR 122 HG1 THR 122 4.635 4.637 -2.446 978 HG21 THR 122 3HG2 THR 122 1.533 6.810 -2.565 979 HG22 THR 122 1HG2 THR 122 2.077 6.141 -1.027 980 HG23 THR 122 2HG2 THR 122 1.876 5.086 -2.426 981 H ASN 123 H ASN 123 4.235 8.776 -4.053 982 HA ASN 123 HA ASN 123 1.539 9.534 -4.605 983 HB2 ASN 123 2HB ASN 123 2.201 11.771 -4.340 984 HB3 ASN 123 1HB ASN 123 3.226 10.862 -3.237 985 HD21 ASN 123 1HD2 ASN 123 3.097 12.790 -6.106 986 HD22 ASN 123 2HD2 ASN 123 4.814 12.976 -6.303 987 H SER 124 H SER 124 4.308 9.001 -6.645 988 HA SER 124 HA SER 124 3.118 10.437 -8.868 989 HB2 SER 124 2HB SER 124 5.568 10.431 -8.571 990 HB3 SER 124 1HB SER 124 5.586 8.682 -8.787 991 HG SER 124 HG SER 124 4.385 9.381 -10.875 992 H PHE 125 H PHE 125 2.561 7.491 -7.485 993 HA PHE 125 HA PHE 125 1.753 6.300 -10.060 994 HB2 PHE 125 2HB PHE 125 3.520 5.066 -8.764 995 HB3 PHE 125 1HB PHE 125 2.345 4.843 -7.475 996 HD1 PHE 125 HD1 PHE 125 3.159 3.990 -10.965 997 HD2 PHE 125 HD2 PHE 125 0.693 3.145 -7.600 998 HE1 PHE 125 HE1 PHE 125 2.384 1.927 -12.057 999 HE2 PHE 125 HE2 PHE 125 -0.086 1.081 -8.686 1000 HZ PHE 125 HZ PHE 125 0.758 0.469 -10.914 1001 H GLY 126 H GLY 126 0.879 6.845 -6.684 1002 HA2 GLY 126 2HA GLY 126 -1.860 7.245 -7.261 1003 HA3 GLY 126 1HA GLY 126 -1.616 5.622 -6.631 1004 H ASP 127 H ASP 127 -1.143 9.047 -5.938 1005 HA ASP 127 HA ASP 127 -0.574 8.561 -3.149 1006 HB2 ASP 127 2HB ASP 127 -0.601 11.033 -2.948 1007 HB3 ASP 127 1HB ASP 127 0.479 10.471 -4.215 1008 H TRP 128 H TRP 128 -3.255 9.837 -5.052 1009 HA TRP 128 HA TRP 128 -5.033 9.260 -2.775 1010 HB2 TRP 128 2HB TRP 128 -5.289 11.258 -5.024 1011 HB3 TRP 128 1HB TRP 128 -6.661 10.776 -4.029 1012 HD1 TRP 128 HD1 TRP 128 -3.326 12.676 -3.790 1013 HE1 TRP 128 HE1 TRP 128 -3.372 14.143 -1.671 1014 HE3 TRP 128 HE3 TRP 128 -7.721 11.025 -1.760 1015 HZ2 TRP 128 HZ2 TRP 128 -5.061 14.550 0.554 1016 HZ3 TRP 128 HZ3 TRP 128 -8.478 12.005 0.366 1017 HH2 TRP 128 HH2 TRP 128 -7.175 13.730 1.498 1018 H VAL 129 H VAL 129 -3.877 7.627 -5.055 1019 HA VAL 129 HA VAL 129 -6.420 6.546 -6.076 1020 HB VAL 129 HB VAL 129 -3.755 6.546 -7.517 1021 HG11 VAL 129 1HG1 VAL 129 -6.481 5.631 -8.425 1022 HG12 VAL 129 2HG1 VAL 129 -5.103 4.595 -8.050 1023 HG13 VAL 129 3HG1 VAL 129 -5.031 5.695 -9.426 1024 HG21 VAL 129 3HG2 VAL 129 -6.242 8.165 -8.063 1025 HG22 VAL 129 1HG2 VAL 129 -4.808 8.107 -9.090 1026 HG23 VAL 129 2HG2 VAL 129 -4.702 8.785 -7.464 1027 H VAL 130 H VAL 130 -6.709 4.380 -5.860 1028 HA VAL 130 HA VAL 130 -5.045 2.961 -4.040 1029 HB VAL 130 HB VAL 130 -7.248 1.900 -5.823 1030 HG11 VAL 130 1HG1 VAL 130 -7.390 0.069 -4.185 1031 HG12 VAL 130 2HG1 VAL 130 -5.979 0.723 -3.353 1032 HG13 VAL 130 3HG1 VAL 130 -5.827 0.114 -5.000 1033 HG21 VAL 130 3HG2 VAL 130 -8.680 2.124 -3.843 1034 HG22 VAL 130 1HG2 VAL 130 -8.050 3.683 -4.377 1035 HG23 VAL 130 2HG2 VAL 130 -7.346 2.880 -2.972 1036 HA PRO 131 HA PRO 131 -1.759 1.597 -6.681 1037 HB2 PRO 131 2HB PRO 131 -1.572 -0.900 -5.329 1038 HB3 PRO 131 1HB PRO 131 -0.583 0.537 -5.076 1039 HG2 PRO 131 2HG PRO 131 -2.943 -0.422 -3.563 1040 HG3 PRO 131 1HG PRO 131 -1.561 0.538 -3.007 1041 HD2 PRO 131 2HD PRO 131 -3.974 1.641 -3.361 1042 HD3 PRO 131 1HD PRO 131 -2.488 2.529 -3.759 1043 H TYR 132 H TYR 132 -2.257 1.030 -8.654 1044 HA TYR 132 HA TYR 132 -3.953 -1.322 -9.123 1045 HB2 TYR 132 2HB TYR 132 -4.200 -0.270 -11.444 1046 HB3 TYR 132 1HB TYR 132 -4.989 0.566 -10.110 1047 HD1 TYR 132 HD1 TYR 132 -2.029 0.617 -12.325 1048 HD2 TYR 132 HD2 TYR 132 -4.398 2.800 -9.555 1049 HE1 TYR 132 HE1 TYR 132 -0.805 2.663 -12.909 1050 HE2 TYR 132 HE2 TYR 132 -3.189 4.860 -10.134 1051 HH TYR 132 HH TYR 132 -0.996 5.501 -11.059 1052 H TYR 133 H TYR 133 -3.375 -2.397 -11.330 1053 HA TYR 133 HA TYR 133 -0.617 -3.216 -11.065 1054 HB2 TYR 133 2HB TYR 133 -2.659 -4.737 -11.500 1055 HB3 TYR 133 1HB TYR 133 -2.527 -4.201 -13.172 1056 HD1 TYR 133 HD1 TYR 133 -0.064 -4.442 -14.201 1057 HD2 TYR 133 HD2 TYR 133 -1.564 -6.647 -10.875 1058 HE1 TYR 133 HE1 TYR 133 1.615 -6.199 -14.602 1059 HE2 TYR 133 HE2 TYR 133 0.113 -8.398 -11.266 1060 HH TYR 133 HH TYR 133 2.751 -7.988 -13.421 1061 H ARG 134 H ARG 134 0.923 -2.137 -12.008 1062 HA ARG 134 HA ARG 134 2.203 -1.011 -13.483 1063 HB2 ARG 134 2HB ARG 134 2.386 -1.872 -15.631 1064 HB3 ARG 134 1HB ARG 134 1.616 -3.197 -14.774 1065 HG2 ARG 134 2HG ARG 134 -0.510 -2.667 -15.714 1066 HG3 ARG 134 1HG ARG 134 0.104 -1.164 -16.398 1067 HD2 ARG 134 2HD ARG 134 0.020 -2.652 -18.204 1068 HD3 ARG 134 1HD ARG 134 1.716 -2.625 -17.725 1069 HE ARG 134 HE ARG 134 1.527 -4.810 -16.950 1070 HH11 ARG 134 1HH1 ARG 134 -1.539 -3.563 -18.076 1071 HH12 ARG 134 2HH1 ARG 134 -2.292 -5.122 -18.172 1072 HH21 ARG 134 1HH2 ARG 134 0.547 -6.891 -17.092 1073 HH22 ARG 134 2HH2 ARG 134 -1.118 -7.014 -17.595 1074 H GLY 135 H GLY 135 1.956 0.260 -15.809 1075 HA2 GLY 135 2HA GLY 135 0.284 2.518 -15.122 1076 HA3 GLY 135 1HA GLY 135 1.353 2.390 -16.514 1077 H LEU 136 H LEU 136 -1.478 0.597 -15.349 1078 HA LEU 136 HA LEU 136 -3.370 -0.134 -16.336 1079 HB2 LEU 136 2HB LEU 136 -2.963 2.394 -17.916 1080 HB3 LEU 136 1HB LEU 136 -4.339 1.346 -18.184 1081 HG LEU 136 HG LEU 136 -4.916 1.668 -15.731 1082 HD11 LEU 136 1HD1 LEU 136 -2.910 3.908 -15.981 1083 HD12 LEU 136 2HD1 LEU 136 -2.746 2.478 -14.964 1084 HD13 LEU 136 3HD1 LEU 136 -4.017 3.653 -14.633 1085 HD21 LEU 136 3HD2 LEU 136 -5.936 3.866 -16.125 1086 HD22 LEU 136 1HD2 LEU 136 -6.140 2.779 -17.498 1087 HD23 LEU 136 2HD2 LEU 136 -4.933 4.063 -17.563 1088 H GLU 137 H GLU 137 -2.413 1.211 -19.386 1089 HA GLU 137 HA GLU 137 -1.057 -1.071 -20.398 1090 HB2 GLU 137 2HB GLU 137 -3.984 -0.875 -20.818 1091 HB3 GLU 137 1HB GLU 137 -3.026 -1.222 -22.251 1092 HG2 GLU 137 2HG GLU 137 -3.004 -2.812 -19.694 1093 HG3 GLU 137 1HG GLU 137 -3.835 -3.261 -21.184 1094 H HIS 138 H HIS 138 -3.293 1.436 -21.562 1095 HA HIS 138 HA HIS 138 -1.099 2.474 -23.233 1096 HB2 HIS 138 2HB HIS 138 -4.082 2.562 -23.761 1097 HB3 HIS 138 1HB HIS 138 -2.876 3.408 -24.724 1098 HD1 HIS 138 HD1 HIS 138 -1.647 2.079 -26.499 1099 HD2 HIS 138 HD2 HIS 138 -4.032 -0.280 -24.031 1100 HE1 HIS 138 HE1 HIS 138 -1.701 -0.196 -27.574 1101 HE2 HIS 138 HE2 HIS 138 -3.006 -1.650 -25.974 1102 H HIS 139 H HIS 139 -0.273 4.098 -22.085 1103 HA HIS 139 HA HIS 139 -2.167 6.041 -20.946 1104 HB2 HIS 139 2HB HIS 139 -0.496 6.688 -19.332 1105 HB3 HIS 139 1HB HIS 139 -0.688 4.944 -19.266 1106 HD1 HIS 139 HD1 HIS 139 1.820 7.416 -19.178 1107 HD2 HIS 139 HD2 HIS 139 1.528 3.660 -20.929 1108 HE1 HIS 139 HE1 HIS 139 4.188 6.682 -19.599 1109 HE2 HIS 139 HE2 HIS 139 3.982 4.304 -20.403 1110 H HIS 140 H HIS 140 -2.174 8.053 -21.742 1111 HA HIS 140 HA HIS 140 -0.725 8.352 -24.222 1112 HB2 HIS 140 2HB HIS 140 -3.206 8.880 -23.824 1113 HB3 HIS 140 1HB HIS 140 -2.642 10.365 -23.066 1114 HD1 HIS 140 HD1 HIS 140 -1.971 8.574 -26.372 1115 HD2 HIS 140 HD2 HIS 140 -2.614 12.389 -24.838 1116 HE1 HIS 140 HE1 HIS 140 -1.936 10.122 -28.358 1117 HE2 HIS 140 HE2 HIS 140 -2.182 12.441 -27.392 1118 H HIS 141 H HIS 141 0.258 8.938 -21.224 1119 HA HIS 141 HA HIS 141 1.470 11.518 -21.555 1120 HB2 HIS 141 2HB HIS 141 1.028 10.226 -19.347 1121 HB3 HIS 141 1HB HIS 141 2.508 9.356 -19.729 1122 HD1 HIS 141 HD1 HIS 141 1.375 12.113 -17.831 1123 HD2 HIS 141 HD2 HIS 141 4.742 11.400 -20.177 1124 HE1 HIS 141 HE1 HIS 141 3.098 13.784 -17.078 1125 HE2 HIS 141 HE2 HIS 141 5.178 13.220 -18.381 1126 H HIS 142 H HIS 142 2.813 11.759 -23.259 1127 HA HIS 142 HA HIS 142 4.596 9.508 -23.928 1128 HB2 HIS 142 2HB HIS 142 2.636 9.531 -25.408 1129 HB3 HIS 142 1HB HIS 142 2.969 11.201 -25.841 1130 HD1 HIS 142 HD1 HIS 142 4.719 11.630 -27.638 1131 HD2 HIS 142 HD2 HIS 142 4.411 7.626 -26.549 1132 HE1 HIS 142 HE1 HIS 142 6.032 10.352 -29.364 1133 HE2 HIS 142 HE2 HIS 142 5.660 7.919 -28.797 1134 H HIS 143 H HIS 143 6.605 9.989 -24.655 1135 HA HIS 143 HA HIS 143 7.221 12.718 -25.452 1136 HB2 HIS 143 2HB HIS 143 9.420 12.554 -24.132 1137 HB3 HIS 143 1HB HIS 143 7.960 12.938 -23.236 1138 HD1 HIS 143 HD1 HIS 143 7.579 11.591 -21.193 1139 HD2 HIS 143 HD2 HIS 143 10.193 9.709 -23.819 1140 HE1 HIS 143 HE1 HIS 143 8.380 9.535 -19.995 1141 HE2 HIS 143 HE2 HIS 143 10.165 8.577 -21.497 Start of MODEL 9 1 H1 MET 1 1H MET 1 -8.621 -0.359 -14.346 2 H2 MET 1 2H MET 1 -7.431 0.573 -15.116 3 H3 MET 1 3H MET 1 -8.890 0.239 -15.911 4 HA MET 1 HA MET 1 -8.868 2.490 -15.111 5 HB2 MET 1 2HB MET 1 -10.744 0.616 -13.658 6 HB3 MET 1 1HB MET 1 -10.919 2.363 -13.636 7 HG2 MET 1 2HG MET 1 -12.408 1.538 -15.266 8 HG3 MET 1 1HG MET 1 -11.073 2.295 -16.131 9 HE1 MET 1 3HE MET 1 -11.972 -0.570 -18.580 10 HE2 MET 1 1HE MET 1 -11.660 1.155 -18.387 11 HE3 MET 1 2HE MET 1 -13.083 0.427 -17.639 12 HA PRO 2 HA PRO 2 -6.560 3.011 -11.322 13 HB2 PRO 2 2HB PRO 2 -6.939 5.866 -11.739 14 HB3 PRO 2 1HB PRO 2 -5.450 4.921 -11.825 15 HG2 PRO 2 2HG PRO 2 -6.621 6.047 -14.006 16 HG3 PRO 2 1HG PRO 2 -5.655 4.561 -14.079 17 HD2 PRO 2 2HD PRO 2 -8.632 4.890 -14.049 18 HD3 PRO 2 1HD PRO 2 -7.630 3.779 -15.009 19 H VAL 3 H VAL 3 -7.657 2.644 -9.489 20 HA VAL 3 HA VAL 3 -10.163 3.979 -8.949 21 HB VAL 3 HB VAL 3 -8.569 2.171 -7.121 22 HG11 VAL 3 1HG1 VAL 3 -10.194 3.554 -5.947 23 HG12 VAL 3 2HG1 VAL 3 -10.689 1.862 -5.944 24 HG13 VAL 3 3HG1 VAL 3 -11.467 3.006 -7.038 25 HG21 VAL 3 3HG2 VAL 3 -9.132 1.002 -9.179 26 HG22 VAL 3 1HG2 VAL 3 -10.822 1.479 -9.006 27 HG23 VAL 3 2HG2 VAL 3 -10.090 0.386 -7.832 28 H GLU 4 H GLU 4 -9.912 6.086 -8.531 29 HA GLU 4 HA GLU 4 -7.777 6.875 -6.666 30 HB2 GLU 4 2HB GLU 4 -7.804 9.065 -7.848 31 HB3 GLU 4 1HB GLU 4 -7.338 7.722 -8.886 32 HG2 GLU 4 2HG GLU 4 -9.778 7.652 -9.609 33 HG3 GLU 4 1HG GLU 4 -9.930 9.226 -8.829 34 H LEU 5 H LEU 5 -8.242 8.304 -5.037 35 HA LEU 5 HA LEU 5 -11.048 8.729 -4.438 36 HB2 LEU 5 2HB LEU 5 -9.433 8.107 -2.651 37 HB3 LEU 5 1HB LEU 5 -8.592 9.623 -2.915 38 HG LEU 5 HG LEU 5 -10.636 10.848 -2.234 39 HD11 LEU 5 1HD1 LEU 5 -12.470 9.640 -1.173 40 HD12 LEU 5 2HD1 LEU 5 -11.703 8.106 -1.580 41 HD13 LEU 5 3HD1 LEU 5 -12.290 9.164 -2.863 42 HD21 LEU 5 3HD2 LEU 5 -9.612 8.817 -0.255 43 HD22 LEU 5 1HD2 LEU 5 -10.513 10.275 0.159 44 HD23 LEU 5 2HD2 LEU 5 -8.920 10.406 -0.584 45 H ARG 6 H ARG 6 -11.913 10.219 -5.704 46 HA ARG 6 HA ARG 6 -10.414 12.434 -6.725 47 HB2 ARG 6 2HB ARG 6 -13.375 11.835 -6.914 48 HB3 ARG 6 1HB ARG 6 -12.494 13.014 -7.882 49 HG2 ARG 6 2HG ARG 6 -11.212 11.283 -8.933 50 HG3 ARG 6 1HG ARG 6 -11.904 10.064 -7.866 51 HD2 ARG 6 2HD ARG 6 -14.129 10.540 -8.835 52 HD3 ARG 6 1HD ARG 6 -13.364 11.669 -9.957 53 HE ARG 6 HE ARG 6 -11.978 9.395 -10.375 54 HH11 ARG 6 1HH1 ARG 6 -15.413 10.063 -10.313 55 HH12 ARG 6 2HH1 ARG 6 -15.810 8.806 -11.447 56 HH21 ARG 6 1HH2 ARG 6 -12.484 7.721 -11.838 57 HH22 ARG 6 2HH2 ARG 6 -14.140 7.460 -12.305 58 H ALA 7 H ALA 7 -10.851 14.648 -6.368 59 HA ALA 7 HA ALA 7 -11.059 15.369 -3.684 60 HB1 ALA 7 3HB ALA 7 -9.953 16.747 -5.380 61 HB2 ALA 7 1HB ALA 7 -11.140 17.671 -4.459 62 HB3 ALA 7 2HB ALA 7 -11.521 17.122 -6.090 63 H ASN 8 H ASN 8 -13.510 15.268 -6.204 64 HA ASN 8 HA ASN 8 -15.541 15.883 -4.171 65 HB2 ASN 8 2HB ASN 8 -15.879 15.607 -7.172 66 HB3 ASN 8 1HB ASN 8 -17.134 16.075 -6.032 67 HD21 ASN 8 1HD2 ASN 8 -16.321 17.552 -8.285 68 HD22 ASN 8 2HD2 ASN 8 -15.666 19.063 -7.722 69 H TRP 9 H TRP 9 -15.450 13.918 -3.063 70 HA TRP 9 HA TRP 9 -16.223 11.556 -4.637 71 HB2 TRP 9 2HB TRP 9 -15.197 10.186 -2.859 72 HB3 TRP 9 1HB TRP 9 -14.036 11.268 -3.613 73 HD1 TRP 9 HD1 TRP 9 -12.955 13.158 -2.103 74 HE1 TRP 9 HE1 TRP 9 -12.887 13.531 0.441 75 HE3 TRP 9 HE3 TRP 9 -16.633 9.901 -0.696 76 HZ2 TRP 9 HZ2 TRP 9 -14.210 12.584 2.738 77 HZ3 TRP 9 HZ3 TRP 9 -17.173 9.691 1.695 78 HH2 TRP 9 HH2 TRP 9 -15.985 11.006 3.376 79 H SER 10 H SER 10 -17.517 9.951 -3.496 80 HA SER 10 HA SER 10 -19.231 11.051 -1.392 81 HB2 SER 10 2HB SER 10 -20.356 11.243 -3.613 82 HB3 SER 10 1HB SER 10 -20.204 9.499 -3.809 83 HG SER 10 HG SER 10 -21.904 9.253 -2.622 84 H GLU 11 H GLU 11 -20.745 9.012 -0.716 85 HA GLU 11 HA GLU 11 -19.097 7.287 0.706 86 HB2 GLU 11 2HB GLU 11 -21.973 6.897 -0.132 87 HB3 GLU 11 1HB GLU 11 -21.152 5.966 1.114 88 HG2 GLU 11 2HG GLU 11 -21.428 8.950 1.237 89 HG3 GLU 11 1HG GLU 11 -22.634 7.848 1.897 90 H GLU 12 H GLU 12 -20.845 6.685 -2.335 91 HA GLU 12 HA GLU 12 -20.030 4.004 -2.631 92 HB2 GLU 12 2HB GLU 12 -20.535 4.440 -5.108 93 HB3 GLU 12 1HB GLU 12 -21.851 4.631 -3.959 94 HG2 GLU 12 2HG GLU 12 -20.257 7.032 -4.661 95 HG3 GLU 12 1HG GLU 12 -21.382 6.397 -5.858 96 H ASP 13 H ASP 13 -18.639 7.018 -3.888 97 HA ASP 13 HA ASP 13 -16.546 5.937 -5.381 98 HB2 ASP 13 2HB ASP 13 -16.470 8.490 -3.746 99 HB3 ASP 13 1HB ASP 13 -15.417 8.090 -5.096 100 H LEU 14 H LEU 14 -16.663 6.925 -1.993 101 HA LEU 14 HA LEU 14 -14.006 6.295 -1.343 102 HB2 LEU 14 2HB LEU 14 -15.514 7.746 -0.016 103 HB3 LEU 14 1HB LEU 14 -16.432 6.330 0.454 104 HG LEU 14 HG LEU 14 -14.491 5.448 1.653 105 HD11 LEU 14 1HD1 LEU 14 -12.506 6.869 1.967 106 HD12 LEU 14 2HD1 LEU 14 -13.151 8.006 0.784 107 HD13 LEU 14 3HD1 LEU 14 -12.714 6.372 0.287 108 HD21 LEU 14 3HD2 LEU 14 -15.117 8.306 2.383 109 HD22 LEU 14 1HD2 LEU 14 -14.470 7.071 3.463 110 HD23 LEU 14 2HD2 LEU 14 -16.098 6.901 2.806 111 H GLU 15 H GLU 15 -16.986 4.367 -1.166 112 HA GLU 15 HA GLU 15 -15.859 2.162 0.160 113 HB2 GLU 15 2HB GLU 15 -18.279 2.504 -0.023 114 HB3 GLU 15 1HB GLU 15 -18.193 2.215 -1.756 115 HG2 GLU 15 2HG GLU 15 -17.521 -0.059 -1.397 116 HG3 GLU 15 1HG GLU 15 -17.414 0.208 0.341 117 H THR 16 H THR 16 -16.193 2.890 -3.296 118 HA THR 16 HA THR 16 -15.130 0.500 -4.295 119 HB THR 16 HB THR 16 -14.958 3.290 -5.461 120 HG1 THR 16 HG1 THR 16 -16.758 1.149 -6.042 121 HG21 THR 16 3HG2 THR 16 -14.560 0.606 -6.789 122 HG22 THR 16 1HG2 THR 16 -13.304 1.806 -6.486 123 HG23 THR 16 2HG2 THR 16 -14.611 2.163 -7.616 124 H VAL 17 H VAL 17 -13.546 3.507 -3.291 125 HA VAL 17 HA VAL 17 -10.897 2.803 -3.865 126 HB VAL 17 HB VAL 17 -11.985 4.540 -1.637 127 HG11 VAL 17 1HG1 VAL 17 -9.739 3.846 -1.059 128 HG12 VAL 17 2HG1 VAL 17 -9.731 5.540 -1.556 129 HG13 VAL 17 3HG1 VAL 17 -9.160 4.292 -2.664 130 HG21 VAL 17 3HG2 VAL 17 -11.395 6.397 -3.111 131 HG22 VAL 17 1HG2 VAL 17 -12.559 5.315 -3.879 132 HG23 VAL 17 2HG2 VAL 17 -10.857 5.254 -4.341 133 H ILE 18 H ILE 18 -12.843 2.283 -0.956 134 HA ILE 18 HA ILE 18 -10.901 1.051 0.635 135 HB ILE 18 HB ILE 18 -13.897 0.676 0.605 136 HG12 ILE 18 2HG1 ILE 18 -12.119 2.324 2.412 137 HG13 ILE 18 1HG1 ILE 18 -13.068 2.967 1.074 138 HG21 ILE 18 1HG2 ILE 18 -11.912 -0.178 2.710 139 HG22 ILE 18 2HG2 ILE 18 -12.851 -1.244 1.665 140 HG23 ILE 18 3HG2 ILE 18 -13.667 -0.241 2.863 141 HD11 ILE 18 3HD1 ILE 18 -15.118 2.245 2.201 142 HD12 ILE 18 1HD1 ILE 18 -14.175 3.359 3.191 143 HD13 ILE 18 2HD1 ILE 18 -14.154 1.631 3.543 144 H ARG 19 H ARG 19 -13.305 -0.415 -1.552 145 HA ARG 19 HA ARG 19 -12.581 -3.094 -0.979 146 HB2 ARG 19 2HB ARG 19 -13.893 -1.987 -3.477 147 HB3 ARG 19 1HB ARG 19 -13.844 -3.679 -3.015 148 HG2 ARG 19 2HG ARG 19 -15.237 -1.486 -1.497 149 HG3 ARG 19 1HG ARG 19 -16.011 -2.656 -2.563 150 HD2 ARG 19 2HD ARG 19 -14.947 -4.430 -1.029 151 HD3 ARG 19 1HD ARG 19 -14.726 -3.099 0.107 152 HE ARG 19 HE ARG 19 -17.280 -4.219 -0.810 153 HH11 ARG 19 1HH1 ARG 19 -15.568 -1.958 1.266 154 HH12 ARG 19 2HH1 ARG 19 -16.964 -1.616 2.241 155 HH21 ARG 19 1HH2 ARG 19 -19.085 -3.775 0.478 156 HH22 ARG 19 2HH2 ARG 19 -18.955 -2.648 1.797 157 H ALA 20 H ALA 20 -11.388 -0.738 -3.275 158 HA ALA 20 HA ALA 20 -9.917 -2.500 -4.920 159 HB1 ALA 20 3HB ALA 20 -8.739 -0.518 -5.685 160 HB2 ALA 20 1HB ALA 20 -9.359 0.404 -4.314 161 HB3 ALA 20 2HB ALA 20 -10.465 -0.188 -5.554 162 H VAL 21 H VAL 21 -9.109 -0.716 -1.981 163 HA VAL 21 HA VAL 21 -6.395 -1.520 -1.872 164 HB VAL 21 HB VAL 21 -8.217 -0.698 0.402 165 HG11 VAL 21 1HG1 VAL 21 -5.202 -0.769 0.265 166 HG12 VAL 21 2HG1 VAL 21 -6.217 -1.893 1.169 167 HG13 VAL 21 3HG1 VAL 21 -6.171 -0.188 1.621 168 HG21 VAL 21 3HG2 VAL 21 -7.239 1.514 0.137 169 HG22 VAL 21 1HG2 VAL 21 -8.043 1.004 -1.347 170 HG23 VAL 21 2HG2 VAL 21 -6.283 0.943 -1.231 171 H TYR 22 H TYR 22 -9.351 -2.779 -0.338 172 HA TYR 22 HA TYR 22 -8.195 -5.433 -0.295 173 HB2 TYR 22 2HB TYR 22 -8.383 -5.794 2.076 174 HB3 TYR 22 1HB TYR 22 -7.384 -4.367 1.824 175 HD1 TYR 22 HD1 TYR 22 -8.563 -2.071 2.030 176 HD2 TYR 22 HD2 TYR 22 -10.232 -5.699 3.482 177 HE1 TYR 22 HE1 TYR 22 -10.021 -0.788 3.540 178 HE2 TYR 22 HE2 TYR 22 -11.693 -4.431 4.992 179 HH TYR 22 HH TYR 22 -12.026 -0.999 4.783 180 H ARG 23 H ARG 23 -9.730 -7.048 -0.167 181 HA ARG 23 HA ARG 23 -12.531 -6.145 -0.126 182 HB2 ARG 23 2HB ARG 23 -11.249 -8.477 -1.549 183 HB3 ARG 23 1HB ARG 23 -12.987 -8.297 -1.378 184 HG2 ARG 23 2HG ARG 23 -12.896 -6.194 -2.604 185 HG3 ARG 23 1HG ARG 23 -11.147 -6.367 -2.770 186 HD2 ARG 23 2HD ARG 23 -11.428 -8.384 -4.058 187 HD3 ARG 23 1HD ARG 23 -13.170 -8.347 -3.799 188 HE ARG 23 HE ARG 23 -12.737 -5.996 -5.014 189 HH11 ARG 23 1HH1 ARG 23 -11.641 -9.220 -5.760 190 HH12 ARG 23 2HH1 ARG 23 -11.723 -9.002 -7.477 191 HH21 ARG 23 1HH2 ARG 23 -12.832 -5.671 -7.292 192 HH22 ARG 23 2HH2 ARG 23 -12.384 -6.976 -8.352 193 H GLN 24 H GLN 24 -12.779 -6.307 2.097 194 HA GLN 24 HA GLN 24 -12.268 -8.877 3.367 195 HB2 GLN 24 2HB GLN 24 -11.702 -6.684 4.468 196 HB3 GLN 24 1HB GLN 24 -13.426 -6.370 4.588 197 HG2 GLN 24 2HG GLN 24 -13.713 -8.283 6.031 198 HG3 GLN 24 1HG GLN 24 -12.012 -8.716 5.841 199 HE21 GLN 24 1HE2 GLN 24 -13.450 -8.123 8.285 200 HE22 GLN 24 2HE2 GLN 24 -12.644 -6.773 9.006 201 H VAL 25 H VAL 25 -14.994 -6.671 3.829 202 HA VAL 25 HA VAL 25 -17.245 -6.919 3.735 203 HB VAL 25 HB VAL 25 -16.697 -9.403 2.102 204 HG11 VAL 25 1HG1 VAL 25 -19.018 -9.187 1.356 205 HG12 VAL 25 2HG1 VAL 25 -19.248 -7.828 2.456 206 HG13 VAL 25 3HG1 VAL 25 -18.928 -9.440 3.099 207 HG21 VAL 25 3HG2 VAL 25 -17.394 -6.598 1.235 208 HG22 VAL 25 1HG2 VAL 25 -17.200 -7.992 0.173 209 HG23 VAL 25 2HG2 VAL 25 -15.815 -7.368 1.070 210 H LEU 26 H LEU 26 -15.832 -10.177 4.117 211 HA LEU 26 HA LEU 26 -17.771 -11.174 5.870 212 HB2 LEU 26 2HB LEU 26 -16.074 -12.552 4.708 213 HB3 LEU 26 1HB LEU 26 -14.835 -11.883 5.750 214 HG LEU 26 HG LEU 26 -15.964 -12.898 7.707 215 HD11 LEU 26 1HD1 LEU 26 -18.235 -12.960 6.812 216 HD12 LEU 26 2HD1 LEU 26 -17.717 -14.558 7.354 217 HD13 LEU 26 3HD1 LEU 26 -17.742 -14.174 5.632 218 HD21 LEU 26 3HD2 LEU 26 -15.355 -15.223 7.188 219 HD22 LEU 26 1HD2 LEU 26 -14.135 -14.075 6.633 220 HD23 LEU 26 2HD2 LEU 26 -15.252 -14.803 5.479 221 H GLY 27 H GLY 27 -18.307 -10.496 7.796 222 HA2 GLY 27 2HA GLY 27 -17.057 -10.105 10.083 223 HA3 GLY 27 1HA GLY 27 -16.553 -8.653 9.218 224 H ASN 28 H ASN 28 -18.986 -8.437 7.713 225 HA ASN 28 HA ASN 28 -21.131 -7.704 7.755 226 HB2 ASN 28 2HB ASN 28 -21.216 -9.014 10.481 227 HB3 ASN 28 1HB ASN 28 -22.620 -8.418 9.602 228 HD21 ASN 28 1HD2 ASN 28 -23.380 -9.561 7.831 229 HD22 ASN 28 2HD2 ASN 28 -22.861 -11.169 7.479 230 H ASP 29 H ASP 29 -22.747 -6.447 9.406 231 HA ASP 29 HA ASP 29 -21.097 -4.269 10.514 232 HB2 ASP 29 2HB ASP 29 -22.624 -3.662 8.648 233 HB3 ASP 29 1HB ASP 29 -23.991 -4.179 9.629 234 H TYR 30 H TYR 30 -23.696 -6.508 11.179 235 HA TYR 30 HA TYR 30 -24.271 -5.342 13.763 236 HB2 TYR 30 2HB TYR 30 -26.021 -6.372 12.266 237 HB3 TYR 30 1HB TYR 30 -25.308 -7.941 12.618 238 HD1 TYR 30 HD2 TYR 30 -27.083 -5.064 14.093 239 HD2 TYR 30 HD1 TYR 30 -25.796 -9.077 14.660 240 HE1 TYR 30 HE2 TYR 30 -28.500 -5.228 16.091 241 HE2 TYR 30 HE1 TYR 30 -27.211 -9.254 16.666 242 HH TYR 30 HH TYR 30 -28.226 -7.721 18.352 243 H VAL 31 H VAL 31 -24.055 -8.801 13.295 244 HA VAL 31 HA VAL 31 -23.354 -10.367 14.812 245 HB VAL 31 HB VAL 31 -20.813 -10.608 14.713 246 HG11 VAL 31 1HG1 VAL 31 -22.362 -11.810 13.269 247 HG12 VAL 31 2HG1 VAL 31 -20.899 -11.362 12.394 248 HG13 VAL 31 3HG1 VAL 31 -22.388 -10.449 12.146 249 HG21 VAL 31 3HG2 VAL 31 -21.133 -8.293 12.796 250 HG22 VAL 31 1HG2 VAL 31 -19.703 -9.319 12.918 251 HG23 VAL 31 2HG2 VAL 31 -20.181 -8.309 14.280 252 H MET 32 H MET 32 -20.453 -8.730 15.644 253 HA MET 32 HA MET 32 -21.524 -7.906 18.248 254 HB2 MET 32 2HB MET 32 -20.427 -10.121 18.507 255 HB3 MET 32 1HB MET 32 -18.950 -9.449 17.839 256 HG2 MET 32 2HG MET 32 -18.582 -9.456 20.127 257 HG3 MET 32 1HG MET 32 -19.036 -7.791 19.779 258 HE1 MET 32 3HE MET 32 -21.103 -6.588 20.741 259 HE2 MET 32 1HE MET 32 -22.536 -7.418 21.347 260 HE3 MET 32 2HE MET 32 -22.083 -7.566 19.648 261 H ALA 33 H ALA 33 -18.776 -7.911 16.039 262 HA ALA 33 HA ALA 33 -18.696 -5.019 16.094 263 HB1 ALA 33 3HB ALA 33 -16.273 -4.938 16.484 264 HB2 ALA 33 1HB ALA 33 -16.259 -6.679 16.766 265 HB3 ALA 33 2HB ALA 33 -17.122 -5.613 17.875 266 H SER 34 H SER 34 -18.072 -4.217 14.116 267 HA SER 34 HA SER 34 -18.078 -6.037 11.931 268 HB2 SER 34 2HB SER 34 -17.284 -3.118 11.933 269 HB3 SER 34 1HB SER 34 -17.790 -4.070 10.537 270 HG SER 34 HG SER 34 -19.773 -4.414 11.970 271 H GLU 35 H GLU 35 -15.563 -4.100 13.500 272 HA GLU 35 HA GLU 35 -13.295 -4.185 13.478 273 HB2 GLU 35 2HB GLU 35 -13.849 -7.068 12.756 274 HB3 GLU 35 1HB GLU 35 -12.273 -6.447 13.232 275 HG2 GLU 35 2HG GLU 35 -13.190 -5.795 15.403 276 HG3 GLU 35 1HG GLU 35 -14.761 -6.439 14.927 277 H ARG 36 H ARG 36 -14.685 -3.405 11.079 278 HA ARG 36 HA ARG 36 -13.127 -4.503 8.877 279 HB2 ARG 36 2HB ARG 36 -14.650 -3.225 7.443 280 HB3 ARG 36 1HB ARG 36 -15.540 -4.234 8.573 281 HG2 ARG 36 2HG ARG 36 -15.885 -2.239 10.007 282 HG3 ARG 36 1HG ARG 36 -15.102 -1.260 8.762 283 HD2 ARG 36 2HD ARG 36 -16.818 -2.103 7.151 284 HD3 ARG 36 1HD ARG 36 -17.645 -2.854 8.516 285 HE ARG 36 HE ARG 36 -17.180 0.060 8.355 286 HH11 ARG 36 1HH1 ARG 36 -19.244 -2.675 9.064 287 HH12 ARG 36 2HH1 ARG 36 -20.639 -1.701 9.430 288 HH21 ARG 36 1HH2 ARG 36 -19.018 1.350 8.770 289 HH22 ARG 36 2HH2 ARG 36 -20.516 0.590 9.241 290 H LEU 37 H LEU 37 -11.584 -3.127 10.684 291 HA LEU 37 HA LEU 37 -10.050 -1.478 10.929 292 HB2 LEU 37 2HB LEU 37 -10.539 -1.075 7.975 293 HB3 LEU 37 1HB LEU 37 -9.190 -0.411 8.876 294 HG LEU 37 HG LEU 37 -9.714 -3.356 8.442 295 HD11 LEU 37 1HD1 LEU 37 -7.725 -3.259 7.009 296 HD12 LEU 37 2HD1 LEU 37 -7.667 -1.510 7.222 297 HD13 LEU 37 3HD1 LEU 37 -9.034 -2.250 6.390 298 HD21 LEU 37 3HD2 LEU 37 -7.470 -3.647 9.407 299 HD22 LEU 37 1HD2 LEU 37 -8.604 -2.943 10.561 300 HD23 LEU 37 2HD2 LEU 37 -7.413 -1.920 9.760 301 H VAL 38 H VAL 38 -12.170 -0.679 12.032 302 HA VAL 38 HA VAL 38 -13.739 1.329 10.904 303 HB VAL 38 HB VAL 38 -14.445 0.116 12.884 304 HG11 VAL 38 1HG1 VAL 38 -13.513 0.574 15.092 305 HG12 VAL 38 2HG1 VAL 38 -12.285 1.609 14.363 306 HG13 VAL 38 3HG1 VAL 38 -12.304 -0.120 14.011 307 HG21 VAL 38 3HG2 VAL 38 -14.187 3.070 13.429 308 HG22 VAL 38 1HG2 VAL 38 -15.338 1.970 14.188 309 HG23 VAL 38 2HG2 VAL 38 -15.441 2.298 12.457 310 H SER 39 H SER 39 -10.733 1.576 12.764 311 HA SER 39 HA SER 39 -10.795 4.383 13.054 312 HB2 SER 39 2HB SER 39 -8.375 2.566 12.999 313 HB3 SER 39 1HB SER 39 -8.455 4.183 13.699 314 HG SER 39 HG SER 39 -9.681 3.447 15.334 315 H ALA 40 H ALA 40 -9.135 2.266 10.725 316 HA ALA 40 HA ALA 40 -7.900 4.309 9.247 317 HB1 ALA 40 3HB ALA 40 -8.751 1.571 8.317 318 HB2 ALA 40 1HB ALA 40 -7.216 1.972 9.088 319 HB3 ALA 40 2HB ALA 40 -7.602 2.629 7.496 320 H GLU 41 H GLU 41 -10.985 2.638 8.799 321 HA GLU 41 HA GLU 41 -11.751 3.887 6.407 322 HB2 GLU 41 2HB GLU 41 -12.762 1.832 7.409 323 HB3 GLU 41 1HB GLU 41 -13.533 2.843 8.619 324 HG2 GLU 41 2HG GLU 41 -14.025 3.440 5.751 325 HG3 GLU 41 1HG GLU 41 -14.804 2.034 6.469 326 H SER 42 H SER 42 -12.494 4.700 9.789 327 HA SER 42 HA SER 42 -14.123 6.920 9.236 328 HB2 SER 42 2HB SER 42 -14.056 5.763 11.421 329 HB3 SER 42 1HB SER 42 -12.437 6.400 11.697 330 HG SER 42 HG SER 42 -13.446 8.020 12.560 331 H LEU 43 H LEU 43 -10.623 6.660 9.751 332 HA LEU 43 HA LEU 43 -10.089 9.420 9.886 333 HB2 LEU 43 2HB LEU 43 -8.369 7.094 9.053 334 HB3 LEU 43 1HB LEU 43 -7.759 8.733 9.167 335 HG LEU 43 HG LEU 43 -8.927 7.149 11.459 336 HD11 LEU 43 1HD1 LEU 43 -6.634 7.079 12.293 337 HD12 LEU 43 2HD1 LEU 43 -6.072 7.881 10.827 338 HD13 LEU 43 3HD1 LEU 43 -6.776 6.267 10.735 339 HD21 LEU 43 3HD2 LEU 43 -9.309 9.529 11.722 340 HD22 LEU 43 1HD2 LEU 43 -7.611 9.861 11.380 341 HD23 LEU 43 2HD2 LEU 43 -8.061 8.986 12.843 342 H LEU 44 H LEU 44 -10.150 7.197 7.124 343 HA LEU 44 HA LEU 44 -9.385 9.208 5.235 344 HB2 LEU 44 2HB LEU 44 -9.046 6.757 4.904 345 HB3 LEU 44 1HB LEU 44 -10.783 6.581 4.726 346 HG LEU 44 HG LEU 44 -10.703 8.068 2.742 347 HD11 LEU 44 1HD1 LEU 44 -8.543 8.577 1.720 348 HD12 LEU 44 2HD1 LEU 44 -7.716 7.873 3.111 349 HD13 LEU 44 3HD1 LEU 44 -8.695 9.327 3.309 350 HD21 LEU 44 3HD2 LEU 44 -8.906 5.649 2.628 351 HD22 LEU 44 1HD2 LEU 44 -9.661 6.436 1.241 352 HD23 LEU 44 2HD2 LEU 44 -10.661 5.654 2.465 353 H ARG 45 H ARG 45 -12.413 7.848 6.380 354 HA ARG 45 HA ARG 45 -14.161 9.076 4.547 355 HB2 ARG 45 2HB ARG 45 -14.587 7.225 6.296 356 HB3 ARG 45 1HB ARG 45 -14.833 8.542 7.431 357 HG2 ARG 45 2HG ARG 45 -16.642 9.401 5.981 358 HG3 ARG 45 1HG ARG 45 -16.427 7.990 4.936 359 HD2 ARG 45 2HD ARG 45 -16.739 6.619 7.084 360 HD3 ARG 45 1HD ARG 45 -17.382 8.105 7.777 361 HE ARG 45 HE ARG 45 -18.775 7.743 5.437 362 HH11 ARG 45 1HH1 ARG 45 -18.212 5.887 8.338 363 HH12 ARG 45 2HH1 ARG 45 -19.734 5.057 8.278 364 HH21 ARG 45 1HH2 ARG 45 -20.769 6.630 5.298 365 HH22 ARG 45 2HH2 ARG 45 -21.186 5.473 6.535 366 H ASN 46 H ASN 46 -12.739 10.152 7.565 367 HA ASN 46 HA ASN 46 -14.219 12.625 7.660 368 HB2 ASN 46 2HB ASN 46 -13.467 11.450 9.702 369 HB3 ASN 46 1HB ASN 46 -11.795 11.710 9.230 370 HD21 ASN 46 1HD2 ASN 46 -11.381 12.804 11.136 371 HD22 ASN 46 2HD2 ASN 46 -11.926 14.422 11.412 372 H GLY 47 H GLY 47 -11.524 11.515 5.975 373 HA2 GLY 47 2HA GLY 47 -10.152 12.602 4.476 374 HA3 GLY 47 1HA GLY 47 -10.978 14.103 4.873 375 H LYS 48 H LYS 48 -9.627 12.216 7.433 376 HA LYS 48 HA LYS 48 -7.880 14.415 8.109 377 HB2 LYS 48 2HB LYS 48 -9.107 13.326 9.899 378 HB3 LYS 48 1HB LYS 48 -8.395 11.771 9.488 379 HG2 LYS 48 2HG LYS 48 -6.238 12.482 10.208 380 HG3 LYS 48 1HG LYS 48 -6.791 14.144 10.403 381 HD2 LYS 48 2HD LYS 48 -7.885 11.817 11.974 382 HD3 LYS 48 1HD LYS 48 -6.564 12.844 12.534 383 HE2 LYS 48 2HE LYS 48 -8.073 14.804 12.323 384 HE3 LYS 48 1HE LYS 48 -9.384 13.705 11.901 385 HZ1 LYS 48 3HZ LYS 48 -9.398 14.326 14.259 386 HZ2 LYS 48 1HZ LYS 48 -7.861 13.635 14.454 387 HZ3 LYS 48 2HZ LYS 48 -9.189 12.658 14.046 388 H ILE 49 H ILE 49 -7.602 11.223 6.741 389 HA ILE 49 HA ILE 49 -4.689 11.619 6.552 390 HB ILE 49 HB ILE 49 -4.415 9.197 6.411 391 HG12 ILE 49 2HG1 ILE 49 -7.369 9.004 7.033 392 HG13 ILE 49 1HG1 ILE 49 -6.666 8.715 5.446 393 HG21 ILE 49 1HG2 ILE 49 -5.969 10.058 8.843 394 HG22 ILE 49 2HG2 ILE 49 -4.235 10.248 8.587 395 HG23 ILE 49 3HG2 ILE 49 -4.932 8.635 8.738 396 HD11 ILE 49 3HD1 ILE 49 -5.386 6.845 6.352 397 HD12 ILE 49 1HD1 ILE 49 -7.116 6.630 6.604 398 HD13 ILE 49 2HD1 ILE 49 -6.087 7.137 7.944 399 H THR 50 H THR 50 -3.721 10.508 4.631 400 HA THR 50 HA THR 50 -5.342 11.010 2.261 401 HB THR 50 HB THR 50 -3.167 10.616 1.057 402 HG1 THR 50 HG1 THR 50 -1.412 10.902 2.945 403 HG21 THR 50 3HG2 THR 50 -3.853 12.885 1.663 404 HG22 THR 50 1HG2 THR 50 -2.103 12.705 1.787 405 HG23 THR 50 2HG2 THR 50 -3.096 12.698 3.245 406 H VAL 51 H VAL 51 -4.759 9.331 0.399 407 HA VAL 51 HA VAL 51 -5.707 6.778 1.215 408 HB VAL 51 HB VAL 51 -4.383 7.565 -1.396 409 HG11 VAL 51 1HG1 VAL 51 -5.489 5.582 -2.327 410 HG12 VAL 51 2HG1 VAL 51 -6.066 5.149 -0.717 411 HG13 VAL 51 3HG1 VAL 51 -4.336 5.146 -1.065 412 HG21 VAL 51 3HG2 VAL 51 -7.293 7.390 -0.629 413 HG22 VAL 51 1HG2 VAL 51 -6.678 7.722 -2.248 414 HG23 VAL 51 2HG2 VAL 51 -6.384 8.869 -0.940 415 H ARG 52 H ARG 52 -2.554 8.187 0.688 416 HA ARG 52 HA ARG 52 -0.916 5.943 0.783 417 HB2 ARG 52 2HB ARG 52 -0.190 8.333 0.435 418 HB3 ARG 52 1HB ARG 52 -0.371 8.579 2.166 419 HG2 ARG 52 2HG ARG 52 1.274 6.675 2.460 420 HG3 ARG 52 1HG ARG 52 1.598 6.827 0.733 421 HD2 ARG 52 2HD ARG 52 3.235 8.181 1.641 422 HD3 ARG 52 1HD ARG 52 1.954 9.347 1.304 423 HE ARG 52 HE ARG 52 1.572 8.394 3.906 424 HH11 ARG 52 1HH1 ARG 52 3.869 10.364 2.124 425 HH12 ARG 52 2HH1 ARG 52 4.448 11.188 3.543 426 HH21 ARG 52 1HH2 ARG 52 2.322 9.458 5.747 427 HH22 ARG 52 2HH2 ARG 52 3.560 10.677 5.617 428 H GLU 53 H GLU 53 -2.237 7.893 3.439 429 HA GLU 53 HA GLU 53 -1.106 6.277 5.495 430 HB2 GLU 53 2HB GLU 53 -3.384 8.259 5.657 431 HB3 GLU 53 1HB GLU 53 -2.487 7.602 7.021 432 HG2 GLU 53 2HG GLU 53 -1.429 9.396 4.851 433 HG3 GLU 53 1HG GLU 53 -1.702 9.816 6.541 434 H PHE 54 H PHE 54 -4.083 6.190 3.690 435 HA PHE 54 HA PHE 54 -5.491 4.429 5.407 436 HB2 PHE 54 2HB PHE 54 -6.561 5.727 3.570 437 HB3 PHE 54 1HB PHE 54 -5.741 4.698 2.399 438 HD1 PHE 54 HD2 PHE 54 -8.037 4.491 5.324 439 HD2 PHE 54 HD1 PHE 54 -6.827 2.822 1.600 440 HE1 PHE 54 HE2 PHE 54 -9.907 2.893 5.434 441 HE2 PHE 54 HE1 PHE 54 -8.691 1.226 1.704 442 HZ PHE 54 HZ PHE 54 -10.233 1.260 3.624 443 H VAL 55 H VAL 55 -3.612 3.836 2.432 444 HA VAL 55 HA VAL 55 -3.553 1.042 2.568 445 HB VAL 55 HB VAL 55 -1.433 2.914 1.486 446 HG11 VAL 55 1HG1 VAL 55 -0.683 1.007 0.144 447 HG12 VAL 55 2HG1 VAL 55 -1.857 -0.028 0.959 448 HG13 VAL 55 3HG1 VAL 55 -0.523 0.685 1.869 449 HG21 VAL 55 3HG2 VAL 55 -2.466 2.476 -0.694 450 HG22 VAL 55 1HG2 VAL 55 -3.599 3.237 0.421 451 HG23 VAL 55 2HG2 VAL 55 -3.711 1.507 0.096 452 H ARG 56 H ARG 56 -1.448 3.480 3.988 453 HA ARG 56 HA ARG 56 0.506 2.021 5.221 454 HB2 ARG 56 2HB ARG 56 0.517 4.393 5.374 455 HB3 ARG 56 1HB ARG 56 -1.054 4.424 6.157 456 HG2 ARG 56 2HG ARG 56 0.094 3.172 8.076 457 HG3 ARG 56 1HG ARG 56 1.603 3.678 7.307 458 HD2 ARG 56 2HD ARG 56 0.901 6.011 7.442 459 HD3 ARG 56 1HD ARG 56 -0.624 5.518 8.182 460 HE ARG 56 HE ARG 56 1.969 4.954 9.467 461 HH11 ARG 56 1HH1 ARG 56 -1.265 6.325 9.571 462 HH12 ARG 56 2HH1 ARG 56 -1.176 6.709 11.268 463 HH21 ARG 56 1HH2 ARG 56 2.068 5.441 11.683 464 HH22 ARG 56 2HH2 ARG 56 0.716 6.195 12.466 465 H ALA 57 H ALA 57 -2.712 2.736 6.589 466 HA ALA 57 HA ALA 57 -2.223 1.235 8.962 467 HB1 ALA 57 3HB ALA 57 -4.843 2.223 7.840 468 HB2 ALA 57 1HB ALA 57 -3.765 3.142 8.893 469 HB3 ALA 57 2HB ALA 57 -4.553 1.683 9.494 470 H VAL 58 H VAL 58 -3.951 0.573 5.947 471 HA VAL 58 HA VAL 58 -5.136 -1.855 6.793 472 HB VAL 58 HB VAL 58 -4.475 -0.935 3.987 473 HG11 VAL 58 1HG1 VAL 58 -4.809 -3.351 4.070 474 HG12 VAL 58 2HG1 VAL 58 -6.159 -2.559 3.257 475 HG13 VAL 58 3HG1 VAL 58 -6.337 -3.119 4.920 476 HG21 VAL 58 3HG2 VAL 58 -5.978 0.579 5.198 477 HG22 VAL 58 1HG2 VAL 58 -7.052 -0.776 5.546 478 HG23 VAL 58 2HG2 VAL 58 -6.809 -0.249 3.879 479 H ALA 59 H ALA 59 -2.111 -1.143 5.078 480 HA ALA 59 HA ALA 59 -1.486 -3.916 4.706 481 HB1 ALA 59 3HB ALA 59 0.585 -3.138 3.744 482 HB2 ALA 59 1HB ALA 59 0.309 -1.518 4.386 483 HB3 ALA 59 2HB ALA 59 -0.755 -2.165 3.137 484 H LYS 60 H LYS 60 -0.465 -1.391 6.972 485 HA LYS 60 HA LYS 60 1.458 -3.147 8.228 486 HB2 LYS 60 2HB LYS 60 0.552 -0.342 8.839 487 HB3 LYS 60 1HB LYS 60 1.660 -1.221 9.883 488 HG2 LYS 60 2HG LYS 60 3.109 -1.522 7.811 489 HG3 LYS 60 1HG LYS 60 2.090 -0.283 7.069 490 HD2 LYS 60 2HD LYS 60 2.676 1.301 8.775 491 HD3 LYS 60 1HD LYS 60 3.540 0.063 9.689 492 HE2 LYS 60 2HE LYS 60 4.885 -0.155 7.421 493 HE3 LYS 60 1HE LYS 60 4.338 1.506 7.214 494 HZ1 LYS 60 3HZ LYS 60 6.431 1.601 8.285 495 HZ2 LYS 60 1HZ LYS 60 5.994 0.412 9.420 496 HZ3 LYS 60 2HZ LYS 60 5.278 1.947 9.481 497 H SER 61 H SER 61 -1.593 -3.569 8.256 498 HA SER 61 HA SER 61 -2.280 -3.520 11.035 499 HB2 SER 61 2HB SER 61 -4.272 -4.780 10.337 500 HB3 SER 61 1HB SER 61 -4.002 -3.405 9.267 501 HG SER 61 HG SER 61 -3.542 -4.719 7.655 502 H GLU 62 H GLU 62 -3.350 -5.997 11.532 503 HA GLU 62 HA GLU 62 -0.974 -7.581 11.986 504 HB2 GLU 62 2HB GLU 62 -3.850 -8.103 12.749 505 HB3 GLU 62 1HB GLU 62 -2.456 -9.010 13.318 506 HG2 GLU 62 2HG GLU 62 -1.603 -7.063 14.456 507 HG3 GLU 62 1HG GLU 62 -2.913 -6.079 13.808 508 H LEU 63 H LEU 63 -3.164 -7.256 9.546 509 HA LEU 63 HA LEU 63 -3.695 -8.407 7.681 510 HB2 LEU 63 2HB LEU 63 -1.456 -10.241 8.538 511 HB3 LEU 63 1HB LEU 63 -2.233 -10.262 6.966 512 HG LEU 63 HG LEU 63 -0.636 -7.957 8.092 513 HD11 LEU 63 1HD1 LEU 63 0.047 -9.966 5.948 514 HD12 LEU 63 2HD1 LEU 63 0.771 -9.868 7.553 515 HD13 LEU 63 3HD1 LEU 63 1.018 -8.562 6.394 516 HD21 LEU 63 3HD2 LEU 63 -1.883 -8.365 5.375 517 HD22 LEU 63 1HD2 LEU 63 -0.824 -7.031 5.829 518 HD23 LEU 63 2HD2 LEU 63 -2.402 -7.205 6.597 519 H TYR 64 H TYR 64 -4.486 -10.570 6.862 520 HA TYR 64 HA TYR 64 -6.263 -11.686 8.836 521 HB2 TYR 64 2HB TYR 64 -5.864 -12.452 5.933 522 HB3 TYR 64 1HB TYR 64 -7.198 -12.962 6.963 523 HD1 TYR 64 HD2 TYR 64 -8.882 -11.288 7.719 524 HD2 TYR 64 HD1 TYR 64 -5.874 -10.315 4.871 525 HE1 TYR 64 HE2 TYR 64 -10.168 -9.304 7.047 526 HE2 TYR 64 HE1 TYR 64 -7.152 -8.327 4.193 527 HH TYR 64 HH TYR 64 -9.761 -7.117 5.991 528 H LYS 65 H LYS 65 -3.435 -12.651 7.041 529 HA LYS 65 HA LYS 65 -1.822 -14.177 7.408 530 HB2 LYS 65 2HB LYS 65 -2.014 -13.581 9.783 531 HB3 LYS 65 1HB LYS 65 -3.262 -14.805 9.986 532 HG2 LYS 65 2HG LYS 65 -1.686 -16.558 9.463 533 HG3 LYS 65 1HG LYS 65 -0.436 -15.365 9.109 534 HD2 LYS 65 2HD LYS 65 -0.497 -14.620 11.445 535 HD3 LYS 65 1HD LYS 65 -1.735 -15.833 11.795 536 HE2 LYS 65 2HE LYS 65 -0.175 -17.606 11.146 537 HE3 LYS 65 1HE LYS 65 1.056 -16.398 10.789 538 HZ1 LYS 65 3HZ LYS 65 1.141 -15.784 13.088 539 HZ2 LYS 65 1HZ LYS 65 1.316 -17.465 12.975 540 HZ3 LYS 65 2HZ LYS 65 -0.163 -16.802 13.466 541 H GLU 66 H GLU 66 -5.053 -15.395 8.130 542 HA GLU 66 HA GLU 66 -4.879 -18.058 8.113 543 HB2 GLU 66 2HB GLU 66 -6.981 -16.822 8.261 544 HB3 GLU 66 1HB GLU 66 -6.907 -16.459 6.545 545 HG2 GLU 66 2HG GLU 66 -8.471 -18.221 6.872 546 HG3 GLU 66 1HG GLU 66 -7.049 -18.893 6.076 547 H LYS 67 H LYS 67 -5.442 -16.388 4.989 548 HA LYS 67 HA LYS 67 -4.223 -18.744 3.695 549 HB2 LYS 67 2HB LYS 67 -6.686 -18.119 3.275 550 HB3 LYS 67 1HB LYS 67 -6.059 -16.758 2.356 551 HG2 LYS 67 2HG LYS 67 -6.594 -18.542 0.850 552 HG3 LYS 67 1HG LYS 67 -4.840 -18.352 0.907 553 HD2 LYS 67 2HD LYS 67 -4.732 -20.214 2.531 554 HD3 LYS 67 1HD LYS 67 -6.473 -20.435 2.350 555 HE2 LYS 67 2HE LYS 67 -4.392 -20.717 0.187 556 HE3 LYS 67 1HE LYS 67 -5.265 -22.029 0.974 557 HZ1 LYS 67 3HZ LYS 67 -7.346 -20.971 0.091 558 HZ2 LYS 67 1HZ LYS 67 -6.314 -21.641 -1.078 559 HZ3 LYS 67 2HZ LYS 67 -6.355 -19.964 -0.850 560 H PHE 68 H PHE 68 -2.853 -16.307 4.759 561 HA PHE 68 HA PHE 68 -1.655 -15.409 2.220 562 HB2 PHE 68 2HB PHE 68 -2.259 -13.714 4.645 563 HB3 PHE 68 1HB PHE 68 -1.249 -13.188 3.305 564 HD1 PHE 68 HD2 PHE 68 -2.491 -13.696 0.915 565 HD2 PHE 68 HD1 PHE 68 -4.372 -12.876 4.642 566 HE1 PHE 68 HE2 PHE 68 -4.492 -12.902 -0.276 567 HE2 PHE 68 HE1 PHE 68 -6.382 -12.087 3.460 568 HZ PHE 68 HZ PHE 68 -6.440 -12.098 0.996 569 H LEU 69 H LEU 69 -1.038 -15.447 5.747 570 HA LEU 69 HA LEU 69 1.800 -15.160 5.176 571 HB2 LEU 69 2HB LEU 69 0.646 -13.775 6.897 572 HB3 LEU 69 1HB LEU 69 0.391 -15.229 7.840 573 HG LEU 69 HG LEU 69 2.845 -15.508 8.035 574 HD11 LEU 69 1HD1 LEU 69 3.490 -14.340 5.985 575 HD12 LEU 69 2HD1 LEU 69 4.322 -13.684 7.395 576 HD13 LEU 69 3HD1 LEU 69 2.962 -12.812 6.689 577 HD21 LEU 69 3HD2 LEU 69 3.196 -13.641 9.593 578 HD22 LEU 69 1HD2 LEU 69 1.611 -14.386 9.798 579 HD23 LEU 69 2HD2 LEU 69 1.758 -12.848 8.950 580 H TYR 70 H TYR 70 -0.335 -17.686 5.650 581 HA TYR 70 HA TYR 70 1.882 -19.518 6.059 582 HB2 TYR 70 2HB TYR 70 0.782 -18.914 8.324 583 HB3 TYR 70 1HB TYR 70 -0.588 -19.859 7.750 584 HD1 TYR 70 HD1 TYR 70 -0.398 -22.288 7.480 585 HD2 TYR 70 HD2 TYR 70 2.857 -19.976 8.950 586 HE1 TYR 70 HE1 TYR 70 0.698 -24.342 8.270 587 HE2 TYR 70 HE2 TYR 70 3.962 -22.025 9.745 588 HH TYR 70 HH TYR 70 3.093 -25.084 8.768 589 H GLY 71 H GLY 71 1.501 -21.570 5.188 590 HA2 GLY 71 2HA GLY 71 0.104 -23.254 4.247 591 HA3 GLY 71 1HA GLY 71 -1.135 -22.036 3.974 592 H ASN 72 H ASN 72 1.820 -20.799 3.150 593 HA ASN 72 HA ASN 72 2.063 -21.925 0.520 594 HB2 ASN 72 2HB ASN 72 1.613 -19.889 -0.731 595 HB3 ASN 72 1HB ASN 72 0.189 -20.309 0.211 596 HD21 ASN 72 1HD2 ASN 72 -0.351 -19.035 2.011 597 HD22 ASN 72 2HD2 ASN 72 0.274 -17.434 2.203 598 H PHE 73 H PHE 73 3.726 -20.376 -0.724 599 HA PHE 73 HA PHE 73 6.116 -20.501 0.757 600 HB2 PHE 73 2HB PHE 73 5.571 -18.948 -1.784 601 HB3 PHE 73 1HB PHE 73 7.155 -19.406 -1.170 602 HD1 PHE 73 HD2 PHE 73 7.614 -21.919 -0.905 603 HD2 PHE 73 HD1 PHE 73 4.447 -20.326 -3.254 604 HE1 PHE 73 HE2 PHE 73 7.487 -24.032 -2.156 605 HE2 PHE 73 HE1 PHE 73 4.314 -22.437 -4.513 606 HZ PHE 73 HZ PHE 73 5.834 -24.291 -3.965 607 H GLN 74 H GLN 74 7.079 -19.068 2.075 608 HA GLN 74 HA GLN 74 5.740 -16.760 2.961 609 HB2 GLN 74 2HB GLN 74 8.684 -17.375 3.261 610 HB3 GLN 74 1HB GLN 74 7.741 -16.269 4.248 611 HG2 GLN 74 2HG GLN 74 7.221 -19.226 4.079 612 HG3 GLN 74 1HG GLN 74 8.244 -18.476 5.298 613 HE21 GLN 74 1HE2 GLN 74 5.253 -17.034 4.105 614 HE22 GLN 74 2HE2 GLN 74 4.367 -17.224 5.576 615 H THR 75 H THR 75 8.006 -17.303 0.402 616 HA THR 75 HA THR 75 8.786 -14.630 -0.084 617 HB THR 75 HB THR 75 9.174 -15.576 -2.462 618 HG1 THR 75 HG1 THR 75 8.303 -17.486 -2.753 619 HG21 THR 75 3HG2 THR 75 10.518 -16.847 -0.077 620 HG22 THR 75 1HG2 THR 75 10.965 -15.314 -0.823 621 HG23 THR 75 2HG2 THR 75 11.161 -16.821 -1.720 622 H ARG 76 H ARG 76 5.900 -16.422 -0.753 623 HA ARG 76 HA ARG 76 4.973 -14.801 -2.919 624 HB2 ARG 76 2HB ARG 76 4.264 -17.234 -2.139 625 HB3 ARG 76 1HB ARG 76 3.083 -16.341 -1.189 626 HG2 ARG 76 2HG ARG 76 2.018 -16.929 -3.211 627 HG3 ARG 76 1HG ARG 76 2.392 -15.206 -3.330 628 HD2 ARG 76 2HD ARG 76 4.447 -15.793 -4.588 629 HD3 ARG 76 1HD ARG 76 3.948 -17.482 -4.557 630 HE ARG 76 HE ARG 76 2.518 -15.306 -5.958 631 HH11 ARG 76 1HH1 ARG 76 3.394 -18.681 -5.617 632 HH12 ARG 76 2HH1 ARG 76 2.559 -19.180 -7.053 633 HH21 ARG 76 1HH2 ARG 76 1.432 -15.945 -7.835 634 HH22 ARG 76 2HH2 ARG 76 1.427 -17.616 -8.319 635 H VAL 77 H VAL 77 4.793 -14.680 0.549 636 HA VAL 77 HA VAL 77 2.733 -12.790 0.853 637 HB VAL 77 HB VAL 77 5.206 -13.083 2.573 638 HG11 VAL 77 1HG1 VAL 77 3.954 -11.040 3.019 639 HG12 VAL 77 2HG1 VAL 77 3.802 -12.178 4.359 640 HG13 VAL 77 3HG1 VAL 77 2.475 -11.980 3.215 641 HG21 VAL 77 3HG2 VAL 77 3.878 -14.612 3.946 642 HG22 VAL 77 1HG2 VAL 77 4.082 -15.233 2.308 643 HG23 VAL 77 2HG2 VAL 77 2.552 -14.499 2.791 644 H ILE 78 H ILE 78 6.185 -12.484 0.245 645 HA ILE 78 HA ILE 78 6.332 -9.666 0.279 646 HB ILE 78 HB ILE 78 8.009 -11.668 -1.243 647 HG12 ILE 78 2HG1 ILE 78 8.531 -10.256 1.381 648 HG13 ILE 78 1HG1 ILE 78 8.003 -11.928 1.225 649 HG21 ILE 78 1HG2 ILE 78 9.691 -9.881 -1.383 650 HG22 ILE 78 2HG2 ILE 78 8.544 -8.756 -0.658 651 HG23 ILE 78 3HG2 ILE 78 8.209 -9.458 -2.241 652 HD11 ILE 78 3HD1 ILE 78 10.583 -10.810 0.160 653 HD12 ILE 78 1HD1 ILE 78 10.058 -12.492 0.079 654 HD13 ILE 78 2HD1 ILE 78 10.399 -11.749 1.642 655 H GLU 79 H GLU 79 5.661 -12.023 -2.269 656 HA GLU 79 HA GLU 79 5.504 -10.263 -4.429 657 HB2 GLU 79 2HB GLU 79 5.551 -12.741 -4.607 658 HB3 GLU 79 1HB GLU 79 3.908 -12.793 -3.984 659 HG2 GLU 79 2HG GLU 79 3.153 -11.489 -5.914 660 HG3 GLU 79 1HG GLU 79 4.798 -11.499 -6.543 661 H LEU 80 H LEU 80 3.136 -11.208 -1.995 662 HA LEU 80 HA LEU 80 0.866 -9.997 -3.069 663 HB2 LEU 80 2HB LEU 80 1.667 -10.308 -0.173 664 HB3 LEU 80 1HB LEU 80 0.062 -9.855 -0.714 665 HG LEU 80 HG LEU 80 1.432 -12.483 -1.301 666 HD11 LEU 80 1HD1 LEU 80 -0.841 -11.822 0.565 667 HD12 LEU 80 2HD1 LEU 80 0.798 -12.265 1.040 668 HD13 LEU 80 3HD1 LEU 80 -0.227 -13.437 0.212 669 HD21 LEU 80 3HD2 LEU 80 -1.375 -11.558 -1.916 670 HD22 LEU 80 1HD2 LEU 80 -0.728 -13.174 -2.197 671 HD23 LEU 80 2HD2 LEU 80 -0.084 -11.800 -3.095 672 H ASN 81 H ASN 81 3.216 -8.640 -0.743 673 HA ASN 81 HA ASN 81 2.078 -6.055 -0.724 674 HB2 ASN 81 2HB ASN 81 4.931 -6.882 -0.136 675 HB3 ASN 81 1HB ASN 81 4.232 -5.311 0.242 676 HD21 ASN 81 1HD2 ASN 81 5.414 -7.157 2.069 677 HD22 ASN 81 2HD2 ASN 81 4.172 -7.618 3.187 678 H TYR 82 H TYR 82 4.795 -7.417 -2.521 679 HA TYR 82 HA TYR 82 5.671 -5.168 -3.893 680 HB2 TYR 82 2HB TYR 82 6.497 -7.677 -3.764 681 HB3 TYR 82 1HB TYR 82 5.563 -7.841 -5.242 682 HD1 TYR 82 HD2 TYR 82 6.111 -5.589 -6.856 683 HD2 TYR 82 HD1 TYR 82 8.729 -7.566 -4.150 684 HE1 TYR 82 HE2 TYR 82 8.044 -4.792 -8.152 685 HE2 TYR 82 HE1 TYR 82 10.667 -6.777 -5.430 686 HH TYR 82 HH TYR 82 10.598 -4.325 -7.542 687 H LYS 83 H LYS 83 3.351 -7.621 -4.960 688 HA LYS 83 HA LYS 83 2.878 -6.409 -7.491 689 HB2 LYS 83 2HB LYS 83 2.747 -8.818 -7.087 690 HB3 LYS 83 1HB LYS 83 1.391 -8.575 -6.003 691 HG2 LYS 83 2HG LYS 83 0.056 -7.745 -7.895 692 HG3 LYS 83 1HG LYS 83 1.422 -8.071 -8.971 693 HD2 LYS 83 2HD LYS 83 1.368 -10.436 -8.261 694 HD3 LYS 83 1HD LYS 83 -0.053 -10.087 -7.279 695 HE2 LYS 83 2HE LYS 83 -1.280 -9.440 -9.295 696 HE3 LYS 83 1HE LYS 83 0.147 -9.795 -10.271 697 HZ1 LYS 83 3HZ LYS 83 -1.286 -11.673 -10.370 698 HZ2 LYS 83 1HZ LYS 83 -1.462 -11.718 -8.684 699 HZ3 LYS 83 2HZ LYS 83 0.030 -12.105 -9.392 700 H HIS 84 H HIS 84 1.166 -6.346 -4.395 701 HA HIS 84 HA HIS 84 -1.173 -5.155 -5.640 702 HB2 HIS 84 2HB HIS 84 -1.402 -6.912 -3.908 703 HB3 HIS 84 1HB HIS 84 -0.676 -5.823 -2.735 704 HD1 HIS 84 HD1 HIS 84 -3.809 -6.275 -4.782 705 HD2 HIS 84 HD2 HIS 84 -2.401 -4.005 -1.594 706 HE1 HIS 84 HE1 HIS 84 -5.822 -5.104 -3.844 707 HE2 HIS 84 HE2 HIS 84 -4.983 -3.936 -1.778 708 H LEU 85 H LEU 85 1.636 -4.073 -3.926 709 HA LEU 85 HA LEU 85 0.325 -1.524 -3.320 710 HB2 LEU 85 2HB LEU 85 3.040 -2.531 -2.469 711 HB3 LEU 85 1HB LEU 85 2.329 -1.001 -1.992 712 HG LEU 85 HG LEU 85 1.281 -3.741 -1.272 713 HD11 LEU 85 1HD1 LEU 85 3.320 -3.145 -0.083 714 HD12 LEU 85 2HD1 LEU 85 1.929 -3.121 1.002 715 HD13 LEU 85 3HD1 LEU 85 2.603 -1.609 0.398 716 HD21 LEU 85 3HD2 LEU 85 -0.320 -2.545 0.128 717 HD22 LEU 85 1HD2 LEU 85 -0.530 -2.125 -1.573 718 HD23 LEU 85 2HD2 LEU 85 0.285 -1.004 -0.481 719 H LEU 86 H LEU 86 2.950 -2.876 -5.246 720 HA LEU 86 HA LEU 86 3.579 -0.205 -6.260 721 HB2 LEU 86 2HB LEU 86 4.901 -2.872 -6.767 722 HB3 LEU 86 1HB LEU 86 5.439 -1.345 -7.442 723 HG LEU 86 HG LEU 86 5.386 -2.052 -4.505 724 HD11 LEU 86 1HD1 LEU 86 7.119 -3.248 -5.719 725 HD12 LEU 86 2HD1 LEU 86 7.828 -1.998 -4.695 726 HD13 LEU 86 3HD1 LEU 86 7.683 -1.738 -6.433 727 HD21 LEU 86 3HD2 LEU 86 6.357 0.427 -5.924 728 HD22 LEU 86 1HD2 LEU 86 6.599 0.070 -4.213 729 HD23 LEU 86 2HD2 LEU 86 4.970 0.314 -4.843 730 H GLY 87 H GLY 87 1.527 -2.721 -6.959 731 HA2 GLY 87 2HA GLY 87 0.049 -3.012 -8.695 732 HA3 GLY 87 1HA GLY 87 0.659 -1.516 -9.386 733 H ARG 88 H ARG 88 2.982 -3.937 -8.697 734 HA ARG 88 HA ARG 88 2.896 -5.140 -11.320 735 HB2 ARG 88 2HB ARG 88 4.027 -2.970 -11.728 736 HB3 ARG 88 1HB ARG 88 5.235 -3.388 -10.522 737 HG2 ARG 88 2HG ARG 88 6.063 -5.175 -11.880 738 HG3 ARG 88 1HG ARG 88 4.737 -4.981 -13.029 739 HD2 ARG 88 2HD ARG 88 6.840 -3.980 -13.845 740 HD3 ARG 88 1HD ARG 88 5.558 -2.787 -13.653 741 HE ARG 88 HE ARG 88 6.951 -2.732 -11.291 742 HH11 ARG 88 1HH1 ARG 88 7.703 -2.202 -14.668 743 HH12 ARG 88 2HH1 ARG 88 9.014 -1.104 -14.338 744 HH21 ARG 88 1HH2 ARG 88 8.648 -1.251 -10.857 745 HH22 ARG 88 2HH2 ARG 88 9.516 -0.534 -12.176 746 H ALA 89 H ALA 89 3.991 -7.072 -11.384 747 HA ALA 89 HA ALA 89 4.594 -8.272 -8.869 748 HB1 ALA 89 3HB ALA 89 4.968 -9.329 -11.672 749 HB2 ALA 89 1HB ALA 89 3.534 -9.536 -10.667 750 HB3 ALA 89 2HB ALA 89 5.058 -10.286 -10.194 751 HA PRO 90 HA PRO 90 8.950 -7.726 -8.350 752 HB2 PRO 90 2HB PRO 90 9.736 -10.381 -8.003 753 HB3 PRO 90 1HB PRO 90 9.166 -9.299 -6.729 754 HG2 PRO 90 2HG PRO 90 7.675 -11.388 -8.253 755 HG3 PRO 90 1HG PRO 90 7.542 -10.929 -6.545 756 HD2 PRO 90 2HD PRO 90 5.709 -10.156 -8.331 757 HD3 PRO 90 1HD PRO 90 6.224 -9.075 -7.017 758 H TYR 91 H TYR 91 10.509 -7.384 -9.783 759 HA TYR 91 HA TYR 91 10.316 -8.629 -12.379 760 HB2 TYR 91 2HB TYR 91 10.784 -6.170 -11.997 761 HB3 TYR 91 1HB TYR 91 12.392 -6.638 -11.453 762 HD1 TYR 91 HD1 TYR 91 10.088 -6.928 -14.363 763 HD2 TYR 91 HD2 TYR 91 14.121 -6.870 -13.011 764 HE1 TYR 91 HE1 TYR 91 10.861 -6.901 -16.697 765 HE2 TYR 91 HE2 TYR 91 14.904 -6.846 -15.343 766 HH TYR 91 HH TYR 91 14.159 -7.411 -17.550 767 H ASP 92 H ASP 92 12.714 -8.483 -9.765 768 HA ASP 92 HA ASP 92 14.023 -10.830 -10.959 769 HB2 ASP 92 2HB ASP 92 16.211 -9.941 -10.257 770 HB3 ASP 92 1HB ASP 92 15.420 -8.881 -11.418 771 H GLU 93 H GLU 93 15.513 -11.916 -9.315 772 HA GLU 93 HA GLU 93 13.870 -12.467 -7.009 773 HB2 GLU 93 2HB GLU 93 14.902 -14.284 -8.340 774 HB3 GLU 93 1HB GLU 93 16.491 -13.724 -7.837 775 HG2 GLU 93 2HG GLU 93 15.917 -14.198 -5.506 776 HG3 GLU 93 1HG GLU 93 14.330 -14.763 -6.019 777 H SER 94 H SER 94 16.757 -10.678 -7.690 778 HA SER 94 HA SER 94 17.962 -10.686 -5.166 779 HB2 SER 94 2HB SER 94 18.240 -8.089 -6.300 780 HB3 SER 94 1HB SER 94 19.415 -9.403 -6.279 781 HG SER 94 HG SER 94 17.425 -8.859 -8.233 782 H GLU 95 H GLU 95 15.417 -8.618 -6.516 783 HA GLU 95 HA GLU 95 14.914 -7.042 -4.271 784 HB2 GLU 95 2HB GLU 95 13.360 -7.917 -6.627 785 HB3 GLU 95 1HB GLU 95 12.413 -7.386 -5.246 786 HG2 GLU 95 2HG GLU 95 14.593 -5.776 -6.552 787 HG3 GLU 95 1HG GLU 95 12.868 -5.595 -6.877 788 H VAL 96 H VAL 96 13.544 -10.209 -5.143 789 HA VAL 96 HA VAL 96 11.850 -10.536 -2.962 790 HB VAL 96 HB VAL 96 13.419 -12.712 -4.358 791 HG11 VAL 96 1HG1 VAL 96 10.872 -12.833 -2.744 792 HG12 VAL 96 2HG1 VAL 96 12.441 -13.494 -2.281 793 HG13 VAL 96 3HG1 VAL 96 11.568 -14.173 -3.656 794 HG21 VAL 96 3HG2 VAL 96 10.689 -11.589 -4.987 795 HG22 VAL 96 1HG2 VAL 96 11.455 -12.958 -5.792 796 HG23 VAL 96 2HG2 VAL 96 12.152 -11.344 -5.939 797 H ILE 97 H ILE 97 15.250 -11.532 -3.303 798 HA ILE 97 HA ILE 97 15.534 -12.597 -0.708 799 HB ILE 97 HB ILE 97 17.651 -11.394 -2.496 800 HG12 ILE 97 2HG1 ILE 97 16.782 -14.269 -2.118 801 HG13 ILE 97 1HG1 ILE 97 16.374 -13.263 -3.503 802 HG21 ILE 97 1HG2 ILE 97 17.939 -13.241 -0.124 803 HG22 ILE 97 2HG2 ILE 97 18.410 -11.543 -0.180 804 HG23 ILE 97 3HG2 ILE 97 19.243 -12.722 -1.191 805 HD11 ILE 97 3HD1 ILE 97 19.146 -14.099 -2.689 806 HD12 ILE 97 1HD1 ILE 97 18.732 -13.101 -4.082 807 HD13 ILE 97 2HD1 ILE 97 18.197 -14.780 -4.011 808 H PHE 98 H PHE 98 16.081 -9.351 -1.996 809 HA PHE 98 HA PHE 98 17.191 -8.157 0.281 810 HB2 PHE 98 2HB PHE 98 17.143 -7.095 -1.943 811 HB3 PHE 98 1HB PHE 98 15.397 -6.930 -1.829 812 HD1 PHE 98 HD2 PHE 98 18.619 -5.720 -0.561 813 HD2 PHE 98 HD1 PHE 98 14.397 -5.183 -0.537 814 HE1 PHE 98 HE2 PHE 98 18.908 -3.514 0.488 815 HE2 PHE 98 HE1 PHE 98 14.677 -2.973 0.507 816 HZ PHE 98 HZ PHE 98 16.937 -2.136 1.023 817 H HIS 99 H HIS 99 13.814 -8.487 -0.743 818 HA HIS 99 HA HIS 99 12.762 -7.132 1.533 819 HB2 HIS 99 2HB HIS 99 11.487 -8.936 -0.525 820 HB3 HIS 99 1HB HIS 99 10.576 -8.200 0.789 821 HD1 HIS 99 HD1 HIS 99 9.846 -5.803 0.504 822 HD2 HIS 99 HD2 HIS 99 12.509 -7.053 -2.441 823 HE1 HIS 99 HE1 HIS 99 9.870 -3.967 -1.236 824 HE2 HIS 99 HE2 HIS 99 11.529 -4.729 -2.988 825 H LEU 100 H LEU 100 13.498 -10.491 0.795 826 HA LEU 100 HA LEU 100 12.242 -11.743 2.956 827 HB2 LEU 100 2HB LEU 100 14.708 -12.380 1.373 828 HB3 LEU 100 1HB LEU 100 14.268 -13.363 2.753 829 HG LEU 100 HG LEU 100 12.462 -12.903 0.380 830 HD11 LEU 100 1HD1 LEU 100 13.083 -15.176 -0.294 831 HD12 LEU 100 2HD1 LEU 100 14.270 -15.231 1.010 832 HD13 LEU 100 3HD1 LEU 100 14.470 -14.087 -0.317 833 HD21 LEU 100 3HD2 LEU 100 11.304 -13.482 2.454 834 HD22 LEU 100 1HD2 LEU 100 12.358 -14.884 2.655 835 HD23 LEU 100 2HD2 LEU 100 11.237 -14.810 1.294 836 H ASP 101 H ASP 101 15.572 -10.516 2.715 837 HA ASP 101 HA ASP 101 16.285 -11.154 5.368 838 HB2 ASP 101 2HB ASP 101 17.876 -10.660 3.491 839 HB3 ASP 101 1HB ASP 101 17.472 -8.955 3.667 840 H LEU 102 H LEU 102 14.946 -8.243 3.906 841 HA LEU 102 HA LEU 102 14.993 -6.584 6.171 842 HB2 LEU 102 2HB LEU 102 14.524 -5.818 3.864 843 HB3 LEU 102 1HB LEU 102 12.982 -6.649 3.911 844 HG LEU 102 HG LEU 102 12.248 -5.143 5.732 845 HD11 LEU 102 1HD1 LEU 102 14.416 -4.612 6.689 846 HD12 LEU 102 2HD1 LEU 102 13.564 -3.138 6.228 847 HD13 LEU 102 3HD1 LEU 102 14.871 -3.753 5.217 848 HD21 LEU 102 3HD2 LEU 102 11.662 -4.590 3.462 849 HD22 LEU 102 1HD2 LEU 102 13.222 -3.805 3.215 850 HD23 LEU 102 2HD2 LEU 102 12.053 -3.110 4.339 851 H TYR 103 H TYR 103 12.567 -8.861 4.970 852 HA TYR 103 HA TYR 103 10.621 -8.434 6.953 853 HB2 TYR 103 2HB TYR 103 10.055 -9.565 4.897 854 HB3 TYR 103 1HB TYR 103 11.214 -10.846 5.228 855 HD1 TYR 103 HD1 TYR 103 8.046 -9.341 6.456 856 HD2 TYR 103 HD2 TYR 103 10.577 -12.759 6.411 857 HE1 TYR 103 HE1 TYR 103 6.282 -10.656 7.549 858 HE2 TYR 103 HE2 TYR 103 8.817 -14.085 7.505 859 HH TYR 103 HH TYR 103 6.838 -13.722 8.900 860 H GLU 104 H GLU 104 13.305 -10.742 6.759 861 HA GLU 104 HA GLU 104 12.640 -12.224 9.057 862 HB2 GLU 104 2HB GLU 104 15.295 -11.784 7.697 863 HB3 GLU 104 1HB GLU 104 15.061 -12.909 9.025 864 HG2 GLU 104 2HG GLU 104 13.387 -14.107 7.652 865 HG3 GLU 104 1HG GLU 104 13.772 -13.029 6.311 866 H ASN 105 H ASN 105 14.455 -9.236 8.694 867 HA ASN 105 HA ASN 105 15.342 -9.458 11.478 868 HB2 ASN 105 2HB ASN 105 16.311 -7.743 9.198 869 HB3 ASN 105 1HB ASN 105 16.852 -7.519 10.861 870 HD21 ASN 105 1HD2 ASN 105 16.985 -9.514 8.047 871 HD22 ASN 105 2HD2 ASN 105 18.239 -10.574 8.603 872 H GLU 106 H GLU 106 13.602 -7.245 9.328 873 HA GLU 106 HA GLU 106 13.108 -5.516 11.643 874 HB2 GLU 106 2HB GLU 106 12.717 -4.981 8.699 875 HB3 GLU 106 1HB GLU 106 12.429 -3.822 9.992 876 HG2 GLU 106 2HG GLU 106 15.093 -5.092 9.398 877 HG3 GLU 106 1HG GLU 106 14.585 -3.508 8.817 878 H GLY 107 H GLY 107 11.461 -7.344 9.117 879 HA2 GLY 107 2HA GLY 107 9.444 -8.531 9.870 880 HA3 GLY 107 1HA GLY 107 8.979 -7.052 10.698 881 H PHE 108 H PHE 108 7.082 -8.038 9.166 882 HA PHE 108 HA PHE 108 7.244 -7.247 6.432 883 HB2 PHE 108 2HB PHE 108 4.774 -7.667 6.401 884 HB3 PHE 108 1HB PHE 108 5.731 -9.027 6.970 885 HD1 PHE 108 HD1 PHE 108 3.313 -6.444 7.907 886 HD2 PHE 108 HD2 PHE 108 5.597 -9.770 9.262 887 HE1 PHE 108 HE1 PHE 108 1.912 -6.579 9.925 888 HE2 PHE 108 HE2 PHE 108 4.203 -9.908 11.285 889 HZ PHE 108 HZ PHE 108 2.356 -8.314 11.619 890 H ASP 109 H ASP 109 6.381 -5.671 9.385 891 HA ASP 109 HA ASP 109 4.943 -3.477 8.386 892 HB2 ASP 109 2HB ASP 109 5.259 -3.981 10.809 893 HB3 ASP 109 1HB ASP 109 6.936 -3.464 10.669 894 H ALA 110 H ALA 110 8.390 -4.115 8.612 895 HA ALA 110 HA ALA 110 9.146 -1.521 7.618 896 HB1 ALA 110 3HB ALA 110 10.578 -2.721 9.194 897 HB2 ALA 110 1HB ALA 110 11.422 -2.379 7.685 898 HB3 ALA 110 2HB ALA 110 10.814 -4.003 8.005 899 H ASP 111 H ASP 111 8.702 -4.749 6.307 900 HA ASP 111 HA ASP 111 9.852 -4.375 3.781 901 HB2 ASP 111 2HB ASP 111 9.120 -6.577 4.541 902 HB3 ASP 111 1HB ASP 111 7.442 -6.038 4.562 903 H ILE 112 H ILE 112 6.496 -3.956 4.818 904 HA ILE 112 HA ILE 112 5.596 -2.718 2.427 905 HB ILE 112 HB ILE 112 4.443 -2.585 5.223 906 HG12 ILE 112 2HG1 ILE 112 3.667 -4.395 2.929 907 HG13 ILE 112 1HG1 ILE 112 4.764 -4.878 4.217 908 HG21 ILE 112 1HG2 ILE 112 2.320 -2.055 4.091 909 HG22 ILE 112 2HG2 ILE 112 3.178 -1.990 2.551 910 HG23 ILE 112 3HG2 ILE 112 3.550 -0.819 3.815 911 HD11 ILE 112 3HD1 ILE 112 1.904 -4.038 4.588 912 HD12 ILE 112 1HD1 ILE 112 3.002 -4.589 5.851 913 HD13 ILE 112 2HD1 ILE 112 2.498 -5.697 4.575 914 H ASP 113 H ASP 113 7.148 -1.590 5.315 915 HA ASP 113 HA ASP 113 6.502 1.143 5.196 916 HB2 ASP 113 2HB ASP 113 7.534 -0.025 7.148 917 HB3 ASP 113 1HB ASP 113 9.049 -0.092 6.257 918 H SER 114 H SER 114 8.763 -0.786 3.409 919 HA SER 114 HA SER 114 10.549 1.138 2.494 920 HB2 SER 114 2HB SER 114 9.463 -1.255 0.992 921 HB3 SER 114 1HB SER 114 10.937 -0.371 0.589 922 HG SER 114 HG SER 114 10.399 -1.971 2.860 923 H TYR 115 H TYR 115 7.249 0.499 1.567 924 HA TYR 115 HA TYR 115 7.315 2.148 -0.791 925 HB2 TYR 115 2HB TYR 115 5.740 0.307 -0.701 926 HB3 TYR 115 1HB TYR 115 5.025 0.941 0.775 927 HD1 TYR 115 HD1 TYR 115 5.651 1.963 -2.773 928 HD2 TYR 115 HD2 TYR 115 3.067 2.161 0.606 929 HE1 TYR 115 HE1 TYR 115 3.992 3.186 -4.117 930 HE2 TYR 115 HE2 TYR 115 1.409 3.392 -0.728 931 HH TYR 115 HH TYR 115 1.273 4.739 -2.719 932 H ILE 116 H ILE 116 5.916 2.445 2.461 933 HA ILE 116 HA ILE 116 4.845 5.032 2.119 934 HB ILE 116 HB ILE 116 5.736 3.744 4.706 935 HG12 ILE 116 2HG1 ILE 116 4.207 2.277 3.476 936 HG13 ILE 116 1HG1 ILE 116 3.424 2.939 4.906 937 HG21 ILE 116 1HG2 ILE 116 5.302 6.112 4.963 938 HG22 ILE 116 2HG2 ILE 116 4.021 5.177 5.734 939 HG23 ILE 116 3HG2 ILE 116 3.738 5.937 4.168 940 HD11 ILE 116 3HD1 ILE 116 3.054 3.933 2.091 941 HD12 ILE 116 1HD1 ILE 116 2.238 4.548 3.527 942 HD13 ILE 116 2HD1 ILE 116 1.932 2.901 2.976 943 H ASP 117 H ASP 117 8.000 3.886 3.105 944 HA ASP 117 HA ASP 117 8.979 6.424 4.010 945 HB2 ASP 117 2HB ASP 117 9.893 4.298 4.844 946 HB3 ASP 117 1HB ASP 117 10.455 3.898 3.228 947 H SER 118 H SER 118 8.277 5.247 0.980 948 HA SER 118 HA SER 118 10.223 7.063 -0.275 949 HB2 SER 118 2HB SER 118 8.771 4.736 -1.561 950 HB3 SER 118 1HB SER 118 10.004 5.747 -2.314 951 HG SER 118 HG SER 118 10.270 3.759 -0.338 952 HA PRO 119 HA PRO 119 6.017 8.965 -0.437 953 HB2 PRO 119 2HB PRO 119 6.875 11.543 -0.333 954 HB3 PRO 119 1HB PRO 119 6.638 10.540 1.102 955 HG2 PRO 119 2HG PRO 119 9.168 11.179 -0.363 956 HG3 PRO 119 1HG PRO 119 8.870 11.123 1.385 957 HD2 PRO 119 2HD PRO 119 10.078 9.107 0.058 958 HD3 PRO 119 1HD PRO 119 9.032 8.824 1.465 959 H GLU 120 H GLU 120 8.881 9.695 -2.307 960 HA GLU 120 HA GLU 120 7.720 11.294 -4.300 961 HB2 GLU 120 2HB GLU 120 10.152 11.050 -3.911 962 HB3 GLU 120 1HB GLU 120 10.071 9.401 -4.508 963 HG2 GLU 120 2HG GLU 120 9.404 10.226 -6.703 964 HG3 GLU 120 1HG GLU 120 9.479 11.885 -6.101 965 H TYR 121 H TYR 121 8.537 7.821 -4.403 966 HA TYR 121 HA TYR 121 7.113 7.389 -6.821 967 HB2 TYR 121 2HB TYR 121 8.245 5.515 -4.754 968 HB3 TYR 121 1HB TYR 121 7.359 4.929 -6.160 969 HD1 TYR 121 HD1 TYR 121 8.255 5.304 -8.428 970 HD2 TYR 121 HD2 TYR 121 10.491 6.343 -4.961 971 HE1 TYR 121 HE1 TYR 121 10.291 5.455 -9.793 972 HE2 TYR 121 HE2 TYR 121 12.537 6.492 -6.319 973 HH TYR 121 HH TYR 121 13.382 5.551 -8.516 974 H THR 122 H THR 122 6.189 7.382 -3.472 975 HA THR 122 HA THR 122 3.755 5.973 -3.789 976 HB THR 122 HB THR 122 4.554 8.003 -1.698 977 HG1 THR 122 HG1 THR 122 5.812 6.182 -1.494 978 HG21 THR 122 3HG2 THR 122 2.126 7.840 -1.852 979 HG22 THR 122 1HG2 THR 122 2.709 7.078 -0.372 980 HG23 THR 122 2HG2 THR 122 2.226 6.083 -1.747 981 H ASN 123 H ASN 123 4.436 9.501 -3.640 982 HA ASN 123 HA ASN 123 1.715 10.176 -4.030 983 HB2 ASN 123 2HB ASN 123 2.436 12.468 -4.292 984 HB3 ASN 123 1HB ASN 123 3.314 11.725 -2.969 985 HD21 ASN 123 1HD2 ASN 123 5.002 13.092 -2.976 986 HD22 ASN 123 2HD2 ASN 123 6.150 13.210 -4.264 987 H SER 124 H SER 124 4.195 9.245 -6.195 988 HA SER 124 HA SER 124 2.980 10.416 -8.526 989 HB2 SER 124 2HB SER 124 5.138 8.303 -8.340 990 HB3 SER 124 1HB SER 124 4.722 9.249 -9.769 991 HG SER 124 HG SER 124 5.747 10.259 -7.308 992 H PHE 125 H PHE 125 2.573 7.432 -6.782 993 HA PHE 125 HA PHE 125 1.153 6.321 -9.118 994 HB2 PHE 125 2HB PHE 125 3.263 5.131 -8.623 995 HB3 PHE 125 1HB PHE 125 2.665 4.769 -7.010 996 HD1 PHE 125 HD2 PHE 125 2.002 4.210 -10.610 997 HD2 PHE 125 HD1 PHE 125 1.342 2.886 -6.620 998 HE1 PHE 125 HE2 PHE 125 0.975 2.147 -11.468 999 HE2 PHE 125 HE1 PHE 125 0.307 0.824 -7.472 1000 HZ PHE 125 HZ PHE 125 0.124 0.451 -9.899 1001 H GLY 126 H GLY 126 1.180 6.544 -5.577 1002 HA2 GLY 126 2HA GLY 126 -1.687 6.079 -5.552 1003 HA3 GLY 126 1HA GLY 126 -0.719 4.841 -4.768 1004 H ASP 127 H ASP 127 -1.045 8.389 -4.813 1005 HA ASP 127 HA ASP 127 -0.697 8.386 -1.889 1006 HB2 ASP 127 2HB ASP 127 0.762 9.932 -3.137 1007 HB3 ASP 127 1HB ASP 127 -0.654 10.696 -3.850 1008 H TRP 128 H TRP 128 -2.758 9.598 -4.482 1009 HA TRP 128 HA TRP 128 -5.023 9.546 -2.592 1010 HB2 TRP 128 2HB TRP 128 -4.623 11.221 -5.081 1011 HB3 TRP 128 1HB TRP 128 -6.160 11.087 -4.234 1012 HD1 TRP 128 HD1 TRP 128 -2.922 12.959 -4.189 1013 HE1 TRP 128 HE1 TRP 128 -2.886 14.592 -2.201 1014 HE3 TRP 128 HE3 TRP 128 -7.034 11.263 -1.674 1015 HZ2 TRP 128 HZ2 TRP 128 -4.400 15.094 0.126 1016 HZ3 TRP 128 HZ3 TRP 128 -7.670 12.369 0.429 1017 HH2 TRP 128 HH2 TRP 128 -6.381 14.245 1.310 1018 H VAL 129 H VAL 129 -3.552 7.742 -4.750 1019 HA VAL 129 HA VAL 129 -6.026 6.735 -5.990 1020 HB VAL 129 HB VAL 129 -3.235 6.574 -7.159 1021 HG11 VAL 129 1HG1 VAL 129 -5.915 5.884 -8.359 1022 HG12 VAL 129 2HG1 VAL 129 -4.681 4.734 -7.844 1023 HG13 VAL 129 3HG1 VAL 129 -4.364 5.823 -9.196 1024 HG21 VAL 129 3HG2 VAL 129 -4.001 8.219 -8.808 1025 HG22 VAL 129 1HG2 VAL 129 -4.002 8.878 -7.173 1026 HG23 VAL 129 2HG2 VAL 129 -5.521 8.387 -7.927 1027 H VAL 130 H VAL 130 -6.342 4.528 -5.928 1028 HA VAL 130 HA VAL 130 -4.727 3.023 -4.060 1029 HB VAL 130 HB VAL 130 -7.066 2.116 -5.755 1030 HG11 VAL 130 1HG1 VAL 130 -7.205 0.232 -4.210 1031 HG12 VAL 130 2HG1 VAL 130 -5.775 0.814 -3.359 1032 HG13 VAL 130 3HG1 VAL 130 -5.643 0.263 -5.029 1033 HG21 VAL 130 3HG2 VAL 130 -6.976 3.018 -2.878 1034 HG22 VAL 130 1HG2 VAL 130 -8.384 2.345 -3.697 1035 HG23 VAL 130 2HG2 VAL 130 -7.713 3.889 -4.223 1036 HA PRO 131 HA PRO 131 -1.718 1.596 -7.001 1037 HB2 PRO 131 2HB PRO 131 -1.883 -0.784 -5.200 1038 HB3 PRO 131 1HB PRO 131 -0.459 0.058 -5.823 1039 HG2 PRO 131 2HG PRO 131 -1.271 0.461 -3.325 1040 HG3 PRO 131 1HG PRO 131 -0.663 1.805 -4.313 1041 HD2 PRO 131 2HD PRO 131 -3.456 1.150 -3.513 1042 HD3 PRO 131 1HD PRO 131 -2.705 2.730 -3.811 1043 H TYR 132 H TYR 132 -2.789 1.219 -8.857 1044 HA TYR 132 HA TYR 132 -4.339 -1.243 -9.137 1045 HB2 TYR 132 2HB TYR 132 -5.051 -0.331 -11.302 1046 HB3 TYR 132 1HB TYR 132 -5.361 0.822 -10.011 1047 HD1 TYR 132 HD2 TYR 132 -3.850 2.819 -9.764 1048 HD2 TYR 132 HD1 TYR 132 -3.624 0.203 -13.112 1049 HE1 TYR 132 HE2 TYR 132 -2.601 4.531 -11.011 1050 HE2 TYR 132 HE1 TYR 132 -2.378 1.907 -14.369 1051 HH TYR 132 HH TYR 132 -2.140 4.419 -14.328 1052 H TYR 133 H TYR 133 -3.910 -2.524 -11.176 1053 HA TYR 133 HA TYR 133 -1.097 -3.126 -11.140 1054 HB2 TYR 133 2HB TYR 133 -3.102 -4.790 -11.248 1055 HB3 TYR 133 1HB TYR 133 -3.056 -4.466 -12.979 1056 HD1 TYR 133 HD1 TYR 133 -0.888 -5.515 -10.150 1057 HD2 TYR 133 HD2 TYR 133 -1.597 -5.692 -14.340 1058 HE1 TYR 133 HE1 TYR 133 0.917 -7.165 -10.375 1059 HE2 TYR 133 HE2 TYR 133 0.210 -7.347 -14.582 1060 HH TYR 133 HH TYR 133 2.053 -8.245 -13.505 1061 H ARG 134 H ARG 134 0.316 -2.152 -12.359 1062 HA ARG 134 HA ARG 134 -0.383 -1.566 -15.150 1063 HB2 ARG 134 2HB ARG 134 -0.399 0.530 -13.736 1064 HB3 ARG 134 1HB ARG 134 1.314 0.264 -13.441 1065 HG2 ARG 134 2HG ARG 134 1.794 0.474 -15.794 1066 HG3 ARG 134 1HG ARG 134 0.077 0.621 -16.162 1067 HD2 ARG 134 2HD ARG 134 0.032 2.681 -14.748 1068 HD3 ARG 134 1HD ARG 134 1.787 2.561 -14.611 1069 HE ARG 134 HE ARG 134 1.313 2.497 -17.297 1070 HH11 ARG 134 1HH1 ARG 134 0.580 4.745 -14.713 1071 HH12 ARG 134 2HH1 ARG 134 0.463 6.123 -15.773 1072 HH21 ARG 134 1HH2 ARG 134 1.196 4.311 -18.692 1073 HH22 ARG 134 2HH2 ARG 134 0.827 5.877 -18.029 1074 H GLY 135 H GLY 135 0.811 -2.939 -16.272 1075 HA2 GLY 135 2HA GLY 135 3.318 -3.917 -15.158 1076 HA3 GLY 135 1HA GLY 135 2.483 -4.551 -16.567 1077 H LEU 136 H LEU 136 4.697 -4.584 -17.403 1078 HA LEU 136 HA LEU 136 6.223 -3.870 -18.913 1079 HB2 LEU 136 2HB LEU 136 4.452 -1.436 -19.149 1080 HB3 LEU 136 1HB LEU 136 5.790 -1.813 -20.212 1081 HG LEU 136 HG LEU 136 3.276 -3.459 -19.915 1082 HD11 LEU 136 1HD1 LEU 136 2.766 -2.693 -22.171 1083 HD12 LEU 136 2HD1 LEU 136 4.215 -1.687 -22.165 1084 HD13 LEU 136 3HD1 LEU 136 2.891 -1.332 -21.056 1085 HD21 LEU 136 3HD2 LEU 136 5.604 -3.769 -21.802 1086 HD22 LEU 136 1HD2 LEU 136 4.124 -4.727 -21.813 1087 HD23 LEU 136 2HD2 LEU 136 5.230 -4.829 -20.442 1088 H GLU 137 H GLU 137 7.131 -1.216 -19.390 1089 HA GLU 137 HA GLU 137 8.023 -0.130 -16.879 1090 HB2 GLU 137 2HB GLU 137 9.546 -2.071 -17.229 1091 HB3 GLU 137 1HB GLU 137 10.012 -1.405 -18.785 1092 HG2 GLU 137 2HG GLU 137 11.664 -1.034 -16.975 1093 HG3 GLU 137 1HG GLU 137 11.103 0.444 -17.751 1094 H HIS 138 H HIS 138 9.692 1.706 -17.445 1095 HA HIS 138 HA HIS 138 8.562 3.616 -19.055 1096 HB2 HIS 138 2HB HIS 138 11.495 3.236 -18.420 1097 HB3 HIS 138 1HB HIS 138 10.820 4.694 -19.136 1098 HD1 HIS 138 HD1 HIS 138 8.626 5.584 -17.518 1099 HD2 HIS 138 HD2 HIS 138 11.805 3.559 -15.761 1100 HE1 HIS 138 HE1 HIS 138 8.546 6.185 -15.075 1101 HE2 HIS 138 HE2 HIS 138 10.357 4.796 -14.006 1102 H HIS 139 H HIS 139 8.557 4.153 -21.162 1103 HA HIS 139 HA HIS 139 8.883 2.131 -23.061 1104 HB2 HIS 139 2HB HIS 139 8.699 5.119 -23.501 1105 HB3 HIS 139 1HB HIS 139 8.519 3.904 -24.760 1106 HD1 HIS 139 HD1 HIS 139 6.442 6.060 -23.119 1107 HD2 HIS 139 HD2 HIS 139 6.365 1.913 -23.501 1108 HE1 HIS 139 HE1 HIS 139 4.058 5.376 -22.673 1109 HE2 HIS 139 HE2 HIS 139 4.006 2.882 -23.055 1110 H HIS 140 H HIS 140 10.891 5.000 -22.468 1111 HA HIS 140 HA HIS 140 12.949 3.894 -24.233 1112 HB2 HIS 140 2HB HIS 140 12.297 6.290 -24.477 1113 HB3 HIS 140 1HB HIS 140 12.861 6.582 -22.835 1114 HD1 HIS 140 HD1 HIS 140 14.172 5.582 -26.244 1115 HD2 HIS 140 HD2 HIS 140 15.554 7.066 -22.608 1116 HE1 HIS 140 HE1 HIS 140 16.579 6.211 -26.633 1117 HE2 HIS 140 HE2 HIS 140 17.429 7.021 -24.397 1118 H HIS 141 H HIS 141 14.293 2.502 -23.282 1119 HA HIS 141 HA HIS 141 15.319 3.159 -20.629 1120 HB2 HIS 141 2HB HIS 141 15.014 0.766 -19.904 1121 HB3 HIS 141 1HB HIS 141 13.530 1.695 -20.054 1122 HD1 HIS 141 HD1 HIS 141 11.845 0.965 -21.855 1123 HD2 HIS 141 HD2 HIS 141 15.291 -1.364 -21.744 1124 HE1 HIS 141 HE1 HIS 141 11.357 -1.043 -23.288 1125 HE2 HIS 141 HE2 HIS 141 13.468 -2.421 -23.241 1126 H HIS 142 H HIS 142 17.326 3.550 -21.250 1127 HA HIS 142 HA HIS 142 19.173 1.494 -21.393 1128 HB2 HIS 142 2HB HIS 142 18.168 1.226 -23.740 1129 HB3 HIS 142 1HB HIS 142 18.916 2.775 -24.121 1130 HD1 HIS 142 HD1 HIS 142 21.180 2.591 -25.118 1131 HD2 HIS 142 HD2 HIS 142 20.248 -0.698 -22.739 1132 HE1 HIS 142 HE1 HIS 142 23.137 1.023 -25.324 1133 HE2 HIS 142 HE2 HIS 142 22.616 -0.894 -23.769 1134 H HIS 143 H HIS 143 18.498 4.689 -22.744 1135 HA HIS 143 HA HIS 143 20.304 6.015 -21.023 1136 HB2 HIS 143 2HB HIS 143 22.012 5.075 -22.506 1137 HB3 HIS 143 1HB HIS 143 21.173 5.728 -23.911 1138 HD1 HIS 143 HD1 HIS 143 21.889 7.971 -24.668 1139 HD2 HIS 143 HD2 HIS 143 23.029 7.216 -20.739 1140 HE1 HIS 143 HE1 HIS 143 23.292 9.942 -23.976 1141 HE2 HIS 143 HE2 HIS 143 23.796 9.561 -21.535 Start of MODEL 10 1 H1 MET 1 1H MET 1 -8.060 4.810 -16.705 2 H2 MET 1 2H MET 1 -7.336 6.142 -15.942 3 H3 MET 1 3H MET 1 -8.542 6.383 -17.106 4 HA MET 1 HA MET 1 -9.305 6.710 -14.810 5 HB2 MET 1 2HB MET 1 -10.570 4.501 -16.443 6 HB3 MET 1 1HB MET 1 -11.336 5.234 -15.042 7 HG2 MET 1 2HG MET 1 -12.218 6.217 -17.040 8 HG3 MET 1 1HG MET 1 -11.262 7.419 -16.176 9 HE1 MET 1 3HE MET 1 -12.193 7.729 -19.201 10 HE2 MET 1 1HE MET 1 -10.725 8.344 -19.961 11 HE3 MET 1 2HE MET 1 -11.219 8.946 -18.378 12 HA PRO 2 HA PRO 2 -7.842 3.226 -12.282 13 HB2 PRO 2 2HB PRO 2 -6.208 4.559 -10.650 14 HB3 PRO 2 1HB PRO 2 -5.681 4.095 -12.272 15 HG2 PRO 2 2HG PRO 2 -6.473 6.761 -11.234 16 HG3 PRO 2 1HG PRO 2 -5.322 6.346 -12.513 17 HD2 PRO 2 2HD PRO 2 -8.022 7.184 -12.830 18 HD3 PRO 2 1HD PRO 2 -6.917 6.615 -14.094 19 H VAL 3 H VAL 3 -7.984 3.114 -9.791 20 HA VAL 3 HA VAL 3 -10.340 4.582 -8.922 21 HB VAL 3 HB VAL 3 -8.756 2.512 -7.384 22 HG11 VAL 3 1HG1 VAL 3 -10.806 2.305 -6.048 23 HG12 VAL 3 2HG1 VAL 3 -11.542 3.605 -6.986 24 HG13 VAL 3 3HG1 VAL 3 -10.135 3.935 -5.974 25 HG21 VAL 3 3HG2 VAL 3 -9.613 1.553 -9.461 26 HG22 VAL 3 1HG2 VAL 3 -11.229 2.147 -9.081 27 HG23 VAL 3 2HG2 VAL 3 -10.484 0.911 -8.068 28 H GLU 4 H GLU 4 -9.804 6.642 -8.417 29 HA GLU 4 HA GLU 4 -7.610 7.016 -6.488 30 HB2 GLU 4 2HB GLU 4 -7.199 9.232 -7.512 31 HB3 GLU 4 1HB GLU 4 -6.902 7.907 -8.630 32 HG2 GLU 4 2HG GLU 4 -8.747 8.396 -9.915 33 HG3 GLU 4 1HG GLU 4 -9.562 9.259 -8.612 34 H LEU 5 H LEU 5 -7.839 8.777 -5.031 35 HA LEU 5 HA LEU 5 -10.536 9.958 -4.890 36 HB2 LEU 5 2HB LEU 5 -10.078 8.240 -3.103 37 HB3 LEU 5 1HB LEU 5 -8.770 9.256 -2.537 38 HG LEU 5 HG LEU 5 -10.460 11.064 -2.115 39 HD11 LEU 5 1HD1 LEU 5 -12.432 8.832 -2.583 40 HD12 LEU 5 2HD1 LEU 5 -12.184 10.212 -3.655 41 HD13 LEU 5 3HD1 LEU 5 -12.803 10.465 -2.023 42 HD21 LEU 5 3HD2 LEU 5 -9.611 9.671 -0.316 43 HD22 LEU 5 1HD2 LEU 5 -10.828 8.445 -0.668 44 HD23 LEU 5 2HD2 LEU 5 -11.319 10.028 -0.062 45 H ARG 6 H ARG 6 -9.965 11.884 -5.863 46 HA ARG 6 HA ARG 6 -8.060 13.555 -4.384 47 HB2 ARG 6 2HB ARG 6 -7.974 13.132 -7.377 48 HB3 ARG 6 1HB ARG 6 -7.039 14.331 -6.498 49 HG2 ARG 6 2HG ARG 6 -5.842 12.594 -5.329 50 HG3 ARG 6 1HG ARG 6 -6.833 11.358 -6.102 51 HD2 ARG 6 2HD ARG 6 -4.743 11.466 -7.262 52 HD3 ARG 6 1HD ARG 6 -5.991 12.147 -8.305 53 HE ARG 6 HE ARG 6 -5.036 14.349 -7.140 54 HH11 ARG 6 1HH1 ARG 6 -3.420 11.648 -8.668 55 HH12 ARG 6 2HH1 ARG 6 -2.016 12.562 -9.123 56 HH21 ARG 6 1HH2 ARG 6 -3.189 15.574 -7.733 57 HH22 ARG 6 2HH2 ARG 6 -1.873 14.787 -8.564 58 H ALA 7 H ALA 7 -9.563 14.919 -3.667 59 HA ALA 7 HA ALA 7 -10.873 16.774 -3.635 60 HB1 ALA 7 3HB ALA 7 -10.285 16.989 -6.579 61 HB2 ALA 7 1HB ALA 7 -9.304 17.669 -5.280 62 HB3 ALA 7 2HB ALA 7 -10.946 18.257 -5.547 63 H ASN 8 H ASN 8 -11.582 14.447 -6.152 64 HA ASN 8 HA ASN 8 -14.281 15.344 -6.590 65 HB2 ASN 8 2HB ASN 8 -12.691 14.189 -8.247 66 HB3 ASN 8 1HB ASN 8 -13.092 12.695 -7.412 67 HD21 ASN 8 1HD2 ASN 8 -14.968 11.670 -7.891 68 HD22 ASN 8 2HD2 ASN 8 -16.117 12.259 -9.044 69 H TRP 9 H TRP 9 -13.433 14.540 -3.878 70 HA TRP 9 HA TRP 9 -14.255 12.117 -2.930 71 HB2 TRP 9 2HB TRP 9 -13.281 14.354 -1.870 72 HB3 TRP 9 1HB TRP 9 -14.957 14.546 -1.387 73 HD1 TRP 9 HD1 TRP 9 -11.908 12.375 -0.798 74 HE1 TRP 9 HE1 TRP 9 -12.247 11.036 1.387 75 HE3 TRP 9 HE3 TRP 9 -16.780 13.581 0.127 76 HZ2 TRP 9 HZ2 TRP 9 -14.319 10.574 3.250 77 HZ3 TRP 9 HZ3 TRP 9 -17.869 12.656 2.129 78 HH2 TRP 9 HH2 TRP 9 -16.664 11.182 3.657 79 H SER 10 H SER 10 -16.134 11.074 -2.973 80 HA SER 10 HA SER 10 -18.555 12.451 -2.164 81 HB2 SER 10 2HB SER 10 -19.909 11.625 -3.998 82 HB3 SER 10 1HB SER 10 -18.555 12.526 -4.682 83 HG SER 10 HG SER 10 -17.830 10.753 -5.581 84 H GLU 11 H GLU 11 -20.372 10.606 -2.012 85 HA GLU 11 HA GLU 11 -19.423 8.540 -0.347 86 HB2 GLU 11 2HB GLU 11 -22.009 8.979 -1.811 87 HB3 GLU 11 1HB GLU 11 -21.724 7.494 -0.915 88 HG2 GLU 11 2HG GLU 11 -21.544 10.245 0.282 89 HG3 GLU 11 1HG GLU 11 -22.987 9.231 0.326 90 H GLU 12 H GLU 12 -20.366 8.543 -3.769 91 HA GLU 12 HA GLU 12 -19.913 5.793 -4.210 92 HB2 GLU 12 2HB GLU 12 -21.257 7.266 -5.700 93 HB3 GLU 12 1HB GLU 12 -19.774 8.052 -6.218 94 HG2 GLU 12 2HG GLU 12 -20.499 6.436 -7.863 95 HG3 GLU 12 1HG GLU 12 -18.974 5.934 -7.138 96 H ASP 13 H ASP 13 -17.877 8.660 -4.764 97 HA ASP 13 HA ASP 13 -15.667 7.320 -5.842 98 HB2 ASP 13 2HB ASP 13 -15.956 9.943 -4.393 99 HB3 ASP 13 1HB ASP 13 -14.362 9.340 -4.835 100 H LEU 14 H LEU 14 -16.208 8.347 -2.472 101 HA LEU 14 HA LEU 14 -13.823 7.325 -1.432 102 HB2 LEU 14 2HB LEU 14 -15.218 8.893 -0.207 103 HB3 LEU 14 1HB LEU 14 -16.500 7.704 -0.095 104 HG LEU 14 HG LEU 14 -14.902 6.266 1.241 105 HD11 LEU 14 1HD1 LEU 14 -13.334 8.835 1.345 106 HD12 LEU 14 2HD1 LEU 14 -12.826 7.339 0.560 107 HD13 LEU 14 3HD1 LEU 14 -13.024 7.393 2.311 108 HD21 LEU 14 3HD2 LEU 14 -15.285 7.491 3.308 109 HD22 LEU 14 1HD2 LEU 14 -16.709 7.544 2.270 110 HD23 LEU 14 2HD2 LEU 14 -15.650 8.950 2.387 111 H GLU 15 H GLU 15 -17.054 5.858 -1.552 112 HA GLU 15 HA GLU 15 -16.397 3.521 -0.140 113 HB2 GLU 15 2HB GLU 15 -18.670 4.402 -0.506 114 HB3 GLU 15 1HB GLU 15 -18.562 3.937 -2.195 115 HG2 GLU 15 2HG GLU 15 -18.360 1.591 -1.518 116 HG3 GLU 15 1HG GLU 15 -18.509 2.083 0.171 117 H THR 16 H THR 16 -16.304 4.266 -3.598 118 HA THR 16 HA THR 16 -15.668 1.658 -4.474 119 HB THR 16 HB THR 16 -14.958 4.320 -5.734 120 HG1 THR 16 HG1 THR 16 -17.158 4.134 -5.694 121 HG21 THR 16 3HG2 THR 16 -14.988 1.549 -6.941 122 HG22 THR 16 1HG2 THR 16 -13.551 2.516 -6.610 123 HG23 THR 16 2HG2 THR 16 -14.714 3.055 -7.821 124 H VAL 17 H VAL 17 -13.706 4.388 -3.406 125 HA VAL 17 HA VAL 17 -11.164 3.305 -3.886 126 HB VAL 17 HB VAL 17 -12.092 5.271 -1.783 127 HG11 VAL 17 1HG1 VAL 17 -9.994 4.281 -1.057 128 HG12 VAL 17 2HG1 VAL 17 -9.739 5.946 -1.587 129 HG13 VAL 17 3HG1 VAL 17 -9.275 4.605 -2.636 130 HG21 VAL 17 3HG2 VAL 17 -11.265 6.959 -3.286 131 HG22 VAL 17 1HG2 VAL 17 -12.400 5.927 -4.149 132 HG23 VAL 17 2HG2 VAL 17 -10.665 5.730 -4.399 133 H ILE 18 H ILE 18 -13.227 3.185 -0.980 134 HA ILE 18 HA ILE 18 -11.569 1.659 0.666 135 HB ILE 18 HB ILE 18 -14.540 1.189 0.566 136 HG12 ILE 18 2HG1 ILE 18 -14.233 3.624 0.455 137 HG13 ILE 18 1HG1 ILE 18 -14.899 3.129 2.004 138 HG21 ILE 18 1HG2 ILE 18 -12.533 1.247 2.809 139 HG22 ILE 18 2HG2 ILE 18 -13.281 -0.180 2.094 140 HG23 ILE 18 3HG2 ILE 18 -14.265 0.969 2.998 141 HD11 ILE 18 3HD1 ILE 18 -13.238 4.880 2.246 142 HD12 ILE 18 1HD1 ILE 18 -12.028 3.849 1.478 143 HD13 ILE 18 2HD1 ILE 18 -12.717 3.391 3.035 144 H ARG 19 H ARG 19 -14.060 0.654 -1.612 145 HA ARG 19 HA ARG 19 -13.922 -2.106 -1.162 146 HB2 ARG 19 2HB ARG 19 -15.824 -1.006 -2.214 147 HB3 ARG 19 1HB ARG 19 -14.830 -0.543 -3.585 148 HG2 ARG 19 2HG ARG 19 -14.541 -2.933 -4.137 149 HG3 ARG 19 1HG ARG 19 -15.641 -3.337 -2.815 150 HD2 ARG 19 2HD ARG 19 -16.289 -1.655 -5.233 151 HD3 ARG 19 1HD ARG 19 -16.837 -3.303 -4.930 152 HE ARG 19 HE ARG 19 -18.107 -2.415 -3.033 153 HH11 ARG 19 1HH1 ARG 19 -17.062 -0.158 -5.504 154 HH12 ARG 19 2HH1 ARG 19 -18.246 1.043 -5.084 155 HH21 ARG 19 1HH2 ARG 19 -19.673 -0.850 -2.503 156 HH22 ARG 19 2HH2 ARG 19 -19.714 0.656 -3.379 157 H ALA 20 H ALA 20 -12.141 -0.033 -3.367 158 HA ALA 20 HA ALA 20 -11.055 -2.113 -4.962 159 HB1 ALA 20 3HB ALA 20 -11.155 0.199 -5.738 160 HB2 ALA 20 1HB ALA 20 -9.502 -0.415 -5.779 161 HB3 ALA 20 2HB ALA 20 -10.005 0.673 -4.485 162 H VAL 21 H VAL 21 -10.007 -0.497 -2.020 163 HA VAL 21 HA VAL 21 -7.448 -1.770 -1.921 164 HB VAL 21 HB VAL 21 -9.008 -0.521 0.351 165 HG11 VAL 21 1HG1 VAL 21 -6.789 -0.261 1.397 166 HG12 VAL 21 2HG1 VAL 21 -6.078 -1.178 0.068 167 HG13 VAL 21 3HG1 VAL 21 -7.229 -1.950 1.156 168 HG21 VAL 21 3HG2 VAL 21 -8.674 1.079 -1.441 169 HG22 VAL 21 1HG2 VAL 21 -6.954 0.690 -1.495 170 HG23 VAL 21 2HG2 VAL 21 -7.637 1.472 -0.069 171 H TYR 22 H TYR 22 -10.614 -2.384 -0.461 172 HA TYR 22 HA TYR 22 -10.214 -5.189 -0.458 173 HB2 TYR 22 2HB TYR 22 -9.919 -5.717 1.788 174 HB3 TYR 22 1HB TYR 22 -8.877 -4.312 1.608 175 HD1 TYR 22 HD2 TYR 22 -10.313 -1.990 2.022 176 HD2 TYR 22 HD1 TYR 22 -11.126 -5.811 3.710 177 HE1 TYR 22 HE2 TYR 22 -11.480 -0.910 3.900 178 HE2 TYR 22 HE1 TYR 22 -12.305 -4.743 5.578 179 HH TYR 22 HH TYR 22 -13.174 -1.446 5.575 180 H ARG 23 H ARG 23 -12.134 -6.334 0.106 181 HA ARG 23 HA ARG 23 -14.377 -5.198 1.334 182 HB2 ARG 23 2HB ARG 23 -14.170 -4.006 -1.035 183 HB3 ARG 23 1HB ARG 23 -14.951 -5.481 -1.583 184 HG2 ARG 23 2HG ARG 23 -16.612 -3.789 -1.207 185 HG3 ARG 23 1HG ARG 23 -16.795 -5.058 0.004 186 HD2 ARG 23 2HD ARG 23 -15.105 -2.688 0.644 187 HD3 ARG 23 1HD ARG 23 -16.857 -2.508 0.667 188 HE ARG 23 HE ARG 23 -16.448 -4.708 2.193 189 HH11 ARG 23 1HH1 ARG 23 -15.044 -1.502 2.250 190 HH12 ARG 23 2HH1 ARG 23 -14.885 -1.450 3.981 191 HH21 ARG 23 1HH2 ARG 23 -16.262 -4.647 4.472 192 HH22 ARG 23 2HH2 ARG 23 -15.584 -3.244 5.244 193 H GLN 24 H GLN 24 -16.323 -6.592 -0.341 194 HA GLN 24 HA GLN 24 -15.985 -9.171 0.850 195 HB2 GLN 24 2HB GLN 24 -18.116 -8.416 -1.139 196 HB3 GLN 24 1HB GLN 24 -18.204 -9.608 0.151 197 HG2 GLN 24 2HG GLN 24 -18.146 -6.615 0.454 198 HG3 GLN 24 1HG GLN 24 -19.519 -7.685 0.730 199 HE21 GLN 24 1HE2 GLN 24 -19.577 -8.950 2.576 200 HE22 GLN 24 2HE2 GLN 24 -18.549 -8.649 3.932 201 H VAL 25 H VAL 25 -16.009 -7.835 -2.387 202 HA VAL 25 HA VAL 25 -15.559 -8.568 -4.438 203 HB VAL 25 HB VAL 25 -13.515 -9.838 -4.846 204 HG11 VAL 25 1HG1 VAL 25 -13.404 -7.456 -4.482 205 HG12 VAL 25 2HG1 VAL 25 -11.972 -8.239 -3.812 206 HG13 VAL 25 3HG1 VAL 25 -13.266 -7.701 -2.742 207 HG21 VAL 25 3HG2 VAL 25 -13.320 -10.135 -1.849 208 HG22 VAL 25 1HG2 VAL 25 -12.042 -10.508 -3.006 209 HG23 VAL 25 2HG2 VAL 25 -13.540 -11.439 -3.015 210 H LEU 26 H LEU 26 -15.116 -11.670 -2.677 211 HA LEU 26 HA LEU 26 -17.193 -12.768 -4.454 212 HB2 LEU 26 2HB LEU 26 -14.619 -14.064 -3.566 213 HB3 LEU 26 1HB LEU 26 -15.946 -14.957 -4.284 214 HG LEU 26 HG LEU 26 -14.397 -12.743 -5.632 215 HD11 LEU 26 1HD1 LEU 26 -13.070 -14.764 -5.343 216 HD12 LEU 26 2HD1 LEU 26 -13.505 -14.531 -7.037 217 HD13 LEU 26 3HD1 LEU 26 -14.363 -15.727 -6.061 218 HD21 LEU 26 3HD2 LEU 26 -16.560 -14.568 -6.681 219 HD22 LEU 26 1HD2 LEU 26 -15.627 -13.418 -7.641 220 HD23 LEU 26 2HD2 LEU 26 -16.716 -12.838 -6.380 221 H GLY 27 H GLY 27 -16.531 -11.892 -1.421 222 HA2 GLY 27 2HA GLY 27 -17.482 -14.139 0.072 223 HA3 GLY 27 1HA GLY 27 -17.303 -12.492 0.662 224 H ASN 28 H ASN 28 -19.387 -14.700 -1.069 225 HA ASN 28 HA ASN 28 -21.603 -12.844 -1.132 226 HB2 ASN 28 2HB ASN 28 -22.835 -14.679 -2.201 227 HB3 ASN 28 1HB ASN 28 -21.277 -14.432 -2.981 228 HD21 ASN 28 1HD2 ASN 28 -22.979 -16.785 -2.958 229 HD22 ASN 28 2HD2 ASN 28 -22.021 -18.064 -2.289 230 H ASP 29 H ASP 29 -20.270 -14.340 1.330 231 HA ASP 29 HA ASP 29 -22.829 -15.025 2.614 232 HB2 ASP 29 2HB ASP 29 -20.953 -16.802 2.422 233 HB3 ASP 29 1HB ASP 29 -20.120 -15.858 3.652 234 H TYR 30 H TYR 30 -22.098 -14.825 5.246 235 HA TYR 30 HA TYR 30 -21.588 -11.930 5.479 236 HB2 TYR 30 2HB TYR 30 -22.976 -12.297 7.673 237 HB3 TYR 30 1HB TYR 30 -23.808 -12.169 6.126 238 HD1 TYR 30 HD2 TYR 30 -22.677 -14.537 8.732 239 HD2 TYR 30 HD1 TYR 30 -25.029 -14.002 5.226 240 HE1 TYR 30 HE2 TYR 30 -23.719 -16.732 9.098 241 HE2 TYR 30 HE1 TYR 30 -26.071 -16.197 5.584 242 HH TYR 30 HH TYR 30 -25.438 -18.350 6.747 243 H VAL 31 H VAL 31 -20.143 -14.796 5.983 244 HA VAL 31 HA VAL 31 -19.044 -14.183 8.599 245 HB VAL 31 HB VAL 31 -19.555 -16.498 8.234 246 HG11 VAL 31 1HG1 VAL 31 -18.458 -17.861 6.527 247 HG12 VAL 31 2HG1 VAL 31 -17.674 -16.419 5.880 248 HG13 VAL 31 3HG1 VAL 31 -19.428 -16.576 5.806 249 HG21 VAL 31 3HG2 VAL 31 -17.393 -17.538 8.720 250 HG22 VAL 31 1HG2 VAL 31 -17.609 -16.032 9.610 251 HG23 VAL 31 2HG2 VAL 31 -16.572 -16.071 8.186 252 H MET 32 H MET 32 -17.807 -12.385 8.358 253 HA MET 32 HA MET 32 -15.342 -12.753 6.783 254 HB2 MET 32 2HB MET 32 -16.869 -10.180 7.245 255 HB3 MET 32 1HB MET 32 -15.275 -10.273 6.511 256 HG2 MET 32 2HG MET 32 -17.758 -11.564 5.401 257 HG3 MET 32 1HG MET 32 -17.106 -10.013 4.879 258 HE1 MET 32 3HE MET 32 -14.808 -9.711 3.630 259 HE2 MET 32 1HE MET 32 -13.697 -11.030 3.263 260 HE3 MET 32 2HE MET 32 -13.957 -10.533 4.936 261 H ALA 33 H ALA 33 -16.769 -10.803 9.387 262 HA ALA 33 HA ALA 33 -16.090 -10.267 11.476 263 HB1 ALA 33 3HB ALA 33 -15.883 -12.673 11.793 264 HB2 ALA 33 1HB ALA 33 -14.639 -11.808 12.695 265 HB3 ALA 33 2HB ALA 33 -14.228 -12.622 11.185 266 H SER 34 H SER 34 -13.894 -9.993 12.831 267 HA SER 34 HA SER 34 -11.959 -8.896 13.169 268 HB2 SER 34 2HB SER 34 -11.075 -10.350 11.307 269 HB3 SER 34 1HB SER 34 -11.433 -9.028 10.196 270 HG SER 34 HG SER 34 -9.942 -8.449 12.491 271 H GLU 35 H GLU 35 -12.412 -6.933 13.840 272 HA GLU 35 HA GLU 35 -13.168 -4.898 11.850 273 HB2 GLU 35 2HB GLU 35 -13.696 -4.834 14.825 274 HB3 GLU 35 1HB GLU 35 -14.292 -3.697 13.623 275 HG2 GLU 35 2HG GLU 35 -15.661 -5.414 12.625 276 HG3 GLU 35 1HG GLU 35 -15.011 -6.616 13.741 277 H ARG 36 H ARG 36 -11.037 -4.410 11.320 278 HA ARG 36 HA ARG 36 -9.610 -2.872 13.389 279 HB2 ARG 36 2HB ARG 36 -8.451 -4.779 11.351 280 HB3 ARG 36 1HB ARG 36 -7.478 -3.595 12.213 281 HG2 ARG 36 2HG ARG 36 -9.110 -5.763 13.523 282 HG3 ARG 36 1HG ARG 36 -7.371 -5.842 13.215 283 HD2 ARG 36 2HD ARG 36 -6.934 -4.053 14.701 284 HD3 ARG 36 1HD ARG 36 -8.641 -3.623 14.802 285 HE ARG 36 HE ARG 36 -8.382 -6.235 15.741 286 HH11 ARG 36 1HH1 ARG 36 -7.176 -3.057 16.607 287 HH12 ARG 36 2HH1 ARG 36 -7.266 -3.355 18.322 288 HH21 ARG 36 1HH2 ARG 36 -8.474 -6.636 17.983 289 HH22 ARG 36 2HH2 ARG 36 -7.979 -5.405 19.110 290 H LEU 37 H LEU 37 -10.545 -3.266 10.054 291 HA LEU 37 HA LEU 37 -9.118 -0.859 9.262 292 HB2 LEU 37 2HB LEU 37 -10.819 -2.753 7.647 293 HB3 LEU 37 1HB LEU 37 -9.871 -1.426 6.996 294 HG LEU 37 HG LEU 37 -8.797 -3.878 8.381 295 HD11 LEU 37 1HD1 LEU 37 -9.560 -4.279 6.106 296 HD12 LEU 37 2HD1 LEU 37 -7.802 -4.368 6.218 297 HD13 LEU 37 3HD1 LEU 37 -8.570 -2.937 5.533 298 HD21 LEU 37 3HD2 LEU 37 -6.589 -2.981 7.859 299 HD22 LEU 37 1HD2 LEU 37 -7.475 -1.918 8.953 300 HD23 LEU 37 2HD2 LEU 37 -7.332 -1.503 7.244 301 H VAL 38 H VAL 38 -12.052 -1.570 10.617 302 HA VAL 38 HA VAL 38 -13.800 0.237 9.378 303 HB VAL 38 HB VAL 38 -13.639 -0.418 12.330 304 HG11 VAL 38 1HG1 VAL 38 -15.928 0.638 10.675 305 HG12 VAL 38 2HG1 VAL 38 -15.014 1.539 11.886 306 HG13 VAL 38 3HG1 VAL 38 -16.017 0.173 12.374 307 HG21 VAL 38 3HG2 VAL 38 -15.325 -2.134 11.856 308 HG22 VAL 38 1HG2 VAL 38 -13.819 -2.442 10.991 309 HG23 VAL 38 2HG2 VAL 38 -15.207 -1.768 10.135 310 H SER 39 H SER 39 -11.342 0.644 11.856 311 HA SER 39 HA SER 39 -11.719 3.357 12.423 312 HB2 SER 39 2HB SER 39 -9.023 2.012 12.394 313 HB3 SER 39 1HB SER 39 -9.635 3.230 13.517 314 HG SER 39 HG SER 39 -10.538 1.716 14.678 315 H ALA 40 H ALA 40 -9.807 1.700 9.961 316 HA ALA 40 HA ALA 40 -8.460 3.944 8.934 317 HB1 ALA 40 3HB ALA 40 -9.210 1.381 7.527 318 HB2 ALA 40 1HB ALA 40 -7.748 1.652 8.474 319 HB3 ALA 40 2HB ALA 40 -8.009 2.547 6.976 320 H GLU 41 H GLU 41 -11.495 2.366 7.943 321 HA GLU 41 HA GLU 41 -12.109 4.045 5.789 322 HB2 GLU 41 2HB GLU 41 -14.001 2.666 7.708 323 HB3 GLU 41 1HB GLU 41 -14.468 3.372 6.170 324 HG2 GLU 41 2HG GLU 41 -12.985 1.780 5.017 325 HG3 GLU 41 1HG GLU 41 -12.601 1.046 6.574 326 H SER 42 H SER 42 -12.906 4.319 9.227 327 HA SER 42 HA SER 42 -14.443 6.662 9.069 328 HB2 SER 42 2HB SER 42 -14.317 5.123 11.045 329 HB3 SER 42 1HB SER 42 -12.717 5.773 11.396 330 HG SER 42 HG SER 42 -15.124 6.771 12.036 331 H LEU 43 H LEU 43 -10.973 6.209 9.743 332 HA LEU 43 HA LEU 43 -10.367 8.932 10.115 333 HB2 LEU 43 2HB LEU 43 -8.611 6.652 9.209 334 HB3 LEU 43 1HB LEU 43 -8.012 8.239 9.648 335 HG LEU 43 HG LEU 43 -9.468 6.349 11.501 336 HD11 LEU 43 1HD1 LEU 43 -7.305 6.075 12.589 337 HD12 LEU 43 2HD1 LEU 43 -6.552 7.107 11.375 338 HD13 LEU 43 3HD1 LEU 43 -7.236 5.552 10.906 339 HD21 LEU 43 3HD2 LEU 43 -9.857 8.699 12.049 340 HD22 LEU 43 1HD2 LEU 43 -8.117 8.991 12.052 341 HD23 LEU 43 2HD2 LEU 43 -8.834 7.921 13.257 342 H LEU 44 H LEU 44 -10.418 6.932 7.201 343 HA LEU 44 HA LEU 44 -9.290 8.931 5.513 344 HB2 LEU 44 2HB LEU 44 -9.289 6.504 4.982 345 HB3 LEU 44 1HB LEU 44 -11.024 6.583 4.740 346 HG LEU 44 HG LEU 44 -10.652 8.200 2.888 347 HD11 LEU 44 1HD1 LEU 44 -8.391 8.424 1.967 348 HD12 LEU 44 2HD1 LEU 44 -7.749 7.540 3.353 349 HD13 LEU 44 3HD1 LEU 44 -8.520 9.110 3.587 350 HD21 LEU 44 3HD2 LEU 44 -10.960 5.832 2.420 351 HD22 LEU 44 1HD2 LEU 44 -9.229 5.557 2.616 352 HD23 LEU 44 2HD2 LEU 44 -9.818 6.552 1.285 353 H ARG 45 H ARG 45 -12.599 7.961 6.314 354 HA ARG 45 HA ARG 45 -13.914 9.750 4.566 355 HB2 ARG 45 2HB ARG 45 -15.081 7.885 5.645 356 HB3 ARG 45 1HB ARG 45 -14.832 8.618 7.222 357 HG2 ARG 45 2HG ARG 45 -16.241 10.509 6.559 358 HG3 ARG 45 1HG ARG 45 -16.499 9.756 4.985 359 HD2 ARG 45 2HD ARG 45 -17.242 8.509 7.629 360 HD3 ARG 45 1HD ARG 45 -18.361 9.387 6.587 361 HE ARG 45 HE ARG 45 -17.986 7.648 4.898 362 HH11 ARG 45 1HH1 ARG 45 -17.137 6.923 8.225 363 HH12 ARG 45 2HH1 ARG 45 -17.296 5.206 8.026 364 HH21 ARG 45 1HH2 ARG 45 -18.194 5.397 4.639 365 HH22 ARG 45 2HH2 ARG 45 -17.877 4.333 5.982 366 H ASN 46 H ASN 46 -12.605 10.092 7.800 367 HA ASN 46 HA ASN 46 -13.633 12.740 8.212 368 HB2 ASN 46 2HB ASN 46 -11.585 11.051 9.634 369 HB3 ASN 46 1HB ASN 46 -11.822 12.739 10.063 370 HD21 ASN 46 1HD2 ASN 46 -14.430 10.664 9.023 371 HD22 ASN 46 2HD2 ASN 46 -15.225 10.570 10.557 372 H GLY 47 H GLY 47 -11.031 11.431 6.441 373 HA2 GLY 47 2HA GLY 47 -9.418 12.454 5.158 374 HA3 GLY 47 1HA GLY 47 -10.145 14.000 5.573 375 H LYS 48 H LYS 48 -8.924 11.629 7.863 376 HA LYS 48 HA LYS 48 -7.162 13.689 8.949 377 HB2 LYS 48 2HB LYS 48 -7.960 10.987 10.045 378 HB3 LYS 48 1HB LYS 48 -6.934 12.149 10.877 379 HG2 LYS 48 2HG LYS 48 -8.808 13.771 10.800 380 HG3 LYS 48 1HG LYS 48 -9.820 12.498 10.120 381 HD2 LYS 48 2HD LYS 48 -9.483 11.147 12.114 382 HD3 LYS 48 1HD LYS 48 -8.421 12.385 12.789 383 HE2 LYS 48 2HE LYS 48 -11.355 12.674 12.153 384 HE3 LYS 48 1HE LYS 48 -10.630 12.575 13.758 385 HZ1 LYS 48 3HZ LYS 48 -11.143 14.857 13.171 386 HZ2 LYS 48 1HZ LYS 48 -10.179 14.752 11.780 387 HZ3 LYS 48 2HZ LYS 48 -9.466 14.656 13.318 388 H ILE 49 H ILE 49 -7.050 10.586 7.371 389 HA ILE 49 HA ILE 49 -4.110 10.711 7.452 390 HB ILE 49 HB ILE 49 -4.075 8.267 7.136 391 HG12 ILE 49 2HG1 ILE 49 -7.059 8.408 7.603 392 HG13 ILE 49 1HG1 ILE 49 -6.302 8.087 6.046 393 HG21 ILE 49 1HG2 ILE 49 -5.653 9.149 9.551 394 HG22 ILE 49 2HG2 ILE 49 -3.898 9.190 9.386 395 HG23 ILE 49 3HG2 ILE 49 -4.747 7.644 9.403 396 HD11 ILE 49 3HD1 ILE 49 -5.315 6.045 6.956 397 HD12 ILE 49 1HD1 ILE 49 -7.074 6.038 7.083 398 HD13 ILE 49 2HD1 ILE 49 -6.088 6.368 8.508 399 H THR 50 H THR 50 -3.028 9.835 5.562 400 HA THR 50 HA THR 50 -4.380 10.605 3.114 401 HB THR 50 HB THR 50 -2.096 9.942 2.106 402 HG1 THR 50 HG1 THR 50 -1.470 9.958 4.898 403 HG21 THR 50 3HG2 THR 50 -2.830 12.265 2.500 404 HG22 THR 50 1HG2 THR 50 -1.100 12.058 2.770 405 HG23 THR 50 2HG2 THR 50 -2.198 12.168 4.145 406 H VAL 51 H VAL 51 -3.988 9.079 1.151 407 HA VAL 51 HA VAL 51 -5.422 6.700 1.781 408 HB VAL 51 HB VAL 51 -4.166 7.549 -0.839 409 HG11 VAL 51 1HG1 VAL 51 -5.673 5.892 -1.865 410 HG12 VAL 51 2HG1 VAL 51 -6.155 5.351 -0.256 411 HG13 VAL 51 3HG1 VAL 51 -4.490 5.137 -0.797 412 HG21 VAL 51 3HG2 VAL 51 -6.436 8.199 -1.455 413 HG22 VAL 51 1HG2 VAL 51 -5.905 9.072 -0.017 414 HG23 VAL 51 2HG2 VAL 51 -7.019 7.715 0.137 415 H ARG 52 H ARG 52 -2.042 7.434 1.065 416 HA ARG 52 HA ARG 52 -1.032 4.844 0.889 417 HB2 ARG 52 2HB ARG 52 1.083 5.744 1.808 418 HB3 ARG 52 1HB ARG 52 0.414 6.778 0.552 419 HG2 ARG 52 2HG ARG 52 0.035 8.489 1.970 420 HG3 ARG 52 1HG ARG 52 -0.362 7.430 3.321 421 HD2 ARG 52 2HD ARG 52 1.691 8.686 3.727 422 HD3 ARG 52 1HD ARG 52 1.989 6.953 3.666 423 HE ARG 52 HE ARG 52 2.588 7.616 1.183 424 HH11 ARG 52 1HH1 ARG 52 3.364 9.285 4.156 425 HH12 ARG 52 2HH1 ARG 52 4.896 9.870 3.588 426 HH21 ARG 52 1HH2 ARG 52 4.619 8.361 0.426 427 HH22 ARG 52 2HH2 ARG 52 5.611 9.329 1.473 428 H GLU 53 H GLU 53 -2.082 6.678 3.686 429 HA GLU 53 HA GLU 53 -1.057 4.734 5.562 430 HB2 GLU 53 2HB GLU 53 -2.792 7.167 6.009 431 HB3 GLU 53 1HB GLU 53 -2.027 6.207 7.273 432 HG2 GLU 53 2HG GLU 53 0.161 6.821 6.469 433 HG3 GLU 53 1HG GLU 53 -0.550 7.685 5.108 434 H PHE 54 H PHE 54 -4.082 5.514 4.010 435 HA PHE 54 HA PHE 54 -5.761 3.873 5.578 436 HB2 PHE 54 2HB PHE 54 -6.695 5.471 3.991 437 HB3 PHE 54 1HB PHE 54 -5.943 4.620 2.647 438 HD1 PHE 54 HD1 PHE 54 -8.407 4.149 5.394 439 HD2 PHE 54 HD2 PHE 54 -7.120 2.976 1.511 440 HE1 PHE 54 HE1 PHE 54 -10.425 2.764 5.145 441 HE2 PHE 54 HE2 PHE 54 -9.135 1.588 1.260 442 HZ PHE 54 HZ PHE 54 -10.791 1.481 3.077 443 H VAL 55 H VAL 55 -4.039 3.231 2.533 444 HA VAL 55 HA VAL 55 -4.586 0.455 2.463 445 HB VAL 55 HB VAL 55 -2.240 1.928 1.246 446 HG11 VAL 55 1HG1 VAL 55 -3.445 -0.746 0.539 447 HG12 VAL 55 2HG1 VAL 55 -1.881 -0.478 1.307 448 HG13 VAL 55 3HG1 VAL 55 -2.155 0.067 -0.346 449 HG21 VAL 55 3HG2 VAL 55 -4.323 2.909 0.502 450 HG22 VAL 55 1HG2 VAL 55 -4.963 1.315 0.098 451 HG23 VAL 55 2HG2 VAL 55 -3.602 1.975 -0.811 452 H ARG 56 H ARG 56 -2.120 2.393 3.989 453 HA ARG 56 HA ARG 56 -0.236 0.489 4.715 454 HB2 ARG 56 2HB ARG 56 -0.232 3.040 5.038 455 HB3 ARG 56 1HB ARG 56 -1.121 2.731 6.519 456 HG2 ARG 56 2HG ARG 56 0.748 1.373 7.341 457 HG3 ARG 56 1HG ARG 56 1.640 1.739 5.861 458 HD2 ARG 56 2HD ARG 56 1.162 4.207 6.492 459 HD3 ARG 56 1HD ARG 56 0.856 3.563 8.102 460 HE ARG 56 HE ARG 56 3.343 2.610 7.138 461 HH11 ARG 56 1HH1 ARG 56 1.804 5.494 8.404 462 HH12 ARG 56 2HH1 ARG 56 3.293 6.209 8.927 463 HH21 ARG 56 1HH2 ARG 56 5.298 3.539 7.814 464 HH22 ARG 56 2HH2 ARG 56 5.286 5.085 8.625 465 H ALA 57 H ALA 57 -3.123 1.560 6.498 466 HA ALA 57 HA ALA 57 -2.838 -0.185 8.678 467 HB1 ALA 57 3HB ALA 57 -5.353 1.023 7.536 468 HB2 ALA 57 1HB ALA 57 -4.300 1.763 8.742 469 HB3 ALA 57 2HB ALA 57 -5.198 0.294 9.134 470 H VAL 58 H VAL 58 -4.588 -0.517 5.625 471 HA VAL 58 HA VAL 58 -5.817 -2.988 6.176 472 HB VAL 58 HB VAL 58 -4.976 -1.921 3.472 473 HG11 VAL 58 1HG1 VAL 58 -5.569 -4.280 3.410 474 HG12 VAL 58 2HG1 VAL 58 -6.795 -3.304 2.600 475 HG13 VAL 58 3HG1 VAL 58 -7.097 -3.931 4.221 476 HG21 VAL 58 3HG2 VAL 58 -7.550 -1.520 4.995 477 HG22 VAL 58 1HG2 VAL 58 -7.249 -1.004 3.336 478 HG23 VAL 58 2HG2 VAL 58 -6.332 -0.290 4.662 479 H ALA 59 H ALA 59 -2.685 -2.161 4.807 480 HA ALA 59 HA ALA 59 -2.025 -4.859 4.106 481 HB1 ALA 59 3HB ALA 59 0.165 -3.960 3.544 482 HB2 ALA 59 1HB ALA 59 -0.249 -2.433 4.323 483 HB3 ALA 59 2HB ALA 59 -1.117 -2.949 2.878 484 H LYS 60 H LYS 60 -1.661 -2.896 6.954 485 HA LYS 60 HA LYS 60 0.221 -4.820 8.093 486 HB2 LYS 60 2HB LYS 60 -0.741 -2.152 9.130 487 HB3 LYS 60 1HB LYS 60 0.357 -3.215 10.002 488 HG2 LYS 60 2HG LYS 60 1.865 -3.095 7.970 489 HG3 LYS 60 1HG LYS 60 0.839 -1.773 7.417 490 HD2 LYS 60 2HD LYS 60 1.326 -0.552 9.498 491 HD3 LYS 60 1HD LYS 60 2.383 -1.869 10.007 492 HE2 LYS 60 2HE LYS 60 3.701 -1.493 7.904 493 HE3 LYS 60 1HE LYS 60 2.734 -0.044 7.638 494 HZ1 LYS 60 3HZ LYS 60 4.751 -0.579 9.720 495 HZ2 LYS 60 1HZ LYS 60 3.518 0.551 10.016 496 HZ3 LYS 60 2HZ LYS 60 4.575 0.775 8.709 497 H SER 61 H SER 61 -2.810 -5.067 7.617 498 HA SER 61 HA SER 61 -3.572 -5.918 10.311 499 HB2 SER 61 2HB SER 61 -5.147 -5.750 7.731 500 HB3 SER 61 1HB SER 61 -5.798 -6.355 9.255 501 HG SER 61 HG SER 61 -4.749 -3.752 8.787 502 H GLU 62 H GLU 62 -5.198 -8.101 9.706 503 HA GLU 62 HA GLU 62 -3.156 -10.014 8.835 504 HB2 GLU 62 2HB GLU 62 -5.594 -10.578 10.527 505 HB3 GLU 62 1HB GLU 62 -4.268 -11.681 10.190 506 HG2 GLU 62 2HG GLU 62 -2.753 -10.041 11.349 507 HG3 GLU 62 1HG GLU 62 -4.204 -9.184 11.860 508 H LEU 63 H LEU 63 -6.418 -11.087 9.127 509 HA LEU 63 HA LEU 63 -7.958 -11.863 7.672 510 HB2 LEU 63 2HB LEU 63 -7.941 -9.524 6.844 511 HB3 LEU 63 1HB LEU 63 -6.714 -9.973 5.675 512 HG LEU 63 HG LEU 63 -8.295 -11.513 4.594 513 HD11 LEU 63 1HD1 LEU 63 -10.654 -11.493 5.235 514 HD12 LEU 63 2HD1 LEU 63 -10.274 -10.457 6.609 515 HD13 LEU 63 3HD1 LEU 63 -9.635 -12.099 6.541 516 HD21 LEU 63 3HD2 LEU 63 -9.403 -8.729 4.955 517 HD22 LEU 63 1HD2 LEU 63 -9.756 -9.828 3.622 518 HD23 LEU 63 2HD2 LEU 63 -8.125 -9.189 3.828 519 H TYR 64 H TYR 64 -5.234 -11.320 5.422 520 HA TYR 64 HA TYR 64 -5.325 -14.187 4.762 521 HB2 TYR 64 2HB TYR 64 -4.047 -11.910 3.229 522 HB3 TYR 64 1HB TYR 64 -4.103 -13.590 2.714 523 HD1 TYR 64 HD2 TYR 64 -6.671 -14.549 2.782 524 HD2 TYR 64 HD1 TYR 64 -5.506 -10.505 2.163 525 HE1 TYR 64 HE2 TYR 64 -8.791 -14.121 1.613 526 HE2 TYR 64 HE1 TYR 64 -7.624 -10.067 0.995 527 HH TYR 64 HH TYR 64 -10.251 -12.160 1.102 528 H LYS 65 H LYS 65 -3.954 -15.239 6.104 529 HA LYS 65 HA LYS 65 -2.067 -15.833 7.235 530 HB2 LYS 65 2HB LYS 65 -0.763 -13.846 5.384 531 HB3 LYS 65 1HB LYS 65 0.125 -14.850 6.526 532 HG2 LYS 65 2HG LYS 65 -0.699 -16.858 5.437 533 HG3 LYS 65 1HG LYS 65 -1.647 -15.878 4.319 534 HD2 LYS 65 2HD LYS 65 0.398 -14.910 3.414 535 HD3 LYS 65 1HD LYS 65 1.362 -15.842 4.564 536 HE2 LYS 65 2HE LYS 65 1.385 -16.938 2.415 537 HE3 LYS 65 1HE LYS 65 0.482 -17.921 3.565 538 HZ1 LYS 65 3HZ LYS 65 -0.704 -17.864 1.513 539 HZ2 LYS 65 1HZ LYS 65 -0.645 -16.168 1.448 540 HZ3 LYS 65 2HZ LYS 65 -1.577 -16.943 2.637 541 H GLU 66 H GLU 66 -1.290 -15.305 9.238 542 HA GLU 66 HA GLU 66 -2.526 -13.129 10.510 543 HB2 GLU 66 2HB GLU 66 -1.874 -15.176 11.706 544 HB3 GLU 66 1HB GLU 66 -0.178 -14.762 11.488 545 HG2 GLU 66 2HG GLU 66 -0.440 -12.792 12.854 546 HG3 GLU 66 1HG GLU 66 -2.170 -13.088 12.998 547 H LYS 67 H LYS 67 -2.097 -11.105 10.102 548 HA LYS 67 HA LYS 67 -1.041 -9.127 9.818 549 HB2 LYS 67 2HB LYS 67 1.269 -10.534 11.183 550 HB3 LYS 67 1HB LYS 67 1.134 -8.795 10.934 551 HG2 LYS 67 2HG LYS 67 -0.829 -8.715 12.348 552 HG3 LYS 67 1HG LYS 67 -0.776 -10.467 12.554 553 HD2 LYS 67 2HD LYS 67 1.433 -10.245 13.622 554 HD3 LYS 67 1HD LYS 67 1.308 -8.489 13.470 555 HE2 LYS 67 2HE LYS 67 0.674 -9.194 15.706 556 HE3 LYS 67 1HE LYS 67 -0.713 -8.520 14.852 557 HZ1 LYS 67 3HZ LYS 67 -0.133 -11.415 15.203 558 HZ2 LYS 67 1HZ LYS 67 -1.474 -10.771 14.380 559 HZ3 LYS 67 2HZ LYS 67 -1.304 -10.531 16.047 560 H PHE 68 H PHE 68 -1.134 -10.873 7.713 561 HA PHE 68 HA PHE 68 -0.329 -11.338 5.673 562 HB2 PHE 68 2HB PHE 68 1.236 -8.873 6.352 563 HB3 PHE 68 1HB PHE 68 1.611 -9.766 4.880 564 HD1 PHE 68 HD2 PHE 68 -1.815 -9.939 5.941 565 HD2 PHE 68 HD1 PHE 68 0.975 -7.642 3.698 566 HE1 PHE 68 HE2 PHE 68 -3.674 -8.830 4.777 567 HE2 PHE 68 HE1 PHE 68 -0.878 -6.527 2.529 568 HZ PHE 68 HZ PHE 68 -3.207 -7.120 3.066 569 H LEU 69 H LEU 69 0.625 -12.688 7.959 570 HA LEU 69 HA LEU 69 1.830 -14.561 8.222 571 HB2 LEU 69 2HB LEU 69 1.790 -14.919 5.874 572 HB3 LEU 69 1HB LEU 69 3.121 -13.799 5.630 573 HG LEU 69 HG LEU 69 3.581 -16.331 5.487 574 HD11 LEU 69 1HD1 LEU 69 5.361 -14.694 5.475 575 HD12 LEU 69 2HD1 LEU 69 5.817 -16.076 6.472 576 HD13 LEU 69 3HD1 LEU 69 5.297 -14.573 7.234 577 HD21 LEU 69 3HD2 LEU 69 4.115 -17.426 7.586 578 HD22 LEU 69 1HD2 LEU 69 2.416 -16.959 7.537 579 HD23 LEU 69 2HD2 LEU 69 3.567 -16.009 8.481 580 H TYR 70 H TYR 70 2.880 -14.435 9.975 581 HA TYR 70 HA TYR 70 4.665 -12.379 10.673 582 HB2 TYR 70 2HB TYR 70 5.143 -14.059 12.640 583 HB3 TYR 70 1HB TYR 70 3.591 -13.239 12.514 584 HD1 TYR 70 HD1 TYR 70 5.309 -16.449 11.713 585 HD2 TYR 70 HD2 TYR 70 1.608 -14.460 12.375 586 HE1 TYR 70 HE1 TYR 70 4.146 -18.617 11.696 587 HE2 TYR 70 HE2 TYR 70 0.436 -16.620 12.359 588 HH TYR 70 HH TYR 70 0.656 -18.822 11.683 589 H GLY 71 H GLY 71 5.229 -15.511 9.238 590 HA2 GLY 71 2HA GLY 71 7.675 -15.031 8.224 591 HA3 GLY 71 1HA GLY 71 8.051 -15.450 9.885 592 H ASN 72 H ASN 72 7.410 -16.588 6.784 593 HA ASN 72 HA ASN 72 8.469 -19.106 7.238 594 HB2 ASN 72 2HB ASN 72 6.307 -19.560 8.432 595 HB3 ASN 72 1HB ASN 72 5.459 -19.255 6.917 596 HD21 ASN 72 1HD2 ASN 72 4.643 -21.374 6.896 597 HD22 ASN 72 2HD2 ASN 72 5.645 -22.719 6.467 598 H PHE 73 H PHE 73 9.540 -18.827 5.369 599 HA PHE 73 HA PHE 73 10.021 -18.493 3.190 600 HB2 PHE 73 2HB PHE 73 7.250 -19.650 2.816 601 HB3 PHE 73 1HB PHE 73 8.376 -19.341 1.499 602 HD1 PHE 73 HD2 PHE 73 10.568 -20.559 1.464 603 HD2 PHE 73 HD1 PHE 73 7.409 -21.603 4.116 604 HE1 PHE 73 HE2 PHE 73 11.606 -22.760 1.827 605 HE2 PHE 73 HE1 PHE 73 8.442 -23.805 4.484 606 HZ PHE 73 HZ PHE 73 10.542 -24.386 3.339 607 H GLN 74 H GLN 74 10.133 -16.299 3.646 608 HA GLN 74 HA GLN 74 7.982 -14.500 3.653 609 HB2 GLN 74 2HB GLN 74 10.205 -14.081 4.657 610 HB3 GLN 74 1HB GLN 74 10.894 -13.966 3.046 611 HG2 GLN 74 2HG GLN 74 10.542 -11.771 4.019 612 HG3 GLN 74 1HG GLN 74 9.544 -12.003 2.585 613 HE21 GLN 74 1HE2 GLN 74 8.161 -10.340 3.284 614 HE22 GLN 74 2HE2 GLN 74 7.009 -10.608 4.546 615 H THR 75 H THR 75 9.773 -15.883 1.046 616 HA THR 75 HA THR 75 9.619 -13.939 -0.915 617 HB THR 75 HB THR 75 9.624 -15.917 -2.527 618 HG1 THR 75 HG1 THR 75 9.228 -17.828 -1.712 619 HG21 THR 75 3HG2 THR 75 11.676 -14.822 -1.746 620 HG22 THR 75 1HG2 THR 75 11.910 -16.563 -1.913 621 HG23 THR 75 2HG2 THR 75 11.682 -15.852 -0.314 622 H ARG 76 H ARG 76 7.167 -16.294 0.058 623 HA ARG 76 HA ARG 76 5.356 -15.757 -2.058 624 HB2 ARG 76 2HB ARG 76 4.935 -16.935 0.688 625 HB3 ARG 76 1HB ARG 76 3.673 -16.842 -0.532 626 HG2 ARG 76 2HG ARG 76 4.937 -18.268 -2.008 627 HG3 ARG 76 1HG ARG 76 6.284 -18.296 -0.867 628 HD2 ARG 76 2HD ARG 76 3.508 -19.343 -0.333 629 HD3 ARG 76 1HD ARG 76 4.914 -20.330 -0.727 630 HE ARG 76 HE ARG 76 5.565 -18.776 1.493 631 HH11 ARG 76 1HH1 ARG 76 3.343 -21.343 0.657 632 HH12 ARG 76 2HH1 ARG 76 3.318 -22.011 2.259 633 HH21 ARG 76 1HH2 ARG 76 5.516 -19.646 3.618 634 HH22 ARG 76 2HH2 ARG 76 4.539 -21.055 3.930 635 H VAL 77 H VAL 77 5.819 -14.384 1.136 636 HA VAL 77 HA VAL 77 3.442 -12.781 1.054 637 HB VAL 77 HB VAL 77 5.845 -12.700 2.891 638 HG11 VAL 77 1HG1 VAL 77 4.860 -10.501 2.860 639 HG12 VAL 77 2HG1 VAL 77 4.427 -11.314 4.366 640 HG13 VAL 77 3HG1 VAL 77 3.247 -11.186 3.062 641 HG21 VAL 77 3HG2 VAL 77 3.083 -13.869 3.125 642 HG22 VAL 77 1HG2 VAL 77 4.144 -13.630 4.517 643 HG23 VAL 77 2HG2 VAL 77 4.631 -14.709 3.205 644 H ILE 78 H ILE 78 6.831 -12.356 0.230 645 HA ILE 78 HA ILE 78 6.905 -9.606 -0.214 646 HB ILE 78 HB ILE 78 8.234 -11.787 -1.839 647 HG12 ILE 78 2HG1 ILE 78 9.301 -10.103 0.440 648 HG13 ILE 78 1HG1 ILE 78 8.804 -11.788 0.572 649 HG21 ILE 78 1HG2 ILE 78 9.806 -10.059 -2.562 650 HG22 ILE 78 2HG2 ILE 78 8.864 -8.840 -1.702 651 HG23 ILE 78 3HG2 ILE 78 8.159 -9.693 -3.076 652 HD11 ILE 78 3HD1 ILE 78 11.203 -11.634 0.425 653 HD12 ILE 78 1HD1 ILE 78 11.084 -10.720 -1.079 654 HD13 ILE 78 2HD1 ILE 78 10.565 -12.404 -1.025 655 H GLU 79 H GLU 79 5.931 -12.214 -2.417 656 HA GLU 79 HA GLU 79 5.084 -10.608 -4.551 657 HB2 GLU 79 2HB GLU 79 4.285 -13.347 -3.620 658 HB3 GLU 79 1HB GLU 79 3.495 -12.595 -4.995 659 HG2 GLU 79 2HG GLU 79 5.957 -12.276 -5.832 660 HG3 GLU 79 1HG GLU 79 6.269 -13.617 -4.723 661 H LEU 80 H LEU 80 3.360 -11.806 -1.725 662 HA LEU 80 HA LEU 80 0.786 -10.969 -2.427 663 HB2 LEU 80 2HB LEU 80 1.414 -12.566 -0.609 664 HB3 LEU 80 1HB LEU 80 1.972 -11.210 0.343 665 HG LEU 80 HG LEU 80 -0.333 -12.199 0.876 666 HD11 LEU 80 1HD1 LEU 80 -0.116 -9.241 0.378 667 HD12 LEU 80 2HD1 LEU 80 0.496 -10.096 1.794 668 HD13 LEU 80 3HD1 LEU 80 -1.239 -10.037 1.480 669 HD21 LEU 80 3HD2 LEU 80 -2.189 -11.250 -0.433 670 HD22 LEU 80 1HD2 LEU 80 -1.197 -12.365 -1.374 671 HD23 LEU 80 2HD2 LEU 80 -1.023 -10.625 -1.597 672 H ASN 81 H ASN 81 3.244 -9.355 -0.418 673 HA ASN 81 HA ASN 81 1.777 -7.005 0.039 674 HB2 ASN 81 2HB ASN 81 4.763 -7.477 0.012 675 HB3 ASN 81 1HB ASN 81 4.021 -5.959 0.510 676 HD21 ASN 81 1HD2 ASN 81 5.662 -7.609 2.143 677 HD22 ASN 81 2HD2 ASN 81 4.677 -8.169 3.453 678 H TYR 82 H TYR 82 4.124 -7.828 -2.485 679 HA TYR 82 HA TYR 82 4.195 -5.342 -3.738 680 HB2 TYR 82 2HB TYR 82 4.975 -8.069 -4.422 681 HB3 TYR 82 1HB TYR 82 4.495 -7.116 -5.823 682 HD1 TYR 82 HD2 TYR 82 5.422 -4.427 -4.643 683 HD2 TYR 82 HD1 TYR 82 7.295 -8.229 -4.996 684 HE1 TYR 82 HE2 TYR 82 7.617 -3.332 -4.685 685 HE2 TYR 82 HE1 TYR 82 9.500 -7.141 -5.038 686 HH TYR 82 HH TYR 82 10.329 -4.726 -5.761 687 H LYS 83 H LYS 83 1.951 -8.042 -4.215 688 HA LYS 83 HA LYS 83 0.666 -6.839 -6.457 689 HB2 LYS 83 2HB LYS 83 -0.228 -9.077 -4.640 690 HB3 LYS 83 1HB LYS 83 -1.094 -8.576 -6.085 691 HG2 LYS 83 2HG LYS 83 0.953 -9.099 -7.409 692 HG3 LYS 83 1HG LYS 83 1.671 -9.757 -5.935 693 HD2 LYS 83 2HD LYS 83 -0.271 -11.318 -5.769 694 HD3 LYS 83 1HD LYS 83 -0.820 -10.730 -7.340 695 HE2 LYS 83 2HE LYS 83 0.393 -12.780 -7.660 696 HE3 LYS 83 1HE LYS 83 1.348 -11.447 -8.308 697 HZ1 LYS 83 3HZ LYS 83 2.752 -12.929 -7.048 698 HZ2 LYS 83 1HZ LYS 83 1.747 -12.785 -5.683 699 HZ3 LYS 83 2HZ LYS 83 2.626 -11.449 -6.236 700 H HIS 84 H HIS 84 0.268 -6.517 -3.016 701 HA HIS 84 HA HIS 84 -2.357 -5.284 -3.392 702 HB2 HIS 84 2HB HIS 84 -1.931 -6.921 -1.518 703 HB3 HIS 84 1HB HIS 84 -0.906 -5.695 -0.776 704 HD1 HIS 84 HD1 HIS 84 -2.178 -4.683 1.102 705 HD2 HIS 84 HD2 HIS 84 -4.595 -5.387 -2.211 706 HE1 HIS 84 HE1 HIS 84 -4.452 -3.790 1.718 707 HE2 HIS 84 HE2 HIS 84 -5.896 -4.193 -0.317 708 H LEU 85 H LEU 85 0.926 -4.357 -3.004 709 HA LEU 85 HA LEU 85 0.154 -1.667 -2.131 710 HB2 LEU 85 2HB LEU 85 2.865 -2.974 -2.327 711 HB3 LEU 85 1HB LEU 85 2.597 -1.318 -1.818 712 HG LEU 85 HG LEU 85 1.558 -3.763 -0.378 713 HD11 LEU 85 1HD1 LEU 85 3.242 -3.199 1.318 714 HD12 LEU 85 2HD1 LEU 85 3.858 -1.919 0.271 715 HD13 LEU 85 3HD1 LEU 85 3.978 -3.604 -0.233 716 HD21 LEU 85 3HD2 LEU 85 1.000 -2.173 1.404 717 HD22 LEU 85 1HD2 LEU 85 0.118 -1.823 -0.082 718 HD23 LEU 85 2HD2 LEU 85 1.510 -0.838 0.370 719 H LEU 86 H LEU 86 1.798 -3.339 -4.772 720 HA LEU 86 HA LEU 86 1.706 -0.819 -6.302 721 HB2 LEU 86 2HB LEU 86 3.781 -2.996 -6.274 722 HB3 LEU 86 1HB LEU 86 3.648 -1.859 -7.601 723 HG LEU 86 HG LEU 86 4.086 -1.005 -4.743 724 HD11 LEU 86 1HD1 LEU 86 6.118 -1.398 -6.937 725 HD12 LEU 86 2HD1 LEU 86 5.955 -2.396 -5.492 726 HD13 LEU 86 3HD1 LEU 86 6.431 -0.703 -5.346 727 HD21 LEU 86 3HD2 LEU 86 4.402 0.418 -7.385 728 HD22 LEU 86 1HD2 LEU 86 4.802 1.088 -5.802 729 HD23 LEU 86 2HD2 LEU 86 3.128 0.694 -6.198 730 H GLY 87 H GLY 87 0.804 -4.083 -6.109 731 HA2 GLY 87 2HA GLY 87 -0.614 -5.300 -7.462 732 HA3 GLY 87 1HA GLY 87 -0.665 -3.938 -8.573 733 H ARG 88 H ARG 88 2.465 -4.958 -7.705 734 HA ARG 88 HA ARG 88 2.754 -6.176 -10.365 735 HB2 ARG 88 2HB ARG 88 5.087 -5.503 -10.316 736 HB3 ARG 88 1HB ARG 88 4.058 -4.107 -10.034 737 HG2 ARG 88 2HG ARG 88 4.696 -3.904 -7.833 738 HG3 ARG 88 1HG ARG 88 5.157 -5.601 -7.699 739 HD2 ARG 88 2HD ARG 88 7.124 -4.169 -7.676 740 HD3 ARG 88 1HD ARG 88 7.104 -5.184 -9.116 741 HE ARG 88 HE ARG 88 5.930 -2.796 -9.844 742 HH11 ARG 88 1HH1 ARG 88 9.055 -3.842 -8.609 743 HH12 ARG 88 2HH1 ARG 88 9.920 -2.569 -9.428 744 HH21 ARG 88 1HH2 ARG 88 7.114 -1.119 -10.902 745 HH22 ARG 88 2HH2 ARG 88 8.839 -1.058 -10.707 746 H ALA 89 H ALA 89 4.473 -7.797 -10.552 747 HA ALA 89 HA ALA 89 4.840 -9.387 -8.103 748 HB1 ALA 89 3HB ALA 89 5.088 -10.237 -10.998 749 HB2 ALA 89 1HB ALA 89 3.735 -10.607 -9.929 750 HB3 ALA 89 2HB ALA 89 5.331 -11.276 -9.592 751 HA PRO 90 HA PRO 90 9.123 -8.295 -7.985 752 HB2 PRO 90 2HB PRO 90 9.757 -11.203 -7.885 753 HB3 PRO 90 1HB PRO 90 10.240 -9.906 -6.787 754 HG2 PRO 90 2HG PRO 90 8.351 -11.650 -6.085 755 HG3 PRO 90 1HG PRO 90 8.220 -9.937 -5.649 756 HD2 PRO 90 2HD PRO 90 6.799 -11.463 -7.785 757 HD3 PRO 90 1HD PRO 90 6.202 -10.155 -6.745 758 H TYR 91 H TYR 91 9.748 -7.516 -9.930 759 HA TYR 91 HA TYR 91 9.914 -9.236 -12.253 760 HB2 TYR 91 2HB TYR 91 10.583 -6.311 -11.856 761 HB3 TYR 91 1HB TYR 91 10.688 -7.147 -13.400 762 HD1 TYR 91 HD1 TYR 91 8.532 -8.206 -14.309 763 HD2 TYR 91 HD2 TYR 91 8.577 -5.329 -11.179 764 HE1 TYR 91 HE1 TYR 91 6.169 -7.698 -14.750 765 HE2 TYR 91 HE2 TYR 91 6.210 -4.818 -11.607 766 HH TYR 91 HH TYR 91 4.280 -6.750 -13.781 767 H ASP 92 H ASP 92 12.049 -7.625 -9.995 768 HA ASP 92 HA ASP 92 14.325 -9.019 -11.254 769 HB2 ASP 92 2HB ASP 92 14.229 -6.368 -9.812 770 HB3 ASP 92 1HB ASP 92 15.736 -7.227 -10.110 771 H GLU 93 H GLU 93 15.765 -10.077 -9.968 772 HA GLU 93 HA GLU 93 14.861 -11.239 -7.588 773 HB2 GLU 93 2HB GLU 93 17.182 -12.083 -7.343 774 HB3 GLU 93 1HB GLU 93 16.516 -12.362 -8.942 775 HG2 GLU 93 2HG GLU 93 18.367 -10.089 -8.266 776 HG3 GLU 93 1HG GLU 93 18.899 -11.643 -8.906 777 H SER 94 H SER 94 16.652 -8.332 -8.220 778 HA SER 94 HA SER 94 17.743 -7.768 -5.738 779 HB2 SER 94 2HB SER 94 16.448 -5.737 -7.569 780 HB3 SER 94 1HB SER 94 17.784 -5.473 -6.447 781 HG SER 94 HG SER 94 19.079 -6.815 -7.731 782 H GLU 95 H GLU 95 14.439 -7.357 -6.909 783 HA GLU 95 HA GLU 95 13.456 -5.897 -4.694 784 HB2 GLU 95 2HB GLU 95 11.995 -7.718 -6.615 785 HB3 GLU 95 1HB GLU 95 11.229 -6.577 -5.518 786 HG2 GLU 95 2HG GLU 95 12.307 -4.727 -6.672 787 HG3 GLU 95 1HG GLU 95 13.096 -5.862 -7.767 788 H VAL 96 H VAL 96 13.596 -9.334 -5.463 789 HA VAL 96 HA VAL 96 12.151 -10.264 -3.226 790 HB VAL 96 HB VAL 96 14.325 -11.721 -4.744 791 HG11 VAL 96 1HG1 VAL 96 12.032 -12.764 -3.087 792 HG12 VAL 96 2HG1 VAL 96 13.738 -12.805 -2.646 793 HG13 VAL 96 3HG1 VAL 96 13.159 -13.750 -4.017 794 HG21 VAL 96 3HG2 VAL 96 12.492 -12.649 -6.104 795 HG22 VAL 96 1HG2 VAL 96 12.642 -10.902 -6.286 796 HG23 VAL 96 2HG2 VAL 96 11.361 -11.575 -5.282 797 H ILE 97 H ILE 97 15.655 -10.050 -3.834 798 HA ILE 97 HA ILE 97 16.506 -10.992 -1.342 799 HB ILE 97 HB ILE 97 17.913 -9.031 -3.157 800 HG12 ILE 97 2HG1 ILE 97 18.097 -12.048 -2.985 801 HG13 ILE 97 1HG1 ILE 97 17.279 -11.150 -4.259 802 HG21 ILE 97 1HG2 ILE 97 19.968 -9.813 -2.074 803 HG22 ILE 97 2HG2 ILE 97 19.008 -10.808 -0.978 804 HG23 ILE 97 3HG2 ILE 97 18.876 -9.050 -0.919 805 HD11 ILE 97 3HD1 ILE 97 20.222 -11.075 -3.653 806 HD12 ILE 97 1HD1 ILE 97 19.409 -10.162 -4.922 807 HD13 ILE 97 2HD1 ILE 97 19.450 -11.923 -4.993 808 H PHE 98 H PHE 98 15.847 -7.687 -2.439 809 HA PHE 98 HA PHE 98 16.695 -6.281 -0.199 810 HB2 PHE 98 2HB PHE 98 16.050 -5.190 -2.288 811 HB3 PHE 98 1HB PHE 98 14.376 -5.676 -2.050 812 HD1 PHE 98 HD2 PHE 98 17.085 -3.562 -0.683 813 HD2 PHE 98 HD1 PHE 98 12.908 -4.359 -0.761 814 HE1 PHE 98 HE2 PHE 98 16.667 -1.461 0.527 815 HE2 PHE 98 HE1 PHE 98 12.482 -2.260 0.447 816 HZ PHE 98 HZ PHE 98 14.361 -0.808 1.094 817 H HIS 99 H HIS 99 13.520 -7.725 -0.867 818 HA HIS 99 HA HIS 99 12.369 -6.768 1.565 819 HB2 HIS 99 2HB HIS 99 11.467 -8.668 -0.567 820 HB3 HIS 99 1HB HIS 99 10.580 -8.564 0.950 821 HD1 HIS 99 HD1 HIS 99 8.775 -6.867 0.999 822 HD2 HIS 99 HD2 HIS 99 11.693 -5.963 -1.831 823 HE1 HIS 99 HE1 HIS 99 7.955 -4.809 -0.197 824 HE2 HIS 99 HE2 HIS 99 9.833 -4.167 -1.756 825 H LEU 100 H LEU 100 13.895 -9.787 0.588 826 HA LEU 100 HA LEU 100 13.181 -11.351 2.794 827 HB2 LEU 100 2HB LEU 100 15.639 -11.399 1.054 828 HB3 LEU 100 1HB LEU 100 15.338 -12.589 2.305 829 HG LEU 100 HG LEU 100 13.530 -12.089 -0.063 830 HD11 LEU 100 1HD1 LEU 100 14.345 -14.242 -0.881 831 HD12 LEU 100 2HD1 LEU 100 15.483 -14.326 0.465 832 HD13 LEU 100 3HD1 LEU 100 15.653 -13.064 -0.756 833 HD21 LEU 100 3HD2 LEU 100 13.497 -14.225 2.065 834 HD22 LEU 100 1HD2 LEU 100 12.440 -14.160 0.656 835 HD23 LEU 100 2HD2 LEU 100 12.337 -12.907 1.894 836 H ASP 101 H ASP 101 16.098 -9.345 2.316 837 HA ASP 101 HA ASP 101 17.069 -9.779 4.949 838 HB2 ASP 101 2HB ASP 101 17.707 -7.722 2.848 839 HB3 ASP 101 1HB ASP 101 18.412 -7.628 4.456 840 H LEU 102 H LEU 102 15.025 -7.309 3.498 841 HA LEU 102 HA LEU 102 14.982 -5.474 5.597 842 HB2 LEU 102 2HB LEU 102 14.050 -5.135 3.304 843 HB3 LEU 102 1HB LEU 102 12.696 -6.155 3.748 844 HG LEU 102 HG LEU 102 11.989 -4.541 5.428 845 HD11 LEU 102 1HD1 LEU 102 14.361 -2.923 4.506 846 HD12 LEU 102 2HD1 LEU 102 14.178 -3.694 6.082 847 HD13 LEU 102 3HD1 LEU 102 13.108 -2.371 5.618 848 HD21 LEU 102 3HD2 LEU 102 11.185 -4.299 3.125 849 HD22 LEU 102 1HD2 LEU 102 12.553 -3.249 2.761 850 HD23 LEU 102 2HD2 LEU 102 11.334 -2.736 3.928 851 H TYR 103 H TYR 103 12.848 -8.246 4.974 852 HA TYR 103 HA TYR 103 11.277 -7.971 7.295 853 HB2 TYR 103 2HB TYR 103 10.361 -9.386 5.668 854 HB3 TYR 103 1HB TYR 103 11.871 -10.268 5.450 855 HD1 TYR 103 HD2 TYR 103 9.123 -9.696 7.901 856 HD2 TYR 103 HD1 TYR 103 12.253 -12.271 6.604 857 HE1 TYR 103 HE2 TYR 103 8.381 -11.404 9.510 858 HE2 TYR 103 HE1 TYR 103 11.526 -13.977 8.219 859 HH TYR 103 HH TYR 103 8.555 -13.672 10.007 860 H GLU 104 H GLU 104 14.163 -9.966 6.667 861 HA GLU 104 HA GLU 104 14.095 -11.198 9.217 862 HB2 GLU 104 2HB GLU 104 16.229 -11.051 7.103 863 HB3 GLU 104 1HB GLU 104 16.441 -11.941 8.607 864 HG2 GLU 104 2HG GLU 104 14.392 -13.242 8.044 865 HG3 GLU 104 1HG GLU 104 14.376 -12.438 6.476 866 H ASN 105 H ASN 105 15.231 -8.127 8.251 867 HA ASN 105 HA ASN 105 16.963 -7.951 10.606 868 HB2 ASN 105 2HB ASN 105 16.691 -6.250 8.149 869 HB3 ASN 105 1HB ASN 105 17.447 -5.607 9.604 870 HD21 ASN 105 1HD2 ASN 105 17.692 -7.911 7.026 871 HD22 ASN 105 2HD2 ASN 105 19.350 -8.342 7.295 872 H GLU 106 H GLU 106 14.341 -6.001 9.107 873 HA GLU 106 HA GLU 106 14.004 -4.730 11.728 874 HB2 GLU 106 2HB GLU 106 12.883 -3.909 9.049 875 HB3 GLU 106 1HB GLU 106 12.710 -3.014 10.553 876 HG2 GLU 106 2HG GLU 106 15.230 -2.897 10.624 877 HG3 GLU 106 1HG GLU 106 15.210 -3.506 8.969 878 H GLY 107 H GLY 107 12.228 -6.593 9.327 879 HA2 GLY 107 2HA GLY 107 10.675 -8.181 10.575 880 HA3 GLY 107 1HA GLY 107 9.966 -6.706 11.217 881 H PHE 108 H PHE 108 8.232 -8.282 10.041 882 HA PHE 108 HA PHE 108 8.005 -7.937 7.224 883 HB2 PHE 108 2HB PHE 108 5.676 -8.795 7.535 884 HB3 PHE 108 1HB PHE 108 6.918 -9.836 8.216 885 HD1 PHE 108 HD2 PHE 108 4.194 -7.491 8.998 886 HD2 PHE 108 HD1 PHE 108 7.036 -10.255 10.564 887 HE1 PHE 108 HE2 PHE 108 3.007 -7.492 11.152 888 HE2 PHE 108 HE1 PHE 108 5.849 -10.258 12.718 889 HZ PHE 108 HZ PHE 108 3.834 -8.875 13.014 890 H ASP 109 H ASP 109 7.072 -6.066 9.985 891 HA ASP 109 HA ASP 109 5.146 -4.385 8.822 892 HB2 ASP 109 2HB ASP 109 5.721 -4.436 11.257 893 HB3 ASP 109 1HB ASP 109 7.238 -3.625 10.881 894 H ALA 110 H ALA 110 8.660 -4.305 8.829 895 HA ALA 110 HA ALA 110 8.909 -1.810 7.479 896 HB1 ALA 110 3HB ALA 110 10.928 -4.038 7.727 897 HB2 ALA 110 1HB ALA 110 10.684 -2.743 8.899 898 HB3 ALA 110 2HB ALA 110 11.257 -2.364 7.276 899 H ASP 111 H ASP 111 8.880 -5.186 6.463 900 HA ASP 111 HA ASP 111 9.638 -4.958 3.808 901 HB2 ASP 111 2HB ASP 111 9.151 -7.100 5.008 902 HB3 ASP 111 1HB ASP 111 7.433 -6.743 4.872 903 H ILE 112 H ILE 112 6.455 -4.545 5.251 904 HA ILE 112 HA ILE 112 5.153 -3.897 2.782 905 HB ILE 112 HB ILE 112 4.198 -3.474 5.619 906 HG12 ILE 112 2HG1 ILE 112 3.691 -5.823 3.778 907 HG13 ILE 112 1HG1 ILE 112 4.842 -5.833 5.111 908 HG21 ILE 112 1HG2 ILE 112 2.926 -2.203 3.992 909 HG22 ILE 112 2HG2 ILE 112 1.959 -3.537 4.625 910 HG23 ILE 112 3HG2 ILE 112 2.682 -3.655 3.021 911 HD11 ILE 112 3HD1 ILE 112 2.758 -6.923 5.720 912 HD12 ILE 112 1HD1 ILE 112 1.866 -5.444 5.356 913 HD13 ILE 112 2HD1 ILE 112 3.022 -5.472 6.690 914 H ASP 113 H ASP 113 6.437 -2.088 5.523 915 HA ASP 113 HA ASP 113 5.139 0.365 4.914 916 HB2 ASP 113 2HB ASP 113 6.239 -0.517 7.137 917 HB3 ASP 113 1HB ASP 113 7.674 0.279 6.500 918 H SER 114 H SER 114 7.992 -1.113 3.724 919 HA SER 114 HA SER 114 9.706 0.922 3.125 920 HB2 SER 114 2HB SER 114 10.410 -0.468 1.156 921 HB3 SER 114 1HB SER 114 10.303 -1.360 2.676 922 HG SER 114 HG SER 114 8.603 -2.449 1.943 923 H TYR 115 H TYR 115 7.276 -0.272 0.784 924 HA TYR 115 HA TYR 115 7.634 1.880 -1.009 925 HB2 TYR 115 2HB TYR 115 6.689 -0.048 -1.966 926 HB3 TYR 115 1HB TYR 115 5.484 -0.203 -0.691 927 HD1 TYR 115 HD1 TYR 115 6.505 2.204 -3.367 928 HD2 TYR 115 HD2 TYR 115 3.312 0.446 -1.166 929 HE1 TYR 115 HE1 TYR 115 4.884 3.444 -4.736 930 HE2 TYR 115 HE2 TYR 115 1.682 1.681 -2.535 931 HH TYR 115 HH TYR 115 1.580 3.676 -3.918 932 H ILE 116 H ILE 116 5.391 1.340 1.635 933 HA ILE 116 HA ILE 116 3.503 3.289 1.028 934 HB ILE 116 HB ILE 116 4.344 2.340 3.770 935 HG12 ILE 116 2HG1 ILE 116 2.165 1.339 1.924 936 HG13 ILE 116 1HG1 ILE 116 3.700 0.527 2.211 937 HG21 ILE 116 1HG2 ILE 116 2.098 3.018 4.469 938 HG22 ILE 116 2HG2 ILE 116 1.782 3.642 2.850 939 HG23 ILE 116 3HG2 ILE 116 3.018 4.393 3.858 940 HD11 ILE 116 3HD1 ILE 116 1.569 1.044 4.271 941 HD12 ILE 116 1HD1 ILE 116 3.100 0.216 4.552 942 HD13 ILE 116 2HD1 ILE 116 1.897 -0.494 3.474 943 H ASP 117 H ASP 117 6.582 3.564 2.725 944 HA ASP 117 HA ASP 117 6.026 6.342 3.376 945 HB2 ASP 117 2HB ASP 117 7.118 4.897 5.050 946 HB3 ASP 117 1HB ASP 117 8.487 4.690 3.960 947 H SER 118 H SER 118 7.847 4.525 1.008 948 HA SER 118 HA SER 118 9.799 6.403 0.348 949 HB2 SER 118 2HB SER 118 9.929 5.297 -1.857 950 HB3 SER 118 1HB SER 118 9.880 4.134 -0.534 951 HG SER 118 HG SER 118 7.416 4.373 -1.098 952 HA PRO 119 HA PRO 119 7.041 9.666 -0.861 953 HB2 PRO 119 2HB PRO 119 8.979 11.501 -1.433 954 HB3 PRO 119 1HB PRO 119 8.437 11.123 0.205 955 HG2 PRO 119 2HG PRO 119 10.848 10.139 -1.268 956 HG3 PRO 119 1HG PRO 119 10.700 10.655 0.423 957 HD2 PRO 119 2HD PRO 119 10.754 8.050 -0.288 958 HD3 PRO 119 1HD PRO 119 9.800 8.635 1.091 959 H GLU 120 H GLU 120 9.837 8.775 -2.866 960 HA GLU 120 HA GLU 120 9.080 10.224 -5.142 961 HB2 GLU 120 2HB GLU 120 10.595 8.731 -6.394 962 HB3 GLU 120 1HB GLU 120 11.326 9.368 -4.930 963 HG2 GLU 120 2HG GLU 120 11.142 7.299 -3.819 964 HG3 GLU 120 1HG GLU 120 10.066 6.648 -5.055 965 H TYR 121 H TYR 121 8.451 6.818 -4.293 966 HA TYR 121 HA TYR 121 6.911 6.337 -6.639 967 HB2 TYR 121 2HB TYR 121 7.614 4.826 -4.203 968 HB3 TYR 121 1HB TYR 121 6.086 4.378 -4.960 969 HD1 TYR 121 HD1 TYR 121 9.593 5.160 -6.014 970 HD2 TYR 121 HD2 TYR 121 6.167 2.693 -6.517 971 HE1 TYR 121 HE1 TYR 121 10.803 3.836 -7.695 972 HE2 TYR 121 HE2 TYR 121 7.364 1.360 -8.201 973 HH TYR 121 HH TYR 121 10.770 1.721 -8.753 974 H THR 122 H THR 122 6.167 7.368 -3.380 975 HA THR 122 HA THR 122 3.392 7.240 -3.436 976 HB THR 122 HB THR 122 5.150 9.358 -2.174 977 HG1 THR 122 HG1 THR 122 5.487 7.182 -1.433 978 HG21 THR 122 3HG2 THR 122 2.254 8.675 -1.667 979 HG22 THR 122 1HG2 THR 122 2.876 10.181 -2.341 980 HG23 THR 122 2HG2 THR 122 3.231 9.753 -0.669 981 H ASN 123 H ASN 123 5.571 9.721 -4.719 982 HA ASN 123 HA ASN 123 3.374 11.372 -5.597 983 HB2 ASN 123 2HB ASN 123 6.351 11.607 -6.094 984 HB3 ASN 123 1HB ASN 123 5.157 12.803 -6.585 985 HD21 ASN 123 1HD2 ASN 123 7.403 13.151 -4.810 986 HD22 ASN 123 2HD2 ASN 123 6.754 13.644 -3.277 987 H SER 124 H SER 124 5.418 8.923 -6.978 988 HA SER 124 HA SER 124 4.842 9.619 -9.710 989 HB2 SER 124 2HB SER 124 6.078 7.101 -8.569 990 HB3 SER 124 1HB SER 124 6.068 7.568 -10.269 991 HG SER 124 HG SER 124 7.342 8.925 -8.123 992 H PHE 125 H PHE 125 3.885 6.938 -7.552 993 HA PHE 125 HA PHE 125 2.059 5.891 -9.520 994 HB2 PHE 125 2HB PHE 125 3.325 4.480 -7.861 995 HB3 PHE 125 1HB PHE 125 2.299 5.147 -6.596 996 HD1 PHE 125 HD2 PHE 125 2.445 2.917 -9.491 997 HD2 PHE 125 HD1 PHE 125 -0.012 4.473 -6.386 998 HE1 PHE 125 HE2 PHE 125 0.785 1.155 -9.930 999 HE2 PHE 125 HE1 PHE 125 -1.679 2.712 -6.819 1000 HZ PHE 125 HZ PHE 125 -1.280 1.053 -8.594 1001 H GLY 126 H GLY 126 1.864 7.750 -6.531 1002 HA2 GLY 126 2HA GLY 126 0.124 9.473 -6.459 1003 HA3 GLY 126 1HA GLY 126 -0.963 8.293 -7.175 1004 H ASP 127 H ASP 127 0.173 9.653 -4.320 1005 HA ASP 127 HA ASP 127 -0.157 7.710 -2.372 1006 HB2 ASP 127 2HB ASP 127 0.598 10.106 -2.040 1007 HB3 ASP 127 1HB ASP 127 -1.093 10.578 -2.127 1008 H TRP 128 H TRP 128 -2.564 9.865 -3.772 1009 HA TRP 128 HA TRP 128 -4.706 8.638 -2.268 1010 HB2 TRP 128 2HB TRP 128 -4.716 10.907 -4.271 1011 HB3 TRP 128 1HB TRP 128 -6.089 10.416 -3.285 1012 HD1 TRP 128 HD1 TRP 128 -2.550 11.914 -2.873 1013 HE1 TRP 128 HE1 TRP 128 -2.506 13.315 -0.710 1014 HE3 TRP 128 HE3 TRP 128 -7.251 10.874 -1.141 1015 HZ2 TRP 128 HZ2 TRP 128 -4.244 13.910 1.433 1016 HZ3 TRP 128 HZ3 TRP 128 -7.982 11.906 0.969 1017 HH2 TRP 128 HH2 TRP 128 -6.509 13.392 2.228 1018 H VAL 129 H VAL 129 -3.285 7.107 -4.372 1019 HA VAL 129 HA VAL 129 -5.612 6.489 -6.076 1020 HB VAL 129 HB VAL 129 -2.693 6.174 -6.832 1021 HG11 VAL 129 1HG1 VAL 129 -5.203 5.660 -8.425 1022 HG12 VAL 129 2HG1 VAL 129 -4.082 4.440 -7.819 1023 HG13 VAL 129 3HG1 VAL 129 -3.559 5.586 -9.055 1024 HG21 VAL 129 3HG2 VAL 129 -4.757 8.122 -7.854 1025 HG22 VAL 129 1HG2 VAL 129 -3.118 7.935 -8.477 1026 HG23 VAL 129 2HG2 VAL 129 -3.377 8.517 -6.831 1027 H VAL 130 H VAL 130 -6.249 4.384 -6.119 1028 HA VAL 130 HA VAL 130 -5.008 2.588 -4.208 1029 HB VAL 130 HB VAL 130 -7.447 2.164 -5.946 1030 HG11 VAL 130 1HG1 VAL 130 -7.963 0.328 -4.406 1031 HG12 VAL 130 2HG1 VAL 130 -6.436 0.605 -3.569 1032 HG13 VAL 130 3HG1 VAL 130 -6.435 0.063 -5.248 1033 HG21 VAL 130 3HG2 VAL 130 -7.749 4.015 -4.386 1034 HG22 VAL 130 1HG2 VAL 130 -7.246 2.979 -3.050 1035 HG23 VAL 130 2HG2 VAL 130 -8.736 2.628 -3.924 1036 HA PRO 131 HA PRO 131 -2.580 0.588 -7.378 1037 HB2 PRO 131 2HB PRO 131 -1.697 -1.454 -5.804 1038 HB3 PRO 131 1HB PRO 131 -1.004 0.171 -5.770 1039 HG2 PRO 131 2HG PRO 131 -2.999 -1.076 -3.923 1040 HG3 PRO 131 1HG PRO 131 -1.609 -0.043 -3.539 1041 HD2 PRO 131 2HD PRO 131 -4.138 0.903 -3.608 1042 HD3 PRO 131 1HD PRO 131 -2.741 1.894 -4.076 1043 H TYR 132 H TYR 132 -2.882 -1.076 -8.753 1044 HA TYR 132 HA TYR 132 -4.852 -3.129 -8.041 1045 HB2 TYR 132 2HB TYR 132 -5.567 -3.079 -10.477 1046 HB3 TYR 132 1HB TYR 132 -6.060 -1.697 -9.509 1047 HD1 TYR 132 HD2 TYR 132 -3.614 -2.832 -12.055 1048 HD2 TYR 132 HD1 TYR 132 -5.415 0.496 -10.113 1049 HE1 TYR 132 HE2 TYR 132 -2.600 -1.326 -13.710 1050 HE2 TYR 132 HE1 TYR 132 -4.413 2.015 -11.771 1051 HH TYR 132 HH TYR 132 -2.397 1.974 -13.313 1052 H TYR 133 H TYR 133 -4.467 -5.195 -8.894 1053 HA TYR 133 HA TYR 133 -1.676 -5.689 -9.359 1054 HB2 TYR 133 2HB TYR 133 -2.273 -8.079 -9.291 1055 HB3 TYR 133 1HB TYR 133 -2.861 -7.201 -7.889 1056 HD1 TYR 133 HD1 TYR 133 -3.851 -8.873 -11.019 1057 HD2 TYR 133 HD2 TYR 133 -5.207 -7.037 -7.430 1058 HE1 TYR 133 HE1 TYR 133 -6.090 -9.808 -11.393 1059 HE2 TYR 133 HE2 TYR 133 -7.455 -7.962 -7.801 1060 HH TYR 133 HH TYR 133 -8.834 -8.860 -9.507 1061 H ARG 134 H ARG 134 -0.752 -6.731 -11.100 1062 HA ARG 134 HA ARG 134 -1.325 -5.780 -13.590 1063 HB2 ARG 134 2HB ARG 134 0.149 -8.268 -12.762 1064 HB3 ARG 134 1HB ARG 134 0.062 -7.737 -14.438 1065 HG2 ARG 134 2HG ARG 134 1.172 -6.108 -12.161 1066 HG3 ARG 134 1HG ARG 134 2.132 -7.022 -13.330 1067 HD2 ARG 134 2HD ARG 134 1.087 -5.663 -15.141 1068 HD3 ARG 134 1HD ARG 134 0.306 -4.689 -13.898 1069 HE ARG 134 HE ARG 134 3.191 -4.872 -13.678 1070 HH11 ARG 134 1HH1 ARG 134 0.463 -3.097 -14.971 1071 HH12 ARG 134 2HH1 ARG 134 1.355 -1.621 -15.182 1072 HH21 ARG 134 1HH2 ARG 134 4.370 -2.913 -13.953 1073 HH22 ARG 134 2HH2 ARG 134 3.559 -1.524 -14.608 1074 H GLY 135 H GLY 135 -2.376 -6.385 -15.355 1075 HA2 GLY 135 2HA GLY 135 -3.591 -8.554 -16.277 1076 HA3 GLY 135 1HA GLY 135 -4.662 -8.150 -14.935 1077 H LEU 136 H LEU 136 -6.363 -6.996 -15.528 1078 HA LEU 136 HA LEU 136 -7.603 -5.255 -16.284 1079 HB2 LEU 136 2HB LEU 136 -4.915 -4.198 -17.102 1080 HB3 LEU 136 1HB LEU 136 -6.398 -3.347 -17.484 1081 HG LEU 136 HG LEU 136 -6.861 -3.458 -14.959 1082 HD11 LEU 136 1HD1 LEU 136 -4.899 -3.523 -13.530 1083 HD12 LEU 136 2HD1 LEU 136 -3.885 -3.891 -14.925 1084 HD13 LEU 136 3HD1 LEU 136 -5.101 -5.049 -14.388 1085 HD21 LEU 136 3HD2 LEU 136 -5.575 -1.403 -14.586 1086 HD22 LEU 136 1HD2 LEU 136 -6.389 -1.400 -16.151 1087 HD23 LEU 136 2HD2 LEU 136 -4.658 -1.725 -16.058 1088 H GLU 137 H GLU 137 -5.201 -6.295 -18.617 1089 HA GLU 137 HA GLU 137 -6.272 -5.403 -20.967 1090 HB2 GLU 137 2HB GLU 137 -4.891 -8.042 -20.503 1091 HB3 GLU 137 1HB GLU 137 -5.138 -7.294 -22.075 1092 HG2 GLU 137 2HG GLU 137 -3.821 -5.335 -21.241 1093 HG3 GLU 137 1HG GLU 137 -3.433 -6.299 -19.815 1094 H HIS 138 H HIS 138 -7.549 -6.221 -22.569 1095 HA HIS 138 HA HIS 138 -9.910 -7.581 -21.694 1096 HB2 HIS 138 2HB HIS 138 -9.653 -5.668 -23.417 1097 HB3 HIS 138 1HB HIS 138 -9.195 -6.932 -24.551 1098 HD1 HIS 138 HD1 HIS 138 -11.070 -8.300 -25.590 1099 HD2 HIS 138 HD2 HIS 138 -12.359 -5.787 -22.534 1100 HE1 HIS 138 HE1 HIS 138 -13.582 -8.327 -25.699 1101 HE2 HIS 138 HE2 HIS 138 -14.317 -6.610 -24.009 1102 H HIS 139 H HIS 139 -7.358 -9.104 -21.684 1103 HA HIS 139 HA HIS 139 -7.294 -10.997 -23.776 1104 HB2 HIS 139 2HB HIS 139 -5.441 -10.564 -22.150 1105 HB3 HIS 139 1HB HIS 139 -6.388 -11.380 -20.913 1106 HD1 HIS 139 HD1 HIS 139 -5.920 -13.796 -20.656 1107 HD2 HIS 139 HD2 HIS 139 -4.849 -12.390 -24.424 1108 HE1 HIS 139 HE1 HIS 139 -4.827 -15.739 -21.821 1109 HE2 HIS 139 HE2 HIS 139 -4.042 -14.822 -24.034 1110 H HIS 140 H HIS 140 -9.098 -10.788 -20.795 1111 HA HIS 140 HA HIS 140 -10.891 -12.810 -21.908 1112 HB2 HIS 140 2HB HIS 140 -11.333 -13.834 -19.777 1113 HB3 HIS 140 1HB HIS 140 -9.598 -13.871 -20.045 1114 HD1 HIS 140 HD1 HIS 140 -12.122 -12.905 -17.617 1115 HD2 HIS 140 HD2 HIS 140 -8.183 -11.846 -18.450 1116 HE1 HIS 140 HE1 HIS 140 -11.262 -11.787 -15.530 1117 HE2 HIS 140 HE2 HIS 140 -8.839 -11.275 -16.008 1118 H HIS 141 H HIS 141 -12.854 -12.002 -22.161 1119 HA HIS 141 HA HIS 141 -13.230 -9.257 -21.419 1120 HB2 HIS 141 2HB HIS 141 -15.152 -9.260 -22.813 1121 HB3 HIS 141 1HB HIS 141 -13.940 -10.239 -23.623 1122 HD1 HIS 141 HD1 HIS 141 -17.415 -10.227 -22.814 1123 HD2 HIS 141 HD2 HIS 141 -14.473 -13.159 -23.085 1124 HE1 HIS 141 HE1 HIS 141 -18.646 -12.402 -23.101 1125 HE2 HIS 141 HE2 HIS 141 -16.842 -14.127 -23.454 1126 H HIS 142 H HIS 142 -14.907 -8.365 -20.225 1127 HA HIS 142 HA HIS 142 -15.767 -10.028 -17.988 1128 HB2 HIS 142 2HB HIS 142 -16.563 -7.826 -17.032 1129 HB3 HIS 142 1HB HIS 142 -14.832 -7.935 -17.303 1130 HD1 HIS 142 HD1 HIS 142 -17.849 -6.608 -19.281 1131 HD2 HIS 142 HD2 HIS 142 -13.866 -5.706 -18.449 1132 HE1 HIS 142 HE1 HIS 142 -17.397 -4.404 -20.401 1133 HE2 HIS 142 HE2 HIS 142 -15.050 -3.783 -19.722 1134 H HIS 143 H HIS 143 -18.119 -8.736 -17.261 1135 HA HIS 143 HA HIS 143 -19.931 -9.729 -19.291 1136 HB2 HIS 143 2HB HIS 143 -21.713 -9.246 -17.644 1137 HB3 HIS 143 1HB HIS 143 -20.451 -10.274 -16.980 1138 HD1 HIS 143 HD1 HIS 143 -22.019 -6.904 -16.624 1139 HD2 HIS 143 HD2 HIS 143 -18.946 -9.113 -14.898 1140 HE1 HIS 143 HE1 HIS 143 -21.416 -5.688 -14.505 1141 HE2 HIS 143 HE2 HIS 143 -19.528 -7.016 -13.489 Start of MODEL 11 1 H1 MET 1 1H MET 1 -9.465 4.341 -15.457 2 H2 MET 1 2H MET 1 -10.939 3.927 -14.743 3 H3 MET 1 3H MET 1 -10.720 3.718 -16.410 4 HA MET 1 HA MET 1 -10.588 1.609 -15.380 5 HB2 MET 1 2HB MET 1 -7.851 2.645 -16.137 6 HB3 MET 1 1HB MET 1 -8.260 0.945 -15.966 7 HG2 MET 1 2HG MET 1 -9.852 1.120 -17.786 8 HG3 MET 1 1HG MET 1 -9.520 2.844 -17.930 9 HE1 MET 1 3HE MET 1 -9.380 0.722 -20.339 10 HE2 MET 1 1HE MET 1 -7.924 1.270 -21.168 11 HE3 MET 1 2HE MET 1 -9.082 2.448 -20.551 12 HA PRO 2 HA PRO 2 -7.643 1.915 -11.631 13 HB2 PRO 2 2HB PRO 2 -6.689 4.637 -11.342 14 HB3 PRO 2 1HB PRO 2 -5.752 3.154 -11.538 15 HG2 PRO 2 2HG PRO 2 -5.892 5.105 -13.436 16 HG3 PRO 2 1HG PRO 2 -5.608 3.396 -13.809 17 HD2 PRO 2 2HD PRO 2 -8.143 4.982 -13.989 18 HD3 PRO 2 1HD PRO 2 -7.494 3.758 -15.105 19 H VAL 3 H VAL 3 -8.342 2.280 -9.536 20 HA VAL 3 HA VAL 3 -10.590 4.121 -9.245 21 HB VAL 3 HB VAL 3 -9.559 2.059 -7.285 22 HG11 VAL 3 1HG1 VAL 3 -10.791 3.877 -6.218 23 HG12 VAL 3 2HG1 VAL 3 -11.711 2.373 -6.163 24 HG13 VAL 3 3HG1 VAL 3 -12.137 3.627 -7.329 25 HG21 VAL 3 3HG2 VAL 3 -11.889 1.910 -9.198 26 HG22 VAL 3 1HG2 VAL 3 -11.469 0.699 -7.987 27 HG23 VAL 3 2HG2 VAL 3 -10.376 1.014 -9.336 28 H GLU 4 H GLU 4 -10.409 6.005 -8.203 29 HA GLU 4 HA GLU 4 -8.090 6.448 -6.463 30 HB2 GLU 4 2HB GLU 4 -7.655 8.609 -7.595 31 HB3 GLU 4 1HB GLU 4 -7.392 7.225 -8.648 32 HG2 GLU 4 2HG GLU 4 -9.712 7.607 -9.544 33 HG3 GLU 4 1HG GLU 4 -9.715 9.128 -8.653 34 H LEU 5 H LEU 5 -8.332 8.195 -4.998 35 HA LEU 5 HA LEU 5 -11.138 8.857 -4.480 36 HB2 LEU 5 2HB LEU 5 -9.849 7.844 -2.640 37 HB3 LEU 5 1HB LEU 5 -8.697 9.164 -2.722 38 HG LEU 5 HG LEU 5 -10.473 10.743 -2.047 39 HD11 LEU 5 1HD1 LEU 5 -12.610 9.895 -1.234 40 HD12 LEU 5 2HD1 LEU 5 -12.158 8.263 -1.728 41 HD13 LEU 5 3HD1 LEU 5 -12.388 9.519 -2.944 42 HD21 LEU 5 3HD2 LEU 5 -9.018 9.741 -0.359 43 HD22 LEU 5 1HD2 LEU 5 -10.137 8.390 -0.189 44 HD23 LEU 5 2HD2 LEU 5 -10.640 10.014 0.277 45 H ARG 6 H ARG 6 -11.873 10.769 -5.060 46 HA ARG 6 HA ARG 6 -10.063 12.799 -6.030 47 HB2 ARG 6 2HB ARG 6 -13.068 12.652 -5.805 48 HB3 ARG 6 1HB ARG 6 -12.225 14.066 -6.418 49 HG2 ARG 6 2HG ARG 6 -11.889 11.338 -7.621 50 HG3 ARG 6 1HG ARG 6 -13.155 12.457 -8.123 51 HD2 ARG 6 2HD ARG 6 -11.609 13.128 -9.615 52 HD3 ARG 6 1HD ARG 6 -11.015 14.082 -8.260 53 HE ARG 6 HE ARG 6 -9.905 11.425 -8.890 54 HH11 ARG 6 1HH1 ARG 6 -9.485 14.815 -8.140 55 HH12 ARG 6 2HH1 ARG 6 -7.754 14.763 -8.265 56 HH21 ARG 6 1HH2 ARG 6 -7.630 11.342 -9.095 57 HH22 ARG 6 2HH2 ARG 6 -6.695 12.788 -8.797 58 H ALA 7 H ALA 7 -9.964 14.957 -5.240 59 HA ALA 7 HA ALA 7 -10.199 15.214 -2.382 60 HB1 ALA 7 3HB ALA 7 -8.381 16.327 -3.600 61 HB2 ALA 7 1HB ALA 7 -9.372 17.487 -2.714 62 HB3 ALA 7 2HB ALA 7 -9.565 17.313 -4.458 63 H ASN 8 H ASN 8 -11.763 16.321 -1.250 64 HA ASN 8 HA ASN 8 -13.929 16.809 -0.776 65 HB2 ASN 8 2HB ASN 8 -13.338 18.931 -1.957 66 HB3 ASN 8 1HB ASN 8 -13.915 18.221 -3.459 67 HD21 ASN 8 1HD2 ASN 8 -16.091 18.075 -3.837 68 HD22 ASN 8 2HD2 ASN 8 -17.282 18.824 -2.829 69 H TRP 9 H TRP 9 -14.501 14.642 -0.868 70 HA TRP 9 HA TRP 9 -15.318 13.549 -3.449 71 HB2 TRP 9 2HB TRP 9 -15.235 11.349 -2.174 72 HB3 TRP 9 1HB TRP 9 -13.698 12.179 -2.395 73 HD1 TRP 9 HD1 TRP 9 -12.452 13.050 -0.236 74 HE1 TRP 9 HE1 TRP 9 -12.803 12.657 2.281 75 HE3 TRP 9 HE3 TRP 9 -17.118 10.958 -0.380 76 HZ2 TRP 9 HZ2 TRP 9 -14.788 11.602 3.978 77 HZ3 TRP 9 HZ3 TRP 9 -18.171 10.284 1.738 78 HH2 TRP 9 HH2 TRP 9 -17.028 10.600 3.872 79 H SER 10 H SER 10 -17.025 11.743 -3.134 80 HA SER 10 HA SER 10 -19.173 12.602 -1.336 81 HB2 SER 10 2HB SER 10 -19.544 11.740 -4.221 82 HB3 SER 10 1HB SER 10 -20.825 12.211 -3.102 83 HG SER 10 HG SER 10 -19.024 14.159 -3.143 84 H GLU 11 H GLU 11 -20.841 10.762 -1.156 85 HA GLU 11 HA GLU 11 -19.588 8.562 -0.027 86 HB2 GLU 11 2HB GLU 11 -21.941 9.370 0.371 87 HB3 GLU 11 1HB GLU 11 -22.398 8.584 -1.133 88 HG2 GLU 11 2HG GLU 11 -22.975 7.174 0.717 89 HG3 GLU 11 1HG GLU 11 -21.670 6.430 -0.203 90 H GLU 12 H GLU 12 -21.110 8.816 -3.227 91 HA GLU 12 HA GLU 12 -20.771 6.203 -4.134 92 HB2 GLU 12 2HB GLU 12 -22.083 7.884 -5.328 93 HB3 GLU 12 1HB GLU 12 -20.626 8.800 -5.678 94 HG2 GLU 12 2HG GLU 12 -21.005 7.707 -7.662 95 HG3 GLU 12 1HG GLU 12 -19.851 6.636 -6.869 96 H ASP 13 H ASP 13 -18.591 8.970 -4.416 97 HA ASP 13 HA ASP 13 -16.607 7.747 -5.981 98 HB2 ASP 13 2HB ASP 13 -16.877 10.216 -5.586 99 HB3 ASP 13 1HB ASP 13 -16.228 9.980 -3.968 100 H LEU 14 H LEU 14 -16.858 8.223 -2.485 101 HA LEU 14 HA LEU 14 -14.406 6.960 -1.860 102 HB2 LEU 14 2HB LEU 14 -15.514 8.565 -0.376 103 HB3 LEU 14 1HB LEU 14 -16.826 7.427 -0.125 104 HG LEU 14 HG LEU 14 -15.220 5.849 0.914 105 HD11 LEU 14 1HD1 LEU 14 -13.285 8.153 0.721 106 HD12 LEU 14 2HD1 LEU 14 -13.194 6.660 -0.212 107 HD13 LEU 14 3HD1 LEU 14 -13.007 6.616 1.541 108 HD21 LEU 14 3HD2 LEU 14 -16.565 7.349 2.277 109 HD22 LEU 14 1HD2 LEU 14 -15.321 8.593 2.151 110 HD23 LEU 14 2HD2 LEU 14 -14.977 7.086 2.999 111 H GLU 15 H GLU 15 -17.764 5.799 -1.901 112 HA GLU 15 HA GLU 15 -17.419 3.287 -0.771 113 HB2 GLU 15 2HB GLU 15 -19.473 4.652 -2.013 114 HB3 GLU 15 1HB GLU 15 -19.212 3.289 -3.091 115 HG2 GLU 15 2HG GLU 15 -19.692 3.053 -0.131 116 HG3 GLU 15 1HG GLU 15 -20.944 2.913 -1.360 117 H THR 16 H THR 16 -17.023 4.295 -4.134 118 HA THR 16 HA THR 16 -16.340 1.804 -5.223 119 HB THR 16 HB THR 16 -15.322 4.494 -6.152 120 HG1 THR 16 HG1 THR 16 -17.486 4.795 -6.146 121 HG21 THR 16 3HG2 THR 16 -15.907 1.929 -7.636 122 HG22 THR 16 1HG2 THR 16 -14.306 2.563 -7.258 123 HG23 THR 16 2HG2 THR 16 -15.360 3.439 -8.367 124 H VAL 17 H VAL 17 -14.355 4.368 -3.801 125 HA VAL 17 HA VAL 17 -11.830 3.230 -4.271 126 HB VAL 17 HB VAL 17 -12.713 5.050 -2.019 127 HG11 VAL 17 1HG1 VAL 17 -10.341 5.637 -1.801 128 HG12 VAL 17 2HG1 VAL 17 -9.932 4.408 -2.998 129 HG13 VAL 17 3HG1 VAL 17 -10.627 3.932 -1.449 130 HG21 VAL 17 3HG2 VAL 17 -13.084 5.993 -4.235 131 HG22 VAL 17 1HG2 VAL 17 -11.406 5.666 -4.666 132 HG23 VAL 17 2HG2 VAL 17 -11.780 6.836 -3.400 133 H ILE 18 H ILE 18 -14.023 2.962 -1.501 134 HA ILE 18 HA ILE 18 -12.369 1.457 0.179 135 HB ILE 18 HB ILE 18 -15.386 1.332 0.009 136 HG12 ILE 18 2HG1 ILE 18 -13.624 3.101 1.717 137 HG13 ILE 18 1HG1 ILE 18 -14.518 3.634 0.297 138 HG21 ILE 18 1HG2 ILE 18 -13.515 0.645 2.273 139 HG22 ILE 18 2HG2 ILE 18 -14.448 -0.497 1.307 140 HG23 ILE 18 3HG2 ILE 18 -15.277 0.652 2.360 141 HD11 ILE 18 3HD1 ILE 18 -15.712 2.555 2.838 142 HD12 ILE 18 1HD1 ILE 18 -16.615 3.064 1.411 143 HD13 ILE 18 2HD1 ILE 18 -15.678 4.244 2.329 144 H ARG 19 H ARG 19 -14.839 0.370 -2.144 145 HA ARG 19 HA ARG 19 -14.574 -2.387 -1.629 146 HB2 ARG 19 2HB ARG 19 -15.432 -1.076 -4.218 147 HB3 ARG 19 1HB ARG 19 -15.768 -2.730 -3.722 148 HG2 ARG 19 2HG ARG 19 -17.114 -1.892 -1.859 149 HG3 ARG 19 1HG ARG 19 -16.791 -0.237 -2.379 150 HD2 ARG 19 2HD ARG 19 -18.936 -0.825 -3.214 151 HD3 ARG 19 1HD ARG 19 -17.830 -0.830 -4.586 152 HE ARG 19 HE ARG 19 -18.048 -3.421 -3.435 153 HH11 ARG 19 1HH1 ARG 19 -19.821 -1.156 -5.448 154 HH12 ARG 19 2HH1 ARG 19 -20.667 -2.407 -6.317 155 HH21 ARG 19 1HH2 ARG 19 -19.167 -5.041 -4.542 156 HH22 ARG 19 2HH2 ARG 19 -20.276 -4.630 -5.814 157 H ALA 20 H ALA 20 -12.753 -0.206 -3.640 158 HA ALA 20 HA ALA 20 -11.446 -2.201 -5.202 159 HB1 ALA 20 3HB ALA 20 -11.629 0.114 -5.955 160 HB2 ALA 20 1HB ALA 20 -9.944 -0.401 -5.878 161 HB3 ALA 20 2HB ALA 20 -10.609 0.637 -4.615 162 H VAL 21 H VAL 21 -10.495 -0.310 -2.345 163 HA VAL 21 HA VAL 21 -7.895 -1.352 -2.106 164 HB VAL 21 HB VAL 21 -9.650 -0.308 0.125 165 HG11 VAL 21 1HG1 VAL 21 -6.646 -0.503 -0.081 166 HG12 VAL 21 2HG1 VAL 21 -7.677 -1.523 0.921 167 HG13 VAL 21 3HG1 VAL 21 -7.551 0.204 1.257 168 HG21 VAL 21 3HG2 VAL 21 -7.729 1.154 -1.682 169 HG22 VAL 21 1HG2 VAL 21 -8.551 1.849 -0.287 170 HG23 VAL 21 2HG2 VAL 21 -9.485 1.310 -1.683 171 H TYR 22 H TYR 22 -10.931 -2.336 -0.495 172 HA TYR 22 HA TYR 22 -9.824 -5.009 -0.253 173 HB2 TYR 22 2HB TYR 22 -10.547 -5.191 2.140 174 HB3 TYR 22 1HB TYR 22 -9.165 -4.140 1.871 175 HD1 TYR 22 HD1 TYR 22 -12.860 -4.065 2.408 176 HD2 TYR 22 HD2 TYR 22 -9.169 -1.965 2.701 177 HE1 TYR 22 HE1 TYR 22 -13.978 -2.285 3.676 178 HE2 TYR 22 HE2 TYR 22 -10.281 -0.174 3.964 179 HH TYR 22 HH TYR 22 -12.564 0.734 4.261 180 H ARG 23 H ARG 23 -11.386 -6.641 0.172 181 HA ARG 23 HA ARG 23 -14.192 -5.960 0.102 182 HB2 ARG 23 2HB ARG 23 -13.613 -5.805 -2.267 183 HB3 ARG 23 1HB ARG 23 -12.879 -7.400 -2.212 184 HG2 ARG 23 2HG ARG 23 -15.065 -8.392 -1.745 185 HG3 ARG 23 1HG ARG 23 -15.798 -6.785 -1.805 186 HD2 ARG 23 2HD ARG 23 -15.083 -6.538 -4.124 187 HD3 ARG 23 1HD ARG 23 -14.316 -8.122 -4.065 188 HE ARG 23 HE ARG 23 -16.722 -8.910 -3.550 189 HH11 ARG 23 1HH1 ARG 23 -15.833 -6.268 -5.664 190 HH12 ARG 23 2HH1 ARG 23 -17.229 -6.427 -6.688 191 HH21 ARG 23 1HH2 ARG 23 -18.549 -9.161 -4.907 192 HH22 ARG 23 2HH2 ARG 23 -18.755 -8.118 -6.284 193 H GLN 24 H GLN 24 -12.231 -8.777 -0.868 194 HA GLN 24 HA GLN 24 -12.450 -10.232 1.505 195 HB2 GLN 24 2HB GLN 24 -14.910 -10.150 0.834 196 HB3 GLN 24 1HB GLN 24 -14.479 -11.190 -0.518 197 HG2 GLN 24 2HG GLN 24 -13.545 -12.805 1.175 198 HG3 GLN 24 1HG GLN 24 -14.301 -11.808 2.417 199 HE21 GLN 24 1HE2 GLN 24 -14.817 -14.566 1.734 200 HE22 GLN 24 2HE2 GLN 24 -16.488 -14.662 1.303 201 H VAL 25 H VAL 25 -11.502 -9.811 -1.635 202 HA VAL 25 HA VAL 25 -10.652 -11.046 -3.326 203 HB VAL 25 HB VAL 25 -8.596 -12.396 -2.636 204 HG11 VAL 25 1HG1 VAL 25 -7.317 -10.348 -2.219 205 HG12 VAL 25 2HG1 VAL 25 -8.819 -9.483 -1.898 206 HG13 VAL 25 3HG1 VAL 25 -8.503 -10.138 -3.505 207 HG21 VAL 25 3HG2 VAL 25 -9.195 -12.857 -0.308 208 HG22 VAL 25 1HG2 VAL 25 -9.191 -11.127 0.043 209 HG23 VAL 25 2HG2 VAL 25 -7.692 -11.940 -0.407 210 H LEU 26 H LEU 26 -9.889 -13.755 -1.233 211 HA LEU 26 HA LEU 26 -12.062 -15.324 -2.383 212 HB2 LEU 26 2HB LEU 26 -9.134 -15.995 -2.699 213 HB3 LEU 26 1HB LEU 26 -10.420 -17.163 -2.931 214 HG LEU 26 HG LEU 26 -10.103 -14.633 -4.552 215 HD11 LEU 26 1HD1 LEU 26 -8.248 -16.159 -4.949 216 HD12 LEU 26 2HD1 LEU 26 -9.331 -16.116 -6.340 217 HD13 LEU 26 3HD1 LEU 26 -9.380 -17.482 -5.227 218 HD21 LEU 26 3HD2 LEU 26 -12.405 -15.451 -4.411 219 HD22 LEU 26 1HD2 LEU 26 -11.873 -17.048 -4.932 220 HD23 LEU 26 2HD2 LEU 26 -11.746 -15.675 -6.031 221 H GLY 27 H GLY 27 -12.952 -16.555 -0.844 222 HA2 GLY 27 2HA GLY 27 -11.476 -18.128 0.965 223 HA3 GLY 27 1HA GLY 27 -12.005 -16.667 1.786 224 H ASN 28 H ASN 28 -12.810 -19.180 2.594 225 HA ASN 28 HA ASN 28 -15.639 -19.292 1.772 226 HB2 ASN 28 2HB ASN 28 -14.507 -21.433 1.563 227 HB3 ASN 28 1HB ASN 28 -13.913 -21.321 3.216 228 HD21 ASN 28 1HD2 ASN 28 -16.633 -21.992 1.182 229 HD22 ASN 28 2HD2 ASN 28 -17.656 -22.641 2.425 230 H ASP 29 H ASP 29 -13.761 -19.904 4.730 231 HA ASP 29 HA ASP 29 -15.841 -18.719 6.374 232 HB2 ASP 29 2HB ASP 29 -14.526 -19.437 8.264 233 HB3 ASP 29 1HB ASP 29 -14.556 -20.760 7.103 234 H TYR 30 H TYR 30 -13.002 -17.837 4.758 235 HA TYR 30 HA TYR 30 -12.323 -15.561 6.361 236 HB2 TYR 30 2HB TYR 30 -10.704 -16.811 4.890 237 HB3 TYR 30 1HB TYR 30 -11.542 -16.146 3.494 238 HD1 TYR 30 HD2 TYR 30 -9.719 -15.114 6.574 239 HD2 TYR 30 HD1 TYR 30 -10.861 -14.105 2.602 240 HE1 TYR 30 HE2 TYR 30 -8.261 -13.137 6.663 241 HE2 TYR 30 HE1 TYR 30 -9.405 -12.126 2.680 242 HH TYR 30 HH TYR 30 -7.079 -11.657 5.137 243 H VAL 31 H VAL 31 -14.504 -14.734 6.467 244 HA VAL 31 HA VAL 31 -15.067 -12.941 4.197 245 HB VAL 31 HB VAL 31 -16.776 -14.740 4.365 246 HG11 VAL 31 1HG1 VAL 31 -16.693 -15.144 6.757 247 HG12 VAL 31 2HG1 VAL 31 -18.339 -14.763 6.251 248 HG13 VAL 31 3HG1 VAL 31 -17.364 -13.543 7.070 249 HG21 VAL 31 3HG2 VAL 31 -18.746 -13.276 4.329 250 HG22 VAL 31 1HG2 VAL 31 -17.394 -12.589 3.429 251 HG23 VAL 31 2HG2 VAL 31 -17.784 -11.978 5.037 252 H MET 32 H MET 32 -14.378 -13.352 7.465 253 HA MET 32 HA MET 32 -15.578 -10.936 8.447 254 HB2 MET 32 2HB MET 32 -13.641 -12.918 9.626 255 HB3 MET 32 1HB MET 32 -14.072 -11.432 10.461 256 HG2 MET 32 2HG MET 32 -16.026 -13.544 9.577 257 HG3 MET 32 1HG MET 32 -15.373 -13.386 11.208 258 HE1 MET 32 3HE MET 32 -17.874 -13.327 12.162 259 HE2 MET 32 1HE MET 32 -18.500 -13.473 10.519 260 HE3 MET 32 2HE MET 32 -19.105 -12.204 11.584 261 H ALA 33 H ALA 33 -14.088 -9.380 9.666 262 HA ALA 33 HA ALA 33 -12.436 -7.829 9.709 263 HB1 ALA 33 3HB ALA 33 -10.935 -9.588 7.775 264 HB2 ALA 33 1HB ALA 33 -10.816 -9.659 9.532 265 HB3 ALA 33 2HB ALA 33 -10.278 -8.218 8.669 266 H SER 34 H SER 34 -14.374 -8.512 7.217 267 HA SER 34 HA SER 34 -13.413 -6.910 5.110 268 HB2 SER 34 2HB SER 34 -16.052 -6.877 4.663 269 HB3 SER 34 1HB SER 34 -15.070 -8.312 4.370 270 HG SER 34 HG SER 34 -16.100 -9.303 5.905 271 H GLU 35 H GLU 35 -15.105 -6.168 8.055 272 HA GLU 35 HA GLU 35 -14.952 -3.319 7.331 273 HB2 GLU 35 2HB GLU 35 -16.881 -2.908 8.813 274 HB3 GLU 35 1HB GLU 35 -17.295 -3.972 7.478 275 HG2 GLU 35 2HG GLU 35 -17.282 -5.882 8.894 276 HG3 GLU 35 1HG GLU 35 -16.605 -4.955 10.232 277 H ARG 36 H ARG 36 -13.012 -5.121 8.624 278 HA ARG 36 HA ARG 36 -12.979 -4.744 11.419 279 HB2 ARG 36 2HB ARG 36 -11.657 -6.496 10.463 280 HB3 ARG 36 1HB ARG 36 -10.780 -5.360 9.447 281 HG2 ARG 36 2HG ARG 36 -9.737 -4.383 11.420 282 HG3 ARG 36 1HG ARG 36 -10.635 -5.498 12.451 283 HD2 ARG 36 2HD ARG 36 -8.720 -6.373 10.295 284 HD3 ARG 36 1HD ARG 36 -8.261 -6.161 11.983 285 HE ARG 36 HE ARG 36 -9.809 -8.322 10.853 286 HH11 ARG 36 1HH1 ARG 36 -8.936 -6.579 13.750 287 HH12 ARG 36 2HH1 ARG 36 -9.305 -7.893 14.822 288 HH21 ARG 36 1HH2 ARG 36 -10.277 -10.092 12.264 289 HH22 ARG 36 2HH2 ARG 36 -10.061 -9.893 13.977 290 H LEU 37 H LEU 37 -11.871 -2.764 8.772 291 HA LEU 37 HA LEU 37 -10.300 -1.083 10.554 292 HB2 LEU 37 2HB LEU 37 -10.643 -1.045 7.560 293 HB3 LEU 37 1HB LEU 37 -9.606 0.049 8.455 294 HG LEU 37 HG LEU 37 -9.282 -2.950 8.307 295 HD11 LEU 37 1HD1 LEU 37 -7.289 -2.445 6.999 296 HD12 LEU 37 2HD1 LEU 37 -7.669 -0.724 7.071 297 HD13 LEU 37 3HD1 LEU 37 -8.742 -1.828 6.211 298 HD21 LEU 37 3HD2 LEU 37 -7.541 -0.852 9.599 299 HD22 LEU 37 1HD2 LEU 37 -7.171 -2.574 9.475 300 HD23 LEU 37 2HD2 LEU 37 -8.538 -2.032 10.449 301 H VAL 38 H VAL 38 -12.934 -0.857 11.222 302 HA VAL 38 HA VAL 38 -14.346 1.228 9.978 303 HB VAL 38 HB VAL 38 -14.309 0.568 12.934 304 HG11 VAL 38 1HG1 VAL 38 -16.536 1.595 12.970 305 HG12 VAL 38 2HG1 VAL 38 -16.350 2.042 11.274 306 HG13 VAL 38 3HG1 VAL 38 -15.289 2.747 12.494 307 HG21 VAL 38 3HG2 VAL 38 -16.316 -0.764 12.452 308 HG22 VAL 38 1HG2 VAL 38 -14.887 -1.387 11.628 309 HG23 VAL 38 2HG2 VAL 38 -16.089 -0.459 10.731 310 H SER 39 H SER 39 -11.804 1.243 12.412 311 HA SER 39 HA SER 39 -11.770 3.954 13.033 312 HB2 SER 39 2HB SER 39 -9.314 2.209 12.807 313 HB3 SER 39 1HB SER 39 -9.587 3.561 13.907 314 HG SER 39 HG SER 39 -11.019 2.341 15.066 315 H ALA 40 H ALA 40 -9.983 2.186 10.513 316 HA ALA 40 HA ALA 40 -8.672 4.430 9.426 317 HB1 ALA 40 3HB ALA 40 -9.377 1.823 8.083 318 HB2 ALA 40 1HB ALA 40 -7.919 2.141 9.024 319 HB3 ALA 40 2HB ALA 40 -8.196 2.998 7.508 320 H GLU 41 H GLU 41 -11.704 2.816 8.602 321 HA GLU 41 HA GLU 41 -12.528 4.285 6.410 322 HB2 GLU 41 2HB GLU 41 -13.789 2.393 7.150 323 HB3 GLU 41 1HB GLU 41 -14.066 3.110 8.731 324 HG2 GLU 41 2HG GLU 41 -16.102 3.351 7.686 325 HG3 GLU 41 1HG GLU 41 -15.350 4.923 7.431 326 H SER 42 H SER 42 -13.089 5.008 9.851 327 HA SER 42 HA SER 42 -14.393 7.470 9.418 328 HB2 SER 42 2HB SER 42 -14.527 6.132 11.522 329 HB3 SER 42 1HB SER 42 -12.866 6.596 11.882 330 HG SER 42 HG SER 42 -14.072 8.838 11.387 331 H LEU 43 H LEU 43 -10.991 6.647 9.997 332 HA LEU 43 HA LEU 43 -10.009 9.263 10.317 333 HB2 LEU 43 2HB LEU 43 -8.617 6.852 9.141 334 HB3 LEU 43 1HB LEU 43 -7.817 8.327 9.644 335 HG LEU 43 HG LEU 43 -9.292 6.423 11.464 336 HD11 LEU 43 1HD1 LEU 43 -7.075 5.887 12.334 337 HD12 LEU 43 2HD1 LEU 43 -6.342 6.936 11.122 338 HD13 LEU 43 3HD1 LEU 43 -7.211 5.483 10.625 339 HD21 LEU 43 3HD2 LEU 43 -9.405 8.750 12.235 340 HD22 LEU 43 1HD2 LEU 43 -7.647 8.861 12.133 341 HD23 LEU 43 2HD2 LEU 43 -8.395 7.757 13.285 342 H LEU 44 H LEU 44 -10.422 7.257 7.436 343 HA LEU 44 HA LEU 44 -9.257 9.094 5.622 344 HB2 LEU 44 2HB LEU 44 -9.568 6.665 5.196 345 HB3 LEU 44 1HB LEU 44 -11.295 6.937 5.072 346 HG LEU 44 HG LEU 44 -10.914 8.385 3.106 347 HD11 LEU 44 1HD1 LEU 44 -8.704 8.382 2.037 348 HD12 LEU 44 2HD1 LEU 44 -8.041 7.529 3.431 349 HD13 LEU 44 3HD1 LEU 44 -8.674 9.165 3.617 350 HD21 LEU 44 3HD2 LEU 44 -11.431 6.046 2.769 351 HD22 LEU 44 1HD2 LEU 44 -9.729 5.617 2.946 352 HD23 LEU 44 2HD2 LEU 44 -10.257 6.576 1.564 353 H ARG 45 H ARG 45 -12.599 8.497 6.642 354 HA ARG 45 HA ARG 45 -13.779 10.299 4.803 355 HB2 ARG 45 2HB ARG 45 -14.796 9.162 7.404 356 HB3 ARG 45 1HB ARG 45 -15.773 10.147 6.323 357 HG2 ARG 45 2HG ARG 45 -15.330 8.478 4.528 358 HG3 ARG 45 1HG ARG 45 -14.552 7.464 5.744 359 HD2 ARG 45 2HD ARG 45 -16.599 7.278 6.980 360 HD3 ARG 45 1HD ARG 45 -17.393 8.453 5.927 361 HE ARG 45 HE ARG 45 -16.476 5.783 5.043 362 HH11 ARG 45 1HH1 ARG 45 -18.759 8.455 4.930 363 HH12 ARG 45 2HH1 ARG 45 -19.742 7.720 3.690 364 HH21 ARG 45 1HH2 ARG 45 -17.780 4.827 3.442 365 HH22 ARG 45 2HH2 ARG 45 -19.183 5.672 2.837 366 H ASN 46 H ASN 46 -12.366 10.731 7.961 367 HA ASN 46 HA ASN 46 -13.441 13.395 8.274 368 HB2 ASN 46 2HB ASN 46 -12.928 11.885 10.210 369 HB3 ASN 46 1HB ASN 46 -11.217 12.058 9.834 370 HD21 ASN 46 1HD2 ASN 46 -14.060 13.637 11.056 371 HD22 ASN 46 2HD2 ASN 46 -13.247 15.005 11.745 372 H GLY 47 H GLY 47 -10.957 11.991 6.520 373 HA2 GLY 47 2HA GLY 47 -9.427 12.983 5.101 374 HA3 GLY 47 1HA GLY 47 -9.907 14.552 5.734 375 H LYS 48 H LYS 48 -8.796 11.838 7.663 376 HA LYS 48 HA LYS 48 -6.734 13.545 8.796 377 HB2 LYS 48 2HB LYS 48 -7.654 10.767 9.551 378 HB3 LYS 48 1HB LYS 48 -6.455 11.705 10.432 379 HG2 LYS 48 2HG LYS 48 -8.131 13.401 10.927 380 HG3 LYS 48 1HG LYS 48 -9.334 12.479 10.022 381 HD2 LYS 48 2HD LYS 48 -9.130 10.632 11.582 382 HD3 LYS 48 1HD LYS 48 -7.859 11.486 12.460 383 HE2 LYS 48 2HE LYS 48 -10.711 12.423 12.145 384 HE3 LYS 48 1HE LYS 48 -10.037 11.655 13.582 385 HZ1 LYS 48 3HZ LYS 48 -9.093 14.223 12.423 386 HZ2 LYS 48 1HZ LYS 48 -8.530 13.498 13.847 387 HZ3 LYS 48 2HZ LYS 48 -10.120 14.083 13.765 388 H ILE 49 H ILE 49 -6.998 10.481 7.049 389 HA ILE 49 HA ILE 49 -4.067 10.499 6.749 390 HB ILE 49 HB ILE 49 -4.183 8.050 6.451 391 HG12 ILE 49 2HG1 ILE 49 -7.063 8.354 7.328 392 HG13 ILE 49 1HG1 ILE 49 -6.538 7.925 5.705 393 HG21 ILE 49 1HG2 ILE 49 -3.627 8.984 8.627 394 HG22 ILE 49 2HG2 ILE 49 -4.542 7.488 8.807 395 HG23 ILE 49 3HG2 ILE 49 -5.337 9.044 9.052 396 HD11 ILE 49 3HD1 ILE 49 -7.283 5.982 6.976 397 HD12 ILE 49 1HD1 ILE 49 -6.041 6.298 8.188 398 HD13 ILE 49 2HD1 ILE 49 -5.578 5.861 6.542 399 H THR 50 H THR 50 -3.212 9.733 4.758 400 HA THR 50 HA THR 50 -4.869 10.359 2.461 401 HB THR 50 HB THR 50 -2.785 9.901 1.164 402 HG1 THR 50 HG1 THR 50 -1.377 9.781 3.604 403 HG21 THR 50 3HG2 THR 50 -3.255 12.160 1.959 404 HG22 THR 50 1HG2 THR 50 -1.523 11.832 2.000 405 HG23 THR 50 2HG2 THR 50 -2.464 11.798 3.493 406 H VAL 51 H VAL 51 -4.590 8.800 0.512 407 HA VAL 51 HA VAL 51 -5.667 6.278 1.178 408 HB VAL 51 HB VAL 51 -4.390 7.164 -1.420 409 HG11 VAL 51 1HG1 VAL 51 -5.695 5.357 -2.446 410 HG12 VAL 51 2HG1 VAL 51 -6.227 4.842 -0.846 411 HG13 VAL 51 3HG1 VAL 51 -4.523 4.737 -1.282 412 HG21 VAL 51 3HG2 VAL 51 -6.683 7.593 -2.157 413 HG22 VAL 51 1HG2 VAL 51 -6.267 8.577 -0.752 414 HG23 VAL 51 2HG2 VAL 51 -7.281 7.146 -0.560 415 H ARG 52 H ARG 52 -2.417 7.396 0.425 416 HA ARG 52 HA ARG 52 -1.031 5.004 0.299 417 HB2 ARG 52 2HB ARG 52 0.039 7.151 -0.130 418 HB3 ARG 52 1HB ARG 52 -0.184 7.628 1.549 419 HG2 ARG 52 2HG ARG 52 1.324 5.849 2.265 420 HG3 ARG 52 1HG ARG 52 1.537 5.352 0.585 421 HD2 ARG 52 2HD ARG 52 3.415 6.700 1.313 422 HD3 ARG 52 1HD ARG 52 2.502 7.548 0.067 423 HE ARG 52 HE ARG 52 1.485 8.843 1.942 424 HH11 ARG 52 1HH1 ARG 52 4.609 7.295 2.333 425 HH12 ARG 52 2HH1 ARG 52 5.161 8.434 3.532 426 HH21 ARG 52 1HH2 ARG 52 2.223 10.337 3.534 427 HH22 ARG 52 2HH2 ARG 52 3.824 10.150 4.191 428 H GLU 53 H GLU 53 -1.802 6.943 3.174 429 HA GLU 53 HA GLU 53 -0.661 5.133 5.037 430 HB2 GLU 53 2HB GLU 53 -2.771 7.263 5.429 431 HB3 GLU 53 1HB GLU 53 -1.885 6.465 6.720 432 HG2 GLU 53 2HG GLU 53 0.159 7.459 6.049 433 HG3 GLU 53 1HG GLU 53 -0.546 8.049 4.545 434 H PHE 54 H PHE 54 -3.937 5.644 3.827 435 HA PHE 54 HA PHE 54 -5.325 3.901 5.502 436 HB2 PHE 54 2HB PHE 54 -6.387 5.531 3.983 437 HB3 PHE 54 1HB PHE 54 -5.880 4.567 2.602 438 HD1 PHE 54 HD1 PHE 54 -8.043 4.551 5.610 439 HD2 PHE 54 HD2 PHE 54 -7.167 2.753 1.851 440 HE1 PHE 54 HE1 PHE 54 -10.141 3.273 5.740 441 HE2 PHE 54 HE2 PHE 54 -9.263 1.470 1.979 442 HZ PHE 54 HZ PHE 54 -10.753 1.729 3.923 443 H VAL 55 H VAL 55 -3.770 3.277 2.362 444 HA VAL 55 HA VAL 55 -4.563 0.567 2.224 445 HB VAL 55 HB VAL 55 -2.245 1.942 0.854 446 HG11 VAL 55 1HG1 VAL 55 -2.339 0.085 -0.748 447 HG12 VAL 55 2HG1 VAL 55 -3.552 -0.712 0.252 448 HG13 VAL 55 3HG1 VAL 55 -1.919 -0.466 0.872 449 HG21 VAL 55 3HG2 VAL 55 -3.764 2.041 -1.073 450 HG22 VAL 55 1HG2 VAL 55 -4.386 2.943 0.308 451 HG23 VAL 55 2HG2 VAL 55 -5.053 1.356 -0.082 452 H ARG 56 H ARG 56 -1.740 2.152 3.672 453 HA ARG 56 HA ARG 56 -0.257 -0.206 4.128 454 HB2 ARG 56 2HB ARG 56 0.757 2.019 4.424 455 HB3 ARG 56 1HB ARG 56 -0.277 2.306 5.822 456 HG2 ARG 56 2HG ARG 56 0.766 0.480 7.014 457 HG3 ARG 56 1HG ARG 56 1.739 0.076 5.602 458 HD2 ARG 56 2HD ARG 56 2.863 2.248 5.766 459 HD3 ARG 56 1HD ARG 56 1.890 2.641 7.186 460 HE ARG 56 HE ARG 56 3.001 0.362 7.967 461 HH11 ARG 56 1HH1 ARG 56 4.468 3.144 6.443 462 HH12 ARG 56 2HH1 ARG 56 6.036 2.865 7.149 463 HH21 ARG 56 1HH2 ARG 56 5.048 -0.012 8.910 464 HH22 ARG 56 2HH2 ARG 56 6.351 1.086 8.546 465 H ALA 57 H ALA 57 -2.806 1.379 5.973 466 HA ALA 57 HA ALA 57 -2.705 -0.297 8.244 467 HB1 ALA 57 3HB ALA 57 -5.094 1.154 7.104 468 HB2 ALA 57 1HB ALA 57 -3.898 1.850 8.199 469 HB3 ALA 57 2HB ALA 57 -4.931 0.530 8.746 470 H VAL 58 H VAL 58 -4.286 -0.587 5.129 471 HA VAL 58 HA VAL 58 -5.807 -2.912 5.764 472 HB VAL 58 HB VAL 58 -4.877 -1.958 3.047 473 HG11 VAL 58 1HG1 VAL 58 -6.796 -3.235 2.193 474 HG12 VAL 58 2HG1 VAL 58 -7.128 -3.813 3.826 475 HG13 VAL 58 3HG1 VAL 58 -5.631 -4.273 3.016 476 HG21 VAL 58 3HG2 VAL 58 -7.451 -1.379 4.508 477 HG22 VAL 58 1HG2 VAL 58 -7.048 -0.864 2.870 478 HG23 VAL 58 2HG2 VAL 58 -6.137 -0.234 4.243 479 H ALA 59 H ALA 59 -2.619 -2.339 4.368 480 HA ALA 59 HA ALA 59 -2.034 -4.981 3.630 481 HB1 ALA 59 3HB ALA 59 -0.091 -2.844 4.494 482 HB2 ALA 59 1HB ALA 59 -0.759 -3.017 2.872 483 HB3 ALA 59 2HB ALA 59 0.278 -4.278 3.535 484 H LYS 60 H LYS 60 -1.889 -3.360 6.718 485 HA LYS 60 HA LYS 60 -0.610 -5.726 7.907 486 HB2 LYS 60 2HB LYS 60 -0.161 -4.295 9.863 487 HB3 LYS 60 1HB LYS 60 0.550 -3.650 8.391 488 HG2 LYS 60 2HG LYS 60 -1.171 -1.989 8.219 489 HG3 LYS 60 1HG LYS 60 -2.057 -2.705 9.566 490 HD2 LYS 60 2HD LYS 60 -0.778 -0.677 10.196 491 HD3 LYS 60 1HD LYS 60 -0.295 -2.114 11.100 492 HE2 LYS 60 2HE LYS 60 1.624 -2.404 9.610 493 HE3 LYS 60 1HE LYS 60 1.139 -0.971 8.703 494 HZ1 LYS 60 3HZ LYS 60 2.937 -0.727 10.479 495 HZ2 LYS 60 1HZ LYS 60 1.679 -0.834 11.609 496 HZ3 LYS 60 2HZ LYS 60 1.685 0.423 10.467 497 H SER 61 H SER 61 -3.572 -5.153 7.172 498 HA SER 61 HA SER 61 -4.896 -5.105 9.718 499 HB2 SER 61 2HB SER 61 -6.961 -5.405 8.448 500 HB3 SER 61 1HB SER 61 -5.956 -4.176 7.681 501 HG SER 61 HG SER 61 -5.464 -5.560 6.067 502 H GLU 62 H GLU 62 -3.803 -7.570 7.504 503 HA GLU 62 HA GLU 62 -5.230 -9.670 8.886 504 HB2 GLU 62 2HB GLU 62 -4.828 -9.728 6.420 505 HB3 GLU 62 1HB GLU 62 -3.110 -9.910 6.744 506 HG2 GLU 62 2HG GLU 62 -3.434 -12.038 7.740 507 HG3 GLU 62 1HG GLU 62 -5.185 -11.828 7.761 508 H LEU 63 H LEU 63 -4.522 -9.942 10.896 509 HA LEU 63 HA LEU 63 -1.678 -9.844 11.490 510 HB2 LEU 63 2HB LEU 63 -2.603 -10.116 13.887 511 HB3 LEU 63 1HB LEU 63 -2.831 -8.597 13.047 512 HG LEU 63 HG LEU 63 -5.153 -9.438 12.426 513 HD11 LEU 63 1HD1 LEU 63 -4.554 -11.432 14.606 514 HD12 LEU 63 2HD1 LEU 63 -4.795 -11.805 12.899 515 HD13 LEU 63 3HD1 LEU 63 -6.126 -11.151 13.855 516 HD21 LEU 63 3HD2 LEU 63 -4.765 -7.731 14.114 517 HD22 LEU 63 1HD2 LEU 63 -4.503 -8.977 15.334 518 HD23 LEU 63 2HD2 LEU 63 -6.090 -8.792 14.589 519 H TYR 64 H TYR 64 -3.192 -12.145 10.135 520 HA TYR 64 HA TYR 64 -2.734 -14.295 12.050 521 HB2 TYR 64 2HB TYR 64 -3.802 -14.456 9.218 522 HB3 TYR 64 1HB TYR 64 -3.834 -15.739 10.425 523 HD1 TYR 64 HD1 TYR 64 -5.364 -15.574 12.368 524 HD2 TYR 64 HD2 TYR 64 -5.403 -12.685 9.244 525 HE1 TYR 64 HE1 TYR 64 -7.553 -14.768 13.148 526 HE2 TYR 64 HE2 TYR 64 -7.594 -11.871 10.012 527 HH TYR 64 HH TYR 64 -8.960 -12.854 13.029 528 H LYS 65 H LYS 65 -0.439 -13.942 12.100 529 HA LYS 65 HA LYS 65 1.271 -13.866 9.928 530 HB2 LYS 65 2HB LYS 65 1.770 -14.938 12.702 531 HB3 LYS 65 1HB LYS 65 3.033 -14.666 11.513 532 HG2 LYS 65 2HG LYS 65 2.438 -12.274 11.467 533 HG3 LYS 65 1HG LYS 65 1.241 -12.576 12.730 534 HD2 LYS 65 2HD LYS 65 2.988 -13.348 14.234 535 HD3 LYS 65 1HD LYS 65 4.198 -13.123 12.971 536 HE2 LYS 65 2HE LYS 65 4.263 -11.276 14.535 537 HE3 LYS 65 1HE LYS 65 3.711 -10.717 12.957 538 HZ1 LYS 65 3HZ LYS 65 1.789 -11.468 15.072 539 HZ2 LYS 65 1HZ LYS 65 1.537 -10.483 13.714 540 HZ3 LYS 65 2HZ LYS 65 2.467 -9.913 15.015 541 H GLU 66 H GLU 66 0.569 -16.741 11.920 542 HA GLU 66 HA GLU 66 2.228 -18.459 10.416 543 HB2 GLU 66 2HB GLU 66 -0.011 -19.088 12.342 544 HB3 GLU 66 1HB GLU 66 1.133 -20.267 11.719 545 HG2 GLU 66 2HG GLU 66 1.933 -17.833 13.295 546 HG3 GLU 66 1HG GLU 66 1.635 -19.416 14.007 547 H LYS 67 H LYS 67 -0.463 -17.092 9.269 548 HA LYS 67 HA LYS 67 -1.569 -19.474 8.001 549 HB2 LYS 67 2HB LYS 67 -3.055 -17.681 8.916 550 HB3 LYS 67 1HB LYS 67 -2.411 -16.582 7.708 551 HG2 LYS 67 2HG LYS 67 -3.616 -19.136 6.784 552 HG3 LYS 67 1HG LYS 67 -4.687 -17.857 7.353 553 HD2 LYS 67 2HD LYS 67 -2.617 -17.577 5.172 554 HD3 LYS 67 1HD LYS 67 -4.355 -17.755 4.925 555 HE2 LYS 67 2HE LYS 67 -4.704 -15.675 6.218 556 HE3 LYS 67 1HE LYS 67 -2.956 -15.484 6.328 557 HZ1 LYS 67 3HZ LYS 67 -4.628 -15.414 3.878 558 HZ2 LYS 67 1HZ LYS 67 -2.934 -15.471 3.854 559 HZ3 LYS 67 2HZ LYS 67 -3.720 -14.146 4.552 560 H PHE 68 H PHE 68 0.418 -16.683 7.278 561 HA PHE 68 HA PHE 68 0.886 -17.780 4.600 562 HB2 PHE 68 2HB PHE 68 0.703 -15.617 3.534 563 HB3 PHE 68 1HB PHE 68 -0.794 -15.971 4.384 564 HD1 PHE 68 HD1 PHE 68 -1.211 -14.845 6.609 565 HD2 PHE 68 HD2 PHE 68 1.933 -13.678 3.988 566 HE1 PHE 68 HE1 PHE 68 -1.053 -12.682 7.769 567 HE2 PHE 68 HE2 PHE 68 2.097 -11.513 5.145 568 HZ PHE 68 HZ PHE 68 0.603 -11.015 7.040 569 H LEU 69 H LEU 69 2.003 -15.868 7.294 570 HA LEU 69 HA LEU 69 4.560 -15.328 5.991 571 HB2 LEU 69 2HB LEU 69 3.374 -13.509 7.173 572 HB3 LEU 69 1HB LEU 69 3.474 -14.427 8.663 573 HG LEU 69 HG LEU 69 5.955 -14.276 8.536 574 HD11 LEU 69 1HD1 LEU 69 6.952 -12.649 7.015 575 HD12 LEU 69 2HD1 LEU 69 5.381 -12.386 6.257 576 HD13 LEU 69 3HD1 LEU 69 6.172 -13.958 6.129 577 HD21 LEU 69 3HD2 LEU 69 4.648 -12.722 9.897 578 HD22 LEU 69 1HD2 LEU 69 4.490 -11.641 8.514 579 HD23 LEU 69 2HD2 LEU 69 6.076 -11.940 9.222 580 H TYR 70 H TYR 70 6.512 -16.025 6.798 581 HA TYR 70 HA TYR 70 8.050 -17.239 7.918 582 HB2 TYR 70 2HB TYR 70 7.069 -16.367 9.980 583 HB3 TYR 70 1HB TYR 70 5.873 -17.658 9.973 584 HD1 TYR 70 HD2 TYR 70 9.438 -16.870 10.459 585 HD2 TYR 70 HD1 TYR 70 6.430 -19.872 10.719 586 HE1 TYR 70 HE2 TYR 70 10.974 -18.295 11.744 587 HE2 TYR 70 HE1 TYR 70 7.962 -21.301 12.004 588 HH TYR 70 HH TYR 70 10.354 -21.592 12.336 589 H GLY 71 H GLY 71 4.878 -18.823 7.921 590 HA2 GLY 71 2HA GLY 71 5.688 -21.424 8.378 591 HA3 GLY 71 1HA GLY 71 4.235 -20.975 7.505 592 H ASN 72 H ASN 72 4.912 -20.143 5.107 593 HA ASN 72 HA ASN 72 6.779 -22.108 4.017 594 HB2 ASN 72 2HB ASN 72 4.503 -23.169 4.306 595 HB3 ASN 72 1HB ASN 72 3.894 -22.019 3.125 596 HD21 ASN 72 1HD2 ASN 72 7.082 -23.415 2.918 597 HD22 ASN 72 2HD2 ASN 72 6.766 -24.414 1.537 598 H PHE 73 H PHE 73 7.926 -21.233 2.473 599 HA PHE 73 HA PHE 73 8.658 -19.928 0.787 600 HB2 PHE 73 2HB PHE 73 5.727 -19.977 0.091 601 HB3 PHE 73 1HB PHE 73 6.941 -19.218 -0.933 602 HD1 PHE 73 HD1 PHE 73 9.049 -20.820 -1.396 603 HD2 PHE 73 HD2 PHE 73 5.108 -22.114 -0.443 604 HE1 PHE 73 HE1 PHE 73 9.504 -22.985 -2.474 605 HE2 PHE 73 HE2 PHE 73 5.556 -24.281 -1.516 606 HZ PHE 73 HZ PHE 73 7.756 -24.719 -2.533 607 H GLN 74 H GLN 74 9.486 -18.193 1.847 608 HA GLN 74 HA GLN 74 7.799 -16.024 2.708 609 HB2 GLN 74 2HB GLN 74 10.812 -16.240 2.566 610 HB3 GLN 74 1HB GLN 74 9.938 -14.888 3.273 611 HG2 GLN 74 2HG GLN 74 10.047 -17.728 4.235 612 HG3 GLN 74 1HG GLN 74 10.598 -16.270 5.063 613 HE21 GLN 74 1HE2 GLN 74 7.874 -18.230 4.211 614 HE22 GLN 74 2HE2 GLN 74 6.720 -17.445 5.225 615 H THR 75 H THR 75 9.684 -16.833 -0.085 616 HA THR 75 HA THR 75 9.809 -14.330 -1.344 617 HB THR 75 HB THR 75 9.380 -16.982 -2.737 618 HG1 THR 75 HG1 THR 75 11.889 -16.714 -2.708 619 HG21 THR 75 3HG2 THR 75 10.728 -15.963 -4.514 620 HG22 THR 75 1HG2 THR 75 10.857 -14.478 -3.569 621 HG23 THR 75 2HG2 THR 75 9.288 -15.001 -4.181 622 H ARG 76 H ARG 76 7.253 -16.679 -1.012 623 HA ARG 76 HA ARG 76 5.471 -15.566 -2.936 624 HB2 ARG 76 2HB ARG 76 5.477 -17.925 -2.055 625 HB3 ARG 76 1HB ARG 76 4.828 -17.300 -0.547 626 HG2 ARG 76 2HG ARG 76 2.784 -16.699 -1.563 627 HG3 ARG 76 1HG ARG 76 3.445 -16.921 -3.188 628 HD2 ARG 76 2HD ARG 76 3.732 -19.311 -2.735 629 HD3 ARG 76 1HD ARG 76 3.059 -19.086 -1.125 630 HE ARG 76 HE ARG 76 0.926 -18.756 -2.087 631 HH11 ARG 76 1HH1 ARG 76 3.374 -19.405 -4.504 632 HH12 ARG 76 2HH1 ARG 76 2.256 -20.086 -5.644 633 HH21 ARG 76 1HH2 ARG 76 -0.558 -19.634 -3.585 634 HH22 ARG 76 2HH2 ARG 76 0.009 -20.204 -5.129 635 H VAL 77 H VAL 77 6.132 -15.027 0.450 636 HA VAL 77 HA VAL 77 3.868 -13.388 0.998 637 HB VAL 77 HB VAL 77 6.562 -13.345 2.371 638 HG11 VAL 77 1HG1 VAL 77 5.177 -11.405 2.882 639 HG12 VAL 77 2HG1 VAL 77 5.328 -12.461 4.285 640 HG13 VAL 77 3HG1 VAL 77 3.842 -12.467 3.334 641 HG21 VAL 77 3HG2 VAL 77 4.118 -14.989 3.003 642 HG22 VAL 77 1HG2 VAL 77 5.579 -14.898 3.987 643 HG23 VAL 77 2HG2 VAL 77 5.649 -15.594 2.369 644 H ILE 78 H ILE 78 7.152 -12.807 -0.133 645 HA ILE 78 HA ILE 78 7.125 -10.011 -0.206 646 HB ILE 78 HB ILE 78 8.505 -11.915 -2.112 647 HG12 ILE 78 2HG1 ILE 78 9.518 -10.553 0.396 648 HG13 ILE 78 1HG1 ILE 78 9.097 -12.258 0.261 649 HG21 ILE 78 1HG2 ILE 78 9.046 -8.999 -1.558 650 HG22 ILE 78 2HG2 ILE 78 8.376 -9.670 -3.043 651 HG23 ILE 78 3HG2 ILE 78 10.032 -10.053 -2.572 652 HD11 ILE 78 3HD1 ILE 78 11.495 -11.934 0.155 653 HD12 ILE 78 1HD1 ILE 78 11.303 -10.861 -1.231 654 HD13 ILE 78 2HD1 ILE 78 10.881 -12.568 -1.373 655 H GLU 79 H GLU 79 6.028 -12.414 -2.564 656 HA GLU 79 HA GLU 79 5.217 -10.677 -4.600 657 HB2 GLU 79 2HB GLU 79 3.986 -13.313 -3.772 658 HB3 GLU 79 1HB GLU 79 3.665 -12.482 -5.286 659 HG2 GLU 79 2HG GLU 79 6.084 -12.692 -5.831 660 HG3 GLU 79 1HG GLU 79 6.266 -13.686 -4.383 661 H LEU 80 H LEU 80 3.561 -11.770 -1.686 662 HA LEU 80 HA LEU 80 1.018 -10.756 -2.258 663 HB2 LEU 80 2HB LEU 80 2.373 -11.096 0.420 664 HB3 LEU 80 1HB LEU 80 0.660 -10.798 0.197 665 HG LEU 80 HG LEU 80 2.159 -13.250 -0.746 666 HD11 LEU 80 1HD1 LEU 80 0.188 -12.862 1.505 667 HD12 LEU 80 2HD1 LEU 80 1.911 -13.201 1.669 668 HD13 LEU 80 3HD1 LEU 80 0.837 -14.412 0.969 669 HD21 LEU 80 3HD2 LEU 80 -0.789 -12.605 -0.847 670 HD22 LEU 80 1HD2 LEU 80 -0.038 -14.126 -1.329 671 HD23 LEU 80 2HD2 LEU 80 0.302 -12.649 -2.232 672 H ASN 81 H ASN 81 3.653 -9.253 -0.355 673 HA ASN 81 HA ASN 81 2.231 -6.845 0.082 674 HB2 ASN 81 2HB ASN 81 5.202 -7.394 0.200 675 HB3 ASN 81 1HB ASN 81 4.454 -5.887 0.719 676 HD21 ASN 81 1HD2 ASN 81 5.995 -7.511 2.401 677 HD22 ASN 81 2HD2 ASN 81 4.952 -8.150 3.628 678 H TYR 82 H TYR 82 4.626 -7.782 -2.342 679 HA TYR 82 HA TYR 82 4.865 -5.327 -3.660 680 HB2 TYR 82 2HB TYR 82 5.423 -8.147 -4.276 681 HB3 TYR 82 1HB TYR 82 5.107 -7.149 -5.690 682 HD1 TYR 82 HD1 TYR 82 7.269 -7.444 -2.686 683 HD2 TYR 82 HD2 TYR 82 6.759 -5.716 -6.541 684 HE1 TYR 82 HE1 TYR 82 9.597 -6.658 -2.636 685 HE2 TYR 82 HE2 TYR 82 9.086 -4.924 -6.499 686 HH TYR 82 HH TYR 82 10.854 -4.473 -5.015 687 H LYS 83 H LYS 83 2.626 -8.022 -4.258 688 HA LYS 83 HA LYS 83 1.417 -6.748 -6.517 689 HB2 LYS 83 2HB LYS 83 1.648 -9.229 -6.159 690 HB3 LYS 83 1HB LYS 83 0.388 -9.106 -4.943 691 HG2 LYS 83 2HG LYS 83 -1.221 -8.443 -6.581 692 HG3 LYS 83 1HG LYS 83 0.028 -8.312 -7.821 693 HD2 LYS 83 2HD LYS 83 -0.738 -10.858 -6.392 694 HD3 LYS 83 1HD LYS 83 -1.282 -10.401 -8.007 695 HE2 LYS 83 2HE LYS 83 1.016 -10.405 -8.806 696 HE3 LYS 83 1HE LYS 83 1.599 -10.772 -7.185 697 HZ1 LYS 83 3HZ LYS 83 -0.183 -12.550 -8.769 698 HZ2 LYS 83 1HZ LYS 83 0.534 -12.901 -7.273 699 HZ3 LYS 83 2HZ LYS 83 1.502 -12.728 -8.652 700 H HIS 84 H HIS 84 0.950 -6.475 -3.148 701 HA HIS 84 HA HIS 84 -1.818 -5.591 -3.403 702 HB2 HIS 84 2HB HIS 84 0.022 -5.921 -1.043 703 HB3 HIS 84 1HB HIS 84 -1.521 -5.091 -0.901 704 HD1 HIS 84 HD1 HIS 84 -0.645 -7.854 0.485 705 HD2 HIS 84 HD2 HIS 84 -3.174 -7.365 -2.789 706 HE1 HIS 84 HE1 HIS 84 -2.096 -9.907 0.429 707 HE2 HIS 84 HE2 HIS 84 -3.777 -9.463 -1.388 708 H LEU 85 H LEU 85 1.369 -4.225 -2.683 709 HA LEU 85 HA LEU 85 0.126 -1.609 -2.286 710 HB2 LEU 85 2HB LEU 85 2.960 -2.507 -1.781 711 HB3 LEU 85 1HB LEU 85 2.293 -0.938 -1.364 712 HG LEU 85 HG LEU 85 1.392 -3.582 -0.213 713 HD11 LEU 85 1HD1 LEU 85 3.610 -2.944 0.563 714 HD12 LEU 85 2HD1 LEU 85 2.415 -2.804 1.852 715 HD13 LEU 85 3HD1 LEU 85 2.996 -1.356 1.030 716 HD21 LEU 85 3HD2 LEU 85 0.578 -0.760 0.470 717 HD22 LEU 85 1HD2 LEU 85 0.086 -2.213 1.338 718 HD23 LEU 85 2HD2 LEU 85 -0.426 -1.969 -0.332 719 H LEU 86 H LEU 86 2.260 -3.271 -4.505 720 HA LEU 86 HA LEU 86 2.577 -0.745 -5.993 721 HB2 LEU 86 2HB LEU 86 4.310 -3.216 -6.128 722 HB3 LEU 86 1HB LEU 86 4.575 -1.724 -7.008 723 HG LEU 86 HG LEU 86 4.770 -2.097 -4.018 724 HD11 LEU 86 1HD1 LEU 86 7.134 -1.577 -4.375 725 HD12 LEU 86 2HD1 LEU 86 6.854 -1.514 -6.115 726 HD13 LEU 86 3HD1 LEU 86 6.648 -3.033 -5.243 727 HD21 LEU 86 3HD2 LEU 86 5.532 0.233 -3.972 728 HD22 LEU 86 1HD2 LEU 86 3.867 0.103 -4.538 729 HD23 LEU 86 2HD2 LEU 86 5.171 0.380 -5.692 730 H GLY 87 H GLY 87 1.181 -3.837 -5.999 731 HA2 GLY 87 2HA GLY 87 -0.138 -4.919 -7.539 732 HA3 GLY 87 1HA GLY 87 -0.082 -3.457 -8.513 733 H ARG 88 H ARG 88 2.908 -4.896 -7.598 734 HA ARG 88 HA ARG 88 3.201 -6.012 -10.308 735 HB2 ARG 88 2HB ARG 88 4.347 -3.811 -10.084 736 HB3 ARG 88 1HB ARG 88 5.311 -4.474 -8.772 737 HG2 ARG 88 2HG ARG 88 6.671 -4.553 -10.693 738 HG3 ARG 88 1HG ARG 88 6.129 -6.210 -10.419 739 HD2 ARG 88 2HD ARG 88 4.254 -5.698 -12.056 740 HD3 ARG 88 1HD ARG 88 5.156 -4.243 -12.475 741 HE ARG 88 HE ARG 88 6.391 -6.917 -12.707 742 HH11 ARG 88 1HH1 ARG 88 5.616 -3.785 -14.082 743 HH12 ARG 88 2HH1 ARG 88 6.243 -4.185 -15.654 744 HH21 ARG 88 1HH2 ARG 88 7.245 -7.426 -14.775 745 HH22 ARG 88 2HH2 ARG 88 7.177 -6.232 -16.038 746 H ALA 89 H ALA 89 4.301 -7.933 -10.453 747 HA ALA 89 HA ALA 89 4.869 -9.371 -8.017 748 HB1 ALA 89 3HB ALA 89 5.280 -10.153 -10.910 749 HB2 ALA 89 1HB ALA 89 3.865 -10.531 -9.929 750 HB3 ALA 89 2HB ALA 89 5.433 -11.231 -9.524 751 HA PRO 90 HA PRO 90 9.196 -8.592 -7.489 752 HB2 PRO 90 2HB PRO 90 10.232 -11.196 -7.724 753 HB3 PRO 90 1HB PRO 90 9.706 -10.409 -6.235 754 HG2 PRO 90 2HG PRO 90 8.249 -12.334 -7.982 755 HG3 PRO 90 1HG PRO 90 8.199 -12.152 -6.218 756 HD2 PRO 90 2HD PRO 90 6.195 -11.277 -7.761 757 HD3 PRO 90 1HD PRO 90 6.710 -10.371 -6.322 758 H TYR 91 H TYR 91 10.005 -7.518 -9.189 759 HA TYR 91 HA TYR 91 9.959 -8.503 -11.841 760 HB2 TYR 91 2HB TYR 91 9.847 -6.104 -11.288 761 HB3 TYR 91 1HB TYR 91 11.499 -6.169 -10.688 762 HD1 TYR 91 HD1 TYR 91 9.469 -6.702 -13.763 763 HD2 TYR 91 HD2 TYR 91 13.289 -5.773 -12.135 764 HE1 TYR 91 HE1 TYR 91 10.301 -6.190 -16.021 765 HE2 TYR 91 HE2 TYR 91 14.127 -5.256 -14.386 766 HH TYR 91 HH TYR 91 13.608 -5.797 -16.711 767 H ASP 92 H ASP 92 12.617 -7.989 -9.541 768 HA ASP 92 HA ASP 92 14.241 -9.831 -11.168 769 HB2 ASP 92 2HB ASP 92 15.002 -7.435 -11.255 770 HB3 ASP 92 1HB ASP 92 15.291 -7.518 -9.521 771 H GLU 93 H GLU 93 15.863 -11.057 -9.911 772 HA GLU 93 HA GLU 93 14.691 -12.144 -7.560 773 HB2 GLU 93 2HB GLU 93 16.613 -13.602 -7.458 774 HB3 GLU 93 1HB GLU 93 16.061 -13.482 -9.121 775 HG2 GLU 93 2HG GLU 93 17.855 -11.882 -9.591 776 HG3 GLU 93 1HG GLU 93 18.414 -12.039 -7.926 777 H SER 94 H SER 94 16.955 -9.602 -8.159 778 HA SER 94 HA SER 94 18.185 -9.433 -5.639 779 HB2 SER 94 2HB SER 94 18.939 -8.133 -7.593 780 HB3 SER 94 1HB SER 94 17.447 -7.192 -7.548 781 HG SER 94 HG SER 94 19.235 -7.326 -5.349 782 H GLU 95 H GLU 95 15.077 -8.263 -6.823 783 HA GLU 95 HA GLU 95 14.350 -6.669 -4.635 784 HB2 GLU 95 2HB GLU 95 12.489 -8.348 -6.334 785 HB3 GLU 95 1HB GLU 95 12.062 -6.924 -5.396 786 HG2 GLU 95 2HG GLU 95 13.822 -7.010 -7.835 787 HG3 GLU 95 1HG GLU 95 12.186 -6.361 -7.727 788 H VAL 96 H VAL 96 14.000 -10.111 -5.251 789 HA VAL 96 HA VAL 96 12.512 -10.805 -2.972 790 HB VAL 96 HB VAL 96 14.550 -12.478 -4.458 791 HG11 VAL 96 1HG1 VAL 96 12.279 -13.316 -2.659 792 HG12 VAL 96 2HG1 VAL 96 13.998 -13.415 -2.278 793 HG13 VAL 96 3HG1 VAL 96 13.325 -14.400 -3.577 794 HG21 VAL 96 3HG2 VAL 96 11.574 -12.200 -4.868 795 HG22 VAL 96 1HG2 VAL 96 12.617 -13.362 -5.689 796 HG23 VAL 96 2HG2 VAL 96 12.840 -11.633 -5.957 797 H ILE 97 H ILE 97 16.014 -11.055 -3.563 798 HA ILE 97 HA ILE 97 16.758 -11.872 -0.997 799 HB ILE 97 HB ILE 97 18.371 -10.255 -2.974 800 HG12 ILE 97 2HG1 ILE 97 18.181 -13.247 -2.554 801 HG13 ILE 97 1HG1 ILE 97 17.469 -12.362 -3.899 802 HG21 ILE 97 1HG2 ILE 97 19.252 -11.956 -0.642 803 HG22 ILE 97 2HG2 ILE 97 19.368 -10.200 -0.759 804 HG23 ILE 97 3HG2 ILE 97 20.327 -11.220 -1.831 805 HD11 ILE 97 3HD1 ILE 97 19.536 -13.472 -4.536 806 HD12 ILE 97 1HD1 ILE 97 20.404 -12.577 -3.290 807 HD13 ILE 97 2HD1 ILE 97 19.687 -11.718 -4.653 808 H PHE 98 H PHE 98 16.537 -8.627 -2.393 809 HA PHE 98 HA PHE 98 17.574 -7.155 -0.263 810 HB2 PHE 98 2HB PHE 98 17.177 -6.238 -2.506 811 HB3 PHE 98 1HB PHE 98 15.441 -6.380 -2.266 812 HD1 PHE 98 HD2 PHE 98 18.470 -4.694 -0.951 813 HD2 PHE 98 HD1 PHE 98 14.232 -4.634 -1.334 814 HE1 PHE 98 HE2 PHE 98 18.424 -2.411 -0.037 815 HE2 PHE 98 HE1 PHE 98 14.176 -2.349 -0.426 816 HZ PHE 98 HZ PHE 98 16.272 -1.235 0.225 817 H HIS 99 H HIS 99 14.233 -8.195 -0.896 818 HA HIS 99 HA HIS 99 13.263 -6.787 1.419 819 HB2 HIS 99 2HB HIS 99 11.980 -8.513 -0.662 820 HB3 HIS 99 1HB HIS 99 11.109 -8.133 0.823 821 HD1 HIS 99 HD1 HIS 99 10.170 -5.806 1.086 822 HD2 HIS 99 HD2 HIS 99 12.535 -6.242 -2.315 823 HE1 HIS 99 HE1 HIS 99 9.881 -3.675 -0.231 824 HE2 HIS 99 HE2 HIS 99 11.192 -4.024 -2.351 825 H LEU 100 H LEU 100 14.173 -10.107 0.682 826 HA LEU 100 HA LEU 100 13.225 -11.304 3.041 827 HB2 LEU 100 2HB LEU 100 15.665 -11.892 1.367 828 HB3 LEU 100 1HB LEU 100 15.184 -12.883 2.731 829 HG LEU 100 HG LEU 100 13.500 -12.405 0.267 830 HD11 LEU 100 1HD1 LEU 100 14.048 -14.707 -0.323 831 HD12 LEU 100 2HD1 LEU 100 15.107 -14.828 1.083 832 HD13 LEU 100 3HD1 LEU 100 15.506 -13.718 -0.230 833 HD21 LEU 100 3HD2 LEU 100 13.137 -14.288 2.597 834 HD22 LEU 100 1HD2 LEU 100 12.114 -14.210 1.162 835 HD23 LEU 100 2HD2 LEU 100 12.181 -12.841 2.272 836 H ASP 101 H ASP 101 16.252 -9.652 2.314 837 HA ASP 101 HA ASP 101 17.484 -9.870 4.815 838 HB2 ASP 101 2HB ASP 101 18.712 -9.146 2.859 839 HB3 ASP 101 1HB ASP 101 17.686 -7.729 2.684 840 H LEU 102 H LEU 102 15.469 -7.257 3.489 841 HA LEU 102 HA LEU 102 15.456 -5.582 5.710 842 HB2 LEU 102 2HB LEU 102 14.650 -4.908 3.514 843 HB3 LEU 102 1HB LEU 102 13.314 -6.036 3.632 844 HG LEU 102 HG LEU 102 12.384 -4.733 5.505 845 HD11 LEU 102 1HD1 LEU 102 14.658 -2.837 4.935 846 HD12 LEU 102 2HD1 LEU 102 14.433 -3.793 6.401 847 HD13 LEU 102 3HD1 LEU 102 13.290 -2.510 5.998 848 HD21 LEU 102 3HD2 LEU 102 11.638 -4.277 3.240 849 HD22 LEU 102 1HD2 LEU 102 12.957 -3.127 3.019 850 HD23 LEU 102 2HD2 LEU 102 11.681 -2.793 4.191 851 H TYR 103 H TYR 103 13.190 -8.185 4.853 852 HA TYR 103 HA TYR 103 11.436 -7.872 7.006 853 HB2 TYR 103 2HB TYR 103 10.728 -9.236 5.197 854 HB3 TYR 103 1HB TYR 103 12.146 -10.273 5.322 855 HD1 TYR 103 HD2 TYR 103 9.104 -9.244 7.228 856 HD2 TYR 103 HD1 TYR 103 12.018 -12.266 6.517 857 HE1 TYR 103 HE2 TYR 103 7.861 -10.781 8.691 858 HE2 TYR 103 HE1 TYR 103 10.785 -13.809 7.982 859 HH TYR 103 HH TYR 103 9.185 -13.680 9.852 860 H GLU 104 H GLU 104 14.319 -9.940 6.712 861 HA GLU 104 HA GLU 104 13.933 -11.142 9.259 862 HB2 GLU 104 2HB GLU 104 16.356 -11.041 7.464 863 HB3 GLU 104 1HB GLU 104 16.281 -11.968 8.955 864 HG2 GLU 104 2HG GLU 104 14.247 -13.118 7.954 865 HG3 GLU 104 1HG GLU 104 14.729 -12.380 6.426 866 H ASN 105 H ASN 105 15.707 -8.307 8.175 867 HA ASN 105 HA ASN 105 17.135 -8.082 10.676 868 HB2 ASN 105 2HB ASN 105 16.904 -6.136 8.378 869 HB3 ASN 105 1HB ASN 105 17.957 -5.930 9.771 870 HD21 ASN 105 1HD2 ASN 105 18.669 -6.052 7.010 871 HD22 ASN 105 2HD2 ASN 105 19.720 -7.414 6.810 872 H GLU 106 H GLU 106 14.645 -6.103 9.038 873 HA GLU 106 HA GLU 106 14.419 -4.543 11.497 874 HB2 GLU 106 2HB GLU 106 13.275 -4.033 8.750 875 HB3 GLU 106 1HB GLU 106 13.190 -2.929 10.116 876 HG2 GLU 106 2HG GLU 106 15.728 -3.862 8.793 877 HG3 GLU 106 1HG GLU 106 14.934 -2.315 8.503 878 H GLY 107 H GLY 107 12.405 -6.538 9.354 879 HA2 GLY 107 2HA GLY 107 10.801 -7.881 10.799 880 HA3 GLY 107 1HA GLY 107 10.262 -6.313 11.377 881 H PHE 108 H PHE 108 8.306 -7.717 10.522 882 HA PHE 108 HA PHE 108 7.887 -7.782 7.701 883 HB2 PHE 108 2HB PHE 108 6.789 -9.353 9.265 884 HB3 PHE 108 1HB PHE 108 5.871 -8.015 9.948 885 HD1 PHE 108 HD1 PHE 108 6.535 -9.683 6.687 886 HD2 PHE 108 HD2 PHE 108 3.754 -7.579 9.125 887 HE1 PHE 108 HE1 PHE 108 4.787 -10.043 4.995 888 HE2 PHE 108 HE2 PHE 108 2.000 -7.935 7.437 889 HZ PHE 108 HZ PHE 108 2.516 -9.167 5.371 890 H ASP 109 H ASP 109 6.922 -5.562 10.285 891 HA ASP 109 HA ASP 109 5.132 -4.024 8.681 892 HB2 ASP 109 2HB ASP 109 5.531 -4.115 11.320 893 HB3 ASP 109 1HB ASP 109 6.591 -2.756 10.960 894 H ALA 110 H ALA 110 8.547 -4.053 9.233 895 HA ALA 110 HA ALA 110 9.100 -1.485 8.111 896 HB1 ALA 110 3HB ALA 110 10.605 -2.545 9.724 897 HB2 ALA 110 1HB ALA 110 11.433 -2.157 8.215 898 HB3 ALA 110 2HB ALA 110 10.952 -3.820 8.556 899 H ASP 111 H ASP 111 8.858 -4.770 6.862 900 HA ASP 111 HA ASP 111 9.915 -4.243 4.298 901 HB2 ASP 111 2HB ASP 111 9.456 -6.548 5.074 902 HB3 ASP 111 1HB ASP 111 7.726 -6.209 5.024 903 H ILE 112 H ILE 112 6.540 -4.363 5.398 904 HA ILE 112 HA ILE 112 5.300 -3.293 3.158 905 HB ILE 112 HB ILE 112 4.554 -2.912 6.066 906 HG12 ILE 112 2HG1 ILE 112 3.613 -4.951 4.039 907 HG13 ILE 112 1HG1 ILE 112 4.738 -5.267 5.358 908 HG21 ILE 112 1HG2 ILE 112 2.834 -2.593 3.611 909 HG22 ILE 112 2HG2 ILE 112 3.430 -1.283 4.629 910 HG23 ILE 112 3HG2 ILE 112 2.294 -2.462 5.285 911 HD11 ILE 112 3HD1 ILE 112 2.498 -6.048 5.883 912 HD12 ILE 112 1HD1 ILE 112 1.868 -4.416 5.658 913 HD13 ILE 112 2HD1 ILE 112 2.993 -4.754 6.973 914 H ASP 113 H ASP 113 6.994 -1.725 5.771 915 HA ASP 113 HA ASP 113 6.238 0.921 5.387 916 HB2 ASP 113 2HB ASP 113 7.503 0.153 7.333 917 HB3 ASP 113 1HB ASP 113 8.902 -0.164 6.313 918 H SER 114 H SER 114 8.729 -0.966 3.705 919 HA SER 114 HA SER 114 10.081 1.218 2.563 920 HB2 SER 114 2HB SER 114 11.081 -0.402 1.022 921 HB3 SER 114 1HB SER 114 11.055 -1.037 2.667 922 HG SER 114 HG SER 114 9.222 -2.269 2.094 923 H TYR 115 H TYR 115 7.097 -0.297 1.666 924 HA TYR 115 HA TYR 115 7.114 0.796 -1.025 925 HB2 TYR 115 2HB TYR 115 4.761 -0.448 0.405 926 HB3 TYR 115 1HB TYR 115 5.000 -0.279 -1.328 927 HD1 TYR 115 HD1 TYR 115 5.842 -2.202 1.655 928 HD2 TYR 115 HD2 TYR 115 6.438 -1.848 -2.539 929 HE1 TYR 115 HE1 TYR 115 6.739 -4.484 1.601 930 HE2 TYR 115 HE2 TYR 115 7.354 -4.133 -2.603 931 HH TYR 115 HH TYR 115 7.288 -6.212 0.248 932 H ILE 116 H ILE 116 5.818 1.540 2.122 933 HA ILE 116 HA ILE 116 3.947 3.503 1.045 934 HB ILE 116 HB ILE 116 4.364 2.516 3.871 935 HG12 ILE 116 2HG1 ILE 116 3.478 0.789 2.391 936 HG13 ILE 116 1HG1 ILE 116 2.234 1.326 3.514 937 HG21 ILE 116 1HG2 ILE 116 3.480 4.797 3.835 938 HG22 ILE 116 2HG2 ILE 116 2.281 3.644 4.419 939 HG23 ILE 116 3HG2 ILE 116 2.171 4.270 2.775 940 HD11 ILE 116 3HD1 ILE 116 2.490 2.194 0.643 941 HD12 ILE 116 1HD1 ILE 116 1.222 2.676 1.769 942 HD13 ILE 116 2HD1 ILE 116 1.357 0.992 1.263 943 H ASP 117 H ASP 117 6.885 3.345 2.948 944 HA ASP 117 HA ASP 117 6.698 6.025 3.948 945 HB2 ASP 117 2HB ASP 117 7.802 4.323 5.262 946 HB3 ASP 117 1HB ASP 117 8.944 4.004 3.964 947 H SER 118 H SER 118 7.851 4.639 1.041 948 HA SER 118 HA SER 118 9.818 6.662 0.488 949 HB2 SER 118 2HB SER 118 9.663 5.532 -1.861 950 HB3 SER 118 1HB SER 118 10.345 4.621 -0.513 951 HG SER 118 HG SER 118 8.800 3.230 -0.747 952 HA PRO 119 HA PRO 119 6.429 9.405 -0.601 953 HB2 PRO 119 2HB PRO 119 7.951 11.647 -0.904 954 HB3 PRO 119 1HB PRO 119 7.423 11.033 0.667 955 HG2 PRO 119 2HG PRO 119 10.066 10.742 -0.698 956 HG3 PRO 119 1HG PRO 119 9.714 11.031 1.015 957 HD2 PRO 119 2HD PRO 119 10.391 8.592 0.028 958 HD3 PRO 119 1HD PRO 119 9.337 8.805 1.439 959 H GLU 120 H GLU 120 9.504 9.363 -2.351 960 HA GLU 120 HA GLU 120 8.601 10.625 -4.696 961 HB2 GLU 120 2HB GLU 120 10.626 9.524 -5.730 962 HB3 GLU 120 1HB GLU 120 10.941 10.506 -4.306 963 HG2 GLU 120 2HG GLU 120 11.023 8.489 -2.931 964 HG3 GLU 120 1HG GLU 120 10.714 7.505 -4.360 965 H TYR 121 H TYR 121 8.619 7.239 -3.703 966 HA TYR 121 HA TYR 121 7.935 6.274 -6.312 967 HB2 TYR 121 2HB TYR 121 9.149 5.059 -4.323 968 HB3 TYR 121 1HB TYR 121 7.508 4.656 -3.828 969 HD1 TYR 121 HD2 TYR 121 6.122 3.158 -5.225 970 HD2 TYR 121 HD1 TYR 121 10.142 4.084 -6.279 971 HE1 TYR 121 HE2 TYR 121 6.142 1.267 -6.803 972 HE2 TYR 121 HE1 TYR 121 10.168 2.203 -7.858 973 HH TYR 121 HH TYR 121 7.377 0.581 -8.853 974 H THR 122 H THR 122 6.174 6.971 -3.322 975 HA THR 122 HA THR 122 3.688 5.956 -4.286 976 HB THR 122 HB THR 122 4.116 7.968 -2.073 977 HG1 THR 122 HG1 THR 122 4.915 5.442 -2.194 978 HG21 THR 122 3HG2 THR 122 1.969 7.087 -1.240 979 HG22 THR 122 1HG2 THR 122 1.842 6.070 -2.675 980 HG23 THR 122 2HG2 THR 122 1.804 7.827 -2.832 981 H ASN 123 H ASN 123 5.093 9.224 -4.057 982 HA ASN 123 HA ASN 123 2.793 10.599 -4.906 983 HB2 ASN 123 2HB ASN 123 4.662 11.728 -3.795 984 HB3 ASN 123 1HB ASN 123 5.690 11.422 -5.191 985 HD21 ASN 123 1HD2 ASN 123 2.886 13.161 -4.033 986 HD22 ASN 123 2HD2 ASN 123 2.918 14.401 -5.243 987 H SER 124 H SER 124 5.435 9.148 -6.743 988 HA SER 124 HA SER 124 4.613 10.237 -9.240 989 HB2 SER 124 2HB SER 124 6.112 8.430 -10.186 990 HB3 SER 124 1HB SER 124 6.881 9.530 -9.041 991 HG SER 124 HG SER 124 7.069 7.960 -7.616 992 H PHE 125 H PHE 125 3.451 7.665 -7.305 993 HA PHE 125 HA PHE 125 2.124 6.341 -9.548 994 HB2 PHE 125 2HB PHE 125 3.198 4.963 -7.805 995 HB3 PHE 125 1HB PHE 125 2.148 5.681 -6.590 996 HD1 PHE 125 HD2 PHE 125 2.313 3.409 -9.462 997 HD2 PHE 125 HD1 PHE 125 -0.126 4.964 -6.342 998 HE1 PHE 125 HE2 PHE 125 0.664 1.632 -9.871 999 HE2 PHE 125 HE1 PHE 125 -1.779 3.189 -6.747 1000 HZ PHE 125 HZ PHE 125 -1.386 1.521 -8.515 1001 H GLY 126 H GLY 126 1.403 8.201 -6.642 1002 HA2 GLY 126 2HA GLY 126 -0.548 9.782 -7.065 1003 HA3 GLY 126 1HA GLY 126 -1.430 8.311 -7.452 1004 H ASP 127 H ASP 127 -0.541 10.450 -5.007 1005 HA ASP 127 HA ASP 127 -0.427 8.727 -2.763 1006 HB2 ASP 127 2HB ASP 127 -1.154 11.659 -2.927 1007 HB3 ASP 127 1HB ASP 127 -0.845 10.788 -1.430 1008 H TRP 128 H TRP 128 -3.068 10.290 -4.439 1009 HA TRP 128 HA TRP 128 -4.952 9.216 -2.458 1010 HB2 TRP 128 2HB TRP 128 -5.309 11.359 -4.562 1011 HB3 TRP 128 1HB TRP 128 -6.606 10.756 -3.535 1012 HD1 TRP 128 HD1 TRP 128 -3.608 13.078 -3.507 1013 HE1 TRP 128 HE1 TRP 128 -3.544 14.355 -1.268 1014 HE3 TRP 128 HE3 TRP 128 -7.220 10.478 -0.993 1015 HZ2 TRP 128 HZ2 TRP 128 -4.855 14.262 1.229 1016 HZ3 TRP 128 HZ3 TRP 128 -7.752 11.131 1.318 1017 HH2 TRP 128 HH2 TRP 128 -6.591 12.987 2.407 1018 H VAL 129 H VAL 129 -3.542 7.848 -4.790 1019 HA VAL 129 HA VAL 129 -5.937 6.877 -6.201 1020 HB VAL 129 HB VAL 129 -3.037 6.597 -7.029 1021 HG11 VAL 129 1HG1 VAL 129 -3.937 5.822 -9.166 1022 HG12 VAL 129 2HG1 VAL 129 -5.574 5.937 -8.522 1023 HG13 VAL 129 3HG1 VAL 129 -4.439 4.770 -7.842 1024 HG21 VAL 129 3HG2 VAL 129 -5.188 8.419 -8.106 1025 HG22 VAL 129 1HG2 VAL 129 -3.567 8.230 -8.775 1026 HG23 VAL 129 2HG2 VAL 129 -3.782 8.916 -7.164 1027 H VAL 130 H VAL 130 -6.458 4.727 -6.125 1028 HA VAL 130 HA VAL 130 -5.329 3.188 -3.980 1029 HB VAL 130 HB VAL 130 -7.379 2.401 -6.062 1030 HG11 VAL 130 1HG1 VAL 130 -7.973 0.584 -4.550 1031 HG12 VAL 130 2HG1 VAL 130 -6.686 1.067 -3.446 1032 HG13 VAL 130 3HG1 VAL 130 -6.287 0.455 -5.051 1033 HG21 VAL 130 3HG2 VAL 130 -8.122 4.277 -4.701 1034 HG22 VAL 130 1HG2 VAL 130 -7.743 3.376 -3.232 1035 HG23 VAL 130 2HG2 VAL 130 -9.029 2.818 -4.301 1036 HA PRO 131 HA PRO 131 -2.024 1.291 -6.309 1037 HB2 PRO 131 2HB PRO 131 -2.464 -0.854 -4.287 1038 HB3 PRO 131 1HB PRO 131 -0.966 -0.043 -4.761 1039 HG2 PRO 131 2HG PRO 131 -2.153 0.573 -2.469 1040 HG3 PRO 131 1HG PRO 131 -1.420 1.836 -3.473 1041 HD2 PRO 131 2HD PRO 131 -4.302 1.128 -3.119 1042 HD3 PRO 131 1HD PRO 131 -3.546 2.724 -3.307 1043 H TYR 132 H TYR 132 -2.754 0.597 -8.225 1044 HA TYR 132 HA TYR 132 -4.471 -1.774 -8.312 1045 HB2 TYR 132 2HB TYR 132 -4.844 -1.099 -10.714 1046 HB3 TYR 132 1HB TYR 132 -5.463 0.035 -9.521 1047 HD1 TYR 132 HD2 TYR 132 -2.809 -0.543 -12.022 1048 HD2 TYR 132 HD1 TYR 132 -4.595 2.266 -9.368 1049 HE1 TYR 132 HE2 TYR 132 -1.567 1.274 -13.115 1050 HE2 TYR 132 HE1 TYR 132 -3.356 4.092 -10.457 1051 HH TYR 132 HH TYR 132 -1.401 4.449 -11.812 1052 H TYR 133 H TYR 133 -3.988 -3.396 -9.954 1053 HA TYR 133 HA TYR 133 -1.289 -4.187 -9.846 1054 HB2 TYR 133 2HB TYR 133 -1.944 -6.014 -11.372 1055 HB3 TYR 133 1HB TYR 133 -3.045 -5.852 -10.012 1056 HD1 TYR 133 HD1 TYR 133 -5.304 -4.806 -10.388 1057 HD2 TYR 133 HD2 TYR 133 -2.714 -5.838 -13.599 1058 HE1 TYR 133 HE1 TYR 133 -7.210 -4.735 -11.943 1059 HE2 TYR 133 HE2 TYR 133 -4.608 -5.764 -15.161 1060 HH TYR 133 HH TYR 133 -7.605 -4.418 -14.377 1061 H ARG 134 H ARG 134 0.323 -4.169 -11.321 1062 HA ARG 134 HA ARG 134 0.344 -1.861 -13.013 1063 HB2 ARG 134 2HB ARG 134 2.231 -3.006 -11.561 1064 HB3 ARG 134 1HB ARG 134 2.524 -3.902 -13.043 1065 HG2 ARG 134 2HG ARG 134 4.006 -2.027 -12.953 1066 HG3 ARG 134 1HG ARG 134 2.822 -1.753 -14.231 1067 HD2 ARG 134 2HD ARG 134 1.791 -0.057 -13.099 1068 HD3 ARG 134 1HD ARG 134 2.215 -0.710 -11.517 1069 HE ARG 134 HE ARG 134 4.603 0.038 -12.620 1070 HH11 ARG 134 1HH1 ARG 134 1.581 1.707 -12.013 1071 HH12 ARG 134 2HH1 ARG 134 2.351 3.217 -11.644 1072 HH21 ARG 134 1HH2 ARG 134 5.604 2.012 -12.122 1073 HH22 ARG 134 2HH2 ARG 134 4.627 3.393 -11.702 1074 H GLY 135 H GLY 135 -0.692 -4.987 -13.526 1075 HA2 GLY 135 2HA GLY 135 0.224 -5.243 -16.268 1076 HA3 GLY 135 1HA GLY 135 -0.827 -6.360 -15.407 1077 H LEU 136 H LEU 136 -1.035 -2.903 -16.202 1078 HA LEU 136 HA LEU 136 -3.816 -2.933 -16.664 1079 HB2 LEU 136 2HB LEU 136 -1.715 -0.985 -17.622 1080 HB3 LEU 136 1HB LEU 136 -3.445 -0.709 -17.693 1081 HG LEU 136 HG LEU 136 -1.851 -1.068 -15.153 1082 HD11 LEU 136 1HD1 LEU 136 -1.333 1.033 -16.288 1083 HD12 LEU 136 2HD1 LEU 136 -2.251 1.311 -14.808 1084 HD13 LEU 136 3HD1 LEU 136 -3.052 1.414 -16.374 1085 HD21 LEU 136 3HD2 LEU 136 -3.902 -0.357 -14.036 1086 HD22 LEU 136 1HD2 LEU 136 -4.156 -1.848 -14.945 1087 HD23 LEU 136 2HD2 LEU 136 -4.738 -0.312 -15.588 1088 H GLU 137 H GLU 137 -1.043 -3.106 -18.844 1089 HA GLU 137 HA GLU 137 -2.855 -3.615 -21.088 1090 HB2 GLU 137 2HB GLU 137 -0.242 -2.405 -20.812 1091 HB3 GLU 137 1HB GLU 137 -0.215 -3.689 -22.012 1092 HG2 GLU 137 2HG GLU 137 -2.240 -1.471 -22.012 1093 HG3 GLU 137 1HG GLU 137 -0.712 -1.399 -22.890 1094 H HIS 138 H HIS 138 -2.609 -5.424 -22.413 1095 HA HIS 138 HA HIS 138 -2.851 -7.688 -22.492 1096 HB2 HIS 138 2HB HIS 138 -0.611 -8.869 -22.653 1097 HB3 HIS 138 1HB HIS 138 -0.879 -7.530 -23.753 1098 HD1 HIS 138 HD1 HIS 138 1.015 -5.966 -23.949 1099 HD2 HIS 138 HD2 HIS 138 1.076 -8.014 -20.325 1100 HE1 HIS 138 HE1 HIS 138 3.131 -5.246 -22.796 1101 HE2 HIS 138 HE2 HIS 138 3.099 -6.410 -20.561 1102 H HIS 139 H HIS 139 -4.012 -7.695 -20.439 1103 HA HIS 139 HA HIS 139 -2.725 -8.444 -18.033 1104 HB2 HIS 139 2HB HIS 139 -5.073 -9.157 -17.325 1105 HB3 HIS 139 1HB HIS 139 -4.848 -7.470 -17.756 1106 HD1 HIS 139 HD1 HIS 139 -6.367 -6.534 -19.514 1107 HD2 HIS 139 HD2 HIS 139 -6.448 -10.697 -19.400 1108 HE1 HIS 139 HE1 HIS 139 -8.237 -7.220 -21.042 1109 HE2 HIS 139 HE2 HIS 139 -8.124 -9.730 -21.127 1110 H HIS 140 H HIS 140 -1.803 -10.291 -17.520 1111 HA HIS 140 HA HIS 140 -2.006 -12.501 -19.322 1112 HB2 HIS 140 2HB HIS 140 -0.327 -13.596 -17.811 1113 HB3 HIS 140 1HB HIS 140 0.177 -12.059 -18.495 1114 HD1 HIS 140 HD1 HIS 140 0.537 -10.093 -16.873 1115 HD2 HIS 140 HD2 HIS 140 -0.603 -13.640 -15.016 1116 HE1 HIS 140 HE1 HIS 140 0.993 -9.756 -14.421 1117 HE2 HIS 140 HE2 HIS 140 0.506 -11.987 -13.357 1118 H HIS 141 H HIS 141 -3.944 -13.417 -19.249 1119 HA HIS 141 HA HIS 141 -4.444 -15.102 -16.899 1120 HB2 HIS 141 2HB HIS 141 -6.021 -13.008 -17.153 1121 HB3 HIS 141 1HB HIS 141 -6.759 -13.952 -18.440 1122 HD1 HIS 141 HD1 HIS 141 -7.330 -13.187 -15.095 1123 HD2 HIS 141 HD2 HIS 141 -7.344 -16.767 -17.215 1124 HE1 HIS 141 HE1 HIS 141 -8.695 -14.793 -13.714 1125 HE2 HIS 141 HE2 HIS 141 -8.828 -16.900 -15.098 1126 H HIS 142 H HIS 142 -3.091 -15.528 -19.390 1127 HA HIS 142 HA HIS 142 -4.737 -17.650 -20.533 1128 HB2 HIS 142 2HB HIS 142 -5.029 -15.511 -21.876 1129 HB3 HIS 142 1HB HIS 142 -3.321 -15.622 -22.278 1130 HD1 HIS 142 HD1 HIS 142 -2.636 -17.313 -24.082 1131 HD2 HIS 142 HD2 HIS 142 -6.678 -17.450 -23.100 1132 HE1 HIS 142 HE1 HIS 142 -3.724 -18.726 -25.859 1133 HE2 HIS 142 HE2 HIS 142 -6.188 -18.647 -25.339 1134 H HIS 143 H HIS 143 -3.455 -19.334 -20.052 1135 HA HIS 143 HA HIS 143 -0.572 -19.035 -20.204 1136 HB2 HIS 143 2HB HIS 143 -0.510 -21.348 -19.265 1137 HB3 HIS 143 1HB HIS 143 -1.370 -20.194 -18.257 1138 HD1 HIS 143 HD1 HIS 143 -3.957 -20.483 -18.061 1139 HD2 HIS 143 HD2 HIS 143 -2.021 -23.490 -20.191 1140 HE1 HIS 143 HE1 HIS 143 -5.622 -22.362 -18.260 1141 HE2 HIS 143 HE2 HIS 143 -4.470 -24.124 -19.650 Start of MODEL 12 1 H1 MET 1 1H MET 1 -9.853 1.862 -14.980 2 H2 MET 1 2H MET 1 -8.670 0.654 -14.995 3 H3 MET 1 3H MET 1 -8.814 1.703 -16.316 4 HA MET 1 HA MET 1 -6.942 2.376 -15.050 5 HB2 MET 1 2HB MET 1 -9.333 4.170 -14.552 6 HB3 MET 1 1HB MET 1 -7.656 4.666 -14.369 7 HG2 MET 1 2HG MET 1 -8.978 3.775 -16.919 8 HG3 MET 1 1HG MET 1 -8.563 5.431 -16.476 9 HE1 MET 1 3HE MET 1 -7.279 5.792 -18.727 10 HE2 MET 1 1HE MET 1 -7.697 4.159 -19.236 11 HE3 MET 1 2HE MET 1 -6.025 4.713 -19.340 12 HA PRO 2 HA PRO 2 -6.828 1.605 -10.677 13 HB2 PRO 2 2HB PRO 2 -5.292 3.656 -9.748 14 HB3 PRO 2 1HB PRO 2 -4.629 2.273 -10.625 15 HG2 PRO 2 2HG PRO 2 -5.289 5.012 -11.631 16 HG3 PRO 2 1HG PRO 2 -3.873 4.004 -11.981 17 HD2 PRO 2 2HD PRO 2 -5.946 4.230 -13.697 18 HD3 PRO 2 1HD PRO 2 -5.006 2.732 -13.537 19 H VAL 3 H VAL 3 -7.687 2.322 -8.666 20 HA VAL 3 HA VAL 3 -9.889 4.155 -8.982 21 HB VAL 3 HB VAL 3 -8.979 2.722 -6.479 22 HG11 VAL 3 1HG1 VAL 3 -10.433 4.621 -6.016 23 HG12 VAL 3 2HG1 VAL 3 -11.272 3.102 -5.704 24 HG13 VAL 3 3HG1 VAL 3 -11.615 4.013 -7.176 25 HG21 VAL 3 3HG2 VAL 3 -9.476 1.113 -8.219 26 HG22 VAL 3 1HG2 VAL 3 -11.013 1.910 -8.550 27 HG23 VAL 3 2HG2 VAL 3 -10.757 1.099 -7.004 28 H GLU 4 H GLU 4 -9.408 6.252 -8.991 29 HA GLU 4 HA GLU 4 -7.270 7.244 -7.251 30 HB2 GLU 4 2HB GLU 4 -8.736 8.715 -9.445 31 HB3 GLU 4 1HB GLU 4 -7.233 9.189 -8.669 32 HG2 GLU 4 2HG GLU 4 -6.085 7.313 -9.663 33 HG3 GLU 4 1HG GLU 4 -7.590 6.737 -10.376 34 H LEU 5 H LEU 5 -7.878 8.040 -5.324 35 HA LEU 5 HA LEU 5 -10.574 9.073 -4.977 36 HB2 LEU 5 2HB LEU 5 -9.557 7.677 -3.209 37 HB3 LEU 5 1HB LEU 5 -8.301 8.881 -2.992 38 HG LEU 5 HG LEU 5 -10.065 10.521 -2.317 39 HD11 LEU 5 1HD1 LEU 5 -12.265 9.669 -1.680 40 HD12 LEU 5 2HD1 LEU 5 -11.847 8.088 -2.342 41 HD13 LEU 5 3HD1 LEU 5 -11.977 9.487 -3.410 42 HD21 LEU 5 3HD2 LEU 5 -10.403 9.583 -0.084 43 HD22 LEU 5 1HD2 LEU 5 -8.750 9.330 -0.646 44 HD23 LEU 5 2HD2 LEU 5 -9.903 7.997 -0.674 45 H ARG 6 H ARG 6 -10.772 10.966 -5.981 46 HA ARG 6 HA ARG 6 -8.750 13.000 -5.897 47 HB2 ARG 6 2HB ARG 6 -10.272 12.768 -7.811 48 HB3 ARG 6 1HB ARG 6 -11.643 13.109 -6.769 49 HG2 ARG 6 2HG ARG 6 -10.767 15.357 -6.364 50 HG3 ARG 6 1HG ARG 6 -9.409 15.011 -7.439 51 HD2 ARG 6 2HD ARG 6 -11.222 16.281 -8.548 52 HD3 ARG 6 1HD ARG 6 -10.906 14.722 -9.308 53 HE ARG 6 HE ARG 6 -12.969 14.532 -7.350 54 HH11 ARG 6 1HH1 ARG 6 -12.359 15.627 -10.623 55 HH12 ARG 6 2HH1 ARG 6 -13.984 15.328 -11.157 56 HH21 ARG 6 1HH2 ARG 6 -15.102 14.144 -8.048 57 HH22 ARG 6 2HH2 ARG 6 -15.552 14.520 -9.691 58 H ALA 7 H ALA 7 -8.660 14.767 -4.570 59 HA ALA 7 HA ALA 7 -9.708 14.656 -2.005 60 HB1 ALA 7 3HB ALA 7 -8.972 16.954 -1.733 61 HB2 ALA 7 1HB ALA 7 -8.845 17.134 -3.482 62 HB3 ALA 7 2HB ALA 7 -7.776 16.018 -2.633 63 H ASN 8 H ASN 8 -11.009 16.249 -4.859 64 HA ASN 8 HA ASN 8 -13.443 16.938 -3.440 65 HB2 ASN 8 2HB ASN 8 -12.748 18.427 -5.240 66 HB3 ASN 8 1HB ASN 8 -12.731 17.085 -6.383 67 HD21 ASN 8 1HD2 ASN 8 -14.753 19.200 -4.474 68 HD22 ASN 8 2HD2 ASN 8 -16.216 18.906 -5.347 69 H TRP 9 H TRP 9 -14.281 15.025 -2.711 70 HA TRP 9 HA TRP 9 -14.981 13.055 -4.774 71 HB2 TRP 9 2HB TRP 9 -14.650 11.284 -3.017 72 HB3 TRP 9 1HB TRP 9 -13.174 12.075 -3.554 73 HD1 TRP 9 HD1 TRP 9 -11.741 13.309 -1.768 74 HE1 TRP 9 HE1 TRP 9 -11.908 13.591 0.780 75 HE3 TRP 9 HE3 TRP 9 -16.480 11.511 -1.041 76 HZ2 TRP 9 HZ2 TRP 9 -13.783 13.113 2.827 77 HZ3 TRP 9 HZ3 TRP 9 -17.381 11.454 1.246 78 HH2 TRP 9 HH2 TRP 9 -16.060 12.239 3.142 79 H SER 10 H SER 10 -16.793 11.715 -4.296 80 HA SER 10 HA SER 10 -18.581 12.770 -2.209 81 HB2 SER 10 2HB SER 10 -19.422 12.860 -4.605 82 HB3 SER 10 1HB SER 10 -19.368 11.097 -4.617 83 HG SER 10 HG SER 10 -21.278 11.185 -3.749 84 H GLU 11 H GLU 11 -19.969 10.904 -1.252 85 HA GLU 11 HA GLU 11 -18.175 9.019 -0.171 86 HB2 GLU 11 2HB GLU 11 -21.172 9.231 -0.074 87 HB3 GLU 11 1HB GLU 11 -20.298 7.932 0.730 88 HG2 GLU 11 2HG GLU 11 -19.055 9.550 2.043 89 HG3 GLU 11 1HG GLU 11 -19.883 10.870 1.221 90 H GLU 12 H GLU 12 -20.106 8.968 -3.019 91 HA GLU 12 HA GLU 12 -20.160 6.216 -3.565 92 HB2 GLU 12 2HB GLU 12 -19.972 8.619 -5.388 93 HB3 GLU 12 1HB GLU 12 -20.092 6.979 -6.002 94 HG2 GLU 12 2HG GLU 12 -22.246 8.134 -5.988 95 HG3 GLU 12 1HG GLU 12 -22.250 6.697 -4.964 96 H ASP 13 H ASP 13 -17.719 8.690 -4.212 97 HA ASP 13 HA ASP 13 -15.866 6.958 -5.496 98 HB2 ASP 13 2HB ASP 13 -15.297 9.558 -4.043 99 HB3 ASP 13 1HB ASP 13 -14.261 8.777 -5.232 100 H LEU 14 H LEU 14 -16.292 8.114 -2.187 101 HA LEU 14 HA LEU 14 -13.962 7.028 -1.072 102 HB2 LEU 14 2HB LEU 14 -16.031 8.543 -0.142 103 HB3 LEU 14 1HB LEU 14 -16.361 7.011 0.641 104 HG LEU 14 HG LEU 14 -15.091 8.336 2.163 105 HD11 LEU 14 1HD1 LEU 14 -13.109 6.996 2.532 106 HD12 LEU 14 2HD1 LEU 14 -13.210 6.358 0.890 107 HD13 LEU 14 3HD1 LEU 14 -14.465 5.966 2.067 108 HD21 LEU 14 3HD2 LEU 14 -12.894 9.258 1.601 109 HD22 LEU 14 1HD2 LEU 14 -14.174 9.943 0.600 110 HD23 LEU 14 2HD2 LEU 14 -13.097 8.713 -0.065 111 H GLU 15 H GLU 15 -17.265 5.665 -1.257 112 HA GLU 15 HA GLU 15 -16.663 3.213 -0.038 113 HB2 GLU 15 2HB GLU 15 -18.792 3.941 -2.050 114 HB3 GLU 15 1HB GLU 15 -18.694 2.362 -1.284 115 HG2 GLU 15 2HG GLU 15 -18.897 3.464 0.919 116 HG3 GLU 15 1HG GLU 15 -19.117 5.004 0.092 117 H THR 16 H THR 16 -16.442 4.243 -3.406 118 HA THR 16 HA THR 16 -15.827 1.761 -4.548 119 HB THR 16 HB THR 16 -14.818 4.485 -5.407 120 HG1 THR 16 HG1 THR 16 -17.104 4.398 -5.333 121 HG21 THR 16 3HG2 THR 16 -15.114 1.917 -6.973 122 HG22 THR 16 1HG2 THR 16 -13.592 2.652 -6.472 123 HG23 THR 16 2HG2 THR 16 -14.628 3.477 -7.635 124 H VAL 17 H VAL 17 -13.753 4.212 -3.066 125 HA VAL 17 HA VAL 17 -11.284 2.982 -3.634 126 HB VAL 17 HB VAL 17 -12.042 4.874 -1.400 127 HG11 VAL 17 1HG1 VAL 17 -10.025 3.600 -0.816 128 HG12 VAL 17 2HG1 VAL 17 -9.661 5.298 -1.124 129 HG13 VAL 17 3HG1 VAL 17 -9.287 4.081 -2.344 130 HG21 VAL 17 3HG2 VAL 17 -10.677 5.336 -4.050 131 HG22 VAL 17 1HG2 VAL 17 -10.959 6.560 -2.812 132 HG23 VAL 17 2HG2 VAL 17 -12.325 5.805 -3.633 133 H ILE 18 H ILE 18 -13.202 2.963 -0.607 134 HA ILE 18 HA ILE 18 -11.401 1.245 0.732 135 HB ILE 18 HB ILE 18 -13.197 0.929 2.412 136 HG12 ILE 18 2HG1 ILE 18 -14.816 2.699 0.562 137 HG13 ILE 18 1HG1 ILE 18 -15.127 0.996 0.877 138 HG21 ILE 18 1HG2 ILE 18 -11.669 2.797 2.583 139 HG22 ILE 18 2HG2 ILE 18 -13.278 3.276 3.122 140 HG23 ILE 18 3HG2 ILE 18 -12.700 3.766 1.529 141 HD11 ILE 18 3HD1 ILE 18 -16.646 2.396 2.134 142 HD12 ILE 18 1HD1 ILE 18 -15.284 3.232 2.884 143 HD13 ILE 18 2HD1 ILE 18 -15.568 1.525 3.226 144 H ARG 19 H ARG 19 -14.329 0.597 -1.142 145 HA ARG 19 HA ARG 19 -14.488 -2.150 -0.387 146 HB2 ARG 19 2HB ARG 19 -16.425 -0.838 -1.184 147 HB3 ARG 19 1HB ARG 19 -15.692 -0.743 -2.777 148 HG2 ARG 19 2HG ARG 19 -15.956 -3.077 -3.127 149 HG3 ARG 19 1HG ARG 19 -16.419 -3.339 -1.444 150 HD2 ARG 19 2HD ARG 19 -17.981 -1.658 -3.404 151 HD3 ARG 19 1HD ARG 19 -18.334 -3.346 -3.034 152 HE ARG 19 HE ARG 19 -18.523 -2.446 -0.628 153 HH11 ARG 19 1HH1 ARG 19 -19.469 -0.679 -3.499 154 HH12 ARG 19 2HH1 ARG 19 -20.708 0.228 -2.682 155 HH21 ARG 19 1HH2 ARG 19 -20.145 -1.271 0.447 156 HH22 ARG 19 2HH2 ARG 19 -21.109 -0.127 -0.444 157 H ALA 20 H ALA 20 -12.720 -0.402 -2.813 158 HA ALA 20 HA ALA 20 -12.041 -2.699 -4.388 159 HB1 ALA 20 3HB ALA 20 -11.979 -0.439 -5.337 160 HB2 ALA 20 1HB ALA 20 -10.410 -1.235 -5.465 161 HB3 ALA 20 2HB ALA 20 -10.678 -0.009 -4.228 162 H VAL 21 H VAL 21 -10.711 -1.059 -1.602 163 HA VAL 21 HA VAL 21 -8.232 -2.517 -1.632 164 HB VAL 21 HB VAL 21 -9.453 -0.853 0.579 165 HG11 VAL 21 1HG1 VAL 21 -6.627 -1.841 0.210 166 HG12 VAL 21 2HG1 VAL 21 -7.784 -2.438 1.400 167 HG13 VAL 21 3HG1 VAL 21 -7.193 -0.779 1.500 168 HG21 VAL 21 3HG2 VAL 21 -9.056 0.458 -1.439 169 HG22 VAL 21 1HG2 VAL 21 -7.395 -0.128 -1.506 170 HG23 VAL 21 2HG2 VAL 21 -7.913 0.903 -0.172 171 H TYR 22 H TYR 22 -11.061 -2.479 0.559 172 HA TYR 22 HA TYR 22 -10.278 -4.803 1.985 173 HB2 TYR 22 2HB TYR 22 -13.023 -3.573 1.645 174 HB3 TYR 22 1HB TYR 22 -12.642 -4.862 2.775 175 HD1 TYR 22 HD1 TYR 22 -10.394 -4.145 4.255 176 HD2 TYR 22 HD2 TYR 22 -13.335 -1.546 2.621 177 HE1 TYR 22 HE1 TYR 22 -9.894 -2.488 6.003 178 HE2 TYR 22 HE2 TYR 22 -12.840 0.122 4.354 179 HH TYR 22 HH TYR 22 -11.902 0.208 6.604 180 H ARG 23 H ARG 23 -13.175 -4.486 -0.019 181 HA ARG 23 HA ARG 23 -14.343 -5.909 -1.303 182 HB2 ARG 23 2HB ARG 23 -12.416 -5.987 -2.758 183 HB3 ARG 23 1HB ARG 23 -11.650 -7.203 -1.746 184 HG2 ARG 23 2HG ARG 23 -13.194 -8.857 -2.391 185 HG3 ARG 23 1HG ARG 23 -14.282 -7.668 -3.107 186 HD2 ARG 23 2HD ARG 23 -13.004 -8.966 -4.783 187 HD3 ARG 23 1HD ARG 23 -12.728 -7.231 -4.882 188 HE ARG 23 HE ARG 23 -10.618 -7.747 -3.564 189 HH11 ARG 23 1HH1 ARG 23 -12.125 -10.104 -5.673 190 HH12 ARG 23 2HH1 ARG 23 -10.616 -10.808 -6.169 191 HH21 ARG 23 1HH2 ARG 23 -8.633 -8.691 -4.204 192 HH22 ARG 23 2HH2 ARG 23 -8.631 -10.010 -5.337 193 H GLN 24 H GLN 24 -11.968 -8.085 0.198 194 HA GLN 24 HA GLN 24 -12.163 -9.935 1.470 195 HB2 GLN 24 2HB GLN 24 -13.190 -8.449 3.095 196 HB3 GLN 24 1HB GLN 24 -14.757 -8.638 2.324 197 HG2 GLN 24 2HG GLN 24 -14.780 -10.999 2.933 198 HG3 GLN 24 1HG GLN 24 -13.198 -10.820 3.687 199 HE21 GLN 24 1HE2 GLN 24 -15.810 -11.621 4.780 200 HE22 GLN 24 2HE2 GLN 24 -16.107 -10.548 6.102 201 H VAL 25 H VAL 25 -15.622 -9.585 0.861 202 HA VAL 25 HA VAL 25 -17.169 -10.898 -0.124 203 HB VAL 25 HB VAL 25 -14.867 -12.031 -1.725 204 HG11 VAL 25 1HG1 VAL 25 -16.580 -12.775 -3.292 205 HG12 VAL 25 2HG1 VAL 25 -17.839 -12.157 -2.224 206 HG13 VAL 25 3HG1 VAL 25 -16.825 -13.502 -1.703 207 HG21 VAL 25 3HG2 VAL 25 -15.630 -10.493 -3.482 208 HG22 VAL 25 1HG2 VAL 25 -15.118 -9.623 -2.037 209 HG23 VAL 25 2HG2 VAL 25 -16.835 -9.833 -2.377 210 H LEU 26 H LEU 26 -14.282 -12.983 0.220 211 HA LEU 26 HA LEU 26 -15.753 -15.273 1.002 212 HB2 LEU 26 2HB LEU 26 -13.415 -15.243 0.077 213 HB3 LEU 26 1HB LEU 26 -12.864 -14.648 1.632 214 HG LEU 26 HG LEU 26 -13.635 -16.714 2.707 215 HD11 LEU 26 1HD1 LEU 26 -14.386 -18.598 1.326 216 HD12 LEU 26 2HD1 LEU 26 -14.371 -17.555 -0.097 217 HD13 LEU 26 3HD1 LEU 26 -15.497 -17.234 1.222 218 HD21 LEU 26 3HD2 LEU 26 -12.001 -18.246 1.683 219 HD22 LEU 26 1HD2 LEU 26 -11.347 -16.622 1.903 220 HD23 LEU 26 2HD2 LEU 26 -11.866 -17.155 0.304 221 H GLY 27 H GLY 27 -15.888 -16.235 3.134 222 HA2 GLY 27 2HA GLY 27 -16.355 -16.035 5.415 223 HA3 GLY 27 1HA GLY 27 -15.667 -14.409 5.383 224 H ASN 28 H ASN 28 -18.426 -16.297 4.269 225 HA ASN 28 HA ASN 28 -19.999 -13.811 4.086 226 HB2 ASN 28 2HB ASN 28 -19.383 -14.962 1.911 227 HB3 ASN 28 1HB ASN 28 -20.367 -16.322 2.433 228 HD21 ASN 28 1HD2 ASN 28 -22.592 -16.151 2.392 229 HD22 ASN 28 2HD2 ASN 28 -23.403 -14.838 1.594 230 H ASP 29 H ASP 29 -22.388 -14.229 4.251 231 HA ASP 29 HA ASP 29 -24.273 -15.130 5.148 232 HB2 ASP 29 2HB ASP 29 -22.510 -17.489 5.834 233 HB3 ASP 29 1HB ASP 29 -24.238 -17.423 6.157 234 H TYR 30 H TYR 30 -21.359 -15.394 7.115 235 HA TYR 30 HA TYR 30 -22.918 -14.535 9.443 236 HB2 TYR 30 2HB TYR 30 -20.041 -15.455 9.274 237 HB3 TYR 30 1HB TYR 30 -20.908 -15.062 10.756 238 HD1 TYR 30 HD1 TYR 30 -23.082 -16.452 11.197 239 HD2 TYR 30 HD2 TYR 30 -19.983 -17.645 8.538 240 HE1 TYR 30 HE1 TYR 30 -23.846 -18.785 11.364 241 HE2 TYR 30 HE2 TYR 30 -20.737 -19.979 8.696 242 HH TYR 30 HH TYR 30 -23.723 -20.870 10.069 243 H VAL 31 H VAL 31 -22.193 -12.706 10.681 244 HA VAL 31 HA VAL 31 -21.201 -10.612 8.917 245 HB VAL 31 HB VAL 31 -22.231 -10.358 11.750 246 HG11 VAL 31 1HG1 VAL 31 -20.877 -8.467 11.066 247 HG12 VAL 31 2HG1 VAL 31 -22.576 -7.998 11.138 248 HG13 VAL 31 3HG1 VAL 31 -21.811 -8.308 9.579 249 HG21 VAL 31 3HG2 VAL 31 -23.957 -11.301 10.328 250 HG22 VAL 31 1HG2 VAL 31 -23.695 -10.032 9.132 251 HG23 VAL 31 2HG2 VAL 31 -24.345 -9.624 10.720 252 H MET 32 H MET 32 -19.249 -9.720 9.044 253 HA MET 32 HA MET 32 -17.286 -10.785 10.840 254 HB2 MET 32 2HB MET 32 -15.733 -9.212 9.722 255 HB3 MET 32 1HB MET 32 -16.611 -10.216 8.581 256 HG2 MET 32 2HG MET 32 -17.380 -7.385 9.265 257 HG3 MET 32 1HG MET 32 -16.342 -7.826 7.910 258 HE1 MET 32 3HE MET 32 -18.956 -6.079 7.521 259 HE2 MET 32 1HE MET 32 -19.677 -6.844 6.105 260 HE3 MET 32 2HE MET 32 -17.934 -6.591 6.177 261 H ALA 33 H ALA 33 -16.294 -9.778 12.549 262 HA ALA 33 HA ALA 33 -17.539 -7.281 13.493 263 HB1 ALA 33 3HB ALA 33 -18.623 -9.159 14.605 264 HB2 ALA 33 1HB ALA 33 -17.659 -8.223 15.747 265 HB3 ALA 33 2HB ALA 33 -17.053 -9.764 15.138 266 H SER 34 H SER 34 -16.225 -7.053 15.873 267 HA SER 34 HA SER 34 -14.402 -6.072 16.735 268 HB2 SER 34 2HB SER 34 -12.241 -7.350 16.526 269 HB3 SER 34 1HB SER 34 -13.609 -8.293 17.104 270 HG SER 34 HG SER 34 -13.435 -8.389 14.405 271 H GLU 35 H GLU 35 -14.842 -4.279 15.333 272 HA GLU 35 HA GLU 35 -13.509 -3.908 12.867 273 HB2 GLU 35 2HB GLU 35 -14.595 -1.826 14.772 274 HB3 GLU 35 1HB GLU 35 -14.215 -1.579 13.074 275 HG2 GLU 35 2HG GLU 35 -15.967 -3.150 12.443 276 HG3 GLU 35 1HG GLU 35 -16.344 -3.416 14.145 277 H ARG 36 H ARG 36 -11.481 -3.301 12.451 278 HA ARG 36 HA ARG 36 -9.918 -2.108 14.638 279 HB2 ARG 36 2HB ARG 36 -9.218 -4.437 14.101 280 HB3 ARG 36 1HB ARG 36 -8.861 -3.915 12.459 281 HG2 ARG 36 2HG ARG 36 -7.217 -2.301 13.396 282 HG3 ARG 36 1HG ARG 36 -7.506 -3.005 14.987 283 HD2 ARG 36 2HD ARG 36 -6.452 -4.455 12.561 284 HD3 ARG 36 1HD ARG 36 -5.502 -3.941 13.952 285 HE ARG 36 HE ARG 36 -7.358 -6.192 13.820 286 HH11 ARG 36 1HH1 ARG 36 -5.320 -4.149 15.816 287 HH12 ARG 36 2HH1 ARG 36 -5.164 -5.336 17.073 288 HH21 ARG 36 1HH2 ARG 36 -7.141 -7.744 15.465 289 HH22 ARG 36 2HH2 ARG 36 -6.209 -7.373 16.884 290 H LEU 37 H LEU 37 -10.289 -2.330 11.114 291 HA LEU 37 HA LEU 37 -8.558 -0.014 10.773 292 HB2 LEU 37 2HB LEU 37 -9.878 -1.803 8.737 293 HB3 LEU 37 1HB LEU 37 -8.773 -0.494 8.364 294 HG LEU 37 HG LEU 37 -8.089 -2.988 9.919 295 HD11 LEU 37 1HD1 LEU 37 -8.427 -3.387 7.540 296 HD12 LEU 37 2HD1 LEU 37 -6.723 -3.530 7.975 297 HD13 LEU 37 3HD1 LEU 37 -7.305 -2.079 7.159 298 HD21 LEU 37 3HD2 LEU 37 -5.778 -2.166 9.768 299 HD22 LEU 37 1HD2 LEU 37 -6.804 -1.088 10.716 300 HD23 LEU 37 2HD2 LEU 37 -6.370 -0.664 9.059 301 H VAL 38 H VAL 38 -11.706 -0.349 11.478 302 HA VAL 38 HA VAL 38 -12.953 1.322 9.552 303 HB VAL 38 HB VAL 38 -13.796 0.685 12.387 304 HG11 VAL 38 1HG1 VAL 38 -14.893 2.715 11.634 305 HG12 VAL 38 2HG1 VAL 38 -16.047 1.382 11.659 306 HG13 VAL 38 3HG1 VAL 38 -15.364 1.930 10.128 307 HG21 VAL 38 3HG2 VAL 38 -15.288 -0.934 11.349 308 HG22 VAL 38 1HG2 VAL 38 -13.611 -1.274 10.927 309 HG23 VAL 38 2HG2 VAL 38 -14.673 -0.497 9.755 310 H SER 39 H SER 39 -11.180 1.892 12.501 311 HA SER 39 HA SER 39 -11.676 4.631 12.819 312 HB2 SER 39 2HB SER 39 -9.361 4.619 13.881 313 HB3 SER 39 1HB SER 39 -10.509 3.455 14.547 314 HG SER 39 HG SER 39 -9.251 1.895 13.910 315 H ALA 40 H ALA 40 -9.331 2.892 10.829 316 HA ALA 40 HA ALA 40 -7.901 5.111 9.860 317 HB1 ALA 40 3HB ALA 40 -8.312 2.420 8.551 318 HB2 ALA 40 1HB ALA 40 -7.056 2.817 9.723 319 HB3 ALA 40 2HB ALA 40 -7.062 3.595 8.139 320 H GLU 41 H GLU 41 -10.582 3.266 8.383 321 HA GLU 41 HA GLU 41 -10.746 4.864 6.063 322 HB2 GLU 41 2HB GLU 41 -12.995 3.852 5.763 323 HB3 GLU 41 1HB GLU 41 -11.733 2.668 6.071 324 HG2 GLU 41 2HG GLU 41 -12.436 2.468 8.370 325 HG3 GLU 41 1HG GLU 41 -13.646 3.724 8.133 326 H SER 42 H SER 42 -12.146 5.233 9.255 327 HA SER 42 HA SER 42 -13.976 7.292 8.557 328 HB2 SER 42 2HB SER 42 -12.676 6.724 11.234 329 HB3 SER 42 1HB SER 42 -14.083 7.754 10.972 330 HG SER 42 HG SER 42 -13.855 4.946 10.675 331 H LEU 43 H LEU 43 -10.638 7.303 9.768 332 HA LEU 43 HA LEU 43 -10.310 10.098 9.840 333 HB2 LEU 43 2HB LEU 43 -8.288 7.908 9.376 334 HB3 LEU 43 1HB LEU 43 -7.871 9.589 9.646 335 HG LEU 43 HG LEU 43 -9.296 7.799 11.620 336 HD11 LEU 43 1HD1 LEU 43 -7.221 7.921 12.901 337 HD12 LEU 43 2HD1 LEU 43 -6.470 8.847 11.601 338 HD13 LEU 43 3HD1 LEU 43 -6.960 7.175 11.325 339 HD21 LEU 43 3HD2 LEU 43 -9.980 10.121 11.846 340 HD22 LEU 43 1HD2 LEU 43 -8.291 10.631 11.885 341 HD23 LEU 43 2HD2 LEU 43 -8.946 9.647 13.194 342 H LEU 44 H LEU 44 -9.818 7.721 7.275 343 HA LEU 44 HA LEU 44 -8.842 9.462 5.297 344 HB2 LEU 44 2HB LEU 44 -8.792 7.008 5.123 345 HB3 LEU 44 1HB LEU 44 -10.540 6.981 4.995 346 HG LEU 44 HG LEU 44 -10.366 8.256 2.865 347 HD11 LEU 44 1HD1 LEU 44 -8.231 8.473 1.761 348 HD12 LEU 44 2HD1 LEU 44 -7.410 7.720 3.129 349 HD13 LEU 44 3HD1 LEU 44 -8.177 9.298 3.320 350 HD21 LEU 44 3HD2 LEU 44 -10.615 5.848 2.821 351 HD22 LEU 44 1HD2 LEU 44 -8.871 5.640 2.991 352 HD23 LEU 44 2HD2 LEU 44 -9.535 6.367 1.528 353 H ARG 45 H ARG 45 -12.122 8.551 6.221 354 HA ARG 45 HA ARG 45 -13.511 9.908 4.193 355 HB2 ARG 45 2HB ARG 45 -14.414 8.174 5.774 356 HB3 ARG 45 1HB ARG 45 -14.458 9.414 7.015 357 HG2 ARG 45 2HG ARG 45 -15.997 10.720 5.579 358 HG3 ARG 45 1HG ARG 45 -16.023 9.367 4.447 359 HD2 ARG 45 2HD ARG 45 -17.040 9.460 7.277 360 HD3 ARG 45 1HD ARG 45 -17.938 9.103 5.802 361 HE ARG 45 HE ARG 45 -16.123 7.298 7.223 362 HH11 ARG 45 1HH1 ARG 45 -18.389 7.848 4.618 363 HH12 ARG 45 2HH1 ARG 45 -18.560 6.161 4.234 364 HH21 ARG 45 1HH2 ARG 45 -16.367 5.078 6.754 365 HH22 ARG 45 2HH2 ARG 45 -17.421 4.583 5.459 366 H ASN 46 H ASN 46 -12.145 10.994 7.220 367 HA ASN 46 HA ASN 46 -13.455 13.576 7.090 368 HB2 ASN 46 2HB ASN 46 -11.284 12.560 8.938 369 HB3 ASN 46 1HB ASN 46 -12.100 14.111 9.093 370 HD21 ASN 46 1HD2 ASN 46 -11.975 11.931 10.975 371 HD22 ASN 46 2HD2 ASN 46 -13.607 11.446 11.279 372 H GLY 47 H GLY 47 -10.780 12.165 5.643 373 HA2 GLY 47 2HA GLY 47 -9.133 13.082 4.304 374 HA3 GLY 47 1HA GLY 47 -9.769 14.679 4.676 375 H LYS 48 H LYS 48 -9.042 12.548 7.266 376 HA LYS 48 HA LYS 48 -7.128 14.409 8.328 377 HB2 LYS 48 2HB LYS 48 -8.976 12.877 9.487 378 HB3 LYS 48 1HB LYS 48 -7.634 11.746 9.574 379 HG2 LYS 48 2HG LYS 48 -7.390 14.554 10.579 380 HG3 LYS 48 1HG LYS 48 -8.051 13.258 11.577 381 HD2 LYS 48 2HD LYS 48 -6.009 12.030 11.450 382 HD3 LYS 48 1HD LYS 48 -5.359 13.138 10.238 383 HE2 LYS 48 2HE LYS 48 -5.270 14.922 11.827 384 HE3 LYS 48 1HE LYS 48 -6.114 13.951 13.033 385 HZ1 LYS 48 3HZ LYS 48 -3.651 14.112 13.322 386 HZ2 LYS 48 1HZ LYS 48 -3.476 13.197 11.901 387 HZ3 LYS 48 2HZ LYS 48 -4.258 12.531 13.255 388 H ILE 49 H ILE 49 -7.105 11.149 6.985 389 HA ILE 49 HA ILE 49 -4.173 11.308 6.859 390 HB ILE 49 HB ILE 49 -4.072 8.835 7.040 391 HG12 ILE 49 2HG1 ILE 49 -6.243 7.925 8.300 392 HG13 ILE 49 1HG1 ILE 49 -7.027 9.157 7.319 393 HG21 ILE 49 1HG2 ILE 49 -5.361 10.203 9.397 394 HG22 ILE 49 2HG2 ILE 49 -3.647 10.252 8.979 395 HG23 ILE 49 3HG2 ILE 49 -4.396 8.727 9.452 396 HD11 ILE 49 3HD1 ILE 49 -7.108 6.981 6.251 397 HD12 ILE 49 1HD1 ILE 49 -5.346 6.886 6.278 398 HD13 ILE 49 2HD1 ILE 49 -6.149 8.115 5.300 399 H THR 50 H THR 50 -3.205 10.244 5.020 400 HA THR 50 HA THR 50 -4.832 10.619 2.658 401 HB THR 50 HB THR 50 -2.720 10.228 1.417 402 HG1 THR 50 HG1 THR 50 -0.798 9.937 2.598 403 HG21 THR 50 3HG2 THR 50 -3.282 12.493 2.115 404 HG22 THR 50 1HG2 THR 50 -1.539 12.242 2.209 405 HG23 THR 50 2HG2 THR 50 -2.514 12.222 3.680 406 H VAL 51 H VAL 51 -4.703 8.990 0.864 407 HA VAL 51 HA VAL 51 -5.626 6.470 1.680 408 HB VAL 51 HB VAL 51 -4.460 7.247 -1.004 409 HG11 VAL 51 1HG1 VAL 51 -4.606 4.822 -0.706 410 HG12 VAL 51 2HG1 VAL 51 -5.765 5.398 -1.904 411 HG13 VAL 51 3HG1 VAL 51 -6.312 4.977 -0.281 412 HG21 VAL 51 3HG2 VAL 51 -7.315 7.290 -0.035 413 HG22 VAL 51 1HG2 VAL 51 -6.773 7.648 -1.675 414 HG23 VAL 51 2HG2 VAL 51 -6.301 8.700 -0.341 415 H ARG 52 H ARG 52 -2.436 7.674 0.953 416 HA ARG 52 HA ARG 52 -0.953 5.354 0.688 417 HB2 ARG 52 2HB ARG 52 -0.138 7.747 0.539 418 HB3 ARG 52 1HB ARG 52 -0.097 7.764 2.298 419 HG2 ARG 52 2HG ARG 52 1.426 5.740 2.122 420 HG3 ARG 52 1HG ARG 52 1.572 6.140 0.411 421 HD2 ARG 52 2HD ARG 52 3.407 7.182 1.421 422 HD3 ARG 52 1HD ARG 52 2.229 8.476 1.193 423 HE ARG 52 HE ARG 52 1.660 7.764 3.679 424 HH11 ARG 52 1HH1 ARG 52 4.795 8.177 2.178 425 HH12 ARG 52 2HH1 ARG 52 5.571 8.664 3.651 426 HH21 ARG 52 1HH2 ARG 52 2.681 8.363 5.613 427 HH22 ARG 52 2HH2 ARG 52 4.384 8.750 5.608 428 H GLU 53 H GLU 53 -1.904 7.043 3.663 429 HA GLU 53 HA GLU 53 -0.693 5.229 5.469 430 HB2 GLU 53 2HB GLU 53 -3.061 7.063 5.909 431 HB3 GLU 53 1HB GLU 53 -2.104 6.306 7.172 432 HG2 GLU 53 2HG GLU 53 -1.068 8.303 5.173 433 HG3 GLU 53 1HG GLU 53 -1.548 8.671 6.830 434 H PHE 54 H PHE 54 -3.935 5.502 4.120 435 HA PHE 54 HA PHE 54 -5.210 3.544 5.660 436 HB2 PHE 54 2HB PHE 54 -6.433 5.180 4.326 437 HB3 PHE 54 1HB PHE 54 -5.798 4.478 2.843 438 HD1 PHE 54 HD2 PHE 54 -7.889 3.681 5.811 439 HD2 PHE 54 HD1 PHE 54 -6.962 2.793 1.752 440 HE1 PHE 54 HE2 PHE 54 -9.822 2.164 5.703 441 HE2 PHE 54 HE1 PHE 54 -8.895 1.278 1.638 442 HZ PHE 54 HZ PHE 54 -10.328 0.958 3.617 443 H VAL 55 H VAL 55 -3.755 3.279 2.412 444 HA VAL 55 HA VAL 55 -4.324 0.568 2.004 445 HB VAL 55 HB VAL 55 -2.008 2.184 0.911 446 HG11 VAL 55 1HG1 VAL 55 -1.581 -0.217 0.724 447 HG12 VAL 55 2HG1 VAL 55 -1.885 0.502 -0.856 448 HG13 VAL 55 3HG1 VAL 55 -3.146 -0.437 -0.060 449 HG21 VAL 55 3HG2 VAL 55 -4.193 3.116 0.352 450 HG22 VAL 55 1HG2 VAL 55 -4.712 1.546 -0.267 451 HG23 VAL 55 2HG2 VAL 55 -3.417 2.430 -1.076 452 H ARG 56 H ARG 56 -1.505 2.128 3.487 453 HA ARG 56 HA ARG 56 0.056 -0.171 3.861 454 HB2 ARG 56 2HB ARG 56 0.905 2.126 4.173 455 HB3 ARG 56 1HB ARG 56 -0.086 2.288 5.617 456 HG2 ARG 56 2HG ARG 56 1.173 0.368 6.603 457 HG3 ARG 56 1HG ARG 56 2.246 0.427 5.202 458 HD2 ARG 56 2HD ARG 56 3.240 1.638 7.039 459 HD3 ARG 56 1HD ARG 56 2.789 2.768 5.766 460 HE ARG 56 HE ARG 56 1.194 2.354 8.219 461 HH11 ARG 56 1HH1 ARG 56 2.513 4.431 5.729 462 HH12 ARG 56 2HH1 ARG 56 1.802 5.880 6.372 463 HH21 ARG 56 1HH2 ARG 56 0.304 4.256 9.101 464 HH22 ARG 56 2HH2 ARG 56 0.568 5.784 8.307 465 H ALA 57 H ALA 57 -2.292 1.398 6.004 466 HA ALA 57 HA ALA 57 -1.987 -0.272 8.214 467 HB1 ALA 57 3HB ALA 57 -4.478 1.169 7.316 468 HB2 ALA 57 1HB ALA 57 -3.175 1.865 8.278 469 HB3 ALA 57 2HB ALA 57 -4.158 0.558 8.939 470 H VAL 58 H VAL 58 -4.157 -0.573 5.420 471 HA VAL 58 HA VAL 58 -5.524 -2.870 6.371 472 HB VAL 58 HB VAL 58 -5.146 -1.969 3.507 473 HG11 VAL 58 1HG1 VAL 58 -5.880 -4.290 3.656 474 HG12 VAL 58 2HG1 VAL 58 -7.181 -3.262 3.056 475 HG13 VAL 58 3HG1 VAL 58 -7.195 -3.816 4.730 476 HG21 VAL 58 3HG2 VAL 58 -7.349 -0.916 3.765 477 HG22 VAL 58 1HG2 VAL 58 -6.160 -0.223 4.868 478 HG23 VAL 58 2HG2 VAL 58 -7.358 -1.368 5.469 479 H ALA 59 H ALA 59 -2.702 -2.435 4.280 480 HA ALA 59 HA ALA 59 -2.426 -5.132 3.518 481 HB1 ALA 59 3HB ALA 59 -0.292 -3.010 3.685 482 HB2 ALA 59 1HB ALA 59 -1.364 -3.292 2.313 483 HB3 ALA 59 2HB ALA 59 -0.190 -4.522 2.784 484 H LYS 60 H LYS 60 -1.035 -3.299 6.211 485 HA LYS 60 HA LYS 60 0.416 -5.679 7.092 486 HB2 LYS 60 2HB LYS 60 1.577 -4.221 8.638 487 HB3 LYS 60 1HB LYS 60 1.599 -3.511 7.032 488 HG2 LYS 60 2HG LYS 60 -0.364 -2.103 7.769 489 HG3 LYS 60 1HG LYS 60 -0.039 -2.674 9.406 490 HD2 LYS 60 2HD LYS 60 1.877 -1.166 7.624 491 HD3 LYS 60 1HD LYS 60 1.022 -0.512 9.019 492 HE2 LYS 60 2HE LYS 60 2.201 -2.108 10.470 493 HE3 LYS 60 1HE LYS 60 3.071 -2.724 9.070 494 HZ1 LYS 60 3HZ LYS 60 4.391 -1.121 10.328 495 HZ2 LYS 60 1HZ LYS 60 3.212 0.071 10.077 496 HZ3 LYS 60 2HZ LYS 60 4.081 -0.554 8.759 497 H SER 61 H SER 61 -2.614 -5.106 7.315 498 HA SER 61 HA SER 61 -3.015 -5.190 10.170 499 HB2 SER 61 2HB SER 61 -4.628 -3.922 8.990 500 HB3 SER 61 1HB SER 61 -4.820 -5.166 7.757 501 HG SER 61 HG SER 61 -5.982 -6.361 9.121 502 H GLU 62 H GLU 62 -4.587 -6.931 10.956 503 HA GLU 62 HA GLU 62 -3.242 -9.422 10.664 504 HB2 GLU 62 2HB GLU 62 -4.166 -8.616 12.802 505 HB3 GLU 62 1HB GLU 62 -5.789 -8.742 12.145 506 HG2 GLU 62 2HG GLU 62 -5.376 -11.194 11.843 507 HG3 GLU 62 1HG GLU 62 -3.874 -10.978 12.744 508 H LEU 63 H LEU 63 -3.636 -9.710 8.348 509 HA LEU 63 HA LEU 63 -6.165 -11.176 7.924 510 HB2 LEU 63 2HB LEU 63 -4.643 -9.418 6.010 511 HB3 LEU 63 1HB LEU 63 -5.722 -10.667 5.431 512 HG LEU 63 HG LEU 63 -6.958 -8.676 5.339 513 HD11 LEU 63 1HD1 LEU 63 -8.195 -10.549 6.283 514 HD12 LEU 63 2HD1 LEU 63 -8.771 -9.006 6.914 515 HD13 LEU 63 3HD1 LEU 63 -7.740 -10.035 7.908 516 HD21 LEU 63 3HD2 LEU 63 -7.190 -7.100 7.176 517 HD22 LEU 63 1HD2 LEU 63 -5.500 -7.287 6.711 518 HD23 LEU 63 2HD2 LEU 63 -6.105 -8.078 8.166 519 H TYR 64 H TYR 64 -2.778 -10.874 6.966 520 HA TYR 64 HA TYR 64 -2.624 -13.298 5.521 521 HB2 TYR 64 2HB TYR 64 -0.156 -12.941 5.708 522 HB3 TYR 64 1HB TYR 64 -1.030 -11.530 5.119 523 HD1 TYR 64 HD1 TYR 64 -1.225 -9.527 6.486 524 HD2 TYR 64 HD2 TYR 64 0.888 -12.934 7.913 525 HE1 TYR 64 HE1 TYR 64 -0.261 -8.168 8.291 526 HE2 TYR 64 HE2 TYR 64 1.858 -11.579 9.721 527 HH TYR 64 HH TYR 64 0.673 -8.522 10.549 528 H LYS 65 H LYS 65 -2.676 -12.685 8.860 529 HA LYS 65 HA LYS 65 -0.806 -14.439 9.915 530 HB2 LYS 65 2HB LYS 65 -2.054 -12.705 11.185 531 HB3 LYS 65 1HB LYS 65 -3.488 -13.718 11.110 532 HG2 LYS 65 2HG LYS 65 -2.554 -14.060 13.237 533 HG3 LYS 65 1HG LYS 65 -2.150 -15.496 12.296 534 HD2 LYS 65 2HD LYS 65 0.080 -14.526 11.848 535 HD3 LYS 65 1HD LYS 65 -0.331 -13.165 12.893 536 HE2 LYS 65 2HE LYS 65 -0.769 -14.876 14.711 537 HE3 LYS 65 1HE LYS 65 -0.007 -16.059 13.649 538 HZ1 LYS 65 3HZ LYS 65 1.246 -13.603 14.755 539 HZ2 LYS 65 1HZ LYS 65 1.992 -14.636 13.635 540 HZ3 LYS 65 2HZ LYS 65 1.601 -15.203 15.182 541 H GLU 66 H GLU 66 -3.972 -15.156 8.607 542 HA GLU 66 HA GLU 66 -4.243 -17.648 10.004 543 HB2 GLU 66 2HB GLU 66 -5.821 -16.595 7.656 544 HB3 GLU 66 1HB GLU 66 -6.266 -17.962 8.668 545 HG2 GLU 66 2HG GLU 66 -6.344 -16.393 10.609 546 HG3 GLU 66 1HG GLU 66 -6.108 -15.069 9.468 547 H LYS 67 H LYS 67 -2.617 -16.731 7.128 548 HA LYS 67 HA LYS 67 -2.131 -19.501 6.453 549 HB2 LYS 67 2HB LYS 67 -4.258 -19.122 5.322 550 HB3 LYS 67 1HB LYS 67 -3.609 -17.693 4.533 551 HG2 LYS 67 2HG LYS 67 -1.991 -19.107 3.343 552 HG3 LYS 67 1HG LYS 67 -2.696 -20.531 4.109 553 HD2 LYS 67 2HD LYS 67 -4.161 -18.604 2.304 554 HD3 LYS 67 1HD LYS 67 -3.540 -20.186 1.828 555 HE2 LYS 67 2HE LYS 67 -5.000 -21.259 3.463 556 HE3 LYS 67 1HE LYS 67 -5.609 -19.682 3.963 557 HZ1 LYS 67 3HZ LYS 67 -6.569 -19.355 1.816 558 HZ2 LYS 67 1HZ LYS 67 -7.075 -20.866 2.394 559 HZ3 LYS 67 2HZ LYS 67 -5.862 -20.771 1.214 560 H PHE 68 H PHE 68 -1.914 -16.215 5.109 561 HA PHE 68 HA PHE 68 0.397 -16.851 3.554 562 HB2 PHE 68 2HB PHE 68 -0.616 -14.076 4.158 563 HB3 PHE 68 1HB PHE 68 0.258 -14.630 2.734 564 HD1 PHE 68 HD2 PHE 68 -0.992 -16.567 1.398 565 HD2 PHE 68 HD1 PHE 68 -2.872 -13.746 3.969 566 HE1 PHE 68 HE2 PHE 68 -3.132 -16.944 0.242 567 HE2 PHE 68 HE1 PHE 68 -5.016 -14.118 2.819 568 HZ PHE 68 HZ PHE 68 -5.144 -15.717 0.951 569 H LEU 69 H LEU 69 1.701 -17.625 5.317 570 HA LEU 69 HA LEU 69 3.712 -15.905 6.170 571 HB2 LEU 69 2HB LEU 69 1.916 -14.966 7.614 572 HB3 LEU 69 1HB LEU 69 1.712 -16.545 8.347 573 HG LEU 69 HG LEU 69 4.069 -16.410 9.162 574 HD11 LEU 69 1HD1 LEU 69 4.933 -14.826 7.532 575 HD12 LEU 69 2HD1 LEU 69 5.163 -14.221 9.173 576 HD13 LEU 69 3HD1 LEU 69 3.868 -13.572 8.166 577 HD21 LEU 69 3HD2 LEU 69 2.188 -15.851 10.608 578 HD22 LEU 69 1HD2 LEU 69 2.229 -14.186 10.031 579 HD23 LEU 69 2HD2 LEU 69 3.584 -14.831 10.959 580 H TYR 70 H TYR 70 1.814 -18.778 6.621 581 HA TYR 70 HA TYR 70 4.012 -20.186 7.924 582 HB2 TYR 70 2HB TYR 70 1.154 -20.986 7.348 583 HB3 TYR 70 1HB TYR 70 2.336 -22.049 8.102 584 HD1 TYR 70 HD1 TYR 70 0.232 -19.081 8.564 585 HD2 TYR 70 HD2 TYR 70 3.051 -21.694 10.377 586 HE1 TYR 70 HE1 TYR 70 -0.339 -18.156 10.772 587 HE2 TYR 70 HE2 TYR 70 2.493 -20.780 12.585 588 HH TYR 70 HH TYR 70 1.558 -18.716 13.533 589 H GLY 71 H GLY 71 4.891 -22.098 7.120 590 HA2 GLY 71 2HA GLY 71 4.742 -23.883 5.427 591 HA3 GLY 71 1HA GLY 71 4.351 -22.627 4.262 592 H ASN 72 H ASN 72 5.944 -21.749 3.132 593 HA ASN 72 HA ASN 72 8.625 -21.547 4.096 594 HB2 ASN 72 2HB ASN 72 9.621 -22.951 2.259 595 HB3 ASN 72 1HB ASN 72 8.786 -23.867 3.505 596 HD21 ASN 72 1HD2 ASN 72 8.555 -25.612 2.114 597 HD22 ASN 72 2HD2 ASN 72 7.398 -25.614 0.825 598 H PHE 73 H PHE 73 10.096 -20.852 2.178 599 HA PHE 73 HA PHE 73 10.603 -19.372 0.554 600 HB2 PHE 73 2HB PHE 73 7.883 -20.208 -0.410 601 HB3 PHE 73 1HB PHE 73 8.820 -18.988 -1.265 602 HD1 PHE 73 HD2 PHE 73 8.876 -22.507 -0.115 603 HD2 PHE 73 HD1 PHE 73 10.552 -19.589 -2.713 604 HE1 PHE 73 HE2 PHE 73 10.108 -24.276 -1.301 605 HE2 PHE 73 HE1 PHE 73 11.790 -21.349 -3.902 606 HZ PHE 73 HZ PHE 73 11.567 -23.698 -3.194 607 H GLN 74 H GLN 74 10.893 -17.578 1.746 608 HA GLN 74 HA GLN 74 8.819 -15.983 2.803 609 HB2 GLN 74 2HB GLN 74 11.657 -15.153 2.175 610 HB3 GLN 74 1HB GLN 74 10.553 -14.348 3.282 611 HG2 GLN 74 2HG GLN 74 11.818 -17.056 3.597 612 HG3 GLN 74 1HG GLN 74 12.083 -15.616 4.578 613 HE21 GLN 74 1HE2 GLN 74 10.519 -15.004 6.081 614 HE22 GLN 74 2HE2 GLN 74 9.251 -16.072 6.591 615 H THR 75 H THR 75 10.358 -16.120 -0.286 616 HA THR 75 HA THR 75 9.712 -13.642 -1.377 617 HB THR 75 HB THR 75 9.499 -15.091 -3.557 618 HG1 THR 75 HG1 THR 75 10.577 -17.144 -3.241 619 HG21 THR 75 3HG2 THR 75 11.952 -15.250 -3.692 620 HG22 THR 75 1HG2 THR 75 12.058 -14.958 -1.956 621 HG23 THR 75 2HG2 THR 75 11.434 -13.702 -3.024 622 H ARG 76 H ARG 76 7.800 -16.576 -1.034 623 HA ARG 76 HA ARG 76 5.547 -15.886 -2.514 624 HB2 ARG 76 2HB ARG 76 5.818 -18.128 -1.723 625 HB3 ARG 76 1HB ARG 76 5.888 -17.597 -0.050 626 HG2 ARG 76 2HG ARG 76 3.536 -16.973 -0.136 627 HG3 ARG 76 1HG ARG 76 3.458 -17.470 -1.829 628 HD2 ARG 76 2HD ARG 76 4.223 -19.299 0.444 629 HD3 ARG 76 1HD ARG 76 2.591 -19.165 -0.208 630 HE ARG 76 HE ARG 76 3.565 -19.915 -2.370 631 HH11 ARG 76 1HH1 ARG 76 5.208 -20.691 0.631 632 HH12 ARG 76 2HH1 ARG 76 5.996 -22.092 -0.019 633 HH21 ARG 76 1HH2 ARG 76 4.581 -21.742 -3.215 634 HH22 ARG 76 2HH2 ARG 76 5.650 -22.690 -2.220 635 H VAL 77 H VAL 77 6.262 -15.284 0.913 636 HA VAL 77 HA VAL 77 3.808 -14.077 1.565 637 HB VAL 77 HB VAL 77 6.513 -13.597 2.829 638 HG11 VAL 77 1HG1 VAL 77 4.897 -11.877 3.444 639 HG12 VAL 77 2HG1 VAL 77 5.256 -12.929 4.814 640 HG13 VAL 77 3HG1 VAL 77 3.744 -13.123 3.926 641 HG21 VAL 77 3HG2 VAL 77 5.766 -15.283 4.485 642 HG22 VAL 77 1HG2 VAL 77 5.981 -15.946 2.864 643 HG23 VAL 77 2HG2 VAL 77 4.361 -15.606 3.472 644 H ILE 78 H ILE 78 6.901 -12.669 0.526 645 HA ILE 78 HA ILE 78 6.075 -9.977 0.741 646 HB ILE 78 HB ILE 78 8.270 -11.181 -0.951 647 HG12 ILE 78 2HG1 ILE 78 8.268 -9.898 1.789 648 HG13 ILE 78 1HG1 ILE 78 8.567 -11.594 1.427 649 HG21 ILE 78 1HG2 ILE 78 7.679 -9.001 -1.828 650 HG22 ILE 78 2HG2 ILE 78 9.229 -8.900 -0.986 651 HG23 ILE 78 3HG2 ILE 78 7.759 -8.301 -0.212 652 HD11 ILE 78 3HD1 ILE 78 10.597 -10.940 0.201 653 HD12 ILE 78 1HD1 ILE 78 10.639 -10.465 1.899 654 HD13 ILE 78 2HD1 ILE 78 10.302 -9.262 0.655 655 H GLU 79 H GLU 79 6.007 -12.276 -1.973 656 HA GLU 79 HA GLU 79 5.084 -10.429 -3.903 657 HB2 GLU 79 2HB GLU 79 4.903 -13.424 -3.707 658 HB3 GLU 79 1HB GLU 79 4.132 -12.548 -5.022 659 HG2 GLU 79 2HG GLU 79 6.385 -11.542 -5.518 660 HG3 GLU 79 1HG GLU 79 7.059 -12.702 -4.371 661 H LEU 80 H LEU 80 3.475 -12.101 -1.325 662 HA LEU 80 HA LEU 80 0.826 -11.592 -2.340 663 HB2 LEU 80 2HB LEU 80 1.782 -12.455 0.388 664 HB3 LEU 80 1HB LEU 80 0.096 -12.343 -0.088 665 HG LEU 80 HG LEU 80 2.113 -14.141 -1.435 666 HD11 LEU 80 1HD1 LEU 80 0.035 -14.798 0.643 667 HD12 LEU 80 2HD1 LEU 80 1.785 -14.844 0.860 668 HD13 LEU 80 3HD1 LEU 80 1.004 -15.970 -0.250 669 HD21 LEU 80 3HD2 LEU 80 0.251 -13.513 -2.864 670 HD22 LEU 80 1HD2 LEU 80 -0.894 -13.993 -1.612 671 HD23 LEU 80 2HD2 LEU 80 0.122 -15.206 -2.389 672 H ASN 81 H ASN 81 2.927 -10.169 0.160 673 HA ASN 81 HA ASN 81 1.244 -8.104 0.985 674 HB2 ASN 81 2HB ASN 81 4.252 -7.992 0.594 675 HB3 ASN 81 1HB ASN 81 3.307 -6.816 1.499 676 HD21 ASN 81 1HD2 ASN 81 5.480 -8.335 2.492 677 HD22 ASN 81 2HD2 ASN 81 4.858 -9.346 3.756 678 H TYR 82 H TYR 82 3.601 -8.183 -1.647 679 HA TYR 82 HA TYR 82 2.861 -5.617 -2.646 680 HB2 TYR 82 2HB TYR 82 4.529 -7.833 -3.841 681 HB3 TYR 82 1HB TYR 82 4.306 -6.257 -4.597 682 HD1 TYR 82 HD2 TYR 82 4.280 -5.650 -1.185 683 HD2 TYR 82 HD1 TYR 82 6.970 -6.694 -4.310 684 HE1 TYR 82 HE2 TYR 82 6.150 -4.771 0.144 685 HE2 TYR 82 HE1 TYR 82 8.847 -5.816 -2.990 686 HH TYR 82 HH TYR 82 8.624 -5.139 0.296 687 H LYS 83 H LYS 83 1.648 -8.823 -3.118 688 HA LYS 83 HA LYS 83 0.243 -8.473 -5.514 689 HB2 LYS 83 2HB LYS 83 0.396 -10.624 -4.287 690 HB3 LYS 83 1HB LYS 83 -0.661 -9.976 -3.044 691 HG2 LYS 83 2HG LYS 83 -1.805 -11.488 -4.619 692 HG3 LYS 83 1HG LYS 83 -2.500 -9.868 -4.588 693 HD2 LYS 83 2HD LYS 83 -1.747 -9.353 -6.692 694 HD3 LYS 83 1HD LYS 83 -0.387 -10.470 -6.594 695 HE2 LYS 83 2HE LYS 83 -2.158 -11.159 -8.198 696 HE3 LYS 83 1HE LYS 83 -1.811 -12.352 -6.950 697 HZ1 LYS 83 3HZ LYS 83 -3.796 -11.858 -5.838 698 HZ2 LYS 83 1HZ LYS 83 -4.226 -11.925 -7.476 699 HZ3 LYS 83 2HZ LYS 83 -4.052 -10.425 -6.706 700 H HIS 84 H HIS 84 -0.359 -7.368 -2.257 701 HA HIS 84 HA HIS 84 -2.880 -6.122 -3.019 702 HB2 HIS 84 2HB HIS 84 -1.386 -5.730 -0.426 703 HB3 HIS 84 1HB HIS 84 -3.098 -5.474 -0.732 704 HD1 HIS 84 HD1 HIS 84 -3.889 -8.172 -1.963 705 HD2 HIS 84 HD2 HIS 84 -1.361 -7.777 1.325 706 HE1 HIS 84 HE1 HIS 84 -3.994 -10.373 -0.753 707 HE2 HIS 84 HE2 HIS 84 -2.335 -10.164 1.130 708 H LEU 85 H LEU 85 0.474 -5.254 -2.808 709 HA LEU 85 HA LEU 85 -0.165 -2.398 -2.626 710 HB2 LEU 85 2HB LEU 85 2.458 -3.835 -2.286 711 HB3 LEU 85 1HB LEU 85 2.237 -2.103 -2.129 712 HG LEU 85 HG LEU 85 0.934 -4.184 -0.375 713 HD11 LEU 85 1HD1 LEU 85 3.319 -4.070 0.021 714 HD12 LEU 85 2HD1 LEU 85 2.446 -3.321 1.359 715 HD13 LEU 85 3HD1 LEU 85 3.236 -2.314 0.146 716 HD21 LEU 85 3HD2 LEU 85 0.245 -2.293 0.989 717 HD22 LEU 85 1HD2 LEU 85 -0.414 -2.158 -0.642 718 HD23 LEU 85 2HD2 LEU 85 0.974 -1.178 -0.164 719 H LEU 86 H LEU 86 1.914 -4.538 -4.621 720 HA LEU 86 HA LEU 86 2.270 -2.254 -6.458 721 HB2 LEU 86 2HB LEU 86 4.157 -4.556 -5.951 722 HB3 LEU 86 1HB LEU 86 4.434 -3.231 -7.063 723 HG LEU 86 HG LEU 86 4.222 -2.992 -4.062 724 HD11 LEU 86 1HD1 LEU 86 6.588 -2.786 -5.918 725 HD12 LEU 86 2HD1 LEU 86 6.281 -4.075 -4.753 726 HD13 LEU 86 3HD1 LEU 86 6.608 -2.435 -4.190 727 HD21 LEU 86 3HD2 LEU 86 4.922 -0.674 -4.413 728 HD22 LEU 86 1HD2 LEU 86 3.375 -1.005 -5.195 729 HD23 LEU 86 2HD2 LEU 86 4.850 -0.916 -6.159 730 H GLY 87 H GLY 87 0.441 -4.837 -6.312 731 HA2 GLY 87 2HA GLY 87 -0.707 -5.925 -8.021 732 HA3 GLY 87 1HA GLY 87 0.407 -5.208 -9.175 733 H ARG 88 H ARG 88 1.167 -7.074 -6.341 734 HA ARG 88 HA ARG 88 1.937 -9.154 -5.945 735 HB2 ARG 88 2HB ARG 88 0.514 -10.106 -7.700 736 HB3 ARG 88 1HB ARG 88 1.734 -9.705 -8.910 737 HG2 ARG 88 2HG ARG 88 3.297 -11.087 -7.305 738 HG3 ARG 88 1HG ARG 88 1.769 -11.804 -6.800 739 HD2 ARG 88 2HD ARG 88 1.373 -12.733 -8.889 740 HD3 ARG 88 1HD ARG 88 2.462 -11.606 -9.704 741 HE ARG 88 HE ARG 88 4.072 -13.024 -7.992 742 HH11 ARG 88 1HH1 ARG 88 1.908 -13.910 -10.625 743 HH12 ARG 88 2HH1 ARG 88 2.852 -15.298 -11.070 744 HH21 ARG 88 1HH2 ARG 88 5.277 -14.816 -8.584 745 HH22 ARG 88 2HH2 ARG 88 4.766 -15.815 -9.919 746 H ALA 89 H ALA 89 3.373 -8.644 -9.154 747 HA ALA 89 HA ALA 89 5.824 -9.669 -8.045 748 HB1 ALA 89 3HB ALA 89 5.169 -8.886 -10.877 749 HB2 ALA 89 1HB ALA 89 4.961 -10.492 -10.179 750 HB3 ALA 89 2HB ALA 89 6.577 -9.805 -10.344 751 HA PRO 90 HA PRO 90 7.758 -5.683 -7.413 752 HB2 PRO 90 2HB PRO 90 10.281 -6.773 -7.149 753 HB3 PRO 90 1HB PRO 90 9.114 -6.610 -5.833 754 HG2 PRO 90 2HG PRO 90 9.779 -8.998 -7.495 755 HG3 PRO 90 1HG PRO 90 9.410 -8.897 -5.764 756 HD2 PRO 90 2HD PRO 90 7.603 -9.759 -7.562 757 HD3 PRO 90 1HD PRO 90 7.132 -8.831 -6.124 758 H TYR 91 H TYR 91 9.973 -4.756 -8.350 759 HA TYR 91 HA TYR 91 9.651 -5.143 -11.242 760 HB2 TYR 91 2HB TYR 91 9.364 -2.852 -10.222 761 HB3 TYR 91 1HB TYR 91 11.088 -2.873 -9.858 762 HD1 TYR 91 HD2 TYR 91 12.741 -2.915 -11.744 763 HD2 TYR 91 HD1 TYR 91 8.575 -2.389 -12.422 764 HE1 TYR 91 HE2 TYR 91 13.219 -2.087 -14.011 765 HE2 TYR 91 HE1 TYR 91 9.042 -1.563 -14.690 766 HH TYR 91 HH TYR 91 11.908 -2.008 -16.255 767 H ASP 92 H ASP 92 12.234 -4.818 -8.801 768 HA ASP 92 HA ASP 92 14.083 -5.922 -10.825 769 HB2 ASP 92 2HB ASP 92 14.589 -3.576 -10.356 770 HB3 ASP 92 1HB ASP 92 14.686 -3.927 -8.633 771 H GLU 93 H GLU 93 15.712 -7.345 -10.115 772 HA GLU 93 HA GLU 93 14.806 -9.170 -8.134 773 HB2 GLU 93 2HB GLU 93 16.063 -9.741 -10.233 774 HB3 GLU 93 1HB GLU 93 17.509 -9.097 -9.472 775 HG2 GLU 93 2HG GLU 93 17.443 -10.782 -7.775 776 HG3 GLU 93 1HG GLU 93 15.880 -11.359 -8.350 777 H SER 94 H SER 94 17.459 -6.801 -8.229 778 HA SER 94 HA SER 94 18.576 -7.534 -5.722 779 HB2 SER 94 2HB SER 94 19.777 -6.172 -7.451 780 HB3 SER 94 1HB SER 94 18.693 -4.828 -7.093 781 HG SER 94 HG SER 94 20.345 -6.106 -5.164 782 H GLU 95 H GLU 95 16.123 -5.268 -6.780 783 HA GLU 95 HA GLU 95 15.432 -4.027 -4.416 784 HB2 GLU 95 2HB GLU 95 14.573 -3.382 -6.581 785 HB3 GLU 95 1HB GLU 95 13.791 -4.942 -6.782 786 HG2 GLU 95 2HG GLU 95 12.867 -3.783 -4.386 787 HG3 GLU 95 1HG GLU 95 12.761 -2.581 -5.670 788 H VAL 96 H VAL 96 14.185 -7.069 -5.809 789 HA VAL 96 HA VAL 96 12.482 -7.874 -3.776 790 HB VAL 96 HB VAL 96 14.304 -9.704 -5.358 791 HG11 VAL 96 1HG1 VAL 96 11.692 -10.249 -3.952 792 HG12 VAL 96 2HG1 VAL 96 13.284 -10.827 -3.462 793 HG13 VAL 96 3HG1 VAL 96 12.567 -11.393 -4.970 794 HG21 VAL 96 3HG2 VAL 96 12.426 -9.939 -6.911 795 HG22 VAL 96 1HG2 VAL 96 13.023 -8.281 -6.851 796 HG23 VAL 96 2HG2 VAL 96 11.534 -8.712 -6.010 797 H ILE 97 H ILE 97 15.952 -8.592 -4.115 798 HA ILE 97 HA ILE 97 16.275 -10.084 -1.779 799 HB ILE 97 HB ILE 97 18.360 -8.234 -2.944 800 HG12 ILE 97 2HG1 ILE 97 17.444 -9.601 -4.742 801 HG13 ILE 97 1HG1 ILE 97 19.067 -10.145 -4.338 802 HG21 ILE 97 1HG2 ILE 97 18.581 -10.786 -1.356 803 HG22 ILE 97 2HG2 ILE 97 18.978 -9.158 -0.804 804 HG23 ILE 97 3HG2 ILE 97 19.935 -9.915 -2.076 805 HD11 ILE 97 3HD1 ILE 97 18.138 -12.018 -3.090 806 HD12 ILE 97 1HD1 ILE 97 17.570 -12.012 -4.760 807 HD13 ILE 97 2HD1 ILE 97 16.506 -11.462 -3.466 808 H PHE 98 H PHE 98 16.396 -6.598 -2.295 809 HA PHE 98 HA PHE 98 17.427 -5.778 0.146 810 HB2 PHE 98 2HB PHE 98 17.131 -4.243 -1.710 811 HB3 PHE 98 1HB PHE 98 15.383 -4.415 -1.616 812 HD1 PHE 98 HD2 PHE 98 18.317 -3.299 0.377 813 HD2 PHE 98 HD1 PHE 98 14.139 -2.937 -0.346 814 HE1 PHE 98 HE2 PHE 98 18.215 -1.403 1.939 815 HE2 PHE 98 HE1 PHE 98 14.029 -1.038 1.216 816 HZ PHE 98 HZ PHE 98 16.070 -0.269 2.361 817 H HIS 99 H HIS 99 13.963 -6.191 -0.731 818 HA HIS 99 HA HIS 99 13.282 -5.743 2.043 819 HB2 HIS 99 2HB HIS 99 10.897 -6.281 1.243 820 HB3 HIS 99 1HB HIS 99 11.646 -4.780 0.733 821 HD1 HIS 99 HD1 HIS 99 10.707 -8.177 -0.594 822 HD2 HIS 99 HD2 HIS 99 11.838 -4.429 -1.962 823 HE1 HIS 99 HE1 HIS 99 10.358 -8.235 -3.085 824 HE2 HIS 99 HE2 HIS 99 10.885 -5.890 -3.869 825 H LEU 100 H LEU 100 14.003 -8.485 0.102 826 HA LEU 100 HA LEU 100 12.751 -10.491 1.609 827 HB2 LEU 100 2HB LEU 100 15.312 -10.361 0.065 828 HB3 LEU 100 1HB LEU 100 14.985 -11.767 1.060 829 HG LEU 100 HG LEU 100 13.188 -10.790 -1.166 830 HD11 LEU 100 1HD1 LEU 100 14.021 -12.745 -2.393 831 HD12 LEU 100 2HD1 LEU 100 15.177 -13.055 -1.098 832 HD13 LEU 100 3HD1 LEU 100 15.302 -11.580 -2.058 833 HD21 LEU 100 3HD2 LEU 100 13.180 -13.362 0.413 834 HD22 LEU 100 1HD2 LEU 100 12.071 -12.926 -0.888 835 HD23 LEU 100 2HD2 LEU 100 12.044 -12.030 0.630 836 H ASP 101 H ASP 101 15.908 -8.931 2.084 837 HA ASP 101 HA ASP 101 16.522 -10.155 4.550 838 HB2 ASP 101 2HB ASP 101 18.199 -8.982 3.196 839 HB3 ASP 101 1HB ASP 101 17.368 -7.454 3.463 840 H LEU 102 H LEU 102 14.987 -7.097 3.732 841 HA LEU 102 HA LEU 102 14.584 -6.021 6.252 842 HB2 LEU 102 2HB LEU 102 14.220 -4.845 4.132 843 HB3 LEU 102 1HB LEU 102 12.820 -5.844 3.810 844 HG LEU 102 HG LEU 102 11.693 -4.851 5.785 845 HD11 LEU 102 1HD1 LEU 102 14.115 -3.059 5.834 846 HD12 LEU 102 2HD1 LEU 102 13.664 -4.234 7.071 847 HD13 LEU 102 3HD1 LEU 102 12.642 -2.826 6.777 848 HD21 LEU 102 3HD2 LEU 102 11.328 -3.968 3.537 849 HD22 LEU 102 1HD2 LEU 102 12.697 -2.877 3.743 850 HD23 LEU 102 2HD2 LEU 102 11.260 -2.687 4.748 851 H TYR 103 H TYR 103 12.453 -8.175 4.402 852 HA TYR 103 HA TYR 103 10.330 -8.274 6.217 853 HB2 TYR 103 2HB TYR 103 9.945 -9.057 4.020 854 HB3 TYR 103 1HB TYR 103 11.294 -10.182 4.095 855 HD1 TYR 103 HD2 TYR 103 8.384 -9.613 6.380 856 HD2 TYR 103 HD1 TYR 103 10.475 -12.329 3.865 857 HE1 TYR 103 HE2 TYR 103 6.855 -11.412 7.062 858 HE2 TYR 103 HE1 TYR 103 8.952 -14.135 4.543 859 HH TYR 103 HH TYR 103 7.460 -14.663 6.497 860 H GLU 104 H GLU 104 13.148 -10.449 5.921 861 HA GLU 104 HA GLU 104 12.170 -12.144 8.008 862 HB2 GLU 104 2HB GLU 104 14.849 -12.030 6.635 863 HB3 GLU 104 1HB GLU 104 14.400 -13.249 7.819 864 HG2 GLU 104 2HG GLU 104 12.480 -13.854 6.323 865 HG3 GLU 104 1HG GLU 104 13.182 -12.782 5.111 866 H ASN 105 H ASN 105 14.543 -9.534 7.840 867 HA ASN 105 HA ASN 105 15.445 -10.063 10.533 868 HB2 ASN 105 2HB ASN 105 16.218 -8.122 8.402 869 HB3 ASN 105 1HB ASN 105 16.666 -7.778 10.070 870 HD21 ASN 105 1HD2 ASN 105 18.306 -8.484 7.699 871 HD22 ASN 105 2HD2 ASN 105 19.239 -9.857 8.200 872 H GLU 106 H GLU 106 13.713 -7.369 8.948 873 HA GLU 106 HA GLU 106 13.287 -6.177 11.572 874 HB2 GLU 106 2HB GLU 106 12.583 -5.157 8.817 875 HB3 GLU 106 1HB GLU 106 12.373 -4.262 10.315 876 HG2 GLU 106 2HG GLU 106 15.000 -5.221 9.204 877 HG3 GLU 106 1HG GLU 106 14.377 -3.575 9.105 878 H GLY 107 H GLY 107 11.392 -7.598 8.934 879 HA2 GLY 107 2HA GLY 107 9.561 -9.008 10.036 880 HA3 GLY 107 1HA GLY 107 9.048 -7.473 10.718 881 H PHE 108 H PHE 108 7.316 -8.982 9.274 882 HA PHE 108 HA PHE 108 7.118 -8.394 6.536 883 HB2 PHE 108 2HB PHE 108 4.550 -8.737 7.126 884 HB3 PHE 108 1HB PHE 108 5.680 -10.086 7.108 885 HD1 PHE 108 HD2 PHE 108 4.281 -7.528 9.443 886 HD2 PHE 108 HD1 PHE 108 5.792 -11.477 8.937 887 HE1 PHE 108 HE2 PHE 108 3.735 -8.035 11.787 888 HE2 PHE 108 HE1 PHE 108 5.249 -11.987 11.284 889 HZ PHE 108 HZ PHE 108 4.218 -10.265 12.709 890 H ASP 109 H ASP 109 6.182 -6.596 9.372 891 HA ASP 109 HA ASP 109 4.504 -4.731 8.069 892 HB2 ASP 109 2HB ASP 109 4.773 -3.380 10.116 893 HB3 ASP 109 1HB ASP 109 4.406 -5.062 10.486 894 H ALA 110 H ALA 110 7.951 -4.872 8.693 895 HA ALA 110 HA ALA 110 8.533 -2.213 7.882 896 HB1 ALA 110 3HB ALA 110 10.052 -3.497 9.299 897 HB2 ALA 110 1HB ALA 110 10.861 -2.947 7.832 898 HB3 ALA 110 2HB ALA 110 10.343 -4.627 7.977 899 H ASP 111 H ASP 111 8.457 -5.328 6.232 900 HA ASP 111 HA ASP 111 9.482 -4.547 3.746 901 HB2 ASP 111 2HB ASP 111 9.157 -6.883 4.207 902 HB3 ASP 111 1HB ASP 111 7.437 -6.650 4.492 903 H ILE 112 H ILE 112 6.222 -4.450 5.046 904 HA ILE 112 HA ILE 112 4.981 -3.420 2.704 905 HB ILE 112 HB ILE 112 4.105 -3.546 5.589 906 HG12 ILE 112 2HG1 ILE 112 3.266 -5.129 3.152 907 HG13 ILE 112 1HG1 ILE 112 4.407 -5.683 4.371 908 HG21 ILE 112 1HG2 ILE 112 2.946 -1.687 4.548 909 HG22 ILE 112 2HG2 ILE 112 1.840 -3.033 4.807 910 HG23 ILE 112 3HG2 ILE 112 2.475 -2.715 3.193 911 HD11 ILE 112 3HD1 ILE 112 1.508 -5.038 4.841 912 HD12 ILE 112 1HD1 ILE 112 2.650 -5.625 6.051 913 HD13 ILE 112 2HD1 ILE 112 2.203 -6.652 4.688 914 H ASP 113 H ASP 113 6.436 -1.954 5.557 915 HA ASP 113 HA ASP 113 5.384 0.650 5.156 916 HB2 ASP 113 2HB ASP 113 7.750 -0.347 6.732 917 HB3 ASP 113 1HB ASP 113 7.315 1.355 6.664 918 H SER 114 H SER 114 8.064 -1.025 3.738 919 HA SER 114 HA SER 114 9.801 1.081 3.208 920 HB2 SER 114 2HB SER 114 10.750 -0.347 1.452 921 HB3 SER 114 1HB SER 114 10.416 -1.277 2.911 922 HG SER 114 HG SER 114 8.812 -2.324 1.910 923 H TYR 115 H TYR 115 7.458 -0.335 0.934 924 HA TYR 115 HA TYR 115 7.756 1.596 -1.074 925 HB2 TYR 115 2HB TYR 115 6.767 -0.364 -1.807 926 HB3 TYR 115 1HB TYR 115 5.699 -0.473 -0.414 927 HD1 TYR 115 HD2 TYR 115 6.285 1.691 -3.415 928 HD2 TYR 115 HD1 TYR 115 3.463 0.013 -0.707 929 HE1 TYR 115 HE2 TYR 115 4.446 2.647 -4.741 930 HE2 TYR 115 HE1 TYR 115 1.621 0.962 -2.027 931 HH TYR 115 HH TYR 115 1.244 2.788 -3.610 932 H ILE 116 H ILE 116 5.672 1.504 1.739 933 HA ILE 116 HA ILE 116 3.916 3.567 0.837 934 HB ILE 116 HB ILE 116 4.326 2.411 3.593 935 HG12 ILE 116 2HG1 ILE 116 3.532 0.796 1.900 936 HG13 ILE 116 1HG1 ILE 116 2.310 1.121 3.126 937 HG21 ILE 116 1HG2 ILE 116 3.349 4.665 3.669 938 HG22 ILE 116 2HG2 ILE 116 2.204 3.427 4.183 939 HG23 ILE 116 3HG2 ILE 116 2.073 4.131 2.573 940 HD11 ILE 116 3HD1 ILE 116 2.389 2.320 0.366 941 HD12 ILE 116 1HD1 ILE 116 1.152 2.610 1.589 942 HD13 ILE 116 2HD1 ILE 116 1.344 1.000 0.893 943 H ASP 117 H ASP 117 6.637 3.473 3.145 944 HA ASP 117 HA ASP 117 6.186 6.188 3.962 945 HB2 ASP 117 2HB ASP 117 7.186 4.408 5.427 946 HB3 ASP 117 1HB ASP 117 8.649 4.511 4.450 947 H SER 118 H SER 118 8.042 4.642 1.496 948 HA SER 118 HA SER 118 9.801 6.875 1.043 949 HB2 SER 118 2HB SER 118 9.226 4.487 -0.725 950 HB3 SER 118 1HB SER 118 10.582 5.605 -0.887 951 HG SER 118 HG SER 118 10.107 3.629 1.063 952 HA PRO 119 HA PRO 119 6.585 9.290 -0.802 953 HB2 PRO 119 2HB PRO 119 8.284 11.139 -1.987 954 HB3 PRO 119 1HB PRO 119 7.695 11.209 -0.325 955 HG2 PRO 119 2HG PRO 119 10.300 10.194 -1.373 956 HG3 PRO 119 1HG PRO 119 9.967 11.131 0.098 957 HD2 PRO 119 2HD PRO 119 10.436 8.500 0.212 958 HD3 PRO 119 1HD PRO 119 9.229 9.265 1.267 959 H GLU 120 H GLU 120 9.471 8.902 -2.904 960 HA GLU 120 HA GLU 120 8.005 9.380 -5.261 961 HB2 GLU 120 2HB GLU 120 9.988 8.603 -6.473 962 HB3 GLU 120 1HB GLU 120 10.400 9.743 -5.199 963 HG2 GLU 120 2HG GLU 120 11.228 7.996 -3.807 964 HG3 GLU 120 1HG GLU 120 10.615 6.759 -4.905 965 H TYR 121 H TYR 121 8.702 6.423 -3.514 966 HA TYR 121 HA TYR 121 8.019 4.607 -5.571 967 HB2 TYR 121 2HB TYR 121 7.987 4.331 -2.565 968 HB3 TYR 121 1HB TYR 121 7.611 3.001 -3.653 969 HD1 TYR 121 HD2 TYR 121 10.299 5.498 -2.959 970 HD2 TYR 121 HD1 TYR 121 9.323 1.601 -4.358 971 HE1 TYR 121 HE2 TYR 121 12.690 4.959 -3.102 972 HE2 TYR 121 HE1 TYR 121 11.717 1.050 -4.503 973 HH TYR 121 HH TYR 121 13.894 2.295 -4.746 974 H THR 122 H THR 122 6.134 6.042 -2.927 975 HA THR 122 HA THR 122 3.668 4.869 -3.720 976 HB THR 122 HB THR 122 4.142 7.376 -2.087 977 HG1 THR 122 HG1 THR 122 4.839 4.976 -1.474 978 HG21 THR 122 3HG2 THR 122 1.895 6.985 -1.209 979 HG22 THR 122 1HG2 THR 122 1.712 5.594 -2.277 980 HG23 THR 122 2HG2 THR 122 1.851 7.213 -2.959 981 H ASN 123 H ASN 123 5.359 7.834 -4.515 982 HA ASN 123 HA ASN 123 3.254 9.246 -5.705 983 HB2 ASN 123 2HB ASN 123 5.264 10.402 -5.104 984 HB3 ASN 123 1HB ASN 123 6.239 9.376 -6.149 985 HD21 ASN 123 1HD2 ASN 123 6.394 9.838 -8.291 986 HD22 ASN 123 2HD2 ASN 123 5.702 11.245 -9.019 987 H SER 124 H SER 124 5.400 6.780 -7.034 988 HA SER 124 HA SER 124 4.692 7.253 -9.748 989 HB2 SER 124 2HB SER 124 5.633 4.807 -9.950 990 HB3 SER 124 1HB SER 124 6.710 6.152 -9.583 991 HG SER 124 HG SER 124 5.512 4.481 -7.618 992 H PHE 125 H PHE 125 2.955 5.871 -7.218 993 HA PHE 125 HA PHE 125 1.181 4.496 -9.127 994 HB2 PHE 125 2HB PHE 125 1.622 4.041 -6.175 995 HB3 PHE 125 1HB PHE 125 0.266 3.347 -7.058 996 HD1 PHE 125 HD2 PHE 125 3.974 3.455 -6.940 997 HD2 PHE 125 HD1 PHE 125 0.509 1.371 -8.264 998 HE1 PHE 125 HE2 PHE 125 5.381 1.555 -7.622 999 HE2 PHE 125 HE1 PHE 125 1.908 -0.533 -8.944 1000 HZ PHE 125 HZ PHE 125 4.346 -0.442 -8.624 1001 H GLY 126 H GLY 126 1.320 6.711 -6.391 1002 HA2 GLY 126 2HA GLY 126 -0.203 8.707 -6.830 1003 HA3 GLY 126 1HA GLY 126 -1.470 7.491 -6.936 1004 H ASP 127 H ASP 127 -0.435 9.781 -4.981 1005 HA ASP 127 HA ASP 127 -0.157 8.466 -2.467 1006 HB2 ASP 127 2HB ASP 127 -0.895 11.315 -3.162 1007 HB3 ASP 127 1HB ASP 127 -0.624 10.753 -1.517 1008 H TRP 128 H TRP 128 -2.840 9.392 -4.397 1009 HA TRP 128 HA TRP 128 -4.692 8.635 -2.233 1010 HB2 TRP 128 2HB TRP 128 -5.130 10.644 -4.458 1011 HB3 TRP 128 1HB TRP 128 -6.349 10.148 -3.291 1012 HD1 TRP 128 HD1 TRP 128 -3.109 12.192 -3.544 1013 HE1 TRP 128 HE1 TRP 128 -2.981 13.781 -1.523 1014 HE3 TRP 128 HE3 TRP 128 -7.144 10.474 -0.921 1015 HZ2 TRP 128 HZ2 TRP 128 -4.418 14.245 0.867 1016 HZ3 TRP 128 HZ3 TRP 128 -7.700 11.542 1.223 1017 HH2 TRP 128 HH2 TRP 128 -6.365 13.389 2.100 1018 H VAL 129 H VAL 129 -3.332 7.123 -4.470 1019 HA VAL 129 HA VAL 129 -5.713 6.319 -6.001 1020 HB VAL 129 HB VAL 129 -2.809 6.096 -6.820 1021 HG11 VAL 129 1HG1 VAL 129 -4.201 4.282 -7.713 1022 HG12 VAL 129 2HG1 VAL 129 -3.656 5.376 -8.983 1023 HG13 VAL 129 3HG1 VAL 129 -5.312 5.477 -8.385 1024 HG21 VAL 129 3HG2 VAL 129 -3.356 7.807 -8.485 1025 HG22 VAL 129 1HG2 VAL 129 -3.605 8.405 -6.845 1026 HG23 VAL 129 2HG2 VAL 129 -4.989 7.924 -7.828 1027 H VAL 130 H VAL 130 -6.389 4.286 -5.872 1028 HA VAL 130 HA VAL 130 -5.179 2.462 -4.027 1029 HB VAL 130 HB VAL 130 -7.429 2.016 -6.005 1030 HG11 VAL 130 1HG1 VAL 130 -8.020 0.081 -4.649 1031 HG12 VAL 130 2HG1 VAL 130 -6.615 0.356 -3.621 1032 HG13 VAL 130 3HG1 VAL 130 -6.396 -0.093 -5.313 1033 HG21 VAL 130 3HG2 VAL 130 -8.898 2.308 -4.064 1034 HG22 VAL 130 1HG2 VAL 130 -7.946 3.757 -4.388 1035 HG23 VAL 130 2HG2 VAL 130 -7.494 2.682 -3.064 1036 HA PRO 131 HA PRO 131 -2.040 0.694 -6.603 1037 HB2 PRO 131 2HB PRO 131 -2.822 -1.702 -4.987 1038 HB3 PRO 131 1HB PRO 131 -1.212 -1.070 -5.354 1039 HG2 PRO 131 2HG PRO 131 -2.285 -0.624 -2.984 1040 HG3 PRO 131 1HG PRO 131 -1.404 0.670 -3.822 1041 HD2 PRO 131 2HD PRO 131 -4.344 0.303 -3.460 1042 HD3 PRO 131 1HD PRO 131 -3.387 1.799 -3.506 1043 H TYR 132 H TYR 132 -1.948 -0.376 -8.468 1044 HA TYR 132 HA TYR 132 -4.280 -1.961 -9.289 1045 HB2 TYR 132 2HB TYR 132 -3.588 -1.428 -11.623 1046 HB3 TYR 132 1HB TYR 132 -4.006 0.002 -10.687 1047 HD1 TYR 132 HD2 TYR 132 -1.137 -1.986 -11.942 1048 HD2 TYR 132 HD1 TYR 132 -2.450 1.769 -10.439 1049 HE1 TYR 132 HE2 TYR 132 1.038 -1.015 -12.514 1050 HE2 TYR 132 HE1 TYR 132 -0.272 2.761 -11.007 1051 HH TYR 132 HH TYR 132 2.017 2.081 -11.410 1052 H TYR 133 H TYR 133 -3.573 -3.574 -11.131 1053 HA TYR 133 HA TYR 133 -1.580 -5.288 -9.907 1054 HB2 TYR 133 2HB TYR 133 -3.872 -5.956 -10.989 1055 HB3 TYR 133 1HB TYR 133 -2.969 -5.900 -12.497 1056 HD1 TYR 133 HD2 TYR 133 -0.834 -7.357 -12.643 1057 HD2 TYR 133 HD1 TYR 133 -3.823 -7.857 -9.657 1058 HE1 TYR 133 HE2 TYR 133 -0.034 -9.648 -12.231 1059 HE2 TYR 133 HE1 TYR 133 -3.029 -10.142 -9.232 1060 HH TYR 133 HH TYR 133 -0.085 -11.350 -10.574 1061 H ARG 134 H ARG 134 0.376 -5.895 -10.800 1062 HA ARG 134 HA ARG 134 2.321 -5.611 -11.902 1063 HB2 ARG 134 2HB ARG 134 1.107 -6.563 -13.790 1064 HB3 ARG 134 1HB ARG 134 0.505 -4.975 -14.231 1065 HG2 ARG 134 2HG ARG 134 2.311 -5.687 -15.701 1066 HG3 ARG 134 1HG ARG 134 2.759 -4.249 -14.786 1067 HD2 ARG 134 2HD ARG 134 3.508 -6.975 -13.796 1068 HD3 ARG 134 1HD ARG 134 4.466 -6.184 -15.047 1069 HE ARG 134 HE ARG 134 4.305 -4.291 -13.132 1070 HH11 ARG 134 1HH1 ARG 134 5.260 -7.663 -13.065 1071 HH12 ARG 134 2HH1 ARG 134 6.368 -7.445 -11.743 1072 HH21 ARG 134 1HH2 ARG 134 5.776 -4.002 -11.408 1073 HH22 ARG 134 2HH2 ARG 134 6.632 -5.378 -10.779 1074 H GLY 135 H GLY 135 2.537 -3.808 -10.401 1075 HA2 GLY 135 2HA GLY 135 2.309 -1.130 -11.329 1076 HA3 GLY 135 1HA GLY 135 3.282 -1.679 -9.970 1077 H LEU 136 H LEU 136 3.462 -0.174 -12.856 1078 HA LEU 136 HA LEU 136 6.100 -1.304 -13.501 1079 HB2 LEU 136 2HB LEU 136 4.443 -1.501 -15.289 1080 HB3 LEU 136 1HB LEU 136 4.167 0.229 -15.241 1081 HG LEU 136 HG LEU 136 6.546 0.565 -15.928 1082 HD11 LEU 136 1HD1 LEU 136 7.767 -1.309 -16.876 1083 HD12 LEU 136 2HD1 LEU 136 6.469 -2.408 -16.418 1084 HD13 LEU 136 3HD1 LEU 136 7.417 -1.599 -15.171 1085 HD21 LEU 136 3HD2 LEU 136 4.748 0.698 -17.548 1086 HD22 LEU 136 1HD2 LEU 136 4.803 -1.049 -17.779 1087 HD23 LEU 136 2HD2 LEU 136 6.172 -0.051 -18.272 1088 H GLU 137 H GLU 137 7.574 -0.096 -12.445 1089 HA GLU 137 HA GLU 137 7.346 2.754 -12.170 1090 HB2 GLU 137 2HB GLU 137 8.766 0.891 -10.813 1091 HB3 GLU 137 1HB GLU 137 10.007 1.462 -11.919 1092 HG2 GLU 137 2HG GLU 137 8.413 3.204 -10.050 1093 HG3 GLU 137 1HG GLU 137 10.048 2.620 -9.757 1094 H HIS 138 H HIS 138 8.193 4.303 -13.486 1095 HA HIS 138 HA HIS 138 8.840 3.332 -16.151 1096 HB2 HIS 138 2HB HIS 138 8.399 5.631 -16.896 1097 HB3 HIS 138 1HB HIS 138 7.059 4.981 -15.965 1098 HD1 HIS 138 HD1 HIS 138 6.725 5.966 -13.532 1099 HD2 HIS 138 HD2 HIS 138 9.546 7.929 -15.884 1100 HE1 HIS 138 HE1 HIS 138 7.153 8.170 -12.394 1101 HE2 HIS 138 HE2 HIS 138 8.930 9.301 -13.782 1102 H HIS 139 H HIS 139 10.848 3.067 -16.737 1103 HA HIS 139 HA HIS 139 12.840 5.050 -15.847 1104 HB2 HIS 139 2HB HIS 139 13.292 2.190 -16.735 1105 HB3 HIS 139 1HB HIS 139 14.564 3.336 -16.333 1106 HD1 HIS 139 HD1 HIS 139 13.885 4.425 -13.682 1107 HD2 HIS 139 HD2 HIS 139 13.001 0.488 -14.686 1108 HE1 HIS 139 HE1 HIS 139 13.721 3.192 -11.501 1109 HE2 HIS 139 HE2 HIS 139 13.468 0.776 -12.159 1110 H HIS 140 H HIS 140 14.566 5.458 -17.513 1111 HA HIS 140 HA HIS 140 13.260 5.658 -20.133 1112 HB2 HIS 140 2HB HIS 140 14.177 7.718 -18.949 1113 HB3 HIS 140 1HB HIS 140 15.783 7.069 -19.250 1114 HD1 HIS 140 HD1 HIS 140 16.843 7.850 -21.347 1115 HD2 HIS 140 HD2 HIS 140 12.689 8.086 -21.517 1116 HE1 HIS 140 HE1 HIS 140 16.309 8.950 -23.547 1117 HE2 HIS 140 HE2 HIS 140 13.794 9.109 -23.625 1118 H HIS 141 H HIS 141 16.600 5.240 -18.969 1119 HA HIS 141 HA HIS 141 17.064 2.801 -20.335 1120 HB2 HIS 141 2HB HIS 141 16.910 4.463 -22.257 1121 HB3 HIS 141 1HB HIS 141 18.356 5.223 -21.609 1122 HD1 HIS 141 HD1 HIS 141 17.176 2.146 -23.404 1123 HD2 HIS 141 HD2 HIS 141 20.744 3.863 -22.115 1124 HE1 HIS 141 HE1 HIS 141 19.006 0.884 -24.579 1125 HE2 HIS 141 HE2 HIS 141 21.131 2.067 -23.939 1126 H HIS 142 H HIS 142 18.627 1.866 -19.135 1127 HA HIS 142 HA HIS 142 19.824 3.365 -17.062 1128 HB2 HIS 142 2HB HIS 142 20.914 1.359 -16.341 1129 HB3 HIS 142 1HB HIS 142 19.288 0.949 -16.849 1130 HD1 HIS 142 HD1 HIS 142 19.109 -1.026 -18.340 1131 HD2 HIS 142 HD2 HIS 142 22.929 0.610 -18.410 1132 HE1 HIS 142 HE1 HIS 142 20.517 -2.649 -19.646 1133 HE2 HIS 142 HE2 HIS 142 22.816 -1.616 -19.725 1134 H HIS 143 H HIS 143 21.736 4.235 -16.783 1135 HA HIS 143 HA HIS 143 23.769 3.968 -18.875 1136 HB2 HIS 143 2HB HIS 143 22.615 6.037 -19.400 1137 HB3 HIS 143 1HB HIS 143 22.700 6.561 -17.723 1138 HD1 HIS 143 HD1 HIS 143 24.740 7.848 -17.022 1139 HD2 HIS 143 HD2 HIS 143 25.163 6.079 -20.767 1140 HE1 HIS 143 HE1 HIS 143 26.882 8.763 -17.974 1141 HE2 HIS 143 HE2 HIS 143 27.197 7.564 -20.159 Start of MODEL 13 1 H1 MET 1 1H MET 1 -7.551 4.435 -16.805 2 H2 MET 1 2H MET 1 -8.485 5.712 -17.404 3 H3 MET 1 3H MET 1 -9.235 4.275 -16.916 4 HA MET 1 HA MET 1 -7.765 6.139 -15.149 5 HB2 MET 1 2HB MET 1 -10.730 5.643 -15.482 6 HB3 MET 1 1HB MET 1 -10.024 6.580 -14.175 7 HG2 MET 1 2HG MET 1 -10.853 8.090 -15.805 8 HG3 MET 1 1HG MET 1 -9.094 8.134 -15.870 9 HE1 MET 1 3HE MET 1 -10.155 8.776 -19.590 10 HE2 MET 1 1HE MET 1 -9.255 9.392 -18.203 11 HE3 MET 1 2HE MET 1 -11.017 9.311 -18.146 12 HA PRO 2 HA PRO 2 -7.898 2.532 -12.495 13 HB2 PRO 2 2HB PRO 2 -6.143 3.413 -10.684 14 HB3 PRO 2 1HB PRO 2 -5.616 2.927 -12.300 15 HG2 PRO 2 2HG PRO 2 -5.980 5.655 -11.164 16 HG3 PRO 2 1HG PRO 2 -4.767 5.070 -12.314 17 HD2 PRO 2 2HD PRO 2 -7.114 6.472 -12.949 18 HD3 PRO 2 1HD PRO 2 -6.086 5.580 -14.088 19 H VAL 3 H VAL 3 -8.207 2.300 -10.029 20 HA VAL 3 HA VAL 3 -10.375 4.028 -9.212 21 HB VAL 3 HB VAL 3 -9.092 1.730 -7.714 22 HG11 VAL 3 1HG1 VAL 3 -10.234 3.278 -6.225 23 HG12 VAL 3 2HG1 VAL 3 -11.137 1.766 -6.358 24 HG13 VAL 3 3HG1 VAL 3 -11.681 3.201 -7.229 25 HG21 VAL 3 3HG2 VAL 3 -11.623 1.800 -9.357 26 HG22 VAL 3 1HG2 VAL 3 -11.028 0.424 -8.427 27 HG23 VAL 3 2HG2 VAL 3 -10.116 1.008 -9.819 28 H GLU 4 H GLU 4 -9.937 5.918 -8.324 29 HA GLU 4 HA GLU 4 -7.851 6.083 -6.285 30 HB2 GLU 4 2HB GLU 4 -7.104 8.263 -7.254 31 HB3 GLU 4 1HB GLU 4 -6.738 6.869 -8.261 32 HG2 GLU 4 2HG GLU 4 -8.706 7.386 -9.647 33 HG3 GLU 4 1HG GLU 4 -8.994 8.817 -8.656 34 H LEU 5 H LEU 5 -8.117 7.819 -4.808 35 HA LEU 5 HA LEU 5 -10.899 8.577 -4.457 36 HB2 LEU 5 2HB LEU 5 -9.624 7.748 -2.532 37 HB3 LEU 5 1HB LEU 5 -8.475 9.056 -2.719 38 HG LEU 5 HG LEU 5 -10.267 10.680 -2.205 39 HD11 LEU 5 1HD1 LEU 5 -11.921 8.220 -1.660 40 HD12 LEU 5 2HD1 LEU 5 -12.175 9.381 -2.963 41 HD13 LEU 5 3HD1 LEU 5 -12.383 9.883 -1.285 42 HD21 LEU 5 3HD2 LEU 5 -10.436 10.152 0.187 43 HD22 LEU 5 1HD2 LEU 5 -8.803 9.905 -0.433 44 HD23 LEU 5 2HD2 LEU 5 -9.855 8.519 -0.141 45 H ARG 6 H ARG 6 -11.669 10.663 -4.463 46 HA ARG 6 HA ARG 6 -9.917 12.658 -5.713 47 HB2 ARG 6 2HB ARG 6 -12.893 12.890 -5.271 48 HB3 ARG 6 1HB ARG 6 -11.895 13.806 -6.392 49 HG2 ARG 6 2HG ARG 6 -11.495 11.704 -7.651 50 HG3 ARG 6 1HG ARG 6 -12.648 10.900 -6.584 51 HD2 ARG 6 2HD ARG 6 -13.183 13.189 -8.469 52 HD3 ARG 6 1HD ARG 6 -13.773 11.536 -8.606 53 HE ARG 6 HE ARG 6 -14.577 13.235 -6.337 54 HH11 ARG 6 1HH1 ARG 6 -15.374 11.207 -9.057 55 HH12 ARG 6 2HH1 ARG 6 -17.090 11.315 -8.819 56 HH21 ARG 6 1HH2 ARG 6 -16.836 13.416 -6.009 57 HH22 ARG 6 2HH2 ARG 6 -17.924 12.564 -7.067 58 H ALA 7 H ALA 7 -9.715 14.753 -4.794 59 HA ALA 7 HA ALA 7 -9.872 14.946 -1.969 60 HB1 ALA 7 3HB ALA 7 -8.282 16.281 -3.250 61 HB2 ALA 7 1HB ALA 7 -9.338 17.321 -2.296 62 HB3 ALA 7 2HB ALA 7 -9.609 17.140 -4.028 63 H ASN 8 H ASN 8 -11.884 16.111 -4.622 64 HA ASN 8 HA ASN 8 -14.010 16.757 -2.741 65 HB2 ASN 8 2HB ASN 8 -15.282 17.348 -4.902 66 HB3 ASN 8 1HB ASN 8 -13.950 18.388 -4.424 67 HD21 ASN 8 1HD2 ASN 8 -13.668 15.240 -6.003 68 HD22 ASN 8 2HD2 ASN 8 -12.977 15.844 -7.478 69 H TRP 9 H TRP 9 -14.322 14.654 -1.944 70 HA TRP 9 HA TRP 9 -15.256 12.672 -3.876 71 HB2 TRP 9 2HB TRP 9 -15.042 11.065 -1.947 72 HB3 TRP 9 1HB TRP 9 -13.536 11.787 -2.493 73 HD1 TRP 9 HD1 TRP 9 -12.180 13.221 -0.781 74 HE1 TRP 9 HE1 TRP 9 -12.422 13.691 1.736 75 HE3 TRP 9 HE3 TRP 9 -16.904 11.413 -0.068 76 HZ2 TRP 9 HZ2 TRP 9 -14.363 13.340 3.762 77 HZ3 TRP 9 HZ3 TRP 9 -17.881 11.510 2.182 78 HH2 TRP 9 HH2 TRP 9 -16.637 12.453 4.062 79 H SER 10 H SER 10 -17.110 11.450 -3.483 80 HA SER 10 HA SER 10 -19.153 12.804 -1.866 81 HB2 SER 10 2HB SER 10 -19.526 10.838 -4.146 82 HB3 SER 10 1HB SER 10 -20.796 11.748 -3.325 83 HG SER 10 HG SER 10 -19.787 12.537 -5.442 84 H GLU 11 H GLU 11 -20.828 11.192 -0.976 85 HA GLU 11 HA GLU 11 -19.574 9.482 0.841 86 HB2 GLU 11 2HB GLU 11 -21.823 10.378 1.199 87 HB3 GLU 11 1HB GLU 11 -22.435 9.411 -0.138 88 HG2 GLU 11 2HG GLU 11 -21.808 7.370 1.102 89 HG3 GLU 11 1HG GLU 11 -21.309 8.385 2.456 90 H GLU 12 H GLU 12 -21.461 8.603 -2.049 91 HA GLU 12 HA GLU 12 -20.932 5.830 -1.881 92 HB2 GLU 12 2HB GLU 12 -21.625 7.483 -4.314 93 HB3 GLU 12 1HB GLU 12 -21.784 5.738 -4.170 94 HG2 GLU 12 2HG GLU 12 -23.563 5.910 -2.660 95 HG3 GLU 12 1HG GLU 12 -23.232 7.611 -2.334 96 H ASP 13 H ASP 13 -19.325 8.491 -3.503 97 HA ASP 13 HA ASP 13 -17.540 7.035 -5.106 98 HB2 ASP 13 2HB ASP 13 -17.965 9.416 -5.442 99 HB3 ASP 13 1HB ASP 13 -17.256 9.777 -3.875 100 H LEU 14 H LEU 14 -17.108 8.465 -1.877 101 HA LEU 14 HA LEU 14 -14.515 7.547 -1.397 102 HB2 LEU 14 2HB LEU 14 -15.609 9.214 -0.000 103 HB3 LEU 14 1HB LEU 14 -16.779 8.028 0.542 104 HG LEU 14 HG LEU 14 -14.931 6.765 1.632 105 HD11 LEU 14 1HD1 LEU 14 -13.293 9.180 0.864 106 HD12 LEU 14 2HD1 LEU 14 -13.077 7.536 0.265 107 HD13 LEU 14 3HD1 LEU 14 -12.781 7.901 1.963 108 HD21 LEU 14 3HD2 LEU 14 -14.633 8.349 3.486 109 HD22 LEU 14 1HD2 LEU 14 -16.304 8.284 2.923 110 HD23 LEU 14 2HD2 LEU 14 -15.273 9.640 2.468 111 H GLU 15 H GLU 15 -17.653 6.027 -0.780 112 HA GLU 15 HA GLU 15 -16.696 3.723 0.505 113 HB2 GLU 15 2HB GLU 15 -19.192 4.235 -1.100 114 HB3 GLU 15 1HB GLU 15 -18.871 2.689 -0.323 115 HG2 GLU 15 2HG GLU 15 -18.752 3.803 1.845 116 HG3 GLU 15 1HG GLU 15 -19.080 5.350 1.065 117 H THR 16 H THR 16 -17.099 4.477 -2.919 118 HA THR 16 HA THR 16 -16.609 1.895 -3.929 119 HB THR 16 HB THR 16 -16.003 4.568 -5.211 120 HG1 THR 16 HG1 THR 16 -18.323 3.243 -4.661 121 HG21 THR 16 3HG2 THR 16 -16.349 1.830 -6.445 122 HG22 THR 16 1HG2 THR 16 -14.845 2.752 -6.360 123 HG23 THR 16 2HG2 THR 16 -16.187 3.341 -7.339 124 H VAL 17 H VAL 17 -14.436 4.566 -3.108 125 HA VAL 17 HA VAL 17 -12.051 3.312 -3.992 126 HB VAL 17 HB VAL 17 -12.384 5.437 -1.862 127 HG11 VAL 17 1HG1 VAL 17 -10.207 4.380 -1.722 128 HG12 VAL 17 2HG1 VAL 17 -10.044 6.005 -2.387 129 HG13 VAL 17 3HG1 VAL 17 -9.960 4.603 -3.453 130 HG21 VAL 17 3HG2 VAL 17 -11.845 5.713 -4.818 131 HG22 VAL 17 1HG2 VAL 17 -11.892 7.031 -3.648 132 HG23 VAL 17 2HG2 VAL 17 -13.356 6.110 -4.000 133 H ILE 18 H ILE 18 -13.577 3.580 -0.783 134 HA ILE 18 HA ILE 18 -11.683 2.105 0.659 135 HB ILE 18 HB ILE 18 -14.658 2.334 1.150 136 HG12 ILE 18 2HG1 ILE 18 -12.331 3.877 2.326 137 HG13 ILE 18 1HG1 ILE 18 -13.453 4.488 1.114 138 HG21 ILE 18 1HG2 ILE 18 -12.460 1.417 3.002 139 HG22 ILE 18 2HG2 ILE 18 -13.754 0.419 2.338 140 HG23 ILE 18 3HG2 ILE 18 -14.132 1.714 3.473 141 HD11 ILE 18 3HD1 ILE 18 -15.289 4.275 2.709 142 HD12 ILE 18 1HD1 ILE 18 -14.007 5.323 3.319 143 HD13 ILE 18 2HD1 ILE 18 -14.160 3.673 3.922 144 H ARG 19 H ARG 19 -14.606 1.059 -1.037 145 HA ARG 19 HA ARG 19 -14.519 -1.656 -0.339 146 HB2 ARG 19 2HB ARG 19 -16.496 -0.605 -1.312 147 HB3 ARG 19 1HB ARG 19 -15.631 -0.315 -2.814 148 HG2 ARG 19 2HG ARG 19 -15.408 -2.774 -3.090 149 HG3 ARG 19 1HG ARG 19 -16.426 -2.979 -1.663 150 HD2 ARG 19 2HD ARG 19 -17.778 -3.187 -3.645 151 HD3 ARG 19 1HD ARG 19 -18.210 -1.702 -2.801 152 HE ARG 19 HE ARG 19 -16.255 -1.462 -4.949 153 HH11 ARG 19 1HH1 ARG 19 -19.586 -1.156 -3.925 154 HH12 ARG 19 2HH1 ARG 19 -20.048 -0.134 -5.248 155 HH21 ARG 19 1HH2 ARG 19 -16.843 -0.143 -6.712 156 HH22 ARG 19 2HH2 ARG 19 -18.475 0.442 -6.854 157 H ALA 20 H ALA 20 -12.911 0.151 -2.878 158 HA ALA 20 HA ALA 20 -11.960 -2.043 -4.373 159 HB1 ALA 20 3HB ALA 20 -10.708 0.680 -4.038 160 HB2 ALA 20 1HB ALA 20 -11.942 0.255 -5.224 161 HB3 ALA 20 2HB ALA 20 -10.343 -0.486 -5.312 162 H VAL 21 H VAL 21 -10.710 -0.329 -1.570 163 HA VAL 21 HA VAL 21 -8.270 -1.797 -1.415 164 HB VAL 21 HB VAL 21 -9.711 -0.338 0.810 165 HG11 VAL 21 1HG1 VAL 21 -8.004 -1.857 1.631 166 HG12 VAL 21 2HG1 VAL 21 -7.474 -0.186 1.823 167 HG13 VAL 21 3HG1 VAL 21 -6.827 -1.172 0.511 168 HG21 VAL 21 3HG2 VAL 21 -8.252 1.560 0.268 169 HG22 VAL 21 1HG2 VAL 21 -9.309 1.144 -1.083 170 HG23 VAL 21 2HG2 VAL 21 -7.611 0.668 -1.111 171 H TYR 22 H TYR 22 -11.292 -1.950 0.498 172 HA TYR 22 HA TYR 22 -11.179 -4.814 0.565 173 HB2 TYR 22 2HB TYR 22 -10.915 -5.134 2.932 174 HB3 TYR 22 1HB TYR 22 -9.544 -4.207 2.346 175 HD1 TYR 22 HD1 TYR 22 -10.611 -1.457 2.310 176 HD2 TYR 22 HD2 TYR 22 -11.175 -4.572 5.151 177 HE1 TYR 22 HE1 TYR 22 -10.994 0.219 4.066 178 HE2 TYR 22 HE2 TYR 22 -11.572 -2.902 6.913 179 HH TYR 22 HH TYR 22 -12.182 0.331 6.279 180 H ARG 23 H ARG 23 -13.112 -5.742 1.098 181 HA ARG 23 HA ARG 23 -15.194 -4.150 2.338 182 HB2 ARG 23 2HB ARG 23 -15.438 -3.574 -0.040 183 HB3 ARG 23 1HB ARG 23 -15.549 -5.283 -0.447 184 HG2 ARG 23 2HG ARG 23 -17.741 -4.201 -0.417 185 HG3 ARG 23 1HG ARG 23 -17.621 -5.476 0.797 186 HD2 ARG 23 2HD ARG 23 -17.097 -3.726 2.486 187 HD3 ARG 23 1HD ARG 23 -17.400 -2.504 1.252 188 HE ARG 23 HE ARG 23 -19.713 -3.211 1.214 189 HH11 ARG 23 1HH1 ARG 23 -17.776 -4.512 3.821 190 HH12 ARG 23 2HH1 ARG 23 -19.130 -4.786 4.875 191 HH21 ARG 23 1HH2 ARG 23 -21.500 -3.558 2.581 192 HH22 ARG 23 2HH2 ARG 23 -21.259 -4.237 4.164 193 H GLN 24 H GLN 24 -14.140 -7.178 0.913 194 HA GLN 24 HA GLN 24 -15.327 -8.691 3.043 195 HB2 GLN 24 2HB GLN 24 -17.182 -8.225 1.290 196 HB3 GLN 24 1HB GLN 24 -16.306 -9.355 0.268 197 HG2 GLN 24 2HG GLN 24 -18.127 -10.471 1.403 198 HG3 GLN 24 1HG GLN 24 -16.578 -11.099 1.960 199 HE21 GLN 24 1HE2 GLN 24 -17.865 -8.014 2.987 200 HE22 GLN 24 2HE2 GLN 24 -18.184 -8.480 4.625 201 H VAL 25 H VAL 25 -15.335 -10.962 0.833 202 HA VAL 25 HA VAL 25 -13.910 -12.522 0.005 203 HB VAL 25 HB VAL 25 -11.710 -10.446 0.147 204 HG11 VAL 25 1HG1 VAL 25 -10.757 -11.700 -1.731 205 HG12 VAL 25 2HG1 VAL 25 -12.086 -12.855 -1.631 206 HG13 VAL 25 3HG1 VAL 25 -10.939 -12.715 -0.301 207 HG21 VAL 25 3HG2 VAL 25 -13.673 -10.931 -2.092 208 HG22 VAL 25 1HG2 VAL 25 -12.298 -9.829 -2.142 209 HG23 VAL 25 2HG2 VAL 25 -13.639 -9.516 -1.040 210 H LEU 26 H LEU 26 -14.481 -12.706 2.583 211 HA LEU 26 HA LEU 26 -11.938 -13.226 3.983 212 HB2 LEU 26 2HB LEU 26 -14.714 -12.887 5.131 213 HB3 LEU 26 1HB LEU 26 -13.247 -13.149 6.054 214 HG LEU 26 HG LEU 26 -13.789 -10.721 4.342 215 HD11 LEU 26 1HD1 LEU 26 -13.927 -11.077 7.332 216 HD12 LEU 26 2HD1 LEU 26 -15.287 -10.781 6.248 217 HD13 LEU 26 3HD1 LEU 26 -14.054 -9.540 6.475 218 HD21 LEU 26 3HD2 LEU 26 -11.413 -11.246 4.563 219 HD22 LEU 26 1HD2 LEU 26 -11.583 -11.311 6.316 220 HD23 LEU 26 2HD2 LEU 26 -11.829 -9.788 5.461 221 H GLY 27 H GLY 27 -15.180 -14.532 3.403 222 HA2 GLY 27 2HA GLY 27 -14.559 -17.131 2.868 223 HA3 GLY 27 1HA GLY 27 -14.584 -17.062 4.626 224 H ASN 28 H ASN 28 -16.391 -18.621 4.334 225 HA ASN 28 HA ASN 28 -18.892 -17.239 3.615 226 HB2 ASN 28 2HB ASN 28 -18.140 -20.150 3.452 227 HB3 ASN 28 1HB ASN 28 -19.822 -19.628 3.444 228 HD21 ASN 28 1HD2 ASN 28 -16.853 -19.759 1.676 229 HD22 ASN 28 2HD2 ASN 28 -17.494 -19.205 0.162 230 H ASP 29 H ASP 29 -17.254 -19.123 6.072 231 HA ASP 29 HA ASP 29 -18.992 -18.129 8.098 232 HB2 ASP 29 2HB ASP 29 -20.554 -19.789 7.399 233 HB3 ASP 29 1HB ASP 29 -19.297 -21.014 7.266 234 H TYR 30 H TYR 30 -17.297 -17.537 9.289 235 HA TYR 30 HA TYR 30 -16.142 -19.444 10.998 236 HB2 TYR 30 2HB TYR 30 -14.634 -19.951 9.152 237 HB3 TYR 30 1HB TYR 30 -14.236 -18.245 8.967 238 HD1 TYR 30 HD1 TYR 30 -14.323 -20.703 11.796 239 HD2 TYR 30 HD2 TYR 30 -12.134 -17.690 9.735 240 HE1 TYR 30 HE1 TYR 30 -12.475 -20.959 13.398 241 HE2 TYR 30 HE2 TYR 30 -10.280 -17.938 11.332 242 HH TYR 30 HH TYR 30 -10.160 -20.528 13.635 243 H VAL 31 H VAL 31 -17.253 -17.909 12.285 244 HA VAL 31 HA VAL 31 -17.392 -16.166 13.734 245 HB VAL 31 HB VAL 31 -14.373 -16.245 13.687 246 HG11 VAL 31 1HG1 VAL 31 -14.558 -15.512 16.011 247 HG12 VAL 31 2HG1 VAL 31 -16.314 -15.474 15.866 248 HG13 VAL 31 3HG1 VAL 31 -15.330 -14.359 14.921 249 HG21 VAL 31 3HG2 VAL 31 -15.217 -18.501 13.965 250 HG22 VAL 31 1HG2 VAL 31 -16.307 -17.960 15.243 251 HG23 VAL 31 2HG2 VAL 31 -14.561 -17.908 15.491 252 H MET 32 H MET 32 -18.275 -14.690 12.192 253 HA MET 32 HA MET 32 -16.684 -12.919 10.681 254 HB2 MET 32 2HB MET 32 -19.540 -12.836 11.610 255 HB3 MET 32 1HB MET 32 -18.825 -11.477 10.754 256 HG2 MET 32 2HG MET 32 -20.057 -12.910 9.240 257 HG3 MET 32 1HG MET 32 -18.340 -12.912 8.852 258 HE1 MET 32 3HE MET 32 -19.525 -16.520 7.875 259 HE2 MET 32 1HE MET 32 -18.705 -15.061 7.317 260 HE3 MET 32 2HE MET 32 -20.421 -15.008 7.715 261 H ALA 33 H ALA 33 -15.183 -11.745 11.628 262 HA ALA 33 HA ALA 33 -15.250 -10.836 14.294 263 HB1 ALA 33 3HB ALA 33 -13.172 -11.272 13.072 264 HB2 ALA 33 1HB ALA 33 -13.204 -9.643 13.748 265 HB3 ALA 33 2HB ALA 33 -13.500 -9.890 12.027 266 H SER 34 H SER 34 -15.252 -8.680 15.079 267 HA SER 34 HA SER 34 -17.251 -7.022 13.852 268 HB2 SER 34 2HB SER 34 -15.562 -6.578 16.329 269 HB3 SER 34 1HB SER 34 -16.960 -5.611 15.856 270 HG SER 34 HG SER 34 -18.034 -7.833 15.830 271 H GLU 35 H GLU 35 -16.712 -4.520 13.979 272 HA GLU 35 HA GLU 35 -14.767 -4.130 11.911 273 HB2 GLU 35 2HB GLU 35 -17.010 -2.915 12.221 274 HB3 GLU 35 1HB GLU 35 -16.185 -1.952 13.437 275 HG2 GLU 35 2HG GLU 35 -16.204 -0.769 11.354 276 HG3 GLU 35 1HG GLU 35 -14.552 -1.252 11.737 277 H ARG 36 H ARG 36 -12.719 -4.401 12.566 278 HA ARG 36 HA ARG 36 -11.835 -3.192 15.076 279 HB2 ARG 36 2HB ARG 36 -11.294 -5.555 14.623 280 HB3 ARG 36 1HB ARG 36 -10.403 -5.071 13.191 281 HG2 ARG 36 2HG ARG 36 -8.694 -4.077 14.454 282 HG3 ARG 36 1HG ARG 36 -9.675 -4.068 15.923 283 HD2 ARG 36 2HD ARG 36 -9.547 -6.441 16.112 284 HD3 ARG 36 1HD ARG 36 -8.815 -6.589 14.517 285 HE ARG 36 HE ARG 36 -6.826 -5.487 15.467 286 HH11 ARG 36 1HH1 ARG 36 -9.133 -6.922 17.686 287 HH12 ARG 36 2HH1 ARG 36 -7.938 -7.272 18.894 288 HH21 ARG 36 1HH2 ARG 36 -5.257 -5.980 17.054 289 HH22 ARG 36 2HH2 ARG 36 -5.750 -6.746 18.537 290 H LEU 37 H LEU 37 -11.406 -2.942 11.609 291 HA LEU 37 HA LEU 37 -9.376 -0.871 11.959 292 HB2 LEU 37 2HB LEU 37 -10.502 -2.207 9.506 293 HB3 LEU 37 1HB LEU 37 -9.388 -0.856 9.432 294 HG LEU 37 HG LEU 37 -8.829 -3.589 10.583 295 HD11 LEU 37 1HD1 LEU 37 -8.809 -3.518 8.151 296 HD12 LEU 37 2HD1 LEU 37 -7.172 -3.709 8.782 297 HD13 LEU 37 3HD1 LEU 37 -7.710 -2.136 8.188 298 HD21 LEU 37 3HD2 LEU 37 -6.544 -2.761 10.947 299 HD22 LEU 37 1HD2 LEU 37 -7.727 -1.896 11.928 300 HD23 LEU 37 2HD2 LEU 37 -7.069 -1.144 10.478 301 H VAL 38 H VAL 38 -12.332 -0.661 12.642 302 HA VAL 38 HA VAL 38 -13.609 1.165 10.963 303 HB VAL 38 HB VAL 38 -14.737 0.063 12.846 304 HG11 VAL 38 1HG1 VAL 38 -14.459 0.909 15.137 305 HG12 VAL 38 2HG1 VAL 38 -13.118 1.916 14.586 306 HG13 VAL 38 3HG1 VAL 38 -12.991 0.158 14.509 307 HG21 VAL 38 3HG2 VAL 38 -14.841 3.071 13.034 308 HG22 VAL 38 1HG2 VAL 38 -16.079 1.952 13.604 309 HG23 VAL 38 2HG2 VAL 38 -15.726 2.073 11.881 310 H SER 39 H SER 39 -11.093 1.624 13.342 311 HA SER 39 HA SER 39 -11.203 4.415 13.558 312 HB2 SER 39 2HB SER 39 -8.768 2.632 13.788 313 HB3 SER 39 1HB SER 39 -8.967 4.241 14.487 314 HG SER 39 HG SER 39 -10.624 3.418 15.794 315 H ALA 40 H ALA 40 -9.617 2.284 11.252 316 HA ALA 40 HA ALA 40 -8.055 4.271 9.971 317 HB1 ALA 40 3HB ALA 40 -9.013 1.614 8.908 318 HB2 ALA 40 1HB ALA 40 -7.517 1.896 9.799 319 HB3 ALA 40 2HB ALA 40 -7.741 2.611 8.204 320 H GLU 41 H GLU 41 -11.165 2.743 9.108 321 HA GLU 41 HA GLU 41 -11.512 4.311 6.772 322 HB2 GLU 41 2HB GLU 41 -13.806 3.449 6.726 323 HB3 GLU 41 1HB GLU 41 -12.647 2.167 7.026 324 HG2 GLU 41 2HG GLU 41 -13.977 1.547 8.681 325 HG3 GLU 41 1HG GLU 41 -13.364 2.946 9.559 326 H SER 42 H SER 42 -12.294 4.821 10.128 327 HA SER 42 HA SER 42 -14.062 7.006 9.745 328 HB2 SER 42 2HB SER 42 -13.939 5.726 11.859 329 HB3 SER 42 1HB SER 42 -12.312 6.346 12.131 330 HG SER 42 HG SER 42 -14.775 7.733 12.170 331 H LEU 43 H LEU 43 -10.563 6.775 10.321 332 HA LEU 43 HA LEU 43 -10.074 9.543 10.440 333 HB2 LEU 43 2HB LEU 43 -8.278 7.276 9.591 334 HB3 LEU 43 1HB LEU 43 -7.729 8.925 9.822 335 HG LEU 43 HG LEU 43 -8.913 7.158 11.968 336 HD11 LEU 43 1HD1 LEU 43 -6.630 7.166 12.882 337 HD12 LEU 43 2HD1 LEU 43 -6.073 8.027 11.446 338 HD13 LEU 43 3HD1 LEU 43 -6.717 6.393 11.301 339 HD21 LEU 43 3HD2 LEU 43 -9.412 9.496 12.366 340 HD22 LEU 43 1HD2 LEU 43 -7.721 9.926 12.106 341 HD23 LEU 43 2HD2 LEU 43 -8.177 8.940 13.496 342 H LEU 44 H LEU 44 -10.122 7.274 7.733 343 HA LEU 44 HA LEU 44 -9.383 9.162 5.748 344 HB2 LEU 44 2HB LEU 44 -9.252 6.712 5.432 345 HB3 LEU 44 1HB LEU 44 -11.003 6.626 5.464 346 HG LEU 44 HG LEU 44 -11.038 8.091 3.427 347 HD11 LEU 44 1HD1 LEU 44 -8.975 8.278 2.124 348 HD12 LEU 44 2HD1 LEU 44 -8.076 7.543 3.451 349 HD13 LEU 44 3HD1 LEU 44 -8.849 9.111 3.672 350 HD21 LEU 44 3HD2 LEU 44 -11.317 5.675 3.265 351 HD22 LEU 44 1HD2 LEU 44 -9.567 5.470 3.184 352 HD23 LEU 44 2HD2 LEU 44 -10.420 6.303 1.884 353 H ARG 45 H ARG 45 -12.443 8.144 7.135 354 HA ARG 45 HA ARG 45 -14.153 9.394 5.276 355 HB2 ARG 45 2HB ARG 45 -14.512 7.728 7.402 356 HB3 ARG 45 1HB ARG 45 -15.098 9.248 8.065 357 HG2 ARG 45 2HG ARG 45 -17.040 8.694 7.138 358 HG3 ARG 45 1HG ARG 45 -16.297 9.200 5.620 359 HD2 ARG 45 2HD ARG 45 -17.177 7.072 5.176 360 HD3 ARG 45 1HD ARG 45 -15.450 6.805 5.425 361 HE ARG 45 HE ARG 45 -15.911 5.723 7.444 362 HH11 ARG 45 1HH1 ARG 45 -18.834 6.966 5.954 363 HH12 ARG 45 2HH1 ARG 45 -19.898 6.029 6.956 364 HH21 ARG 45 1HH2 ARG 45 -17.281 4.483 8.741 365 HH22 ARG 45 2HH2 ARG 45 -19.006 4.606 8.555 366 H ASN 46 H ASN 46 -12.376 10.589 8.003 367 HA ASN 46 HA ASN 46 -13.759 13.169 7.879 368 HB2 ASN 46 2HB ASN 46 -11.831 11.978 9.872 369 HB3 ASN 46 1HB ASN 46 -12.278 13.682 9.900 370 HD21 ASN 46 1HD2 ASN 46 -13.353 10.426 10.441 371 HD22 ASN 46 2HD2 ASN 46 -14.845 10.830 11.228 372 H GLY 47 H GLY 47 -11.376 11.739 6.249 373 HA2 GLY 47 2HA GLY 47 -9.800 12.560 4.808 374 HA3 GLY 47 1HA GLY 47 -10.407 14.167 5.174 375 H LYS 48 H LYS 48 -9.264 12.197 7.791 376 HA LYS 48 HA LYS 48 -7.238 14.170 8.354 377 HB2 LYS 48 2HB LYS 48 -7.884 11.598 9.808 378 HB3 LYS 48 1HB LYS 48 -6.806 12.859 10.390 379 HG2 LYS 48 2HG LYS 48 -8.836 14.410 10.202 380 HG3 LYS 48 1HG LYS 48 -9.783 12.927 10.084 381 HD2 LYS 48 2HD LYS 48 -9.745 13.651 12.378 382 HD3 LYS 48 1HD LYS 48 -8.780 12.181 12.230 383 HE2 LYS 48 2HE LYS 48 -6.740 13.489 12.214 384 HE3 LYS 48 1HE LYS 48 -7.667 14.986 12.254 385 HZ1 LYS 48 3HZ LYS 48 -8.540 14.315 14.424 386 HZ2 LYS 48 1HZ LYS 48 -6.850 14.454 14.437 387 HZ3 LYS 48 2HZ LYS 48 -7.572 12.920 14.388 388 H ILE 49 H ILE 49 -7.351 10.796 7.337 389 HA ILE 49 HA ILE 49 -4.448 10.921 6.900 390 HB ILE 49 HB ILE 49 -4.446 8.476 6.788 391 HG12 ILE 49 2HG1 ILE 49 -7.362 8.626 7.592 392 HG13 ILE 49 1HG1 ILE 49 -6.801 8.241 5.969 393 HG21 ILE 49 1HG2 ILE 49 -5.753 9.556 9.279 394 HG22 ILE 49 2HG2 ILE 49 -4.025 9.550 8.919 395 HG23 ILE 49 3HG2 ILE 49 -4.883 8.028 9.155 396 HD11 ILE 49 3HD1 ILE 49 -7.386 6.222 7.143 397 HD12 ILE 49 1HD1 ILE 49 -6.294 6.635 8.465 398 HD13 ILE 49 2HD1 ILE 49 -5.645 6.263 6.868 399 H THR 50 H THR 50 -3.599 10.258 4.934 400 HA THR 50 HA THR 50 -5.365 10.675 2.671 401 HB THR 50 HB THR 50 -3.202 10.472 1.363 402 HG1 THR 50 HG1 THR 50 -2.116 10.409 4.016 403 HG21 THR 50 3HG2 THR 50 -4.114 12.639 1.997 404 HG22 THR 50 1HG2 THR 50 -2.353 12.655 2.094 405 HG23 THR 50 2HG2 THR 50 -3.316 12.531 3.567 406 H VAL 51 H VAL 51 -4.941 9.167 0.700 407 HA VAL 51 HA VAL 51 -5.698 6.522 1.325 408 HB VAL 51 HB VAL 51 -4.417 7.543 -1.225 409 HG11 VAL 51 1HG1 VAL 51 -5.503 5.639 -2.308 410 HG12 VAL 51 2HG1 VAL 51 -6.088 5.079 -0.740 411 HG13 VAL 51 3HG1 VAL 51 -4.356 5.113 -1.076 412 HG21 VAL 51 3HG2 VAL 51 -6.716 7.755 -2.057 413 HG22 VAL 51 1HG2 VAL 51 -6.412 8.808 -0.677 414 HG23 VAL 51 2HG2 VAL 51 -7.325 7.316 -0.462 415 H ARG 52 H ARG 52 -2.621 8.035 0.630 416 HA ARG 52 HA ARG 52 -0.834 5.968 0.581 417 HB2 ARG 52 2HB ARG 52 0.057 8.110 0.319 418 HB3 ARG 52 1HB ARG 52 -0.773 8.735 1.735 419 HG2 ARG 52 2HG ARG 52 0.759 7.333 3.135 420 HG3 ARG 52 1HG ARG 52 1.665 6.980 1.662 421 HD2 ARG 52 2HD ARG 52 2.583 8.859 3.033 422 HD3 ARG 52 1HD ARG 52 2.217 9.278 1.361 423 HE ARG 52 HE ARG 52 0.077 10.230 2.285 424 HH11 ARG 52 1HH1 ARG 52 2.963 10.001 4.286 425 HH12 ARG 52 2HH1 ARG 52 2.527 11.374 5.261 426 HH21 ARG 52 1HH2 ARG 52 -0.458 12.033 3.546 427 HH22 ARG 52 2HH2 ARG 52 0.604 12.547 4.823 428 H GLU 53 H GLU 53 -2.221 7.523 3.452 429 HA GLU 53 HA GLU 53 -0.810 5.767 5.253 430 HB2 GLU 53 2HB GLU 53 -2.956 7.831 5.791 431 HB3 GLU 53 1HB GLU 53 -1.956 7.042 7.009 432 HG2 GLU 53 2HG GLU 53 -0.027 8.156 6.323 433 HG3 GLU 53 1HG GLU 53 -0.730 8.606 4.771 434 H PHE 54 H PHE 54 -4.055 6.069 3.954 435 HA PHE 54 HA PHE 54 -5.362 4.295 5.701 436 HB2 PHE 54 2HB PHE 54 -6.539 5.816 4.151 437 HB3 PHE 54 1HB PHE 54 -5.973 4.852 2.791 438 HD1 PHE 54 HD1 PHE 54 -7.890 4.512 5.972 439 HD2 PHE 54 HD2 PHE 54 -7.318 3.161 1.975 440 HE1 PHE 54 HE1 PHE 54 -9.869 3.068 6.182 441 HE2 PHE 54 HE2 PHE 54 -9.301 1.717 2.179 442 HZ PHE 54 HZ PHE 54 -10.577 1.670 4.281 443 H VAL 55 H VAL 55 -3.989 3.702 2.453 444 HA VAL 55 HA VAL 55 -4.361 0.913 2.470 445 HB VAL 55 HB VAL 55 -2.248 2.539 1.032 446 HG11 VAL 55 1HG1 VAL 55 -3.158 -0.292 0.511 447 HG12 VAL 55 2HG1 VAL 55 -1.611 0.177 1.212 448 HG13 VAL 55 3HG1 VAL 55 -1.993 0.622 -0.450 449 HG21 VAL 55 3HG2 VAL 55 -3.744 2.298 -0.907 450 HG22 VAL 55 1HG2 VAL 55 -4.499 3.187 0.416 451 HG23 VAL 55 2HG2 VAL 55 -4.931 1.503 0.127 452 H ARG 56 H ARG 56 -1.720 2.958 3.574 453 HA ARG 56 HA ARG 56 0.186 1.032 4.189 454 HB2 ARG 56 2HB ARG 56 0.267 3.639 4.320 455 HB3 ARG 56 1HB ARG 56 -0.268 3.405 5.977 456 HG2 ARG 56 2HG ARG 56 1.700 2.136 6.494 457 HG3 ARG 56 1HG ARG 56 2.210 2.159 4.804 458 HD2 ARG 56 2HD ARG 56 2.216 4.696 5.003 459 HD3 ARG 56 1HD ARG 56 2.071 4.458 6.744 460 HE ARG 56 HE ARG 56 4.204 2.902 6.038 461 HH11 ARG 56 1HH1 ARG 56 3.420 6.309 5.695 462 HH12 ARG 56 2HH1 ARG 56 5.077 6.817 5.671 463 HH21 ARG 56 1HH2 ARG 56 6.375 3.560 5.975 464 HH22 ARG 56 2HH2 ARG 56 6.761 5.257 5.816 465 H ALA 57 H ALA 57 -2.240 2.465 6.365 466 HA ALA 57 HA ALA 57 -1.693 0.896 8.602 467 HB1 ALA 57 3HB ALA 57 -4.336 2.108 7.796 468 HB2 ALA 57 1HB ALA 57 -3.053 2.924 8.690 469 HB3 ALA 57 2HB ALA 57 -3.899 1.556 9.413 470 H VAL 58 H VAL 58 -4.262 0.413 6.156 471 HA VAL 58 HA VAL 58 -5.365 -1.866 7.345 472 HB VAL 58 HB VAL 58 -5.404 -1.068 4.430 473 HG11 VAL 58 1HG1 VAL 58 -5.979 -3.430 4.711 474 HG12 VAL 58 2HG1 VAL 58 -7.395 -2.484 4.251 475 HG13 VAL 58 3HG1 VAL 58 -7.182 -2.997 5.925 476 HG21 VAL 58 3HG2 VAL 58 -7.360 -0.560 6.666 477 HG22 VAL 58 1HG2 VAL 58 -7.612 -0.138 4.971 478 HG23 VAL 58 2HG2 VAL 58 -6.322 0.639 5.893 479 H ALA 59 H ALA 59 -2.793 -1.590 4.912 480 HA ALA 59 HA ALA 59 -2.788 -4.386 4.327 481 HB1 ALA 59 3HB ALA 59 -0.742 -2.281 3.655 482 HB2 ALA 59 1HB ALA 59 -2.126 -2.738 2.663 483 HB3 ALA 59 2HB ALA 59 -0.831 -3.898 2.959 484 H LYS 60 H LYS 60 -1.077 -2.419 6.675 485 HA LYS 60 HA LYS 60 0.793 -4.657 7.099 486 HB2 LYS 60 2HB LYS 60 2.338 -3.103 8.044 487 HB3 LYS 60 1HB LYS 60 1.732 -2.398 6.550 488 HG2 LYS 60 2HG LYS 60 0.104 -1.094 7.947 489 HG3 LYS 60 1HG LYS 60 0.980 -1.663 9.368 490 HD2 LYS 60 2HD LYS 60 2.115 -0.028 7.099 491 HD3 LYS 60 1HD LYS 60 1.736 0.558 8.718 492 HE2 LYS 60 2HE LYS 60 3.372 -1.210 9.554 493 HE3 LYS 60 1HE LYS 60 3.891 -1.358 7.878 494 HZ1 LYS 60 3HZ LYS 60 5.249 0.206 9.205 495 HZ2 LYS 60 1HZ LYS 60 3.883 1.193 9.398 496 HZ3 LYS 60 2HZ LYS 60 4.529 0.932 7.850 497 H SER 61 H SER 61 -2.067 -3.924 8.312 498 HA SER 61 HA SER 61 -1.255 -3.849 11.119 499 HB2 SER 61 2HB SER 61 -3.699 -3.327 11.525 500 HB3 SER 61 1HB SER 61 -2.791 -2.122 10.609 501 HG SER 61 HG SER 61 -3.907 -2.578 8.858 502 H GLU 62 H GLU 62 -4.283 -5.199 9.923 503 HA GLU 62 HA GLU 62 -3.862 -7.336 11.894 504 HB2 GLU 62 2HB GLU 62 -5.827 -5.490 11.738 505 HB3 GLU 62 1HB GLU 62 -6.565 -6.797 10.821 506 HG2 GLU 62 2HG GLU 62 -7.238 -6.946 13.115 507 HG3 GLU 62 1HG GLU 62 -6.191 -8.311 12.721 508 H LEU 63 H LEU 63 -3.029 -7.456 8.989 509 HA LEU 63 HA LEU 63 -4.784 -9.436 7.849 510 HB2 LEU 63 2HB LEU 63 -2.023 -8.531 7.030 511 HB3 LEU 63 1HB LEU 63 -2.976 -9.702 6.143 512 HG LEU 63 HG LEU 63 -3.648 -6.792 6.568 513 HD11 LEU 63 1HD1 LEU 63 -3.432 -6.661 4.140 514 HD12 LEU 63 2HD1 LEU 63 -2.982 -8.364 4.084 515 HD13 LEU 63 3HD1 LEU 63 -1.928 -7.202 4.887 516 HD21 LEU 63 3HD2 LEU 63 -5.618 -7.188 5.213 517 HD22 LEU 63 1HD2 LEU 63 -5.662 -8.204 6.654 518 HD23 LEU 63 2HD2 LEU 63 -5.220 -8.902 5.096 519 H TYR 64 H TYR 64 -4.936 -11.182 9.120 520 HA TYR 64 HA TYR 64 -2.697 -12.349 10.459 521 HB2 TYR 64 2HB TYR 64 -5.519 -13.361 10.058 522 HB3 TYR 64 1HB TYR 64 -4.315 -14.145 11.078 523 HD1 TYR 64 HD2 TYR 64 -3.160 -12.419 12.803 524 HD2 TYR 64 HD1 TYR 64 -7.053 -12.022 11.136 525 HE1 TYR 64 HE2 TYR 64 -3.813 -10.988 14.690 526 HE2 TYR 64 HE1 TYR 64 -7.717 -10.585 13.017 527 HH TYR 64 HH TYR 64 -5.544 -9.147 15.080 528 H LYS 65 H LYS 65 -1.922 -14.508 10.178 529 HA LYS 65 HA LYS 65 -1.523 -15.101 7.379 530 HB2 LYS 65 2HB LYS 65 0.132 -16.721 8.149 531 HB3 LYS 65 1HB LYS 65 0.387 -15.155 8.905 532 HG2 LYS 65 2HG LYS 65 -0.610 -15.941 10.957 533 HG3 LYS 65 1HG LYS 65 -0.999 -17.490 10.205 534 HD2 LYS 65 2HD LYS 65 1.385 -17.931 9.881 535 HD3 LYS 65 1HD LYS 65 1.775 -16.378 10.625 536 HE2 LYS 65 2HE LYS 65 2.059 -18.124 12.255 537 HE3 LYS 65 1HE LYS 65 0.668 -17.139 12.698 538 HZ1 LYS 65 3HZ LYS 65 0.668 -19.856 11.511 539 HZ2 LYS 65 1HZ LYS 65 -0.725 -18.886 11.569 540 HZ3 LYS 65 2HZ LYS 65 0.036 -19.366 13.006 541 H GLU 66 H GLU 66 -2.029 -16.939 6.330 542 HA GLU 66 HA GLU 66 -3.092 -19.312 7.255 543 HB2 GLU 66 2HB GLU 66 -5.029 -17.955 8.057 544 HB3 GLU 66 1HB GLU 66 -5.294 -17.402 6.407 545 HG2 GLU 66 2HG GLU 66 -5.377 -19.993 5.921 546 HG3 GLU 66 1HG GLU 66 -5.810 -20.059 7.627 547 H LYS 67 H LYS 67 -4.249 -17.035 4.823 548 HA LYS 67 HA LYS 67 -4.036 -18.918 2.677 549 HB2 LYS 67 2HB LYS 67 -4.359 -15.935 2.370 550 HB3 LYS 67 1HB LYS 67 -4.979 -17.212 1.333 551 HG2 LYS 67 2HG LYS 67 -6.536 -17.890 3.090 552 HG3 LYS 67 1HG LYS 67 -5.918 -16.610 4.128 553 HD2 LYS 67 2HD LYS 67 -6.610 -14.985 2.315 554 HD3 LYS 67 1HD LYS 67 -7.457 -16.335 1.558 555 HE2 LYS 67 2HE LYS 67 -7.951 -15.199 4.311 556 HE3 LYS 67 1HE LYS 67 -9.008 -15.070 2.910 557 HZ1 LYS 67 3HZ LYS 67 -9.327 -17.460 2.961 558 HZ2 LYS 67 1HZ LYS 67 -9.759 -16.775 4.451 559 HZ3 LYS 67 2HZ LYS 67 -8.289 -17.600 4.297 560 H PHE 68 H PHE 68 -2.073 -16.523 4.128 561 HA PHE 68 HA PHE 68 0.162 -17.351 2.470 562 HB2 PHE 68 2HB PHE 68 0.984 -14.985 2.339 563 HB3 PHE 68 1HB PHE 68 -0.475 -15.276 1.401 564 HD1 PHE 68 HD2 PHE 68 0.860 -13.738 4.474 565 HD2 PHE 68 HD1 PHE 68 -2.493 -14.133 1.884 566 HE1 PHE 68 HE2 PHE 68 -0.238 -11.857 5.619 567 HE2 PHE 68 HE1 PHE 68 -3.595 -12.248 3.021 568 HZ PHE 68 HZ PHE 68 -2.469 -11.108 4.889 569 H LEU 69 H LEU 69 2.236 -16.765 3.511 570 HA LEU 69 HA LEU 69 3.676 -16.776 5.251 571 HB2 LEU 69 2HB LEU 69 2.596 -14.629 5.825 572 HB3 LEU 69 1HB LEU 69 1.423 -15.493 6.801 573 HG LEU 69 HG LEU 69 3.251 -16.257 8.283 574 HD11 LEU 69 1HD1 LEU 69 5.088 -16.179 6.680 575 HD12 LEU 69 2HD1 LEU 69 5.453 -15.211 8.108 576 HD13 LEU 69 3HD1 LEU 69 4.962 -14.421 6.610 577 HD21 LEU 69 3HD2 LEU 69 3.041 -13.276 7.880 578 HD22 LEU 69 1HD2 LEU 69 3.666 -14.070 9.329 579 HD23 LEU 69 2HD2 LEU 69 1.977 -14.281 8.864 580 H TYR 70 H TYR 70 3.801 -18.984 5.379 581 HA TYR 70 HA TYR 70 2.949 -20.198 7.802 582 HB2 TYR 70 2HB TYR 70 0.824 -20.415 6.596 583 HB3 TYR 70 1HB TYR 70 1.653 -21.164 5.237 584 HD1 TYR 70 HD2 TYR 70 0.620 -21.645 8.750 585 HD2 TYR 70 HD1 TYR 70 2.200 -23.487 5.256 586 HE1 TYR 70 HE2 TYR 70 0.287 -23.857 9.771 587 HE2 TYR 70 HE1 TYR 70 1.872 -25.702 6.267 588 HH TYR 70 HH TYR 70 1.722 -26.645 8.621 589 H GLY 71 H GLY 71 3.446 -21.515 4.542 590 HA2 GLY 71 2HA GLY 71 6.203 -22.191 5.103 591 HA3 GLY 71 1HA GLY 71 5.115 -23.574 5.034 592 H ASN 72 H ASN 72 4.621 -20.708 3.153 593 HA ASN 72 HA ASN 72 4.761 -22.339 0.731 594 HB2 ASN 72 2HB ASN 72 3.703 -19.517 1.021 595 HB3 ASN 72 1HB ASN 72 3.454 -20.604 -0.336 596 HD21 ASN 72 1HD2 ASN 72 1.288 -20.695 -0.318 597 HD22 ASN 72 2HD2 ASN 72 0.346 -21.330 0.985 598 H PHE 73 H PHE 73 7.082 -21.164 2.219 599 HA PHE 73 HA PHE 73 9.049 -20.116 1.859 600 HB2 PHE 73 2HB PHE 73 8.050 -19.871 -0.983 601 HB3 PHE 73 1HB PHE 73 9.624 -19.285 -0.454 602 HD1 PHE 73 HD2 PHE 73 7.581 -22.257 -1.101 603 HD2 PHE 73 HD1 PHE 73 11.407 -20.807 0.069 604 HE1 PHE 73 HE2 PHE 73 8.538 -24.490 -1.478 605 HE2 PHE 73 HE1 PHE 73 12.370 -23.039 -0.305 606 HZ PHE 73 HZ PHE 73 10.934 -24.883 -1.084 607 H GLN 74 H GLN 74 9.680 -18.145 2.451 608 HA GLN 74 HA GLN 74 7.695 -16.255 3.075 609 HB2 GLN 74 2HB GLN 74 9.851 -16.611 4.302 610 HB3 GLN 74 1HB GLN 74 10.674 -15.781 2.991 611 HG2 GLN 74 2HG GLN 74 10.259 -14.333 4.928 612 HG3 GLN 74 1HG GLN 74 9.482 -13.749 3.458 613 HE21 GLN 74 1HE2 GLN 74 7.271 -13.707 3.322 614 HE22 GLN 74 2HE2 GLN 74 6.242 -13.968 4.687 615 H THR 75 H THR 75 9.949 -16.480 0.404 616 HA THR 75 HA THR 75 9.761 -13.924 -0.669 617 HB THR 75 HB THR 75 10.174 -15.115 -2.890 618 HG1 THR 75 HG1 THR 75 10.848 -17.394 -2.476 619 HG21 THR 75 3HG2 THR 75 11.996 -15.706 -0.557 620 HG22 THR 75 1HG2 THR 75 11.997 -14.237 -1.535 621 HG23 THR 75 2HG2 THR 75 12.455 -15.780 -2.257 622 H ARG 76 H ARG 76 7.798 -16.787 -1.408 623 HA ARG 76 HA ARG 76 6.076 -15.681 -3.268 624 HB2 ARG 76 2HB ARG 76 5.609 -17.839 -1.212 625 HB3 ARG 76 1HB ARG 76 4.436 -17.435 -2.459 626 HG2 ARG 76 2HG ARG 76 7.265 -18.193 -3.106 627 HG3 ARG 76 1HG ARG 76 5.980 -19.388 -2.917 628 HD2 ARG 76 2HD ARG 76 5.810 -17.053 -4.809 629 HD3 ARG 76 1HD ARG 76 6.424 -18.638 -5.280 630 HE ARG 76 HE ARG 76 3.768 -18.557 -4.075 631 HH11 ARG 76 1HH1 ARG 76 5.660 -18.619 -7.020 632 HH12 ARG 76 2HH1 ARG 76 4.412 -19.388 -7.953 633 HH21 ARG 76 1HH2 ARG 76 2.110 -19.505 -5.301 634 HH22 ARG 76 2HH2 ARG 76 2.376 -19.867 -6.987 635 H VAL 77 H VAL 77 5.793 -15.721 0.256 636 HA VAL 77 HA VAL 77 3.260 -14.498 0.424 637 HB VAL 77 HB VAL 77 5.507 -14.331 2.441 638 HG11 VAL 77 1HG1 VAL 77 3.704 -12.773 2.896 639 HG12 VAL 77 2HG1 VAL 77 3.696 -14.084 4.077 640 HG13 VAL 77 3HG1 VAL 77 2.521 -14.075 2.762 641 HG21 VAL 77 3HG2 VAL 77 3.384 -16.444 2.073 642 HG22 VAL 77 1HG2 VAL 77 4.453 -16.318 3.470 643 HG23 VAL 77 2HG2 VAL 77 5.125 -16.648 1.874 644 H ILE 78 H ILE 78 6.534 -13.174 0.475 645 HA ILE 78 HA ILE 78 5.823 -10.484 0.942 646 HB ILE 78 HB ILE 78 8.269 -11.722 -0.320 647 HG12 ILE 78 2HG1 ILE 78 7.815 -10.519 2.421 648 HG13 ILE 78 1HG1 ILE 78 7.824 -12.245 2.071 649 HG21 ILE 78 1HG2 ILE 78 9.371 -9.599 -0.104 650 HG22 ILE 78 2HG2 ILE 78 7.923 -8.878 0.599 651 HG23 ILE 78 3HG2 ILE 78 7.919 -9.400 -1.085 652 HD11 ILE 78 3HD1 ILE 78 9.930 -11.549 3.031 653 HD12 ILE 78 1HD1 ILE 78 10.144 -10.355 1.750 654 HD13 ILE 78 2HD1 ILE 78 10.160 -12.076 1.364 655 H GLU 79 H GLU 79 6.747 -12.162 -2.062 656 HA GLU 79 HA GLU 79 6.354 -9.983 -3.769 657 HB2 GLU 79 2HB GLU 79 6.610 -12.922 -4.126 658 HB3 GLU 79 1HB GLU 79 5.984 -11.991 -5.478 659 HG2 GLU 79 2HG GLU 79 8.412 -12.354 -5.598 660 HG3 GLU 79 1HG GLU 79 7.969 -10.653 -5.562 661 H LEU 80 H LEU 80 4.074 -12.377 -2.555 662 HA LEU 80 HA LEU 80 1.882 -11.764 -4.197 663 HB2 LEU 80 2HB LEU 80 2.094 -12.730 -1.362 664 HB3 LEU 80 1HB LEU 80 0.531 -12.350 -2.059 665 HG LEU 80 HG LEU 80 2.451 -14.386 -3.189 666 HD11 LEU 80 1HD1 LEU 80 -0.012 -14.751 -1.487 667 HD12 LEU 80 2HD1 LEU 80 1.651 -15.104 -1.017 668 HD13 LEU 80 3HD1 LEU 80 0.875 -16.049 -2.287 669 HD21 LEU 80 3HD2 LEU 80 -0.435 -13.778 -3.826 670 HD22 LEU 80 1HD2 LEU 80 0.520 -15.091 -4.517 671 HD23 LEU 80 2HD2 LEU 80 0.954 -13.414 -4.853 672 H ASN 81 H ASN 81 2.908 -10.338 -1.121 673 HA ASN 81 HA ASN 81 0.831 -8.443 -0.925 674 HB2 ASN 81 2HB ASN 81 3.634 -8.355 0.215 675 HB3 ASN 81 1HB ASN 81 2.334 -7.258 0.668 676 HD21 ASN 81 1HD2 ASN 81 3.847 -9.150 2.284 677 HD22 ASN 81 2HD2 ASN 81 2.674 -10.201 2.995 678 H TYR 82 H TYR 82 4.140 -8.167 -2.161 679 HA TYR 82 HA TYR 82 4.011 -5.476 -2.915 680 HB2 TYR 82 2HB TYR 82 5.707 -7.794 -3.753 681 HB3 TYR 82 1HB TYR 82 5.814 -6.277 -4.640 682 HD1 TYR 82 HD1 TYR 82 5.798 -7.445 -1.077 683 HD2 TYR 82 HD2 TYR 82 7.438 -4.800 -3.975 684 HE1 TYR 82 HE1 TYR 82 7.350 -6.561 0.611 685 HE2 TYR 82 HE2 TYR 82 8.992 -3.909 -2.295 686 HH TYR 82 HH TYR 82 9.374 -5.406 0.827 687 H LYS 83 H LYS 83 3.114 -8.401 -4.690 688 HA LYS 83 HA LYS 83 2.694 -7.189 -7.190 689 HB2 LYS 83 2HB LYS 83 2.817 -9.652 -6.724 690 HB3 LYS 83 1HB LYS 83 1.192 -9.552 -6.063 691 HG2 LYS 83 2HG LYS 83 0.332 -8.844 -8.223 692 HG3 LYS 83 1HG LYS 83 1.966 -8.874 -8.891 693 HD2 LYS 83 2HD LYS 83 2.086 -11.293 -8.338 694 HD3 LYS 83 1HD LYS 83 0.395 -11.223 -7.835 695 HE2 LYS 83 2HE LYS 83 -0.226 -10.493 -10.100 696 HE3 LYS 83 1HE LYS 83 1.466 -10.611 -10.586 697 HZ1 LYS 83 3HZ LYS 83 0.312 -12.585 -11.253 698 HZ2 LYS 83 1HZ LYS 83 -0.277 -12.836 -9.681 699 HZ3 LYS 83 2HZ LYS 83 1.379 -12.988 -9.997 700 H HIS 84 H HIS 84 0.635 -7.485 -4.359 701 HA HIS 84 HA HIS 84 -1.678 -6.413 -5.734 702 HB2 HIS 84 2HB HIS 84 -1.871 -8.130 -3.939 703 HB3 HIS 84 1HB HIS 84 -1.285 -6.944 -2.780 704 HD1 HIS 84 HD1 HIS 84 -2.997 -5.457 -1.731 705 HD2 HIS 84 HD2 HIS 84 -4.464 -7.456 -5.061 706 HE1 HIS 84 HE1 HIS 84 -5.461 -4.980 -1.770 707 HE2 HIS 84 HE2 HIS 84 -6.358 -6.423 -3.629 708 H LEU 85 H LEU 85 1.020 -5.126 -4.058 709 HA LEU 85 HA LEU 85 -0.413 -2.647 -3.431 710 HB2 LEU 85 2HB LEU 85 2.312 -3.619 -2.586 711 HB3 LEU 85 1HB LEU 85 1.643 -2.057 -2.154 712 HG LEU 85 HG LEU 85 0.492 -4.735 -1.358 713 HD11 LEU 85 1HD1 LEU 85 2.563 -4.276 -0.190 714 HD12 LEU 85 2HD1 LEU 85 1.198 -4.082 0.910 715 HD13 LEU 85 3HD1 LEU 85 1.995 -2.662 0.235 716 HD21 LEU 85 3HD2 LEU 85 -1.014 -3.428 0.052 717 HD22 LEU 85 1HD2 LEU 85 -1.230 -3.032 -1.652 718 HD23 LEU 85 2HD2 LEU 85 -0.337 -1.936 -0.600 719 H LEU 86 H LEU 86 2.057 -3.916 -5.526 720 HA LEU 86 HA LEU 86 2.742 -1.214 -6.441 721 HB2 LEU 86 2HB LEU 86 3.979 -3.882 -7.119 722 HB3 LEU 86 1HB LEU 86 4.548 -2.331 -7.698 723 HG LEU 86 HG LEU 86 4.525 -3.191 -4.803 724 HD11 LEU 86 1HD1 LEU 86 6.121 -4.481 -6.096 725 HD12 LEU 86 2HD1 LEU 86 6.961 -3.319 -5.068 726 HD13 LEU 86 3HD1 LEU 86 6.781 -3.002 -6.793 727 HD21 LEU 86 3HD2 LEU 86 4.303 -0.783 -5.070 728 HD22 LEU 86 1HD2 LEU 86 5.688 -0.762 -6.162 729 HD23 LEU 86 2HD2 LEU 86 5.908 -1.195 -4.467 730 H GLY 87 H GLY 87 0.909 -3.976 -7.331 731 HA2 GLY 87 2HA GLY 87 -0.300 -4.503 -9.216 732 HA3 GLY 87 1HA GLY 87 -0.055 -2.845 -9.753 733 H ARG 88 H ARG 88 2.556 -4.968 -8.940 734 HA ARG 88 HA ARG 88 3.273 -5.549 -11.676 735 HB2 ARG 88 2HB ARG 88 4.664 -3.465 -10.019 736 HB3 ARG 88 1HB ARG 88 5.587 -4.416 -11.172 737 HG2 ARG 88 2HG ARG 88 4.495 -3.507 -12.997 738 HG3 ARG 88 1HG ARG 88 3.113 -2.982 -12.033 739 HD2 ARG 88 2HD ARG 88 5.882 -1.842 -11.721 740 HD3 ARG 88 1HD ARG 88 4.662 -1.152 -12.793 741 HE ARG 88 HE ARG 88 3.656 -1.497 -10.151 742 HH11 ARG 88 1HH1 ARG 88 5.712 0.554 -12.082 743 HH12 ARG 88 2HH1 ARG 88 5.383 1.989 -11.155 744 HH21 ARG 88 1HH2 ARG 88 3.225 0.366 -8.905 745 HH22 ARG 88 2HH2 ARG 88 3.974 1.874 -9.335 746 H ALA 89 H ALA 89 5.902 -6.177 -11.319 747 HA ALA 89 HA ALA 89 5.985 -7.986 -9.009 748 HB1 ALA 89 3HB ALA 89 5.400 -9.290 -11.008 749 HB2 ALA 89 1HB ALA 89 7.001 -9.718 -10.402 750 HB3 ALA 89 2HB ALA 89 6.841 -8.684 -11.822 751 HA PRO 90 HA PRO 90 10.058 -6.434 -8.140 752 HB2 PRO 90 2HB PRO 90 11.479 -8.840 -8.020 753 HB3 PRO 90 1HB PRO 90 10.638 -8.066 -6.676 754 HG2 PRO 90 2HG PRO 90 9.740 -10.289 -8.445 755 HG3 PRO 90 1HG PRO 90 9.456 -10.047 -6.713 756 HD2 PRO 90 2HD PRO 90 7.533 -9.581 -8.507 757 HD3 PRO 90 1HD PRO 90 7.728 -8.537 -7.081 758 H TYR 91 H TYR 91 11.831 -5.790 -9.258 759 HA TYR 91 HA TYR 91 11.863 -6.550 -12.071 760 HB2 TYR 91 2HB TYR 91 13.433 -4.384 -10.657 761 HB3 TYR 91 1HB TYR 91 13.245 -4.578 -12.396 762 HD1 TYR 91 HD1 TYR 91 10.908 -4.297 -13.381 763 HD2 TYR 91 HD2 TYR 91 11.902 -3.121 -9.415 764 HE1 TYR 91 HE1 TYR 91 8.938 -2.825 -13.332 765 HE2 TYR 91 HE2 TYR 91 9.933 -1.649 -9.354 766 HH TYR 91 HH TYR 91 8.493 -0.443 -10.978 767 H ASP 92 H ASP 92 13.922 -6.594 -9.227 768 HA ASP 92 HA ASP 92 15.814 -8.286 -10.729 769 HB2 ASP 92 2HB ASP 92 16.780 -6.045 -10.310 770 HB3 ASP 92 1HB ASP 92 16.526 -6.273 -8.583 771 H GLU 93 H GLU 93 17.031 -9.808 -9.352 772 HA GLU 93 HA GLU 93 15.182 -11.066 -7.541 773 HB2 GLU 93 2HB GLU 93 16.583 -12.321 -9.190 774 HB3 GLU 93 1HB GLU 93 17.994 -11.924 -8.220 775 HG2 GLU 93 2HG GLU 93 16.987 -13.095 -6.311 776 HG3 GLU 93 1HG GLU 93 15.615 -13.535 -7.325 777 H SER 94 H SER 94 18.050 -9.096 -7.246 778 HA SER 94 HA SER 94 18.774 -9.954 -4.636 779 HB2 SER 94 2HB SER 94 19.422 -7.376 -6.079 780 HB3 SER 94 1HB SER 94 20.200 -7.937 -4.597 781 HG SER 94 HG SER 94 20.769 -8.575 -7.134 782 H GLU 95 H GLU 95 16.393 -7.703 -5.823 783 HA GLU 95 HA GLU 95 16.104 -6.318 -3.335 784 HB2 GLU 95 2HB GLU 95 14.175 -5.271 -4.275 785 HB3 GLU 95 1HB GLU 95 15.386 -5.375 -5.544 786 HG2 GLU 95 2HG GLU 95 14.231 -7.337 -6.457 787 HG3 GLU 95 1HG GLU 95 12.996 -7.168 -5.208 788 H VAL 96 H VAL 96 14.852 -9.243 -4.729 789 HA VAL 96 HA VAL 96 12.768 -9.726 -2.868 790 HB VAL 96 HB VAL 96 14.457 -11.739 -4.373 791 HG11 VAL 96 1HG1 VAL 96 13.272 -12.729 -2.487 792 HG12 VAL 96 2HG1 VAL 96 12.577 -13.267 -4.018 793 HG13 VAL 96 3HG1 VAL 96 11.757 -12.033 -3.060 794 HG21 VAL 96 3HG2 VAL 96 12.605 -11.773 -5.988 795 HG22 VAL 96 1HG2 VAL 96 13.363 -10.183 -5.889 796 HG23 VAL 96 2HG2 VAL 96 11.816 -10.473 -5.095 797 H ILE 97 H ILE 97 16.168 -10.716 -3.010 798 HA ILE 97 HA ILE 97 16.338 -12.018 -0.540 799 HB ILE 97 HB ILE 97 18.474 -10.378 -1.919 800 HG12 ILE 97 2HG1 ILE 97 17.826 -13.330 -2.096 801 HG13 ILE 97 1HG1 ILE 97 17.535 -12.138 -3.357 802 HG21 ILE 97 1HG2 ILE 97 20.056 -11.782 -0.665 803 HG22 ILE 97 2HG2 ILE 97 18.704 -12.537 0.179 804 HG23 ILE 97 3HG2 ILE 97 19.037 -10.819 0.405 805 HD11 ILE 97 3HD1 ILE 97 20.226 -12.952 -2.288 806 HD12 ILE 97 1HD1 ILE 97 19.935 -11.763 -3.556 807 HD13 ILE 97 2HD1 ILE 97 19.517 -13.456 -3.823 808 H PHE 98 H PHE 98 16.616 -8.621 -1.420 809 HA PHE 98 HA PHE 98 17.240 -7.589 1.113 810 HB2 PHE 98 2HB PHE 98 17.472 -6.261 -0.924 811 HB3 PHE 98 1HB PHE 98 15.732 -6.310 -1.178 812 HD1 PHE 98 HD2 PHE 98 18.342 -5.097 1.157 813 HD2 PHE 98 HD1 PHE 98 14.345 -4.685 -0.240 814 HE1 PHE 98 HE2 PHE 98 18.098 -3.036 2.475 815 HE2 PHE 98 HE1 PHE 98 14.092 -2.618 1.074 816 HZ PHE 98 HZ PHE 98 15.973 -1.792 2.432 817 H HIS 99 H HIS 99 14.116 -8.290 -0.434 818 HA HIS 99 HA HIS 99 12.427 -7.247 1.543 819 HB2 HIS 99 2HB HIS 99 12.009 -9.710 -0.173 820 HB3 HIS 99 1HB HIS 99 10.759 -8.932 0.782 821 HD1 HIS 99 HD1 HIS 99 10.390 -9.261 -2.236 822 HD2 HIS 99 HD2 HIS 99 12.034 -5.874 -0.447 823 HE1 HIS 99 HE1 HIS 99 10.121 -7.411 -3.907 824 HE2 HIS 99 HE2 HIS 99 11.138 -5.370 -2.825 825 H LEU 100 H LEU 100 13.754 -10.499 1.173 826 HA LEU 100 HA LEU 100 12.713 -11.684 3.458 827 HB2 LEU 100 2HB LEU 100 15.401 -12.161 2.166 828 HB3 LEU 100 1HB LEU 100 14.606 -13.250 3.283 829 HG LEU 100 HG LEU 100 13.507 -12.492 0.577 830 HD11 LEU 100 1HD1 LEU 100 15.567 -13.764 0.343 831 HD12 LEU 100 2HD1 LEU 100 14.174 -14.750 -0.102 832 HD13 LEU 100 3HD1 LEU 100 14.956 -14.984 1.461 833 HD21 LEU 100 3HD2 LEU 100 11.991 -14.378 0.957 834 HD22 LEU 100 1HD2 LEU 100 11.789 -13.119 2.178 835 HD23 LEU 100 2HD2 LEU 100 12.675 -14.594 2.570 836 H ASP 101 H ASP 101 15.732 -9.885 3.028 837 HA ASP 101 HA ASP 101 16.641 -10.263 5.687 838 HB2 ASP 101 2HB ASP 101 18.066 -9.644 3.693 839 HB3 ASP 101 1HB ASP 101 17.428 -8.010 3.835 840 H LEU 102 H LEU 102 14.955 -7.596 4.065 841 HA LEU 102 HA LEU 102 14.862 -5.808 6.216 842 HB2 LEU 102 2HB LEU 102 14.293 -5.202 3.912 843 HB3 LEU 102 1HB LEU 102 12.876 -6.230 3.978 844 HG LEU 102 HG LEU 102 11.889 -4.765 5.688 845 HD11 LEU 102 1HD1 LEU 102 14.334 -3.061 5.239 846 HD12 LEU 102 2HD1 LEU 102 13.947 -3.949 6.712 847 HD13 LEU 102 3HD1 LEU 102 12.923 -2.610 6.195 848 HD21 LEU 102 3HD2 LEU 102 11.398 -4.364 3.338 849 HD22 LEU 102 1HD2 LEU 102 12.821 -3.331 3.203 850 HD23 LEU 102 2HD2 LEU 102 11.469 -2.842 4.225 851 H TYR 103 H TYR 103 12.642 -8.387 5.251 852 HA TYR 103 HA TYR 103 10.690 -8.079 7.206 853 HB2 TYR 103 2HB TYR 103 10.227 -9.611 5.471 854 HB3 TYR 103 1HB TYR 103 11.731 -10.490 5.729 855 HD1 TYR 103 HD2 TYR 103 8.540 -9.662 7.489 856 HD2 TYR 103 HD1 TYR 103 11.666 -12.486 6.906 857 HE1 TYR 103 HE2 TYR 103 7.358 -11.260 8.938 858 HE2 TYR 103 HE1 TYR 103 10.498 -14.087 8.356 859 HH TYR 103 HH TYR 103 8.849 -14.067 10.150 860 H GLU 104 H GLU 104 13.764 -9.837 7.354 861 HA GLU 104 HA GLU 104 13.260 -10.905 9.955 862 HB2 GLU 104 2HB GLU 104 15.830 -10.658 8.390 863 HB3 GLU 104 1HB GLU 104 15.640 -11.581 9.876 864 HG2 GLU 104 2HG GLU 104 14.028 -13.037 8.786 865 HG3 GLU 104 1HG GLU 104 14.162 -12.091 7.304 866 H ASN 105 H ASN 105 14.846 -8.016 8.744 867 HA ASN 105 HA ASN 105 16.099 -7.398 11.264 868 HB2 ASN 105 2HB ASN 105 15.671 -5.632 8.843 869 HB3 ASN 105 1HB ASN 105 16.698 -5.248 10.216 870 HD21 ASN 105 1HD2 ASN 105 17.348 -5.466 7.409 871 HD22 ASN 105 2HD2 ASN 105 18.561 -6.702 7.262 872 H GLU 106 H GLU 106 13.455 -5.880 9.392 873 HA GLU 106 HA GLU 106 12.892 -4.235 11.751 874 HB2 GLU 106 2HB GLU 106 12.022 -3.894 8.882 875 HB3 GLU 106 1HB GLU 106 11.675 -2.776 10.195 876 HG2 GLU 106 2HG GLU 106 14.415 -3.483 9.168 877 HG3 GLU 106 1HG GLU 106 13.525 -2.005 8.809 878 H GLY 107 H GLY 107 11.318 -6.458 9.482 879 HA2 GLY 107 2HA GLY 107 9.670 -7.857 10.868 880 HA3 GLY 107 1HA GLY 107 8.903 -6.304 11.161 881 H PHE 108 H PHE 108 7.279 -8.041 10.203 882 HA PHE 108 HA PHE 108 7.284 -8.441 7.382 883 HB2 PHE 108 2HB PHE 108 6.133 -9.915 9.028 884 HB3 PHE 108 1HB PHE 108 4.980 -8.625 9.335 885 HD1 PHE 108 HD2 PHE 108 6.274 -10.851 6.660 886 HD2 PHE 108 HD1 PHE 108 3.066 -8.412 8.037 887 HE1 PHE 108 HE2 PHE 108 4.854 -11.695 4.834 888 HE2 PHE 108 HE1 PHE 108 1.642 -9.255 6.219 889 HZ PHE 108 HZ PHE 108 2.533 -10.896 4.613 890 H ASP 109 H ASP 109 5.644 -6.175 9.536 891 HA ASP 109 HA ASP 109 4.142 -4.891 7.501 892 HB2 ASP 109 2HB ASP 109 3.697 -3.158 9.168 893 HB3 ASP 109 1HB ASP 109 3.502 -4.758 9.871 894 H ALA 110 H ALA 110 7.407 -4.622 8.555 895 HA ALA 110 HA ALA 110 7.850 -1.953 7.618 896 HB1 ALA 110 3HB ALA 110 9.195 -2.924 9.417 897 HB2 ALA 110 1HB ALA 110 10.194 -2.390 8.067 898 HB3 ALA 110 2HB ALA 110 9.850 -4.106 8.283 899 H ASP 111 H ASP 111 8.385 -5.200 6.343 900 HA ASP 111 HA ASP 111 9.671 -4.428 3.955 901 HB2 ASP 111 2HB ASP 111 9.744 -6.736 4.635 902 HB3 ASP 111 1HB ASP 111 7.987 -6.848 4.624 903 H ILE 112 H ILE 112 6.275 -5.212 4.611 904 HA ILE 112 HA ILE 112 5.122 -4.478 2.200 905 HB ILE 112 HB ILE 112 4.145 -4.430 5.037 906 HG12 ILE 112 2HG1 ILE 112 3.386 -6.078 2.617 907 HG13 ILE 112 1HG1 ILE 112 4.444 -6.591 3.927 908 HG21 ILE 112 1HG2 ILE 112 2.964 -2.599 3.995 909 HG22 ILE 112 2HG2 ILE 112 1.870 -3.955 4.264 910 HG23 ILE 112 3HG2 ILE 112 2.496 -3.634 2.644 911 HD11 ILE 112 3HD1 ILE 112 1.525 -5.909 4.203 912 HD12 ILE 112 1HD1 ILE 112 2.590 -6.470 5.492 913 HD13 ILE 112 2HD1 ILE 112 2.208 -7.535 4.139 914 H ASP 113 H ASP 113 6.347 -2.511 4.762 915 HA ASP 113 HA ASP 113 4.908 -0.133 4.155 916 HB2 ASP 113 2HB ASP 113 5.909 -0.808 6.383 917 HB3 ASP 113 1HB ASP 113 7.477 -0.364 5.717 918 H SER 114 H SER 114 7.698 -1.581 2.783 919 HA SER 114 HA SER 114 9.424 0.535 2.350 920 HB2 SER 114 2HB SER 114 10.375 -0.795 0.524 921 HB3 SER 114 1HB SER 114 10.003 -1.809 1.917 922 HG SER 114 HG SER 114 8.800 -2.948 0.635 923 H TYR 115 H TYR 115 6.704 -0.469 0.299 924 HA TYR 115 HA TYR 115 7.219 1.232 -1.864 925 HB2 TYR 115 2HB TYR 115 5.636 -0.500 -2.195 926 HB3 TYR 115 1HB TYR 115 4.668 0.011 -0.816 927 HD1 TYR 115 HD1 TYR 115 5.934 1.540 -3.997 928 HD2 TYR 115 HD2 TYR 115 2.651 0.995 -1.344 929 HE1 TYR 115 HE1 TYR 115 4.511 2.876 -5.491 930 HE2 TYR 115 HE2 TYR 115 1.221 2.331 -2.831 931 HH TYR 115 HH TYR 115 1.435 4.026 -4.551 932 H ILE 116 H ILE 116 5.384 1.782 1.090 933 HA ILE 116 HA ILE 116 4.594 4.438 0.201 934 HB ILE 116 HB ILE 116 3.964 3.028 2.803 935 HG12 ILE 116 2HG1 ILE 116 2.311 3.231 0.274 936 HG13 ILE 116 1HG1 ILE 116 3.196 1.797 0.777 937 HG21 ILE 116 1HG2 ILE 116 2.677 5.408 1.463 938 HG22 ILE 116 2HG2 ILE 116 3.666 5.443 2.924 939 HG23 ILE 116 3HG2 ILE 116 2.103 4.626 2.936 940 HD11 ILE 116 3HD1 ILE 116 0.920 3.077 2.265 941 HD12 ILE 116 1HD1 ILE 116 1.805 1.637 2.768 942 HD13 ILE 116 2HD1 ILE 116 0.839 1.607 1.293 943 H ASP 117 H ASP 117 7.080 2.947 1.920 944 HA ASP 117 HA ASP 117 7.880 5.173 3.534 945 HB2 ASP 117 2HB ASP 117 8.608 2.865 4.031 946 HB3 ASP 117 1HB ASP 117 9.485 2.812 2.506 947 H SER 118 H SER 118 8.356 4.096 0.277 948 HA SER 118 HA SER 118 10.383 6.106 -0.282 949 HB2 SER 118 2HB SER 118 9.073 4.130 -2.166 950 HB3 SER 118 1HB SER 118 10.553 5.045 -2.452 951 HG SER 118 HG SER 118 10.109 2.872 -0.702 952 HA PRO 119 HA PRO 119 6.930 8.902 -0.961 953 HB2 PRO 119 2HB PRO 119 8.520 11.022 -1.748 954 HB3 PRO 119 1HB PRO 119 8.117 10.623 -0.078 955 HG2 PRO 119 2HG PRO 119 10.586 9.981 -1.635 956 HG3 PRO 119 1HG PRO 119 10.426 10.486 0.059 957 HD2 PRO 119 2HD PRO 119 10.871 7.929 -0.612 958 HD3 PRO 119 1HD PRO 119 9.831 8.361 0.760 959 H GLU 120 H GLU 120 9.633 8.784 -3.287 960 HA GLU 120 HA GLU 120 8.276 9.933 -5.440 961 HB2 GLU 120 2HB GLU 120 10.695 9.684 -5.414 962 HB3 GLU 120 1HB GLU 120 10.539 7.934 -5.472 963 HG2 GLU 120 2HG GLU 120 9.595 8.042 -7.679 964 HG3 GLU 120 1HG GLU 120 9.572 9.804 -7.622 965 H TYR 121 H TYR 121 8.538 6.545 -4.451 966 HA TYR 121 HA TYR 121 7.303 5.432 -6.714 967 HB2 TYR 121 2HB TYR 121 7.747 4.490 -3.910 968 HB3 TYR 121 1HB TYR 121 6.691 3.566 -4.972 969 HD1 TYR 121 HD1 TYR 121 10.142 4.631 -4.354 970 HD2 TYR 121 HD2 TYR 121 7.568 2.394 -6.889 971 HE1 TYR 121 HE1 TYR 121 12.100 3.533 -5.362 972 HE2 TYR 121 HE2 TYR 121 9.512 1.284 -7.902 973 HH TYR 121 HH TYR 121 12.569 1.332 -6.580 974 H THR 122 H THR 122 5.906 6.221 -3.525 975 HA THR 122 HA THR 122 3.268 5.547 -4.223 976 HB THR 122 HB THR 122 4.135 7.601 -2.174 977 HG1 THR 122 HG1 THR 122 4.742 5.050 -2.250 978 HG21 THR 122 3HG2 THR 122 1.732 7.638 -2.654 979 HG22 THR 122 1HG2 THR 122 2.044 7.001 -1.038 980 HG23 THR 122 2HG2 THR 122 1.640 5.900 -2.358 981 H ASN 123 H ASN 123 4.974 8.658 -4.271 982 HA ASN 123 HA ASN 123 2.752 10.243 -4.933 983 HB2 ASN 123 2HB ASN 123 4.743 11.214 -3.964 984 HB3 ASN 123 1HB ASN 123 5.705 10.720 -5.351 985 HD21 ASN 123 1HD2 ASN 123 5.609 11.897 -7.233 986 HD22 ASN 123 2HD2 ASN 123 4.844 13.448 -7.329 987 H SER 124 H SER 124 5.253 8.784 -7.004 988 HA SER 124 HA SER 124 4.277 10.146 -9.339 989 HB2 SER 124 2HB SER 124 6.264 7.869 -9.228 990 HB3 SER 124 1HB SER 124 6.052 9.039 -10.530 991 HG SER 124 HG SER 124 7.318 9.310 -8.071 992 H PHE 125 H PHE 125 3.546 7.167 -7.786 993 HA PHE 125 HA PHE 125 2.347 6.065 -10.206 994 HB2 PHE 125 2HB PHE 125 3.559 4.545 -8.691 995 HB3 PHE 125 1HB PHE 125 2.437 4.943 -7.395 996 HD1 PHE 125 HD1 PHE 125 2.262 3.797 -10.949 997 HD2 PHE 125 HD2 PHE 125 0.818 3.382 -6.970 998 HE1 PHE 125 HE1 PHE 125 0.792 1.962 -11.677 999 HE2 PHE 125 HE2 PHE 125 -0.651 1.551 -7.689 1000 HZ PHE 125 HZ PHE 125 -0.666 0.836 -10.043 1001 H GLY 126 H GLY 126 1.416 7.370 -7.061 1002 HA2 GLY 126 2HA GLY 126 -0.763 8.761 -7.639 1003 HA3 GLY 126 1HA GLY 126 -1.406 7.128 -7.737 1004 H ASP 127 H ASP 127 -0.475 9.691 -5.693 1005 HA ASP 127 HA ASP 127 -0.217 8.241 -3.260 1006 HB2 ASP 127 2HB ASP 127 0.653 10.561 -3.639 1007 HB3 ASP 127 1HB ASP 127 -1.007 11.142 -3.620 1008 H TRP 128 H TRP 128 -2.912 9.599 -5.038 1009 HA TRP 128 HA TRP 128 -4.773 8.860 -2.886 1010 HB2 TRP 128 2HB TRP 128 -5.267 10.354 -5.474 1011 HB3 TRP 128 1HB TRP 128 -6.483 10.019 -4.250 1012 HD1 TRP 128 HD1 TRP 128 -3.849 12.498 -5.197 1013 HE1 TRP 128 HE1 TRP 128 -3.755 14.385 -3.447 1014 HE3 TRP 128 HE3 TRP 128 -6.753 10.368 -1.563 1015 HZ2 TRP 128 HZ2 TRP 128 -4.764 14.884 -0.857 1016 HZ3 TRP 128 HZ3 TRP 128 -7.136 11.620 0.522 1017 HH2 TRP 128 HH2 TRP 128 -6.162 13.830 0.865 1018 H VAL 129 H VAL 129 -3.309 7.227 -5.217 1019 HA VAL 129 HA VAL 129 -5.705 6.086 -6.469 1020 HB VAL 129 HB VAL 129 -2.814 5.828 -7.317 1021 HG11 VAL 129 1HG1 VAL 129 -4.173 3.938 -8.041 1022 HG12 VAL 129 2HG1 VAL 129 -3.720 4.953 -9.411 1023 HG13 VAL 129 3HG1 VAL 129 -5.350 5.046 -8.746 1024 HG21 VAL 129 3HG2 VAL 129 -5.016 7.546 -8.455 1025 HG22 VAL 129 1HG2 VAL 129 -3.388 7.379 -9.110 1026 HG23 VAL 129 2HG2 VAL 129 -3.629 8.122 -7.529 1027 H VAL 130 H VAL 130 -6.240 3.983 -6.313 1028 HA VAL 130 HA VAL 130 -4.800 2.314 -4.420 1029 HB VAL 130 HB VAL 130 -7.301 1.699 -6.020 1030 HG11 VAL 130 1HG1 VAL 130 -7.651 -0.093 -4.383 1031 HG12 VAL 130 2HG1 VAL 130 -6.103 0.294 -3.631 1032 HG13 VAL 130 3HG1 VAL 130 -6.153 -0.318 -5.284 1033 HG21 VAL 130 3HG2 VAL 130 -6.969 2.740 -3.207 1034 HG22 VAL 130 1HG2 VAL 130 -8.483 2.121 -3.869 1035 HG23 VAL 130 2HG2 VAL 130 -7.739 3.560 -4.565 1036 HA PRO 131 HA PRO 131 -2.088 0.580 -7.442 1037 HB2 PRO 131 2HB PRO 131 -1.916 -1.927 -6.193 1038 HB3 PRO 131 1HB PRO 131 -0.862 -0.539 -5.920 1039 HG2 PRO 131 2HG PRO 131 -3.216 -1.466 -4.352 1040 HG3 PRO 131 1HG PRO 131 -1.711 -0.719 -3.787 1041 HD2 PRO 131 2HD PRO 131 -3.980 0.679 -3.891 1042 HD3 PRO 131 1HD PRO 131 -2.429 1.425 -4.333 1043 H TYR 132 H TYR 132 -2.499 -0.228 -9.348 1044 HA TYR 132 HA TYR 132 -4.330 -2.507 -9.617 1045 HB2 TYR 132 2HB TYR 132 -5.291 -1.574 -11.622 1046 HB3 TYR 132 1HB TYR 132 -5.416 -0.356 -10.359 1047 HD1 TYR 132 HD1 TYR 132 -3.565 1.465 -10.322 1048 HD2 TYR 132 HD2 TYR 132 -4.346 -1.040 -13.671 1049 HE1 TYR 132 HE1 TYR 132 -2.431 3.079 -11.788 1050 HE2 TYR 132 HE2 TYR 132 -3.209 0.565 -15.144 1051 HH TYR 132 HH TYR 132 -1.297 3.115 -13.962 1052 H TYR 133 H TYR 133 -3.946 -3.609 -11.829 1053 HA TYR 133 HA TYR 133 -1.145 -4.209 -11.921 1054 HB2 TYR 133 2HB TYR 133 -3.034 -5.873 -12.275 1055 HB3 TYR 133 1HB TYR 133 -3.229 -5.174 -13.879 1056 HD1 TYR 133 HD2 TYR 133 -0.783 -6.873 -11.669 1057 HD2 TYR 133 HD1 TYR 133 -1.854 -5.876 -15.664 1058 HE1 TYR 133 HE2 TYR 133 0.991 -8.353 -12.506 1059 HE2 TYR 133 HE1 TYR 133 -0.078 -7.351 -16.515 1060 HH TYR 133 HH TYR 133 2.058 -8.317 -15.717 1061 H ARG 134 H ARG 134 0.354 -3.364 -13.142 1062 HA ARG 134 HA ARG 134 -0.335 -1.294 -15.053 1063 HB2 ARG 134 2HB ARG 134 2.220 -2.256 -13.799 1064 HB3 ARG 134 1HB ARG 134 2.238 -1.131 -15.146 1065 HG2 ARG 134 2HG ARG 134 0.481 -0.382 -12.914 1066 HG3 ARG 134 1HG ARG 134 2.210 -0.403 -12.553 1067 HD2 ARG 134 2HD ARG 134 0.890 1.088 -14.822 1068 HD3 ARG 134 1HD ARG 134 1.485 1.805 -13.324 1069 HE ARG 134 HE ARG 134 3.447 0.324 -14.875 1070 HH11 ARG 134 1HH1 ARG 134 2.020 3.453 -14.185 1071 HH12 ARG 134 2HH1 ARG 134 3.390 4.352 -14.779 1072 HH21 ARG 134 1HH2 ARG 134 5.237 1.506 -15.687 1073 HH22 ARG 134 2HH2 ARG 134 5.214 3.244 -15.627 1074 H GLY 135 H GLY 135 -0.028 -1.365 -17.232 1075 HA2 GLY 135 2HA GLY 135 1.285 -2.028 -19.119 1076 HA3 GLY 135 1HA GLY 135 1.597 -3.557 -18.319 1077 H LEU 136 H LEU 136 -1.583 -2.051 -18.690 1078 HA LEU 136 HA LEU 136 -2.663 -4.401 -19.875 1079 HB2 LEU 136 2HB LEU 136 -4.738 -3.260 -20.004 1080 HB3 LEU 136 1HB LEU 136 -3.980 -2.772 -18.504 1081 HG LEU 136 HG LEU 136 -3.897 -1.072 -20.998 1082 HD11 LEU 136 1HD1 LEU 136 -5.869 -0.988 -18.717 1083 HD12 LEU 136 2HD1 LEU 136 -6.221 -1.430 -20.389 1084 HD13 LEU 136 3HD1 LEU 136 -5.728 0.218 -19.994 1085 HD21 LEU 136 3HD2 LEU 136 -3.401 -0.487 -18.079 1086 HD22 LEU 136 1HD2 LEU 136 -3.485 0.732 -19.351 1087 HD23 LEU 136 2HD2 LEU 136 -2.209 -0.482 -19.380 1088 H GLU 137 H GLU 137 -1.329 -1.437 -21.108 1089 HA GLU 137 HA GLU 137 -2.219 -1.870 -23.820 1090 HB2 GLU 137 2HB GLU 137 -0.248 0.074 -22.604 1091 HB3 GLU 137 1HB GLU 137 -0.709 0.074 -24.299 1092 HG2 GLU 137 2HG GLU 137 -2.845 0.263 -22.243 1093 HG3 GLU 137 1HG GLU 137 -1.844 1.678 -22.566 1094 H HIS 138 H HIS 138 0.332 -2.931 -21.844 1095 HA HIS 138 HA HIS 138 2.219 -3.225 -24.052 1096 HB2 HIS 138 2HB HIS 138 2.839 -2.250 -21.775 1097 HB3 HIS 138 1HB HIS 138 2.705 -3.888 -21.150 1098 HD1 HIS 138 HD1 HIS 138 4.704 -1.896 -23.684 1099 HD2 HIS 138 HD2 HIS 138 4.950 -5.414 -21.470 1100 HE1 HIS 138 HE1 HIS 138 7.046 -2.755 -24.019 1101 HE2 HIS 138 HE2 HIS 138 7.206 -4.808 -22.570 1102 H HIS 139 H HIS 139 -0.285 -4.966 -23.117 1103 HA HIS 139 HA HIS 139 1.085 -7.487 -23.774 1104 HB2 HIS 139 2HB HIS 139 -1.154 -7.081 -21.782 1105 HB3 HIS 139 1HB HIS 139 -0.712 -8.658 -22.429 1106 HD1 HIS 139 HD1 HIS 139 0.084 -6.325 -19.758 1107 HD2 HIS 139 HD2 HIS 139 2.034 -9.421 -21.738 1108 HE1 HIS 139 HE1 HIS 139 2.011 -6.977 -18.275 1109 HE2 HIS 139 HE2 HIS 139 3.209 -8.820 -19.509 1110 H HIS 140 H HIS 140 0.108 -8.754 -25.292 1111 HA HIS 140 HA HIS 140 -2.549 -7.999 -26.242 1112 HB2 HIS 140 2HB HIS 140 -1.498 -8.443 -28.646 1113 HB3 HIS 140 1HB HIS 140 -1.511 -6.845 -27.916 1114 HD1 HIS 140 HD1 HIS 140 0.883 -9.791 -28.353 1115 HD2 HIS 140 HD2 HIS 140 0.924 -5.677 -27.724 1116 HE1 HIS 140 HE1 HIS 140 3.285 -9.089 -28.572 1117 HE2 HIS 140 HE2 HIS 140 3.258 -6.579 -28.383 1118 H HIS 141 H HIS 141 -3.694 -9.749 -25.966 1119 HA HIS 141 HA HIS 141 -4.448 -11.886 -26.067 1120 HB2 HIS 141 2HB HIS 141 -2.608 -11.830 -28.443 1121 HB3 HIS 141 1HB HIS 141 -3.525 -13.275 -28.030 1122 HD1 HIS 141 HD1 HIS 141 -6.103 -13.159 -28.299 1123 HD2 HIS 141 HD2 HIS 141 -4.081 -9.749 -29.555 1124 HE1 HIS 141 HE1 HIS 141 -7.773 -11.830 -29.633 1125 HE2 HIS 141 HE2 HIS 141 -6.594 -9.672 -30.170 1126 H HIS 142 H HIS 142 -2.226 -11.336 -24.317 1127 HA HIS 142 HA HIS 142 -0.915 -12.431 -22.831 1128 HB2 HIS 142 2HB HIS 142 -2.335 -14.772 -24.062 1129 HB3 HIS 142 1HB HIS 142 -1.048 -15.022 -22.889 1130 HD1 HIS 142 HD1 HIS 142 -4.621 -14.457 -23.110 1131 HD2 HIS 142 HD2 HIS 142 -1.619 -13.668 -20.339 1132 HE1 HIS 142 HE1 HIS 142 -5.799 -14.043 -20.925 1133 HE2 HIS 142 HE2 HIS 142 -3.961 -13.641 -19.243 1134 H HIS 143 H HIS 143 -0.197 -12.131 -25.891 1135 HA HIS 143 HA HIS 143 2.497 -13.098 -25.472 1136 HB2 HIS 143 2HB HIS 143 1.398 -15.032 -26.553 1137 HB3 HIS 143 1HB HIS 143 0.890 -13.994 -27.881 1138 HD1 HIS 143 HD1 HIS 143 4.009 -15.500 -26.363 1139 HD2 HIS 143 HD2 HIS 143 2.756 -13.611 -29.851 1140 HE1 HIS 143 HE1 HIS 143 5.942 -15.678 -27.967 1141 HE2 HIS 143 HE2 HIS 143 5.235 -14.329 -29.976 Start of MODEL 14 1 H1 MET 1 1H MET 1 -9.369 7.433 -13.976 2 H2 MET 1 2H MET 1 -10.303 7.307 -12.569 3 H3 MET 1 3H MET 1 -10.925 8.092 -13.933 4 HA MET 1 HA MET 1 -11.933 5.999 -13.783 5 HB2 MET 1 2HB MET 1 -11.320 5.003 -15.941 6 HB3 MET 1 1HB MET 1 -11.480 6.747 -16.026 7 HG2 MET 1 2HG MET 1 -9.611 6.449 -17.270 8 HG3 MET 1 1HG MET 1 -8.880 6.677 -15.684 9 HE1 MET 1 3HE MET 1 -7.343 5.349 -18.165 10 HE2 MET 1 1HE MET 1 -6.518 4.033 -17.331 11 HE3 MET 1 2HE MET 1 -6.634 5.622 -16.574 12 HA PRO 2 HA PRO 2 -8.600 2.881 -12.369 13 HB2 PRO 2 2HB PRO 2 -6.475 4.002 -11.100 14 HB3 PRO 2 1HB PRO 2 -6.406 3.479 -12.787 15 HG2 PRO 2 2HG PRO 2 -6.796 6.223 -11.668 16 HG3 PRO 2 1HG PRO 2 -5.798 5.701 -13.038 17 HD2 PRO 2 2HD PRO 2 -8.235 6.843 -13.355 18 HD3 PRO 2 1HD PRO 2 -7.590 5.636 -14.483 19 H VAL 3 H VAL 3 -8.002 2.649 -9.853 20 HA VAL 3 HA VAL 3 -10.206 3.815 -8.458 21 HB VAL 3 HB VAL 3 -7.857 2.405 -7.188 22 HG11 VAL 3 1HG1 VAL 3 -9.336 3.565 -5.645 23 HG12 VAL 3 2HG1 VAL 3 -9.499 1.817 -5.469 24 HG13 VAL 3 3HG1 VAL 3 -10.730 2.735 -6.337 25 HG21 VAL 3 3HG2 VAL 3 -10.364 1.186 -8.345 26 HG22 VAL 3 1HG2 VAL 3 -9.139 0.329 -7.410 27 HG23 VAL 3 2HG2 VAL 3 -8.731 1.008 -8.985 28 H GLU 4 H GLU 4 -10.063 6.008 -8.345 29 HA GLU 4 HA GLU 4 -7.868 7.053 -6.695 30 HB2 GLU 4 2HB GLU 4 -7.598 9.004 -8.018 31 HB3 GLU 4 1HB GLU 4 -7.578 7.659 -9.144 32 HG2 GLU 4 2HG GLU 4 -10.209 8.909 -8.700 33 HG3 GLU 4 1HG GLU 4 -9.006 9.916 -9.499 34 H LEU 5 H LEU 5 -8.412 8.850 -5.381 35 HA LEU 5 HA LEU 5 -11.306 9.044 -4.903 36 HB2 LEU 5 2HB LEU 5 -9.870 8.187 -3.049 37 HB3 LEU 5 1HB LEU 5 -9.047 9.733 -3.021 38 HG LEU 5 HG LEU 5 -11.185 10.836 -2.433 39 HD11 LEU 5 1HD1 LEU 5 -13.089 9.468 -1.758 40 HD12 LEU 5 2HD1 LEU 5 -12.232 8.013 -2.266 41 HD13 LEU 5 3HD1 LEU 5 -12.700 9.224 -3.460 42 HD21 LEU 5 3HD2 LEU 5 -11.287 10.006 -0.133 43 HD22 LEU 5 1HD2 LEU 5 -9.621 10.168 -0.685 44 HD23 LEU 5 2HD2 LEU 5 -10.374 8.575 -0.608 45 H ARG 6 H ARG 6 -12.224 10.807 -5.664 46 HA ARG 6 HA ARG 6 -10.686 13.174 -6.247 47 HB2 ARG 6 2HB ARG 6 -12.925 14.110 -6.956 48 HB3 ARG 6 1HB ARG 6 -12.381 12.692 -7.838 49 HG2 ARG 6 2HG ARG 6 -13.869 11.287 -6.511 50 HG3 ARG 6 1HG ARG 6 -14.405 12.705 -5.607 51 HD2 ARG 6 2HD ARG 6 -15.358 13.679 -7.589 52 HD3 ARG 6 1HD ARG 6 -14.679 12.400 -8.594 53 HE ARG 6 HE ARG 6 -16.183 10.922 -7.039 54 HH11 ARG 6 1HH1 ARG 6 -16.957 14.010 -8.511 55 HH12 ARG 6 2HH1 ARG 6 -18.670 13.716 -8.525 56 HH21 ARG 6 1HH2 ARG 6 -18.426 10.545 -7.018 57 HH22 ARG 6 2HH2 ARG 6 -19.507 11.762 -7.642 58 H ALA 7 H ALA 7 -11.374 15.325 -5.449 59 HA ALA 7 HA ALA 7 -11.251 15.393 -2.644 60 HB1 ALA 7 3HB ALA 7 -11.526 17.806 -2.852 61 HB2 ALA 7 1HB ALA 7 -12.042 17.611 -4.527 62 HB3 ALA 7 2HB ALA 7 -10.393 17.197 -4.059 63 H ASN 8 H ASN 8 -13.943 16.369 -4.773 64 HA ASN 8 HA ASN 8 -15.755 15.958 -2.508 65 HB2 ASN 8 2HB ASN 8 -16.114 18.026 -3.757 66 HB3 ASN 8 1HB ASN 8 -16.296 17.115 -5.254 67 HD21 ASN 8 1HD2 ASN 8 -17.739 17.849 -2.154 68 HD22 ASN 8 2HD2 ASN 8 -19.347 17.331 -2.562 69 H TRP 9 H TRP 9 -15.673 13.769 -2.360 70 HA TRP 9 HA TRP 9 -16.483 12.205 -4.694 71 HB2 TRP 9 2HB TRP 9 -15.861 10.242 -3.214 72 HB3 TRP 9 1HB TRP 9 -14.538 11.304 -3.675 73 HD1 TRP 9 HD1 TRP 9 -13.170 12.416 -1.757 74 HE1 TRP 9 HE1 TRP 9 -13.240 12.283 0.815 75 HE3 TRP 9 HE3 TRP 9 -17.639 9.983 -1.184 76 HZ2 TRP 9 HZ2 TRP 9 -14.967 11.296 2.805 77 HZ3 TRP 9 HZ3 TRP 9 -18.425 9.489 1.091 78 HH2 TRP 9 HH2 TRP 9 -17.112 10.132 3.046 79 H SER 10 H SER 10 -18.109 10.569 -4.502 80 HA SER 10 HA SER 10 -20.154 11.160 -2.476 81 HB2 SER 10 2HB SER 10 -20.380 9.491 -5.000 82 HB3 SER 10 1HB SER 10 -21.704 10.002 -3.952 83 HG SER 10 HG SER 10 -20.697 12.231 -4.522 84 H GLU 11 H GLU 11 -21.416 8.963 -1.931 85 HA GLU 11 HA GLU 11 -19.638 7.402 -0.420 86 HB2 GLU 11 2HB GLU 11 -22.471 6.861 -1.305 87 HB3 GLU 11 1HB GLU 11 -21.587 5.806 -0.212 88 HG2 GLU 11 2HG GLU 11 -22.228 8.704 0.268 89 HG3 GLU 11 1HG GLU 11 -23.054 7.324 0.990 90 H GLU 12 H GLU 12 -21.047 6.897 -3.596 91 HA GLU 12 HA GLU 12 -20.228 4.273 -4.065 92 HB2 GLU 12 2HB GLU 12 -21.807 5.537 -5.475 93 HB3 GLU 12 1HB GLU 12 -20.485 6.546 -6.041 94 HG2 GLU 12 2HG GLU 12 -19.465 4.684 -7.155 95 HG3 GLU 12 1HG GLU 12 -20.643 3.572 -6.456 96 H ASP 13 H ASP 13 -18.505 7.326 -4.502 97 HA ASP 13 HA ASP 13 -16.169 6.284 -5.695 98 HB2 ASP 13 2HB ASP 13 -16.485 8.696 -3.895 99 HB3 ASP 13 1HB ASP 13 -15.078 8.351 -4.892 100 H LEU 14 H LEU 14 -16.913 7.131 -2.327 101 HA LEU 14 HA LEU 14 -14.521 6.314 -1.162 102 HB2 LEU 14 2HB LEU 14 -16.232 7.653 -0.018 103 HB3 LEU 14 1HB LEU 14 -17.296 6.262 0.028 104 HG LEU 14 HG LEU 14 -15.606 5.092 1.452 105 HD11 LEU 14 1HD1 LEU 14 -13.630 6.351 0.799 106 HD12 LEU 14 2HD1 LEU 14 -13.880 6.450 2.543 107 HD13 LEU 14 3HD1 LEU 14 -14.310 7.815 1.513 108 HD21 LEU 14 3HD2 LEU 14 -16.148 6.338 3.487 109 HD22 LEU 14 1HD2 LEU 14 -17.552 6.176 2.432 110 HD23 LEU 14 2HD2 LEU 14 -16.677 7.705 2.506 111 H GLU 15 H GLU 15 -17.537 4.483 -1.628 112 HA GLU 15 HA GLU 15 -16.816 2.081 -0.453 113 HB2 GLU 15 2HB GLU 15 -18.491 2.569 -2.924 114 HB3 GLU 15 1HB GLU 15 -18.368 1.012 -2.120 115 HG2 GLU 15 2HG GLU 15 -19.438 3.543 -0.891 116 HG3 GLU 15 1HG GLU 15 -20.405 2.205 -1.510 117 H THR 16 H THR 16 -16.453 2.981 -3.876 118 HA THR 16 HA THR 16 -15.196 0.647 -4.719 119 HB THR 16 HB THR 16 -14.861 3.429 -5.855 120 HG1 THR 16 HG1 THR 16 -17.000 3.058 -5.979 121 HG21 THR 16 3HG2 THR 16 -13.225 1.829 -6.740 122 HG22 THR 16 1HG2 THR 16 -14.412 2.266 -7.970 123 HG23 THR 16 2HG2 THR 16 -14.528 0.713 -7.143 124 H VAL 17 H VAL 17 -13.801 3.637 -3.433 125 HA VAL 17 HA VAL 17 -11.101 3.073 -3.912 126 HB VAL 17 HB VAL 17 -12.441 4.737 -1.780 127 HG11 VAL 17 1HG1 VAL 17 -10.271 4.015 -0.916 128 HG12 VAL 17 2HG1 VAL 17 -10.269 5.738 -1.296 129 HG13 VAL 17 3HG1 VAL 17 -9.490 4.594 -2.387 130 HG21 VAL 17 3HG2 VAL 17 -11.601 6.605 -3.154 131 HG22 VAL 17 1HG2 VAL 17 -12.710 5.556 -4.038 132 HG23 VAL 17 2HG2 VAL 17 -10.972 5.438 -4.318 133 H ILE 18 H ILE 18 -12.869 2.678 -0.823 134 HA ILE 18 HA ILE 18 -10.686 1.315 0.386 135 HB ILE 18 HB ILE 18 -12.262 0.820 2.237 136 HG12 ILE 18 2HG1 ILE 18 -14.254 2.216 0.439 137 HG13 ILE 18 1HG1 ILE 18 -14.332 0.547 0.995 138 HG21 ILE 18 1HG2 ILE 18 -10.997 2.871 2.251 139 HG22 ILE 18 2HG2 ILE 18 -12.618 3.184 2.875 140 HG23 ILE 18 3HG2 ILE 18 -12.200 3.658 1.228 141 HD11 ILE 18 3HD1 ILE 18 -14.573 3.016 2.699 142 HD12 ILE 18 1HD1 ILE 18 -14.597 1.356 3.298 143 HD13 ILE 18 2HD1 ILE 18 -15.879 1.926 2.230 144 H ARG 19 H ARG 19 -13.443 0.278 -1.451 145 HA ARG 19 HA ARG 19 -13.409 -2.458 -0.650 146 HB2 ARG 19 2HB ARG 19 -15.376 -1.326 -1.655 147 HB3 ARG 19 1HB ARG 19 -14.507 -1.213 -3.177 148 HG2 ARG 19 2HG ARG 19 -14.485 -3.620 -3.383 149 HG3 ARG 19 1HG ARG 19 -15.251 -3.784 -1.800 150 HD2 ARG 19 2HD ARG 19 -17.201 -2.536 -2.641 151 HD3 ARG 19 1HD ARG 19 -16.442 -2.455 -4.230 152 HE ARG 19 HE ARG 19 -16.716 -4.817 -4.438 153 HH11 ARG 19 1HH1 ARG 19 -18.310 -3.388 -1.666 154 HH12 ARG 19 2HH1 ARG 19 -19.422 -4.711 -1.456 155 HH21 ARG 19 1HH2 ARG 19 -18.179 -6.559 -4.166 156 HH22 ARG 19 2HH2 ARG 19 -19.318 -6.526 -2.854 157 H ALA 20 H ALA 20 -11.781 -0.598 -3.133 158 HA ALA 20 HA ALA 20 -10.731 -2.806 -4.584 159 HB1 ALA 20 3HB ALA 20 -9.621 -0.011 -4.344 160 HB2 ALA 20 1HB ALA 20 -10.841 -0.527 -5.508 161 HB3 ALA 20 2HB ALA 20 -9.212 -1.199 -5.581 162 H VAL 21 H VAL 21 -9.621 -0.879 -1.852 163 HA VAL 21 HA VAL 21 -7.117 -2.180 -1.538 164 HB VAL 21 HB VAL 21 -8.797 -0.865 0.609 165 HG11 VAL 21 1HG1 VAL 21 -6.995 -2.229 1.507 166 HG12 VAL 21 2HG1 VAL 21 -6.660 -0.514 1.748 167 HG13 VAL 21 3HG1 VAL 21 -5.833 -1.404 0.469 168 HG21 VAL 21 3HG2 VAL 21 -7.474 1.155 0.155 169 HG22 VAL 21 1HG2 VAL 21 -8.445 0.674 -1.237 170 HG23 VAL 21 2HG2 VAL 21 -6.713 0.339 -1.212 171 H TYR 22 H TYR 22 -10.141 -2.531 0.325 172 HA TYR 22 HA TYR 22 -9.908 -5.375 0.522 173 HB2 TYR 22 2HB TYR 22 -9.517 -5.558 2.902 174 HB3 TYR 22 1HB TYR 22 -8.201 -4.635 2.195 175 HD1 TYR 22 HD2 TYR 22 -9.668 -1.943 2.041 176 HD2 TYR 22 HD1 TYR 22 -9.357 -4.847 5.132 177 HE1 TYR 22 HE2 TYR 22 -10.035 -0.189 3.718 178 HE2 TYR 22 HE1 TYR 22 -9.726 -3.096 6.818 179 HH TYR 22 HH TYR 22 -10.884 -0.037 6.069 180 H ARG 23 H ARG 23 -11.480 -5.533 2.991 181 HA ARG 23 HA ARG 23 -13.882 -4.079 2.116 182 HB2 ARG 23 2HB ARG 23 -15.228 -5.762 3.265 183 HB3 ARG 23 1HB ARG 23 -14.208 -6.490 2.037 184 HG2 ARG 23 2HG ARG 23 -12.641 -7.201 3.804 185 HG3 ARG 23 1HG ARG 23 -13.747 -6.538 5.011 186 HD2 ARG 23 2HD ARG 23 -15.524 -8.023 4.097 187 HD3 ARG 23 1HD ARG 23 -14.310 -8.757 3.055 188 HE ARG 23 HE ARG 23 -13.480 -8.849 5.766 189 HH11 ARG 23 1HH1 ARG 23 -15.652 -10.314 3.452 190 HH12 ARG 23 2HH1 ARG 23 -15.807 -11.810 4.334 191 HH21 ARG 23 1HH2 ARG 23 -13.658 -10.828 6.937 192 HH22 ARG 23 2HH2 ARG 23 -14.659 -12.097 6.306 193 H GLN 24 H GLN 24 -15.039 -2.885 3.586 194 HA GLN 24 HA GLN 24 -13.355 -1.672 5.538 195 HB2 GLN 24 2HB GLN 24 -15.362 -0.203 5.972 196 HB3 GLN 24 1HB GLN 24 -14.755 -0.202 4.324 197 HG2 GLN 24 2HG GLN 24 -17.035 -1.971 5.122 198 HG3 GLN 24 1HG GLN 24 -17.297 -0.273 4.732 199 HE21 GLN 24 1HE2 GLN 24 -17.133 0.403 2.639 200 HE22 GLN 24 2HE2 GLN 24 -17.007 -0.686 1.299 201 H VAL 25 H VAL 25 -16.698 -2.799 6.061 202 HA VAL 25 HA VAL 25 -15.867 -3.662 8.753 203 HB VAL 25 HB VAL 25 -18.570 -2.477 8.076 204 HG11 VAL 25 1HG1 VAL 25 -18.529 -3.901 10.056 205 HG12 VAL 25 2HG1 VAL 25 -18.801 -2.215 10.492 206 HG13 VAL 25 3HG1 VAL 25 -17.211 -2.940 10.730 207 HG21 VAL 25 3HG2 VAL 25 -16.188 -1.070 9.276 208 HG22 VAL 25 1HG2 VAL 25 -17.817 -0.403 9.156 209 HG23 VAL 25 2HG2 VAL 25 -16.901 -0.761 7.692 210 H LEU 26 H LEU 26 -17.247 -5.357 9.671 211 HA LEU 26 HA LEU 26 -17.980 -7.368 7.784 212 HB2 LEU 26 2HB LEU 26 -18.583 -7.209 10.740 213 HB3 LEU 26 1HB LEU 26 -18.686 -8.645 9.739 214 HG LEU 26 HG LEU 26 -16.130 -7.140 10.305 215 HD11 LEU 26 1HD1 LEU 26 -17.191 -9.697 11.495 216 HD12 LEU 26 2HD1 LEU 26 -16.997 -8.157 12.333 217 HD13 LEU 26 3HD1 LEU 26 -15.578 -9.033 11.759 218 HD21 LEU 26 3HD2 LEU 26 -16.634 -9.813 9.004 219 HD22 LEU 26 1HD2 LEU 26 -15.052 -9.121 9.363 220 HD23 LEU 26 2HD2 LEU 26 -16.109 -8.343 8.184 221 H GLY 27 H GLY 27 -19.550 -6.371 6.484 222 HA2 GLY 27 2HA GLY 27 -21.768 -6.071 5.871 223 HA3 GLY 27 1HA GLY 27 -22.245 -6.448 7.523 224 H ASN 28 H ASN 28 -22.212 -4.802 9.092 225 HA ASN 28 HA ASN 28 -21.486 -2.120 8.589 226 HB2 ASN 28 2HB ASN 28 -23.473 -2.215 7.083 227 HB3 ASN 28 1HB ASN 28 -24.468 -2.668 8.461 228 HD21 ASN 28 1HD2 ASN 28 -24.943 -1.119 10.040 229 HD22 ASN 28 2HD2 ASN 28 -24.716 0.575 9.759 230 H ASP 29 H ASP 29 -23.616 -4.349 10.261 231 HA ASP 29 HA ASP 29 -24.161 -4.673 12.433 232 HB2 ASP 29 2HB ASP 29 -21.550 -4.333 12.595 233 HB3 ASP 29 1HB ASP 29 -21.991 -2.812 13.362 234 H TYR 30 H TYR 30 -24.162 -2.985 14.637 235 HA TYR 30 HA TYR 30 -25.647 -0.615 13.710 236 HB2 TYR 30 2HB TYR 30 -26.317 -2.375 16.084 237 HB3 TYR 30 1HB TYR 30 -27.140 -0.875 15.667 238 HD1 TYR 30 HD2 TYR 30 -28.413 -0.756 13.495 239 HD2 TYR 30 HD1 TYR 30 -26.930 -4.416 15.074 240 HE1 TYR 30 HE2 TYR 30 -29.957 -2.000 12.044 241 HE2 TYR 30 HE1 TYR 30 -28.465 -5.672 13.622 242 HH TYR 30 HH TYR 30 -30.163 -4.217 11.044 243 H VAL 31 H VAL 31 -23.561 -2.118 16.071 244 HA VAL 31 HA VAL 31 -22.624 0.547 16.868 245 HB VAL 31 HB VAL 31 -23.071 -1.758 18.785 246 HG11 VAL 31 1HG1 VAL 31 -22.370 -0.160 20.518 247 HG12 VAL 31 2HG1 VAL 31 -21.987 1.014 19.259 248 HG13 VAL 31 3HG1 VAL 31 -21.087 -0.499 19.357 249 HG21 VAL 31 3HG2 VAL 31 -25.169 -0.669 18.188 250 HG22 VAL 31 1HG2 VAL 31 -24.484 0.903 18.598 251 HG23 VAL 31 2HG2 VAL 31 -24.729 -0.308 19.857 252 H MET 32 H MET 32 -20.745 0.405 15.678 253 HA MET 32 HA MET 32 -19.135 -1.943 15.610 254 HB2 MET 32 2HB MET 32 -17.416 -0.486 14.562 255 HB3 MET 32 1HB MET 32 -18.979 -0.396 13.768 256 HG2 MET 32 2HG MET 32 -18.043 1.622 15.785 257 HG3 MET 32 1HG MET 32 -17.749 1.772 14.054 258 HE1 MET 32 3HE MET 32 -20.458 0.513 12.892 259 HE2 MET 32 1HE MET 32 -19.726 1.980 12.242 260 HE3 MET 32 2HE MET 32 -21.436 1.964 12.671 261 H ALA 33 H ALA 33 -17.382 -2.512 16.806 262 HA ALA 33 HA ALA 33 -17.006 -0.931 19.269 263 HB1 ALA 33 3HB ALA 33 -17.973 -3.168 19.600 264 HB2 ALA 33 1HB ALA 33 -16.381 -3.026 20.349 265 HB3 ALA 33 2HB ALA 33 -16.563 -3.883 18.819 266 H SER 34 H SER 34 -15.669 -0.674 16.633 267 HA SER 34 HA SER 34 -13.631 -0.279 15.756 268 HB2 SER 34 2HB SER 34 -13.257 1.034 17.808 269 HB3 SER 34 1HB SER 34 -12.678 -0.414 18.630 270 HG SER 34 HG SER 34 -10.803 -0.101 17.761 271 H GLU 35 H GLU 35 -14.016 -2.424 14.863 272 HA GLU 35 HA GLU 35 -12.730 -4.709 15.931 273 HB2 GLU 35 2HB GLU 35 -13.657 -4.076 13.124 274 HB3 GLU 35 1HB GLU 35 -13.048 -5.646 13.622 275 HG2 GLU 35 2HG GLU 35 -15.477 -5.615 13.554 276 HG3 GLU 35 1HG GLU 35 -14.889 -5.888 15.190 277 H ARG 36 H ARG 36 -11.873 -3.665 12.693 278 HA ARG 36 HA ARG 36 -9.149 -3.018 13.519 279 HB2 ARG 36 2HB ARG 36 -9.854 -5.235 11.589 280 HB3 ARG 36 1HB ARG 36 -8.276 -4.469 11.611 281 HG2 ARG 36 2HG ARG 36 -9.473 -5.850 13.999 282 HG3 ARG 36 1HG ARG 36 -8.442 -6.657 12.820 283 HD2 ARG 36 2HD ARG 36 -6.956 -6.061 14.512 284 HD3 ARG 36 1HD ARG 36 -6.755 -4.775 13.324 285 HE ARG 36 HE ARG 36 -8.715 -4.001 15.184 286 HH11 ARG 36 1HH1 ARG 36 -5.259 -4.594 15.047 287 HH12 ARG 36 2HH1 ARG 36 -4.895 -3.486 16.342 288 HH21 ARG 36 1HH2 ARG 36 -8.228 -2.545 16.875 289 HH22 ARG 36 2HH2 ARG 36 -6.578 -2.299 17.364 290 H LEU 37 H LEU 37 -8.520 -1.245 12.479 291 HA LEU 37 HA LEU 37 -8.069 0.229 10.826 292 HB2 LEU 37 2HB LEU 37 -9.267 -1.890 9.053 293 HB3 LEU 37 1HB LEU 37 -8.452 -0.449 8.469 294 HG LEU 37 HG LEU 37 -7.173 -2.591 10.168 295 HD11 LEU 37 1HD1 LEU 37 -6.865 -1.993 7.229 296 HD12 LEU 37 2HD1 LEU 37 -7.697 -3.389 7.918 297 HD13 LEU 37 3HD1 LEU 37 -5.959 -3.196 8.146 298 HD21 LEU 37 3HD2 LEU 37 -5.096 -1.411 9.660 299 HD22 LEU 37 1HD2 LEU 37 -6.226 -0.375 10.531 300 HD23 LEU 37 2HD2 LEU 37 -6.005 -0.176 8.793 301 H VAL 38 H VAL 38 -11.017 -0.325 11.952 302 HA VAL 38 HA VAL 38 -12.712 1.053 10.159 303 HB VAL 38 HB VAL 38 -13.559 -0.351 12.011 304 HG11 VAL 38 1HG1 VAL 38 -13.656 0.571 14.294 305 HG12 VAL 38 2HG1 VAL 38 -12.607 1.893 13.781 306 HG13 VAL 38 3HG1 VAL 38 -12.009 0.234 13.760 307 HG21 VAL 38 3HG2 VAL 38 -14.513 2.506 12.092 308 HG22 VAL 38 1HG2 VAL 38 -15.409 1.109 12.687 309 HG23 VAL 38 2HG2 VAL 38 -15.046 1.257 10.968 310 H SER 39 H SER 39 -10.383 2.050 12.514 311 HA SER 39 HA SER 39 -11.110 4.787 12.684 312 HB2 SER 39 2HB SER 39 -9.687 3.841 14.386 313 HB3 SER 39 1HB SER 39 -8.495 3.342 13.189 314 HG SER 39 HG SER 39 -9.155 5.980 14.014 315 H ALA 40 H ALA 40 -8.979 2.939 10.560 316 HA ALA 40 HA ALA 40 -7.807 5.168 9.267 317 HB1 ALA 40 3HB ALA 40 -6.801 2.930 9.238 318 HB2 ALA 40 1HB ALA 40 -7.020 3.573 7.609 319 HB3 ALA 40 2HB ALA 40 -8.130 2.352 8.234 320 H GLU 41 H GLU 41 -10.579 3.111 8.497 321 HA GLU 41 HA GLU 41 -11.214 4.215 6.005 322 HB2 GLU 41 2HB GLU 41 -12.150 2.105 6.844 323 HB3 GLU 41 1HB GLU 41 -13.048 2.977 8.073 324 HG2 GLU 41 2HG GLU 41 -13.495 3.671 5.214 325 HG3 GLU 41 1HG GLU 41 -14.183 2.178 5.849 326 H SER 42 H SER 42 -12.395 5.092 9.250 327 HA SER 42 HA SER 42 -14.129 7.126 8.333 328 HB2 SER 42 2HB SER 42 -13.962 7.864 10.806 329 HB3 SER 42 1HB SER 42 -14.641 6.276 10.451 330 HG SER 42 HG SER 42 -12.880 5.315 11.224 331 H LEU 43 H LEU 43 -10.775 7.204 9.517 332 HA LEU 43 HA LEU 43 -10.504 10.007 9.479 333 HB2 LEU 43 2HB LEU 43 -8.453 7.824 9.178 334 HB3 LEU 43 1HB LEU 43 -8.040 9.524 9.279 335 HG LEU 43 HG LEU 43 -9.446 7.930 11.423 336 HD11 LEU 43 1HD1 LEU 43 -7.092 7.318 11.157 337 HD12 LEU 43 2HD1 LEU 43 -7.372 8.173 12.674 338 HD13 LEU 43 3HD1 LEU 43 -6.633 9.013 11.310 339 HD21 LEU 43 3HD2 LEU 43 -10.138 10.280 11.380 340 HD22 LEU 43 1HD2 LEU 43 -8.448 10.777 11.449 341 HD23 LEU 43 2HD2 LEU 43 -9.170 9.913 12.809 342 H LEU 44 H LEU 44 -10.108 7.568 6.965 343 HA LEU 44 HA LEU 44 -9.120 9.363 4.980 344 HB2 LEU 44 2HB LEU 44 -8.853 6.915 4.832 345 HB3 LEU 44 1HB LEU 44 -10.590 6.737 4.675 346 HG LEU 44 HG LEU 44 -10.466 8.046 2.543 347 HD11 LEU 44 1HD1 LEU 44 -8.283 8.282 1.467 348 HD12 LEU 44 2HD1 LEU 44 -7.499 7.709 2.940 349 HD13 LEU 44 3HD1 LEU 44 -8.392 9.230 2.949 350 HD21 LEU 44 3HD2 LEU 44 -9.548 6.199 1.219 351 HD22 LEU 44 1HD2 LEU 44 -10.596 5.624 2.514 352 HD23 LEU 44 2HD2 LEU 44 -8.843 5.507 2.681 353 H ARG 45 H ARG 45 -12.297 8.232 5.961 354 HA ARG 45 HA ARG 45 -13.831 9.385 3.917 355 HB2 ARG 45 2HB ARG 45 -14.605 7.683 5.580 356 HB3 ARG 45 1HB ARG 45 -14.641 8.951 6.797 357 HG2 ARG 45 2HG ARG 45 -16.370 10.118 5.595 358 HG3 ARG 45 1HG ARG 45 -16.265 8.962 4.262 359 HD2 ARG 45 2HD ARG 45 -18.148 8.360 5.601 360 HD3 ARG 45 1HD ARG 45 -16.884 7.163 5.876 361 HE ARG 45 HE ARG 45 -17.497 9.363 7.753 362 HH11 ARG 45 1HH1 ARG 45 -16.449 6.066 7.122 363 HH12 ARG 45 2HH1 ARG 45 -16.469 5.622 8.806 364 HH21 ARG 45 1HH2 ARG 45 -17.514 8.775 9.940 365 HH22 ARG 45 2HH2 ARG 45 -17.062 7.161 10.404 366 H ASN 46 H ASN 46 -12.957 10.649 7.131 367 HA ASN 46 HA ASN 46 -14.110 13.215 6.732 368 HB2 ASN 46 2HB ASN 46 -12.013 12.165 8.622 369 HB3 ASN 46 1HB ASN 46 -12.437 13.873 8.585 370 HD21 ASN 46 1HD2 ASN 46 -14.411 14.542 9.344 371 HD22 ASN 46 2HD2 ASN 46 -15.448 13.502 10.268 372 H GLY 47 H GLY 47 -11.076 11.787 5.835 373 HA2 GLY 47 2HA GLY 47 -9.662 12.593 4.145 374 HA3 GLY 47 1HA GLY 47 -10.437 14.166 4.275 375 H LYS 48 H LYS 48 -9.394 12.543 7.141 376 HA LYS 48 HA LYS 48 -7.529 14.690 7.683 377 HB2 LYS 48 2HB LYS 48 -8.302 12.283 9.345 378 HB3 LYS 48 1HB LYS 48 -7.280 13.605 9.893 379 HG2 LYS 48 2HG LYS 48 -9.184 15.162 9.482 380 HG3 LYS 48 1HG LYS 48 -10.188 13.757 9.128 381 HD2 LYS 48 2HD LYS 48 -10.517 14.473 11.424 382 HD3 LYS 48 1HD LYS 48 -9.744 12.887 11.384 383 HE2 LYS 48 2HE LYS 48 -7.609 13.841 11.876 384 HE3 LYS 48 1HE LYS 48 -8.239 15.478 11.698 385 HZ1 LYS 48 3HZ LYS 48 -9.617 15.146 13.632 386 HZ2 LYS 48 1HZ LYS 48 -7.999 14.812 14.029 387 HZ3 LYS 48 2HZ LYS 48 -9.091 13.540 13.783 388 H ILE 49 H ILE 49 -7.476 11.336 6.759 389 HA ILE 49 HA ILE 49 -4.554 11.569 6.478 390 HB ILE 49 HB ILE 49 -4.337 9.149 6.670 391 HG12 ILE 49 2HG1 ILE 49 -7.283 9.091 7.357 392 HG13 ILE 49 1HG1 ILE 49 -6.616 8.606 5.801 393 HG21 ILE 49 1HG2 ILE 49 -4.130 10.484 8.699 394 HG22 ILE 49 2HG2 ILE 49 -4.808 8.893 9.047 395 HG23 ILE 49 3HG2 ILE 49 -5.858 10.310 8.999 396 HD11 ILE 49 3HD1 ILE 49 -7.076 6.676 7.193 397 HD12 ILE 49 1HD1 ILE 49 -6.027 7.319 8.458 398 HD13 ILE 49 2HD1 ILE 49 -5.343 6.834 6.907 399 H THR 50 H THR 50 -3.670 10.597 4.571 400 HA THR 50 HA THR 50 -5.542 10.683 2.340 401 HB THR 50 HB THR 50 -3.485 10.666 0.939 402 HG1 THR 50 HG1 THR 50 -1.480 10.732 1.917 403 HG21 THR 50 3HG2 THR 50 -4.475 12.792 1.657 404 HG22 THR 50 1HG2 THR 50 -2.719 12.907 1.551 405 HG23 THR 50 2HG2 THR 50 -3.498 12.750 3.125 406 H VAL 51 H VAL 51 -4.691 9.067 0.471 407 HA VAL 51 HA VAL 51 -5.401 6.472 1.345 408 HB VAL 51 HB VAL 51 -4.060 7.272 -1.248 409 HG11 VAL 51 1HG1 VAL 51 -5.630 4.802 -0.523 410 HG12 VAL 51 2HG1 VAL 51 -3.896 4.880 -0.839 411 HG13 VAL 51 3HG1 VAL 51 -5.046 5.209 -2.136 412 HG21 VAL 51 3HG2 VAL 51 -6.981 6.974 -0.567 413 HG22 VAL 51 1HG2 VAL 51 -6.329 7.286 -2.175 414 HG23 VAL 51 2HG2 VAL 51 -6.139 8.488 -0.899 415 H ARG 52 H ARG 52 -2.336 8.063 0.736 416 HA ARG 52 HA ARG 52 -0.563 5.935 0.938 417 HB2 ARG 52 2HB ARG 52 0.253 8.106 0.360 418 HB3 ARG 52 1HB ARG 52 -0.351 8.801 1.856 419 HG2 ARG 52 2HG ARG 52 1.295 7.387 3.090 420 HG3 ARG 52 1HG ARG 52 1.967 6.908 1.527 421 HD2 ARG 52 2HD ARG 52 2.539 9.183 1.016 422 HD3 ARG 52 1HD ARG 52 1.704 9.764 2.454 423 HE ARG 52 HE ARG 52 4.152 8.110 2.545 424 HH11 ARG 52 1HH1 ARG 52 2.113 10.671 3.790 425 HH12 ARG 52 2HH1 ARG 52 3.247 11.147 5.020 426 HH21 ARG 52 1HH2 ARG 52 5.658 8.751 4.160 427 HH22 ARG 52 2HH2 ARG 52 5.257 10.077 5.215 428 H GLU 53 H GLU 53 -1.977 7.920 3.501 429 HA GLU 53 HA GLU 53 -0.717 6.521 5.637 430 HB2 GLU 53 2HB GLU 53 -3.099 8.378 5.607 431 HB3 GLU 53 1HB GLU 53 -2.287 7.811 7.061 432 HG2 GLU 53 2HG GLU 53 -0.976 9.405 4.875 433 HG3 GLU 53 1HG GLU 53 -1.605 10.077 6.381 434 H PHE 54 H PHE 54 -3.851 6.375 4.070 435 HA PHE 54 HA PHE 54 -5.154 4.598 5.769 436 HB2 PHE 54 2HB PHE 54 -6.251 5.816 3.924 437 HB3 PHE 54 1HB PHE 54 -5.387 4.822 2.759 438 HD1 PHE 54 HD2 PHE 54 -7.780 4.594 5.591 439 HD2 PHE 54 HD1 PHE 54 -6.339 2.865 1.979 440 HE1 PHE 54 HE2 PHE 54 -9.617 2.957 5.646 441 HE2 PHE 54 HE1 PHE 54 -8.175 1.226 2.027 442 HZ PHE 54 HZ PHE 54 -9.818 1.271 3.863 443 H VAL 55 H VAL 55 -3.277 3.875 2.819 444 HA VAL 55 HA VAL 55 -3.420 1.074 3.071 445 HB VAL 55 HB VAL 55 -1.319 2.741 1.669 446 HG11 VAL 55 1HG1 VAL 55 -0.831 0.723 0.372 447 HG12 VAL 55 2HG1 VAL 55 -1.978 -0.187 1.353 448 HG13 VAL 55 3HG1 VAL 55 -0.517 0.469 2.089 449 HG21 VAL 55 3HG2 VAL 55 -2.618 2.252 -0.355 450 HG22 VAL 55 1HG2 VAL 55 -3.568 3.151 0.830 451 HG23 VAL 55 2HG2 VAL 55 -3.821 1.417 0.628 452 H ARG 56 H ARG 56 -1.076 3.435 4.283 453 HA ARG 56 HA ARG 56 0.878 1.669 5.208 454 HB2 ARG 56 2HB ARG 56 1.261 4.079 5.131 455 HB3 ARG 56 1HB ARG 56 0.036 4.337 6.365 456 HG2 ARG 56 2HG ARG 56 1.370 3.391 8.047 457 HG3 ARG 56 1HG ARG 56 2.460 2.648 6.880 458 HD2 ARG 56 2HD ARG 56 3.568 4.530 7.871 459 HD3 ARG 56 1HD ARG 56 3.202 4.911 6.194 460 HE ARG 56 HE ARG 56 1.473 6.396 6.953 461 HH11 ARG 56 1HH1 ARG 56 3.567 5.142 9.489 462 HH12 ARG 56 2HH1 ARG 56 3.205 6.441 10.587 463 HH21 ARG 56 1HH2 ARG 56 1.054 8.130 8.406 464 HH22 ARG 56 2HH2 ARG 56 1.799 8.113 9.979 465 H ALA 57 H ALA 57 -2.008 2.919 6.835 466 HA ALA 57 HA ALA 57 -1.553 1.500 9.264 467 HB1 ALA 57 3HB ALA 57 -4.114 2.666 8.174 468 HB2 ALA 57 1HB ALA 57 -2.936 3.512 9.180 469 HB3 ALA 57 2HB ALA 57 -3.836 2.145 9.836 470 H VAL 58 H VAL 58 -3.528 0.875 6.388 471 HA VAL 58 HA VAL 58 -4.865 -1.396 7.371 472 HB VAL 58 HB VAL 58 -4.258 -0.565 4.533 473 HG11 VAL 58 1HG1 VAL 58 -4.593 -2.987 4.596 474 HG12 VAL 58 2HG1 VAL 58 -5.961 -2.181 3.829 475 HG13 VAL 58 3HG1 VAL 58 -6.098 -2.763 5.487 476 HG21 VAL 58 3HG2 VAL 58 -6.772 -0.421 6.192 477 HG22 VAL 58 1HG2 VAL 58 -6.614 0.086 4.510 478 HG23 VAL 58 2HG2 VAL 58 -5.724 0.935 5.774 479 H ALA 59 H ALA 59 -1.925 -1.176 5.354 480 HA ALA 59 HA ALA 59 -1.677 -4.004 5.153 481 HB1 ALA 59 3HB ALA 59 0.456 -3.552 4.080 482 HB2 ALA 59 1HB ALA 59 0.376 -1.868 4.606 483 HB3 ALA 59 2HB ALA 59 -0.803 -2.489 3.450 484 H LYS 60 H LYS 60 -0.316 -1.602 7.365 485 HA LYS 60 HA LYS 60 1.489 -3.590 8.499 486 HB2 LYS 60 2HB LYS 60 2.178 -1.197 8.123 487 HB3 LYS 60 1HB LYS 60 1.065 -0.739 9.407 488 HG2 LYS 60 2HG LYS 60 2.344 -2.304 10.913 489 HG3 LYS 60 1HG LYS 60 3.542 -2.430 9.625 490 HD2 LYS 60 2HD LYS 60 2.679 0.151 10.926 491 HD3 LYS 60 1HD LYS 60 4.119 -0.764 11.375 492 HE2 LYS 60 2HE LYS 60 4.853 -0.542 8.967 493 HE3 LYS 60 1HE LYS 60 3.531 0.608 8.761 494 HZ1 LYS 60 3HZ LYS 60 5.817 0.862 10.642 495 HZ2 LYS 60 1HZ LYS 60 4.506 1.936 10.568 496 HZ3 LYS 60 2HZ LYS 60 5.553 1.785 9.242 497 H SER 61 H SER 61 -1.634 -3.409 8.822 498 HA SER 61 HA SER 61 -2.004 -3.029 11.635 499 HB2 SER 61 2HB SER 61 -4.289 -3.863 11.224 500 HB3 SER 61 1HB SER 61 -3.828 -2.620 10.061 501 HG SER 61 HG SER 61 -3.830 -4.056 8.484 502 H GLU 62 H GLU 62 -0.762 -5.531 9.791 503 HA GLU 62 HA GLU 62 -0.276 -7.708 10.097 504 HB2 GLU 62 2HB GLU 62 -0.451 -6.834 12.967 505 HB3 GLU 62 1HB GLU 62 -0.044 -8.483 12.519 506 HG2 GLU 62 2HG GLU 62 1.815 -7.459 11.108 507 HG3 GLU 62 1HG GLU 62 1.506 -5.971 12.010 508 H LEU 63 H LEU 63 -2.322 -8.172 9.073 509 HA LEU 63 HA LEU 63 -4.619 -8.960 10.476 510 HB2 LEU 63 2HB LEU 63 -3.511 -10.092 7.899 511 HB3 LEU 63 1HB LEU 63 -5.157 -10.273 8.472 512 HG LEU 63 HG LEU 63 -3.872 -7.649 7.709 513 HD11 LEU 63 1HD1 LEU 63 -5.834 -9.392 6.227 514 HD12 LEU 63 2HD1 LEU 63 -4.173 -9.033 5.755 515 HD13 LEU 63 3HD1 LEU 63 -5.385 -7.752 5.764 516 HD21 LEU 63 3HD2 LEU 63 -6.144 -6.757 7.848 517 HD22 LEU 63 1HD2 LEU 63 -5.608 -7.393 9.403 518 HD23 LEU 63 2HD2 LEU 63 -6.728 -8.323 8.408 519 H TYR 64 H TYR 64 -5.341 -11.160 10.948 520 HA TYR 64 HA TYR 64 -3.582 -12.597 12.535 521 HB2 TYR 64 2HB TYR 64 -6.033 -12.807 12.678 522 HB3 TYR 64 1HB TYR 64 -6.053 -13.633 11.124 523 HD1 TYR 64 HD2 TYR 64 -4.379 -13.946 14.458 524 HD2 TYR 64 HD1 TYR 64 -6.171 -15.920 11.148 525 HE1 TYR 64 HE2 TYR 64 -4.088 -16.105 15.597 526 HE2 TYR 64 HE1 TYR 64 -5.882 -18.085 12.271 527 HH TYR 64 HH TYR 64 -4.674 -19.130 13.971 528 H LYS 65 H LYS 65 -2.155 -14.194 12.198 529 HA LYS 65 HA LYS 65 -1.159 -14.420 9.527 530 HB2 LYS 65 2HB LYS 65 -0.186 -15.851 12.007 531 HB3 LYS 65 1HB LYS 65 0.710 -15.585 10.518 532 HG2 LYS 65 2HG LYS 65 -0.246 -13.392 12.349 533 HG3 LYS 65 1HG LYS 65 1.380 -14.075 12.359 534 HD2 LYS 65 2HD LYS 65 1.868 -13.224 10.223 535 HD3 LYS 65 1HD LYS 65 0.170 -12.903 9.872 536 HE2 LYS 65 2HE LYS 65 1.404 -10.838 10.335 537 HE3 LYS 65 1HE LYS 65 0.146 -11.122 11.535 538 HZ1 LYS 65 3HZ LYS 65 3.014 -11.795 11.935 539 HZ2 LYS 65 1HZ LYS 65 1.776 -11.857 13.096 540 HZ3 LYS 65 2HZ LYS 65 2.287 -10.362 12.483 541 H GLU 66 H GLU 66 -3.048 -15.443 8.640 542 HA GLU 66 HA GLU 66 -3.527 -18.241 9.243 543 HB2 GLU 66 2HB GLU 66 -4.677 -16.592 6.985 544 HB3 GLU 66 1HB GLU 66 -5.344 -18.063 7.682 545 HG2 GLU 66 2HG GLU 66 -5.858 -16.908 9.731 546 HG3 GLU 66 1HG GLU 66 -5.070 -15.446 9.141 547 H LYS 67 H LYS 67 -4.065 -19.188 6.643 548 HA LYS 67 HA LYS 67 -1.434 -19.778 5.703 549 HB2 LYS 67 2HB LYS 67 -4.139 -20.388 4.503 550 HB3 LYS 67 1HB LYS 67 -2.618 -20.956 3.834 551 HG2 LYS 67 2HG LYS 67 -2.194 -22.081 6.048 552 HG3 LYS 67 1HG LYS 67 -3.866 -21.691 6.468 553 HD2 LYS 67 2HD LYS 67 -2.969 -23.327 4.092 554 HD3 LYS 67 1HD LYS 67 -3.679 -23.963 5.577 555 HE2 LYS 67 2HE LYS 67 -5.762 -22.883 5.124 556 HE3 LYS 67 1HE LYS 67 -5.066 -21.992 3.774 557 HZ1 LYS 67 3HZ LYS 67 -4.862 -23.972 2.516 558 HZ2 LYS 67 1HZ LYS 67 -6.440 -23.950 3.138 559 HZ3 LYS 67 2HZ LYS 67 -5.264 -24.952 3.839 560 H PHE 68 H PHE 68 -0.749 -17.572 5.350 561 HA PHE 68 HA PHE 68 -0.952 -17.007 2.518 562 HB2 PHE 68 2HB PHE 68 -1.514 -14.696 2.690 563 HB3 PHE 68 1HB PHE 68 -2.709 -15.563 3.643 564 HD1 PHE 68 HD1 PHE 68 -2.544 -15.524 6.135 565 HD2 PHE 68 HD2 PHE 68 -0.110 -13.071 3.654 566 HE1 PHE 68 HE1 PHE 68 -2.049 -14.073 8.057 567 HE2 PHE 68 HE2 PHE 68 0.389 -11.617 5.573 568 HZ PHE 68 HZ PHE 68 -0.580 -12.117 7.780 569 H LEU 69 H LEU 69 0.483 -16.401 5.652 570 HA LEU 69 HA LEU 69 2.951 -15.421 4.432 571 HB2 LEU 69 2HB LEU 69 2.014 -14.256 6.401 572 HB3 LEU 69 1HB LEU 69 2.162 -15.729 7.336 573 HG LEU 69 HG LEU 69 4.630 -15.622 7.046 574 HD11 LEU 69 1HD1 LEU 69 4.029 -12.936 5.818 575 HD12 LEU 69 2HD1 LEU 69 4.730 -14.330 4.995 576 HD13 LEU 69 3HD1 LEU 69 5.627 -13.519 6.279 577 HD21 LEU 69 3HD2 LEU 69 3.333 -13.203 8.291 578 HD22 LEU 69 1HD2 LEU 69 4.973 -13.767 8.611 579 HD23 LEU 69 2HD2 LEU 69 3.592 -14.766 9.065 580 H TYR 70 H TYR 70 1.600 -18.319 4.986 581 HA TYR 70 HA TYR 70 4.172 -19.638 5.436 582 HB2 TYR 70 2HB TYR 70 2.686 -19.415 7.560 583 HB3 TYR 70 1HB TYR 70 1.679 -20.636 6.793 584 HD1 TYR 70 HD1 TYR 70 5.019 -19.947 8.187 585 HD2 TYR 70 HD2 TYR 70 2.342 -22.931 6.760 586 HE1 TYR 70 HE1 TYR 70 6.482 -21.694 9.114 587 HE2 TYR 70 HE2 TYR 70 3.797 -24.685 7.678 588 HH TYR 70 HH TYR 70 6.252 -24.038 9.904 589 H GLY 71 H GLY 71 4.437 -21.463 4.229 590 HA2 GLY 71 2HA GLY 71 2.564 -23.172 3.199 591 HA3 GLY 71 1HA GLY 71 2.620 -21.840 2.051 592 H ASN 72 H ASN 72 3.722 -22.514 0.343 593 HA ASN 72 HA ASN 72 5.828 -24.456 0.602 594 HB2 ASN 72 2HB ASN 72 5.949 -24.349 -1.860 595 HB3 ASN 72 1HB ASN 72 4.311 -24.630 -1.288 596 HD21 ASN 72 1HD2 ASN 72 5.272 -23.577 -3.828 597 HD22 ASN 72 2HD2 ASN 72 4.556 -22.015 -4.014 598 H PHE 73 H PHE 73 5.669 -21.084 -0.569 599 HA PHE 73 HA PHE 73 8.534 -20.868 0.052 600 HB2 PHE 73 2HB PHE 73 7.127 -19.980 -2.464 601 HB3 PHE 73 1HB PHE 73 8.679 -19.311 -1.972 602 HD1 PHE 73 HD1 PHE 73 10.687 -20.661 -2.020 603 HD2 PHE 73 HD2 PHE 73 6.946 -22.247 -3.283 604 HE1 PHE 73 HE1 PHE 73 11.850 -22.533 -3.107 605 HE2 PHE 73 HE2 PHE 73 8.106 -24.120 -4.377 606 HZ PHE 73 HZ PHE 73 10.559 -24.266 -4.289 607 H GLN 74 H GLN 74 9.211 -18.968 0.909 608 HA GLN 74 HA GLN 74 7.167 -17.201 1.959 609 HB2 GLN 74 2HB GLN 74 10.174 -17.230 2.278 610 HB3 GLN 74 1HB GLN 74 9.097 -16.111 3.103 611 HG2 GLN 74 2HG GLN 74 8.910 -19.102 3.366 612 HG3 GLN 74 1HG GLN 74 9.842 -18.078 4.458 613 HE21 GLN 74 1HE2 GLN 74 6.647 -18.943 3.370 614 HE22 GLN 74 2HE2 GLN 74 5.790 -18.220 4.691 615 H THR 75 H THR 75 9.507 -17.303 -0.571 616 HA THR 75 HA THR 75 9.777 -14.595 -1.193 617 HB THR 75 HB THR 75 10.231 -15.447 -3.540 618 HG1 THR 75 HG1 THR 75 9.988 -17.554 -3.961 619 HG21 THR 75 3HG2 THR 75 12.312 -16.579 -2.900 620 HG22 THR 75 1HG2 THR 75 11.702 -16.771 -1.256 621 HG23 THR 75 2HG2 THR 75 12.016 -15.159 -1.897 622 H ARG 76 H ARG 76 7.343 -16.964 -2.168 623 HA ARG 76 HA ARG 76 6.039 -15.219 -4.001 624 HB2 ARG 76 2HB ARG 76 5.942 -17.781 -3.957 625 HB3 ARG 76 1HB ARG 76 4.743 -17.594 -2.682 626 HG2 ARG 76 2HG ARG 76 3.480 -16.096 -4.285 627 HG3 ARG 76 1HG ARG 76 4.571 -16.690 -5.535 628 HD2 ARG 76 2HD ARG 76 3.867 -19.005 -4.949 629 HD3 ARG 76 1HD ARG 76 2.670 -18.312 -3.854 630 HE ARG 76 HE ARG 76 2.501 -18.510 -6.701 631 HH11 ARG 76 1HH1 ARG 76 1.490 -16.584 -3.951 632 HH12 ARG 76 2HH1 ARG 76 0.111 -15.908 -4.763 633 HH21 ARG 76 1HH2 ARG 76 0.651 -17.639 -7.764 634 HH22 ARG 76 2HH2 ARG 76 -0.378 -16.528 -6.908 635 H VAL 77 H VAL 77 5.868 -15.684 -0.577 636 HA VAL 77 HA VAL 77 3.290 -14.586 -0.133 637 HB VAL 77 HB VAL 77 5.705 -14.510 1.692 638 HG11 VAL 77 1HG1 VAL 77 2.774 -14.189 2.331 639 HG12 VAL 77 2HG1 VAL 77 3.980 -12.902 2.328 640 HG13 VAL 77 3HG1 VAL 77 4.097 -14.217 3.498 641 HG21 VAL 77 3HG2 VAL 77 4.771 -16.498 2.737 642 HG22 VAL 77 1HG2 VAL 77 5.108 -16.789 1.032 643 HG23 VAL 77 2HG2 VAL 77 3.450 -16.510 1.567 644 H ILE 78 H ILE 78 6.545 -13.152 -0.034 645 HA ILE 78 HA ILE 78 5.722 -10.490 0.304 646 HB ILE 78 HB ILE 78 8.198 -11.539 -1.083 647 HG12 ILE 78 2HG1 ILE 78 7.766 -10.582 1.758 648 HG13 ILE 78 1HG1 ILE 78 7.953 -12.262 1.267 649 HG21 ILE 78 1HG2 ILE 78 9.154 -9.317 -0.667 650 HG22 ILE 78 2HG2 ILE 78 7.604 -8.772 -0.023 651 HG23 ILE 78 3HG2 ILE 78 7.742 -9.228 -1.722 652 HD11 ILE 78 3HD1 ILE 78 10.220 -11.770 0.494 653 HD12 ILE 78 1HD1 ILE 78 10.005 -11.398 2.205 654 HD13 ILE 78 2HD1 ILE 78 10.025 -10.097 1.014 655 H GLU 79 H GLU 79 6.265 -12.451 -2.584 656 HA GLU 79 HA GLU 79 5.847 -10.511 -4.537 657 HB2 GLU 79 2HB GLU 79 6.720 -12.758 -5.007 658 HB3 GLU 79 1HB GLU 79 5.159 -13.458 -4.598 659 HG2 GLU 79 2HG GLU 79 4.131 -12.327 -6.466 660 HG3 GLU 79 1HG GLU 79 5.657 -11.537 -6.852 661 H LEU 80 H LEU 80 3.568 -12.506 -2.737 662 HA LEU 80 HA LEU 80 1.209 -11.939 -4.099 663 HB2 LEU 80 2HB LEU 80 1.843 -13.475 -2.006 664 HB3 LEU 80 1HB LEU 80 1.177 -12.118 -1.122 665 HG LEU 80 HG LEU 80 -0.290 -13.733 -3.202 666 HD11 LEU 80 1HD1 LEU 80 0.135 -15.026 -1.197 667 HD12 LEU 80 2HD1 LEU 80 -1.573 -14.599 -1.311 668 HD13 LEU 80 3HD1 LEU 80 -0.517 -13.725 -0.202 669 HD21 LEU 80 3HD2 LEU 80 -1.253 -11.542 -1.366 670 HD22 LEU 80 1HD2 LEU 80 -2.280 -12.538 -2.398 671 HD23 LEU 80 2HD2 LEU 80 -1.101 -11.444 -3.121 672 H ASN 81 H ASN 81 2.554 -10.316 -1.224 673 HA ASN 81 HA ASN 81 0.603 -8.255 -1.178 674 HB2 ASN 81 2HB ASN 81 3.377 -8.294 0.042 675 HB3 ASN 81 1HB ASN 81 2.104 -7.144 0.435 676 HD21 ASN 81 1HD2 ASN 81 0.023 -9.229 0.280 677 HD22 ASN 81 2HD2 ASN 81 0.188 -10.148 1.732 678 H TYR 82 H TYR 82 3.867 -8.486 -2.459 679 HA TYR 82 HA TYR 82 4.327 -5.853 -3.224 680 HB2 TYR 82 2HB TYR 82 5.728 -8.143 -3.331 681 HB3 TYR 82 1HB TYR 82 5.248 -8.042 -5.019 682 HD1 TYR 82 HD1 TYR 82 6.680 -5.849 -2.364 683 HD2 TYR 82 HD2 TYR 82 6.716 -6.998 -6.456 684 HE1 TYR 82 HE1 TYR 82 8.583 -4.353 -2.758 685 HE2 TYR 82 HE2 TYR 82 8.625 -5.500 -6.866 686 HH TYR 82 HH TYR 82 9.904 -3.851 -6.008 687 H LYS 83 H LYS 83 2.873 -8.514 -5.025 688 HA LYS 83 HA LYS 83 2.551 -7.111 -7.465 689 HB2 LYS 83 2HB LYS 83 2.685 -9.625 -7.034 690 HB3 LYS 83 1HB LYS 83 0.997 -9.531 -6.566 691 HG2 LYS 83 2HG LYS 83 0.377 -8.814 -8.778 692 HG3 LYS 83 1HG LYS 83 2.077 -8.743 -9.263 693 HD2 LYS 83 2HD LYS 83 2.247 -11.176 -8.705 694 HD3 LYS 83 1HD LYS 83 0.498 -11.186 -8.476 695 HE2 LYS 83 2HE LYS 83 0.161 -10.543 -10.782 696 HE3 LYS 83 1HE LYS 83 1.900 -10.395 -11.025 697 HZ1 LYS 83 3HZ LYS 83 1.194 -12.482 -11.891 698 HZ2 LYS 83 1HZ LYS 83 0.383 -12.879 -10.453 699 HZ3 LYS 83 2HZ LYS 83 2.079 -12.789 -10.473 700 H HIS 84 H HIS 84 0.519 -7.565 -4.642 701 HA HIS 84 HA HIS 84 -1.838 -6.541 -5.965 702 HB2 HIS 84 2HB HIS 84 -1.828 -8.271 -4.087 703 HB3 HIS 84 1HB HIS 84 -1.484 -6.938 -2.994 704 HD1 HIS 84 HD1 HIS 84 -4.216 -8.834 -4.261 705 HD2 HIS 84 HD2 HIS 84 -3.646 -4.824 -3.291 706 HE1 HIS 84 HE1 HIS 84 -6.516 -7.878 -3.937 707 HE2 HIS 84 HE2 HIS 84 -6.152 -5.414 -3.540 708 H LEU 85 H LEU 85 0.644 -5.308 -3.786 709 HA LEU 85 HA LEU 85 -0.819 -2.862 -3.287 710 HB2 LEU 85 2HB LEU 85 1.939 -3.775 -2.488 711 HB3 LEU 85 1HB LEU 85 1.274 -2.215 -2.050 712 HG LEU 85 HG LEU 85 0.046 -4.858 -1.260 713 HD11 LEU 85 1HD1 LEU 85 2.236 -4.576 -0.224 714 HD12 LEU 85 2HD1 LEU 85 0.943 -4.411 0.964 715 HD13 LEU 85 3HD1 LEU 85 1.765 -2.977 0.349 716 HD21 LEU 85 3HD2 LEU 85 -1.573 -3.055 -1.332 717 HD22 LEU 85 1HD2 LEU 85 -0.505 -2.027 -0.375 718 HD23 LEU 85 2HD2 LEU 85 -1.211 -3.474 0.344 719 H LEU 86 H LEU 86 2.283 -3.655 -4.897 720 HA LEU 86 HA LEU 86 2.486 -0.935 -5.864 721 HB2 LEU 86 2HB LEU 86 4.215 -3.370 -6.186 722 HB3 LEU 86 1HB LEU 86 4.521 -1.899 -7.086 723 HG LEU 86 HG LEU 86 4.478 -2.079 -4.072 724 HD11 LEU 86 1HD1 LEU 86 6.346 -3.334 -5.001 725 HD12 LEU 86 2HD1 LEU 86 6.906 -1.848 -4.235 726 HD13 LEU 86 3HD1 LEU 86 6.798 -1.946 -5.992 727 HD21 LEU 86 3HD2 LEU 86 5.447 0.144 -4.154 728 HD22 LEU 86 1HD2 LEU 86 3.888 0.128 -4.981 729 HD23 LEU 86 2HD2 LEU 86 5.382 0.129 -5.918 730 H GLY 87 H GLY 87 0.940 -3.717 -6.884 731 HA2 GLY 87 2HA GLY 87 -0.237 -4.177 -8.803 732 HA3 GLY 87 1HA GLY 87 0.150 -2.553 -9.356 733 H ARG 88 H ARG 88 2.827 -4.405 -8.449 734 HA ARG 88 HA ARG 88 3.373 -5.178 -11.233 735 HB2 ARG 88 2HB ARG 88 5.338 -4.009 -9.252 736 HB3 ARG 88 1HB ARG 88 5.762 -4.655 -10.826 737 HG2 ARG 88 2HG ARG 88 4.307 -2.884 -11.837 738 HG3 ARG 88 1HG ARG 88 4.166 -2.185 -10.220 739 HD2 ARG 88 2HD ARG 88 6.754 -2.675 -11.696 740 HD3 ARG 88 1HD ARG 88 5.946 -1.117 -11.552 741 HE ARG 88 HE ARG 88 6.502 -1.068 -9.253 742 HH11 ARG 88 1HH1 ARG 88 7.909 -3.820 -10.922 743 HH12 ARG 88 2HH1 ARG 88 9.131 -4.088 -9.716 744 HH21 ARG 88 1HH2 ARG 88 8.132 -1.437 -7.672 745 HH22 ARG 88 2HH2 ARG 88 9.259 -2.750 -7.887 746 H ALA 89 H ALA 89 4.120 -7.203 -11.485 747 HA ALA 89 HA ALA 89 4.679 -8.859 -9.183 748 HB1 ALA 89 3HB ALA 89 4.982 -9.392 -12.146 749 HB2 ALA 89 1HB ALA 89 3.626 -9.875 -11.128 750 HB3 ALA 89 2HB ALA 89 5.217 -10.589 -10.871 751 HA PRO 90 HA PRO 90 8.847 -7.496 -8.498 752 HB2 PRO 90 2HB PRO 90 9.741 -10.192 -8.080 753 HB3 PRO 90 1HB PRO 90 9.430 -8.942 -6.876 754 HG2 PRO 90 2HG PRO 90 7.717 -11.173 -7.747 755 HG3 PRO 90 1HG PRO 90 7.684 -10.251 -6.236 756 HD2 PRO 90 2HD PRO 90 5.776 -9.992 -8.128 757 HD3 PRO 90 1HD PRO 90 6.293 -8.629 -7.112 758 H TYR 91 H TYR 91 9.899 -6.859 -10.237 759 HA TYR 91 HA TYR 91 10.113 -8.589 -12.557 760 HB2 TYR 91 2HB TYR 91 9.450 -6.254 -12.878 761 HB3 TYR 91 1HB TYR 91 10.936 -5.706 -12.112 762 HD1 TYR 91 HD2 TYR 91 9.514 -7.279 -15.122 763 HD2 TYR 91 HD1 TYR 91 13.000 -5.641 -13.320 764 HE1 TYR 91 HE2 TYR 91 10.639 -7.278 -17.309 765 HE2 TYR 91 HE1 TYR 91 14.131 -5.633 -15.498 766 HH TYR 91 HH TYR 91 13.951 -6.901 -17.657 767 H ASP 92 H ASP 92 12.105 -7.188 -10.080 768 HA ASP 92 HA ASP 92 14.450 -8.572 -11.215 769 HB2 ASP 92 2HB ASP 92 14.502 -6.010 -11.103 770 HB3 ASP 92 1HB ASP 92 14.543 -6.189 -9.353 771 H GLU 93 H GLU 93 15.637 -9.871 -9.837 772 HA GLU 93 HA GLU 93 14.277 -10.967 -7.615 773 HB2 GLU 93 2HB GLU 93 16.399 -12.202 -7.201 774 HB3 GLU 93 1HB GLU 93 15.811 -12.339 -8.853 775 HG2 GLU 93 2HG GLU 93 17.428 -10.680 -9.580 776 HG3 GLU 93 1HG GLU 93 18.001 -10.499 -7.921 777 H SER 94 H SER 94 16.457 -8.311 -7.948 778 HA SER 94 HA SER 94 17.447 -8.128 -5.328 779 HB2 SER 94 2HB SER 94 16.775 -5.804 -7.148 780 HB3 SER 94 1HB SER 94 17.966 -5.830 -5.846 781 HG SER 94 HG SER 94 18.040 -7.176 -8.344 782 H GLU 95 H GLU 95 14.379 -7.106 -6.751 783 HA GLU 95 HA GLU 95 13.430 -5.556 -4.604 784 HB2 GLU 95 2HB GLU 95 11.833 -7.261 -6.533 785 HB3 GLU 95 1HB GLU 95 11.181 -5.989 -5.513 786 HG2 GLU 95 2HG GLU 95 12.659 -4.376 -6.722 787 HG3 GLU 95 1HG GLU 95 13.079 -5.682 -7.827 788 H VAL 96 H VAL 96 13.229 -9.002 -5.312 789 HA VAL 96 HA VAL 96 11.595 -9.659 -3.082 790 HB VAL 96 HB VAL 96 13.416 -11.503 -4.638 791 HG11 VAL 96 1HG1 VAL 96 10.952 -12.083 -2.994 792 HG12 VAL 96 2HG1 VAL 96 12.615 -12.435 -2.523 793 HG13 VAL 96 3HG1 VAL 96 11.896 -13.264 -3.904 794 HG21 VAL 96 3HG2 VAL 96 11.427 -12.026 -5.990 795 HG22 VAL 96 1HG2 VAL 96 11.933 -10.345 -6.162 796 HG23 VAL 96 2HG2 VAL 96 10.543 -10.749 -5.154 797 H ILE 97 H ILE 97 15.078 -10.042 -3.736 798 HA ILE 97 HA ILE 97 15.767 -11.215 -1.285 799 HB ILE 97 HB ILE 97 17.470 -9.500 -3.097 800 HG12 ILE 97 2HG1 ILE 97 17.167 -12.505 -2.886 801 HG13 ILE 97 1HG1 ILE 97 16.515 -11.500 -4.178 802 HG21 ILE 97 1HG2 ILE 97 18.276 -11.385 -0.883 803 HG22 ILE 97 2HG2 ILE 97 18.451 -9.631 -0.878 804 HG23 ILE 97 3HG2 ILE 97 19.384 -10.606 -2.014 805 HD11 ILE 97 3HD1 ILE 97 19.433 -11.876 -3.542 806 HD12 ILE 97 1HD1 ILE 97 18.773 -10.895 -4.850 807 HD13 ILE 97 2HD1 ILE 97 18.550 -12.644 -4.861 808 H PHE 98 H PHE 98 15.596 -7.821 -2.261 809 HA PHE 98 HA PHE 98 16.641 -6.609 0.011 810 HB2 PHE 98 2HB PHE 98 16.099 -5.340 -1.998 811 HB3 PHE 98 1HB PHE 98 14.385 -5.680 -1.785 812 HD1 PHE 98 HD2 PHE 98 17.271 -3.874 -0.358 813 HD2 PHE 98 HD1 PHE 98 13.042 -4.341 -0.386 814 HE1 PHE 98 HE2 PHE 98 17.036 -1.815 0.968 815 HE2 PHE 98 HE1 PHE 98 12.800 -2.284 0.941 816 HZ PHE 98 HZ PHE 98 14.799 -1.019 1.620 817 H HIS 99 H HIS 99 13.264 -7.507 -0.678 818 HA HIS 99 HA HIS 99 12.325 -6.632 1.862 819 HB2 HIS 99 2HB HIS 99 11.117 -8.275 -0.344 820 HB3 HIS 99 1HB HIS 99 10.280 -8.073 1.193 821 HD1 HIS 99 HD1 HIS 99 8.965 -5.978 1.516 822 HD2 HIS 99 HD2 HIS 99 11.591 -5.735 -1.711 823 HE1 HIS 99 HE1 HIS 99 8.421 -3.812 0.346 824 HE2 HIS 99 HE2 HIS 99 10.109 -3.622 -1.523 825 H LEU 100 H LEU 100 13.325 -9.780 0.595 826 HA LEU 100 HA LEU 100 12.629 -11.389 2.764 827 HB2 LEU 100 2HB LEU 100 14.990 -11.528 0.891 828 HB3 LEU 100 1HB LEU 100 14.658 -12.761 2.090 829 HG LEU 100 HG LEU 100 12.771 -12.003 -0.145 830 HD11 LEU 100 1HD1 LEU 100 13.452 -14.145 -1.142 831 HD12 LEU 100 2HD1 LEU 100 14.671 -14.331 0.119 832 HD13 LEU 100 3HD1 LEU 100 14.793 -13.005 -1.036 833 HD21 LEU 100 3HD2 LEU 100 11.629 -12.915 1.796 834 HD22 LEU 100 1HD2 LEU 100 12.748 -14.277 1.840 835 HD23 LEU 100 2HD2 LEU 100 11.637 -14.092 0.483 836 H ASP 101 H ASP 101 15.602 -9.543 2.204 837 HA ASP 101 HA ASP 101 16.925 -10.287 4.573 838 HB2 ASP 101 2HB ASP 101 17.675 -8.924 2.390 839 HB3 ASP 101 1HB ASP 101 17.377 -7.561 3.464 840 H LEU 102 H LEU 102 14.911 -7.465 3.805 841 HA LEU 102 HA LEU 102 15.159 -6.186 6.300 842 HB2 LEU 102 2HB LEU 102 14.373 -5.060 4.269 843 HB3 LEU 102 1HB LEU 102 12.916 -6.033 4.287 844 HG LEU 102 HG LEU 102 12.262 -4.986 6.426 845 HD11 LEU 102 1HD1 LEU 102 14.680 -3.239 5.976 846 HD12 LEU 102 2HD1 LEU 102 14.500 -4.442 7.252 847 HD13 LEU 102 3HD1 LEU 102 13.456 -3.020 7.229 848 HD21 LEU 102 3HD2 LEU 102 11.462 -4.085 4.300 849 HD22 LEU 102 1HD2 LEU 102 12.872 -3.031 4.214 850 HD23 LEU 102 2HD2 LEU 102 11.684 -2.809 5.498 851 H TYR 103 H TYR 103 12.732 -8.458 5.060 852 HA TYR 103 HA TYR 103 11.013 -8.472 7.256 853 HB2 TYR 103 2HB TYR 103 10.375 -9.566 5.199 854 HB3 TYR 103 1HB TYR 103 11.723 -10.691 5.327 855 HD1 TYR 103 HD1 TYR 103 8.485 -9.732 6.840 856 HD2 TYR 103 HD2 TYR 103 11.536 -12.685 6.590 857 HE1 TYR 103 HE1 TYR 103 7.053 -11.311 8.071 858 HE2 TYR 103 HE2 TYR 103 10.117 -14.269 7.816 859 HH TYR 103 HH TYR 103 8.206 -14.094 9.487 860 H GLU 104 H GLU 104 13.956 -10.329 6.653 861 HA GLU 104 HA GLU 104 13.793 -11.885 9.024 862 HB2 GLU 104 2HB GLU 104 16.142 -11.204 7.254 863 HB3 GLU 104 1HB GLU 104 16.200 -12.370 8.567 864 HG2 GLU 104 2HG GLU 104 14.569 -13.760 7.458 865 HG3 GLU 104 1HG GLU 104 14.386 -12.565 6.173 866 H ASN 105 H ASN 105 15.152 -8.743 8.271 867 HA ASN 105 HA ASN 105 16.730 -8.582 10.661 868 HB2 ASN 105 2HB ASN 105 15.881 -6.422 8.724 869 HB3 ASN 105 1HB ASN 105 17.031 -6.197 10.033 870 HD21 ASN 105 1HD2 ASN 105 18.131 -8.927 9.561 871 HD22 ASN 105 2HD2 ASN 105 19.141 -8.749 8.169 872 H GLU 106 H GLU 106 13.794 -6.867 9.576 873 HA GLU 106 HA GLU 106 13.479 -5.892 12.336 874 HB2 GLU 106 2HB GLU 106 12.322 -4.816 9.764 875 HB3 GLU 106 1HB GLU 106 12.134 -4.094 11.355 876 HG2 GLU 106 2HG GLU 106 14.779 -4.472 9.976 877 HG3 GLU 106 1HG GLU 106 13.824 -2.992 9.915 878 H GLY 107 H GLY 107 11.734 -7.432 9.678 879 HA2 GLY 107 2HA GLY 107 10.144 -9.174 10.477 880 HA3 GLY 107 1HA GLY 107 9.540 -7.953 11.584 881 H PHE 108 H PHE 108 7.539 -8.763 10.455 882 HA PHE 108 HA PHE 108 7.045 -8.222 7.734 883 HB2 PHE 108 2HB PHE 108 5.756 -9.841 9.057 884 HB3 PHE 108 1HB PHE 108 5.098 -8.534 10.030 885 HD1 PHE 108 HD1 PHE 108 5.151 -9.992 6.637 886 HD2 PHE 108 HD2 PHE 108 3.209 -7.320 9.321 887 HE1 PHE 108 HE1 PHE 108 3.269 -9.785 5.065 888 HE2 PHE 108 HE2 PHE 108 1.326 -7.103 7.753 889 HZ PHE 108 HZ PHE 108 1.355 -8.337 5.621 890 H ASP 109 H ASP 109 6.322 -6.342 10.662 891 HA ASP 109 HA ASP 109 4.644 -4.466 9.372 892 HB2 ASP 109 2HB ASP 109 4.574 -3.308 11.395 893 HB3 ASP 109 1HB ASP 109 4.903 -4.960 11.901 894 H ALA 110 H ALA 110 8.099 -4.620 9.818 895 HA ALA 110 HA ALA 110 8.542 -1.885 9.049 896 HB1 ALA 110 3HB ALA 110 10.055 -3.035 10.594 897 HB2 ALA 110 1HB ALA 110 10.901 -2.426 9.170 898 HB3 ALA 110 2HB ALA 110 10.519 -4.143 9.302 899 H ASP 111 H ASP 111 8.596 -5.030 7.456 900 HA ASP 111 HA ASP 111 9.756 -4.169 5.033 901 HB2 ASP 111 2HB ASP 111 9.384 -6.572 5.693 902 HB3 ASP 111 1HB ASP 111 7.673 -6.342 5.336 903 H ILE 112 H ILE 112 6.386 -4.498 6.047 904 HA ILE 112 HA ILE 112 5.123 -3.353 3.845 905 HB ILE 112 HB ILE 112 4.395 -3.291 6.774 906 HG12 ILE 112 2HG1 ILE 112 4.450 -5.515 5.726 907 HG13 ILE 112 1HG1 ILE 112 2.813 -5.051 6.178 908 HG21 ILE 112 1HG2 ILE 112 3.320 -1.413 5.676 909 HG22 ILE 112 2HG2 ILE 112 2.137 -2.650 6.099 910 HG23 ILE 112 3HG2 ILE 112 2.683 -2.488 4.431 911 HD11 ILE 112 3HD1 ILE 112 3.982 -4.922 3.408 912 HD12 ILE 112 1HD1 ILE 112 2.340 -4.465 3.859 913 HD13 ILE 112 2HD1 ILE 112 2.861 -6.144 4.010 914 H ASP 113 H ASP 113 6.709 -1.883 6.604 915 HA ASP 113 HA ASP 113 5.738 0.737 6.278 916 HB2 ASP 113 2HB ASP 113 6.799 -0.149 8.342 917 HB3 ASP 113 1HB ASP 113 8.356 -0.120 7.523 918 H SER 114 H SER 114 8.623 -0.881 5.000 919 HA SER 114 HA SER 114 9.840 1.422 3.920 920 HB2 SER 114 2HB SER 114 11.211 -0.104 2.612 921 HB3 SER 114 1HB SER 114 11.014 -0.743 4.243 922 HG SER 114 HG SER 114 9.333 -2.105 3.375 923 H TYR 115 H TYR 115 7.301 -0.642 2.762 924 HA TYR 115 HA TYR 115 7.276 0.109 0.056 925 HB2 TYR 115 2HB TYR 115 6.037 -1.796 0.576 926 HB3 TYR 115 1HB TYR 115 5.255 -1.038 1.956 927 HD1 TYR 115 HD1 TYR 115 5.406 -0.846 -1.771 928 HD2 TYR 115 HD2 TYR 115 3.090 -0.279 1.749 929 HE1 TYR 115 HE1 TYR 115 3.426 -0.379 -3.153 930 HE2 TYR 115 HE2 TYR 115 1.107 0.189 0.378 931 HH TYR 115 HH TYR 115 0.621 0.998 -1.936 932 H ILE 116 H ILE 116 5.933 1.607 2.929 933 HA ILE 116 HA ILE 116 4.602 3.664 1.343 934 HB ILE 116 HB ILE 116 4.695 3.264 4.343 935 HG12 ILE 116 2HG1 ILE 116 3.469 1.500 3.108 936 HG13 ILE 116 1HG1 ILE 116 2.415 2.463 4.140 937 HG21 ILE 116 1HG2 ILE 116 4.353 5.595 3.841 938 HG22 ILE 116 2HG2 ILE 116 2.839 4.891 4.406 939 HG23 ILE 116 3HG2 ILE 116 3.080 5.196 2.687 940 HD11 ILE 116 3HD1 ILE 116 2.719 2.733 1.156 941 HD12 ILE 116 1HD1 ILE 116 1.690 3.740 2.176 942 HD13 ILE 116 2HD1 ILE 116 1.357 2.016 2.016 943 H ASP 117 H ASP 117 7.513 3.123 3.089 944 HA ASP 117 HA ASP 117 8.005 5.843 3.824 945 HB2 ASP 117 2HB ASP 117 8.909 3.939 5.108 946 HB3 ASP 117 1HB ASP 117 9.915 3.500 3.733 947 H SER 118 H SER 118 8.478 4.041 0.963 948 HA SER 118 HA SER 118 10.702 5.581 -0.008 949 HB2 SER 118 2HB SER 118 10.061 4.345 -2.190 950 HB3 SER 118 1HB SER 118 10.660 3.393 -0.833 951 HG SER 118 HG SER 118 8.714 2.553 -0.531 952 HA PRO 119 HA PRO 119 8.017 9.019 -0.869 953 HB2 PRO 119 2HB PRO 119 9.930 10.598 -2.039 954 HB3 PRO 119 1HB PRO 119 9.724 10.415 -0.294 955 HG2 PRO 119 2HG PRO 119 11.662 9.064 -2.127 956 HG3 PRO 119 1HG PRO 119 11.933 9.733 -0.506 957 HD2 PRO 119 2HD PRO 119 11.622 7.093 -0.914 958 HD3 PRO 119 1HD PRO 119 10.999 7.892 0.545 959 H GLU 120 H GLU 120 10.354 8.173 -3.453 960 HA GLU 120 HA GLU 120 8.824 9.414 -5.482 961 HB2 GLU 120 2HB GLU 120 11.307 8.892 -5.537 962 HB3 GLU 120 1HB GLU 120 10.865 7.231 -5.904 963 HG2 GLU 120 2HG GLU 120 11.437 8.477 -7.916 964 HG3 GLU 120 1HG GLU 120 9.753 7.952 -7.936 965 H TYR 121 H TYR 121 8.958 6.132 -4.245 966 HA TYR 121 HA TYR 121 7.341 4.963 -6.257 967 HB2 TYR 121 2HB TYR 121 7.891 4.095 -3.410 968 HB3 TYR 121 1HB TYR 121 7.041 3.113 -4.602 969 HD1 TYR 121 HD1 TYR 121 10.293 4.687 -3.797 970 HD2 TYR 121 HD2 TYR 121 8.235 1.885 -6.251 971 HE1 TYR 121 HE1 TYR 121 12.446 3.842 -4.621 972 HE2 TYR 121 HE2 TYR 121 10.386 1.029 -7.083 973 HH TYR 121 HH TYR 121 12.754 1.946 -7.338 974 H THR 122 H THR 122 6.667 6.564 -3.199 975 HA THR 122 HA THR 122 3.873 6.162 -3.182 976 HB THR 122 HB THR 122 5.430 8.519 -2.080 977 HG1 THR 122 HG1 THR 122 6.084 6.435 -1.230 978 HG21 THR 122 3HG2 THR 122 3.012 8.934 -2.253 979 HG22 THR 122 1HG2 THR 122 3.531 8.810 -0.572 980 HG23 THR 122 2HG2 THR 122 2.698 7.458 -1.338 981 H ASN 123 H ASN 123 5.925 8.715 -4.555 982 HA ASN 123 HA ASN 123 3.916 10.419 -5.514 983 HB2 ASN 123 2HB ASN 123 6.698 9.900 -6.576 984 HB3 ASN 123 1HB ASN 123 5.653 11.188 -7.167 985 HD21 ASN 123 1HD2 ASN 123 8.244 11.378 -5.918 986 HD22 ASN 123 2HD2 ASN 123 8.032 12.360 -4.500 987 H SER 124 H SER 124 5.090 7.405 -6.721 988 HA SER 124 HA SER 124 4.281 7.607 -9.403 989 HB2 SER 124 2HB SER 124 4.431 5.130 -7.668 990 HB3 SER 124 1HB SER 124 4.419 5.162 -9.433 991 HG SER 124 HG SER 124 6.427 6.092 -7.666 992 H PHE 125 H PHE 125 2.423 7.255 -6.518 993 HA PHE 125 HA PHE 125 0.022 6.826 -8.182 994 HB2 PHE 125 2HB PHE 125 0.473 5.958 -5.318 995 HB3 PHE 125 1HB PHE 125 -1.059 5.836 -6.173 996 HD1 PHE 125 HD2 PHE 125 -1.234 4.319 -8.151 997 HD2 PHE 125 HD1 PHE 125 2.151 4.332 -5.572 998 HE1 PHE 125 HE2 PHE 125 -0.581 2.104 -8.998 999 HE2 PHE 125 HE1 PHE 125 2.809 2.118 -6.417 1000 HZ PHE 125 HZ PHE 125 1.441 0.999 -8.131 1001 H GLY 126 H GLY 126 1.389 8.467 -5.363 1002 HA2 GLY 126 2HA GLY 126 0.890 10.772 -4.912 1003 HA3 GLY 126 1HA GLY 126 -0.688 10.535 -5.653 1004 H ASP 127 H ASP 127 -1.330 11.620 -3.578 1005 HA ASP 127 HA ASP 127 -1.362 9.754 -1.315 1006 HB2 ASP 127 2HB ASP 127 -1.527 12.722 -1.533 1007 HB3 ASP 127 1HB ASP 127 -2.344 11.943 -0.184 1008 H TRP 128 H TRP 128 -3.367 10.839 -3.811 1009 HA TRP 128 HA TRP 128 -5.733 10.039 -2.243 1010 HB2 TRP 128 2HB TRP 128 -5.536 12.148 -4.390 1011 HB3 TRP 128 1HB TRP 128 -7.067 11.503 -3.809 1012 HD1 TRP 128 HD1 TRP 128 -4.939 14.359 -3.276 1013 HE1 TRP 128 HE1 TRP 128 -5.356 15.457 -0.986 1014 HE3 TRP 128 HE3 TRP 128 -7.528 10.571 -1.021 1015 HZ2 TRP 128 HZ2 TRP 128 -6.606 14.796 1.458 1016 HZ3 TRP 128 HZ3 TRP 128 -8.296 10.882 1.295 1017 HH2 TRP 128 HH2 TRP 128 -7.843 12.950 2.508 1018 H VAL 129 H VAL 129 -3.757 8.787 -4.362 1019 HA VAL 129 HA VAL 129 -5.916 7.495 -5.895 1020 HB VAL 129 HB VAL 129 -2.989 7.725 -6.628 1021 HG11 VAL 129 1HG1 VAL 129 -5.279 6.446 -8.117 1022 HG12 VAL 129 2HG1 VAL 129 -3.906 5.610 -7.393 1023 HG13 VAL 129 3HG1 VAL 129 -3.656 6.693 -8.762 1024 HG21 VAL 129 3HG2 VAL 129 -3.760 9.135 -8.464 1025 HG22 VAL 129 1HG2 VAL 129 -4.220 9.824 -6.907 1026 HG23 VAL 129 2HG2 VAL 129 -5.421 8.987 -7.890 1027 H VAL 130 H VAL 130 -6.145 5.323 -5.735 1028 HA VAL 130 HA VAL 130 -4.744 4.045 -3.547 1029 HB VAL 130 HB VAL 130 -6.944 2.986 -5.336 1030 HG11 VAL 130 1HG1 VAL 130 -7.245 1.251 -3.644 1031 HG12 VAL 130 2HG1 VAL 130 -5.880 1.891 -2.731 1032 HG13 VAL 130 3HG1 VAL 130 -5.619 1.186 -4.326 1033 HG21 VAL 130 3HG2 VAL 130 -7.669 4.902 -4.032 1034 HG22 VAL 130 1HG2 VAL 130 -7.054 4.153 -2.559 1035 HG23 VAL 130 2HG2 VAL 130 -8.409 3.422 -3.420 1036 HA PRO 131 HA PRO 131 -1.588 2.106 -6.065 1037 HB2 PRO 131 2HB PRO 131 -1.842 0.129 -3.840 1038 HB3 PRO 131 1HB PRO 131 -0.391 0.866 -4.529 1039 HG2 PRO 131 2HG PRO 131 -1.332 1.698 -2.193 1040 HG3 PRO 131 1HG PRO 131 -0.700 2.862 -3.372 1041 HD2 PRO 131 2HD PRO 131 -3.523 2.238 -2.648 1042 HD3 PRO 131 1HD PRO 131 -2.787 3.791 -3.093 1043 H TYR 132 H TYR 132 -2.148 1.028 -7.828 1044 HA TYR 132 HA TYR 132 -3.952 -1.276 -7.608 1045 HB2 TYR 132 2HB TYR 132 -5.041 -0.545 -9.726 1046 HB3 TYR 132 1HB TYR 132 -5.294 0.592 -8.406 1047 HD1 TYR 132 HD2 TYR 132 -4.056 2.755 -8.393 1048 HD2 TYR 132 HD1 TYR 132 -3.870 0.101 -11.709 1049 HE1 TYR 132 HE2 TYR 132 -3.190 4.577 -9.794 1050 HE2 TYR 132 HE1 TYR 132 -3.003 1.915 -13.122 1051 HH TYR 132 HH TYR 132 -1.840 4.833 -11.861 1052 H TYR 133 H TYR 133 -3.747 -2.822 -9.355 1053 HA TYR 133 HA TYR 133 -1.086 -3.146 -10.294 1054 HB2 TYR 133 2HB TYR 133 -1.935 -5.079 -11.548 1055 HB3 TYR 133 1HB TYR 133 -2.494 -5.102 -9.884 1056 HD1 TYR 133 HD1 TYR 133 -3.524 -4.450 -13.375 1057 HD2 TYR 133 HD2 TYR 133 -4.806 -5.105 -9.373 1058 HE1 TYR 133 HE1 TYR 133 -5.827 -4.759 -14.172 1059 HE2 TYR 133 HE2 TYR 133 -7.116 -5.409 -10.156 1060 HH TYR 133 HH TYR 133 -8.519 -5.067 -11.947 1061 H ARG 134 H ARG 134 -0.320 -3.050 -12.441 1062 HA ARG 134 HA ARG 134 -0.666 -0.670 -13.684 1063 HB2 ARG 134 2HB ARG 134 0.490 -1.530 -15.588 1064 HB3 ARG 134 1HB ARG 134 1.125 -2.362 -14.176 1065 HG2 ARG 134 2HG ARG 134 -0.153 -4.328 -14.694 1066 HG3 ARG 134 1HG ARG 134 -0.973 -3.494 -16.015 1067 HD2 ARG 134 2HD ARG 134 0.661 -4.749 -17.095 1068 HD3 ARG 134 1HD ARG 134 1.383 -3.147 -16.980 1069 HE ARG 134 HE ARG 134 2.108 -4.771 -14.760 1070 HH11 ARG 134 1HH1 ARG 134 2.806 -4.151 -18.123 1071 HH12 ARG 134 2HH1 ARG 134 4.393 -4.859 -18.075 1072 HH21 ARG 134 1HH2 ARG 134 4.193 -5.718 -14.666 1073 HH22 ARG 134 2HH2 ARG 134 5.181 -5.770 -16.102 1074 H GLY 135 H GLY 135 -2.064 0.301 -15.025 1075 HA2 GLY 135 2HA GLY 135 -4.546 -1.016 -15.673 1076 HA3 GLY 135 1HA GLY 135 -4.108 0.643 -16.067 1077 H LEU 136 H LEU 136 -2.959 -2.615 -16.880 1078 HA LEU 136 HA LEU 136 -2.240 -3.569 -18.790 1079 HB2 LEU 136 2HB LEU 136 -4.311 -1.702 -19.893 1080 HB3 LEU 136 1HB LEU 136 -3.316 -2.663 -20.968 1081 HG LEU 136 HG LEU 136 -4.149 -4.717 -19.807 1082 HD11 LEU 136 1HD1 LEU 136 -6.064 -2.793 -18.505 1083 HD12 LEU 136 2HD1 LEU 136 -4.802 -3.714 -17.688 1084 HD13 LEU 136 3HD1 LEU 136 -6.159 -4.552 -18.441 1085 HD21 LEU 136 3HD2 LEU 136 -6.200 -2.917 -21.082 1086 HD22 LEU 136 1HD2 LEU 136 -6.375 -4.658 -20.856 1087 HD23 LEU 136 2HD2 LEU 136 -5.110 -4.029 -21.911 1088 H GLU 137 H GLU 137 -2.683 -0.562 -20.518 1089 HA GLU 137 HA GLU 137 -0.145 0.556 -20.169 1090 HB2 GLU 137 2HB GLU 137 1.000 -0.122 -22.203 1091 HB3 GLU 137 1HB GLU 137 0.635 -1.545 -21.237 1092 HG2 GLU 137 2HG GLU 137 -1.203 -2.116 -22.661 1093 HG3 GLU 137 1HG GLU 137 -1.037 -0.604 -23.553 1094 H HIS 138 H HIS 138 0.366 2.131 -21.916 1095 HA HIS 138 HA HIS 138 -0.149 3.789 -23.375 1096 HB2 HIS 138 2HB HIS 138 -0.214 1.569 -24.708 1097 HB3 HIS 138 1HB HIS 138 -1.953 1.824 -24.754 1098 HD1 HIS 138 HD1 HIS 138 -2.148 2.277 -27.228 1099 HD2 HIS 138 HD2 HIS 138 0.648 4.717 -25.351 1100 HE1 HIS 138 HE1 HIS 138 -1.488 3.992 -28.938 1101 HE2 HIS 138 HE2 HIS 138 0.411 5.259 -27.870 1102 H HIS 139 H HIS 139 -1.410 4.729 -21.485 1103 HA HIS 139 HA HIS 139 -4.262 4.797 -21.701 1104 HB2 HIS 139 2HB HIS 139 -2.316 6.652 -20.315 1105 HB3 HIS 139 1HB HIS 139 -4.065 6.834 -20.230 1106 HD1 HIS 139 HD1 HIS 139 -4.667 3.728 -19.904 1107 HD2 HIS 139 HD2 HIS 139 -1.953 5.961 -17.676 1108 HE1 HIS 139 HE1 HIS 139 -4.382 2.487 -17.736 1109 HE2 HIS 139 HE2 HIS 139 -2.959 4.005 -16.312 1110 H HIS 140 H HIS 140 -1.611 6.540 -23.099 1111 HA HIS 140 HA HIS 140 -3.131 8.590 -24.360 1112 HB2 HIS 140 2HB HIS 140 -0.677 8.689 -24.083 1113 HB3 HIS 140 1HB HIS 140 -0.502 7.311 -25.161 1114 HD1 HIS 140 HD1 HIS 140 -1.519 10.948 -25.192 1115 HD2 HIS 140 HD2 HIS 140 -0.437 7.919 -27.826 1116 HE1 HIS 140 HE1 HIS 140 -1.210 12.067 -27.425 1117 HE2 HIS 140 HE2 HIS 140 -0.331 10.249 -28.942 1118 H HIS 141 H HIS 141 -4.242 8.539 -26.296 1119 HA HIS 141 HA HIS 141 -5.191 5.918 -26.940 1120 HB2 HIS 141 2HB HIS 141 -5.939 8.625 -28.042 1121 HB3 HIS 141 1HB HIS 141 -6.748 7.123 -28.483 1122 HD1 HIS 141 HD1 HIS 141 -6.768 5.928 -25.540 1123 HD2 HIS 141 HD2 HIS 141 -8.045 9.732 -26.645 1124 HE1 HIS 141 HE1 HIS 141 -8.406 6.641 -23.768 1125 HE2 HIS 141 HE2 HIS 141 -8.995 9.023 -24.344 1126 H HIS 142 H HIS 142 -4.181 8.457 -29.271 1127 HA HIS 142 HA HIS 142 -2.941 6.287 -30.838 1128 HB2 HIS 142 2HB HIS 142 -4.711 8.479 -31.945 1129 HB3 HIS 142 1HB HIS 142 -3.820 7.310 -32.913 1130 HD1 HIS 142 HD1 HIS 142 -4.845 4.978 -33.177 1131 HD2 HIS 142 HD2 HIS 142 -6.963 7.437 -30.581 1132 HE1 HIS 142 HE1 HIS 142 -6.989 3.768 -32.695 1133 HE2 HIS 142 HE2 HIS 142 -8.205 5.213 -31.024 1134 H HIS 143 H HIS 143 -1.128 6.798 -31.989 1135 HA HIS 143 HA HIS 143 0.760 7.897 -32.601 1136 HB2 HIS 143 2HB HIS 143 -1.052 10.298 -32.361 1137 HB3 HIS 143 1HB HIS 143 0.630 10.429 -32.857 1138 HD1 HIS 143 HD1 HIS 143 1.188 9.879 -35.249 1139 HD2 HIS 143 HD2 HIS 143 -2.736 8.938 -34.229 1140 HE1 HIS 143 HE1 HIS 143 0.029 9.336 -37.418 1141 HE2 HIS 143 HE2 HIS 143 -2.381 8.964 -36.793 Start of MODEL 15 1 H1 MET 1 1H MET 1 -7.097 3.364 -17.189 2 H2 MET 1 2H MET 1 -7.484 2.453 -15.812 3 H3 MET 1 3H MET 1 -5.874 2.867 -16.131 4 HA MET 1 HA MET 1 -6.282 5.156 -15.750 5 HB2 MET 1 2HB MET 1 -9.148 4.257 -15.399 6 HB3 MET 1 1HB MET 1 -8.558 5.829 -14.883 7 HG2 MET 1 2HG MET 1 -8.588 4.776 -17.700 8 HG3 MET 1 1HG MET 1 -9.676 5.984 -17.022 9 HE1 MET 1 3HE MET 1 -9.210 7.727 -18.887 10 HE2 MET 1 1HE MET 1 -8.178 6.556 -19.712 11 HE3 MET 1 2HE MET 1 -7.601 8.200 -19.431 12 HA PRO 2 HA PRO 2 -5.719 4.057 -11.464 13 HB2 PRO 2 2HB PRO 2 -5.190 6.760 -10.746 14 HB3 PRO 2 1HB PRO 2 -4.012 5.499 -11.109 15 HG2 PRO 2 2HG PRO 2 -4.460 7.772 -12.640 16 HG3 PRO 2 1HG PRO 2 -3.646 6.301 -13.199 17 HD2 PRO 2 2HD PRO 2 -6.463 7.193 -13.633 18 HD3 PRO 2 1HD PRO 2 -5.371 6.322 -14.731 19 H VAL 3 H VAL 3 -6.493 4.773 -9.285 20 HA VAL 3 HA VAL 3 -9.051 6.225 -9.432 21 HB VAL 3 HB VAL 3 -8.478 3.850 -7.640 22 HG11 VAL 3 1HG1 VAL 3 -9.972 5.458 -6.596 23 HG12 VAL 3 2HG1 VAL 3 -10.857 4.002 -7.051 24 HG13 VAL 3 3HG1 VAL 3 -10.998 5.462 -8.030 25 HG21 VAL 3 3HG2 VAL 3 -10.289 4.043 -10.045 26 HG22 VAL 3 1HG2 VAL 3 -10.152 2.655 -8.964 27 HG23 VAL 3 2HG2 VAL 3 -8.776 3.143 -9.955 28 H GLU 4 H GLU 4 -8.550 8.154 -8.516 29 HA GLU 4 HA GLU 4 -7.114 8.049 -5.947 30 HB2 GLU 4 2HB GLU 4 -6.558 10.407 -6.268 31 HB3 GLU 4 1HB GLU 4 -5.976 9.427 -7.600 32 HG2 GLU 4 2HG GLU 4 -8.623 10.702 -7.907 33 HG3 GLU 4 1HG GLU 4 -7.201 11.741 -7.960 34 H LEU 5 H LEU 5 -7.826 9.358 -4.225 35 HA LEU 5 HA LEU 5 -10.692 9.880 -4.251 36 HB2 LEU 5 2HB LEU 5 -9.650 8.687 -2.333 37 HB3 LEU 5 1HB LEU 5 -8.710 10.125 -1.981 38 HG LEU 5 HG LEU 5 -10.800 11.368 -1.544 39 HD11 LEU 5 1HD1 LEU 5 -12.295 10.109 -2.991 40 HD12 LEU 5 2HD1 LEU 5 -12.906 10.130 -1.336 41 HD13 LEU 5 3HD1 LEU 5 -12.113 8.685 -1.966 42 HD21 LEU 5 3HD2 LEU 5 -11.345 10.271 0.569 43 HD22 LEU 5 1HD2 LEU 5 -9.605 10.289 0.292 44 HD23 LEU 5 2HD2 LEU 5 -10.521 8.808 0.029 45 H ARG 6 H ARG 6 -11.523 11.867 -4.432 46 HA ARG 6 HA ARG 6 -9.687 14.022 -5.064 47 HB2 ARG 6 2HB ARG 6 -12.691 14.225 -5.085 48 HB3 ARG 6 1HB ARG 6 -11.525 15.113 -6.057 49 HG2 ARG 6 2HG ARG 6 -10.965 12.989 -7.218 50 HG3 ARG 6 1HG ARG 6 -12.276 12.212 -6.328 51 HD2 ARG 6 2HD ARG 6 -13.305 12.769 -8.319 52 HD3 ARG 6 1HD ARG 6 -13.720 14.143 -7.294 53 HE ARG 6 HE ARG 6 -11.302 14.565 -8.770 54 HH11 ARG 6 1HH1 ARG 6 -14.809 14.742 -8.967 55 HH12 ARG 6 2HH1 ARG 6 -14.788 15.853 -10.305 56 HH21 ARG 6 1HH2 ARG 6 -11.287 16.018 -10.515 57 HH22 ARG 6 2HH2 ARG 6 -12.790 16.579 -11.194 58 H ALA 7 H ALA 7 -9.780 16.104 -4.080 59 HA ALA 7 HA ALA 7 -9.952 16.121 -1.287 60 HB1 ALA 7 3HB ALA 7 -8.621 17.731 -2.565 61 HB2 ALA 7 1HB ALA 7 -9.713 18.542 -1.446 62 HB3 ALA 7 2HB ALA 7 -10.102 18.477 -3.165 63 H ASN 8 H ASN 8 -12.247 17.291 -3.730 64 HA ASN 8 HA ASN 8 -14.311 17.467 -1.651 65 HB2 ASN 8 2HB ASN 8 -14.300 18.338 -4.549 66 HB3 ASN 8 1HB ASN 8 -15.739 18.376 -3.537 67 HD21 ASN 8 1HD2 ASN 8 -15.910 19.911 -1.906 68 HD22 ASN 8 2HD2 ASN 8 -14.839 21.266 -1.797 69 H TRP 9 H TRP 9 -14.515 15.276 -1.248 70 HA TRP 9 HA TRP 9 -15.372 13.586 -3.484 71 HB2 TRP 9 2HB TRP 9 -14.859 11.687 -1.926 72 HB3 TRP 9 1HB TRP 9 -13.466 12.677 -2.346 73 HD1 TRP 9 HD1 TRP 9 -12.233 13.938 -0.401 74 HE1 TRP 9 HE1 TRP 9 -12.445 13.879 2.162 75 HE3 TRP 9 HE3 TRP 9 -16.659 11.401 -0.005 76 HZ2 TRP 9 HZ2 TRP 9 -14.246 12.889 4.093 77 HZ3 TRP 9 HZ3 TRP 9 -17.556 10.941 2.238 78 HH2 TRP 9 HH2 TRP 9 -16.374 11.670 4.242 79 H SER 10 H SER 10 -17.010 11.946 -3.009 80 HA SER 10 HA SER 10 -18.926 12.779 -0.935 81 HB2 SER 10 2HB SER 10 -19.723 13.377 -3.239 82 HB3 SER 10 1HB SER 10 -19.649 11.669 -3.664 83 HG SER 10 HG SER 10 -21.713 11.957 -3.047 84 H GLU 11 H GLU 11 -20.595 10.754 -0.783 85 HA GLU 11 HA GLU 11 -18.998 8.830 0.537 86 HB2 GLU 11 2HB GLU 11 -21.266 9.490 1.259 87 HB3 GLU 11 1HB GLU 11 -21.933 8.677 -0.151 88 HG2 GLU 11 2HG GLU 11 -21.021 6.551 0.665 89 HG3 GLU 11 1HG GLU 11 -20.409 7.379 2.097 90 H GLU 12 H GLU 12 -20.718 8.767 -2.557 91 HA GLU 12 HA GLU 12 -20.453 5.942 -2.874 92 HB2 GLU 12 2HB GLU 12 -21.232 6.409 -5.221 93 HB3 GLU 12 1HB GLU 12 -22.309 6.939 -3.937 94 HG2 GLU 12 2HG GLU 12 -21.340 9.227 -4.189 95 HG3 GLU 12 1HG GLU 12 -20.478 8.634 -5.609 96 H ASP 13 H ASP 13 -18.606 8.726 -4.099 97 HA ASP 13 HA ASP 13 -16.905 7.058 -5.688 98 HB2 ASP 13 2HB ASP 13 -15.399 9.186 -5.620 99 HB3 ASP 13 1HB ASP 13 -16.916 9.218 -6.510 100 H LEU 14 H LEU 14 -16.764 8.374 -2.417 101 HA LEU 14 HA LEU 14 -14.224 7.367 -1.730 102 HB2 LEU 14 2HB LEU 14 -15.456 8.910 -0.287 103 HB3 LEU 14 1HB LEU 14 -16.700 7.705 -0.025 104 HG LEU 14 HG LEU 14 -15.019 6.274 1.123 105 HD11 LEU 14 1HD1 LEU 14 -13.255 8.698 0.825 106 HD12 LEU 14 2HD1 LEU 14 -13.004 7.121 0.077 107 HD13 LEU 14 3HD1 LEU 14 -12.903 7.294 1.830 108 HD21 LEU 14 3HD2 LEU 14 -15.386 9.046 2.248 109 HD22 LEU 14 1HD2 LEU 14 -14.920 7.617 3.170 110 HD23 LEU 14 2HD2 LEU 14 -16.509 7.694 2.409 111 H GLU 15 H GLU 15 -17.451 5.940 -1.570 112 HA GLU 15 HA GLU 15 -16.857 3.427 -0.564 113 HB2 GLU 15 2HB GLU 15 -19.024 4.722 -1.967 114 HB3 GLU 15 1HB GLU 15 -18.841 3.064 -2.520 115 HG2 GLU 15 2HG GLU 15 -18.900 3.642 0.404 116 HG3 GLU 15 1HG GLU 15 -20.404 3.633 -0.519 117 H THR 16 H THR 16 -16.600 4.647 -3.863 118 HA THR 16 HA THR 16 -16.072 2.156 -5.097 119 HB THR 16 HB THR 16 -15.156 4.872 -6.068 120 HG1 THR 16 HG1 THR 16 -17.483 4.685 -5.586 121 HG21 THR 16 3HG2 THR 16 -15.807 2.318 -7.547 122 HG22 THR 16 1HG2 THR 16 -14.187 2.952 -7.253 123 HG23 THR 16 2HG2 THR 16 -15.309 3.843 -8.282 124 H VAL 17 H VAL 17 -13.969 4.699 -3.806 125 HA VAL 17 HA VAL 17 -11.492 3.577 -4.477 126 HB VAL 17 HB VAL 17 -12.231 5.279 -2.084 127 HG11 VAL 17 1HG1 VAL 17 -9.842 5.858 -1.983 128 HG12 VAL 17 2HG1 VAL 17 -9.510 4.664 -3.239 129 HG13 VAL 17 3HG1 VAL 17 -10.124 4.144 -1.669 130 HG21 VAL 17 3HG2 VAL 17 -12.718 6.345 -4.221 131 HG22 VAL 17 1HG2 VAL 17 -11.068 6.033 -4.762 132 HG23 VAL 17 2HG2 VAL 17 -11.362 7.137 -3.418 133 H ILE 18 H ILE 18 -13.376 3.298 -1.472 134 HA ILE 18 HA ILE 18 -11.649 1.563 -0.118 135 HB ILE 18 HB ILE 18 -14.657 1.794 0.131 136 HG12 ILE 18 2HG1 ILE 18 -12.422 3.148 1.662 137 HG13 ILE 18 1HG1 ILE 18 -13.458 3.923 0.469 138 HG21 ILE 18 1HG2 ILE 18 -12.627 0.638 2.040 139 HG22 ILE 18 2HG2 ILE 18 -13.847 -0.263 1.140 140 HG23 ILE 18 3HG2 ILE 18 -14.339 0.882 2.388 141 HD11 ILE 18 3HD1 ILE 18 -14.133 4.470 2.741 142 HD12 ILE 18 1HD1 ILE 18 -14.367 2.757 3.092 143 HD13 ILE 18 2HD1 ILE 18 -15.392 3.564 1.902 144 H ARG 19 H ARG 19 -14.393 0.879 -2.251 145 HA ARG 19 HA ARG 19 -14.391 -1.913 -1.977 146 HB2 ARG 19 2HB ARG 19 -16.270 -0.762 -2.950 147 HB3 ARG 19 1HB ARG 19 -15.275 -0.153 -4.264 148 HG2 ARG 19 2HG ARG 19 -15.127 -2.264 -5.276 149 HG3 ARG 19 1HG ARG 19 -15.705 -3.090 -3.828 150 HD2 ARG 19 2HD ARG 19 -17.340 -1.174 -5.485 151 HD3 ARG 19 1HD ARG 19 -17.418 -2.931 -5.613 152 HE ARG 19 HE ARG 19 -18.322 -3.006 -3.397 153 HH11 ARG 19 1HH1 ARG 19 -18.171 0.178 -4.833 154 HH12 ARG 19 2HH1 ARG 19 -19.303 0.872 -3.717 155 HH21 ARG 19 1HH2 ARG 19 -19.793 -2.090 -1.919 156 HH22 ARG 19 2HH2 ARG 19 -20.175 -0.394 -2.024 157 H ALA 20 H ALA 20 -12.584 0.213 -4.151 158 HA ALA 20 HA ALA 20 -11.559 -1.819 -5.826 159 HB1 ALA 20 3HB ALA 20 -10.387 0.894 -5.224 160 HB2 ALA 20 1HB ALA 20 -11.584 0.545 -6.469 161 HB3 ALA 20 2HB ALA 20 -9.964 -0.143 -6.585 162 H VAL 21 H VAL 21 -10.572 -0.565 -2.730 163 HA VAL 21 HA VAL 21 -7.966 -1.791 -2.804 164 HB VAL 21 HB VAL 21 -9.466 -0.637 -0.442 165 HG11 VAL 21 1HG1 VAL 21 -7.672 -2.150 0.232 166 HG12 VAL 21 2HG1 VAL 21 -7.273 -0.475 0.618 167 HG13 VAL 21 3HG1 VAL 21 -6.534 -1.259 -0.780 168 HG21 VAL 21 3HG2 VAL 21 -9.135 1.034 -2.173 169 HG22 VAL 21 1HG2 VAL 21 -7.421 0.625 -2.265 170 HG23 VAL 21 2HG2 VAL 21 -8.076 1.355 -0.799 171 H TYR 22 H TYR 22 -11.148 -2.638 -1.557 172 HA TYR 22 HA TYR 22 -10.000 -4.984 -0.229 173 HB2 TYR 22 2HB TYR 22 -12.712 -3.689 0.044 174 HB3 TYR 22 1HB TYR 22 -12.282 -5.216 0.805 175 HD1 TYR 22 HD1 TYR 22 -10.492 -5.257 2.549 176 HD2 TYR 22 HD2 TYR 22 -12.021 -1.619 0.965 177 HE1 TYR 22 HE1 TYR 22 -9.577 -4.037 4.478 178 HE2 TYR 22 HE2 TYR 22 -11.111 -0.393 2.887 179 HH TYR 22 HH TYR 22 -8.876 -1.710 5.025 180 H ARG 23 H ARG 23 -13.299 -4.785 -1.474 181 HA ARG 23 HA ARG 23 -12.738 -7.194 -3.074 182 HB2 ARG 23 2HB ARG 23 -15.010 -6.825 -1.112 183 HB3 ARG 23 1HB ARG 23 -14.861 -8.174 -2.224 184 HG2 ARG 23 2HG ARG 23 -12.806 -7.543 -0.122 185 HG3 ARG 23 1HG ARG 23 -14.181 -8.612 0.156 186 HD2 ARG 23 2HD ARG 23 -12.389 -10.031 -0.401 187 HD3 ARG 23 1HD ARG 23 -13.374 -9.930 -1.857 188 HE ARG 23 HE ARG 23 -11.382 -7.961 -1.999 189 HH11 ARG 23 1HH1 ARG 23 -11.697 -11.444 -2.064 190 HH12 ARG 23 2HH1 ARG 23 -10.256 -11.688 -3.006 191 HH21 ARG 23 1HH2 ARG 23 -9.489 -8.268 -3.227 192 HH22 ARG 23 2HH2 ARG 23 -9.001 -9.877 -3.663 193 H GLN 24 H GLN 24 -13.627 -7.169 -5.036 194 HA GLN 24 HA GLN 24 -15.515 -5.064 -5.731 195 HB2 GLN 24 2HB GLN 24 -14.102 -7.129 -7.433 196 HB3 GLN 24 1HB GLN 24 -15.202 -5.912 -8.063 197 HG2 GLN 24 2HG GLN 24 -12.643 -5.322 -6.593 198 HG3 GLN 24 1HG GLN 24 -12.830 -5.325 -8.344 199 HE21 GLN 24 1HE2 GLN 24 -15.543 -4.158 -8.178 200 HE22 GLN 24 2HE2 GLN 24 -15.281 -2.482 -7.815 201 H VAL 25 H VAL 25 -16.972 -6.323 -4.155 202 HA VAL 25 HA VAL 25 -18.969 -7.364 -3.865 203 HB VAL 25 HB VAL 25 -18.857 -7.955 -6.829 204 HG11 VAL 25 1HG1 VAL 25 -21.264 -8.373 -6.639 205 HG12 VAL 25 2HG1 VAL 25 -21.165 -8.151 -4.892 206 HG13 VAL 25 3HG1 VAL 25 -20.332 -9.505 -5.659 207 HG21 VAL 25 3HG2 VAL 25 -18.894 -5.561 -6.332 208 HG22 VAL 25 1HG2 VAL 25 -20.316 -5.789 -5.314 209 HG23 VAL 25 2HG2 VAL 25 -20.418 -6.087 -7.049 210 H LEU 26 H LEU 26 -16.997 -9.257 -6.152 211 HA LEU 26 HA LEU 26 -17.841 -11.767 -5.113 212 HB2 LEU 26 2HB LEU 26 -16.979 -11.431 -7.413 213 HB3 LEU 26 1HB LEU 26 -15.389 -11.116 -6.748 214 HG LEU 26 HG LEU 26 -15.376 -13.425 -5.806 215 HD11 LEU 26 1HD1 LEU 26 -17.008 -15.038 -6.620 216 HD12 LEU 26 2HD1 LEU 26 -17.879 -13.753 -7.455 217 HD13 LEU 26 3HD1 LEU 26 -17.794 -13.760 -5.693 218 HD21 LEU 26 3HD2 LEU 26 -14.963 -14.542 -7.932 219 HD22 LEU 26 1HD2 LEU 26 -14.278 -12.917 -7.924 220 HD23 LEU 26 2HD2 LEU 26 -15.781 -13.236 -8.787 221 H GLY 27 H GLY 27 -17.010 -13.002 -3.554 222 HA2 GLY 27 2HA GLY 27 -14.452 -13.100 -2.541 223 HA3 GLY 27 1HA GLY 27 -15.262 -11.833 -1.625 224 H ASN 28 H ASN 28 -15.187 -15.247 -2.361 225 HA ASN 28 HA ASN 28 -17.371 -15.731 -0.464 226 HB2 ASN 28 2HB ASN 28 -16.139 -17.453 -2.612 227 HB3 ASN 28 1HB ASN 28 -17.286 -18.077 -1.430 228 HD21 ASN 28 1HD2 ASN 28 -19.424 -17.405 -1.497 229 HD22 ASN 28 2HD2 ASN 28 -20.100 -16.650 -2.906 230 H ASP 29 H ASP 29 -13.996 -15.887 -0.697 231 HA ASP 29 HA ASP 29 -13.914 -17.466 1.779 232 HB2 ASP 29 2HB ASP 29 -13.173 -18.870 -0.125 233 HB3 ASP 29 1HB ASP 29 -11.921 -17.687 -0.491 234 H TYR 30 H TYR 30 -11.883 -17.125 3.004 235 HA TYR 30 HA TYR 30 -10.408 -15.818 4.106 236 HB2 TYR 30 2HB TYR 30 -10.364 -14.242 1.531 237 HB3 TYR 30 1HB TYR 30 -9.350 -13.863 2.918 238 HD1 TYR 30 HD2 TYR 30 -7.939 -15.929 3.820 239 HD2 TYR 30 HD1 TYR 30 -9.489 -15.584 -0.128 240 HE1 TYR 30 HE2 TYR 30 -6.244 -17.524 3.022 241 HE2 TYR 30 HE1 TYR 30 -7.804 -17.181 -0.937 242 HH TYR 30 HH TYR 30 -5.910 -19.085 1.154 243 H VAL 31 H VAL 31 -13.441 -14.883 3.294 244 HA VAL 31 HA VAL 31 -13.312 -12.274 4.552 245 HB VAL 31 HB VAL 31 -14.770 -12.379 2.668 246 HG11 VAL 31 1HG1 VAL 31 -16.218 -14.636 4.042 247 HG12 VAL 31 2HG1 VAL 31 -15.205 -14.768 2.604 248 HG13 VAL 31 3HG1 VAL 31 -16.716 -13.860 2.538 249 HG21 VAL 31 3HG2 VAL 31 -16.920 -11.683 3.633 250 HG22 VAL 31 1HG2 VAL 31 -15.547 -10.960 4.472 251 HG23 VAL 31 2HG2 VAL 31 -16.406 -12.319 5.196 252 H MET 32 H MET 32 -12.975 -12.384 6.649 253 HA MET 32 HA MET 32 -14.906 -13.895 8.278 254 HB2 MET 32 2HB MET 32 -12.715 -15.019 8.367 255 HB3 MET 32 1HB MET 32 -11.957 -13.512 8.867 256 HG2 MET 32 2HG MET 32 -13.260 -13.530 10.926 257 HG3 MET 32 1HG MET 32 -14.044 -15.025 10.424 258 HE1 MET 32 3HE MET 32 -10.669 -13.336 11.510 259 HE2 MET 32 1HE MET 32 -10.266 -14.018 9.935 260 HE3 MET 32 2HE MET 32 -9.541 -14.686 11.398 261 H ALA 33 H ALA 33 -15.928 -12.708 9.771 262 HA ALA 33 HA ALA 33 -16.649 -10.924 10.966 263 HB1 ALA 33 3HB ALA 33 -15.085 -9.297 11.850 264 HB2 ALA 33 1HB ALA 33 -13.837 -9.856 10.737 265 HB3 ALA 33 2HB ALA 33 -14.422 -10.924 12.012 266 H SER 34 H SER 34 -18.060 -9.675 10.006 267 HA SER 34 HA SER 34 -17.631 -8.700 7.364 268 HB2 SER 34 2HB SER 34 -19.983 -7.683 7.844 269 HB3 SER 34 1HB SER 34 -19.806 -9.436 7.753 270 HG SER 34 HG SER 34 -20.952 -8.340 9.661 271 H GLU 35 H GLU 35 -15.719 -7.364 8.121 272 HA GLU 35 HA GLU 35 -16.593 -4.621 8.035 273 HB2 GLU 35 2HB GLU 35 -15.203 -3.881 9.932 274 HB3 GLU 35 1HB GLU 35 -16.520 -4.924 10.446 275 HG2 GLU 35 2HG GLU 35 -15.040 -6.767 10.751 276 HG3 GLU 35 1HG GLU 35 -13.706 -5.887 10.005 277 H ARG 36 H ARG 36 -15.238 -3.423 6.847 278 HA ARG 36 HA ARG 36 -12.676 -4.633 6.061 279 HB2 ARG 36 2HB ARG 36 -14.136 -2.294 4.810 280 HB3 ARG 36 1HB ARG 36 -12.726 -3.120 4.159 281 HG2 ARG 36 2HG ARG 36 -13.994 -5.107 3.754 282 HG3 ARG 36 1HG ARG 36 -15.397 -4.434 4.594 283 HD2 ARG 36 2HD ARG 36 -15.501 -2.642 2.899 284 HD3 ARG 36 1HD ARG 36 -14.164 -3.410 2.040 285 HE ARG 36 HE ARG 36 -15.808 -5.423 2.014 286 HH11 ARG 36 1HH1 ARG 36 -16.720 -2.039 1.785 287 HH12 ARG 36 2HH1 ARG 36 -18.093 -2.351 0.762 288 HH21 ARG 36 1HH2 ARG 36 -17.604 -5.833 0.693 289 HH22 ARG 36 2HH2 ARG 36 -18.593 -4.519 0.130 290 H LEU 37 H LEU 37 -11.803 -4.057 8.146 291 HA LEU 37 HA LEU 37 -10.878 -2.737 9.754 292 HB2 LEU 37 2HB LEU 37 -9.803 -1.511 7.223 293 HB3 LEU 37 1HB LEU 37 -9.270 -1.002 8.812 294 HG LEU 37 HG LEU 37 -8.755 -3.555 9.136 295 HD11 LEU 37 1HD1 LEU 37 -9.767 -4.268 7.021 296 HD12 LEU 37 2HD1 LEU 37 -8.047 -4.659 7.100 297 HD13 LEU 37 3HD1 LEU 37 -8.596 -3.283 6.139 298 HD21 LEU 37 3HD2 LEU 37 -7.044 -1.761 7.426 299 HD22 LEU 37 1HD2 LEU 37 -6.489 -3.157 8.347 300 HD23 LEU 37 2HD2 LEU 37 -7.124 -1.741 9.188 301 H VAL 38 H VAL 38 -12.959 -1.955 10.450 302 HA VAL 38 HA VAL 38 -14.173 0.350 9.413 303 HB VAL 38 HB VAL 38 -15.326 -1.327 10.839 304 HG11 VAL 38 1HG1 VAL 38 -15.154 -1.219 13.252 305 HG12 VAL 38 2HG1 VAL 38 -13.924 0.038 13.131 306 HG13 VAL 38 3HG1 VAL 38 -13.580 -1.589 12.547 307 HG21 VAL 38 3HG2 VAL 38 -16.337 0.851 10.407 308 HG22 VAL 38 1HG2 VAL 38 -15.518 1.520 11.819 309 HG23 VAL 38 2HG2 VAL 38 -16.747 0.271 12.022 310 H SER 39 H SER 39 -11.586 -0.053 11.716 311 HA SER 39 HA SER 39 -11.648 2.547 12.824 312 HB2 SER 39 2HB SER 39 -10.358 0.621 13.778 313 HB3 SER 39 1HB SER 39 -9.228 0.765 12.435 314 HG SER 39 HG SER 39 -9.798 2.768 14.376 315 H ALA 40 H ALA 40 -9.980 1.154 10.026 316 HA ALA 40 HA ALA 40 -8.495 3.507 9.430 317 HB1 ALA 40 3HB ALA 40 -9.097 1.138 7.666 318 HB2 ALA 40 1HB ALA 40 -7.732 1.274 8.776 319 HB3 ALA 40 2HB ALA 40 -7.852 2.357 7.388 320 H GLU 41 H GLU 41 -11.468 2.073 8.094 321 HA GLU 41 HA GLU 41 -11.753 3.894 5.972 322 HB2 GLU 41 2HB GLU 41 -14.081 3.154 5.840 323 HB3 GLU 41 1HB GLU 41 -12.987 1.791 6.028 324 HG2 GLU 41 2HG GLU 41 -13.846 1.201 8.009 325 HG3 GLU 41 1HG GLU 41 -14.053 2.871 8.535 326 H SER 42 H SER 42 -12.926 4.016 9.314 327 HA SER 42 HA SER 42 -14.544 6.315 8.918 328 HB2 SER 42 2HB SER 42 -14.475 6.438 11.451 329 HB3 SER 42 1HB SER 42 -15.076 4.925 10.774 330 HG SER 42 HG SER 42 -13.279 3.901 11.379 331 H LEU 43 H LEU 43 -11.199 5.826 9.937 332 HA LEU 43 HA LEU 43 -10.611 8.494 10.585 333 HB2 LEU 43 2HB LEU 43 -8.812 6.386 9.380 334 HB3 LEU 43 1HB LEU 43 -8.257 7.903 10.060 335 HG LEU 43 HG LEU 43 -9.618 5.675 11.579 336 HD11 LEU 43 1HD1 LEU 43 -7.451 5.402 12.669 337 HD12 LEU 43 2HD1 LEU 43 -6.764 6.653 11.629 338 HD13 LEU 43 3HD1 LEU 43 -7.330 5.137 10.930 339 HD21 LEU 43 3HD2 LEU 43 -8.504 8.300 12.555 340 HD22 LEU 43 1HD2 LEU 43 -9.106 6.991 13.573 341 HD23 LEU 43 2HD2 LEU 43 -10.206 7.848 12.494 342 H LEU 44 H LEU 44 -10.236 6.736 7.512 343 HA LEU 44 HA LEU 44 -9.361 8.924 5.975 344 HB2 LEU 44 2HB LEU 44 -9.170 6.584 5.244 345 HB3 LEU 44 1HB LEU 44 -10.915 6.476 5.112 346 HG LEU 44 HG LEU 44 -10.819 8.249 3.342 347 HD11 LEU 44 1HD1 LEU 44 -8.676 9.235 3.960 348 HD12 LEU 44 2HD1 LEU 44 -8.673 8.702 2.279 349 HD13 LEU 44 3HD1 LEU 44 -7.855 7.742 3.511 350 HD21 LEU 44 3HD2 LEU 44 -11.005 5.884 2.781 351 HD22 LEU 44 1HD2 LEU 44 -9.249 5.730 2.821 352 HD23 LEU 44 2HD2 LEU 44 -10.018 6.742 1.597 353 H ARG 45 H ARG 45 -12.544 7.744 6.820 354 HA ARG 45 HA ARG 45 -14.076 9.251 5.024 355 HB2 ARG 45 2HB ARG 45 -14.871 7.296 6.304 356 HB3 ARG 45 1HB ARG 45 -14.816 8.250 7.775 357 HG2 ARG 45 2HG ARG 45 -16.569 9.683 6.973 358 HG3 ARG 45 1HG ARG 45 -16.558 8.874 5.401 359 HD2 ARG 45 2HD ARG 45 -17.271 6.801 6.423 360 HD3 ARG 45 1HD ARG 45 -17.177 7.525 8.027 361 HE ARG 45 HE ARG 45 -18.978 9.087 7.138 362 HH11 ARG 45 1HH1 ARG 45 -18.589 5.783 6.023 363 HH12 ARG 45 2HH1 ARG 45 -20.282 5.567 5.680 364 HH21 ARG 45 1HH2 ARG 45 -21.197 8.810 6.711 365 HH22 ARG 45 2HH2 ARG 45 -21.774 7.291 6.085 366 H ASN 46 H ASN 46 -12.843 10.045 8.254 367 HA ASN 46 HA ASN 46 -14.181 12.639 8.141 368 HB2 ASN 46 2HB ASN 46 -12.569 11.266 10.283 369 HB3 ASN 46 1HB ASN 46 -13.003 12.968 10.398 370 HD21 ASN 46 1HD2 ASN 46 -14.400 12.952 12.018 371 HD22 ASN 46 2HD2 ASN 46 -15.883 12.042 12.051 372 H GLY 47 H GLY 47 -11.450 11.422 6.840 373 HA2 GLY 47 2HA GLY 47 -9.709 12.526 5.788 374 HA3 GLY 47 1HA GLY 47 -10.310 14.037 6.455 375 H LYS 48 H LYS 48 -9.688 11.360 8.555 376 HA LYS 48 HA LYS 48 -7.721 12.783 10.060 377 HB2 LYS 48 2HB LYS 48 -8.635 9.901 10.101 378 HB3 LYS 48 1HB LYS 48 -7.437 10.542 11.214 379 HG2 LYS 48 2HG LYS 48 -10.167 11.756 10.979 380 HG3 LYS 48 1HG LYS 48 -9.850 10.363 12.017 381 HD2 LYS 48 2HD LYS 48 -8.075 11.677 13.150 382 HD3 LYS 48 1HD LYS 48 -8.532 13.073 12.172 383 HE2 LYS 48 2HE LYS 48 -10.735 13.088 13.142 384 HE3 LYS 48 1HE LYS 48 -10.397 11.597 14.021 385 HZ1 LYS 48 3HZ LYS 48 -10.192 13.513 15.460 386 HZ2 LYS 48 1HZ LYS 48 -9.039 14.207 14.430 387 HZ3 LYS 48 2HZ LYS 48 -8.680 12.776 15.263 388 H ILE 49 H ILE 49 -7.661 10.185 7.691 389 HA ILE 49 HA ILE 49 -4.732 10.429 7.541 390 HB ILE 49 HB ILE 49 -4.612 8.042 6.962 391 HG12 ILE 49 2HG1 ILE 49 -7.542 7.960 7.725 392 HG13 ILE 49 1HG1 ILE 49 -6.913 7.799 6.087 393 HG21 ILE 49 1HG2 ILE 49 -5.942 8.608 9.606 394 HG22 ILE 49 2HG2 ILE 49 -4.216 8.708 9.256 395 HG23 ILE 49 3HG2 ILE 49 -5.033 7.147 9.213 396 HD11 ILE 49 3HD1 ILE 49 -7.501 5.643 7.038 397 HD12 ILE 49 1HD1 ILE 49 -6.378 5.916 8.371 398 HD13 ILE 49 2HD1 ILE 49 -5.768 5.746 6.725 399 H THR 50 H THR 50 -3.925 9.487 5.399 400 HA THR 50 HA THR 50 -5.668 10.469 3.252 401 HB THR 50 HB THR 50 -3.586 10.590 1.903 402 HG1 THR 50 HG1 THR 50 -1.601 10.463 3.335 403 HG21 THR 50 3HG2 THR 50 -2.588 12.499 3.060 404 HG22 THR 50 1HG2 THR 50 -3.411 12.038 4.550 405 HG23 THR 50 2HG2 THR 50 -4.347 12.565 3.153 406 H VAL 51 H VAL 51 -4.819 9.258 1.050 407 HA VAL 51 HA VAL 51 -5.825 6.630 1.200 408 HB VAL 51 HB VAL 51 -4.223 7.968 -0.987 409 HG11 VAL 51 1HG1 VAL 51 -5.077 6.194 -2.464 410 HG12 VAL 51 2HG1 VAL 51 -5.762 5.373 -1.061 411 HG13 VAL 51 3HG1 VAL 51 -4.015 5.559 -1.207 412 HG21 VAL 51 3HG2 VAL 51 -7.184 7.487 -0.662 413 HG22 VAL 51 1HG2 VAL 51 -6.410 8.213 -2.070 414 HG23 VAL 51 2HG2 VAL 51 -6.357 9.036 -0.512 415 H ARG 52 H ARG 52 -2.563 7.934 1.281 416 HA ARG 52 HA ARG 52 -1.012 5.661 1.081 417 HB2 ARG 52 2HB ARG 52 -0.714 8.004 2.964 418 HB3 ARG 52 1HB ARG 52 0.500 6.752 2.790 419 HG2 ARG 52 2HG ARG 52 0.724 7.375 0.402 420 HG3 ARG 52 1HG ARG 52 -0.395 8.714 0.693 421 HD2 ARG 52 2HD ARG 52 1.093 9.617 2.385 422 HD3 ARG 52 1HD ARG 52 2.195 8.262 2.171 423 HE ARG 52 HE ARG 52 1.671 9.963 -0.143 424 HH11 ARG 52 1HH1 ARG 52 3.804 8.993 2.445 425 HH12 ARG 52 2HH1 ARG 52 5.198 9.785 1.782 426 HH21 ARG 52 1HH2 ARG 52 3.486 11.010 -1.039 427 HH22 ARG 52 2HH2 ARG 52 5.033 10.898 -0.233 428 H GLU 53 H GLU 53 -2.453 7.033 4.008 429 HA GLU 53 HA GLU 53 -1.595 4.969 5.736 430 HB2 GLU 53 2HB GLU 53 -3.913 6.845 6.188 431 HB3 GLU 53 1HB GLU 53 -2.917 6.059 7.406 432 HG2 GLU 53 2HG GLU 53 -1.954 8.150 5.464 433 HG3 GLU 53 1HG GLU 53 -2.403 8.446 7.142 434 H PHE 54 H PHE 54 -4.462 5.420 3.791 435 HA PHE 54 HA PHE 54 -6.089 3.488 5.059 436 HB2 PHE 54 2HB PHE 54 -6.944 5.220 3.492 437 HB3 PHE 54 1HB PHE 54 -6.157 4.373 2.165 438 HD1 PHE 54 HD1 PHE 54 -8.483 3.601 4.983 439 HD2 PHE 54 HD2 PHE 54 -7.480 3.020 0.889 440 HE1 PHE 54 HE1 PHE 54 -10.493 2.216 4.694 441 HE2 PHE 54 HE2 PHE 54 -9.491 1.634 0.592 442 HZ PHE 54 HZ PHE 54 -11.000 1.230 2.495 443 H VAL 55 H VAL 55 -4.129 3.276 2.070 444 HA VAL 55 HA VAL 55 -4.413 0.477 1.770 445 HB VAL 55 HB VAL 55 -2.149 2.236 0.796 446 HG11 VAL 55 1HG1 VAL 55 -1.832 0.505 -0.916 447 HG12 VAL 55 2HG1 VAL 55 -3.080 -0.474 -0.145 448 HG13 VAL 55 3HG1 VAL 55 -1.576 -0.127 0.712 449 HG21 VAL 55 3HG2 VAL 55 -4.286 3.069 0.016 450 HG22 VAL 55 1HG2 VAL 55 -4.733 1.456 -0.547 451 HG23 VAL 55 2HG2 VAL 55 -3.402 2.322 -1.316 452 H ARG 56 H ARG 56 -2.173 2.511 3.505 453 HA ARG 56 HA ARG 56 -0.184 0.744 4.278 454 HB2 ARG 56 2HB ARG 56 -0.405 3.250 4.683 455 HB3 ARG 56 1HB ARG 56 -1.426 2.848 6.050 456 HG2 ARG 56 2HG ARG 56 0.409 1.720 7.138 457 HG3 ARG 56 1HG ARG 56 1.443 2.000 5.732 458 HD2 ARG 56 2HD ARG 56 1.016 4.464 6.048 459 HD3 ARG 56 1HD ARG 56 0.251 4.059 7.581 460 HE ARG 56 HE ARG 56 2.824 2.924 7.519 461 HH11 ARG 56 1HH1 ARG 56 1.274 6.074 7.662 462 HH12 ARG 56 2HH1 ARG 56 2.577 6.803 8.553 463 HH21 ARG 56 1HH2 ARG 56 4.545 3.888 8.626 464 HH22 ARG 56 2HH2 ARG 56 4.453 5.567 9.081 465 H ALA 57 H ALA 57 -3.303 1.414 5.843 466 HA ALA 57 HA ALA 57 -2.919 -0.397 7.994 467 HB1 ALA 57 3HB ALA 57 -5.484 0.759 6.907 468 HB2 ALA 57 1HB ALA 57 -4.462 1.484 8.149 469 HB3 ALA 57 2HB ALA 57 -5.285 -0.044 8.465 470 H VAL 58 H VAL 58 -4.638 -0.649 4.903 471 HA VAL 58 HA VAL 58 -5.729 -3.223 5.372 472 HB VAL 58 HB VAL 58 -5.127 -1.991 2.682 473 HG11 VAL 58 1HG1 VAL 58 -5.774 -4.340 2.581 474 HG12 VAL 58 2HG1 VAL 58 -7.042 -3.311 1.915 475 HG13 VAL 58 3HG1 VAL 58 -7.219 -3.994 3.532 476 HG21 VAL 58 3HG2 VAL 58 -6.341 -0.386 4.035 477 HG22 VAL 58 1HG2 VAL 58 -7.547 -1.607 4.435 478 HG23 VAL 58 2HG2 VAL 58 -7.386 -1.038 2.773 479 H ALA 59 H ALA 59 -2.572 -2.205 4.545 480 HA ALA 59 HA ALA 59 -1.857 -4.667 3.210 481 HB1 ALA 59 3HB ALA 59 -0.090 -2.386 4.056 482 HB2 ALA 59 1HB ALA 59 -0.909 -2.517 2.500 483 HB3 ALA 59 2HB ALA 59 0.327 -3.693 2.947 484 H LYS 60 H LYS 60 -0.972 -3.065 6.281 485 HA LYS 60 HA LYS 60 0.426 -5.482 7.099 486 HB2 LYS 60 2HB LYS 60 1.085 -4.160 9.102 487 HB3 LYS 60 1HB LYS 60 1.586 -3.445 7.578 488 HG2 LYS 60 2HG LYS 60 -0.501 -1.993 7.766 489 HG3 LYS 60 1HG LYS 60 -0.588 -2.550 9.439 490 HD2 LYS 60 2HD LYS 60 1.747 -1.122 8.163 491 HD3 LYS 60 1HD LYS 60 0.593 -0.417 9.293 492 HE2 LYS 60 2HE LYS 60 1.322 -1.986 11.017 493 HE3 LYS 60 1HE LYS 60 2.464 -2.706 9.888 494 HZ1 LYS 60 3HZ LYS 60 3.726 -0.715 9.830 495 HZ2 LYS 60 1HZ LYS 60 3.436 -1.053 11.464 496 HZ3 LYS 60 2HZ LYS 60 2.546 0.155 10.673 497 H SER 61 H SER 61 -2.568 -3.891 7.596 498 HA SER 61 HA SER 61 -4.514 -4.568 8.498 499 HB2 SER 61 2HB SER 61 -3.214 -7.294 8.394 500 HB3 SER 61 1HB SER 61 -4.947 -6.965 8.483 501 HG SER 61 HG SER 61 -4.967 -6.576 6.422 502 H GLU 62 H GLU 62 -5.402 -6.315 10.249 503 HA GLU 62 HA GLU 62 -4.110 -5.632 12.783 504 HB2 GLU 62 2HB GLU 62 -6.770 -6.931 12.125 505 HB3 GLU 62 1HB GLU 62 -6.193 -6.644 13.759 506 HG2 GLU 62 2HG GLU 62 -6.435 -4.384 11.822 507 HG3 GLU 62 1HG GLU 62 -7.848 -4.988 12.682 508 H LEU 63 H LEU 63 -4.027 -7.455 14.431 509 HA LEU 63 HA LEU 63 -3.614 -9.572 15.156 510 HB2 LEU 63 2HB LEU 63 -5.500 -10.258 13.719 511 HB3 LEU 63 1HB LEU 63 -4.396 -10.454 12.375 512 HG LEU 63 HG LEU 63 -3.219 -12.235 13.681 513 HD11 LEU 63 1HD1 LEU 63 -3.855 -11.602 15.917 514 HD12 LEU 63 2HD1 LEU 63 -4.450 -13.229 15.580 515 HD13 LEU 63 3HD1 LEU 63 -5.559 -11.859 15.541 516 HD21 LEU 63 3HD2 LEU 63 -6.155 -12.668 13.145 517 HD22 LEU 63 1HD2 LEU 63 -4.938 -13.934 13.302 518 HD23 LEU 63 2HD2 LEU 63 -4.852 -12.789 11.961 519 H TYR 64 H TYR 64 -2.031 -8.183 12.508 520 HA TYR 64 HA TYR 64 0.138 -8.176 11.841 521 HB2 TYR 64 2HB TYR 64 0.561 -10.140 14.106 522 HB3 TYR 64 1HB TYR 64 1.854 -9.465 13.120 523 HD1 TYR 64 HD1 TYR 64 2.466 -7.106 13.324 524 HD2 TYR 64 HD2 TYR 64 -0.530 -8.823 15.808 525 HE1 TYR 64 HE1 TYR 64 2.626 -5.179 14.838 526 HE2 TYR 64 HE2 TYR 64 -0.383 -6.896 17.329 527 HH TYR 64 HH TYR 64 1.208 -5.145 17.938 528 H LYS 65 H LYS 65 -0.552 -11.545 12.776 529 HA LYS 65 HA LYS 65 0.382 -12.395 10.132 530 HB2 LYS 65 2HB LYS 65 -0.330 -14.060 12.559 531 HB3 LYS 65 1HB LYS 65 0.319 -14.681 11.052 532 HG2 LYS 65 2HG LYS 65 2.377 -13.361 11.443 533 HG3 LYS 65 1HG LYS 65 1.720 -12.876 13.010 534 HD2 LYS 65 2HD LYS 65 1.576 -15.245 13.665 535 HD3 LYS 65 1HD LYS 65 2.269 -15.708 12.113 536 HE2 LYS 65 2HE LYS 65 3.988 -15.758 13.797 537 HE3 LYS 65 1HE LYS 65 4.309 -14.429 12.686 538 HZ1 LYS 65 3HZ LYS 65 4.499 -14.053 15.218 539 HZ2 LYS 65 1HZ LYS 65 2.808 -13.937 15.173 540 HZ3 LYS 65 2HZ LYS 65 3.762 -12.863 14.264 541 H GLU 66 H GLU 66 -1.720 -11.236 9.435 542 HA GLU 66 HA GLU 66 -4.161 -12.674 9.944 543 HB2 GLU 66 2HB GLU 66 -4.032 -10.186 9.524 544 HB3 GLU 66 1HB GLU 66 -3.699 -10.558 7.839 545 HG2 GLU 66 2HG GLU 66 -5.849 -11.672 7.637 546 HG3 GLU 66 1HG GLU 66 -6.181 -11.373 9.341 547 H LYS 67 H LYS 67 -2.726 -14.585 9.182 548 HA LYS 67 HA LYS 67 -2.737 -16.429 7.905 549 HB2 LYS 67 2HB LYS 67 -4.839 -14.963 6.323 550 HB3 LYS 67 1HB LYS 67 -4.381 -16.635 6.036 551 HG2 LYS 67 2HG LYS 67 -5.697 -15.471 8.474 552 HG3 LYS 67 1HG LYS 67 -6.331 -16.689 7.365 553 HD2 LYS 67 2HD LYS 67 -3.961 -17.043 9.204 554 HD3 LYS 67 1HD LYS 67 -5.582 -17.680 9.488 555 HE2 LYS 67 2HE LYS 67 -5.416 -19.068 7.512 556 HE3 LYS 67 1HE LYS 67 -3.844 -18.373 7.122 557 HZ1 LYS 67 3HZ LYS 67 -4.460 -19.969 9.554 558 HZ2 LYS 67 1HZ LYS 67 -2.947 -19.323 9.148 559 HZ3 LYS 67 2HZ LYS 67 -3.636 -20.535 8.190 560 H PHE 68 H PHE 68 -2.323 -13.409 6.120 561 HA PHE 68 HA PHE 68 -1.155 -14.580 3.828 562 HB2 PHE 68 2HB PHE 68 -0.389 -12.376 3.237 563 HB3 PHE 68 1HB PHE 68 -1.999 -12.233 3.925 564 HD1 PHE 68 HD2 PHE 68 -2.234 -11.412 6.292 565 HD2 PHE 68 HD1 PHE 68 1.434 -11.233 4.144 566 HE1 PHE 68 HE2 PHE 68 -1.398 -9.715 7.867 567 HE2 PHE 68 HE1 PHE 68 2.277 -9.536 5.712 568 HZ PHE 68 HZ PHE 68 0.860 -8.774 7.576 569 H LEU 69 H LEU 69 0.147 -13.676 6.938 570 HA LEU 69 HA LEU 69 2.814 -14.516 6.097 571 HB2 LEU 69 2HB LEU 69 2.594 -12.439 7.430 572 HB3 LEU 69 1HB LEU 69 1.895 -13.371 8.738 573 HG LEU 69 HG LEU 69 4.011 -14.603 8.991 574 HD11 LEU 69 1HD1 LEU 69 4.794 -14.429 6.674 575 HD12 LEU 69 2HD1 LEU 69 6.011 -13.869 7.821 576 HD13 LEU 69 3HD1 LEU 69 5.064 -12.700 6.901 577 HD21 LEU 69 3HD2 LEU 69 5.319 -12.755 9.920 578 HD22 LEU 69 1HD2 LEU 69 3.609 -12.610 10.330 579 HD23 LEU 69 2HD2 LEU 69 4.300 -11.603 9.058 580 H TYR 70 H TYR 70 2.002 -16.708 5.782 581 HA TYR 70 HA TYR 70 1.451 -18.159 8.265 582 HB2 TYR 70 2HB TYR 70 0.749 -20.025 6.773 583 HB3 TYR 70 1HB TYR 70 -0.192 -18.558 6.552 584 HD1 TYR 70 HD1 TYR 70 0.113 -17.190 4.501 585 HD2 TYR 70 HD2 TYR 70 2.090 -20.925 5.003 586 HE1 TYR 70 HE1 TYR 70 0.549 -17.279 2.084 587 HE2 TYR 70 HE2 TYR 70 2.534 -21.020 2.587 588 HH TYR 70 HH TYR 70 2.126 -18.353 0.532 589 H GLY 71 H GLY 71 4.003 -17.436 6.272 590 HA2 GLY 71 2HA GLY 71 6.205 -18.123 6.504 591 HA3 GLY 71 1HA GLY 71 5.661 -19.427 7.551 592 H ASN 72 H ASN 72 6.385 -21.246 6.716 593 HA ASN 72 HA ASN 72 6.783 -22.966 5.302 594 HB2 ASN 72 2HB ASN 72 4.600 -21.663 3.668 595 HB3 ASN 72 1HB ASN 72 5.338 -23.205 3.254 596 HD21 ASN 72 1HD2 ASN 72 4.967 -24.998 4.574 597 HD22 ASN 72 2HD2 ASN 72 3.641 -25.046 5.688 598 H PHE 73 H PHE 73 6.035 -20.604 2.775 599 HA PHE 73 HA PHE 73 8.847 -20.787 1.916 600 HB2 PHE 73 2HB PHE 73 6.380 -20.312 0.222 601 HB3 PHE 73 1HB PHE 73 8.037 -20.306 -0.375 602 HD1 PHE 73 HD1 PHE 73 9.373 -22.418 -0.282 603 HD2 PHE 73 HD2 PHE 73 5.192 -22.326 0.503 604 HE1 PHE 73 HE1 PHE 73 9.255 -24.848 -0.652 605 HE2 PHE 73 HE2 PHE 73 5.064 -24.757 0.138 606 HZ PHE 73 HZ PHE 73 7.099 -26.017 -0.440 607 H GLN 74 H GLN 74 9.808 -19.023 2.696 608 HA GLN 74 HA GLN 74 8.441 -16.667 3.416 609 HB2 GLN 74 2HB GLN 74 10.599 -17.465 4.398 610 HB3 GLN 74 1HB GLN 74 11.404 -16.986 2.911 611 HG2 GLN 74 2HG GLN 74 11.718 -15.297 4.592 612 HG3 GLN 74 1HG GLN 74 10.703 -14.666 3.295 613 HE21 GLN 74 1HE2 GLN 74 9.780 -13.095 4.581 614 HE22 GLN 74 2HE2 GLN 74 8.659 -13.459 5.842 615 H THR 75 H THR 75 10.143 -17.612 0.516 616 HA THR 75 HA THR 75 10.450 -15.088 -0.663 617 HB THR 75 HB THR 75 10.316 -16.601 -2.837 618 HG1 THR 75 HG1 THR 75 11.209 -18.663 -1.255 619 HG21 THR 75 3HG2 THR 75 12.341 -15.527 -1.956 620 HG22 THR 75 1HG2 THR 75 12.675 -17.169 -2.506 621 HG23 THR 75 2HG2 THR 75 12.522 -16.830 -0.783 622 H ARG 76 H ARG 76 7.744 -17.376 -0.740 623 HA ARG 76 HA ARG 76 6.279 -15.944 -2.719 624 HB2 ARG 76 2HB ARG 76 5.440 -18.033 -0.718 625 HB3 ARG 76 1HB ARG 76 4.321 -17.307 -1.862 626 HG2 ARG 76 2HG ARG 76 6.049 -18.064 -3.644 627 HG3 ARG 76 1HG ARG 76 6.610 -19.151 -2.370 628 HD2 ARG 76 2HD ARG 76 4.933 -20.199 -3.851 629 HD3 ARG 76 1HD ARG 76 4.400 -20.113 -2.170 630 HE ARG 76 HE ARG 76 3.564 -18.031 -4.075 631 HH11 ARG 76 1HH1 ARG 76 2.741 -20.777 -2.059 632 HH12 ARG 76 2HH1 ARG 76 1.050 -20.370 -1.971 633 HH21 ARG 76 1HH2 ARG 76 1.338 -17.498 -3.994 634 HH22 ARG 76 2HH2 ARG 76 0.244 -18.516 -3.096 635 H VAL 77 H VAL 77 6.426 -15.824 0.786 636 HA VAL 77 HA VAL 77 4.192 -14.164 1.221 637 HB VAL 77 HB VAL 77 6.762 -14.249 2.821 638 HG11 VAL 77 1HG1 VAL 77 5.402 -12.294 3.329 639 HG12 VAL 77 2HG1 VAL 77 5.398 -13.433 4.675 640 HG13 VAL 77 3HG1 VAL 77 4.000 -13.329 3.605 641 HG21 VAL 77 3HG2 VAL 77 4.232 -15.864 3.101 642 HG22 VAL 77 1HG2 VAL 77 5.545 -15.830 4.280 643 HG23 VAL 77 2HG2 VAL 77 5.830 -16.467 2.659 644 H ILE 78 H ILE 78 7.491 -13.529 0.241 645 HA ILE 78 HA ILE 78 7.486 -10.720 0.456 646 HB ILE 78 HB ILE 78 8.933 -12.338 -1.649 647 HG12 ILE 78 2HG1 ILE 78 9.426 -13.318 0.514 648 HG13 ILE 78 1HG1 ILE 78 10.826 -12.414 -0.049 649 HG21 ILE 78 1HG2 ILE 78 9.571 -9.678 -0.385 650 HG22 ILE 78 2HG2 ILE 78 8.957 -9.935 -2.018 651 HG23 ILE 78 3HG2 ILE 78 10.563 -10.516 -1.578 652 HD11 ILE 78 3HD1 ILE 78 10.408 -12.116 2.339 653 HD12 ILE 78 1HD1 ILE 78 8.823 -11.435 1.973 654 HD13 ILE 78 2HD1 ILE 78 10.287 -10.597 1.452 655 H GLU 79 H GLU 79 6.763 -12.881 -2.265 656 HA GLU 79 HA GLU 79 6.099 -10.931 -4.156 657 HB2 GLU 79 2HB GLU 79 5.029 -13.752 -3.920 658 HB3 GLU 79 1HB GLU 79 4.974 -12.746 -5.363 659 HG2 GLU 79 2HG GLU 79 7.390 -12.750 -5.498 660 HG3 GLU 79 1HG GLU 79 7.492 -13.679 -4.003 661 H LEU 80 H LEU 80 4.117 -12.587 -1.748 662 HA LEU 80 HA LEU 80 1.588 -11.724 -2.509 663 HB2 LEU 80 2HB LEU 80 2.711 -12.196 0.251 664 HB3 LEU 80 1HB LEU 80 1.007 -11.937 -0.078 665 HG LEU 80 HG LEU 80 2.643 -14.232 -1.167 666 HD11 LEU 80 1HD1 LEU 80 0.617 -14.161 1.068 667 HD12 LEU 80 2HD1 LEU 80 2.354 -14.398 1.251 668 HD13 LEU 80 3HD1 LEU 80 1.383 -15.608 0.413 669 HD21 LEU 80 3HD2 LEU 80 -0.313 -13.647 -1.257 670 HD22 LEU 80 1HD2 LEU 80 0.452 -15.137 -1.810 671 HD23 LEU 80 2HD2 LEU 80 0.801 -13.613 -2.624 672 H ASN 81 H ASN 81 3.926 -10.134 -0.363 673 HA ASN 81 HA ASN 81 2.270 -7.921 0.234 674 HB2 ASN 81 2HB ASN 81 5.212 -8.438 0.509 675 HB3 ASN 81 1HB ASN 81 4.554 -6.838 0.836 676 HD21 ASN 81 1HD2 ASN 81 4.649 -10.170 1.872 677 HD22 ASN 81 2HD2 ASN 81 3.960 -9.895 3.435 678 H TYR 82 H TYR 82 4.705 -8.442 -2.277 679 HA TYR 82 HA TYR 82 4.778 -5.787 -3.226 680 HB2 TYR 82 2HB TYR 82 5.530 -8.446 -4.355 681 HB3 TYR 82 1HB TYR 82 5.435 -7.069 -5.447 682 HD1 TYR 82 HD1 TYR 82 7.130 -8.370 -2.421 683 HD2 TYR 82 HD2 TYR 82 7.128 -5.419 -5.480 684 HE1 TYR 82 HE1 TYR 82 9.386 -7.669 -1.737 685 HE2 TYR 82 HE2 TYR 82 9.379 -4.709 -4.807 686 HH TYR 82 HH TYR 82 10.793 -4.783 -2.799 687 H LYS 83 H LYS 83 2.698 -8.510 -4.020 688 HA LYS 83 HA LYS 83 1.368 -7.086 -6.143 689 HB2 LYS 83 2HB LYS 83 1.698 -9.548 -6.166 690 HB3 LYS 83 1HB LYS 83 0.622 -9.686 -4.784 691 HG2 LYS 83 2HG LYS 83 -1.251 -8.999 -6.067 692 HG3 LYS 83 1HG LYS 83 -0.227 -8.499 -7.413 693 HD2 LYS 83 2HD LYS 83 -1.319 -10.630 -7.885 694 HD3 LYS 83 1HD LYS 83 0.428 -10.827 -7.783 695 HE2 LYS 83 2HE LYS 83 0.222 -11.697 -5.523 696 HE3 LYS 83 1HE LYS 83 -1.522 -11.448 -5.570 697 HZ1 LYS 83 3HZ LYS 83 -1.640 -13.043 -7.409 698 HZ2 LYS 83 1HZ LYS 83 -0.995 -13.747 -6.008 699 HZ3 LYS 83 2HZ LYS 83 0.027 -13.317 -7.286 700 H HIS 84 H HIS 84 1.096 -7.214 -2.756 701 HA HIS 84 HA HIS 84 -1.718 -6.486 -2.683 702 HB2 HIS 84 2HB HIS 84 -0.657 -7.901 -0.901 703 HB3 HIS 84 1HB HIS 84 0.306 -6.511 -0.429 704 HD1 HIS 84 HD1 HIS 84 -2.557 -4.743 -0.945 705 HD2 HIS 84 HD2 HIS 84 -1.663 -7.747 1.791 706 HE1 HIS 84 HE1 HIS 84 -4.197 -4.455 0.938 707 HE2 HIS 84 HE2 HIS 84 -3.496 -6.139 2.677 708 H LEU 85 H LEU 85 1.435 -4.938 -2.250 709 HA LEU 85 HA LEU 85 0.143 -2.437 -1.500 710 HB2 LEU 85 2HB LEU 85 2.920 -3.495 -1.372 711 HB3 LEU 85 1HB LEU 85 2.675 -1.759 -1.361 712 HG LEU 85 HG LEU 85 1.360 -3.629 0.598 713 HD11 LEU 85 1HD1 LEU 85 3.834 -1.947 0.949 714 HD12 LEU 85 2HD1 LEU 85 3.803 -3.704 0.816 715 HD13 LEU 85 3HD1 LEU 85 3.040 -2.911 2.195 716 HD21 LEU 85 3HD2 LEU 85 0.214 -1.500 0.261 717 HD22 LEU 85 1HD2 LEU 85 1.723 -0.635 0.556 718 HD23 LEU 85 2HD2 LEU 85 0.974 -1.564 1.854 719 H LEU 86 H LEU 86 2.512 -3.508 -3.942 720 HA LEU 86 HA LEU 86 2.230 -0.882 -5.212 721 HB2 LEU 86 2HB LEU 86 4.277 -3.054 -5.676 722 HB3 LEU 86 1HB LEU 86 4.283 -1.469 -6.425 723 HG LEU 86 HG LEU 86 4.594 -1.979 -3.463 724 HD11 LEU 86 1HD1 LEU 86 6.522 -2.774 -4.738 725 HD12 LEU 86 2HD1 LEU 86 6.921 -1.330 -3.804 726 HD13 LEU 86 3HD1 LEU 86 6.640 -1.208 -5.541 727 HD21 LEU 86 3HD2 LEU 86 4.828 0.548 -5.095 728 HD22 LEU 86 1HD2 LEU 86 5.224 0.395 -3.383 729 HD23 LEU 86 2HD2 LEU 86 3.562 0.171 -3.927 730 H GLY 87 H GLY 87 0.813 -3.803 -5.444 731 HA2 GLY 87 2HA GLY 87 -0.238 -5.002 -7.102 732 HA3 GLY 87 1HA GLY 87 -0.279 -3.488 -7.999 733 H ARG 88 H ARG 88 2.578 -5.157 -6.891 734 HA ARG 88 HA ARG 88 3.702 -4.979 -9.556 735 HB2 ARG 88 2HB ARG 88 4.736 -5.268 -6.813 736 HB3 ARG 88 1HB ARG 88 5.635 -6.150 -8.033 737 HG2 ARG 88 2HG ARG 88 5.811 -3.976 -9.302 738 HG3 ARG 88 1HG ARG 88 5.177 -3.187 -7.853 739 HD2 ARG 88 2HD ARG 88 7.013 -4.130 -6.537 740 HD3 ARG 88 1HD ARG 88 7.645 -4.919 -7.980 741 HE ARG 88 HE ARG 88 7.415 -1.992 -7.902 742 HH11 ARG 88 1HH1 ARG 88 9.408 -4.882 -8.040 743 HH12 ARG 88 2HH1 ARG 88 10.842 -4.009 -8.469 744 HH21 ARG 88 1HH2 ARG 88 9.318 -0.844 -8.397 745 HH22 ARG 88 2HH2 ARG 88 10.797 -1.720 -8.687 746 H ALA 89 H ALA 89 4.390 -6.652 -10.779 747 HA ALA 89 HA ALA 89 4.189 -9.365 -9.664 748 HB1 ALA 89 3HB ALA 89 4.407 -8.497 -12.558 749 HB2 ALA 89 1HB ALA 89 2.941 -9.078 -11.765 750 HB3 ALA 89 2HB ALA 89 4.315 -10.163 -11.989 751 HA PRO 90 HA PRO 90 8.377 -8.725 -8.487 752 HB2 PRO 90 2HB PRO 90 9.032 -11.464 -9.103 753 HB3 PRO 90 1HB PRO 90 8.805 -10.711 -7.525 754 HG2 PRO 90 2HG PRO 90 6.918 -12.297 -9.129 755 HG3 PRO 90 1HG PRO 90 6.908 -11.958 -7.390 756 HD2 PRO 90 2HD PRO 90 5.111 -10.865 -9.073 757 HD3 PRO 90 1HD PRO 90 5.722 -9.992 -7.652 758 H TYR 91 H TYR 91 9.634 -7.592 -9.781 759 HA TYR 91 HA TYR 91 9.832 -8.196 -12.583 760 HB2 TYR 91 2HB TYR 91 9.657 -5.878 -11.647 761 HB3 TYR 91 1HB TYR 91 11.275 -6.072 -10.987 762 HD1 TYR 91 HD2 TYR 91 9.644 -6.667 -14.310 763 HD2 TYR 91 HD1 TYR 91 12.893 -4.953 -12.162 764 HE1 TYR 91 HE2 TYR 91 10.599 -5.840 -16.421 765 HE2 TYR 91 HE1 TYR 91 13.854 -4.123 -14.267 766 HH TYR 91 HH TYR 91 13.777 -4.457 -16.586 767 H ASP 92 H ASP 92 12.104 -8.030 -9.846 768 HA ASP 92 HA ASP 92 13.697 -10.109 -11.147 769 HB2 ASP 92 2HB ASP 92 14.741 -7.979 -11.845 770 HB3 ASP 92 1HB ASP 92 14.916 -7.517 -10.155 771 H GLU 93 H GLU 93 15.261 -11.090 -9.637 772 HA GLU 93 HA GLU 93 13.991 -11.674 -7.178 773 HB2 GLU 93 2HB GLU 93 15.950 -13.086 -6.740 774 HB3 GLU 93 1HB GLU 93 15.331 -13.324 -8.368 775 HG2 GLU 93 2HG GLU 93 17.105 -11.686 -9.129 776 HG3 GLU 93 1HG GLU 93 17.798 -11.844 -7.517 777 H SER 94 H SER 94 16.277 -9.259 -8.069 778 HA SER 94 HA SER 94 17.683 -8.906 -5.686 779 HB2 SER 94 2HB SER 94 17.971 -6.525 -6.514 780 HB3 SER 94 1HB SER 94 18.463 -7.793 -7.636 781 HG SER 94 HG SER 94 16.787 -7.368 -8.911 782 H GLU 95 H GLU 95 14.563 -7.542 -6.697 783 HA GLU 95 HA GLU 95 14.259 -5.830 -4.466 784 HB2 GLU 95 2HB GLU 95 11.899 -5.694 -5.117 785 HB3 GLU 95 1HB GLU 95 12.949 -5.531 -6.517 786 HG2 GLU 95 2HG GLU 95 12.541 -8.048 -6.847 787 HG3 GLU 95 1HG GLU 95 11.193 -7.820 -5.733 788 H VAL 96 H VAL 96 13.311 -9.161 -5.099 789 HA VAL 96 HA VAL 96 11.878 -9.639 -2.730 790 HB VAL 96 HB VAL 96 13.503 -11.591 -4.373 791 HG11 VAL 96 1HG1 VAL 96 12.030 -13.308 -3.404 792 HG12 VAL 96 2HG1 VAL 96 11.310 -12.082 -2.361 793 HG13 VAL 96 3HG1 VAL 96 13.015 -12.503 -2.183 794 HG21 VAL 96 3HG2 VAL 96 11.321 -12.146 -5.411 795 HG22 VAL 96 1HG2 VAL 96 11.852 -10.498 -5.744 796 HG23 VAL 96 2HG2 VAL 96 10.601 -10.793 -4.538 797 H ILE 97 H ILE 97 15.297 -10.131 -3.545 798 HA ILE 97 HA ILE 97 16.131 -11.205 -1.097 799 HB ILE 97 HB ILE 97 17.696 -9.564 -3.091 800 HG12 ILE 97 2HG1 ILE 97 17.520 -12.554 -2.659 801 HG13 ILE 97 1HG1 ILE 97 16.730 -11.672 -3.961 802 HG21 ILE 97 1HG2 ILE 97 19.699 -10.502 -2.054 803 HG22 ILE 97 2HG2 ILE 97 18.701 -11.294 -0.836 804 HG23 ILE 97 3HG2 ILE 97 18.779 -9.534 -0.901 805 HD11 ILE 97 3HD1 ILE 97 18.766 -12.790 -4.701 806 HD12 ILE 97 1HD1 ILE 97 19.699 -11.860 -3.534 807 HD13 ILE 97 2HD1 ILE 97 18.887 -11.038 -4.866 808 H PHE 98 H PHE 98 16.020 -7.841 -2.221 809 HA PHE 98 HA PHE 98 17.180 -6.709 0.087 810 HB2 PHE 98 2HB PHE 98 17.055 -5.484 -2.021 811 HB3 PHE 98 1HB PHE 98 15.297 -5.459 -1.925 812 HD1 PHE 98 HD1 PHE 98 18.309 -4.408 0.006 813 HD2 PHE 98 HD2 PHE 98 14.253 -3.623 -1.010 814 HE1 PHE 98 HE1 PHE 98 18.415 -2.285 1.245 815 HE2 PHE 98 HE2 PHE 98 14.350 -1.501 0.232 816 HZ PHE 98 HZ PHE 98 16.430 -0.829 1.359 817 H HIS 99 H HIS 99 13.893 -7.648 -0.683 818 HA HIS 99 HA HIS 99 12.743 -6.243 1.521 819 HB2 HIS 99 2HB HIS 99 11.456 -6.690 -0.526 820 HB3 HIS 99 1HB HIS 99 11.635 -8.422 -0.274 821 HD1 HIS 99 HD1 HIS 99 9.274 -5.797 0.244 822 HD2 HIS 99 HD2 HIS 99 10.469 -9.164 2.322 823 HE1 HIS 99 HE1 HIS 99 7.387 -6.305 1.827 824 HE2 HIS 99 HE2 HIS 99 8.325 -8.115 3.320 825 H LEU 100 H LEU 100 13.923 -9.496 0.842 826 HA LEU 100 HA LEU 100 13.158 -10.777 3.213 827 HB2 LEU 100 2HB LEU 100 15.632 -11.095 1.517 828 HB3 LEU 100 1HB LEU 100 15.248 -12.151 2.860 829 HG LEU 100 HG LEU 100 13.465 -11.797 0.450 830 HD11 LEU 100 1HD1 LEU 100 14.316 -13.977 -0.274 831 HD12 LEU 100 2HD1 LEU 100 15.469 -13.968 1.060 832 HD13 LEU 100 3HD1 LEU 100 15.596 -12.767 -0.225 833 HD21 LEU 100 3HD2 LEU 100 13.499 -13.851 2.657 834 HD22 LEU 100 1HD2 LEU 100 12.403 -13.828 1.277 835 HD23 LEU 100 2HD2 LEU 100 12.329 -12.543 2.482 836 H ASP 101 H ASP 101 15.997 -8.805 2.465 837 HA ASP 101 HA ASP 101 17.251 -8.989 4.972 838 HB2 ASP 101 2HB ASP 101 17.403 -7.056 2.700 839 HB3 ASP 101 1HB ASP 101 18.137 -6.607 4.235 840 H LEU 102 H LEU 102 14.910 -6.634 3.728 841 HA LEU 102 HA LEU 102 14.874 -4.958 5.984 842 HB2 LEU 102 2HB LEU 102 13.921 -4.409 3.746 843 HB3 LEU 102 1HB LEU 102 12.611 -5.527 4.062 844 HG LEU 102 HG LEU 102 11.811 -4.137 5.892 845 HD11 LEU 102 1HD1 LEU 102 14.096 -2.296 5.210 846 HD12 LEU 102 2HD1 LEU 102 13.992 -3.309 6.649 847 HD13 LEU 102 3HD1 LEU 102 12.834 -2.000 6.406 848 HD21 LEU 102 3HD2 LEU 102 11.021 -3.637 3.631 849 HD22 LEU 102 1HD2 LEU 102 12.365 -2.516 3.407 850 HD23 LEU 102 2HD2 LEU 102 11.122 -2.172 4.611 851 H TYR 103 H TYR 103 12.974 -7.804 5.133 852 HA TYR 103 HA TYR 103 11.197 -7.878 7.272 853 HB2 TYR 103 2HB TYR 103 11.033 -9.329 5.291 854 HB3 TYR 103 1HB TYR 103 12.479 -10.192 5.800 855 HD1 TYR 103 HD1 TYR 103 8.920 -9.608 6.511 856 HD2 TYR 103 HD2 TYR 103 12.377 -11.873 7.529 857 HE1 TYR 103 HE1 TYR 103 7.511 -11.188 7.762 858 HE2 TYR 103 HE2 TYR 103 10.976 -13.461 8.783 859 HH TYR 103 HH TYR 103 8.797 -13.542 9.871 860 H GLU 104 H GLU 104 14.461 -9.224 6.998 861 HA GLU 104 HA GLU 104 14.419 -10.369 9.624 862 HB2 GLU 104 2HB GLU 104 16.725 -9.837 7.744 863 HB3 GLU 104 1HB GLU 104 16.837 -10.764 9.233 864 HG2 GLU 104 2HG GLU 104 15.223 -12.381 8.318 865 HG3 GLU 104 1HG GLU 104 15.200 -11.468 6.809 866 H ASN 105 H ASN 105 15.641 -7.398 8.200 867 HA ASN 105 HA ASN 105 17.230 -6.699 10.476 868 HB2 ASN 105 2HB ASN 105 16.447 -5.250 7.964 869 HB3 ASN 105 1HB ASN 105 17.299 -4.420 9.259 870 HD21 ASN 105 1HD2 ASN 105 17.851 -7.790 8.504 871 HD22 ASN 105 2HD2 ASN 105 19.448 -7.584 7.871 872 H GLU 106 H GLU 106 14.158 -5.394 9.165 873 HA GLU 106 HA GLU 106 13.870 -4.011 11.750 874 HB2 GLU 106 2HB GLU 106 12.863 -3.220 9.021 875 HB3 GLU 106 1HB GLU 106 12.396 -2.409 10.510 876 HG2 GLU 106 2HG GLU 106 14.732 -1.835 10.935 877 HG3 GLU 106 1HG GLU 106 15.202 -2.650 9.445 878 H GLY 107 H GLY 107 12.135 -5.906 9.305 879 HA2 GLY 107 2HA GLY 107 10.682 -7.623 10.464 880 HA3 GLY 107 1HA GLY 107 9.974 -6.248 11.296 881 H PHE 108 H PHE 108 8.412 -8.018 9.878 882 HA PHE 108 HA PHE 108 7.996 -7.322 7.183 883 HB2 PHE 108 2HB PHE 108 5.914 -8.583 7.339 884 HB3 PHE 108 1HB PHE 108 7.223 -9.451 8.130 885 HD1 PHE 108 HD2 PHE 108 7.322 -9.532 10.609 886 HD2 PHE 108 HD1 PHE 108 3.992 -7.888 8.529 887 HE1 PHE 108 HE2 PHE 108 5.961 -9.724 12.644 888 HE2 PHE 108 HE1 PHE 108 2.626 -8.073 10.568 889 HZ PHE 108 HZ PHE 108 3.612 -8.995 12.629 890 H ASP 109 H ASP 109 6.929 -5.866 10.136 891 HA ASP 109 HA ASP 109 4.750 -4.419 8.992 892 HB2 ASP 109 2HB ASP 109 4.662 -3.187 11.054 893 HB3 ASP 109 1HB ASP 109 4.985 -4.868 11.452 894 H ALA 110 H ALA 110 8.178 -3.913 9.376 895 HA ALA 110 HA ALA 110 8.146 -1.194 8.433 896 HB1 ALA 110 3HB ALA 110 9.918 -1.960 9.918 897 HB2 ALA 110 1HB ALA 110 10.588 -1.421 8.379 898 HB3 ALA 110 2HB ALA 110 10.431 -3.144 8.717 899 H ASP 111 H ASP 111 8.706 -4.398 7.088 900 HA ASP 111 HA ASP 111 9.409 -3.912 4.488 901 HB2 ASP 111 2HB ASP 111 7.365 -5.837 5.598 902 HB3 ASP 111 1HB ASP 111 7.770 -5.801 3.890 903 H ILE 112 H ILE 112 6.104 -4.170 5.632 904 HA ILE 112 HA ILE 112 4.825 -3.230 3.336 905 HB ILE 112 HB ILE 112 3.972 -3.355 6.226 906 HG12 ILE 112 2HG1 ILE 112 3.214 -5.103 3.882 907 HG13 ILE 112 1HG1 ILE 112 4.541 -5.466 4.982 908 HG21 ILE 112 1HG2 ILE 112 2.636 -1.663 5.088 909 HG22 ILE 112 2HG2 ILE 112 1.672 -3.090 5.475 910 HG23 ILE 112 3HG2 ILE 112 2.235 -2.824 3.823 911 HD11 ILE 112 3HD1 ILE 112 1.633 -5.238 5.711 912 HD12 ILE 112 1HD1 ILE 112 2.950 -5.560 6.839 913 HD13 ILE 112 2HD1 ILE 112 2.572 -6.725 5.571 914 H ASP 113 H ASP 113 6.026 -1.547 6.181 915 HA ASP 113 HA ASP 113 4.583 0.861 5.702 916 HB2 ASP 113 2HB ASP 113 5.630 -0.086 7.902 917 HB3 ASP 113 1HB ASP 113 7.072 0.766 7.363 918 H SER 114 H SER 114 7.762 -0.307 4.794 919 HA SER 114 HA SER 114 9.013 2.129 4.253 920 HB2 SER 114 2HB SER 114 10.589 0.839 2.898 921 HB3 SER 114 1HB SER 114 10.217 -0.007 4.397 922 HG SER 114 HG SER 114 8.886 -1.398 3.263 923 H TYR 115 H TYR 115 6.815 0.225 2.290 924 HA TYR 115 HA TYR 115 7.449 1.546 -0.161 925 HB2 TYR 115 2HB TYR 115 5.079 -0.193 0.543 926 HB3 TYR 115 1HB TYR 115 5.504 0.341 -1.083 927 HD1 TYR 115 HD1 TYR 115 8.008 -0.211 -1.777 928 HD2 TYR 115 HD2 TYR 115 5.798 -2.281 1.207 929 HE1 TYR 115 HE1 TYR 115 9.497 -2.150 -2.028 930 HE2 TYR 115 HE2 TYR 115 7.280 -4.226 0.965 931 HH TYR 115 HH TYR 115 10.229 -4.085 -0.748 932 H ILE 116 H ILE 116 5.490 2.360 2.490 933 HA ILE 116 HA ILE 116 3.565 3.949 1.098 934 HB ILE 116 HB ILE 116 4.464 4.132 3.981 935 HG12 ILE 116 2HG1 ILE 116 3.647 1.898 3.457 936 HG13 ILE 116 1HG1 ILE 116 2.477 2.743 4.463 937 HG21 ILE 116 1HG2 ILE 116 1.985 5.179 2.619 938 HG22 ILE 116 2HG2 ILE 116 3.291 6.137 3.318 939 HG23 ILE 116 3HG2 ILE 116 2.253 5.166 4.362 940 HD11 ILE 116 3HD1 ILE 116 2.291 2.382 1.481 941 HD12 ILE 116 1HD1 ILE 116 1.108 3.197 2.505 942 HD13 ILE 116 2HD1 ILE 116 1.394 1.467 2.694 943 H ASP 117 H ASP 117 6.814 4.411 2.189 944 HA ASP 117 HA ASP 117 6.661 7.294 1.632 945 HB2 ASP 117 2HB ASP 117 7.464 6.751 3.865 946 HB3 ASP 117 1HB ASP 117 8.699 5.691 3.195 947 H SER 118 H SER 118 7.663 4.395 0.283 948 HA SER 118 HA SER 118 10.130 4.956 -0.851 949 HB2 SER 118 2HB SER 118 9.612 3.205 -2.496 950 HB3 SER 118 1HB SER 118 9.134 2.717 -0.871 951 HG SER 118 HG SER 118 6.969 3.515 -1.508 952 HA PRO 119 HA PRO 119 9.430 8.295 -3.622 953 HB2 PRO 119 2HB PRO 119 11.456 7.637 -5.411 954 HB3 PRO 119 1HB PRO 119 11.653 8.603 -3.945 955 HG2 PRO 119 2HG PRO 119 12.212 5.710 -4.401 956 HG3 PRO 119 1HG PRO 119 13.106 6.888 -3.424 957 HD2 PRO 119 2HD PRO 119 11.498 5.068 -2.295 958 HD3 PRO 119 1HD PRO 119 11.636 6.713 -1.641 959 H GLU 120 H GLU 120 9.913 5.038 -4.954 960 HA GLU 120 HA GLU 120 8.895 5.577 -7.522 961 HB2 GLU 120 2HB GLU 120 10.242 3.587 -6.941 962 HB3 GLU 120 1HB GLU 120 8.888 2.956 -6.016 963 HG2 GLU 120 2HG GLU 120 7.555 2.771 -8.017 964 HG3 GLU 120 1HG GLU 120 8.832 3.523 -8.972 965 H TYR 121 H TYR 121 7.342 4.578 -4.524 966 HA TYR 121 HA TYR 121 4.772 4.055 -5.516 967 HB2 TYR 121 2HB TYR 121 5.369 3.429 -3.259 968 HB3 TYR 121 1HB TYR 121 5.675 5.105 -2.826 969 HD1 TYR 121 HD2 TYR 121 3.041 2.653 -3.635 970 HD2 TYR 121 HD1 TYR 121 3.897 6.550 -2.164 971 HE1 TYR 121 HE2 TYR 121 0.718 2.867 -2.862 972 HE2 TYR 121 HE1 TYR 121 1.576 6.774 -1.385 973 HH TYR 121 HH TYR 121 -0.671 5.771 -1.982 974 H THR 122 H THR 122 6.071 7.035 -4.061 975 HA THR 122 HA THR 122 3.764 8.587 -4.514 976 HB THR 122 HB THR 122 6.599 9.620 -4.314 977 HG1 THR 122 HG1 THR 122 5.038 8.307 -2.484 978 HG21 THR 122 3HG2 THR 122 5.498 11.580 -3.288 979 HG22 THR 122 1HG2 THR 122 3.925 10.842 -3.604 980 HG23 THR 122 2HG2 THR 122 4.966 11.313 -4.948 981 H ASN 123 H ASN 123 6.721 8.148 -6.402 982 HA ASN 123 HA ASN 123 6.219 10.161 -8.306 983 HB2 ASN 123 2HB ASN 123 8.440 9.170 -7.884 984 HB3 ASN 123 1HB ASN 123 7.892 7.658 -8.597 985 HD21 ASN 123 1HD2 ASN 123 8.873 10.911 -9.175 986 HD22 ASN 123 2HD2 ASN 123 9.043 10.778 -10.891 987 H SER 124 H SER 124 5.566 6.664 -8.381 988 HA SER 124 HA SER 124 4.623 6.846 -11.107 989 HB2 SER 124 2HB SER 124 4.623 4.464 -9.245 990 HB3 SER 124 1HB SER 124 4.409 4.430 -10.996 991 HG SER 124 HG SER 124 6.708 4.708 -9.489 992 H PHE 125 H PHE 125 3.184 6.190 -7.914 993 HA PHE 125 HA PHE 125 0.565 5.969 -9.207 994 HB2 PHE 125 2HB PHE 125 1.424 5.363 -6.372 995 HB3 PHE 125 1HB PHE 125 -0.217 5.176 -6.981 996 HD1 PHE 125 HD2 PHE 125 -0.625 3.531 -8.850 997 HD2 PHE 125 HD1 PHE 125 3.020 3.680 -6.659 998 HE1 PHE 125 HE2 PHE 125 -0.084 1.251 -9.601 999 HE2 PHE 125 HE1 PHE 125 3.567 1.401 -7.407 1000 HZ PHE 125 HZ PHE 125 2.014 0.181 -8.878 1001 H GLY 126 H GLY 126 2.295 7.921 -6.816 1002 HA2 GLY 126 2HA GLY 126 1.693 10.240 -6.524 1003 HA3 GLY 126 1HA GLY 126 0.030 9.805 -6.893 1004 H ASP 127 H ASP 127 -0.469 10.976 -4.900 1005 HA ASP 127 HA ASP 127 0.282 9.544 -2.450 1006 HB2 ASP 127 2HB ASP 127 -0.871 12.313 -2.822 1007 HB3 ASP 127 1HB ASP 127 -0.519 11.577 -1.262 1008 H TRP 128 H TRP 128 -2.577 11.024 -3.977 1009 HA TRP 128 HA TRP 128 -4.284 9.558 -2.118 1010 HB2 TRP 128 2HB TRP 128 -4.816 11.821 -4.033 1011 HB3 TRP 128 1HB TRP 128 -6.116 10.950 -3.223 1012 HD1 TRP 128 HD1 TRP 128 -3.203 13.337 -2.484 1013 HE1 TRP 128 HE1 TRP 128 -3.600 14.414 -0.177 1014 HE3 TRP 128 HE3 TRP 128 -7.276 10.625 -1.009 1015 HZ2 TRP 128 HZ2 TRP 128 -5.401 14.146 1.972 1016 HZ3 TRP 128 HZ3 TRP 128 -8.275 11.100 1.187 1017 HH2 TRP 128 HH2 TRP 128 -7.356 12.824 2.645 1018 H VAL 129 H VAL 129 -2.838 8.652 -4.754 1019 HA VAL 129 HA VAL 129 -5.159 7.536 -6.139 1020 HB VAL 129 HB VAL 129 -2.228 7.405 -6.875 1021 HG11 VAL 129 1HG1 VAL 129 -3.471 5.515 -7.759 1022 HG12 VAL 129 2HG1 VAL 129 -3.038 6.623 -9.060 1023 HG13 VAL 129 3HG1 VAL 129 -4.686 6.602 -8.432 1024 HG21 VAL 129 3HG2 VAL 129 -3.320 9.682 -6.948 1025 HG22 VAL 129 1HG2 VAL 129 -4.365 9.043 -8.215 1026 HG23 VAL 129 2HG2 VAL 129 -2.621 9.109 -8.462 1027 H VAL 130 H VAL 130 -5.772 5.496 -5.856 1028 HA VAL 130 HA VAL 130 -4.450 3.780 -3.998 1029 HB VAL 130 HB VAL 130 -6.674 3.167 -5.960 1030 HG11 VAL 130 1HG1 VAL 130 -7.165 1.253 -4.502 1031 HG12 VAL 130 2HG1 VAL 130 -5.735 1.626 -3.540 1032 HG13 VAL 130 3HG1 VAL 130 -5.562 1.133 -5.224 1033 HG21 VAL 130 3HG2 VAL 130 -8.165 3.450 -4.041 1034 HG22 VAL 130 1HG2 VAL 130 -7.270 4.930 -4.385 1035 HG23 VAL 130 2HG2 VAL 130 -6.789 3.901 -3.036 1036 HA PRO 131 HA PRO 131 -1.551 2.052 -6.946 1037 HB2 PRO 131 2HB PRO 131 -1.138 0.002 -4.882 1038 HB3 PRO 131 1HB PRO 131 0.016 1.146 -5.570 1039 HG2 PRO 131 2HG PRO 131 -0.914 1.370 -3.050 1040 HG3 PRO 131 1HG PRO 131 -0.493 2.782 -4.035 1041 HD2 PRO 131 2HD PRO 131 -3.182 1.650 -3.392 1042 HD3 PRO 131 1HD PRO 131 -2.675 3.346 -3.538 1043 H TYR 132 H TYR 132 -2.778 1.150 -8.532 1044 HA TYR 132 HA TYR 132 -4.450 -1.140 -7.937 1045 HB2 TYR 132 2HB TYR 132 -5.365 -0.861 -10.152 1046 HB3 TYR 132 1HB TYR 132 -5.295 0.712 -9.371 1047 HD1 TYR 132 HD1 TYR 132 -3.173 2.171 -9.953 1048 HD2 TYR 132 HD2 TYR 132 -4.550 -1.104 -12.295 1049 HE1 TYR 132 HE1 TYR 132 -1.971 3.063 -11.908 1050 HE2 TYR 132 HE2 TYR 132 -3.356 -0.219 -14.248 1051 HH TYR 132 HH TYR 132 -2.562 2.253 -14.961 1052 H TYR 133 H TYR 133 -3.976 -3.177 -8.383 1053 HA TYR 133 HA TYR 133 -1.478 -4.079 -9.209 1054 HB2 TYR 133 2HB TYR 133 -3.084 -5.531 -8.069 1055 HB3 TYR 133 1HB TYR 133 -4.176 -5.445 -9.444 1056 HD1 TYR 133 HD1 TYR 133 -0.525 -6.190 -9.036 1057 HD2 TYR 133 HD2 TYR 133 -4.288 -7.448 -10.573 1058 HE1 TYR 133 HE1 TYR 133 0.535 -8.199 -9.975 1059 HE2 TYR 133 HE2 TYR 133 -3.233 -9.457 -11.520 1060 HH TYR 133 HH TYR 133 -1.127 -10.318 -12.144 1061 H ARG 134 H ARG 134 -0.495 -4.107 -11.130 1062 HA ARG 134 HA ARG 134 -1.648 -2.707 -13.284 1063 HB2 ARG 134 2HB ARG 134 0.703 -4.561 -13.578 1064 HB3 ARG 134 1HB ARG 134 0.350 -3.103 -14.488 1065 HG2 ARG 134 2HG ARG 134 1.287 -3.307 -11.640 1066 HG3 ARG 134 1HG ARG 134 2.160 -2.647 -13.019 1067 HD2 ARG 134 2HD ARG 134 -0.244 -1.492 -11.623 1068 HD3 ARG 134 1HD ARG 134 1.381 -0.826 -11.696 1069 HE ARG 134 HE ARG 134 -0.682 -0.291 -13.479 1070 HH11 ARG 134 1HH1 ARG 134 2.674 -1.304 -13.762 1071 HH12 ARG 134 2HH1 ARG 134 2.955 -0.359 -15.184 1072 HH21 ARG 134 1HH2 ARG 134 -0.283 0.962 -15.332 1073 HH22 ARG 134 2HH2 ARG 134 1.289 0.915 -16.084 1074 H GLY 135 H GLY 135 -1.815 -6.016 -12.420 1075 HA2 GLY 135 2HA GLY 135 -2.777 -7.841 -13.446 1076 HA3 GLY 135 1HA GLY 135 -3.500 -6.716 -14.593 1077 H LEU 136 H LEU 136 -0.206 -7.702 -13.775 1078 HA LEU 136 HA LEU 136 1.585 -8.311 -15.005 1079 HB2 LEU 136 2HB LEU 136 -0.452 -8.848 -17.164 1080 HB3 LEU 136 1HB LEU 136 1.257 -9.217 -17.307 1081 HG LEU 136 HG LEU 136 -0.563 -10.389 -15.209 1082 HD11 LEU 136 1HD1 LEU 136 -1.215 -11.129 -17.446 1083 HD12 LEU 136 2HD1 LEU 136 -0.477 -12.442 -16.527 1084 HD13 LEU 136 3HD1 LEU 136 0.451 -11.608 -17.775 1085 HD21 LEU 136 3HD2 LEU 136 2.245 -11.096 -16.045 1086 HD22 LEU 136 1HD2 LEU 136 1.275 -11.965 -14.855 1087 HD23 LEU 136 2HD2 LEU 136 1.777 -10.302 -14.540 1088 H GLU 137 H GLU 137 3.053 -7.399 -16.456 1089 HA GLU 137 HA GLU 137 2.596 -4.623 -16.911 1090 HB2 GLU 137 2HB GLU 137 4.888 -6.480 -17.370 1091 HB3 GLU 137 1HB GLU 137 4.886 -4.917 -18.177 1092 HG2 GLU 137 2HG GLU 137 4.689 -5.377 -15.213 1093 HG3 GLU 137 1HG GLU 137 6.119 -4.828 -16.092 1094 H HIS 138 H HIS 138 1.309 -3.966 -18.456 1095 HA HIS 138 HA HIS 138 0.912 -5.475 -20.878 1096 HB2 HIS 138 2HB HIS 138 -0.124 -2.710 -20.198 1097 HB3 HIS 138 1HB HIS 138 -0.714 -3.770 -21.472 1098 HD1 HIS 138 HD1 HIS 138 -2.125 -5.867 -20.705 1099 HD2 HIS 138 HD2 HIS 138 -1.169 -3.161 -17.692 1100 HE1 HIS 138 HE1 HIS 138 -3.645 -6.426 -18.776 1101 HE2 HIS 138 HE2 HIS 138 -2.871 -4.931 -16.896 1102 H HIS 139 H HIS 139 1.918 -5.184 -22.756 1103 HA HIS 139 HA HIS 139 4.160 -3.492 -22.972 1104 HB2 HIS 139 2HB HIS 139 2.570 -4.960 -25.087 1105 HB3 HIS 139 1HB HIS 139 4.082 -4.118 -25.411 1106 HD1 HIS 139 HD1 HIS 139 2.710 -7.275 -24.058 1107 HD2 HIS 139 HD2 HIS 139 6.384 -5.328 -24.213 1108 HE1 HIS 139 HE1 HIS 139 4.425 -9.014 -23.469 1109 HE2 HIS 139 HE2 HIS 139 6.652 -7.859 -23.721 1110 H HIS 140 H HIS 140 4.440 -1.509 -23.858 1111 HA HIS 140 HA HIS 140 2.493 0.385 -23.543 1112 HB2 HIS 140 2HB HIS 140 5.066 0.342 -25.028 1113 HB3 HIS 140 1HB HIS 140 3.984 1.703 -25.301 1114 HD1 HIS 140 HD1 HIS 140 4.402 3.600 -23.802 1115 HD2 HIS 140 HD2 HIS 140 5.447 -0.017 -22.036 1116 HE1 HIS 140 HE1 HIS 140 5.332 4.192 -21.540 1117 HE2 HIS 140 HE2 HIS 140 5.760 1.975 -20.413 1118 H HIS 141 H HIS 141 0.586 0.454 -24.439 1119 HA HIS 141 HA HIS 141 0.174 1.236 -27.095 1120 HB2 HIS 141 2HB HIS 141 0.723 -1.379 -27.204 1121 HB3 HIS 141 1HB HIS 141 -0.982 -1.501 -26.787 1122 HD1 HIS 141 HD1 HIS 141 0.957 -1.754 -29.617 1123 HD2 HIS 141 HD2 HIS 141 -2.403 0.538 -28.737 1124 HE1 HIS 141 HE1 HIS 141 -0.042 -1.126 -31.838 1125 HE2 HIS 141 HE2 HIS 141 -1.977 0.388 -31.287 1126 H HIS 142 H HIS 142 -0.949 -0.089 -24.108 1127 HA HIS 142 HA HIS 142 -3.713 0.681 -24.609 1128 HB2 HIS 142 2HB HIS 142 -2.645 -1.364 -23.163 1129 HB3 HIS 142 1HB HIS 142 -2.909 -0.173 -21.894 1130 HD1 HIS 142 HD1 HIS 142 -5.072 -0.578 -20.772 1131 HD2 HIS 142 HD2 HIS 142 -5.247 -1.453 -24.835 1132 HE1 HIS 142 HE1 HIS 142 -7.431 -1.325 -21.208 1133 HE2 HIS 142 HE2 HIS 142 -7.549 -1.744 -23.689 1134 H HIS 143 H HIS 143 -4.609 2.518 -23.898 1135 HA HIS 143 HA HIS 143 -2.896 4.319 -22.305 1136 HB2 HIS 143 2HB HIS 143 -3.315 4.875 -24.776 1137 HB3 HIS 143 1HB HIS 143 -4.976 5.206 -24.304 1138 HD1 HIS 143 HD1 HIS 143 -2.349 7.090 -25.234 1139 HD2 HIS 143 HD2 HIS 143 -4.516 7.057 -21.688 1140 HE1 HIS 143 HE1 HIS 143 -2.018 9.367 -24.215 1141 HE2 HIS 143 HE2 HIS 143 -3.240 9.283 -22.012 Start of MODEL 16 1 H1 MET 1 1H MET 1 -9.344 2.041 -15.757 2 H2 MET 1 2H MET 1 -7.746 2.599 -15.875 3 H3 MET 1 3H MET 1 -8.923 3.170 -16.952 4 HA MET 1 HA MET 1 -8.430 4.815 -15.288 5 HB2 MET 1 2HB MET 1 -10.713 4.716 -16.165 6 HB3 MET 1 1HB MET 1 -11.150 3.527 -14.946 7 HG2 MET 1 2HG MET 1 -11.976 5.715 -14.338 8 HG3 MET 1 1HG MET 1 -10.751 5.179 -13.190 9 HE1 MET 1 3HE MET 1 -10.196 9.046 -13.240 10 HE2 MET 1 1HE MET 1 -10.490 7.626 -12.237 11 HE3 MET 1 2HE MET 1 -11.735 8.191 -13.351 12 HA PRO 2 HA PRO 2 -7.414 2.929 -11.351 13 HB2 PRO 2 2HB PRO 2 -6.107 5.379 -10.629 14 HB3 PRO 2 1HB PRO 2 -5.365 3.858 -11.124 15 HG2 PRO 2 2HG PRO 2 -5.290 6.195 -12.594 16 HG3 PRO 2 1HG PRO 2 -5.057 4.571 -13.262 17 HD2 PRO 2 2HD PRO 2 -7.493 6.305 -13.286 18 HD3 PRO 2 1HD PRO 2 -6.864 5.222 -14.547 19 H VAL 3 H VAL 3 -8.012 3.297 -9.178 20 HA VAL 3 HA VAL 3 -10.297 5.044 -8.847 21 HB VAL 3 HB VAL 3 -9.005 3.213 -6.814 22 HG11 VAL 3 1HG1 VAL 3 -10.407 4.951 -5.824 23 HG12 VAL 3 2HG1 VAL 3 -11.133 3.355 -5.636 24 HG13 VAL 3 3HG1 VAL 3 -11.747 4.464 -6.862 25 HG21 VAL 3 3HG2 VAL 3 -9.743 1.938 -8.751 26 HG22 VAL 3 1HG2 VAL 3 -11.339 2.683 -8.649 27 HG23 VAL 3 2HG2 VAL 3 -10.779 1.618 -7.360 28 H GLU 4 H GLU 4 -10.118 7.058 -8.130 29 HA GLU 4 HA GLU 4 -7.752 7.776 -6.527 30 HB2 GLU 4 2HB GLU 4 -7.518 8.555 -8.861 31 HB3 GLU 4 1HB GLU 4 -9.031 9.438 -8.706 32 HG2 GLU 4 2HG GLU 4 -7.996 10.770 -6.882 33 HG3 GLU 4 1HG GLU 4 -6.470 9.950 -7.210 34 H LEU 5 H LEU 5 -8.121 9.004 -4.763 35 HA LEU 5 HA LEU 5 -10.865 9.999 -4.362 36 HB2 LEU 5 2HB LEU 5 -9.992 8.342 -2.696 37 HB3 LEU 5 1HB LEU 5 -8.736 9.491 -2.277 38 HG LEU 5 HG LEU 5 -10.572 11.106 -1.639 39 HD11 LEU 5 1HD1 LEU 5 -12.280 8.626 -1.796 40 HD12 LEU 5 2HD1 LEU 5 -12.367 9.997 -2.904 41 HD13 LEU 5 3HD1 LEU 5 -12.774 10.211 -1.201 42 HD21 LEU 5 3HD2 LEU 5 -9.265 9.827 -0.000 43 HD22 LEU 5 1HD2 LEU 5 -10.443 8.518 -0.099 44 HD23 LEU 5 2HD2 LEU 5 -10.925 10.093 0.532 45 H ARG 6 H ARG 6 -10.807 12.015 -5.201 46 HA ARG 6 HA ARG 6 -8.564 13.756 -4.466 47 HB2 ARG 6 2HB ARG 6 -9.328 15.194 -6.352 48 HB3 ARG 6 1HB ARG 6 -8.844 13.579 -6.853 49 HG2 ARG 6 2HG ARG 6 -11.194 12.913 -6.967 50 HG3 ARG 6 1HG ARG 6 -11.675 14.536 -6.472 51 HD2 ARG 6 2HD ARG 6 -10.592 15.454 -8.477 52 HD3 ARG 6 1HD ARG 6 -10.151 13.820 -8.976 53 HE ARG 6 HE ARG 6 -12.673 13.426 -8.943 54 HH11 ARG 6 1HH1 ARG 6 -11.167 16.487 -9.790 55 HH12 ARG 6 2HH1 ARG 6 -12.511 16.998 -10.771 56 HH21 ARG 6 1HH2 ARG 6 -14.403 14.102 -10.241 57 HH22 ARG 6 2HH2 ARG 6 -14.358 15.670 -10.999 58 H ALA 7 H ALA 7 -9.179 16.109 -4.201 59 HA ALA 7 HA ALA 7 -11.017 16.274 -2.024 60 HB1 ALA 7 3HB ALA 7 -10.326 18.585 -1.859 61 HB2 ALA 7 1HB ALA 7 -9.577 18.501 -3.454 62 HB3 ALA 7 2HB ALA 7 -8.922 17.550 -2.119 63 H ASN 8 H ASN 8 -12.490 15.454 -4.143 64 HA ASN 8 HA ASN 8 -14.542 17.490 -4.265 65 HB2 ASN 8 2HB ASN 8 -12.989 16.601 -6.660 66 HB3 ASN 8 1HB ASN 8 -14.724 16.841 -6.845 67 HD21 ASN 8 1HD2 ASN 8 -14.943 18.997 -4.985 68 HD22 ASN 8 2HD2 ASN 8 -14.203 20.377 -5.714 69 H TRP 9 H TRP 9 -14.060 14.892 -3.054 70 HA TRP 9 HA TRP 9 -15.471 12.944 -4.635 71 HB2 TRP 9 2HB TRP 9 -15.047 11.428 -2.708 72 HB3 TRP 9 1HB TRP 9 -13.587 12.165 -3.353 73 HD1 TRP 9 HD1 TRP 9 -12.229 13.800 -1.771 74 HE1 TRP 9 HE1 TRP 9 -12.319 14.256 0.759 75 HE3 TRP 9 HE3 TRP 9 -16.725 11.598 -0.699 76 HZ2 TRP 9 HZ2 TRP 9 -14.062 13.760 2.922 77 HZ3 TRP 9 HZ3 TRP 9 -17.526 11.632 1.627 78 HH2 TRP 9 HH2 TRP 9 -16.222 12.690 3.400 79 H SER 10 H SER 10 -17.457 12.128 -4.292 80 HA SER 10 HA SER 10 -19.159 13.378 -2.284 81 HB2 SER 10 2HB SER 10 -19.880 11.297 -4.368 82 HB3 SER 10 1HB SER 10 -20.994 12.305 -3.442 83 HG SER 10 HG SER 10 -20.177 12.874 -5.769 84 H GLU 11 H GLU 11 -20.464 11.876 -0.861 85 HA GLU 11 HA GLU 11 -18.774 10.083 0.489 86 HB2 GLU 11 2HB GLU 11 -20.729 11.169 1.542 87 HB3 GLU 11 1HB GLU 11 -21.796 10.166 0.565 88 HG2 GLU 11 2HG GLU 11 -20.852 8.164 1.626 89 HG3 GLU 11 1HG GLU 11 -19.838 9.192 2.634 90 H GLU 12 H GLU 12 -21.204 9.578 -2.004 91 HA GLU 12 HA GLU 12 -21.259 6.786 -2.044 92 HB2 GLU 12 2HB GLU 12 -22.792 8.244 -3.328 93 HB3 GLU 12 1HB GLU 12 -21.463 8.681 -4.394 94 HG2 GLU 12 2HG GLU 12 -21.264 6.286 -5.020 95 HG3 GLU 12 1HG GLU 12 -22.716 5.966 -4.071 96 H ASP 13 H ASP 13 -19.019 9.067 -3.558 97 HA ASP 13 HA ASP 13 -17.544 7.078 -4.978 98 HB2 ASP 13 2HB ASP 13 -16.961 9.957 -4.301 99 HB3 ASP 13 1HB ASP 13 -15.808 8.941 -5.160 100 H LEU 14 H LEU 14 -17.298 8.539 -1.804 101 HA LEU 14 HA LEU 14 -14.778 7.531 -1.048 102 HB2 LEU 14 2HB LEU 14 -16.561 9.096 0.175 103 HB3 LEU 14 1HB LEU 14 -17.033 7.584 0.917 104 HG LEU 14 HG LEU 14 -15.542 8.691 2.411 105 HD11 LEU 14 1HD1 LEU 14 -13.756 7.108 2.682 106 HD12 LEU 14 2HD1 LEU 14 -13.933 6.570 1.012 107 HD13 LEU 14 3HD1 LEU 14 -15.218 6.255 2.181 108 HD21 LEU 14 3HD2 LEU 14 -13.287 9.374 1.787 109 HD22 LEU 14 1HD2 LEU 14 -14.508 10.224 0.840 110 HD23 LEU 14 2HD2 LEU 14 -13.601 8.893 0.119 111 H GLU 15 H GLU 15 -18.039 6.163 -0.898 112 HA GLU 15 HA GLU 15 -17.359 3.674 0.223 113 HB2 GLU 15 2HB GLU 15 -19.642 4.377 -1.637 114 HB3 GLU 15 1HB GLU 15 -19.528 2.903 -0.684 115 HG2 GLU 15 2HG GLU 15 -19.582 4.226 1.369 116 HG3 GLU 15 1HG GLU 15 -19.697 5.702 0.412 117 H THR 16 H THR 16 -17.330 4.863 -3.088 118 HA THR 16 HA THR 16 -16.905 2.421 -4.404 119 HB THR 16 HB THR 16 -15.762 5.098 -5.224 120 HG1 THR 16 HG1 THR 16 -18.383 4.115 -5.187 121 HG21 THR 16 3HG2 THR 16 -16.602 2.678 -6.823 122 HG22 THR 16 1HG2 THR 16 -14.945 3.198 -6.525 123 HG23 THR 16 2HG2 THR 16 -16.023 4.201 -7.498 124 H VAL 17 H VAL 17 -14.649 4.743 -2.969 125 HA VAL 17 HA VAL 17 -12.262 3.517 -3.798 126 HB VAL 17 HB VAL 17 -12.749 5.208 -1.339 127 HG11 VAL 17 1HG1 VAL 17 -10.666 3.926 -1.194 128 HG12 VAL 17 2HG1 VAL 17 -10.355 5.653 -1.382 129 HG13 VAL 17 3HG1 VAL 17 -10.166 4.569 -2.759 130 HG21 VAL 17 3HG2 VAL 17 -11.882 7.048 -2.730 131 HG22 VAL 17 1HG2 VAL 17 -13.376 6.369 -3.375 132 HG23 VAL 17 2HG2 VAL 17 -11.829 5.955 -4.113 133 H ILE 18 H ILE 18 -13.983 3.259 -0.672 134 HA ILE 18 HA ILE 18 -12.146 1.435 0.438 135 HB ILE 18 HB ILE 18 -13.881 0.921 2.121 136 HG12 ILE 18 2HG1 ILE 18 -15.608 2.832 0.531 137 HG13 ILE 18 1HG1 ILE 18 -15.850 1.092 0.615 138 HG21 ILE 18 1HG2 ILE 18 -13.486 3.843 1.500 139 HG22 ILE 18 2HG2 ILE 18 -12.412 2.812 2.447 140 HG23 ILE 18 3HG2 ILE 18 -14.025 3.197 3.050 141 HD11 ILE 18 3HD1 ILE 18 -17.382 2.254 2.083 142 HD12 ILE 18 1HD1 ILE 18 -16.032 3.018 2.921 143 HD13 ILE 18 2HD1 ILE 18 -16.256 1.272 3.020 144 H ARG 19 H ARG 19 -15.123 0.933 -1.401 145 HA ARG 19 HA ARG 19 -15.157 -1.891 -1.002 146 HB2 ARG 19 2HB ARG 19 -16.621 -0.038 -2.855 147 HB3 ARG 19 1HB ARG 19 -16.773 -1.784 -3.014 148 HG2 ARG 19 2HG ARG 19 -17.186 -0.576 -0.330 149 HG3 ARG 19 1HG ARG 19 -18.447 -0.373 -1.547 150 HD2 ARG 19 2HD ARG 19 -18.578 -2.396 0.047 151 HD3 ARG 19 1HD ARG 19 -18.870 -2.652 -1.669 152 HE ARG 19 HE ARG 19 -16.539 -3.492 -1.788 153 HH11 ARG 19 1HH1 ARG 19 -18.083 -3.376 1.352 154 HH12 ARG 19 2HH1 ARG 19 -17.234 -4.764 1.969 155 HH21 ARG 19 1HH2 ARG 19 -15.438 -5.336 -1.007 156 HH22 ARG 19 2HH2 ARG 19 -15.752 -5.896 0.609 157 H ALA 20 H ALA 20 -13.462 0.186 -3.156 158 HA ALA 20 HA ALA 20 -12.838 -1.848 -5.084 159 HB1 ALA 20 3HB ALA 20 -12.782 0.500 -5.724 160 HB2 ALA 20 1HB ALA 20 -11.194 -0.237 -5.935 161 HB3 ALA 20 2HB ALA 20 -11.504 0.807 -4.548 162 H VAL 21 H VAL 21 -11.323 -0.495 -2.205 163 HA VAL 21 HA VAL 21 -8.890 -1.949 -2.421 164 HB VAL 21 HB VAL 21 -10.166 -0.761 0.053 165 HG11 VAL 21 1HG1 VAL 21 -8.444 -2.413 0.584 166 HG12 VAL 21 2HG1 VAL 21 -7.907 -0.781 0.983 167 HG13 VAL 21 3HG1 VAL 21 -7.308 -1.574 -0.474 168 HG21 VAL 21 3HG2 VAL 21 -8.716 1.160 -0.348 169 HG22 VAL 21 1HG2 VAL 21 -9.803 0.898 -1.714 170 HG23 VAL 21 2HG2 VAL 21 -8.112 0.408 -1.824 171 H TYR 22 H TYR 22 -11.923 -2.504 -0.659 172 HA TYR 22 HA TYR 22 -11.008 -5.060 0.336 173 HB2 TYR 22 2HB TYR 22 -13.783 -3.847 0.381 174 HB3 TYR 22 1HB TYR 22 -13.278 -5.286 1.255 175 HD1 TYR 22 HD1 TYR 22 -10.715 -4.509 2.399 176 HD2 TYR 22 HD2 TYR 22 -14.288 -2.242 1.962 177 HE1 TYR 22 HE1 TYR 22 -10.064 -3.119 4.321 178 HE2 TYR 22 HE2 TYR 22 -13.646 -0.847 3.880 179 HH TYR 22 HH TYR 22 -10.537 -0.860 5.201 180 H ARG 23 H ARG 23 -11.914 -3.995 -2.583 181 HA ARG 23 HA ARG 23 -12.386 -4.955 -4.558 182 HB2 ARG 23 2HB ARG 23 -12.156 -7.587 -3.096 183 HB3 ARG 23 1HB ARG 23 -12.170 -7.373 -4.840 184 HG2 ARG 23 2HG ARG 23 -10.108 -5.948 -4.561 185 HG3 ARG 23 1HG ARG 23 -10.053 -6.518 -2.891 186 HD2 ARG 23 2HD ARG 23 -8.615 -7.929 -4.147 187 HD3 ARG 23 1HD ARG 23 -10.073 -8.861 -3.806 188 HE ARG 23 HE ARG 23 -10.004 -7.466 -6.356 189 HH11 ARG 23 1HH1 ARG 23 -9.534 -10.484 -4.632 190 HH12 ARG 23 2HH1 ARG 23 -9.604 -11.457 -6.078 191 HH21 ARG 23 1HH2 ARG 23 -10.096 -8.726 -8.226 192 HH22 ARG 23 2HH2 ARG 23 -9.920 -10.458 -8.128 193 H GLN 24 H GLN 24 -14.006 -6.218 -5.758 194 HA GLN 24 HA GLN 24 -16.585 -6.041 -4.392 195 HB2 GLN 24 2HB GLN 24 -16.273 -4.787 -6.514 196 HB3 GLN 24 1HB GLN 24 -15.992 -6.307 -7.346 197 HG2 GLN 24 2HG GLN 24 -18.260 -5.474 -7.694 198 HG3 GLN 24 1HG GLN 24 -18.252 -7.029 -6.863 199 HE21 GLN 24 1HE2 GLN 24 -19.001 -7.163 -4.789 200 HE22 GLN 24 2HE2 GLN 24 -19.806 -5.863 -3.985 201 H VAL 25 H VAL 25 -16.085 -8.024 -3.237 202 HA VAL 25 HA VAL 25 -15.961 -10.513 -4.645 203 HB VAL 25 HB VAL 25 -16.727 -10.002 -1.760 204 HG11 VAL 25 1HG1 VAL 25 -15.746 -12.508 -3.122 205 HG12 VAL 25 2HG1 VAL 25 -17.384 -12.212 -2.539 206 HG13 VAL 25 3HG1 VAL 25 -16.047 -12.326 -1.394 207 HG21 VAL 25 3HG2 VAL 25 -14.526 -9.074 -2.288 208 HG22 VAL 25 1HG2 VAL 25 -14.022 -10.632 -2.941 209 HG23 VAL 25 2HG2 VAL 25 -14.393 -10.473 -1.224 210 H LEU 26 H LEU 26 -18.454 -8.896 -2.733 211 HA LEU 26 HA LEU 26 -20.606 -9.434 -4.443 212 HB2 LEU 26 2HB LEU 26 -20.006 -11.776 -3.460 213 HB3 LEU 26 1HB LEU 26 -20.699 -11.163 -1.975 214 HG LEU 26 HG LEU 26 -22.249 -12.576 -3.294 215 HD11 LEU 26 1HD1 LEU 26 -24.189 -11.112 -3.136 216 HD12 LEU 26 2HD1 LEU 26 -23.126 -9.711 -2.995 217 HD13 LEU 26 3HD1 LEU 26 -23.138 -10.940 -1.731 218 HD21 LEU 26 3HD2 LEU 26 -23.226 -11.722 -5.342 219 HD22 LEU 26 1HD2 LEU 26 -21.483 -11.922 -5.520 220 HD23 LEU 26 2HD2 LEU 26 -22.167 -10.314 -5.280 221 H GLY 27 H GLY 27 -19.751 -9.397 -1.022 222 HA2 GLY 27 2HA GLY 27 -20.458 -6.814 -0.386 223 HA3 GLY 27 1HA GLY 27 -21.929 -7.764 -0.184 224 H ASN 28 H ASN 28 -21.103 -10.092 0.737 225 HA ASN 28 HA ASN 28 -19.245 -9.636 2.961 226 HB2 ASN 28 2HB ASN 28 -20.635 -10.953 4.461 227 HB3 ASN 28 1HB ASN 28 -21.583 -9.613 3.828 228 HD21 ASN 28 1HD2 ASN 28 -22.373 -12.205 4.951 229 HD22 ASN 28 2HD2 ASN 28 -23.380 -12.946 3.741 230 H ASP 29 H ASP 29 -18.872 -12.078 3.936 231 HA ASP 29 HA ASP 29 -18.272 -13.739 1.572 232 HB2 ASP 29 2HB ASP 29 -16.272 -12.647 2.659 233 HB3 ASP 29 1HB ASP 29 -16.617 -13.596 4.102 234 H TYR 30 H TYR 30 -20.499 -13.634 3.625 235 HA TYR 30 HA TYR 30 -21.926 -15.083 4.618 236 HB2 TYR 30 2HB TYR 30 -20.044 -17.180 3.530 237 HB3 TYR 30 1HB TYR 30 -21.524 -17.560 4.404 238 HD1 TYR 30 HD2 TYR 30 -20.166 -16.083 1.308 239 HD2 TYR 30 HD1 TYR 30 -23.652 -17.405 3.350 240 HE1 TYR 30 HE2 TYR 30 -21.435 -15.965 -0.794 241 HE2 TYR 30 HE1 TYR 30 -24.931 -17.295 1.255 242 HH TYR 30 HH TYR 30 -24.898 -16.345 -0.882 243 H VAL 31 H VAL 31 -18.598 -16.214 5.189 244 HA VAL 31 HA VAL 31 -19.124 -16.959 7.903 245 HB VAL 31 HB VAL 31 -16.434 -16.469 6.605 246 HG11 VAL 31 1HG1 VAL 31 -15.594 -18.045 8.268 247 HG12 VAL 31 2HG1 VAL 31 -17.212 -18.191 8.954 248 HG13 VAL 31 3HG1 VAL 31 -16.354 -16.653 9.037 249 HG21 VAL 31 3HG2 VAL 31 -17.733 -18.034 5.263 250 HG22 VAL 31 1HG2 VAL 31 -18.045 -19.014 6.696 251 HG23 VAL 31 2HG2 VAL 31 -16.401 -18.851 6.080 252 H MET 32 H MET 32 -18.209 -15.942 9.776 253 HA MET 32 HA MET 32 -18.586 -13.150 9.859 254 HB2 MET 32 2HB MET 32 -17.329 -15.038 11.850 255 HB3 MET 32 1HB MET 32 -17.638 -13.339 12.177 256 HG2 MET 32 2HG MET 32 -20.027 -13.714 11.840 257 HG3 MET 32 1HG MET 32 -19.711 -15.420 11.526 258 HE1 MET 32 3HE MET 32 -21.484 -16.072 13.405 259 HE2 MET 32 1HE MET 32 -21.785 -14.362 13.717 260 HE3 MET 32 2HE MET 32 -21.428 -15.454 15.056 261 H ALA 33 H ALA 33 -17.253 -11.996 8.583 262 HA ALA 33 HA ALA 33 -14.364 -12.190 9.136 263 HB1 ALA 33 3HB ALA 33 -15.770 -10.982 6.751 264 HB2 ALA 33 1HB ALA 33 -14.931 -12.533 6.787 265 HB3 ALA 33 2HB ALA 33 -14.025 -11.034 6.997 266 H SER 34 H SER 34 -17.167 -10.340 9.509 267 HA SER 34 HA SER 34 -17.619 -8.477 10.696 268 HB2 SER 34 2HB SER 34 -14.645 -8.413 11.220 269 HB3 SER 34 1HB SER 34 -15.813 -7.324 11.968 270 HG SER 34 HG SER 34 -16.626 -8.943 13.130 271 H GLU 35 H GLU 35 -14.777 -8.129 8.604 272 HA GLU 35 HA GLU 35 -14.099 -6.481 7.190 273 HB2 GLU 35 2HB GLU 35 -16.286 -7.065 6.124 274 HB3 GLU 35 1HB GLU 35 -17.049 -5.801 7.073 275 HG2 GLU 35 2HG GLU 35 -15.674 -4.126 5.941 276 HG3 GLU 35 1HG GLU 35 -14.909 -5.402 4.993 277 H ARG 36 H ARG 36 -13.066 -5.564 9.072 278 HA ARG 36 HA ARG 36 -14.481 -3.412 10.440 279 HB2 ARG 36 2HB ARG 36 -11.787 -4.645 11.041 280 HB3 ARG 36 1HB ARG 36 -12.626 -3.471 12.043 281 HG2 ARG 36 2HG ARG 36 -14.468 -5.135 12.314 282 HG3 ARG 36 1HG ARG 36 -13.449 -6.306 11.472 283 HD2 ARG 36 2HD ARG 36 -11.688 -5.900 13.190 284 HD3 ARG 36 1HD ARG 36 -12.846 -4.904 14.069 285 HE ARG 36 HE ARG 36 -13.256 -7.776 13.526 286 HH11 ARG 36 1HH1 ARG 36 -13.516 -4.969 15.607 287 HH12 ARG 36 2HH1 ARG 36 -14.176 -5.869 16.943 288 HH21 ARG 36 1HH2 ARG 36 -14.117 -8.953 15.268 289 HH22 ARG 36 2HH2 ARG 36 -14.524 -8.137 16.745 290 H LEU 37 H LEU 37 -11.462 -2.583 11.004 291 HA LEU 37 HA LEU 37 -10.123 -0.866 10.395 292 HB2 LEU 37 2HB LEU 37 -11.043 -1.669 7.641 293 HB3 LEU 37 1HB LEU 37 -9.841 -0.422 7.927 294 HG LEU 37 HG LEU 37 -9.589 -3.322 8.733 295 HD11 LEU 37 1HD1 LEU 37 -7.856 -3.412 7.014 296 HD12 LEU 37 2HD1 LEU 37 -8.222 -1.748 6.558 297 HD13 LEU 37 3HD1 LEU 37 -9.431 -3.011 6.328 298 HD21 LEU 37 3HD2 LEU 37 -7.644 -1.027 8.960 299 HD22 LEU 37 1HD2 LEU 37 -7.273 -2.719 9.295 300 HD23 LEU 37 2HD2 LEU 37 -8.443 -1.858 10.294 301 H VAL 38 H VAL 38 -12.948 -0.497 11.022 302 HA VAL 38 HA VAL 38 -14.089 1.586 9.536 303 HB VAL 38 HB VAL 38 -15.451 2.045 11.549 304 HG11 VAL 38 1HG1 VAL 38 -15.130 -0.884 10.909 305 HG12 VAL 38 2HG1 VAL 38 -16.095 0.277 9.998 306 HG13 VAL 38 3HG1 VAL 38 -16.544 -0.136 11.652 307 HG21 VAL 38 3HG2 VAL 38 -13.696 -0.035 12.857 308 HG22 VAL 38 1HG2 VAL 38 -15.171 0.644 13.549 309 HG23 VAL 38 2HG2 VAL 38 -13.771 1.678 13.270 310 H SER 39 H SER 39 -11.598 1.546 11.950 311 HA SER 39 HA SER 39 -11.552 4.271 12.630 312 HB2 SER 39 2HB SER 39 -9.147 2.446 12.439 313 HB3 SER 39 1HB SER 39 -9.372 3.829 13.513 314 HG SER 39 HG SER 39 -10.383 2.588 14.867 315 H ALA 40 H ALA 40 -9.973 2.431 10.049 316 HA ALA 40 HA ALA 40 -8.582 4.687 8.981 317 HB1 ALA 40 3HB ALA 40 -8.029 3.202 7.121 318 HB2 ALA 40 1HB ALA 40 -9.184 2.012 7.720 319 HB3 ALA 40 2HB ALA 40 -7.751 2.406 8.671 320 H GLU 41 H GLU 41 -11.606 3.028 8.305 321 HA GLU 41 HA GLU 41 -12.349 4.332 5.951 322 HB2 GLU 41 2HB GLU 41 -13.519 2.369 6.892 323 HB3 GLU 41 1HB GLU 41 -14.130 3.370 8.201 324 HG2 GLU 41 2HG GLU 41 -15.257 4.783 6.464 325 HG3 GLU 41 1HG GLU 41 -14.799 3.563 5.279 326 H SER 42 H SER 42 -12.948 5.220 9.338 327 HA SER 42 HA SER 42 -14.437 7.551 8.694 328 HB2 SER 42 2HB SER 42 -13.940 8.112 11.161 329 HB3 SER 42 1HB SER 42 -14.877 6.659 10.819 330 HG SER 42 HG SER 42 -13.120 5.409 11.249 331 H LEU 43 H LEU 43 -11.043 7.024 9.638 332 HA LEU 43 HA LEU 43 -10.287 9.732 9.609 333 HB2 LEU 43 2HB LEU 43 -8.657 7.251 9.081 334 HB3 LEU 43 1HB LEU 43 -7.969 8.857 9.250 335 HG LEU 43 HG LEU 43 -9.483 7.354 11.386 336 HD11 LEU 43 1HD1 LEU 43 -7.273 6.427 10.991 337 HD12 LEU 43 2HD1 LEU 43 -7.317 7.290 12.529 338 HD13 LEU 43 3HD1 LEU 43 -6.559 8.035 11.122 339 HD21 LEU 43 3HD2 LEU 43 -9.838 9.776 11.515 340 HD22 LEU 43 1HD2 LEU 43 -8.093 10.027 11.511 341 HD23 LEU 43 2HD2 LEU 43 -8.859 9.185 12.858 342 H LEU 44 H LEU 44 -10.712 7.421 7.033 343 HA LEU 44 HA LEU 44 -9.400 8.904 5.001 344 HB2 LEU 44 2HB LEU 44 -9.978 6.475 4.873 345 HB3 LEU 44 1HB LEU 44 -11.663 6.924 4.700 346 HG LEU 44 HG LEU 44 -11.099 8.109 2.592 347 HD11 LEU 44 1HD1 LEU 44 -8.771 8.614 3.048 348 HD12 LEU 44 2HD1 LEU 44 -8.918 7.688 1.554 349 HD13 LEU 44 3HD1 LEU 44 -8.375 6.896 3.033 350 HD21 LEU 44 3HD2 LEU 44 -11.933 5.818 2.540 351 HD22 LEU 44 1HD2 LEU 44 -10.286 5.206 2.690 352 HD23 LEU 44 2HD2 LEU 44 -10.767 6.096 1.246 353 H ARG 45 H ARG 45 -12.808 8.645 5.995 354 HA ARG 45 HA ARG 45 -13.806 10.548 4.153 355 HB2 ARG 45 2HB ARG 45 -14.870 9.639 6.832 356 HB3 ARG 45 1HB ARG 45 -15.741 10.727 5.763 357 HG2 ARG 45 2HG ARG 45 -15.792 8.983 4.044 358 HG3 ARG 45 1HG ARG 45 -14.940 7.892 5.142 359 HD2 ARG 45 2HD ARG 45 -16.773 8.028 6.734 360 HD3 ARG 45 1HD ARG 45 -17.617 9.172 5.691 361 HE ARG 45 HE ARG 45 -17.808 7.344 4.059 362 HH11 ARG 45 1HH1 ARG 45 -17.184 6.561 7.404 363 HH12 ARG 45 2HH1 ARG 45 -17.795 4.938 7.282 364 HH21 ARG 45 1HH2 ARG 45 -18.689 5.229 3.899 365 HH22 ARG 45 2HH2 ARG 45 -18.694 4.194 5.293 366 H ASN 46 H ASN 46 -12.368 10.820 7.326 367 HA ASN 46 HA ASN 46 -13.086 13.599 7.632 368 HB2 ASN 46 2HB ASN 46 -12.810 11.877 9.502 369 HB3 ASN 46 1HB ASN 46 -11.075 12.072 9.276 370 HD21 ASN 46 1HD2 ASN 46 -13.376 14.687 8.904 371 HD22 ASN 46 2HD2 ASN 46 -12.859 15.575 10.292 372 H GLY 47 H GLY 47 -10.744 11.956 5.914 373 HA2 GLY 47 2HA GLY 47 -9.023 12.723 4.610 374 HA3 GLY 47 1HA GLY 47 -9.509 14.353 5.043 375 H LYS 48 H LYS 48 -8.541 11.901 7.380 376 HA LYS 48 HA LYS 48 -6.319 13.651 8.141 377 HB2 LYS 48 2HB LYS 48 -7.728 11.419 9.587 378 HB3 LYS 48 1HB LYS 48 -6.216 12.099 10.169 379 HG2 LYS 48 2HG LYS 48 -7.331 14.338 10.205 380 HG3 LYS 48 1HG LYS 48 -8.849 13.509 9.843 381 HD2 LYS 48 2HD LYS 48 -8.686 12.225 11.873 382 HD3 LYS 48 1HD LYS 48 -7.088 12.894 12.212 383 HE2 LYS 48 2HE LYS 48 -8.089 15.130 12.404 384 HE3 LYS 48 1HE LYS 48 -9.680 14.435 12.102 385 HZ1 LYS 48 3HZ LYS 48 -9.301 14.757 14.461 386 HZ2 LYS 48 1HZ LYS 48 -7.912 13.787 14.395 387 HZ3 LYS 48 2HZ LYS 48 -9.437 13.103 14.106 388 H ILE 49 H ILE 49 -6.899 10.745 6.482 389 HA ILE 49 HA ILE 49 -4.021 10.177 6.535 390 HB ILE 49 HB ILE 49 -4.527 7.728 6.361 391 HG12 ILE 49 2HG1 ILE 49 -6.860 7.261 7.591 392 HG13 ILE 49 1HG1 ILE 49 -7.297 8.746 6.756 393 HG21 ILE 49 1HG2 ILE 49 -4.878 7.404 8.756 394 HG22 ILE 49 2HG2 ILE 49 -5.393 9.085 8.906 395 HG23 ILE 49 3HG2 ILE 49 -3.735 8.709 8.434 396 HD11 ILE 49 3HD1 ILE 49 -7.927 6.802 5.463 397 HD12 ILE 49 1HD1 ILE 49 -6.257 6.234 5.470 398 HD13 ILE 49 2HD1 ILE 49 -6.678 7.725 4.626 399 H THR 50 H THR 50 -3.216 9.121 4.617 400 HA THR 50 HA THR 50 -4.691 9.949 2.256 401 HB THR 50 HB THR 50 -2.628 9.361 1.022 402 HG1 THR 50 HG1 THR 50 -0.828 9.060 2.858 403 HG21 THR 50 3HG2 THR 50 -2.864 11.618 1.917 404 HG22 THR 50 1HG2 THR 50 -1.181 11.099 1.986 405 HG23 THR 50 2HG2 THR 50 -2.163 11.098 3.450 406 H VAL 51 H VAL 51 -4.451 8.346 0.325 407 HA VAL 51 HA VAL 51 -5.990 6.072 0.978 408 HB VAL 51 HB VAL 51 -4.504 6.710 -1.577 409 HG11 VAL 51 1HG1 VAL 51 -6.677 4.679 -1.057 410 HG12 VAL 51 2HG1 VAL 51 -4.993 4.329 -1.445 411 HG13 VAL 51 3HG1 VAL 51 -6.032 5.106 -2.641 412 HG21 VAL 51 3HG2 VAL 51 -7.380 7.147 -0.766 413 HG22 VAL 51 1HG2 VAL 51 -6.717 7.442 -2.373 414 HG23 VAL 51 2HG2 VAL 51 -6.157 8.394 -0.999 415 H ARG 52 H ARG 52 -2.542 6.546 0.480 416 HA ARG 52 HA ARG 52 -1.888 3.785 0.315 417 HB2 ARG 52 2HB ARG 52 -0.087 6.025 1.246 418 HB3 ARG 52 1HB ARG 52 0.415 4.446 0.660 419 HG2 ARG 52 2HG ARG 52 -0.744 5.090 -1.526 420 HG3 ARG 52 1HG ARG 52 -0.741 6.735 -0.887 421 HD2 ARG 52 2HD ARG 52 1.590 4.984 -1.593 422 HD3 ARG 52 1HD ARG 52 1.209 6.606 -2.171 423 HE ARG 52 HE ARG 52 2.541 5.890 0.307 424 HH11 ARG 52 1HH1 ARG 52 0.963 8.364 -1.572 425 HH12 ARG 52 2HH1 ARG 52 1.648 9.685 -0.666 426 HH21 ARG 52 1HH2 ARG 52 3.465 7.602 1.502 427 HH22 ARG 52 2HH2 ARG 52 3.072 9.241 1.094 428 H GLU 53 H GLU 53 -2.316 6.041 2.969 429 HA GLU 53 HA GLU 53 -1.273 4.383 5.014 430 HB2 GLU 53 2HB GLU 53 -3.386 6.541 5.166 431 HB3 GLU 53 1HB GLU 53 -2.595 5.808 6.554 432 HG2 GLU 53 2HG GLU 53 -1.340 7.516 4.427 433 HG3 GLU 53 1HG GLU 53 -1.560 7.901 6.136 434 H PHE 54 H PHE 54 -4.443 4.744 3.559 435 HA PHE 54 HA PHE 54 -5.871 2.987 5.218 436 HB2 PHE 54 2HB PHE 54 -6.840 4.578 3.525 437 HB3 PHE 54 1HB PHE 54 -6.314 3.472 2.264 438 HD1 PHE 54 HD1 PHE 54 -8.648 3.950 5.059 439 HD2 PHE 54 HD2 PHE 54 -7.498 1.451 1.815 440 HE1 PHE 54 HE1 PHE 54 -10.765 2.713 5.265 441 HE2 PHE 54 HE2 PHE 54 -9.610 0.208 2.019 442 HZ PHE 54 HZ PHE 54 -11.247 0.839 3.741 443 H VAL 55 H VAL 55 -4.083 2.460 2.198 444 HA VAL 55 HA VAL 55 -4.508 -0.318 2.002 445 HB VAL 55 HB VAL 55 -2.148 1.293 1.005 446 HG11 VAL 55 1HG1 VAL 55 -3.170 -1.408 0.132 447 HG12 VAL 55 2HG1 VAL 55 -1.691 -1.105 1.044 448 HG13 VAL 55 3HG1 VAL 55 -1.842 -0.515 -0.611 449 HG21 VAL 55 3HG2 VAL 55 -4.254 2.169 0.162 450 HG22 VAL 55 1HG2 VAL 55 -4.736 0.555 -0.361 451 HG23 VAL 55 2HG2 VAL 55 -3.366 1.358 -1.127 452 H ARG 56 H ARG 56 -1.968 1.573 3.599 453 HA ARG 56 HA ARG 56 -0.259 -0.475 4.393 454 HB2 ARG 56 2HB ARG 56 0.103 2.017 4.701 455 HB3 ARG 56 1HB ARG 56 -0.961 1.927 6.100 456 HG2 ARG 56 2HG ARG 56 0.657 0.094 6.925 457 HG3 ARG 56 1HG ARG 56 1.765 0.753 5.723 458 HD2 ARG 56 2HD ARG 56 0.522 2.212 8.053 459 HD3 ARG 56 1HD ARG 56 2.214 1.764 7.860 460 HE ARG 56 HE ARG 56 0.858 3.748 6.144 461 HH11 ARG 56 1HH1 ARG 56 3.660 2.643 7.948 462 HH12 ARG 56 2HH1 ARG 56 4.582 4.080 7.613 463 HH21 ARG 56 1HH2 ARG 56 2.073 5.634 5.717 464 HH22 ARG 56 2HH2 ARG 56 3.694 5.758 6.339 465 H ALA 57 H ALA 57 -3.111 0.839 6.022 466 HA ALA 57 HA ALA 57 -3.051 -0.780 8.304 467 HB1 ALA 57 3HB ALA 57 -5.408 -0.203 8.581 468 HB2 ALA 57 1HB ALA 57 -5.465 0.399 6.926 469 HB3 ALA 57 2HB ALA 57 -4.459 1.211 8.125 470 H VAL 58 H VAL 58 -4.729 -1.243 5.199 471 HA VAL 58 HA VAL 58 -6.023 -3.647 5.833 472 HB VAL 58 HB VAL 58 -5.026 -2.738 3.124 473 HG11 VAL 58 1HG1 VAL 58 -5.580 -5.116 3.143 474 HG12 VAL 58 2HG1 VAL 58 -6.764 -4.201 2.211 475 HG13 VAL 58 3HG1 VAL 58 -7.159 -4.749 3.839 476 HG21 VAL 58 3HG2 VAL 58 -6.499 -1.107 4.219 477 HG22 VAL 58 1HG2 VAL 58 -7.721 -2.364 4.419 478 HG23 VAL 58 2HG2 VAL 58 -7.256 -1.835 2.802 479 H ALA 59 H ALA 59 -2.819 -3.050 4.457 480 HA ALA 59 HA ALA 59 -2.155 -5.730 3.915 481 HB1 ALA 59 3HB ALA 59 0.114 -4.954 3.699 482 HB2 ALA 59 1HB ALA 59 -0.275 -3.471 4.570 483 HB3 ALA 59 2HB ALA 59 -0.980 -3.772 2.983 484 H LYS 60 H LYS 60 -2.041 -3.853 6.847 485 HA LYS 60 HA LYS 60 -0.585 -6.013 8.199 486 HB2 LYS 60 2HB LYS 60 0.165 -3.605 8.396 487 HB3 LYS 60 1HB LYS 60 -1.300 -3.298 9.318 488 HG2 LYS 60 2HG LYS 60 -0.595 -4.834 11.036 489 HG3 LYS 60 1HG LYS 60 0.811 -5.306 10.081 490 HD2 LYS 60 2HD LYS 60 0.279 -2.543 11.174 491 HD3 LYS 60 1HD LYS 60 1.395 -3.724 11.866 492 HE2 LYS 60 2HE LYS 60 2.602 -3.725 9.661 493 HE3 LYS 60 1HE LYS 60 1.588 -2.362 9.184 494 HZ1 LYS 60 3HZ LYS 60 3.437 -2.427 11.510 495 HZ2 LYS 60 1HZ LYS 60 2.453 -1.115 11.073 496 HZ3 LYS 60 2HZ LYS 60 3.708 -1.605 10.043 497 H SER 61 H SER 61 -3.562 -5.824 7.376 498 HA SER 61 HA SER 61 -4.713 -6.298 10.042 499 HB2 SER 61 2HB SER 61 -6.022 -5.473 7.452 500 HB3 SER 61 1HB SER 61 -6.925 -5.960 8.886 501 HG SER 61 HG SER 61 -5.132 -3.773 8.622 502 H GLU 62 H GLU 62 -7.011 -7.629 9.241 503 HA GLU 62 HA GLU 62 -7.860 -9.693 8.899 504 HB2 GLU 62 2HB GLU 62 -5.470 -10.051 7.079 505 HB3 GLU 62 1HB GLU 62 -6.787 -11.205 7.230 506 HG2 GLU 62 2HG GLU 62 -8.339 -9.387 6.484 507 HG3 GLU 62 1HG GLU 62 -6.914 -8.404 6.147 508 H LEU 63 H LEU 63 -6.939 -12.185 8.886 509 HA LEU 63 HA LEU 63 -5.694 -12.510 11.438 510 HB2 LEU 63 2HB LEU 63 -6.440 -14.460 9.259 511 HB3 LEU 63 1HB LEU 63 -5.640 -14.966 10.733 512 HG LEU 63 HG LEU 63 -7.608 -13.996 12.001 513 HD11 LEU 63 1HD1 LEU 63 -9.693 -13.698 10.784 514 HD12 LEU 63 2HD1 LEU 63 -8.856 -13.976 9.257 515 HD13 LEU 63 3HD1 LEU 63 -8.475 -12.552 10.225 516 HD21 LEU 63 3HD2 LEU 63 -9.025 -15.939 11.566 517 HD22 LEU 63 1HD2 LEU 63 -7.322 -16.387 11.646 518 HD23 LEU 63 2HD2 LEU 63 -8.128 -16.262 10.082 519 H TYR 64 H TYR 64 -3.576 -12.640 11.875 520 HA TYR 64 HA TYR 64 -1.656 -12.125 9.873 521 HB2 TYR 64 2HB TYR 64 -1.205 -13.220 12.656 522 HB3 TYR 64 1HB TYR 64 0.018 -12.491 11.621 523 HD1 TYR 64 HD1 TYR 64 -0.625 -10.035 10.780 524 HD2 TYR 64 HD2 TYR 64 -2.154 -11.895 14.289 525 HE1 TYR 64 HE1 TYR 64 -1.148 -7.825 11.720 526 HE2 TYR 64 HE2 TYR 64 -2.683 -9.687 15.232 527 HH TYR 64 HH TYR 64 -1.954 -7.356 14.987 528 H LYS 65 H LYS 65 -0.029 -13.477 9.019 529 HA LYS 65 HA LYS 65 0.654 -15.335 7.891 530 HB2 LYS 65 2HB LYS 65 -0.716 -16.799 10.163 531 HB3 LYS 65 1HB LYS 65 0.258 -17.579 8.926 532 HG2 LYS 65 2HG LYS 65 2.231 -16.433 9.674 533 HG3 LYS 65 1HG LYS 65 1.287 -15.466 10.809 534 HD2 LYS 65 2HD LYS 65 0.685 -17.482 12.047 535 HD3 LYS 65 1HD LYS 65 1.592 -18.468 10.900 536 HE2 LYS 65 2HE LYS 65 3.658 -17.411 11.563 537 HE3 LYS 65 1HE LYS 65 2.787 -16.295 12.615 538 HZ1 LYS 65 3HZ LYS 65 2.129 -18.109 14.009 539 HZ2 LYS 65 1HZ LYS 65 3.811 -18.175 13.811 540 HZ3 LYS 65 2HZ LYS 65 2.814 -19.249 12.956 541 H GLU 66 H GLU 66 -1.170 -17.838 8.045 542 HA GLU 66 HA GLU 66 -2.936 -18.746 6.957 543 HB2 GLU 66 2HB GLU 66 -4.088 -15.950 6.860 544 HB3 GLU 66 1HB GLU 66 -4.965 -17.449 6.594 545 HG2 GLU 66 2HG GLU 66 -3.694 -16.563 9.174 546 HG3 GLU 66 1HG GLU 66 -5.416 -16.572 8.801 547 H LYS 67 H LYS 67 -2.929 -15.564 5.363 548 HA LYS 67 HA LYS 67 -2.232 -16.934 2.860 549 HB2 LYS 67 2HB LYS 67 -3.484 -14.213 3.278 550 HB3 LYS 67 1HB LYS 67 -3.055 -14.890 1.714 551 HG2 LYS 67 2HG LYS 67 -5.178 -15.581 1.668 552 HG3 LYS 67 1HG LYS 67 -4.618 -16.864 2.742 553 HD2 LYS 67 2HD LYS 67 -6.575 -15.903 3.718 554 HD3 LYS 67 1HD LYS 67 -5.190 -15.374 4.675 555 HE2 LYS 67 2HE LYS 67 -5.178 -13.250 3.404 556 HE3 LYS 67 1HE LYS 67 -6.631 -13.781 2.555 557 HZ1 LYS 67 3HZ LYS 67 -7.741 -13.932 4.741 558 HZ2 LYS 67 1HZ LYS 67 -7.253 -12.350 4.354 559 HZ3 LYS 67 2HZ LYS 67 -6.357 -13.267 5.464 560 H PHE 68 H PHE 68 -1.213 -14.614 5.199 561 HA PHE 68 HA PHE 68 1.146 -13.947 3.580 562 HB2 PHE 68 2HB PHE 68 0.635 -12.785 6.300 563 HB3 PHE 68 1HB PHE 68 1.505 -12.089 4.940 564 HD1 PHE 68 HD1 PHE 68 0.034 -11.517 2.844 565 HD2 PHE 68 HD2 PHE 68 -1.454 -12.037 6.797 566 HE1 PHE 68 HE1 PHE 68 -1.959 -10.190 2.268 567 HE2 PHE 68 HE2 PHE 68 -3.443 -10.718 6.233 568 HZ PHE 68 HZ PHE 68 -3.704 -9.788 3.963 569 H LEU 69 H LEU 69 3.044 -13.571 5.518 570 HA LEU 69 HA LEU 69 3.114 -15.660 7.435 571 HB2 LEU 69 2HB LEU 69 3.387 -17.087 5.533 572 HB3 LEU 69 1HB LEU 69 4.615 -16.047 4.851 573 HG LEU 69 HG LEU 69 5.353 -18.267 5.884 574 HD11 LEU 69 1HD1 LEU 69 6.927 -16.525 5.249 575 HD12 LEU 69 2HD1 LEU 69 7.429 -17.303 6.747 576 HD13 LEU 69 3HD1 LEU 69 6.675 -15.709 6.794 577 HD21 LEU 69 3HD2 LEU 69 4.952 -16.687 8.422 578 HD22 LEU 69 1HD2 LEU 69 5.759 -18.251 8.287 579 HD23 LEU 69 2HD2 LEU 69 4.036 -18.117 7.935 580 H TYR 70 H TYR 70 4.508 -15.169 8.982 581 HA TYR 70 HA TYR 70 6.945 -13.724 8.273 582 HB2 TYR 70 2HB TYR 70 6.860 -12.369 10.249 583 HB3 TYR 70 1HB TYR 70 5.316 -12.187 9.432 584 HD1 TYR 70 HD1 TYR 70 3.286 -13.286 10.382 585 HD2 TYR 70 HD2 TYR 70 7.011 -13.275 12.437 586 HE1 TYR 70 HE1 TYR 70 2.129 -13.868 12.473 587 HE2 TYR 70 HE2 TYR 70 5.868 -13.861 14.531 588 HH TYR 70 HH TYR 70 3.683 -13.734 15.535 589 H GLY 71 H GLY 71 8.732 -14.713 8.971 590 HA2 GLY 71 2HA GLY 71 10.086 -15.888 10.482 591 HA3 GLY 71 1HA GLY 71 8.644 -16.421 11.334 592 H ASN 72 H ASN 72 9.491 -16.683 7.903 593 HA ASN 72 HA ASN 72 10.203 -19.425 7.975 594 HB2 ASN 72 2HB ASN 72 7.644 -19.404 8.449 595 HB3 ASN 72 1HB ASN 72 7.478 -18.958 6.756 596 HD21 ASN 72 1HD2 ASN 72 8.385 -21.457 8.990 597 HD22 ASN 72 2HD2 ASN 72 8.404 -22.754 7.844 598 H PHE 73 H PHE 73 9.022 -19.922 5.265 599 HA PHE 73 HA PHE 73 10.990 -18.585 3.711 600 HB2 PHE 73 2HB PHE 73 8.587 -20.227 2.894 601 HB3 PHE 73 1HB PHE 73 9.793 -19.622 1.761 602 HD1 PHE 73 HD2 PHE 73 12.173 -20.368 2.017 603 HD2 PHE 73 HD1 PHE 73 8.958 -22.183 4.127 604 HE1 PHE 73 HE2 PHE 73 13.577 -22.340 2.450 605 HE2 PHE 73 HE1 PHE 73 10.357 -24.154 4.575 606 HZ PHE 73 HZ PHE 73 12.670 -24.237 3.732 607 H GLN 74 H GLN 74 10.924 -16.511 3.353 608 HA GLN 74 HA GLN 74 8.437 -15.051 3.448 609 HB2 GLN 74 2HB GLN 74 11.253 -14.035 3.076 610 HB3 GLN 74 1HB GLN 74 9.835 -13.054 3.422 611 HG2 GLN 74 2HG GLN 74 11.056 -15.133 5.220 612 HG3 GLN 74 1HG GLN 74 11.145 -13.384 5.420 613 HE21 GLN 74 1HE2 GLN 74 8.355 -13.012 4.588 614 HE22 GLN 74 2HE2 GLN 74 7.387 -13.525 5.926 615 H THR 75 H THR 75 10.551 -16.224 0.990 616 HA THR 75 HA THR 75 10.559 -14.344 -0.976 617 HB THR 75 HB THR 75 10.406 -16.328 -2.616 618 HG1 THR 75 HG1 THR 75 10.663 -18.367 -1.558 619 HG21 THR 75 3HG2 THR 75 12.494 -16.302 -0.429 620 HG22 THR 75 1HG2 THR 75 12.515 -15.328 -1.899 621 HG23 THR 75 2HG2 THR 75 12.666 -17.081 -2.004 622 H ARG 76 H ARG 76 8.057 -16.889 -0.817 623 HA ARG 76 HA ARG 76 6.452 -15.841 -2.855 624 HB2 ARG 76 2HB ARG 76 5.806 -17.658 -0.543 625 HB3 ARG 76 1HB ARG 76 4.626 -17.235 -1.774 626 HG2 ARG 76 2HG ARG 76 5.961 -18.259 -3.485 627 HG3 ARG 76 1HG ARG 76 7.266 -18.564 -2.336 628 HD2 ARG 76 2HD ARG 76 4.482 -19.686 -2.069 629 HD3 ARG 76 1HD ARG 76 5.820 -20.550 -2.827 630 HE ARG 76 HE ARG 76 6.900 -20.664 -0.707 631 HH11 ARG 76 1HH1 ARG 76 3.628 -19.411 -0.572 632 HH12 ARG 76 2HH1 ARG 76 3.454 -19.703 1.136 633 HH21 ARG 76 1HH2 ARG 76 6.672 -21.078 1.503 634 HH22 ARG 76 2HH2 ARG 76 5.190 -20.672 2.321 635 H VAL 77 H VAL 77 6.515 -15.169 0.586 636 HA VAL 77 HA VAL 77 4.060 -13.776 0.732 637 HB VAL 77 HB VAL 77 6.503 -13.372 2.463 638 HG11 VAL 77 1HG1 VAL 77 4.833 -11.611 2.709 639 HG12 VAL 77 2HG1 VAL 77 4.904 -12.618 4.154 640 HG13 VAL 77 3HG1 VAL 77 3.584 -12.823 3.000 641 HG21 VAL 77 3HG2 VAL 77 5.441 -15.010 3.979 642 HG22 VAL 77 1HG2 VAL 77 5.914 -15.713 2.431 643 HG23 VAL 77 2HG2 VAL 77 4.222 -15.324 2.744 644 H ILE 78 H ILE 78 7.400 -12.714 0.195 645 HA ILE 78 HA ILE 78 6.861 -9.951 0.046 646 HB ILE 78 HB ILE 78 9.064 -11.509 -1.321 647 HG12 ILE 78 2HG1 ILE 78 9.057 -9.987 1.294 648 HG13 ILE 78 1HG1 ILE 78 9.002 -11.741 1.146 649 HG21 ILE 78 1HG2 ILE 78 10.247 -9.360 -1.423 650 HG22 ILE 78 2HG2 ILE 78 8.830 -8.550 -0.759 651 HG23 ILE 78 3HG2 ILE 78 8.745 -9.315 -2.345 652 HD11 ILE 78 3HD1 ILE 78 11.197 -11.710 0.074 653 HD12 ILE 78 1HD1 ILE 78 11.235 -10.987 1.682 654 HD13 ILE 78 2HD1 ILE 78 11.250 -9.956 0.251 655 H GLU 79 H GLU 79 6.807 -12.519 -2.377 656 HA GLU 79 HA GLU 79 6.343 -10.850 -4.600 657 HB2 GLU 79 2HB GLU 79 5.610 -13.744 -4.141 658 HB3 GLU 79 1HB GLU 79 5.472 -12.922 -5.691 659 HG2 GLU 79 2HG GLU 79 7.900 -12.463 -5.616 660 HG3 GLU 79 1HG GLU 79 8.000 -13.402 -4.129 661 H LEU 80 H LEU 80 4.218 -12.200 -2.170 662 HA LEU 80 HA LEU 80 1.784 -11.396 -3.435 663 HB2 LEU 80 2HB LEU 80 2.365 -11.910 -0.514 664 HB3 LEU 80 1HB LEU 80 0.769 -11.753 -1.220 665 HG LEU 80 HG LEU 80 2.743 -13.953 -1.835 666 HD11 LEU 80 1HD1 LEU 80 1.817 -14.085 0.432 667 HD12 LEU 80 2HD1 LEU 80 1.217 -15.386 -0.598 668 HD13 LEU 80 3HD1 LEU 80 0.186 -14.001 -0.236 669 HD21 LEU 80 3HD2 LEU 80 -0.127 -13.603 -2.698 670 HD22 LEU 80 1HD2 LEU 80 0.910 -14.982 -3.057 671 HD23 LEU 80 2HD2 LEU 80 1.285 -13.397 -3.735 672 H ASN 81 H ASN 81 3.665 -10.101 -0.717 673 HA ASN 81 HA ASN 81 2.266 -7.775 -0.210 674 HB2 ASN 81 2HB ASN 81 5.215 -8.404 0.005 675 HB3 ASN 81 1HB ASN 81 4.535 -6.882 0.568 676 HD21 ASN 81 1HD2 ASN 81 5.401 -7.555 2.647 677 HD22 ASN 81 2HD2 ASN 81 4.462 -8.627 3.630 678 H TYR 82 H TYR 82 4.963 -8.245 -2.451 679 HA TYR 82 HA TYR 82 5.182 -5.589 -3.327 680 HB2 TYR 82 2HB TYR 82 6.650 -7.820 -3.670 681 HB3 TYR 82 1HB TYR 82 5.845 -7.764 -5.235 682 HD1 TYR 82 HD2 TYR 82 6.269 -5.922 -6.781 683 HD2 TYR 82 HD1 TYR 82 8.268 -6.170 -3.035 684 HE1 TYR 82 HE2 TYR 82 7.898 -4.248 -7.547 685 HE2 TYR 82 HE1 TYR 82 9.897 -4.497 -3.784 686 HH TYR 82 HH TYR 82 10.791 -3.554 -5.857 687 H LYS 83 H LYS 83 3.372 -8.345 -4.608 688 HA LYS 83 HA LYS 83 2.539 -6.996 -6.980 689 HB2 LYS 83 2HB LYS 83 2.766 -9.521 -6.538 690 HB3 LYS 83 1HB LYS 83 1.191 -9.401 -5.776 691 HG2 LYS 83 2HG LYS 83 0.924 -10.165 -8.026 692 HG3 LYS 83 1HG LYS 83 0.272 -8.529 -7.897 693 HD2 LYS 83 2HD LYS 83 2.156 -7.596 -8.998 694 HD3 LYS 83 1HD LYS 83 3.073 -9.095 -8.849 695 HE2 LYS 83 2HE LYS 83 0.546 -8.808 -10.467 696 HE3 LYS 83 1HE LYS 83 2.173 -8.667 -11.134 697 HZ1 LYS 83 3HZ LYS 83 1.163 -11.070 -9.704 698 HZ2 LYS 83 1HZ LYS 83 2.634 -10.919 -10.537 699 HZ3 LYS 83 2HZ LYS 83 1.167 -10.902 -11.391 700 H HIS 84 H HIS 84 1.392 -7.019 -3.744 701 HA HIS 84 HA HIS 84 -1.281 -6.130 -4.538 702 HB2 HIS 84 2HB HIS 84 -0.121 -6.678 -1.798 703 HB3 HIS 84 1HB HIS 84 -1.766 -6.135 -2.089 704 HD1 HIS 84 HD1 HIS 84 -2.099 -8.157 -4.615 705 HD2 HIS 84 HD2 HIS 84 -0.957 -9.101 -0.734 706 HE1 HIS 84 HE1 HIS 84 -2.655 -10.594 -4.320 707 HE2 HIS 84 HE2 HIS 84 -1.977 -11.141 -1.947 708 H LEU 85 H LEU 85 1.444 -4.971 -2.563 709 HA LEU 85 HA LEU 85 0.084 -2.512 -1.986 710 HB2 LEU 85 2HB LEU 85 2.932 -3.324 -1.411 711 HB3 LEU 85 1HB LEU 85 2.101 -1.939 -0.727 712 HG LEU 85 HG LEU 85 1.432 -4.842 -0.254 713 HD11 LEU 85 1HD1 LEU 85 2.064 -4.355 2.053 714 HD12 LEU 85 2HD1 LEU 85 2.508 -2.714 1.587 715 HD13 LEU 85 3HD1 LEU 85 3.409 -4.087 0.944 716 HD21 LEU 85 3HD2 LEU 85 -0.594 -3.499 -0.346 717 HD22 LEU 85 1HD2 LEU 85 0.095 -2.361 0.811 718 HD23 LEU 85 2HD2 LEU 85 -0.256 -4.018 1.305 719 H LEU 86 H LEU 86 2.703 -3.475 -4.153 720 HA LEU 86 HA LEU 86 2.968 -0.672 -4.985 721 HB2 LEU 86 2HB LEU 86 4.754 -3.037 -5.557 722 HB3 LEU 86 1HB LEU 86 5.039 -1.400 -6.110 723 HG LEU 86 HG LEU 86 5.024 -2.324 -3.236 724 HD11 LEU 86 1HD1 LEU 86 7.255 -1.395 -5.033 725 HD12 LEU 86 2HD1 LEU 86 7.004 -3.036 -4.434 726 HD13 LEU 86 3HD1 LEU 86 7.404 -1.738 -3.309 727 HD21 LEU 86 3HD2 LEU 86 5.559 0.405 -4.395 728 HD22 LEU 86 1HD2 LEU 86 5.750 -0.055 -2.703 729 HD23 LEU 86 2HD2 LEU 86 4.148 -0.059 -3.444 730 H GLY 87 H GLY 87 1.496 -3.532 -5.890 731 HA2 GLY 87 2HA GLY 87 0.262 -4.116 -7.724 732 HA3 GLY 87 1HA GLY 87 0.354 -2.429 -8.202 733 H ARG 88 H ARG 88 3.316 -4.177 -7.804 734 HA ARG 88 HA ARG 88 3.478 -4.580 -10.703 735 HB2 ARG 88 2HB ARG 88 5.814 -3.719 -10.670 736 HB3 ARG 88 1HB ARG 88 4.602 -2.491 -10.337 737 HG2 ARG 88 2HG ARG 88 5.095 -2.655 -7.947 738 HG3 ARG 88 1HG ARG 88 6.321 -3.879 -8.289 739 HD2 ARG 88 2HD ARG 88 7.546 -2.254 -9.657 740 HD3 ARG 88 1HD ARG 88 6.328 -1.032 -9.291 741 HE ARG 88 HE ARG 88 7.356 -2.073 -6.891 742 HH11 ARG 88 1HH1 ARG 88 8.366 -0.064 -9.578 743 HH12 ARG 88 2HH1 ARG 88 9.504 0.837 -8.630 744 HH21 ARG 88 1HH2 ARG 88 8.867 -0.879 -5.657 745 HH22 ARG 88 2HH2 ARG 88 9.775 0.399 -6.415 746 H ALA 89 H ALA 89 5.382 -5.963 -11.300 747 HA ALA 89 HA ALA 89 5.356 -8.230 -9.439 748 HB1 ALA 89 3HB ALA 89 5.899 -8.141 -12.404 749 HB2 ALA 89 1HB ALA 89 4.393 -8.640 -11.632 750 HB3 ALA 89 2HB ALA 89 5.857 -9.597 -11.409 751 HA PRO 90 HA PRO 90 9.748 -8.014 -8.788 752 HB2 PRO 90 2HB PRO 90 9.860 -10.944 -8.807 753 HB3 PRO 90 1HB PRO 90 10.156 -9.826 -7.474 754 HG2 PRO 90 2HG PRO 90 7.974 -11.411 -7.570 755 HG3 PRO 90 1HG PRO 90 7.945 -9.800 -6.833 756 HD2 PRO 90 2HD PRO 90 6.963 -10.674 -9.521 757 HD3 PRO 90 1HD PRO 90 6.229 -9.540 -8.367 758 H TYR 91 H TYR 91 10.466 -7.254 -10.777 759 HA TYR 91 HA TYR 91 10.836 -9.115 -12.983 760 HB2 TYR 91 2HB TYR 91 9.970 -6.762 -13.284 761 HB3 TYR 91 1HB TYR 91 11.571 -6.183 -12.841 762 HD1 TYR 91 HD1 TYR 91 9.743 -8.229 -15.338 763 HD2 TYR 91 HD2 TYR 91 13.280 -6.037 -14.453 764 HE1 TYR 91 HE1 TYR 91 10.444 -8.424 -17.686 765 HE2 TYR 91 HE2 TYR 91 13.990 -6.228 -16.797 766 HH TYR 91 HH TYR 91 13.591 -7.712 -18.724 767 H ASP 92 H ASP 92 12.596 -7.719 -10.408 768 HA ASP 92 HA ASP 92 15.082 -8.915 -11.433 769 HB2 ASP 92 2HB ASP 92 15.046 -6.358 -11.440 770 HB3 ASP 92 1HB ASP 92 14.967 -6.447 -9.684 771 H GLU 93 H GLU 93 16.327 -10.006 -9.861 772 HA GLU 93 HA GLU 93 14.810 -11.093 -7.707 773 HB2 GLU 93 2HB GLU 93 16.723 -12.441 -7.218 774 HB3 GLU 93 1HB GLU 93 16.596 -12.332 -8.967 775 HG2 GLU 93 2HG GLU 93 18.338 -10.606 -8.973 776 HG3 GLU 93 1HG GLU 93 18.471 -10.756 -7.220 777 H SER 94 H SER 94 16.982 -8.436 -8.053 778 HA SER 94 HA SER 94 18.008 -8.209 -5.460 779 HB2 SER 94 2HB SER 94 17.346 -5.938 -7.349 780 HB3 SER 94 1HB SER 94 18.550 -5.927 -6.058 781 HG SER 94 HG SER 94 18.574 -7.355 -8.512 782 H GLU 95 H GLU 95 14.926 -7.241 -6.814 783 HA GLU 95 HA GLU 95 13.990 -5.600 -4.749 784 HB2 GLU 95 2HB GLU 95 12.451 -7.515 -6.518 785 HB3 GLU 95 1HB GLU 95 11.729 -6.252 -5.531 786 HG2 GLU 95 2HG GLU 95 13.737 -5.706 -7.696 787 HG3 GLU 95 1HG GLU 95 11.996 -5.716 -7.965 788 H VAL 96 H VAL 96 13.696 -9.103 -5.223 789 HA VAL 96 HA VAL 96 12.320 -9.595 -2.795 790 HB VAL 96 HB VAL 96 14.007 -11.538 -4.386 791 HG11 VAL 96 1HG1 VAL 96 11.752 -12.004 -2.438 792 HG12 VAL 96 2HG1 VAL 96 13.461 -12.342 -2.158 793 HG13 VAL 96 3HG1 VAL 96 12.571 -13.249 -3.382 794 HG21 VAL 96 3HG2 VAL 96 12.346 -10.509 -5.825 795 HG22 VAL 96 1HG2 VAL 96 11.078 -10.860 -4.651 796 HG23 VAL 96 2HG2 VAL 96 11.900 -12.180 -5.484 797 H ILE 97 H ILE 97 15.733 -9.835 -3.747 798 HA ILE 97 HA ILE 97 16.787 -10.868 -1.385 799 HB ILE 97 HB ILE 97 18.136 -8.838 -3.173 800 HG12 ILE 97 2HG1 ILE 97 17.339 -10.722 -4.505 801 HG13 ILE 97 1HG1 ILE 97 19.092 -10.778 -4.360 802 HG21 ILE 97 1HG2 ILE 97 19.272 -10.892 -1.285 803 HG22 ILE 97 2HG2 ILE 97 19.294 -9.142 -1.073 804 HG23 ILE 97 3HG2 ILE 97 20.216 -9.883 -2.381 805 HD11 ILE 97 3HD1 ILE 97 18.879 -12.498 -2.633 806 HD12 ILE 97 1HD1 ILE 97 18.134 -12.984 -4.154 807 HD13 ILE 97 2HD1 ILE 97 17.124 -12.449 -2.809 808 H PHE 98 H PHE 98 16.306 -7.475 -2.317 809 HA PHE 98 HA PHE 98 17.404 -6.336 0.006 810 HB2 PHE 98 2HB PHE 98 17.053 -5.019 -2.004 811 HB3 PHE 98 1HB PHE 98 15.312 -5.251 -1.890 812 HD1 PHE 98 HD1 PHE 98 18.195 -3.821 -0.035 813 HD2 PHE 98 HD2 PHE 98 14.007 -3.690 -0.777 814 HE1 PHE 98 HE1 PHE 98 18.019 -1.783 1.330 815 HE2 PHE 98 HE2 PHE 98 13.824 -1.647 0.579 816 HZ PHE 98 HZ PHE 98 15.832 -0.693 1.638 817 H HIS 99 H HIS 99 14.076 -7.293 -0.776 818 HA HIS 99 HA HIS 99 13.031 -6.244 1.668 819 HB2 HIS 99 2HB HIS 99 11.893 -8.002 -0.482 820 HB3 HIS 99 1HB HIS 99 11.017 -7.744 1.024 821 HD1 HIS 99 HD1 HIS 99 9.786 -5.557 1.308 822 HD2 HIS 99 HD2 HIS 99 12.246 -5.635 -2.055 823 HE1 HIS 99 HE1 HIS 99 9.273 -3.445 0.025 824 HE2 HIS 99 HE2 HIS 99 10.844 -3.469 -1.957 825 H LEU 100 H LEU 100 14.289 -9.370 0.667 826 HA LEU 100 HA LEU 100 13.541 -10.860 2.924 827 HB2 LEU 100 2HB LEU 100 15.954 -11.020 1.124 828 HB3 LEU 100 1HB LEU 100 15.705 -12.139 2.450 829 HG LEU 100 HG LEU 100 13.780 -11.776 0.150 830 HD11 LEU 100 1HD1 LEU 100 14.635 -13.920 -0.653 831 HD12 LEU 100 2HD1 LEU 100 15.838 -13.926 0.636 832 HD13 LEU 100 3HD1 LEU 100 15.902 -12.694 -0.626 833 HD21 LEU 100 3HD2 LEU 100 13.951 -13.862 2.324 834 HD22 LEU 100 1HD2 LEU 100 12.807 -13.858 0.983 835 HD23 LEU 100 2HD2 LEU 100 12.737 -12.588 2.205 836 H ASP 101 H ASP 101 16.446 -8.933 2.298 837 HA ASP 101 HA ASP 101 17.639 -9.306 4.819 838 HB2 ASP 101 2HB ASP 101 18.920 -8.517 2.908 839 HB3 ASP 101 1HB ASP 101 17.941 -7.058 2.817 840 H LEU 102 H LEU 102 15.675 -6.610 3.553 841 HA LEU 102 HA LEU 102 15.620 -5.024 5.837 842 HB2 LEU 102 2HB LEU 102 14.791 -4.203 3.729 843 HB3 LEU 102 1HB LEU 102 13.529 -5.419 3.698 844 HG LEU 102 HG LEU 102 12.503 -4.343 5.697 845 HD11 LEU 102 1HD1 LEU 102 14.565 -2.203 5.192 846 HD12 LEU 102 2HD1 LEU 102 14.494 -3.267 6.598 847 HD13 LEU 102 3HD1 LEU 102 13.210 -2.090 6.316 848 HD21 LEU 102 3HD2 LEU 102 11.696 -3.843 3.450 849 HD22 LEU 102 1HD2 LEU 102 12.878 -2.541 3.311 850 HD23 LEU 102 2HD2 LEU 102 11.581 -2.432 4.501 851 H TYR 103 H TYR 103 13.357 -7.585 4.857 852 HA TYR 103 HA TYR 103 11.611 -7.419 7.005 853 HB2 TYR 103 2HB TYR 103 10.982 -8.800 5.171 854 HB3 TYR 103 1HB TYR 103 12.448 -9.770 5.306 855 HD1 TYR 103 HD2 TYR 103 9.277 -8.940 7.031 856 HD2 TYR 103 HD1 TYR 103 12.507 -11.678 6.670 857 HE1 TYR 103 HE2 TYR 103 8.128 -10.495 8.547 858 HE2 TYR 103 HE1 TYR 103 11.363 -13.236 8.184 859 HH TYR 103 HH TYR 103 9.707 -13.131 9.962 860 H GLU 104 H GLU 104 14.562 -9.378 6.680 861 HA GLU 104 HA GLU 104 14.274 -10.508 9.283 862 HB2 GLU 104 2HB GLU 104 16.577 -10.494 7.342 863 HB3 GLU 104 1HB GLU 104 16.606 -11.353 8.879 864 HG2 GLU 104 2HG GLU 104 14.549 -11.815 6.731 865 HG3 GLU 104 1HG GLU 104 16.025 -12.760 6.905 866 H ASN 105 H ASN 105 15.574 -7.559 8.130 867 HA ASN 105 HA ASN 105 17.406 -7.027 10.224 868 HB2 ASN 105 2HB ASN 105 15.847 -5.195 8.406 869 HB3 ASN 105 1HB ASN 105 16.932 -4.581 9.645 870 HD21 ASN 105 1HD2 ASN 105 18.802 -6.845 9.253 871 HD22 ASN 105 2HD2 ASN 105 19.642 -6.475 7.780 872 H GLU 106 H GLU 106 14.004 -6.044 9.788 873 HA GLU 106 HA GLU 106 14.006 -5.364 12.664 874 HB2 GLU 106 2HB GLU 106 12.494 -4.007 10.442 875 HB3 GLU 106 1HB GLU 106 12.444 -3.559 12.142 876 HG2 GLU 106 2HG GLU 106 14.699 -2.852 12.111 877 HG3 GLU 106 1HG GLU 106 14.971 -3.565 10.521 878 H GLY 107 H GLY 107 12.037 -6.631 9.985 879 HA2 GLY 107 2HA GLY 107 10.739 -8.634 11.002 880 HA3 GLY 107 1HA GLY 107 9.973 -7.367 11.942 881 H PHE 108 H PHE 108 8.165 -8.618 10.798 882 HA PHE 108 HA PHE 108 7.696 -8.300 8.036 883 HB2 PHE 108 2HB PHE 108 6.589 -10.037 9.376 884 HB3 PHE 108 1HB PHE 108 5.738 -8.802 10.298 885 HD1 PHE 108 HD1 PHE 108 6.100 -10.260 6.915 886 HD2 PHE 108 HD2 PHE 108 3.683 -7.965 9.562 887 HE1 PHE 108 HE1 PHE 108 4.244 -10.369 5.307 888 HE2 PHE 108 HE2 PHE 108 1.823 -8.067 7.955 889 HZ PHE 108 HZ PHE 108 2.102 -9.271 5.824 890 H ASP 109 H ASP 109 6.913 -6.324 10.827 891 HA ASP 109 HA ASP 109 5.158 -4.504 9.586 892 HB2 ASP 109 2HB ASP 109 7.051 -4.221 11.917 893 HB3 ASP 109 1HB ASP 109 6.029 -2.894 11.376 894 H ALA 110 H ALA 110 8.677 -4.537 9.888 895 HA ALA 110 HA ALA 110 9.188 -2.000 8.830 896 HB1 ALA 110 3HB ALA 110 10.872 -3.281 10.020 897 HB2 ALA 110 1HB ALA 110 11.461 -2.805 8.429 898 HB3 ALA 110 2HB ALA 110 10.921 -4.461 8.712 899 H ASP 111 H ASP 111 8.891 -5.162 7.251 900 HA ASP 111 HA ASP 111 9.507 -4.283 4.648 901 HB2 ASP 111 2HB ASP 111 9.394 -6.665 5.200 902 HB3 ASP 111 1HB ASP 111 7.664 -6.531 5.496 903 H ILE 112 H ILE 112 6.296 -4.849 6.110 904 HA ILE 112 HA ILE 112 4.715 -3.934 4.041 905 HB ILE 112 HB ILE 112 4.218 -3.714 7.012 906 HG12 ILE 112 2HG1 ILE 112 4.536 -6.001 6.188 907 HG13 ILE 112 1HG1 ILE 112 2.869 -5.731 6.689 908 HG21 ILE 112 1HG2 ILE 112 1.838 -3.497 6.456 909 HG22 ILE 112 2HG2 ILE 112 2.254 -3.411 4.744 910 HG23 ILE 112 3HG2 ILE 112 2.782 -2.138 5.846 911 HD11 ILE 112 3HD1 ILE 112 3.885 -5.735 3.855 912 HD12 ILE 112 1HD1 ILE 112 2.215 -5.459 4.354 913 HD13 ILE 112 2HD1 ILE 112 2.976 -7.024 4.642 914 H ASP 113 H ASP 113 6.048 -2.019 6.730 915 HA ASP 113 HA ASP 113 4.709 0.366 5.986 916 HB2 ASP 113 2HB ASP 113 6.917 -0.279 7.904 917 HB3 ASP 113 1HB ASP 113 6.526 1.400 7.554 918 H SER 114 H SER 114 7.651 -1.067 4.831 919 HA SER 114 HA SER 114 8.880 1.382 4.028 920 HB2 SER 114 2HB SER 114 10.474 0.020 2.816 921 HB3 SER 114 1HB SER 114 10.164 -0.721 4.385 922 HG SER 114 HG SER 114 8.784 -2.203 3.356 923 H TYR 115 H TYR 115 6.673 -0.879 2.489 924 HA TYR 115 HA TYR 115 6.917 -0.051 -0.162 925 HB2 TYR 115 2HB TYR 115 4.503 -1.092 1.332 926 HB3 TYR 115 1HB TYR 115 4.528 -0.831 -0.407 927 HD1 TYR 115 HD2 TYR 115 5.986 -2.822 2.334 928 HD2 TYR 115 HD1 TYR 115 5.540 -2.408 -1.867 929 HE1 TYR 115 HE2 TYR 115 6.891 -5.082 2.023 930 HE2 TYR 115 HE1 TYR 115 6.446 -4.671 -2.193 931 HH TYR 115 HH TYR 115 7.066 -6.807 0.510 932 H ILE 116 H ILE 116 4.689 1.105 2.335 933 HA ILE 116 HA ILE 116 3.323 2.897 0.614 934 HB ILE 116 HB ILE 116 3.334 2.546 3.605 935 HG12 ILE 116 2HG1 ILE 116 0.908 1.919 3.087 936 HG13 ILE 116 1HG1 ILE 116 1.383 1.903 1.393 937 HG21 ILE 116 1HG2 ILE 116 2.926 4.896 3.217 938 HG22 ILE 116 2HG2 ILE 116 1.435 4.098 3.720 939 HG23 ILE 116 3HG2 ILE 116 1.687 4.509 2.023 940 HD11 ILE 116 3HD1 ILE 116 3.007 0.146 1.868 941 HD12 ILE 116 1HD1 ILE 116 1.375 -0.330 2.336 942 HD13 ILE 116 2HD1 ILE 116 2.534 0.168 3.567 943 H ASP 117 H ASP 117 6.116 3.230 2.685 944 HA ASP 117 HA ASP 117 5.975 6.131 2.665 945 HB2 ASP 117 2HB ASP 117 6.729 4.871 4.679 946 HB3 ASP 117 1HB ASP 117 8.137 4.328 3.773 947 H SER 118 H SER 118 7.281 3.688 0.719 948 HA SER 118 HA SER 118 9.715 4.778 -0.109 949 HB2 SER 118 2HB SER 118 8.983 2.458 -0.575 950 HB3 SER 118 1HB SER 118 7.812 3.078 -1.738 951 HG SER 118 HG SER 118 10.474 2.644 -2.032 952 HA PRO 119 HA PRO 119 8.461 8.420 -2.277 953 HB2 PRO 119 2HB PRO 119 10.789 8.762 -3.695 954 HB3 PRO 119 1HB PRO 119 10.574 9.239 -2.008 955 HG2 PRO 119 2HG PRO 119 11.842 6.774 -3.131 956 HG3 PRO 119 1HG PRO 119 12.375 7.792 -1.779 957 HD2 PRO 119 2HD PRO 119 11.120 5.459 -1.366 958 HD3 PRO 119 1HD PRO 119 10.847 6.860 -0.309 959 H GLU 120 H GLU 120 10.018 5.766 -4.085 960 HA GLU 120 HA GLU 120 9.182 6.661 -6.638 961 HB2 GLU 120 2HB GLU 120 9.724 4.358 -7.389 962 HB3 GLU 120 1HB GLU 120 11.012 5.093 -6.447 963 HG2 GLU 120 2HG GLU 120 10.200 3.839 -4.465 964 HG3 GLU 120 1HG GLU 120 9.035 3.028 -5.511 965 H TYR 121 H TYR 121 7.633 4.899 -4.114 966 HA TYR 121 HA TYR 121 5.481 3.844 -5.679 967 HB2 TYR 121 2HB TYR 121 6.152 2.743 -3.638 968 HB3 TYR 121 1HB TYR 121 5.874 4.207 -2.706 969 HD1 TYR 121 HD2 TYR 121 3.760 2.398 -5.216 970 HD2 TYR 121 HD1 TYR 121 4.172 3.825 -1.233 971 HE1 TYR 121 HE2 TYR 121 1.481 1.626 -4.707 972 HE2 TYR 121 HE1 TYR 121 1.902 3.055 -0.712 973 HH TYR 121 HH TYR 121 0.167 0.968 -2.724 974 H THR 122 H THR 122 5.970 6.694 -3.635 975 HA THR 122 HA THR 122 3.263 7.584 -3.901 976 HB THR 122 HB THR 122 4.907 8.188 -2.022 977 HG1 THR 122 HG1 THR 122 3.767 10.571 -2.884 978 HG21 THR 122 3HG2 THR 122 6.741 9.012 -3.430 979 HG22 THR 122 1HG2 THR 122 6.172 10.254 -2.315 980 HG23 THR 122 2HG2 THR 122 5.703 10.312 -4.014 981 H ASN 123 H ASN 123 6.169 7.928 -5.747 982 HA ASN 123 HA ASN 123 5.243 10.157 -7.301 983 HB2 ASN 123 2HB ASN 123 7.528 8.222 -7.666 984 HB3 ASN 123 1HB ASN 123 7.153 9.472 -8.849 985 HD21 ASN 123 1HD2 ASN 123 6.286 11.371 -6.805 986 HD22 ASN 123 2HD2 ASN 123 7.738 11.950 -6.055 987 H SER 124 H SER 124 5.063 6.669 -7.590 988 HA SER 124 HA SER 124 4.208 6.775 -10.336 989 HB2 SER 124 2HB SER 124 3.751 4.271 -9.865 990 HB3 SER 124 1HB SER 124 5.423 4.834 -9.836 991 HG SER 124 HG SER 124 5.506 4.564 -7.724 992 H PHE 125 H PHE 125 2.647 6.237 -7.191 993 HA PHE 125 HA PHE 125 0.067 6.206 -8.600 994 HB2 PHE 125 2HB PHE 125 0.845 5.103 -5.904 995 HB3 PHE 125 1HB PHE 125 -0.824 5.207 -6.459 996 HD1 PHE 125 HD2 PHE 125 -1.530 3.909 -8.463 997 HD2 PHE 125 HD1 PHE 125 2.279 3.385 -6.643 998 HE1 PHE 125 HE2 PHE 125 -1.285 1.745 -9.611 999 HE2 PHE 125 HE1 PHE 125 2.538 1.227 -7.792 1000 HZ PHE 125 HZ PHE 125 0.755 0.403 -9.277 1001 H GLY 126 H GLY 126 1.780 7.751 -5.909 1002 HA2 GLY 126 2HA GLY 126 1.369 10.053 -5.404 1003 HA3 GLY 126 1HA GLY 126 -0.271 9.855 -6.001 1004 H ASP 127 H ASP 127 -0.635 11.017 -3.900 1005 HA ASP 127 HA ASP 127 -0.507 9.271 -1.557 1006 HB2 ASP 127 2HB ASP 127 -1.326 12.176 -1.821 1007 HB3 ASP 127 1HB ASP 127 -1.231 11.289 -0.305 1008 H TRP 128 H TRP 128 -2.747 10.314 -3.935 1009 HA TRP 128 HA TRP 128 -5.001 9.607 -2.177 1010 HB2 TRP 128 2HB TRP 128 -4.917 11.641 -4.404 1011 HB3 TRP 128 1HB TRP 128 -6.366 11.184 -3.515 1012 HD1 TRP 128 HD1 TRP 128 -3.696 13.695 -3.490 1013 HE1 TRP 128 HE1 TRP 128 -3.655 14.981 -1.259 1014 HE3 TRP 128 HE3 TRP 128 -6.690 10.612 -0.721 1015 HZ2 TRP 128 HZ2 TRP 128 -4.737 14.719 1.326 1016 HZ3 TRP 128 HZ3 TRP 128 -7.134 11.203 1.626 1017 HH2 TRP 128 HH2 TRP 128 -6.176 13.215 2.629 1018 H VAL 129 H VAL 129 -3.344 8.186 -4.474 1019 HA VAL 129 HA VAL 129 -5.718 7.277 -5.959 1020 HB VAL 129 HB VAL 129 -2.823 7.178 -6.827 1021 HG11 VAL 129 1HG1 VAL 129 -5.310 6.339 -8.318 1022 HG12 VAL 129 2HG1 VAL 129 -4.094 5.249 -7.653 1023 HG13 VAL 129 3HG1 VAL 129 -3.669 6.352 -8.962 1024 HG21 VAL 129 3HG2 VAL 129 -3.556 8.767 -8.569 1025 HG22 VAL 129 1HG2 VAL 129 -3.723 9.421 -6.939 1026 HG23 VAL 129 2HG2 VAL 129 -5.144 8.834 -7.802 1027 H VAL 130 H VAL 130 -6.274 5.183 -5.923 1028 HA VAL 130 HA VAL 130 -5.051 3.448 -3.993 1029 HB VAL 130 HB VAL 130 -7.191 2.816 -6.042 1030 HG11 VAL 130 1HG1 VAL 130 -7.748 0.924 -4.606 1031 HG12 VAL 130 2HG1 VAL 130 -6.426 1.344 -3.518 1032 HG13 VAL 130 3HG1 VAL 130 -6.079 0.814 -5.164 1033 HG21 VAL 130 3HG2 VAL 130 -7.461 3.654 -3.156 1034 HG22 VAL 130 1HG2 VAL 130 -8.782 3.146 -4.208 1035 HG23 VAL 130 2HG2 VAL 130 -7.887 4.621 -4.568 1036 HA PRO 131 HA PRO 131 -2.016 1.789 -6.827 1037 HB2 PRO 131 2HB PRO 131 -1.204 -0.262 -5.219 1038 HB3 PRO 131 1HB PRO 131 -0.667 1.410 -5.012 1039 HG2 PRO 131 2HG PRO 131 -2.831 -0.079 -3.570 1040 HG3 PRO 131 1HG PRO 131 -1.585 1.000 -2.911 1041 HD2 PRO 131 2HD PRO 131 -4.108 1.838 -3.309 1042 HD3 PRO 131 1HD PRO 131 -2.718 2.913 -3.569 1043 H TYR 132 H TYR 132 -2.989 0.824 -8.537 1044 HA TYR 132 HA TYR 132 -4.296 -1.756 -8.062 1045 HB2 TYR 132 2HB TYR 132 -5.440 -1.499 -10.155 1046 HB3 TYR 132 1HB TYR 132 -5.631 0.000 -9.257 1047 HD1 TYR 132 HD1 TYR 132 -4.068 1.958 -9.896 1048 HD2 TYR 132 HD2 TYR 132 -4.625 -1.488 -12.328 1049 HE1 TYR 132 HE1 TYR 132 -3.264 3.212 -11.854 1050 HE2 TYR 132 HE2 TYR 132 -3.823 -0.244 -14.290 1051 HH TYR 132 HH TYR 132 -2.246 2.749 -14.057 1052 H TYR 133 H TYR 133 -3.675 -3.562 -9.221 1053 HA TYR 133 HA TYR 133 -0.922 -3.789 -9.723 1054 HB2 TYR 133 2HB TYR 133 -1.597 -6.062 -10.696 1055 HB3 TYR 133 1HB TYR 133 -1.998 -5.755 -9.013 1056 HD1 TYR 133 HD1 TYR 133 -4.331 -5.349 -8.345 1057 HD2 TYR 133 HD2 TYR 133 -3.325 -6.373 -12.351 1058 HE1 TYR 133 HE1 TYR 133 -6.680 -5.922 -8.779 1059 HE2 TYR 133 HE2 TYR 133 -5.674 -6.946 -12.798 1060 HH TYR 133 HH TYR 133 -8.212 -6.079 -10.756 1061 H ARG 134 H ARG 134 0.267 -3.461 -11.444 1062 HA ARG 134 HA ARG 134 -0.806 -2.342 -13.816 1063 HB2 ARG 134 2HB ARG 134 1.945 -3.293 -13.049 1064 HB3 ARG 134 1HB ARG 134 1.593 -2.693 -14.662 1065 HG2 ARG 134 2HG ARG 134 0.917 -0.545 -13.728 1066 HG3 ARG 134 1HG ARG 134 1.236 -1.147 -12.101 1067 HD2 ARG 134 2HD ARG 134 3.562 -1.325 -12.523 1068 HD3 ARG 134 1HD ARG 134 3.334 -1.085 -14.255 1069 HE ARG 134 HE ARG 134 2.380 1.211 -13.253 1070 HH11 ARG 134 1HH1 ARG 134 5.375 -0.520 -12.642 1071 HH12 ARG 134 2HH1 ARG 134 6.274 0.929 -12.284 1072 HH21 ARG 134 1HH2 ARG 134 3.564 3.089 -12.856 1073 HH22 ARG 134 2HH2 ARG 134 5.256 2.992 -12.454 1074 H GLY 135 H GLY 135 -2.238 -3.757 -14.725 1075 HA2 GLY 135 2HA GLY 135 -1.422 -6.416 -15.488 1076 HA3 GLY 135 1HA GLY 135 -2.929 -5.619 -15.922 1077 H LEU 136 H LEU 136 -1.363 -7.150 -17.709 1078 HA LEU 136 HA LEU 136 0.242 -5.468 -19.331 1079 HB2 LEU 136 2HB LEU 136 -1.094 -8.102 -19.905 1080 HB3 LEU 136 1HB LEU 136 -0.010 -7.292 -21.024 1081 HG LEU 136 HG LEU 136 0.759 -8.133 -18.241 1082 HD11 LEU 136 1HD1 LEU 136 2.017 -9.943 -19.341 1083 HD12 LEU 136 2HD1 LEU 136 1.298 -9.485 -20.885 1084 HD13 LEU 136 3HD1 LEU 136 0.278 -10.101 -19.586 1085 HD21 LEU 136 3HD2 LEU 136 2.392 -7.165 -20.578 1086 HD22 LEU 136 1HD2 LEU 136 3.044 -7.754 -19.049 1087 HD23 LEU 136 2HD2 LEU 136 2.071 -6.284 -19.085 1088 H GLU 137 H GLU 137 -0.460 -3.827 -20.327 1089 HA GLU 137 HA GLU 137 -1.694 -2.360 -21.517 1090 HB2 GLU 137 2HB GLU 137 -1.693 -4.131 -23.239 1091 HB3 GLU 137 1HB GLU 137 -3.167 -4.793 -22.542 1092 HG2 GLU 137 2HG GLU 137 -4.338 -2.711 -23.047 1093 HG3 GLU 137 1HG GLU 137 -2.862 -2.057 -23.757 1094 H HIS 138 H HIS 138 -2.574 -1.385 -19.713 1095 HA HIS 138 HA HIS 138 -5.047 -2.392 -18.588 1096 HB2 HIS 138 2HB HIS 138 -4.938 -0.442 -17.077 1097 HB3 HIS 138 1HB HIS 138 -3.451 -1.376 -17.060 1098 HD1 HIS 138 HD1 HIS 138 -1.320 -0.128 -17.499 1099 HD2 HIS 138 HD2 HIS 138 -4.701 2.079 -18.530 1100 HE1 HIS 138 HE1 HIS 138 -0.501 2.206 -17.973 1101 HE2 HIS 138 HE2 HIS 138 -2.530 3.484 -18.726 1102 H HIS 139 H HIS 139 -4.827 -1.454 -21.406 1103 HA HIS 139 HA HIS 139 -6.687 0.790 -21.478 1104 HB2 HIS 139 2HB HIS 139 -4.782 0.711 -23.060 1105 HB3 HIS 139 1HB HIS 139 -5.412 -0.784 -23.733 1106 HD1 HIS 139 HD1 HIS 139 -5.983 2.908 -23.689 1107 HD2 HIS 139 HD2 HIS 139 -7.546 -0.479 -25.519 1108 HE1 HIS 139 HE1 HIS 139 -7.459 3.758 -25.539 1109 HE2 HIS 139 HE2 HIS 139 -8.152 1.684 -26.797 1110 H HIS 140 H HIS 140 -6.733 -2.611 -21.437 1111 HA HIS 140 HA HIS 140 -9.465 -2.623 -22.534 1112 HB2 HIS 140 2HB HIS 140 -7.700 -3.639 -24.045 1113 HB3 HIS 140 1HB HIS 140 -7.486 -4.888 -22.825 1114 HD1 HIS 140 HD1 HIS 140 -8.333 -6.789 -24.333 1115 HD2 HIS 140 HD2 HIS 140 -11.071 -3.694 -23.844 1116 HE1 HIS 140 HE1 HIS 140 -10.501 -7.634 -25.286 1117 HE2 HIS 140 HE2 HIS 140 -12.060 -5.658 -25.195 1118 H HIS 141 H HIS 141 -10.972 -3.451 -21.243 1119 HA HIS 141 HA HIS 141 -10.317 -4.359 -18.616 1120 HB2 HIS 141 2HB HIS 141 -12.365 -3.074 -19.115 1121 HB3 HIS 141 1HB HIS 141 -12.961 -4.404 -20.101 1122 HD1 HIS 141 HD1 HIS 141 -12.335 -3.432 -16.522 1123 HD2 HIS 141 HD2 HIS 141 -14.177 -6.457 -18.700 1124 HE1 HIS 141 HE1 HIS 141 -13.627 -4.789 -14.844 1125 HE2 HIS 141 HE2 HIS 141 -14.481 -6.766 -16.152 1126 H HIS 142 H HIS 142 -9.679 -6.354 -18.081 1127 HA HIS 142 HA HIS 142 -10.120 -8.533 -19.964 1128 HB2 HIS 142 2HB HIS 142 -7.855 -8.024 -18.926 1129 HB3 HIS 142 1HB HIS 142 -8.506 -8.649 -17.416 1130 HD1 HIS 142 HD1 HIS 142 -7.510 -10.895 -17.079 1131 HD2 HIS 142 HD2 HIS 142 -8.621 -10.263 -21.042 1132 HE1 HIS 142 HE1 HIS 142 -7.030 -13.056 -18.277 1133 HE2 HIS 142 HE2 HIS 142 -7.560 -12.604 -20.699 1134 H HIS 143 H HIS 143 -10.252 -8.364 -16.381 1135 HA HIS 143 HA HIS 143 -12.380 -10.374 -16.450 1136 HB2 HIS 143 2HB HIS 143 -10.347 -9.574 -14.443 1137 HB3 HIS 143 1HB HIS 143 -11.910 -10.074 -13.811 1138 HD1 HIS 143 HD1 HIS 143 -11.950 -12.466 -13.230 1139 HD2 HIS 143 HD2 HIS 143 -9.442 -11.700 -16.462 1140 HE1 HIS 143 HE1 HIS 143 -10.969 -14.689 -13.875 1141 HE2 HIS 143 HE2 HIS 143 -9.569 -14.229 -15.917 Start of MODEL 17 1 H1 MET 1 1H MET 1 -9.969 3.514 -16.253 2 H2 MET 1 2H MET 1 -10.895 4.669 -17.074 3 H3 MET 1 3H MET 1 -11.640 3.615 -15.974 4 HA MET 1 HA MET 1 -9.673 5.743 -15.350 5 HB2 MET 1 2HB MET 1 -12.109 6.355 -15.867 6 HB3 MET 1 1HB MET 1 -12.529 5.492 -14.396 7 HG2 MET 1 2HG MET 1 -11.167 7.005 -13.085 8 HG3 MET 1 1HG MET 1 -10.658 7.844 -14.550 9 HE1 MET 1 3HE MET 1 -12.895 10.647 -13.198 10 HE2 MET 1 1HE MET 1 -11.416 10.245 -14.073 11 HE3 MET 1 2HE MET 1 -11.637 9.689 -12.414 12 HA PRO 2 HA PRO 2 -8.671 2.873 -12.089 13 HB2 PRO 2 2HB PRO 2 -6.860 4.449 -10.819 14 HB3 PRO 2 1HB PRO 2 -6.500 3.582 -12.318 15 HG2 PRO 2 2HG PRO 2 -7.255 6.452 -11.924 16 HG3 PRO 2 1HG PRO 2 -6.008 5.757 -12.978 17 HD2 PRO 2 2HD PRO 2 -8.428 6.542 -13.906 18 HD3 PRO 2 1HD PRO 2 -7.532 5.180 -14.608 19 H VAL 3 H VAL 3 -8.751 2.790 -9.747 20 HA VAL 3 HA VAL 3 -10.938 4.312 -8.675 21 HB VAL 3 HB VAL 3 -9.127 2.373 -7.220 22 HG11 VAL 3 1HG1 VAL 3 -11.888 3.408 -6.578 23 HG12 VAL 3 2HG1 VAL 3 -10.395 3.800 -5.725 24 HG13 VAL 3 3HG1 VAL 3 -11.032 2.156 -5.675 25 HG21 VAL 3 3HG2 VAL 3 -11.745 1.852 -8.631 26 HG22 VAL 3 1HG2 VAL 3 -10.854 0.687 -7.650 27 HG23 VAL 3 2HG2 VAL 3 -10.155 1.295 -9.152 28 H GLU 4 H GLU 4 -10.520 6.370 -8.241 29 HA GLU 4 HA GLU 4 -8.130 7.008 -6.646 30 HB2 GLU 4 2HB GLU 4 -8.284 9.286 -7.779 31 HB3 GLU 4 1HB GLU 4 -7.737 7.950 -8.785 32 HG2 GLU 4 2HG GLU 4 -9.868 7.778 -9.839 33 HG3 GLU 4 1HG GLU 4 -10.579 8.922 -8.703 34 H LEU 5 H LEU 5 -8.365 8.458 -4.976 35 HA LEU 5 HA LEU 5 -11.127 9.127 -4.237 36 HB2 LEU 5 2HB LEU 5 -9.660 7.897 -2.613 37 HB3 LEU 5 1HB LEU 5 -8.620 9.306 -2.559 38 HG LEU 5 HG LEU 5 -10.523 10.636 -1.676 39 HD11 LEU 5 1HD1 LEU 5 -12.497 9.443 -0.841 40 HD12 LEU 5 2HD1 LEU 5 -11.907 7.960 -1.592 41 HD13 LEU 5 3HD1 LEU 5 -12.355 9.340 -2.595 42 HD21 LEU 5 3HD2 LEU 5 -10.492 9.668 0.566 43 HD22 LEU 5 1HD2 LEU 5 -8.885 9.641 -0.161 44 HD23 LEU 5 2HD2 LEU 5 -9.845 8.164 -0.088 45 H ARG 6 H ARG 6 -11.790 11.107 -4.735 46 HA ARG 6 HA ARG 6 -9.888 13.118 -5.537 47 HB2 ARG 6 2HB ARG 6 -12.910 13.152 -5.409 48 HB3 ARG 6 1HB ARG 6 -11.940 14.499 -5.989 49 HG2 ARG 6 2HG ARG 6 -12.640 13.388 -7.920 50 HG3 ARG 6 1HG ARG 6 -10.974 12.862 -7.682 51 HD2 ARG 6 2HD ARG 6 -11.862 10.826 -6.538 52 HD3 ARG 6 1HD ARG 6 -13.482 11.335 -7.009 53 HE ARG 6 HE ARG 6 -11.467 10.979 -9.104 54 HH11 ARG 6 1HH1 ARG 6 -14.388 9.892 -7.504 55 HH12 ARG 6 2HH1 ARG 6 -14.795 8.752 -8.744 56 HH21 ARG 6 1HH2 ARG 6 -12.002 9.470 -10.730 57 HH22 ARG 6 2HH2 ARG 6 -13.442 8.505 -10.580 58 H ALA 7 H ALA 7 -10.028 15.358 -4.689 59 HA ALA 7 HA ALA 7 -9.749 15.368 -1.862 60 HB1 ALA 7 3HB ALA 7 -9.948 17.682 -3.787 61 HB2 ALA 7 1HB ALA 7 -8.465 16.888 -3.257 62 HB3 ALA 7 2HB ALA 7 -9.443 17.795 -2.102 63 H ASN 8 H ASN 8 -12.277 16.375 -4.073 64 HA ASN 8 HA ASN 8 -14.040 16.978 -1.800 65 HB2 ASN 8 2HB ASN 8 -15.550 17.968 -3.573 66 HB3 ASN 8 1HB ASN 8 -14.010 18.794 -3.363 67 HD21 ASN 8 1HD2 ASN 8 -15.929 16.788 -5.446 68 HD22 ASN 8 2HD2 ASN 8 -14.959 16.992 -6.870 69 H TRP 9 H TRP 9 -13.491 14.393 -2.029 70 HA TRP 9 HA TRP 9 -15.011 12.859 -3.819 71 HB2 TRP 9 2HB TRP 9 -14.606 10.998 -2.201 72 HB3 TRP 9 1HB TRP 9 -13.150 11.865 -2.665 73 HD1 TRP 9 HD1 TRP 9 -11.826 13.139 -0.770 74 HE1 TRP 9 HE1 TRP 9 -12.012 13.174 1.794 75 HE3 TRP 9 HE3 TRP 9 -16.376 10.869 -0.242 76 HZ2 TRP 9 HZ2 TRP 9 -13.833 12.346 3.776 77 HZ3 TRP 9 HZ3 TRP 9 -17.266 10.524 2.022 78 HH2 TRP 9 HH2 TRP 9 -16.019 11.248 3.992 79 H SER 10 H SER 10 -16.871 11.603 -3.494 80 HA SER 10 HA SER 10 -18.664 12.542 -1.367 81 HB2 SER 10 2HB SER 10 -19.499 12.719 -3.713 82 HB3 SER 10 1HB SER 10 -19.325 10.973 -3.880 83 HG SER 10 HG SER 10 -21.473 11.876 -3.273 84 H GLU 11 H GLU 11 -20.105 10.729 -0.480 85 HA GLU 11 HA GLU 11 -18.541 8.781 0.772 86 HB2 GLU 11 2HB GLU 11 -21.519 8.660 0.267 87 HB3 GLU 11 1HB GLU 11 -20.637 7.777 1.505 88 HG2 GLU 11 2HG GLU 11 -20.046 9.892 2.583 89 HG3 GLU 11 1HG GLU 11 -20.952 10.767 1.350 90 H GLU 12 H GLU 12 -20.359 8.719 -2.199 91 HA GLU 12 HA GLU 12 -20.327 5.987 -2.779 92 HB2 GLU 12 2HB GLU 12 -20.112 8.297 -4.723 93 HB3 GLU 12 1HB GLU 12 -20.669 6.672 -5.097 94 HG2 GLU 12 2HG GLU 12 -22.622 6.956 -3.766 95 HG3 GLU 12 1HG GLU 12 -22.032 8.489 -3.130 96 H ASP 13 H ASP 13 -17.981 8.539 -3.519 97 HA ASP 13 HA ASP 13 -16.162 6.873 -4.934 98 HB2 ASP 13 2HB ASP 13 -15.592 9.475 -3.500 99 HB3 ASP 13 1HB ASP 13 -14.573 8.719 -4.717 100 H LEU 14 H LEU 14 -16.367 8.023 -1.604 101 HA LEU 14 HA LEU 14 -13.932 7.059 -0.648 102 HB2 LEU 14 2HB LEU 14 -15.477 8.586 0.563 103 HB3 LEU 14 1HB LEU 14 -16.541 7.224 0.860 104 HG LEU 14 HG LEU 14 -14.645 6.125 2.097 105 HD11 LEU 14 1HD1 LEU 14 -13.420 8.868 1.815 106 HD12 LEU 14 2HD1 LEU 14 -12.792 7.361 1.145 107 HD13 LEU 14 3HD1 LEU 14 -12.839 7.599 2.891 108 HD21 LEU 14 3HD2 LEU 14 -14.945 7.480 4.117 109 HD22 LEU 14 1HD2 LEU 14 -16.469 7.211 3.272 110 HD23 LEU 14 2HD2 LEU 14 -15.651 8.767 3.139 111 H GLU 15 H GLU 15 -17.137 5.508 -0.550 112 HA GLU 15 HA GLU 15 -16.266 3.087 0.568 113 HB2 GLU 15 2HB GLU 15 -18.702 4.072 -0.748 114 HB3 GLU 15 1HB GLU 15 -18.448 2.338 -0.881 115 HG2 GLU 15 2HG GLU 15 -19.826 2.919 1.043 116 HG3 GLU 15 1HG GLU 15 -18.324 2.137 1.524 117 H THR 16 H THR 16 -16.310 4.211 -2.755 118 HA THR 16 HA THR 16 -15.796 1.741 -4.017 119 HB THR 16 HB THR 16 -14.888 4.502 -4.874 120 HG1 THR 16 HG1 THR 16 -17.223 4.144 -4.626 121 HG21 THR 16 3HG2 THR 16 -15.165 1.941 -6.448 122 HG22 THR 16 1HG2 THR 16 -13.656 2.755 -6.038 123 HG23 THR 16 2HG2 THR 16 -14.804 3.526 -7.133 124 H VAL 17 H VAL 17 -13.637 4.257 -2.774 125 HA VAL 17 HA VAL 17 -11.205 2.991 -3.453 126 HB VAL 17 HB VAL 17 -11.800 5.028 -1.297 127 HG11 VAL 17 1HG1 VAL 17 -9.714 3.888 -0.800 128 HG12 VAL 17 2HG1 VAL 17 -9.398 5.535 -1.349 129 HG13 VAL 17 3HG1 VAL 17 -9.142 4.177 -2.445 130 HG21 VAL 17 3HG2 VAL 17 -10.932 6.647 -2.912 131 HG22 VAL 17 1HG2 VAL 17 -12.339 5.794 -3.546 132 HG23 VAL 17 2HG2 VAL 17 -10.721 5.356 -4.095 133 H ILE 18 H ILE 18 -13.071 3.079 -0.435 134 HA ILE 18 HA ILE 18 -11.283 1.564 1.107 135 HB ILE 18 HB ILE 18 -14.270 1.888 1.403 136 HG12 ILE 18 2HG1 ILE 18 -11.931 3.240 2.771 137 HG13 ILE 18 1HG1 ILE 18 -12.967 3.968 1.549 138 HG21 ILE 18 1HG2 ILE 18 -12.266 0.789 3.379 139 HG22 ILE 18 2HG2 ILE 18 -13.526 -0.133 2.560 140 HG23 ILE 18 3HG2 ILE 18 -13.966 1.124 3.714 141 HD11 ILE 18 3HD1 ILE 18 -14.867 3.812 3.054 142 HD12 ILE 18 1HD1 ILE 18 -13.542 4.716 3.787 143 HD13 ILE 18 2HD1 ILE 18 -13.843 3.048 4.271 144 H ARG 19 H ARG 19 -14.151 0.535 -0.744 145 HA ARG 19 HA ARG 19 -14.062 -2.179 -0.022 146 HB2 ARG 19 2HB ARG 19 -15.966 -0.977 -1.160 147 HB3 ARG 19 1HB ARG 19 -15.050 -1.085 -2.655 148 HG2 ARG 19 2HG ARG 19 -15.074 -3.684 -1.702 149 HG3 ARG 19 1HG ARG 19 -16.690 -3.075 -1.339 150 HD2 ARG 19 2HD ARG 19 -16.816 -4.007 -3.503 151 HD3 ARG 19 1HD ARG 19 -16.779 -2.261 -3.732 152 HE ARG 19 HE ARG 19 -14.315 -3.854 -3.968 153 HH11 ARG 19 1HH1 ARG 19 -16.641 -1.626 -5.362 154 HH12 ARG 19 2HH1 ARG 19 -15.716 -1.388 -6.810 155 HH21 ARG 19 1HH2 ARG 19 -13.105 -3.526 -5.844 156 HH22 ARG 19 2HH2 ARG 19 -13.698 -2.464 -7.093 157 H ALA 20 H ALA 20 -12.372 -0.381 -2.511 158 HA ALA 20 HA ALA 20 -11.456 -2.609 -4.003 159 HB1 ALA 20 3HB ALA 20 -11.512 -0.346 -4.923 160 HB2 ALA 20 1HB ALA 20 -9.893 -1.042 -5.029 161 HB3 ALA 20 2HB ALA 20 -10.261 0.150 -3.784 162 H VAL 21 H VAL 21 -10.100 -0.803 -1.289 163 HA VAL 21 HA VAL 21 -7.650 -2.347 -1.337 164 HB VAL 21 HB VAL 21 -8.603 -0.402 0.776 165 HG11 VAL 21 1HG1 VAL 21 -6.824 -1.875 1.546 166 HG12 VAL 21 2HG1 VAL 21 -6.236 -0.223 1.361 167 HG13 VAL 21 3HG1 VAL 21 -5.842 -1.441 0.149 168 HG21 VAL 21 3HG2 VAL 21 -8.509 0.705 -1.384 169 HG22 VAL 21 1HG2 VAL 21 -6.873 0.098 -1.647 170 HG23 VAL 21 2HG2 VAL 21 -7.188 1.257 -0.355 171 H TYR 22 H TYR 22 -10.676 -2.275 0.409 172 HA TYR 22 HA TYR 22 -9.883 -4.110 2.479 173 HB2 TYR 22 2HB TYR 22 -12.120 -2.422 1.896 174 HB3 TYR 22 1HB TYR 22 -12.711 -4.054 2.184 175 HD1 TYR 22 HD2 TYR 22 -10.829 -1.244 3.669 176 HD2 TYR 22 HD1 TYR 22 -12.734 -4.982 4.368 177 HE1 TYR 22 HE2 TYR 22 -10.688 -0.856 6.093 178 HE2 TYR 22 HE1 TYR 22 -12.603 -4.605 6.793 179 HH TYR 22 HH TYR 22 -12.076 -1.674 8.151 180 H ARG 23 H ARG 23 -9.076 -5.502 0.444 181 HA ARG 23 HA ARG 23 -11.212 -7.189 -0.608 182 HB2 ARG 23 2HB ARG 23 -9.180 -6.251 -1.936 183 HB3 ARG 23 1HB ARG 23 -8.283 -7.559 -1.175 184 HG2 ARG 23 2HG ARG 23 -9.849 -9.182 -2.142 185 HG3 ARG 23 1HG ARG 23 -10.718 -7.860 -2.926 186 HD2 ARG 23 2HD ARG 23 -9.235 -8.868 -4.525 187 HD3 ARG 23 1HD ARG 23 -8.622 -7.267 -4.118 188 HE ARG 23 HE ARG 23 -7.087 -8.523 -2.534 189 HH11 ARG 23 1HH1 ARG 23 -8.302 -9.895 -5.515 190 HH12 ARG 23 2HH1 ARG 23 -6.955 -10.984 -5.708 191 HH21 ARG 23 1HH2 ARG 23 -5.337 -9.940 -2.764 192 HH22 ARG 23 2HH2 ARG 23 -5.276 -11.023 -4.126 193 H GLN 24 H GLN 24 -10.562 -7.223 2.192 194 HA GLN 24 HA GLN 24 -9.025 -9.423 2.969 195 HB2 GLN 24 2HB GLN 24 -10.654 -9.310 5.028 196 HB3 GLN 24 1HB GLN 24 -9.487 -8.031 4.734 197 HG2 GLN 24 2HG GLN 24 -11.549 -7.019 5.326 198 HG3 GLN 24 1HG GLN 24 -11.284 -6.731 3.611 199 HE21 GLN 24 1HE2 GLN 24 -13.430 -6.388 3.157 200 HE22 GLN 24 2HE2 GLN 24 -14.618 -7.648 3.194 201 H VAL 25 H VAL 25 -9.774 -11.429 3.923 202 HA VAL 25 HA VAL 25 -12.193 -12.479 2.607 203 HB VAL 25 HB VAL 25 -10.070 -13.319 1.579 204 HG11 VAL 25 1HG1 VAL 25 -8.665 -13.358 3.552 205 HG12 VAL 25 2HG1 VAL 25 -8.723 -14.957 2.808 206 HG13 VAL 25 3HG1 VAL 25 -9.662 -14.626 4.264 207 HG21 VAL 25 3HG2 VAL 25 -10.713 -15.683 1.561 208 HG22 VAL 25 1HG2 VAL 25 -12.114 -14.624 1.407 209 HG23 VAL 25 2HG2 VAL 25 -11.765 -15.407 2.949 210 H LEU 26 H LEU 26 -10.680 -11.808 5.499 211 HA LEU 26 HA LEU 26 -11.817 -14.063 6.936 212 HB2 LEU 26 2HB LEU 26 -10.709 -12.905 8.951 213 HB3 LEU 26 1HB LEU 26 -9.707 -13.726 7.782 214 HG LEU 26 HG LEU 26 -8.759 -11.593 8.642 215 HD11 LEU 26 1HD1 LEU 26 -8.035 -10.717 6.477 216 HD12 LEU 26 2HD1 LEU 26 -9.288 -11.670 5.680 217 HD13 LEU 26 3HD1 LEU 26 -7.979 -12.478 6.541 218 HD21 LEU 26 3HD2 LEU 26 -10.771 -10.271 8.862 219 HD22 LEU 26 1HD2 LEU 26 -11.018 -10.305 7.116 220 HD23 LEU 26 2HD2 LEU 26 -9.625 -9.461 7.795 221 H GLY 27 H GLY 27 -13.104 -13.752 8.857 222 HA2 GLY 27 2HA GLY 27 -14.272 -11.335 9.632 223 HA3 GLY 27 1HA GLY 27 -15.306 -12.044 8.397 224 H ASN 28 H ASN 28 -16.400 -13.947 8.812 225 HA ASN 28 HA ASN 28 -17.563 -15.468 10.005 226 HB2 ASN 28 2HB ASN 28 -15.331 -16.424 10.455 227 HB3 ASN 28 1HB ASN 28 -15.202 -15.425 11.899 228 HD21 ASN 28 1HD2 ASN 28 -16.813 -18.126 10.407 229 HD22 ASN 28 2HD2 ASN 28 -17.441 -18.810 11.871 230 H ASP 29 H ASP 29 -19.356 -14.609 10.738 231 HA ASP 29 HA ASP 29 -20.906 -13.724 12.152 232 HB2 ASP 29 2HB ASP 29 -19.436 -15.229 13.779 233 HB3 ASP 29 1HB ASP 29 -18.973 -13.663 14.436 234 H TYR 30 H TYR 30 -20.896 -11.865 14.104 235 HA TYR 30 HA TYR 30 -19.103 -9.712 13.194 236 HB2 TYR 30 2HB TYR 30 -20.801 -8.115 13.073 237 HB3 TYR 30 1HB TYR 30 -21.567 -9.534 12.374 238 HD1 TYR 30 HD2 TYR 30 -23.156 -10.887 13.828 239 HD2 TYR 30 HD1 TYR 30 -21.690 -7.055 14.955 240 HE1 TYR 30 HE2 TYR 30 -24.992 -10.665 15.449 241 HE2 TYR 30 HE1 TYR 30 -23.519 -6.823 16.578 242 HH TYR 30 HH TYR 30 -25.760 -7.701 16.962 243 H VAL 31 H VAL 31 -20.478 -11.552 15.664 244 HA VAL 31 HA VAL 31 -20.111 -9.691 17.815 245 HB VAL 31 HB VAL 31 -20.408 -12.701 17.913 246 HG11 VAL 31 1HG1 VAL 31 -21.051 -12.354 20.249 247 HG12 VAL 31 2HG1 VAL 31 -20.715 -10.630 20.084 248 HG13 VAL 31 3HG1 VAL 31 -19.403 -11.801 19.946 249 HG21 VAL 31 3HG2 VAL 31 -22.330 -11.603 16.867 250 HG22 VAL 31 1HG2 VAL 31 -22.475 -10.531 18.261 251 HG23 VAL 31 2HG2 VAL 31 -22.750 -12.264 18.448 252 H MET 32 H MET 32 -18.278 -9.130 18.662 253 HA MET 32 HA MET 32 -16.106 -9.018 19.256 254 HB2 MET 32 2HB MET 32 -16.814 -11.265 20.359 255 HB3 MET 32 1HB MET 32 -15.870 -12.008 19.077 256 HG2 MET 32 2HG MET 32 -14.790 -9.980 21.020 257 HG3 MET 32 1HG MET 32 -14.661 -11.722 21.228 258 HE1 MET 32 3HE MET 32 -12.173 -9.730 21.299 259 HE2 MET 32 1HE MET 32 -10.995 -10.632 20.345 260 HE3 MET 32 2HE MET 32 -12.019 -11.475 21.507 261 H ALA 33 H ALA 33 -15.910 -8.083 17.106 262 HA ALA 33 HA ALA 33 -14.232 -9.720 15.325 263 HB1 ALA 33 3HB ALA 33 -15.564 -7.063 14.782 264 HB2 ALA 33 1HB ALA 33 -16.146 -8.634 14.235 265 HB3 ALA 33 2HB ALA 33 -14.616 -8.000 13.626 266 H SER 34 H SER 34 -12.233 -9.616 16.189 267 HA SER 34 HA SER 34 -11.389 -7.239 17.594 268 HB2 SER 34 2HB SER 34 -9.361 -8.677 18.119 269 HB3 SER 34 1HB SER 34 -10.914 -9.282 18.696 270 HG SER 34 HG SER 34 -10.965 -10.676 16.864 271 H GLU 35 H GLU 35 -10.019 -5.758 16.972 272 HA GLU 35 HA GLU 35 -8.343 -4.645 15.957 273 HB2 GLU 35 2HB GLU 35 -7.546 -7.331 14.833 274 HB3 GLU 35 1HB GLU 35 -6.554 -5.879 14.823 275 HG2 GLU 35 2HG GLU 35 -7.435 -7.495 17.196 276 HG3 GLU 35 1HG GLU 35 -5.795 -7.239 16.605 277 H ARG 36 H ARG 36 -10.961 -5.328 14.594 278 HA ARG 36 HA ARG 36 -10.406 -5.010 11.802 279 HB2 ARG 36 2HB ARG 36 -12.511 -5.998 12.516 280 HB3 ARG 36 1HB ARG 36 -12.916 -4.552 13.428 281 HG2 ARG 36 2HG ARG 36 -13.166 -3.280 11.400 282 HG3 ARG 36 1HG ARG 36 -12.597 -4.644 10.436 283 HD2 ARG 36 2HD ARG 36 -14.516 -5.940 10.990 284 HD3 ARG 36 1HD ARG 36 -15.035 -4.763 12.196 285 HE ARG 36 HE ARG 36 -15.090 -3.264 10.000 286 HH11 ARG 36 1HH1 ARG 36 -16.215 -6.563 10.457 287 HH12 ARG 36 2HH1 ARG 36 -17.553 -6.381 9.355 288 HH21 ARG 36 1HH2 ARG 36 -16.828 -3.041 8.563 289 HH22 ARG 36 2HH2 ARG 36 -17.882 -4.391 8.262 290 H LEU 37 H LEU 37 -9.752 -3.189 10.837 291 HA LEU 37 HA LEU 37 -9.363 -0.863 12.472 292 HB2 LEU 37 2HB LEU 37 -8.094 0.044 10.600 293 HB3 LEU 37 1HB LEU 37 -7.575 -1.576 11.012 294 HG LEU 37 HG LEU 37 -9.491 -1.113 8.736 295 HD11 LEU 37 1HD1 LEU 37 -6.474 -1.015 8.632 296 HD12 LEU 37 2HD1 LEU 37 -7.574 0.328 8.314 297 HD13 LEU 37 3HD1 LEU 37 -7.549 -1.068 7.235 298 HD21 LEU 37 3HD2 LEU 37 -7.428 -3.241 9.289 299 HD22 LEU 37 1HD2 LEU 37 -8.544 -3.196 7.926 300 HD23 LEU 37 2HD2 LEU 37 -9.162 -3.402 9.566 301 H VAL 38 H VAL 38 -11.999 -1.083 12.332 302 HA VAL 38 HA VAL 38 -13.258 0.423 10.301 303 HB VAL 38 HB VAL 38 -14.511 -0.994 11.879 304 HG11 VAL 38 1HG1 VAL 38 -13.842 1.100 13.943 305 HG12 VAL 38 2HG1 VAL 38 -13.234 -0.556 13.900 306 HG13 VAL 38 3HG1 VAL 38 -14.951 -0.254 14.162 307 HG21 VAL 38 3HG2 VAL 38 -15.322 1.911 11.977 308 HG22 VAL 38 1HG2 VAL 38 -16.374 0.537 12.317 309 HG23 VAL 38 2HG2 VAL 38 -15.707 0.756 10.700 310 H SER 39 H SER 39 -11.369 1.257 13.068 311 HA SER 39 HA SER 39 -12.022 3.980 13.324 312 HB2 SER 39 2HB SER 39 -9.655 4.071 14.328 313 HB3 SER 39 1HB SER 39 -10.809 2.977 15.097 314 HG SER 39 HG SER 39 -8.500 2.424 13.676 315 H ALA 40 H ALA 40 -9.718 2.243 11.298 316 HA ALA 40 HA ALA 40 -8.410 4.486 10.204 317 HB1 ALA 40 3HB ALA 40 -8.815 1.734 9.028 318 HB2 ALA 40 1HB ALA 40 -7.462 2.253 10.036 319 HB3 ALA 40 2HB ALA 40 -7.682 2.946 8.429 320 H GLU 41 H GLU 41 -11.198 2.584 9.126 321 HA GLU 41 HA GLU 41 -11.756 4.008 6.775 322 HB2 GLU 41 2HB GLU 41 -13.628 2.591 8.674 323 HB3 GLU 41 1HB GLU 41 -14.073 3.147 7.068 324 HG2 GLU 41 2HG GLU 41 -12.550 1.629 6.038 325 HG3 GLU 41 1HG GLU 41 -11.855 1.189 7.596 326 H SER 42 H SER 42 -12.709 4.578 10.123 327 HA SER 42 HA SER 42 -14.416 6.776 9.650 328 HB2 SER 42 2HB SER 42 -14.390 5.516 11.770 329 HB3 SER 42 1HB SER 42 -12.767 6.114 12.108 330 HG SER 42 HG SER 42 -13.796 7.664 13.076 331 H LEU 43 H LEU 43 -10.948 6.572 10.405 332 HA LEU 43 HA LEU 43 -10.455 9.341 10.507 333 HB2 LEU 43 2HB LEU 43 -8.612 7.065 9.782 334 HB3 LEU 43 1HB LEU 43 -8.081 8.710 10.078 335 HG LEU 43 HG LEU 43 -9.430 6.919 12.099 336 HD11 LEU 43 1HD1 LEU 43 -7.235 6.868 13.181 337 HD12 LEU 43 2HD1 LEU 43 -6.554 7.786 11.838 338 HD13 LEU 43 3HD1 LEU 43 -7.186 6.162 11.566 339 HD21 LEU 43 3HD2 LEU 43 -9.937 9.279 12.458 340 HD22 LEU 43 1HD2 LEU 43 -8.219 9.668 12.402 341 HD23 LEU 43 2HD2 LEU 43 -8.854 8.668 13.708 342 H LEU 44 H LEU 44 -10.604 7.084 7.831 343 HA LEU 44 HA LEU 44 -9.507 8.855 5.889 344 HB2 LEU 44 2HB LEU 44 -9.611 6.375 5.651 345 HB3 LEU 44 1HB LEU 44 -11.350 6.498 5.463 346 HG LEU 44 HG LEU 44 -11.009 7.848 3.414 347 HD11 LEU 44 1HD1 LEU 44 -8.792 7.962 2.404 348 HD12 LEU 44 2HD1 LEU 44 -8.098 7.169 3.818 349 HD13 LEU 44 3HD1 LEU 44 -8.813 8.773 3.972 350 HD21 LEU 44 3HD2 LEU 44 -11.346 5.431 3.278 351 HD22 LEU 44 1HD2 LEU 44 -9.607 5.178 3.413 352 HD23 LEU 44 2HD2 LEU 44 -10.272 6.001 2.002 353 H ARG 45 H ARG 45 -12.796 8.072 6.939 354 HA ARG 45 HA ARG 45 -14.129 9.617 4.982 355 HB2 ARG 45 2HB ARG 45 -15.279 7.878 6.262 356 HB3 ARG 45 1HB ARG 45 -15.053 8.799 7.744 357 HG2 ARG 45 2HG ARG 45 -16.498 10.544 6.944 358 HG3 ARG 45 1HG ARG 45 -16.630 9.765 5.368 359 HD2 ARG 45 2HD ARG 45 -17.600 8.624 7.988 360 HD3 ARG 45 1HD ARG 45 -18.612 9.374 6.754 361 HE ARG 45 HE ARG 45 -17.403 6.736 6.671 362 HH11 ARG 45 1HH1 ARG 45 -19.045 9.278 4.891 363 HH12 ARG 45 2HH1 ARG 45 -19.605 8.206 3.648 364 HH21 ARG 45 1HH2 ARG 45 -18.113 5.343 5.013 365 HH22 ARG 45 2HH2 ARG 45 -19.051 5.972 3.690 366 H ASN 46 H ASN 46 -12.669 10.437 8.036 367 HA ASN 46 HA ASN 46 -13.848 13.101 8.001 368 HB2 ASN 46 2HB ASN 46 -12.073 11.667 9.972 369 HB3 ASN 46 1HB ASN 46 -12.436 13.384 10.115 370 HD21 ASN 46 1HD2 ASN 46 -13.704 10.157 10.334 371 HD22 ASN 46 2HD2 ASN 46 -15.188 10.587 11.115 372 H GLY 47 H GLY 47 -11.547 11.776 6.266 373 HA2 GLY 47 2HA GLY 47 -9.843 12.623 4.999 374 HA3 GLY 47 1HA GLY 47 -10.435 14.214 5.443 375 H LYS 48 H LYS 48 -9.242 11.813 7.725 376 HA LYS 48 HA LYS 48 -7.202 13.724 8.557 377 HB2 LYS 48 2HB LYS 48 -8.286 11.218 9.825 378 HB3 LYS 48 1HB LYS 48 -6.868 12.045 10.450 379 HG2 LYS 48 2HG LYS 48 -8.313 14.117 10.606 380 HG3 LYS 48 1HG LYS 48 -9.689 13.054 10.298 381 HD2 LYS 48 2HD LYS 48 -9.280 11.812 12.278 382 HD3 LYS 48 1HD LYS 48 -7.707 12.575 12.513 383 HE2 LYS 48 2HE LYS 48 -8.924 14.759 12.775 384 HE3 LYS 48 1HE LYS 48 -10.428 13.839 12.783 385 HZ1 LYS 48 3HZ LYS 48 -9.509 14.371 15.022 386 HZ2 LYS 48 1HZ LYS 48 -8.204 13.346 14.683 387 HZ3 LYS 48 2HZ LYS 48 -9.778 12.718 14.756 388 H ILE 49 H ILE 49 -7.466 10.409 7.361 389 HA ILE 49 HA ILE 49 -4.537 10.362 7.110 390 HB ILE 49 HB ILE 49 -4.702 7.934 6.833 391 HG12 ILE 49 2HG1 ILE 49 -7.647 8.287 7.426 392 HG13 ILE 49 1HG1 ILE 49 -6.981 7.893 5.845 393 HG21 ILE 49 1HG2 ILE 49 -4.328 8.796 9.045 394 HG22 ILE 49 2HG2 ILE 49 -5.386 7.388 9.143 395 HG23 ILE 49 3HG2 ILE 49 -6.060 9.011 9.294 396 HD11 ILE 49 3HD1 ILE 49 -7.852 5.919 6.967 397 HD12 ILE 49 1HD1 ILE 49 -6.754 6.197 8.319 398 HD13 ILE 49 2HD1 ILE 49 -6.107 5.800 6.727 399 H THR 50 H THR 50 -3.626 9.508 5.158 400 HA THR 50 HA THR 50 -5.126 10.366 2.816 401 HB THR 50 HB THR 50 -3.000 10.168 1.624 402 HG1 THR 50 HG1 THR 50 -1.182 9.691 3.387 403 HG21 THR 50 3HG2 THR 50 -3.397 12.239 2.852 404 HG22 THR 50 1HG2 THR 50 -1.682 11.826 2.875 405 HG23 THR 50 2HG2 THR 50 -2.679 11.531 4.300 406 H VAL 51 H VAL 51 -4.752 8.947 0.787 407 HA VAL 51 HA VAL 51 -5.708 6.336 1.160 408 HB VAL 51 HB VAL 51 -4.209 7.481 -1.211 409 HG11 VAL 51 1HG1 VAL 51 -4.167 5.026 -1.208 410 HG12 VAL 51 2HG1 VAL 51 -5.173 5.662 -2.511 411 HG13 VAL 51 3HG1 VAL 51 -5.925 5.004 -1.057 412 HG21 VAL 51 3HG2 VAL 51 -7.164 7.175 -0.697 413 HG22 VAL 51 1HG2 VAL 51 -6.432 7.776 -2.185 414 HG23 VAL 51 2HG2 VAL 51 -6.259 8.689 -0.685 415 H ARG 52 H ARG 52 -2.472 7.664 1.009 416 HA ARG 52 HA ARG 52 -1.004 5.274 0.837 417 HB2 ARG 52 2HB ARG 52 -0.310 7.881 2.203 418 HB3 ARG 52 1HB ARG 52 0.832 6.580 1.906 419 HG2 ARG 52 2HG ARG 52 -0.679 7.940 -0.303 420 HG3 ARG 52 1HG ARG 52 0.873 8.525 0.295 421 HD2 ARG 52 2HD ARG 52 1.367 7.191 -1.583 422 HD3 ARG 52 1HD ARG 52 1.780 6.214 -0.177 423 HE ARG 52 HE ARG 52 -0.820 5.554 -0.860 424 HH11 ARG 52 1HH1 ARG 52 2.333 5.444 -2.399 425 HH12 ARG 52 2HH1 ARG 52 1.957 4.035 -3.338 426 HH21 ARG 52 1HH2 ARG 52 -1.304 3.694 -2.130 427 HH22 ARG 52 2HH2 ARG 52 -0.087 3.042 -3.181 428 H GLU 53 H GLU 53 -2.077 7.156 3.656 429 HA GLU 53 HA GLU 53 -1.065 5.407 5.614 430 HB2 GLU 53 2HB GLU 53 -3.402 7.318 5.767 431 HB3 GLU 53 1HB GLU 53 -2.655 6.533 7.151 432 HG2 GLU 53 2HG GLU 53 -1.373 8.522 5.296 433 HG3 GLU 53 1HG GLU 53 -1.861 8.788 6.969 434 H PHE 54 H PHE 54 -4.221 5.599 4.032 435 HA PHE 54 HA PHE 54 -5.498 3.613 5.560 436 HB2 PHE 54 2HB PHE 54 -6.694 5.220 4.100 437 HB3 PHE 54 1HB PHE 54 -6.049 4.392 2.687 438 HD1 PHE 54 HD2 PHE 54 -8.124 3.830 5.722 439 HD2 PHE 54 HD1 PHE 54 -7.217 2.616 1.742 440 HE1 PHE 54 HE2 PHE 54 -10.046 2.294 5.756 441 HE2 PHE 54 HE1 PHE 54 -9.138 1.081 1.772 442 HZ PHE 54 HZ PHE 54 -10.554 0.919 3.778 443 H VAL 55 H VAL 55 -3.896 3.394 2.375 444 HA VAL 55 HA VAL 55 -4.211 0.625 2.051 445 HB VAL 55 HB VAL 55 -2.068 2.466 0.969 446 HG11 VAL 55 1HG1 VAL 55 -2.680 -0.385 0.185 447 HG12 VAL 55 2HG1 VAL 55 -1.217 0.180 0.990 448 HG13 VAL 55 3HG1 VAL 55 -1.571 0.698 -0.659 449 HG21 VAL 55 3HG2 VAL 55 -4.325 2.974 0.207 450 HG22 VAL 55 1HG2 VAL 55 -4.550 1.294 -0.285 451 HG23 VAL 55 2HG2 VAL 55 -3.360 2.302 -1.109 452 H ARG 56 H ARG 56 -1.611 2.503 3.578 453 HA ARG 56 HA ARG 56 0.077 0.340 4.161 454 HB2 ARG 56 2HB ARG 56 0.831 2.661 4.339 455 HB3 ARG 56 1HB ARG 56 -0.278 2.935 5.677 456 HG2 ARG 56 2HG ARG 56 0.946 1.531 7.116 457 HG3 ARG 56 1HG ARG 56 1.883 0.856 5.783 458 HD2 ARG 56 2HD ARG 56 3.271 2.382 6.985 459 HD3 ARG 56 1HD ARG 56 2.881 3.098 5.427 460 HE ARG 56 HE ARG 56 1.082 4.321 6.829 461 HH11 ARG 56 1HH1 ARG 56 4.282 3.408 7.943 462 HH12 ARG 56 2HH1 ARG 56 4.445 4.794 8.988 463 HH21 ARG 56 1HH2 ARG 56 1.300 6.156 8.199 464 HH22 ARG 56 2HH2 ARG 56 2.756 6.334 9.139 465 H ALA 57 H ALA 57 -2.611 1.754 5.979 466 HA ALA 57 HA ALA 57 -2.275 0.242 8.327 467 HB1 ALA 57 3HB ALA 57 -4.835 1.371 7.198 468 HB2 ALA 57 1HB ALA 57 -3.686 2.246 8.212 469 HB3 ALA 57 2HB ALA 57 -4.564 0.860 8.863 470 H VAL 58 H VAL 58 -4.273 -0.342 5.443 471 HA VAL 58 HA VAL 58 -5.421 -2.745 6.403 472 HB VAL 58 HB VAL 58 -5.035 -1.888 3.528 473 HG11 VAL 58 1HG1 VAL 58 -6.942 -3.885 4.748 474 HG12 VAL 58 2HG1 VAL 58 -5.559 -4.260 3.720 475 HG13 VAL 58 3HG1 VAL 58 -6.934 -3.372 3.060 476 HG21 VAL 58 3HG2 VAL 58 -6.246 -0.203 4.796 477 HG22 VAL 58 1HG2 VAL 58 -7.358 -1.432 5.396 478 HG23 VAL 58 2HG2 VAL 58 -7.327 -1.035 3.678 479 H ALA 59 H ALA 59 -2.625 -2.115 4.293 480 HA ALA 59 HA ALA 59 -2.025 -4.825 3.778 481 HB1 ALA 59 3HB ALA 59 0.138 -4.012 2.997 482 HB2 ALA 59 1HB ALA 59 -0.181 -2.440 3.728 483 HB3 ALA 59 2HB ALA 59 -1.178 -3.010 2.386 484 H LYS 60 H LYS 60 -1.067 -2.646 6.376 485 HA LYS 60 HA LYS 60 0.882 -4.438 7.477 486 HB2 LYS 60 2HB LYS 60 -0.440 -1.933 8.481 487 HB3 LYS 60 1HB LYS 60 0.591 -2.897 9.527 488 HG2 LYS 60 2HG LYS 60 2.478 -2.551 8.064 489 HG3 LYS 60 1HG LYS 60 1.458 -1.695 6.902 490 HD2 LYS 60 2HD LYS 60 1.881 0.204 7.983 491 HD3 LYS 60 1HD LYS 60 1.050 -0.452 9.394 492 HE2 LYS 60 2HE LYS 60 3.170 0.190 10.164 493 HE3 LYS 60 1HE LYS 60 3.253 -1.559 9.992 494 HZ1 LYS 60 3HZ LYS 60 5.231 -0.544 9.130 495 HZ2 LYS 60 1HZ LYS 60 4.335 0.456 8.095 496 HZ3 LYS 60 2HZ LYS 60 4.360 -1.221 7.849 497 H SER 61 H SER 61 -2.510 -4.408 7.526 498 HA SER 61 HA SER 61 -2.505 -5.960 10.017 499 HB2 SER 61 2HB SER 61 -4.990 -5.445 10.069 500 HB3 SER 61 1HB SER 61 -3.914 -4.074 10.334 501 HG SER 61 HG SER 61 -4.350 -3.322 8.330 502 H GLU 62 H GLU 62 -5.092 -5.915 7.654 503 HA GLU 62 HA GLU 62 -6.206 -7.558 6.568 504 HB2 GLU 62 2HB GLU 62 -4.021 -7.839 5.384 505 HB3 GLU 62 1HB GLU 62 -3.589 -9.075 6.557 506 HG2 GLU 62 2HG GLU 62 -4.350 -10.172 4.599 507 HG3 GLU 62 1HG GLU 62 -5.596 -10.366 5.829 508 H LEU 63 H LEU 63 -3.910 -9.212 8.713 509 HA LEU 63 HA LEU 63 -4.191 -10.405 10.620 510 HB2 LEU 63 2HB LEU 63 -6.067 -8.849 11.135 511 HB3 LEU 63 1HB LEU 63 -7.158 -9.946 10.313 512 HG LEU 63 HG LEU 63 -6.580 -11.698 11.983 513 HD11 LEU 63 1HD1 LEU 63 -4.394 -10.879 12.653 514 HD12 LEU 63 2HD1 LEU 63 -5.461 -11.007 14.052 515 HD13 LEU 63 3HD1 LEU 63 -5.127 -9.429 13.335 516 HD21 LEU 63 3HD2 LEU 63 -7.657 -9.117 13.107 517 HD22 LEU 63 1HD2 LEU 63 -7.885 -10.723 13.799 518 HD23 LEU 63 2HD2 LEU 63 -8.585 -10.334 12.228 519 H TYR 64 H TYR 64 -4.961 -12.528 11.335 520 HA TYR 64 HA TYR 64 -5.406 -14.736 11.039 521 HB2 TYR 64 2HB TYR 64 -7.397 -13.518 9.588 522 HB3 TYR 64 1HB TYR 64 -6.635 -14.533 8.374 523 HD1 TYR 64 HD2 TYR 64 -5.875 -16.634 10.708 524 HD2 TYR 64 HD1 TYR 64 -9.463 -14.825 9.302 525 HE1 TYR 64 HE2 TYR 64 -7.165 -18.557 11.537 526 HE2 TYR 64 HE1 TYR 64 -10.760 -16.742 10.131 527 HH TYR 64 HH TYR 64 -10.490 -19.026 10.733 528 H LYS 65 H LYS 65 -5.177 -16.490 9.095 529 HA LYS 65 HA LYS 65 -2.770 -15.752 7.585 530 HB2 LYS 65 2HB LYS 65 -3.618 -18.344 8.822 531 HB3 LYS 65 1HB LYS 65 -2.624 -18.377 7.373 532 HG2 LYS 65 2HG LYS 65 -1.151 -18.552 9.190 533 HG3 LYS 65 1HG LYS 65 -0.995 -16.900 8.594 534 HD2 LYS 65 2HD LYS 65 -2.472 -16.127 10.394 535 HD3 LYS 65 1HD LYS 65 -2.600 -17.784 10.993 536 HE2 LYS 65 2HE LYS 65 -0.138 -17.813 11.292 537 HE3 LYS 65 1HE LYS 65 -0.090 -16.122 10.808 538 HZ1 LYS 65 3HZ LYS 65 -0.050 -16.298 13.182 539 HZ2 LYS 65 1HZ LYS 65 -1.469 -17.229 13.195 540 HZ3 LYS 65 2HZ LYS 65 -1.523 -15.603 12.712 541 H GLU 66 H GLU 66 -4.584 -18.635 6.919 542 HA GLU 66 HA GLU 66 -5.873 -19.306 5.192 543 HB2 GLU 66 2HB GLU 66 -7.368 -17.605 6.314 544 HB3 GLU 66 1HB GLU 66 -6.860 -16.454 5.087 545 HG2 GLU 66 2HG GLU 66 -9.027 -17.491 4.591 546 HG3 GLU 66 1HG GLU 66 -7.816 -17.816 3.348 547 H LYS 67 H LYS 67 -4.271 -19.773 3.747 548 HA LYS 67 HA LYS 67 -3.528 -19.848 1.604 549 HB2 LYS 67 2HB LYS 67 -4.917 -17.191 1.286 550 HB3 LYS 67 1HB LYS 67 -4.073 -18.020 -0.012 551 HG2 LYS 67 2HG LYS 67 -5.820 -19.324 -0.417 552 HG3 LYS 67 1HG LYS 67 -5.963 -19.774 1.283 553 HD2 LYS 67 2HD LYS 67 -7.219 -17.747 1.739 554 HD3 LYS 67 1HD LYS 67 -7.016 -17.221 0.067 555 HE2 LYS 67 2HE LYS 67 -9.239 -18.217 0.532 556 HE3 LYS 67 1HE LYS 67 -8.343 -19.048 -0.737 557 HZ1 LYS 67 3HZ LYS 67 -7.811 -20.807 0.742 558 HZ2 LYS 67 1HZ LYS 67 -9.476 -20.526 0.897 559 HZ3 LYS 67 2HZ LYS 67 -8.404 -19.969 2.092 560 H PHE 68 H PHE 68 -3.047 -16.725 3.269 561 HA PHE 68 HA PHE 68 -0.357 -16.687 2.067 562 HB2 PHE 68 2HB PHE 68 -0.347 -14.383 2.064 563 HB3 PHE 68 1HB PHE 68 -2.056 -14.694 1.808 564 HD1 PHE 68 HD2 PHE 68 -3.635 -14.476 3.770 565 HD2 PHE 68 HD1 PHE 68 0.414 -13.172 3.914 566 HE1 PHE 68 HE2 PHE 68 -4.160 -13.066 5.725 567 HE2 PHE 68 HE1 PHE 68 -0.106 -11.759 5.857 568 HZ PHE 68 HZ PHE 68 -2.392 -11.704 6.766 569 H LEU 69 H LEU 69 1.395 -15.890 3.392 570 HA LEU 69 HA LEU 69 2.685 -15.660 5.232 571 HB2 LEU 69 2HB LEU 69 0.834 -14.393 6.228 572 HB3 LEU 69 1HB LEU 69 0.119 -15.887 6.805 573 HG LEU 69 HG LEU 69 2.101 -16.260 8.236 574 HD11 LEU 69 1HD1 LEU 69 3.702 -14.459 8.582 575 HD12 LEU 69 2HD1 LEU 69 2.923 -13.508 7.317 576 HD13 LEU 69 3HD1 LEU 69 3.737 -15.018 6.910 577 HD21 LEU 69 3HD2 LEU 69 0.724 -13.607 8.619 578 HD22 LEU 69 1HD2 LEU 69 1.582 -14.512 9.868 579 HD23 LEU 69 2HD2 LEU 69 0.122 -15.180 9.139 580 H TYR 70 H TYR 70 0.142 -18.065 5.977 581 HA TYR 70 HA TYR 70 2.268 -19.826 6.996 582 HB2 TYR 70 2HB TYR 70 0.241 -19.151 8.421 583 HB3 TYR 70 1HB TYR 70 -0.699 -20.204 7.376 584 HD1 TYR 70 HD1 TYR 70 2.210 -20.181 9.692 585 HD2 TYR 70 HD2 TYR 70 -0.843 -22.492 7.839 586 HE1 TYR 70 HE1 TYR 70 2.769 -22.079 11.152 587 HE2 TYR 70 HE2 TYR 70 -0.292 -24.396 9.294 588 HH TYR 70 HH TYR 70 1.579 -25.227 10.608 589 H GLY 71 H GLY 71 2.932 -20.484 4.878 590 HA2 GLY 71 2HA GLY 71 1.940 -22.864 3.939 591 HA3 GLY 71 1HA GLY 71 1.068 -21.633 3.038 592 H ASN 72 H ASN 72 3.738 -23.567 3.093 593 HA ASN 72 HA ASN 72 5.405 -23.913 1.618 594 HB2 ASN 72 2HB ASN 72 4.079 -21.647 0.153 595 HB3 ASN 72 1HB ASN 72 5.561 -22.393 -0.433 596 HD21 ASN 72 1HD2 ASN 72 2.795 -22.303 -1.506 597 HD22 ASN 72 2HD2 ASN 72 2.384 -23.958 -1.795 598 H PHE 73 H PHE 73 5.510 -20.426 1.067 599 HA PHE 73 HA PHE 73 7.993 -20.301 2.624 600 HB2 PHE 73 2HB PHE 73 7.746 -19.392 -0.256 601 HB3 PHE 73 1HB PHE 73 9.158 -19.177 0.771 602 HD1 PHE 73 HD2 PHE 73 10.368 -21.242 1.594 603 HD2 PHE 73 HD1 PHE 73 7.441 -21.351 -1.494 604 HE1 PHE 73 HE2 PHE 73 11.237 -23.422 0.852 605 HE2 PHE 73 HE1 PHE 73 8.304 -23.530 -2.242 606 HZ PHE 73 HZ PHE 73 10.205 -24.568 -1.069 607 H GLN 74 H GLN 74 8.719 -18.089 3.001 608 HA GLN 74 HA GLN 74 6.462 -16.383 3.562 609 HB2 GLN 74 2HB GLN 74 9.392 -15.771 3.979 610 HB3 GLN 74 1HB GLN 74 8.022 -14.983 4.748 611 HG2 GLN 74 2HG GLN 74 8.898 -17.833 5.154 612 HG3 GLN 74 1HG GLN 74 9.114 -16.496 6.280 613 HE21 GLN 74 1HE2 GLN 74 6.481 -15.363 5.811 614 HE22 GLN 74 2HE2 GLN 74 5.355 -16.428 6.580 615 H THR 75 H THR 75 8.994 -16.595 1.210 616 HA THR 75 HA THR 75 8.994 -14.028 0.127 617 HB THR 75 HB THR 75 9.234 -16.544 -1.519 618 HG1 THR 75 HG1 THR 75 11.566 -16.271 -0.813 619 HG21 THR 75 3HG2 THR 75 10.897 -15.227 -2.750 620 HG22 THR 75 1HG2 THR 75 10.626 -13.865 -1.657 621 HG23 THR 75 2HG2 THR 75 9.332 -14.409 -2.725 622 H ARG 76 H ARG 76 6.710 -16.635 -0.172 623 HA ARG 76 HA ARG 76 5.285 -15.910 -2.445 624 HB2 ARG 76 2HB ARG 76 4.454 -17.270 0.110 625 HB3 ARG 76 1HB ARG 76 3.352 -17.061 -1.245 626 HG2 ARG 76 2HG ARG 76 6.006 -18.348 -1.690 627 HG3 ARG 76 1HG ARG 76 4.683 -19.275 -0.975 628 HD2 ARG 76 2HD ARG 76 4.544 -17.773 -3.590 629 HD3 ARG 76 1HD ARG 76 4.797 -19.513 -3.433 630 HE ARG 76 HE ARG 76 2.504 -18.946 -2.008 631 HH11 ARG 76 1HH1 ARG 76 3.545 -18.634 -5.342 632 HH12 ARG 76 2HH1 ARG 76 1.947 -18.865 -5.988 633 HH21 ARG 76 1HH2 ARG 76 0.419 -19.190 -2.829 634 HH22 ARG 76 2HH2 ARG 76 0.150 -19.186 -4.547 635 H VAL 77 H VAL 77 5.124 -14.660 0.830 636 HA VAL 77 HA VAL 77 2.728 -13.140 0.423 637 HB VAL 77 HB VAL 77 4.857 -12.719 2.537 638 HG11 VAL 77 1HG1 VAL 77 3.047 -11.742 3.847 639 HG12 VAL 77 2HG1 VAL 77 1.925 -12.008 2.512 640 HG13 VAL 77 3HG1 VAL 77 3.265 -10.877 2.325 641 HG21 VAL 77 3HG2 VAL 77 2.441 -14.523 2.601 642 HG22 VAL 77 1HG2 VAL 77 3.481 -14.159 3.978 643 HG23 VAL 77 2HG2 VAL 77 4.130 -15.031 2.589 644 H ILE 78 H ILE 78 6.188 -12.520 0.190 645 HA ILE 78 HA ILE 78 6.032 -9.716 -0.108 646 HB ILE 78 HB ILE 78 8.144 -11.621 -1.142 647 HG12 ILE 78 2HG1 ILE 78 8.002 -9.978 1.398 648 HG13 ILE 78 1HG1 ILE 78 7.835 -11.728 1.294 649 HG21 ILE 78 1HG2 ILE 78 9.605 -9.662 -1.231 650 HG22 ILE 78 2HG2 ILE 78 8.260 -8.631 -0.745 651 HG23 ILE 78 3HG2 ILE 78 8.214 -9.468 -2.297 652 HD11 ILE 78 3HD1 ILE 78 10.129 -11.924 0.549 653 HD12 ILE 78 1HD1 ILE 78 10.047 -11.042 2.075 654 HD13 ILE 78 2HD1 ILE 78 10.301 -10.169 0.563 655 H GLU 79 H GLU 79 6.062 -12.380 -2.456 656 HA GLU 79 HA GLU 79 5.890 -10.856 -4.803 657 HB2 GLU 79 2HB GLU 79 4.560 -13.516 -4.250 658 HB3 GLU 79 1HB GLU 79 4.914 -12.843 -5.831 659 HG2 GLU 79 2HG GLU 79 7.286 -13.049 -5.429 660 HG3 GLU 79 1HG GLU 79 6.978 -13.621 -3.788 661 H LEU 80 H LEU 80 3.349 -12.277 -2.799 662 HA LEU 80 HA LEU 80 1.083 -11.420 -4.119 663 HB2 LEU 80 2HB LEU 80 1.555 -12.852 -1.918 664 HB3 LEU 80 1HB LEU 80 1.154 -11.338 -1.136 665 HG LEU 80 HG LEU 80 -0.647 -12.851 -3.019 666 HD11 LEU 80 1HD1 LEU 80 -0.732 -12.583 -0.024 667 HD12 LEU 80 2HD1 LEU 80 -0.320 -14.040 -0.929 668 HD13 LEU 80 3HD1 LEU 80 -1.950 -13.373 -1.023 669 HD21 LEU 80 3HD2 LEU 80 -2.385 -11.306 -2.255 670 HD22 LEU 80 1HD2 LEU 80 -1.078 -10.449 -3.071 671 HD23 LEU 80 2HD2 LEU 80 -1.186 -10.424 -1.310 672 H ASN 81 H ASN 81 2.740 -9.848 -1.427 673 HA ASN 81 HA ASN 81 1.190 -7.570 -1.170 674 HB2 ASN 81 2HB ASN 81 2.908 -8.340 0.437 675 HB3 ASN 81 1HB ASN 81 4.168 -7.868 -0.695 676 HD21 ASN 81 1HD2 ASN 81 3.658 -6.995 2.030 677 HD22 ASN 81 2HD2 ASN 81 3.490 -5.280 1.957 678 H TYR 82 H TYR 82 4.294 -7.830 -2.917 679 HA TYR 82 HA TYR 82 4.132 -5.125 -3.784 680 HB2 TYR 82 2HB TYR 82 6.022 -7.387 -4.391 681 HB3 TYR 82 1HB TYR 82 6.177 -5.808 -5.163 682 HD1 TYR 82 HD2 TYR 82 5.551 -7.066 -1.692 683 HD2 TYR 82 HD1 TYR 82 7.760 -4.435 -4.196 684 HE1 TYR 82 HE2 TYR 82 6.725 -6.191 0.278 685 HE2 TYR 82 HE1 TYR 82 8.936 -3.545 -2.227 686 HH TYR 82 HH TYR 82 8.620 -5.013 0.924 687 H LYS 83 H LYS 83 3.220 -8.179 -5.225 688 HA LYS 83 HA LYS 83 2.960 -7.213 -7.878 689 HB2 LYS 83 2HB LYS 83 2.994 -9.627 -7.285 690 HB3 LYS 83 1HB LYS 83 1.410 -9.441 -6.545 691 HG2 LYS 83 2HG LYS 83 0.438 -8.872 -8.686 692 HG3 LYS 83 1HG LYS 83 2.027 -8.955 -9.454 693 HD2 LYS 83 2HD LYS 83 2.170 -11.338 -8.823 694 HD3 LYS 83 1HD LYS 83 0.546 -11.233 -8.138 695 HE2 LYS 83 2HE LYS 83 0.532 -12.195 -10.396 696 HE3 LYS 83 1HE LYS 83 -0.365 -10.677 -10.316 697 HZ1 LYS 83 3HZ LYS 83 1.129 -10.915 -12.284 698 HZ2 LYS 83 1HZ LYS 83 2.456 -10.864 -11.227 699 HZ3 LYS 83 2HZ LYS 83 1.417 -9.528 -11.354 700 H HIS 84 H HIS 84 0.987 -6.956 -5.019 701 HA HIS 84 HA HIS 84 -1.211 -5.876 -6.609 702 HB2 HIS 84 2HB HIS 84 -0.982 -6.676 -3.724 703 HB3 HIS 84 1HB HIS 84 -2.355 -5.743 -4.320 704 HD1 HIS 84 HD1 HIS 84 -0.786 -9.132 -4.498 705 HD2 HIS 84 HD2 HIS 84 -4.128 -7.147 -5.968 706 HE1 HIS 84 HE1 HIS 84 -2.251 -10.915 -5.493 707 HE2 HIS 84 HE2 HIS 84 -4.109 -9.646 -6.624 708 H LEU 85 H LEU 85 1.167 -4.744 -4.228 709 HA LEU 85 HA LEU 85 -0.082 -2.144 -4.103 710 HB2 LEU 85 2HB LEU 85 2.495 -3.173 -2.943 711 HB3 LEU 85 1HB LEU 85 1.941 -1.525 -2.740 712 HG LEU 85 HG LEU 85 0.707 -4.039 -1.639 713 HD11 LEU 85 1HD1 LEU 85 2.529 -3.051 -0.358 714 HD12 LEU 85 2HD1 LEU 85 0.992 -2.884 0.493 715 HD13 LEU 85 3HD1 LEU 85 1.691 -1.500 -0.348 716 HD21 LEU 85 3HD2 LEU 85 -1.112 -2.691 -2.526 717 HD22 LEU 85 1HD2 LEU 85 -0.490 -1.271 -1.687 718 HD23 LEU 85 2HD2 LEU 85 -1.107 -2.641 -0.760 719 H LEU 86 H LEU 86 2.775 -3.508 -5.688 720 HA LEU 86 HA LEU 86 3.282 -0.913 -6.954 721 HB2 LEU 86 2HB LEU 86 4.847 -3.493 -6.935 722 HB3 LEU 86 1HB LEU 86 5.293 -2.105 -7.907 723 HG LEU 86 HG LEU 86 5.144 -2.138 -4.891 724 HD11 LEU 86 1HD1 LEU 86 6.987 -3.489 -5.770 725 HD12 LEU 86 2HD1 LEU 86 7.575 -2.024 -4.983 726 HD13 LEU 86 3HD1 LEU 86 7.523 -2.121 -6.743 727 HD21 LEU 86 3HD2 LEU 86 6.217 0.056 -5.051 728 HD22 LEU 86 1HD2 LEU 86 4.639 0.056 -5.841 729 HD23 LEU 86 2HD2 LEU 86 6.109 -0.019 -6.810 730 H GLY 87 H GLY 87 1.795 -3.909 -7.493 731 HA2 GLY 87 2HA GLY 87 0.423 -4.489 -9.279 732 HA3 GLY 87 1HA GLY 87 1.073 -3.133 -10.187 733 H ARG 88 H ARG 88 3.444 -5.044 -8.730 734 HA ARG 88 HA ARG 88 3.732 -7.061 -10.709 735 HB2 ARG 88 2HB ARG 88 4.379 -5.130 -12.089 736 HB3 ARG 88 1HB ARG 88 5.577 -4.668 -10.890 737 HG2 ARG 88 2HG ARG 88 6.874 -6.635 -11.343 738 HG3 ARG 88 1HG ARG 88 5.626 -7.254 -12.426 739 HD2 ARG 88 2HD ARG 88 5.997 -5.453 -13.970 740 HD3 ARG 88 1HD ARG 88 7.105 -4.664 -12.849 741 HE ARG 88 HE ARG 88 8.287 -7.052 -13.224 742 HH11 ARG 88 1HH1 ARG 88 6.931 -4.782 -15.528 743 HH12 ARG 88 2HH1 ARG 88 8.135 -5.102 -16.745 744 HH21 ARG 88 1HH2 ARG 88 9.851 -7.490 -14.824 745 HH22 ARG 88 2HH2 ARG 88 9.805 -6.629 -16.334 746 H ALA 89 H ALA 89 5.058 -8.628 -9.952 747 HA ALA 89 HA ALA 89 5.982 -8.473 -7.273 748 HB1 ALA 89 3HB ALA 89 6.807 -10.743 -7.642 749 HB2 ALA 89 1HB ALA 89 6.545 -10.568 -9.377 750 HB3 ALA 89 2HB ALA 89 5.171 -10.557 -8.271 751 HA PRO 90 HA PRO 90 10.182 -7.053 -7.339 752 HB2 PRO 90 2HB PRO 90 10.936 -9.813 -6.461 753 HB3 PRO 90 1HB PRO 90 11.437 -8.249 -5.807 754 HG2 PRO 90 2HG PRO 90 9.592 -9.681 -4.557 755 HG3 PRO 90 1HG PRO 90 9.427 -7.921 -4.693 756 HD2 PRO 90 2HD PRO 90 7.979 -10.078 -6.150 757 HD3 PRO 90 1HD PRO 90 7.409 -8.475 -5.643 758 H TYR 91 H TYR 91 11.809 -6.938 -8.784 759 HA TYR 91 HA TYR 91 11.375 -8.263 -11.252 760 HB2 TYR 91 2HB TYR 91 13.708 -6.516 -10.442 761 HB3 TYR 91 1HB TYR 91 13.241 -6.932 -12.087 762 HD1 TYR 91 HD2 TYR 91 10.985 -6.106 -12.940 763 HD2 TYR 91 HD1 TYR 91 12.771 -4.653 -9.360 764 HE1 TYR 91 HE2 TYR 91 9.535 -4.119 -13.028 765 HE2 TYR 91 HE1 TYR 91 11.331 -2.662 -9.443 766 HH TYR 91 HH TYR 91 10.072 -1.372 -11.074 767 H ASP 92 H ASP 92 14.246 -8.256 -9.106 768 HA ASP 92 HA ASP 92 14.865 -10.947 -10.118 769 HB2 ASP 92 2HB ASP 92 16.123 -9.229 -11.435 770 HB3 ASP 92 1HB ASP 92 16.897 -8.710 -9.943 771 H GLU 93 H GLU 93 17.075 -11.583 -8.857 772 HA GLU 93 HA GLU 93 16.360 -12.329 -6.309 773 HB2 GLU 93 2HB GLU 93 18.147 -13.367 -7.628 774 HB3 GLU 93 1HB GLU 93 19.137 -11.928 -7.447 775 HG2 GLU 93 2HG GLU 93 19.968 -13.519 -5.930 776 HG3 GLU 93 1HG GLU 93 19.090 -12.331 -4.970 777 H SER 94 H SER 94 18.092 -9.435 -7.327 778 HA SER 94 HA SER 94 19.173 -8.599 -4.919 779 HB2 SER 94 2HB SER 94 18.776 -6.247 -6.005 780 HB3 SER 94 1HB SER 94 19.878 -7.392 -6.773 781 HG SER 94 HG SER 94 17.342 -6.522 -7.571 782 H GLU 95 H GLU 95 15.938 -7.960 -6.239 783 HA GLU 95 HA GLU 95 15.113 -6.305 -4.079 784 HB2 GLU 95 2HB GLU 95 13.535 -7.833 -6.155 785 HB3 GLU 95 1HB GLU 95 12.794 -6.772 -4.965 786 HG2 GLU 95 2HG GLU 95 12.997 -5.599 -7.032 787 HG3 GLU 95 1HG GLU 95 14.123 -4.898 -5.873 788 H VAL 96 H VAL 96 14.835 -9.731 -4.811 789 HA VAL 96 HA VAL 96 13.065 -10.434 -2.746 790 HB VAL 96 HB VAL 96 15.212 -12.183 -3.960 791 HG11 VAL 96 1HG1 VAL 96 14.215 -13.100 -1.926 792 HG12 VAL 96 2HG1 VAL 96 13.735 -14.030 -3.346 793 HG13 VAL 96 3HG1 VAL 96 12.604 -12.890 -2.614 794 HG21 VAL 96 3HG2 VAL 96 13.811 -11.165 -5.690 795 HG22 VAL 96 1HG2 VAL 96 12.366 -11.746 -4.863 796 HG23 VAL 96 2HG2 VAL 96 13.509 -12.897 -5.556 797 H ILE 97 H ILE 97 16.624 -10.579 -2.893 798 HA ILE 97 HA ILE 97 17.061 -11.526 -0.299 799 HB ILE 97 HB ILE 97 18.820 -9.708 -1.952 800 HG12 ILE 97 2HG1 ILE 97 18.799 -12.713 -1.592 801 HG13 ILE 97 1HG1 ILE 97 18.329 -11.840 -3.047 802 HG21 ILE 97 1HG2 ILE 97 19.435 -9.606 0.397 803 HG22 ILE 97 2HG2 ILE 97 20.653 -10.488 -0.524 804 HG23 ILE 97 3HG2 ILE 97 19.495 -11.366 0.477 805 HD11 ILE 97 3HD1 ILE 97 21.086 -11.900 -1.843 806 HD12 ILE 97 1HD1 ILE 97 20.613 -11.035 -3.305 807 HD13 ILE 97 2HD1 ILE 97 20.548 -12.796 -3.263 808 H PHE 98 H PHE 98 17.022 -8.173 -1.491 809 HA PHE 98 HA PHE 98 17.598 -6.917 0.926 810 HB2 PHE 98 2HB PHE 98 17.685 -5.726 -1.186 811 HB3 PHE 98 1HB PHE 98 15.951 -5.926 -1.409 812 HD1 PHE 98 HD1 PHE 98 18.473 -4.357 0.824 813 HD2 PHE 98 HD2 PHE 98 14.465 -4.323 -0.607 814 HE1 PHE 98 HE1 PHE 98 18.078 -2.224 1.986 815 HE2 PHE 98 HE2 PHE 98 14.066 -2.186 0.543 816 HZ PHE 98 HZ PHE 98 15.876 -1.134 1.844 817 H HIS 99 H HIS 99 14.467 -7.869 -0.437 818 HA HIS 99 HA HIS 99 13.045 -6.609 1.720 819 HB2 HIS 99 2HB HIS 99 12.149 -8.269 -0.623 820 HB3 HIS 99 1HB HIS 99 11.035 -7.758 0.644 821 HD1 HIS 99 HD1 HIS 99 11.144 -5.018 1.093 822 HD2 HIS 99 HD2 HIS 99 12.331 -6.445 -2.637 823 HE1 HIS 99 HE1 HIS 99 11.134 -3.018 -0.447 824 HE2 HIS 99 HE2 HIS 99 11.958 -3.883 -2.668 825 H LEU 100 H LEU 100 13.990 -9.938 0.931 826 HA LEU 100 HA LEU 100 12.605 -11.178 3.053 827 HB2 LEU 100 2HB LEU 100 15.165 -11.866 1.629 828 HB3 LEU 100 1HB LEU 100 14.570 -12.838 2.961 829 HG LEU 100 HG LEU 100 13.079 -12.331 0.385 830 HD11 LEU 100 1HD1 LEU 100 14.542 -14.778 1.368 831 HD12 LEU 100 2HD1 LEU 100 15.044 -13.729 0.042 832 HD13 LEU 100 3HD1 LEU 100 13.566 -14.682 -0.096 833 HD21 LEU 100 3HD2 LEU 100 12.463 -14.147 2.716 834 HD22 LEU 100 1HD2 LEU 100 11.559 -14.070 1.203 835 HD23 LEU 100 2HD2 LEU 100 11.590 -12.677 2.286 836 H ASP 101 H ASP 101 15.769 -9.655 2.852 837 HA ASP 101 HA ASP 101 16.735 -10.118 5.411 838 HB2 ASP 101 2HB ASP 101 18.061 -9.108 3.605 839 HB3 ASP 101 1HB ASP 101 17.067 -7.659 3.675 840 H LEU 102 H LEU 102 14.895 -7.300 4.254 841 HA LEU 102 HA LEU 102 14.658 -6.088 6.796 842 HB2 LEU 102 2HB LEU 102 14.426 -4.963 4.566 843 HB3 LEU 102 1HB LEU 102 12.858 -5.727 4.400 844 HG LEU 102 HG LEU 102 12.046 -4.503 6.368 845 HD11 LEU 102 1HD1 LEU 102 14.749 -3.165 6.330 846 HD12 LEU 102 2HD1 LEU 102 14.184 -4.302 7.553 847 HD13 LEU 102 3HD1 LEU 102 13.385 -2.741 7.369 848 HD21 LEU 102 3HD2 LEU 102 11.997 -2.279 5.358 849 HD22 LEU 102 1HD2 LEU 102 11.760 -3.536 4.142 850 HD23 LEU 102 2HD2 LEU 102 13.323 -2.732 4.286 851 H TYR 103 H TYR 103 12.505 -8.181 4.931 852 HA TYR 103 HA TYR 103 10.238 -8.042 6.550 853 HB2 TYR 103 2HB TYR 103 10.031 -8.977 4.381 854 HB3 TYR 103 1HB TYR 103 11.277 -10.177 4.695 855 HD1 TYR 103 HD1 TYR 103 7.792 -9.207 5.541 856 HD2 TYR 103 HD2 TYR 103 10.735 -12.279 5.593 857 HE1 TYR 103 HE1 TYR 103 6.069 -10.848 6.176 858 HE2 TYR 103 HE2 TYR 103 9.024 -13.920 6.222 859 HH TYR 103 HH TYR 103 6.784 -13.866 7.400 860 H GLU 104 H GLU 104 12.969 -10.350 6.724 861 HA GLU 104 HA GLU 104 11.677 -11.705 8.935 862 HB2 GLU 104 2HB GLU 104 14.385 -12.188 7.685 863 HB3 GLU 104 1HB GLU 104 13.619 -13.212 8.891 864 HG2 GLU 104 2HG GLU 104 11.719 -13.507 7.267 865 HG3 GLU 104 1HG GLU 104 12.737 -12.717 6.064 866 H ASN 105 H ASN 105 14.214 -9.335 8.506 867 HA ASN 105 HA ASN 105 15.252 -9.659 11.170 868 HB2 ASN 105 2HB ASN 105 15.688 -7.633 8.999 869 HB3 ASN 105 1HB ASN 105 16.281 -7.334 10.627 870 HD21 ASN 105 1HD2 ASN 105 16.139 -10.508 9.155 871 HD22 ASN 105 2HD2 ASN 105 17.849 -10.722 9.026 872 H GLU 106 H GLU 106 13.359 -7.101 9.567 873 HA GLU 106 HA GLU 106 12.886 -5.893 12.178 874 HB2 GLU 106 2HB GLU 106 12.294 -4.882 9.394 875 HB3 GLU 106 1HB GLU 106 12.039 -3.972 10.877 876 HG2 GLU 106 2HG GLU 106 14.681 -4.963 9.838 877 HG3 GLU 106 1HG GLU 106 14.093 -3.302 9.779 878 H GLY 107 H GLY 107 11.172 -7.460 9.564 879 HA2 GLY 107 2HA GLY 107 9.190 -8.735 10.389 880 HA3 GLY 107 1HA GLY 107 8.704 -7.236 11.170 881 H PHE 108 H PHE 108 6.951 -8.480 9.496 882 HA PHE 108 HA PHE 108 7.136 -7.633 6.807 883 HB2 PHE 108 2HB PHE 108 4.815 -8.267 6.579 884 HB3 PHE 108 1HB PHE 108 5.633 -9.466 7.568 885 HD1 PHE 108 HD1 PHE 108 5.186 -9.581 9.992 886 HD2 PHE 108 HD2 PHE 108 3.040 -6.943 7.435 887 HE1 PHE 108 HE1 PHE 108 3.447 -9.328 11.717 888 HE2 PHE 108 HE2 PHE 108 1.306 -6.677 9.154 889 HZ PHE 108 HZ PHE 108 1.508 -7.870 11.299 890 H ASP 109 H ASP 109 5.963 -6.103 9.719 891 HA ASP 109 HA ASP 109 4.516 -3.976 8.655 892 HB2 ASP 109 2HB ASP 109 6.269 -4.137 11.104 893 HB3 ASP 109 1HB ASP 109 5.358 -2.689 10.693 894 H ALA 110 H ALA 110 7.988 -4.240 9.282 895 HA ALA 110 HA ALA 110 8.612 -1.593 8.510 896 HB1 ALA 110 3HB ALA 110 10.068 -2.884 9.961 897 HB2 ALA 110 1HB ALA 110 10.937 -2.346 8.528 898 HB3 ALA 110 2HB ALA 110 10.395 -4.021 8.653 899 H ASP 111 H ASP 111 8.770 -4.688 6.762 900 HA ASP 111 HA ASP 111 9.955 -3.605 4.438 901 HB2 ASP 111 2HB ASP 111 9.890 -6.042 4.994 902 HB3 ASP 111 1HB ASP 111 8.179 -6.047 4.574 903 H ILE 112 H ILE 112 6.587 -4.219 5.316 904 HA ILE 112 HA ILE 112 5.384 -3.302 2.956 905 HB ILE 112 HB ILE 112 4.430 -3.373 5.814 906 HG12 ILE 112 2HG1 ILE 112 3.648 -5.023 3.405 907 HG13 ILE 112 1HG1 ILE 112 4.805 -5.524 4.633 908 HG21 ILE 112 1HG2 ILE 112 3.208 -1.578 4.793 909 HG22 ILE 112 2HG2 ILE 112 2.145 -2.976 4.955 910 HG23 ILE 112 3HG2 ILE 112 2.839 -2.571 3.383 911 HD11 ILE 112 3HD1 ILE 112 1.883 -4.966 5.066 912 HD12 ILE 112 1HD1 ILE 112 3.033 -5.429 6.319 913 HD13 ILE 112 2HD1 ILE 112 2.652 -6.551 5.012 914 H ASP 113 H ASP 113 6.660 -1.608 5.730 915 HA ASP 113 HA ASP 113 5.379 0.884 5.232 916 HB2 ASP 113 2HB ASP 113 6.662 -0.155 7.352 917 HB3 ASP 113 1HB ASP 113 7.958 0.839 6.694 918 H SER 114 H SER 114 8.221 -0.660 4.035 919 HA SER 114 HA SER 114 9.715 1.534 3.149 920 HB2 SER 114 2HB SER 114 9.535 -1.176 1.823 921 HB3 SER 114 1HB SER 114 10.886 -0.044 1.753 922 HG SER 114 HG SER 114 10.106 -1.774 3.780 923 H TYR 115 H TYR 115 6.899 -0.033 1.840 924 HA TYR 115 HA TYR 115 7.026 0.976 -0.797 925 HB2 TYR 115 2HB TYR 115 5.568 -0.867 -0.337 926 HB3 TYR 115 1HB TYR 115 4.721 0.033 0.916 927 HD1 TYR 115 HD2 TYR 115 5.437 0.196 -2.752 928 HD2 TYR 115 HD1 TYR 115 2.695 1.007 0.396 929 HE1 TYR 115 HE2 TYR 115 3.762 0.918 -4.403 930 HE2 TYR 115 HE1 TYR 115 1.015 1.725 -1.245 931 HH TYR 115 HH TYR 115 1.331 1.143 -4.580 932 H ILE 116 H ILE 116 5.732 2.251 2.206 933 HA ILE 116 HA ILE 116 4.435 4.487 0.948 934 HB ILE 116 HB ILE 116 5.048 4.027 3.875 935 HG12 ILE 116 2HG1 ILE 116 3.668 2.238 2.930 936 HG13 ILE 116 1HG1 ILE 116 2.727 3.240 4.029 937 HG21 ILE 116 1HG2 ILE 116 3.107 5.924 2.552 938 HG22 ILE 116 2HG2 ILE 116 4.590 6.370 3.397 939 HG23 ILE 116 3HG2 ILE 116 3.250 5.647 4.287 940 HD11 ILE 116 3HD1 ILE 116 2.675 3.380 1.024 941 HD12 ILE 116 1HD1 ILE 116 1.743 4.402 2.118 942 HD13 ILE 116 2HD1 ILE 116 1.440 2.666 2.062 943 H ASP 117 H ASP 117 7.562 3.774 2.238 944 HA ASP 117 HA ASP 117 8.409 6.519 2.424 945 HB2 ASP 117 2HB ASP 117 9.776 3.876 2.729 946 HB3 ASP 117 1HB ASP 117 10.749 5.323 2.488 947 H SER 118 H SER 118 7.486 5.042 -0.189 948 HA SER 118 HA SER 118 9.655 6.148 -1.846 949 HB2 SER 118 2HB SER 118 7.490 4.168 -2.606 950 HB3 SER 118 1HB SER 118 8.741 4.779 -3.689 951 HG SER 118 HG SER 118 9.333 3.446 -1.259 952 HA PRO 119 HA PRO 119 6.135 9.101 -2.049 953 HB2 PRO 119 2HB PRO 119 7.614 11.367 -2.034 954 HB3 PRO 119 1HB PRO 119 7.187 10.494 -0.557 955 HG2 PRO 119 2HG PRO 119 9.749 10.495 -2.089 956 HG3 PRO 119 1HG PRO 119 9.491 10.490 -0.336 957 HD2 PRO 119 2HD PRO 119 10.121 8.261 -1.798 958 HD3 PRO 119 1HD PRO 119 9.236 8.220 -0.261 959 H GLU 120 H GLU 120 9.188 9.373 -3.859 960 HA GLU 120 HA GLU 120 8.281 11.003 -5.930 961 HB2 GLU 120 2HB GLU 120 10.656 10.458 -5.428 962 HB3 GLU 120 1HB GLU 120 10.400 8.844 -6.063 963 HG2 GLU 120 2HG GLU 120 9.890 11.242 -7.770 964 HG3 GLU 120 1HG GLU 120 11.527 10.639 -7.534 965 H TYR 121 H TYR 121 8.432 7.451 -5.763 966 HA TYR 121 HA TYR 121 7.245 7.001 -8.284 967 HB2 TYR 121 2HB TYR 121 8.524 5.320 -6.853 968 HB3 TYR 121 1HB TYR 121 7.040 5.130 -5.923 969 HD1 TYR 121 HD2 TYR 121 8.541 4.716 -9.271 970 HD2 TYR 121 HD1 TYR 121 5.251 3.774 -6.744 971 HE1 TYR 121 HE2 TYR 121 7.760 3.069 -10.918 972 HE2 TYR 121 HE1 TYR 121 4.457 2.122 -8.387 973 HH TYR 121 HH TYR 121 6.382 1.066 -11.011 974 H THR 122 H THR 122 5.883 7.288 -5.028 975 HA THR 122 HA THR 122 3.222 6.683 -5.665 976 HB THR 122 HB THR 122 4.342 8.475 -3.505 977 HG1 THR 122 HG1 THR 122 4.928 6.413 -3.055 978 HG21 THR 122 3HG2 THR 122 1.535 7.408 -3.833 979 HG22 THR 122 1HG2 THR 122 2.025 9.099 -3.939 980 HG23 THR 122 2HG2 THR 122 2.152 8.235 -2.404 981 H ASN 123 H ASN 123 4.904 9.817 -5.593 982 HA ASN 123 HA ASN 123 2.711 11.451 -6.165 983 HB2 ASN 123 2HB ASN 123 5.601 11.855 -6.981 984 HB3 ASN 123 1HB ASN 123 4.363 13.102 -6.990 985 HD21 ASN 123 1HD2 ASN 123 3.166 12.111 -4.474 986 HD22 ASN 123 2HD2 ASN 123 4.257 12.628 -3.227 987 H SER 124 H SER 124 4.808 9.602 -8.266 988 HA SER 124 HA SER 124 3.736 10.781 -10.673 989 HB2 SER 124 2HB SER 124 5.588 8.409 -10.391 990 HB3 SER 124 1HB SER 124 5.344 9.405 -11.826 991 HG SER 124 HG SER 124 6.699 10.017 -9.430 992 H PHE 125 H PHE 125 2.935 8.141 -8.646 993 HA PHE 125 HA PHE 125 1.571 6.708 -10.809 994 HB2 PHE 125 2HB PHE 125 2.989 5.366 -9.342 995 HB3 PHE 125 1HB PHE 125 2.092 5.918 -7.933 996 HD1 PHE 125 HD1 PHE 125 1.762 3.989 -11.086 997 HD2 PHE 125 HD2 PHE 125 0.192 4.774 -7.208 998 HE1 PHE 125 HE1 PHE 125 0.225 2.081 -11.325 999 HE2 PHE 125 HE2 PHE 125 -1.344 2.870 -7.440 1000 HZ PHE 125 HZ PHE 125 -1.332 1.519 -9.500 1001 H GLY 126 H GLY 126 0.940 8.357 -7.765 1002 HA2 GLY 126 2HA GLY 126 -1.412 9.496 -8.134 1003 HA3 GLY 126 1HA GLY 126 -1.919 7.818 -7.992 1004 H ASP 127 H ASP 127 -1.171 10.643 -6.327 1005 HA ASP 127 HA ASP 127 -0.206 9.609 -3.877 1006 HB2 ASP 127 2HB ASP 127 -1.813 12.141 -4.281 1007 HB3 ASP 127 1HB ASP 127 -0.757 11.772 -2.922 1008 H TRP 128 H TRP 128 -3.433 10.374 -5.067 1009 HA TRP 128 HA TRP 128 -4.581 9.010 -2.715 1010 HB2 TRP 128 2HB TRP 128 -5.747 11.187 -4.465 1011 HB3 TRP 128 1HB TRP 128 -6.667 10.311 -3.248 1012 HD1 TRP 128 HD1 TRP 128 -3.750 12.817 -3.540 1013 HE1 TRP 128 HE1 TRP 128 -3.549 14.094 -1.309 1014 HE3 TRP 128 HE3 TRP 128 -7.217 10.233 -0.808 1015 HZ2 TRP 128 HZ2 TRP 128 -4.712 14.015 1.257 1016 HZ3 TRP 128 HZ3 TRP 128 -7.613 10.900 1.526 1017 HH2 TRP 128 HH2 TRP 128 -6.386 12.752 2.536 1018 H VAL 129 H VAL 129 -3.619 7.574 -4.957 1019 HA VAL 129 HA VAL 129 -6.147 6.648 -6.165 1020 HB VAL 129 HB VAL 129 -3.371 6.505 -7.373 1021 HG11 VAL 129 1HG1 VAL 129 -6.042 5.673 -8.505 1022 HG12 VAL 129 2HG1 VAL 129 -4.717 4.600 -8.053 1023 HG13 VAL 129 3HG1 VAL 129 -4.523 5.719 -9.401 1024 HG21 VAL 129 3HG2 VAL 129 -4.254 8.100 -9.029 1025 HG22 VAL 129 1HG2 VAL 129 -4.226 8.774 -7.399 1026 HG23 VAL 129 2HG2 VAL 129 -5.747 8.218 -8.097 1027 H VAL 130 H VAL 130 -6.564 4.463 -6.193 1028 HA VAL 130 HA VAL 130 -5.139 2.835 -4.288 1029 HB VAL 130 HB VAL 130 -7.423 2.111 -6.140 1030 HG11 VAL 130 1HG1 VAL 130 -7.775 0.203 -4.642 1031 HG12 VAL 130 2HG1 VAL 130 -6.343 0.659 -3.721 1032 HG13 VAL 130 3HG1 VAL 130 -6.181 0.137 -5.397 1033 HG21 VAL 130 3HG2 VAL 130 -8.843 2.397 -4.182 1034 HG22 VAL 130 1HG2 VAL 130 -7.992 3.895 -4.565 1035 HG23 VAL 130 2HG2 VAL 130 -7.443 2.885 -3.227 1036 HA PRO 131 HA PRO 131 -2.142 1.304 -7.173 1037 HB2 PRO 131 2HB PRO 131 -1.975 -0.956 -5.269 1038 HB3 PRO 131 1HB PRO 131 -0.706 0.127 -5.845 1039 HG2 PRO 131 2HG PRO 131 -1.673 0.347 -3.370 1040 HG3 PRO 131 1HG PRO 131 -1.237 1.783 -4.315 1041 HD2 PRO 131 2HD PRO 131 -3.941 0.633 -3.751 1042 HD3 PRO 131 1HD PRO 131 -3.428 2.332 -3.813 1043 H TYR 132 H TYR 132 -2.417 0.175 -8.958 1044 HA TYR 132 HA TYR 132 -3.961 -2.320 -8.860 1045 HB2 TYR 132 2HB TYR 132 -4.727 -1.816 -11.192 1046 HB3 TYR 132 1HB TYR 132 -5.356 -0.702 -9.983 1047 HD1 TYR 132 HD1 TYR 132 -3.047 -1.067 -12.823 1048 HD2 TYR 132 HD2 TYR 132 -4.725 1.623 -9.988 1049 HE1 TYR 132 HE1 TYR 132 -2.215 0.834 -14.143 1050 HE2 TYR 132 HE2 TYR 132 -3.895 3.529 -11.297 1051 HH TYR 132 HH TYR 132 -2.265 4.074 -12.940 1052 H TYR 133 H TYR 133 -3.386 -3.784 -10.727 1053 HA TYR 133 HA TYR 133 -0.558 -4.094 -10.693 1054 HB2 TYR 133 2HB TYR 133 -1.019 -6.078 -12.185 1055 HB3 TYR 133 1HB TYR 133 -1.819 -6.099 -10.620 1056 HD1 TYR 133 HD1 TYR 133 -4.270 -5.517 -10.503 1057 HD2 TYR 133 HD2 TYR 133 -2.257 -6.196 -14.190 1058 HE1 TYR 133 HE1 TYR 133 -6.433 -5.907 -11.605 1059 HE2 TYR 133 HE2 TYR 133 -4.414 -6.582 -15.303 1060 HH TYR 133 HH TYR 133 -7.371 -5.767 -13.935 1061 H ARG 134 H ARG 134 0.882 -3.292 -11.995 1062 HA ARG 134 HA ARG 134 0.085 -2.452 -14.700 1063 HB2 ARG 134 2HB ARG 134 0.468 -0.530 -13.140 1064 HB3 ARG 134 1HB ARG 134 2.118 -1.097 -12.916 1065 HG2 ARG 134 2HG ARG 134 1.746 -0.908 -15.684 1066 HG3 ARG 134 1HG ARG 134 1.019 0.543 -14.992 1067 HD2 ARG 134 2HD ARG 134 3.328 0.988 -15.471 1068 HD3 ARG 134 1HD ARG 134 3.113 0.926 -13.724 1069 HE ARG 134 HE ARG 134 3.885 -1.564 -14.182 1070 HH11 ARG 134 1HH1 ARG 134 5.160 1.441 -15.462 1071 HH12 ARG 134 2HH1 ARG 134 6.769 0.818 -15.680 1072 HH21 ARG 134 1HH2 ARG 134 6.001 -2.378 -14.458 1073 HH22 ARG 134 2HH2 ARG 134 7.254 -1.341 -15.069 1074 H GLY 135 H GLY 135 1.010 -3.859 -16.056 1075 HA2 GLY 135 2HA GLY 135 3.072 -5.626 -15.306 1076 HA3 GLY 135 1HA GLY 135 2.479 -5.376 -16.938 1077 H LEU 136 H LEU 136 3.329 -3.425 -18.069 1078 HA LEU 136 HA LEU 136 5.957 -2.570 -17.192 1079 HB2 LEU 136 2HB LEU 136 7.125 -3.325 -19.152 1080 HB3 LEU 136 1HB LEU 136 6.383 -4.703 -18.366 1081 HG LEU 136 HG LEU 136 5.097 -3.343 -20.727 1082 HD11 LEU 136 1HD1 LEU 136 7.076 -5.619 -20.746 1083 HD12 LEU 136 2HD1 LEU 136 7.321 -4.009 -21.421 1084 HD13 LEU 136 3HD1 LEU 136 6.117 -5.085 -22.127 1085 HD21 LEU 136 3HD2 LEU 136 4.857 -6.135 -19.605 1086 HD22 LEU 136 1HD2 LEU 136 3.993 -5.500 -21.004 1087 HD23 LEU 136 2HD2 LEU 136 3.680 -4.838 -19.400 1088 H GLU 137 H GLU 137 6.831 -0.850 -18.498 1089 HA GLU 137 HA GLU 137 4.763 0.721 -19.786 1090 HB2 GLU 137 2HB GLU 137 6.656 2.424 -20.014 1091 HB3 GLU 137 1HB GLU 137 6.103 2.048 -18.393 1092 HG2 GLU 137 2HG GLU 137 8.505 0.709 -19.596 1093 HG3 GLU 137 1HG GLU 137 8.612 2.268 -18.783 1094 H HIS 138 H HIS 138 8.115 0.536 -20.879 1095 HA HIS 138 HA HIS 138 7.445 -0.945 -23.265 1096 HB2 HIS 138 2HB HIS 138 8.220 1.976 -23.387 1097 HB3 HIS 138 1HB HIS 138 8.488 0.880 -24.736 1098 HD1 HIS 138 HD1 HIS 138 6.165 3.293 -23.633 1099 HD2 HIS 138 HD2 HIS 138 5.823 -0.445 -25.424 1100 HE1 HIS 138 HE1 HIS 138 3.861 3.230 -24.647 1101 HE2 HIS 138 HE2 HIS 138 3.604 0.882 -25.524 1102 H HIS 139 H HIS 139 9.434 -1.395 -24.546 1103 HA HIS 139 HA HIS 139 11.952 -0.695 -23.320 1104 HB2 HIS 139 2HB HIS 139 12.732 -3.046 -23.088 1105 HB3 HIS 139 1HB HIS 139 11.456 -2.620 -21.958 1106 HD1 HIS 139 HD1 HIS 139 11.966 -4.582 -25.173 1107 HD2 HIS 139 HD2 HIS 139 9.272 -4.262 -22.015 1108 HE1 HIS 139 HE1 HIS 139 10.393 -6.525 -25.418 1109 HE2 HIS 139 HE2 HIS 139 8.846 -6.381 -23.438 1110 H HIS 140 H HIS 140 13.593 -0.676 -24.721 1111 HA HIS 140 HA HIS 140 13.087 -1.760 -27.414 1112 HB2 HIS 140 2HB HIS 140 14.458 0.763 -26.522 1113 HB3 HIS 140 1HB HIS 140 14.843 0.036 -28.079 1114 HD1 HIS 140 HD1 HIS 140 11.992 1.656 -26.208 1115 HD2 HIS 140 HD2 HIS 140 12.988 0.448 -30.064 1116 HE1 HIS 140 HE1 HIS 140 10.212 2.606 -27.700 1117 HE2 HIS 140 HE2 HIS 140 10.934 2.021 -30.039 1118 H HIS 141 H HIS 141 14.241 -3.501 -27.773 1119 HA HIS 141 HA HIS 141 16.988 -3.630 -26.717 1120 HB2 HIS 141 2HB HIS 141 15.440 -5.068 -25.399 1121 HB3 HIS 141 1HB HIS 141 15.023 -5.931 -26.872 1122 HD1 HIS 141 HD1 HIS 141 16.284 -8.025 -27.202 1123 HD2 HIS 141 HD2 HIS 141 18.393 -5.300 -24.875 1124 HE1 HIS 141 HE1 HIS 141 18.359 -9.233 -26.460 1125 HE2 HIS 141 HE2 HIS 141 19.728 -7.483 -25.280 1126 H HIS 142 H HIS 142 17.955 -3.089 -28.629 1127 HA HIS 142 HA HIS 142 17.679 -5.055 -30.809 1128 HB2 HIS 142 2HB HIS 142 17.909 -2.053 -31.054 1129 HB3 HIS 142 1HB HIS 142 18.301 -3.140 -32.381 1130 HD1 HIS 142 HD1 HIS 142 15.792 -0.983 -31.707 1131 HD2 HIS 142 HD2 HIS 142 15.735 -5.083 -32.404 1132 HE1 HIS 142 HE1 HIS 142 13.463 -1.504 -32.496 1133 HE2 HIS 142 HE2 HIS 142 13.515 -3.945 -33.103 1134 H HIS 143 H HIS 143 19.597 -5.141 -32.213 1135 HA HIS 143 HA HIS 143 22.050 -4.270 -30.857 1136 HB2 HIS 143 2HB HIS 143 23.155 -6.392 -31.481 1137 HB3 HIS 143 1HB HIS 143 21.818 -6.648 -30.371 1138 HD1 HIS 143 HD1 HIS 143 19.670 -7.813 -31.354 1139 HD2 HIS 143 HD2 HIS 143 22.942 -7.667 -33.929 1140 HE1 HIS 143 HE1 HIS 143 19.159 -9.442 -33.201 1141 HE2 HIS 143 HE2 HIS 143 21.105 -9.272 -34.799 Start of MODEL 18 1 H1 MET 1 1H MET 1 -8.249 0.985 -15.946 2 H2 MET 1 2H MET 1 -7.835 0.308 -14.444 3 H3 MET 1 3H MET 1 -6.809 1.438 -15.182 4 HA MET 1 HA MET 1 -8.323 3.190 -14.883 5 HB2 MET 1 2HB MET 1 -10.186 1.038 -13.882 6 HB3 MET 1 1HB MET 1 -10.464 2.751 -13.613 7 HG2 MET 1 2HG MET 1 -10.403 3.042 -16.103 8 HG3 MET 1 1HG MET 1 -10.402 1.283 -16.231 9 HE1 MET 1 3HE MET 1 -12.259 3.491 -13.550 10 HE2 MET 1 1HE MET 1 -13.823 3.732 -14.331 11 HE3 MET 1 2HE MET 1 -12.370 4.448 -15.028 12 HA PRO 2 HA PRO 2 -6.326 3.091 -10.849 13 HB2 PRO 2 2HB PRO 2 -6.275 5.980 -11.042 14 HB3 PRO 2 1HB PRO 2 -4.923 4.848 -11.087 15 HG2 PRO 2 2HG PRO 2 -5.735 6.324 -13.240 16 HG3 PRO 2 1HG PRO 2 -4.903 4.764 -13.370 17 HD2 PRO 2 2HD PRO 2 -7.818 5.389 -13.634 18 HD3 PRO 2 1HD PRO 2 -6.815 4.255 -14.567 19 H VAL 3 H VAL 3 -7.671 2.773 -9.183 20 HA VAL 3 HA VAL 3 -10.155 4.199 -8.930 21 HB VAL 3 HB VAL 3 -8.828 2.385 -6.905 22 HG11 VAL 3 1HG1 VAL 3 -10.573 3.779 -5.937 23 HG12 VAL 3 2HG1 VAL 3 -11.099 2.097 -6.019 24 HG13 VAL 3 3HG1 VAL 3 -11.700 3.267 -7.194 25 HG21 VAL 3 3HG2 VAL 3 -10.865 1.694 -9.017 26 HG22 VAL 3 1HG2 VAL 3 -10.208 0.597 -7.804 27 HG23 VAL 3 2HG2 VAL 3 -9.158 1.258 -9.059 28 H GLU 4 H GLU 4 -9.924 6.326 -8.488 29 HA GLU 4 HA GLU 4 -7.931 7.138 -6.500 30 HB2 GLU 4 2HB GLU 4 -8.337 9.432 -7.450 31 HB3 GLU 4 1HB GLU 4 -7.651 8.270 -8.579 32 HG2 GLU 4 2HG GLU 4 -9.899 7.888 -9.511 33 HG3 GLU 4 1HG GLU 4 -10.533 9.120 -8.423 34 H LEU 5 H LEU 5 -8.446 8.545 -4.808 35 HA LEU 5 HA LEU 5 -11.327 8.856 -4.275 36 HB2 LEU 5 2HB LEU 5 -10.208 7.423 -2.618 37 HB3 LEU 5 1HB LEU 5 -9.057 8.705 -2.284 38 HG LEU 5 HG LEU 5 -10.916 10.129 -1.475 39 HD11 LEU 5 1HD1 LEU 5 -13.092 9.115 -1.039 40 HD12 LEU 5 2HD1 LEU 5 -12.563 7.635 -1.841 41 HD13 LEU 5 3HD1 LEU 5 -12.718 9.129 -2.763 42 HD21 LEU 5 3HD2 LEU 5 -10.709 7.453 -0.109 43 HD22 LEU 5 1HD2 LEU 5 -11.258 8.961 0.626 44 HD23 LEU 5 2HD2 LEU 5 -9.587 8.799 0.085 45 H ARG 6 H ARG 6 -11.935 10.841 -4.729 46 HA ARG 6 HA ARG 6 -10.018 13.034 -4.471 47 HB2 ARG 6 2HB ARG 6 -12.764 12.922 -5.739 48 HB3 ARG 6 1HB ARG 6 -11.715 14.336 -5.733 49 HG2 ARG 6 2HG ARG 6 -10.066 13.187 -7.047 50 HG3 ARG 6 1HG ARG 6 -10.978 11.682 -6.942 51 HD2 ARG 6 2HD ARG 6 -11.281 12.770 -9.110 52 HD3 ARG 6 1HD ARG 6 -12.795 12.672 -8.214 53 HE ARG 6 HE ARG 6 -12.874 14.954 -8.138 54 HH11 ARG 6 1HH1 ARG 6 -9.617 13.989 -9.027 55 HH12 ARG 6 2HH1 ARG 6 -9.152 15.585 -9.540 56 HH21 ARG 6 1HH2 ARG 6 -12.263 17.044 -8.822 57 HH22 ARG 6 2HH2 ARG 6 -10.659 17.320 -9.426 58 H ALA 7 H ALA 7 -10.847 15.117 -3.550 59 HA ALA 7 HA ALA 7 -11.681 14.647 -0.883 60 HB1 ALA 7 3HB ALA 7 -11.504 17.255 -2.390 61 HB2 ALA 7 1HB ALA 7 -10.199 16.495 -1.479 62 HB3 ALA 7 2HB ALA 7 -11.634 17.081 -0.640 63 H ASN 8 H ASN 8 -13.394 15.287 -3.779 64 HA ASN 8 HA ASN 8 -15.876 15.554 -2.224 65 HB2 ASN 8 2HB ASN 8 -15.435 16.355 -5.109 66 HB3 ASN 8 1HB ASN 8 -16.900 16.605 -4.166 67 HD21 ASN 8 1HD2 ASN 8 -13.713 17.715 -4.848 68 HD22 ASN 8 2HD2 ASN 8 -13.793 19.174 -3.916 69 H TRP 9 H TRP 9 -16.101 13.363 -1.909 70 HA TRP 9 HA TRP 9 -16.365 11.712 -4.327 71 HB2 TRP 9 2HB TRP 9 -16.057 9.783 -2.699 72 HB3 TRP 9 1HB TRP 9 -14.654 10.814 -2.952 73 HD1 TRP 9 HD1 TRP 9 -13.654 12.030 -0.875 74 HE1 TRP 9 HE1 TRP 9 -14.197 12.033 1.640 75 HE3 TRP 9 HE3 TRP 9 -18.140 9.589 -1.005 76 HZ2 TRP 9 HZ2 TRP 9 -16.254 11.127 3.339 77 HZ3 TRP 9 HZ3 TRP 9 -19.326 9.192 1.108 78 HH2 TRP 9 HH2 TRP 9 -18.401 9.944 3.236 79 H SER 10 H SER 10 -18.091 10.287 -4.534 80 HA SER 10 HA SER 10 -20.480 10.916 -3.022 81 HB2 SER 10 2HB SER 10 -20.021 8.904 -5.248 82 HB3 SER 10 1HB SER 10 -21.590 9.358 -4.580 83 HG SER 10 HG SER 10 -21.458 11.300 -5.521 84 H GLU 11 H GLU 11 -21.649 9.321 -1.817 85 HA GLU 11 HA GLU 11 -20.097 7.969 0.034 86 HB2 GLU 11 2HB GLU 11 -22.417 8.663 0.412 87 HB3 GLU 11 1HB GLU 11 -22.971 7.440 -0.720 88 HG2 GLU 11 2HG GLU 11 -22.288 5.681 0.733 89 HG3 GLU 11 1HG GLU 11 -21.470 6.816 1.807 90 H GLU 12 H GLU 12 -21.800 6.612 -2.798 91 HA GLU 12 HA GLU 12 -20.946 3.943 -2.277 92 HB2 GLU 12 2HB GLU 12 -22.946 4.561 -3.646 93 HB3 GLU 12 1HB GLU 12 -21.855 5.095 -4.918 94 HG2 GLU 12 2HG GLU 12 -20.932 2.820 -5.053 95 HG3 GLU 12 1HG GLU 12 -22.088 2.301 -3.829 96 H ASP 13 H ASP 13 -19.504 6.648 -3.880 97 HA ASP 13 HA ASP 13 -17.600 5.233 -5.444 98 HB2 ASP 13 2HB ASP 13 -18.138 7.598 -5.867 99 HB3 ASP 13 1HB ASP 13 -17.452 8.039 -4.308 100 H LEU 14 H LEU 14 -17.467 6.737 -2.231 101 HA LEU 14 HA LEU 14 -14.854 5.987 -1.553 102 HB2 LEU 14 2HB LEU 14 -16.154 7.601 -0.261 103 HB3 LEU 14 1HB LEU 14 -17.270 6.340 0.226 104 HG LEU 14 HG LEU 14 -15.402 5.211 1.423 105 HD11 LEU 14 1HD1 LEU 14 -13.902 7.735 0.746 106 HD12 LEU 14 2HD1 LEU 14 -13.536 6.113 0.158 107 HD13 LEU 14 3HD1 LEU 14 -13.364 6.488 1.872 108 HD21 LEU 14 3HD2 LEU 14 -16.957 6.657 2.616 109 HD22 LEU 14 1HD2 LEU 14 -15.953 8.058 2.244 110 HD23 LEU 14 2HD2 LEU 14 -15.332 6.783 3.294 111 H GLU 15 H GLU 15 -17.925 4.270 -1.250 112 HA GLU 15 HA GLU 15 -17.101 2.024 0.156 113 HB2 GLU 15 2HB GLU 15 -19.116 2.228 -2.087 114 HB3 GLU 15 1HB GLU 15 -18.934 0.825 -1.045 115 HG2 GLU 15 2HG GLU 15 -19.596 3.581 -0.041 116 HG3 GLU 15 1HG GLU 15 -20.801 2.357 -0.438 117 H THR 16 H THR 16 -16.876 2.715 -3.300 118 HA THR 16 HA THR 16 -15.786 0.190 -4.010 119 HB THR 16 HB THR 16 -15.694 2.837 -5.473 120 HG1 THR 16 HG1 THR 16 -17.743 2.341 -5.727 121 HG21 THR 16 3HG2 THR 16 -15.161 0.037 -6.487 122 HG22 THR 16 1HG2 THR 16 -13.954 1.307 -6.287 123 HG23 THR 16 2HG2 THR 16 -15.240 1.494 -7.479 124 H VAL 17 H VAL 17 -14.381 3.318 -3.141 125 HA VAL 17 HA VAL 17 -11.705 2.760 -3.763 126 HB VAL 17 HB VAL 17 -12.807 4.518 -1.561 127 HG11 VAL 17 1HG1 VAL 17 -10.462 3.946 -1.152 128 HG12 VAL 17 2HG1 VAL 17 -10.645 5.645 -1.586 129 HG13 VAL 17 3HG1 VAL 17 -10.046 4.491 -2.778 130 HG21 VAL 17 3HG2 VAL 17 -11.906 5.185 -4.360 131 HG22 VAL 17 1HG2 VAL 17 -12.440 6.343 -3.143 132 HG23 VAL 17 2HG2 VAL 17 -13.572 5.155 -3.786 133 H ILE 18 H ILE 18 -13.402 2.413 -0.632 134 HA ILE 18 HA ILE 18 -11.150 1.246 0.655 135 HB ILE 18 HB ILE 18 -12.707 0.653 2.472 136 HG12 ILE 18 2HG1 ILE 18 -14.818 1.843 0.662 137 HG13 ILE 18 1HG1 ILE 18 -14.692 0.144 1.103 138 HG21 ILE 18 1HG2 ILE 18 -11.670 2.846 2.414 139 HG22 ILE 18 2HG2 ILE 18 -13.298 2.951 3.083 140 HG23 ILE 18 3HG2 ILE 18 -12.992 3.464 1.424 141 HD11 ILE 18 3HD1 ILE 18 -15.117 0.715 3.430 142 HD12 ILE 18 1HD1 ILE 18 -16.418 1.275 2.381 143 HD13 ILE 18 2HD1 ILE 18 -15.227 2.421 2.997 144 H ARG 19 H ARG 19 -13.849 -0.040 -1.134 145 HA ARG 19 HA ARG 19 -13.546 -2.762 -0.431 146 HB2 ARG 19 2HB ARG 19 -15.591 -1.995 -1.434 147 HB3 ARG 19 1HB ARG 19 -14.740 -1.410 -2.852 148 HG2 ARG 19 2HG ARG 19 -14.266 -3.652 -3.566 149 HG3 ARG 19 1HG ARG 19 -14.939 -4.310 -2.072 150 HD2 ARG 19 2HD ARG 19 -16.460 -4.438 -4.059 151 HD3 ARG 19 1HD ARG 19 -17.137 -3.606 -2.662 152 HE ARG 19 HE ARG 19 -16.482 -1.497 -3.872 153 HH11 ARG 19 1HH1 ARG 19 -17.138 -4.456 -5.591 154 HH12 ARG 19 2HH1 ARG 19 -17.733 -3.664 -7.021 155 HH21 ARG 19 1HH2 ARG 19 -17.278 -0.419 -5.757 156 HH22 ARG 19 2HH2 ARG 19 -17.795 -1.367 -7.122 157 H ALA 20 H ALA 20 -11.871 -0.680 -2.644 158 HA ALA 20 HA ALA 20 -10.581 -2.822 -4.079 159 HB1 ALA 20 3HB ALA 20 -10.994 -0.652 -5.154 160 HB2 ALA 20 1HB ALA 20 -9.276 -1.058 -5.140 161 HB3 ALA 20 2HB ALA 20 -9.913 0.120 -3.995 162 H VAL 21 H VAL 21 -9.903 -0.781 -1.319 163 HA VAL 21 HA VAL 21 -7.163 -1.573 -1.048 164 HB VAL 21 HB VAL 21 -8.988 -0.386 1.051 165 HG11 VAL 21 1HG1 VAL 21 -6.984 -1.405 1.989 166 HG12 VAL 21 2HG1 VAL 21 -6.910 0.354 2.113 167 HG13 VAL 21 3HG1 VAL 21 -5.980 -0.483 0.870 168 HG21 VAL 21 3HG2 VAL 21 -8.890 1.045 -0.921 169 HG22 VAL 21 1HG2 VAL 21 -7.127 0.991 -0.884 170 HG23 VAL 21 2HG2 VAL 21 -8.011 1.774 0.426 171 H TYR 22 H TYR 22 -10.157 -2.423 0.700 172 HA TYR 22 HA TYR 22 -8.932 -5.015 1.300 173 HB2 TYR 22 2HB TYR 22 -10.097 -4.951 3.554 174 HB3 TYR 22 1HB TYR 22 -8.689 -3.916 3.382 175 HD1 TYR 22 HD1 TYR 22 -12.385 -3.942 3.566 176 HD2 TYR 22 HD2 TYR 22 -8.860 -1.556 3.587 177 HE1 TYR 22 HE1 TYR 22 -13.703 -2.008 4.324 178 HE2 TYR 22 HE2 TYR 22 -10.168 0.379 4.344 179 HH TYR 22 HH TYR 22 -13.344 0.131 5.506 180 H ARG 23 H ARG 23 -10.305 -6.749 1.267 181 HA ARG 23 HA ARG 23 -12.619 -6.325 -0.363 182 HB2 ARG 23 2HB ARG 23 -10.918 -8.574 0.362 183 HB3 ARG 23 1HB ARG 23 -12.622 -9.002 0.293 184 HG2 ARG 23 2HG ARG 23 -12.762 -8.136 -1.979 185 HG3 ARG 23 1HG ARG 23 -11.063 -7.669 -1.913 186 HD2 ARG 23 2HD ARG 23 -11.492 -9.825 -3.101 187 HD3 ARG 23 1HD ARG 23 -10.369 -9.950 -1.748 188 HE ARG 23 HE ARG 23 -12.555 -10.658 -0.500 189 HH11 ARG 23 1HH1 ARG 23 -11.677 -11.479 -3.797 190 HH12 ARG 23 2HH1 ARG 23 -12.445 -13.038 -3.743 191 HH21 ARG 23 1HH2 ARG 23 -13.580 -12.685 -0.444 192 HH22 ARG 23 2HH2 ARG 23 -13.542 -13.723 -1.838 193 H GLN 24 H GLN 24 -14.560 -5.996 0.291 194 HA GLN 24 HA GLN 24 -15.657 -7.601 2.462 195 HB2 GLN 24 2HB GLN 24 -15.153 -5.387 3.464 196 HB3 GLN 24 1HB GLN 24 -16.114 -4.616 2.209 197 HG2 GLN 24 2HG GLN 24 -17.347 -4.789 4.299 198 HG3 GLN 24 1HG GLN 24 -18.108 -5.734 3.020 199 HE21 GLN 24 1HE2 GLN 24 -19.187 -7.050 4.469 200 HE22 GLN 24 2HE2 GLN 24 -18.374 -8.254 5.417 201 H VAL 25 H VAL 25 -17.233 -8.729 1.498 202 HA VAL 25 HA VAL 25 -17.955 -8.111 -1.176 203 HB VAL 25 HB VAL 25 -19.298 -10.172 0.564 204 HG11 VAL 25 1HG1 VAL 25 -18.909 -9.936 -2.419 205 HG12 VAL 25 2HG1 VAL 25 -20.427 -9.784 -1.531 206 HG13 VAL 25 3HG1 VAL 25 -19.596 -11.338 -1.601 207 HG21 VAL 25 3HG2 VAL 25 -16.917 -10.517 0.741 208 HG22 VAL 25 1HG2 VAL 25 -16.736 -10.397 -1.009 209 HG23 VAL 25 2HG2 VAL 25 -17.612 -11.756 -0.305 210 H LEU 26 H LEU 26 -19.900 -8.204 1.830 211 HA LEU 26 HA LEU 26 -21.679 -6.237 0.543 212 HB2 LEU 26 2HB LEU 26 -22.568 -8.510 2.327 213 HB3 LEU 26 1HB LEU 26 -23.601 -7.224 1.742 214 HG LEU 26 HG LEU 26 -22.785 -8.148 -0.619 215 HD11 LEU 26 1HD1 LEU 26 -21.299 -9.831 0.341 216 HD12 LEU 26 2HD1 LEU 26 -22.600 -10.571 -0.591 217 HD13 LEU 26 3HD1 LEU 26 -22.668 -10.569 1.172 218 HD21 LEU 26 3HD2 LEU 26 -25.097 -7.948 0.078 219 HD22 LEU 26 1HD2 LEU 26 -24.941 -9.386 1.090 220 HD23 LEU 26 2HD2 LEU 26 -24.824 -9.525 -0.664 221 H GLY 27 H GLY 27 -22.676 -4.739 1.957 222 HA2 GLY 27 2HA GLY 27 -21.290 -4.325 4.480 223 HA3 GLY 27 1HA GLY 27 -22.460 -3.237 3.738 224 H ASN 28 H ASN 28 -22.007 -5.990 5.802 225 HA ASN 28 HA ASN 28 -24.840 -6.500 6.049 226 HB2 ASN 28 2HB ASN 28 -24.167 -8.279 7.618 227 HB3 ASN 28 1HB ASN 28 -23.325 -8.394 6.080 228 HD21 ASN 28 1HD2 ASN 28 -21.512 -9.404 6.662 229 HD22 ASN 28 2HD2 ASN 28 -20.380 -8.809 7.828 230 H ASP 29 H ASP 29 -25.531 -6.922 8.500 231 HA ASP 29 HA ASP 29 -25.399 -4.245 9.660 232 HB2 ASP 29 2HB ASP 29 -27.417 -4.878 10.881 233 HB3 ASP 29 1HB ASP 29 -27.617 -5.187 9.160 234 H TYR 30 H TYR 30 -23.465 -6.685 10.040 235 HA TYR 30 HA TYR 30 -23.736 -7.215 12.854 236 HB2 TYR 30 2HB TYR 30 -21.668 -8.023 10.819 237 HB3 TYR 30 1HB TYR 30 -21.516 -8.419 12.530 238 HD1 TYR 30 HD1 TYR 30 -23.145 -9.931 13.598 239 HD2 TYR 30 HD2 TYR 30 -23.222 -9.196 9.413 240 HE1 TYR 30 HE1 TYR 30 -24.570 -11.911 13.285 241 HE2 TYR 30 HE2 TYR 30 -24.645 -11.173 9.084 242 HH TYR 30 HH TYR 30 -26.209 -12.763 11.637 243 H VAL 31 H VAL 31 -23.645 -5.140 13.706 244 HA VAL 31 HA VAL 31 -21.341 -3.466 13.356 245 HB VAL 31 HB VAL 31 -23.636 -2.594 13.833 246 HG11 VAL 31 1HG1 VAL 31 -24.345 -4.216 15.490 247 HG12 VAL 31 2HG1 VAL 31 -24.446 -2.584 16.149 248 HG13 VAL 31 3HG1 VAL 31 -23.112 -3.642 16.610 249 HG21 VAL 31 3HG2 VAL 31 -21.696 -1.168 14.144 250 HG22 VAL 31 1HG2 VAL 31 -21.492 -1.773 15.788 251 HG23 VAL 31 2HG2 VAL 31 -22.917 -0.822 15.369 252 H MET 32 H MET 32 -22.117 -6.146 15.290 253 HA MET 32 HA MET 32 -20.381 -5.575 17.498 254 HB2 MET 32 2HB MET 32 -21.490 -8.211 16.516 255 HB3 MET 32 1HB MET 32 -20.670 -7.967 18.051 256 HG2 MET 32 2HG MET 32 -22.434 -6.439 18.758 257 HG3 MET 32 1HG MET 32 -23.257 -6.676 17.217 258 HE1 MET 32 3HE MET 32 -21.371 -9.366 19.428 259 HE2 MET 32 1HE MET 32 -22.705 -9.963 20.413 260 HE3 MET 32 2HE MET 32 -22.149 -8.299 20.597 261 H ALA 33 H ALA 33 -19.855 -6.373 14.296 262 HA ALA 33 HA ALA 33 -17.238 -7.601 14.834 263 HB1 ALA 33 3HB ALA 33 -18.805 -7.443 12.256 264 HB2 ALA 33 1HB ALA 33 -18.695 -8.850 13.317 265 HB3 ALA 33 2HB ALA 33 -17.259 -8.262 12.479 266 H SER 34 H SER 34 -17.751 -4.818 15.295 267 HA SER 34 HA SER 34 -16.968 -3.228 13.076 268 HB2 SER 34 2HB SER 34 -16.793 -1.417 14.810 269 HB3 SER 34 1HB SER 34 -18.342 -2.263 14.795 270 HG SER 34 HG SER 34 -16.168 -2.734 16.575 271 H GLU 35 H GLU 35 -15.109 -5.309 14.838 272 HA GLU 35 HA GLU 35 -12.832 -3.578 15.183 273 HB2 GLU 35 2HB GLU 35 -13.033 -6.573 15.507 274 HB3 GLU 35 1HB GLU 35 -11.684 -5.567 16.018 275 HG2 GLU 35 2HG GLU 35 -14.470 -5.633 17.127 276 HG3 GLU 35 1HG GLU 35 -12.954 -6.001 17.949 277 H ARG 36 H ARG 36 -12.848 -2.965 12.888 278 HA ARG 36 HA ARG 36 -10.686 -4.290 11.594 279 HB2 ARG 36 2HB ARG 36 -12.677 -5.703 10.919 280 HB3 ARG 36 1HB ARG 36 -13.283 -4.295 10.056 281 HG2 ARG 36 2HG ARG 36 -11.210 -4.278 8.708 282 HG3 ARG 36 1HG ARG 36 -10.699 -5.754 9.530 283 HD2 ARG 36 2HD ARG 36 -12.830 -6.814 8.735 284 HD3 ARG 36 1HD ARG 36 -13.101 -5.376 7.754 285 HE ARG 36 HE ARG 36 -10.566 -6.744 7.365 286 HH11 ARG 36 1HH1 ARG 36 -13.819 -6.127 6.202 287 HH12 ARG 36 2HH1 ARG 36 -13.536 -6.874 4.657 288 HH21 ARG 36 1HH2 ARG 36 -10.195 -7.722 5.331 289 HH22 ARG 36 2HH2 ARG 36 -11.490 -7.790 4.169 290 H LEU 37 H LEU 37 -10.287 -1.941 12.276 291 HA LEU 37 HA LEU 37 -9.354 -0.061 11.429 292 HB2 LEU 37 2HB LEU 37 -10.204 -1.314 8.834 293 HB3 LEU 37 1HB LEU 37 -9.316 0.198 8.915 294 HG LEU 37 HG LEU 37 -8.297 -2.357 10.144 295 HD11 LEU 37 1HD1 LEU 37 -7.696 -1.205 7.428 296 HD12 LEU 37 2HD1 LEU 37 -8.553 -2.710 7.755 297 HD13 LEU 37 3HD1 LEU 37 -6.848 -2.553 8.183 298 HD21 LEU 37 3HD2 LEU 37 -6.157 -1.173 10.078 299 HD22 LEU 37 1HD2 LEU 37 -7.352 -0.301 11.039 300 HD23 LEU 37 2HD2 LEU 37 -6.965 0.245 9.408 301 H VAL 38 H VAL 38 -12.243 -0.131 12.174 302 HA VAL 38 HA VAL 38 -13.741 1.554 10.512 303 HB VAL 38 HB VAL 38 -13.876 1.198 13.512 304 HG11 VAL 38 1HG1 VAL 38 -16.107 2.195 13.395 305 HG12 VAL 38 2HG1 VAL 38 -15.868 2.539 11.682 306 HG13 VAL 38 3HG1 VAL 38 -14.869 3.347 12.891 307 HG21 VAL 38 3HG2 VAL 38 -15.782 -0.229 12.997 308 HG22 VAL 38 1HG2 VAL 38 -14.327 -0.807 12.187 309 HG23 VAL 38 2HG2 VAL 38 -15.554 0.071 11.274 310 H SER 39 H SER 39 -11.381 2.297 13.031 311 HA SER 39 HA SER 39 -11.790 5.079 13.113 312 HB2 SER 39 2HB SER 39 -9.252 3.503 13.611 313 HB3 SER 39 1HB SER 39 -9.530 5.177 14.094 314 HG SER 39 HG SER 39 -10.330 4.357 15.839 315 H ALA 40 H ALA 40 -9.764 3.024 11.092 316 HA ALA 40 HA ALA 40 -8.415 5.119 9.743 317 HB1 ALA 40 3HB ALA 40 -8.929 2.280 8.857 318 HB2 ALA 40 1HB ALA 40 -7.539 2.846 9.781 319 HB3 ALA 40 2HB ALA 40 -7.778 3.396 8.122 320 H GLU 41 H GLU 41 -11.326 3.232 9.015 321 HA GLU 41 HA GLU 41 -11.935 4.289 6.508 322 HB2 GLU 41 2HB GLU 41 -13.930 3.561 8.658 323 HB3 GLU 41 1HB GLU 41 -14.239 3.642 6.932 324 HG2 GLU 41 2HG GLU 41 -12.654 1.778 6.600 325 HG3 GLU 41 1HG GLU 41 -12.462 1.670 8.350 326 H SER 42 H SER 42 -12.941 5.401 9.719 327 HA SER 42 HA SER 42 -14.502 7.559 8.845 328 HB2 SER 42 2HB SER 42 -14.461 6.455 11.147 329 HB3 SER 42 1HB SER 42 -13.037 7.436 11.485 330 HG SER 42 HG SER 42 -14.242 9.266 11.348 331 H LEU 43 H LEU 43 -11.075 7.347 9.709 332 HA LEU 43 HA LEU 43 -10.544 10.121 9.575 333 HB2 LEU 43 2HB LEU 43 -8.728 7.736 9.242 334 HB3 LEU 43 1HB LEU 43 -8.158 9.393 9.311 335 HG LEU 43 HG LEU 43 -9.615 7.945 11.526 336 HD11 LEU 43 1HD1 LEU 43 -7.461 8.065 12.686 337 HD12 LEU 43 2HD1 LEU 43 -6.727 8.759 11.240 338 HD13 LEU 43 3HD1 LEU 43 -7.357 7.113 11.205 339 HD21 LEU 43 3HD2 LEU 43 -10.125 10.315 11.543 340 HD22 LEU 43 1HD2 LEU 43 -8.412 10.709 11.415 341 HD23 LEU 43 2HD2 LEU 43 -9.030 9.924 12.869 342 H LEU 44 H LEU 44 -10.373 7.525 7.172 343 HA LEU 44 HA LEU 44 -9.302 9.171 5.106 344 HB2 LEU 44 2HB LEU 44 -9.167 6.687 5.133 345 HB3 LEU 44 1HB LEU 44 -10.896 6.618 4.850 346 HG LEU 44 HG LEU 44 -10.500 7.870 2.703 347 HD11 LEU 44 1HD1 LEU 44 -8.249 7.868 1.783 348 HD12 LEU 44 2HD1 LEU 44 -7.622 7.190 3.285 349 HD13 LEU 44 3HD1 LEU 44 -8.317 8.811 3.273 350 HD21 LEU 44 3HD2 LEU 44 -10.898 5.474 2.742 351 HD22 LEU 44 1HD2 LEU 44 -9.181 5.179 3.013 352 HD23 LEU 44 2HD2 LEU 44 -9.724 5.892 1.494 353 H ARG 45 H ARG 45 -12.559 8.174 6.035 354 HA ARG 45 HA ARG 45 -13.984 9.233 3.888 355 HB2 ARG 45 2HB ARG 45 -15.062 7.778 5.481 356 HB3 ARG 45 1HB ARG 45 -14.775 8.917 6.789 357 HG2 ARG 45 2HG ARG 45 -16.323 10.482 5.845 358 HG3 ARG 45 1HG ARG 45 -16.510 9.490 4.401 359 HD2 ARG 45 2HD ARG 45 -18.408 9.232 5.908 360 HD3 ARG 45 1HD ARG 45 -17.521 7.723 5.728 361 HE ARG 45 HE ARG 45 -16.969 7.791 7.955 362 HH11 ARG 45 1HH1 ARG 45 -18.220 10.938 7.004 363 HH12 ARG 45 2HH1 ARG 45 -18.482 11.472 8.639 364 HH21 ARG 45 1HH2 ARG 45 -17.313 8.499 10.106 365 HH22 ARG 45 2HH2 ARG 45 -17.959 10.089 10.404 366 H ASN 46 H ASN 46 -12.758 10.806 6.789 367 HA ASN 46 HA ASN 46 -14.014 13.314 5.986 368 HB2 ASN 46 2HB ASN 46 -12.577 12.450 8.486 369 HB3 ASN 46 1HB ASN 46 -12.981 14.137 8.181 370 HD21 ASN 46 1HD2 ASN 46 -14.189 11.001 8.999 371 HD22 ASN 46 2HD2 ASN 46 -15.810 11.495 9.353 372 H GLY 47 H GLY 47 -11.460 11.810 4.911 373 HA2 GLY 47 2HA GLY 47 -9.556 12.454 3.815 374 HA3 GLY 47 1HA GLY 47 -10.273 14.055 3.761 375 H LYS 48 H LYS 48 -9.483 12.397 6.746 376 HA LYS 48 HA LYS 48 -7.845 14.664 7.494 377 HB2 LYS 48 2HB LYS 48 -9.489 13.742 9.080 378 HB3 LYS 48 1HB LYS 48 -8.624 12.212 9.086 379 HG2 LYS 48 2HG LYS 48 -6.740 13.195 10.156 380 HG3 LYS 48 1HG LYS 48 -7.399 14.819 9.952 381 HD2 LYS 48 2HD LYS 48 -8.679 12.643 11.603 382 HD3 LYS 48 1HD LYS 48 -7.654 13.924 12.252 383 HE2 LYS 48 2HE LYS 48 -9.237 15.599 11.365 384 HE3 LYS 48 1HE LYS 48 -10.273 14.292 10.795 385 HZ1 LYS 48 3HZ LYS 48 -10.572 13.564 13.067 386 HZ2 LYS 48 1HZ LYS 48 -11.011 15.196 12.924 387 HZ3 LYS 48 2HZ LYS 48 -9.528 14.775 13.629 388 H ILE 49 H ILE 49 -7.452 11.348 6.557 389 HA ILE 49 HA ILE 49 -4.536 11.647 6.873 390 HB ILE 49 HB ILE 49 -4.356 9.201 6.948 391 HG12 ILE 49 2HG1 ILE 49 -7.381 9.193 7.066 392 HG13 ILE 49 1HG1 ILE 49 -6.429 8.700 5.668 393 HG21 ILE 49 1HG2 ILE 49 -6.243 10.317 9.020 394 HG22 ILE 49 2HG2 ILE 49 -4.482 10.433 9.042 395 HG23 ILE 49 3HG2 ILE 49 -5.265 8.860 9.198 396 HD11 ILE 49 3HD1 ILE 49 -7.210 6.779 6.932 397 HD12 ILE 49 1HD1 ILE 49 -6.400 7.384 8.378 398 HD13 ILE 49 2HD1 ILE 49 -5.450 6.886 6.976 399 H THR 50 H THR 50 -3.221 10.803 5.166 400 HA THR 50 HA THR 50 -4.386 11.150 2.567 401 HB THR 50 HB THR 50 -2.100 10.571 1.732 402 HG1 THR 50 HG1 THR 50 -1.327 10.550 4.478 403 HG21 THR 50 3HG2 THR 50 -0.980 12.565 2.617 404 HG22 THR 50 1HG2 THR 50 -2.175 12.662 3.912 405 HG23 THR 50 2HG2 THR 50 -2.670 12.895 2.236 406 H VAL 51 H VAL 51 -4.390 9.545 0.874 407 HA VAL 51 HA VAL 51 -5.375 7.037 1.642 408 HB VAL 51 HB VAL 51 -4.234 7.906 -1.022 409 HG11 VAL 51 1HG1 VAL 51 -5.409 5.990 -1.986 410 HG12 VAL 51 2HG1 VAL 51 -5.888 5.466 -0.372 411 HG13 VAL 51 3HG1 VAL 51 -4.185 5.466 -0.829 412 HG21 VAL 51 3HG2 VAL 51 -7.073 7.698 -0.024 413 HG22 VAL 51 1HG2 VAL 51 -6.592 8.135 -1.664 414 HG23 VAL 51 2HG2 VAL 51 -6.178 9.190 -0.311 415 H ARG 52 H ARG 52 -2.131 8.094 0.760 416 HA ARG 52 HA ARG 52 -0.823 5.642 0.651 417 HB2 ARG 52 2HB ARG 52 0.211 7.854 0.121 418 HB3 ARG 52 1HB ARG 52 0.265 8.203 1.845 419 HG2 ARG 52 2HG ARG 52 1.648 6.097 2.084 420 HG3 ARG 52 1HG ARG 52 1.781 6.104 0.325 421 HD2 ARG 52 2HD ARG 52 3.722 7.177 1.139 422 HD3 ARG 52 1HD ARG 52 2.676 8.457 0.532 423 HE ARG 52 HE ARG 52 2.002 8.503 3.082 424 HH11 ARG 52 1HH1 ARG 52 5.168 8.170 1.654 425 HH12 ARG 52 2HH1 ARG 52 6.001 8.932 2.974 426 HH21 ARG 52 1HH2 ARG 52 3.075 9.483 4.857 427 HH22 ARG 52 2HH2 ARG 52 4.811 9.641 4.825 428 H GLU 53 H GLU 53 -1.500 7.724 3.441 429 HA GLU 53 HA GLU 53 -0.237 6.024 5.340 430 HB2 GLU 53 2HB GLU 53 -0.539 8.425 5.722 431 HB3 GLU 53 1HB GLU 53 -2.284 8.214 5.727 432 HG2 GLU 53 2HG GLU 53 -2.272 7.125 7.780 433 HG3 GLU 53 1HG GLU 53 -0.545 6.765 7.683 434 H PHE 54 H PHE 54 -3.533 6.398 4.168 435 HA PHE 54 HA PHE 54 -4.834 4.715 5.987 436 HB2 PHE 54 2HB PHE 54 -6.070 6.135 4.440 437 HB3 PHE 54 1HB PHE 54 -5.446 5.228 3.067 438 HD1 PHE 54 HD1 PHE 54 -7.521 4.892 6.122 439 HD2 PHE 54 HD2 PHE 54 -6.601 3.379 2.255 440 HE1 PHE 54 HE1 PHE 54 -9.467 3.396 6.251 441 HE2 PHE 54 HE2 PHE 54 -8.548 1.877 2.376 442 HZ PHE 54 HZ PHE 54 -9.985 1.886 4.374 443 H VAL 55 H VAL 55 -3.453 3.946 2.785 444 HA VAL 55 HA VAL 55 -3.968 1.191 2.853 445 HB VAL 55 HB VAL 55 -1.715 2.646 1.448 446 HG11 VAL 55 1HG1 VAL 55 -2.831 -0.113 0.939 447 HG12 VAL 55 2HG1 VAL 55 -1.259 0.247 1.648 448 HG13 VAL 55 3HG1 VAL 55 -1.594 0.700 -0.021 449 HG21 VAL 55 3HG2 VAL 55 -3.181 2.525 -0.520 450 HG22 VAL 55 1HG2 VAL 55 -3.912 3.456 0.788 451 HG23 VAL 55 2HG2 VAL 55 -4.446 1.805 0.477 452 H ARG 56 H ARG 56 -1.188 3.060 4.002 453 HA ARG 56 HA ARG 56 0.477 0.960 4.767 454 HB2 ARG 56 2HB ARG 56 1.232 3.284 4.773 455 HB3 ARG 56 1HB ARG 56 0.113 3.667 6.073 456 HG2 ARG 56 2HG ARG 56 1.330 2.267 7.606 457 HG3 ARG 56 1HG ARG 56 2.387 1.708 6.310 458 HD2 ARG 56 2HD ARG 56 3.516 3.380 7.649 459 HD3 ARG 56 1HD ARG 56 3.225 3.996 6.025 460 HE ARG 56 HE ARG 56 1.272 5.196 7.056 461 HH11 ARG 56 1HH1 ARG 56 4.038 4.252 8.972 462 HH12 ARG 56 2HH1 ARG 56 3.883 5.575 10.090 463 HH21 ARG 56 1HH2 ARG 56 1.080 6.976 8.546 464 HH22 ARG 56 2HH2 ARG 56 2.234 7.110 9.837 465 H ALA 57 H ALA 57 -1.994 2.672 6.654 466 HA ALA 57 HA ALA 57 -1.736 1.202 9.015 467 HB1 ALA 57 3HB ALA 57 -4.225 2.506 7.912 468 HB2 ALA 57 1HB ALA 57 -2.975 3.314 8.859 469 HB3 ALA 57 2HB ALA 57 -3.948 2.037 9.590 470 H VAL 58 H VAL 58 -3.959 0.730 6.273 471 HA VAL 58 HA VAL 58 -5.366 -1.455 7.283 472 HB VAL 58 HB VAL 58 -4.719 -0.828 4.396 473 HG11 VAL 58 1HG1 VAL 58 -6.669 -2.194 3.838 474 HG12 VAL 58 2HG1 VAL 58 -6.861 -2.621 5.538 475 HG13 VAL 58 3HG1 VAL 58 -5.433 -3.152 4.653 476 HG21 VAL 58 3HG2 VAL 58 -7.134 -0.155 6.068 477 HG22 VAL 58 1HG2 VAL 58 -6.928 0.211 4.356 478 HG23 VAL 58 2HG2 VAL 58 -5.885 0.978 5.555 479 H ALA 59 H ALA 59 -2.483 -1.449 5.199 480 HA ALA 59 HA ALA 59 -2.421 -4.252 4.866 481 HB1 ALA 59 3HB ALA 59 -0.181 -2.270 4.517 482 HB2 ALA 59 1HB ALA 59 -1.390 -2.676 3.300 483 HB3 ALA 59 2HB ALA 59 -0.248 -3.901 3.853 484 H LYS 60 H LYS 60 -1.135 -2.176 7.365 485 HA LYS 60 HA LYS 60 0.621 -4.337 8.283 486 HB2 LYS 60 2HB LYS 60 0.498 -1.448 9.155 487 HB3 LYS 60 1HB LYS 60 1.673 -2.635 9.704 488 HG2 LYS 60 2HG LYS 60 2.498 -2.862 7.398 489 HG3 LYS 60 1HG LYS 60 1.351 -1.624 6.884 490 HD2 LYS 60 2HD LYS 60 3.520 -0.614 7.197 491 HD3 LYS 60 1HD LYS 60 2.427 -0.038 8.457 492 HE2 LYS 60 2HE LYS 60 3.363 -1.708 10.003 493 HE3 LYS 60 1HE LYS 60 4.485 -2.221 8.745 494 HZ1 LYS 60 3HZ LYS 60 5.434 0.019 8.748 495 HZ2 LYS 60 1HZ LYS 60 5.548 -0.715 10.277 496 HZ3 LYS 60 2HZ LYS 60 4.374 0.473 9.986 497 H SER 61 H SER 61 -2.497 -3.701 8.805 498 HA SER 61 HA SER 61 -2.283 -4.102 11.721 499 HB2 SER 61 2HB SER 61 -4.479 -2.935 11.906 500 HB3 SER 61 1HB SER 61 -3.185 -1.910 11.282 501 HG SER 61 HG SER 61 -4.061 -1.961 9.308 502 H GLU 62 H GLU 62 -2.717 -6.005 9.282 503 HA GLU 62 HA GLU 62 -5.248 -7.121 9.435 504 HB2 GLU 62 2HB GLU 62 -2.576 -8.310 8.770 505 HB3 GLU 62 1HB GLU 62 -4.020 -9.316 8.823 506 HG2 GLU 62 2HG GLU 62 -3.628 -6.885 7.086 507 HG3 GLU 62 1HG GLU 62 -3.536 -8.565 6.558 508 H LEU 63 H LEU 63 -6.268 -8.508 10.714 509 HA LEU 63 HA LEU 63 -5.721 -8.281 13.432 510 HB2 LEU 63 2HB LEU 63 -7.548 -10.261 12.080 511 HB3 LEU 63 1HB LEU 63 -7.605 -9.796 13.769 512 HG LEU 63 HG LEU 63 -8.154 -7.973 11.426 513 HD11 LEU 63 1HD1 LEU 63 -10.020 -9.121 13.495 514 HD12 LEU 63 2HD1 LEU 63 -9.901 -9.650 11.817 515 HD13 LEU 63 3HD1 LEU 63 -10.452 -8.016 12.190 516 HD21 LEU 63 3HD2 LEU 63 -8.827 -6.343 13.098 517 HD22 LEU 63 1HD2 LEU 63 -7.135 -6.794 13.315 518 HD23 LEU 63 2HD2 LEU 63 -8.371 -7.453 14.388 519 H TYR 64 H TYR 64 -5.694 -11.330 11.549 520 HA TYR 64 HA TYR 64 -3.965 -12.444 13.664 521 HB2 TYR 64 2HB TYR 64 -6.134 -13.864 12.103 522 HB3 TYR 64 1HB TYR 64 -5.052 -14.631 13.259 523 HD1 TYR 64 HD1 TYR 64 -7.916 -12.369 12.856 524 HD2 TYR 64 HD2 TYR 64 -5.383 -14.353 15.635 525 HE1 TYR 64 HE1 TYR 64 -9.507 -11.859 14.658 526 HE2 TYR 64 HE2 TYR 64 -6.965 -13.846 17.448 527 HH TYR 64 HH TYR 64 -8.740 -12.374 17.994 528 H LYS 65 H LYS 65 -2.592 -14.233 12.992 529 HA LYS 65 HA LYS 65 -1.591 -13.839 10.279 530 HB2 LYS 65 2HB LYS 65 0.040 -13.811 12.112 531 HB3 LYS 65 1HB LYS 65 -0.462 -15.424 12.600 532 HG2 LYS 65 2HG LYS 65 0.337 -16.308 10.456 533 HG3 LYS 65 1HG LYS 65 0.873 -14.689 10.002 534 HD2 LYS 65 2HD LYS 65 2.409 -14.646 11.886 535 HD3 LYS 65 1HD LYS 65 1.842 -16.232 12.410 536 HE2 LYS 65 2HE LYS 65 2.661 -17.209 10.324 537 HE3 LYS 65 1HE LYS 65 3.222 -15.623 9.799 538 HZ1 LYS 65 3HZ LYS 65 4.731 -15.572 11.684 539 HZ2 LYS 65 1HZ LYS 65 5.027 -16.938 10.719 540 HZ3 LYS 65 2HZ LYS 65 4.191 -17.100 12.189 541 H GLU 66 H GLU 66 -3.006 -14.904 8.972 542 HA GLU 66 HA GLU 66 -3.137 -17.812 9.334 543 HB2 GLU 66 2HB GLU 66 -5.456 -17.715 8.368 544 HB3 GLU 66 1HB GLU 66 -5.286 -17.050 9.986 545 HG2 GLU 66 2HG GLU 66 -5.166 -14.780 8.942 546 HG3 GLU 66 1HG GLU 66 -5.575 -15.539 7.403 547 H LYS 67 H LYS 67 -4.671 -18.202 6.911 548 HA LYS 67 HA LYS 67 -2.485 -18.448 5.145 549 HB2 LYS 67 2HB LYS 67 -4.367 -20.019 5.118 550 HB3 LYS 67 1HB LYS 67 -5.428 -18.741 4.541 551 HG2 LYS 67 2HG LYS 67 -4.695 -20.257 2.745 552 HG3 LYS 67 1HG LYS 67 -4.196 -18.587 2.471 553 HD2 LYS 67 2HD LYS 67 -1.969 -19.161 3.428 554 HD3 LYS 67 1HD LYS 67 -2.487 -20.846 3.508 555 HE2 LYS 67 2HE LYS 67 -2.801 -20.877 1.093 556 HE3 LYS 67 1HE LYS 67 -2.337 -19.179 0.999 557 HZ1 LYS 67 3HZ LYS 67 -0.135 -19.727 1.714 558 HZ2 LYS 67 1HZ LYS 67 -0.534 -20.744 0.416 559 HZ3 LYS 67 2HZ LYS 67 -0.563 -21.341 2.007 560 H PHE 68 H PHE 68 -1.610 -16.498 4.798 561 HA PHE 68 HA PHE 68 -2.137 -15.293 2.388 562 HB2 PHE 68 2HB PHE 68 -2.962 -13.090 2.899 563 HB3 PHE 68 1HB PHE 68 -4.095 -14.241 3.588 564 HD1 PHE 68 HD1 PHE 68 -4.147 -14.592 6.047 565 HD2 PHE 68 HD2 PHE 68 -1.784 -11.546 4.244 566 HE1 PHE 68 HE1 PHE 68 -3.970 -13.444 8.216 567 HE2 PHE 68 HE2 PHE 68 -1.600 -10.400 6.411 568 HZ PHE 68 HZ PHE 68 -2.695 -11.350 8.401 569 H LEU 69 H LEU 69 -0.953 -14.930 5.649 570 HA LEU 69 HA LEU 69 1.569 -13.796 4.661 571 HB2 LEU 69 2HB LEU 69 0.472 -12.631 6.533 572 HB3 LEU 69 1HB LEU 69 0.492 -14.108 7.474 573 HG LEU 69 HG LEU 69 2.992 -14.037 7.421 574 HD11 LEU 69 1HD1 LEU 69 2.558 -11.284 6.276 575 HD12 LEU 69 2HD1 LEU 69 3.236 -12.662 5.409 576 HD13 LEU 69 3HD1 LEU 69 4.098 -11.975 6.785 577 HD21 LEU 69 3HD2 LEU 69 1.632 -11.615 8.600 578 HD22 LEU 69 1HD2 LEU 69 3.191 -12.275 9.093 579 HD23 LEU 69 2HD2 LEU 69 1.717 -13.212 9.341 580 H TYR 70 H TYR 70 0.075 -16.632 5.871 581 HA TYR 70 HA TYR 70 2.646 -17.931 6.403 582 HB2 TYR 70 2HB TYR 70 0.735 -18.047 8.074 583 HB3 TYR 70 1HB TYR 70 -0.122 -19.040 6.903 584 HD1 TYR 70 HD2 TYR 70 0.816 -21.286 6.280 585 HD2 TYR 70 HD1 TYR 70 2.426 -18.959 9.459 586 HE1 TYR 70 HE2 TYR 70 1.930 -23.286 7.176 587 HE2 TYR 70 HE1 TYR 70 3.541 -20.954 10.360 588 HH TYR 70 HH TYR 70 3.970 -23.763 8.626 589 H GLY 71 H GLY 71 3.442 -19.469 5.086 590 HA2 GLY 71 2HA GLY 71 1.949 -21.210 3.479 591 HA3 GLY 71 1HA GLY 71 2.457 -19.847 2.489 592 H ASN 72 H ASN 72 3.418 -22.166 1.658 593 HA ASN 72 HA ASN 72 5.897 -22.895 2.902 594 HB2 ASN 72 2HB ASN 72 4.571 -24.485 1.497 595 HB3 ASN 72 1HB ASN 72 4.965 -23.510 0.085 596 HD21 ASN 72 1HD2 ASN 72 6.097 -25.820 2.373 597 HD22 ASN 72 2HD2 ASN 72 7.627 -26.131 1.625 598 H PHE 73 H PHE 73 5.191 -21.448 -0.285 599 HA PHE 73 HA PHE 73 7.859 -20.312 -0.343 600 HB2 PHE 73 2HB PHE 73 5.592 -20.203 -2.344 601 HB3 PHE 73 1HB PHE 73 7.166 -19.456 -2.592 602 HD1 PHE 73 HD2 PHE 73 9.199 -20.907 -2.694 603 HD2 PHE 73 HD1 PHE 73 5.252 -22.493 -2.765 604 HE1 PHE 73 HE2 PHE 73 10.071 -23.019 -3.606 605 HE2 PHE 73 HE1 PHE 73 6.114 -24.609 -3.673 606 HZ PHE 73 HZ PHE 73 8.525 -24.876 -4.094 607 H GLN 74 H GLN 74 7.652 -18.931 1.452 608 HA GLN 74 HA GLN 74 5.704 -16.979 1.815 609 HB2 GLN 74 2HB GLN 74 8.548 -17.187 2.754 610 HB3 GLN 74 1HB GLN 74 7.538 -15.807 3.178 611 HG2 GLN 74 2HG GLN 74 5.915 -17.296 4.211 612 HG3 GLN 74 1HG GLN 74 6.892 -18.692 3.761 613 HE21 GLN 74 1HE2 GLN 74 6.622 -15.932 5.859 614 HE22 GLN 74 2HE2 GLN 74 7.828 -16.430 6.998 615 H THR 75 H THR 75 8.390 -17.029 -0.354 616 HA THR 75 HA THR 75 8.834 -14.460 -1.098 617 HB THR 75 HB THR 75 8.211 -16.662 -3.078 618 HG1 THR 75 HG1 THR 75 10.756 -16.701 -2.713 619 HG21 THR 75 3HG2 THR 75 9.955 -15.539 -4.426 620 HG22 THR 75 1HG2 THR 75 10.054 -14.272 -3.201 621 HG23 THR 75 2HG2 THR 75 8.564 -14.501 -4.117 622 H ARG 76 H ARG 76 5.921 -16.363 -1.744 623 HA ARG 76 HA ARG 76 4.670 -14.660 -3.586 624 HB2 ARG 76 2HB ARG 76 3.757 -16.792 -1.726 625 HB3 ARG 76 1HB ARG 76 2.534 -15.717 -2.380 626 HG2 ARG 76 2HG ARG 76 2.678 -17.705 -3.722 627 HG3 ARG 76 1HG ARG 76 3.236 -16.318 -4.654 628 HD2 ARG 76 2HD ARG 76 5.231 -17.962 -3.172 629 HD3 ARG 76 1HD ARG 76 4.549 -18.592 -4.670 630 HE ARG 76 HE ARG 76 5.547 -15.890 -4.881 631 HH11 ARG 76 1HH1 ARG 76 6.355 -19.287 -5.082 632 HH12 ARG 76 2HH1 ARG 76 7.706 -19.040 -6.146 633 HH21 ARG 76 1HH2 ARG 76 7.316 -15.553 -6.272 634 HH22 ARG 76 2HH2 ARG 76 8.254 -16.913 -6.812 635 H VAL 77 H VAL 77 4.916 -14.481 -0.105 636 HA VAL 77 HA VAL 77 2.752 -12.641 0.264 637 HB VAL 77 HB VAL 77 5.096 -13.192 2.099 638 HG11 VAL 77 1HG1 VAL 77 3.909 -11.135 2.645 639 HG12 VAL 77 2HG1 VAL 77 3.624 -12.375 3.868 640 HG13 VAL 77 3HG1 VAL 77 2.381 -12.014 2.668 641 HG21 VAL 77 3HG2 VAL 77 2.374 -14.488 2.003 642 HG22 VAL 77 1HG2 VAL 77 3.604 -14.770 3.236 643 HG23 VAL 77 2HG2 VAL 77 3.903 -15.248 1.565 644 H ILE 78 H ILE 78 6.268 -12.332 -0.059 645 HA ILE 78 HA ILE 78 6.395 -9.532 0.290 646 HB ILE 78 HB ILE 78 8.208 -11.369 -1.285 647 HG12 ILE 78 2HG1 ILE 78 8.481 -10.175 1.482 648 HG13 ILE 78 1HG1 ILE 78 8.058 -11.848 1.130 649 HG21 ILE 78 1HG2 ILE 78 9.867 -9.549 -1.144 650 HG22 ILE 78 2HG2 ILE 78 8.631 -8.501 -0.448 651 HG23 ILE 78 3HG2 ILE 78 8.455 -9.099 -2.099 652 HD11 ILE 78 3HD1 ILE 78 10.385 -11.654 1.750 653 HD12 ILE 78 1HD1 ILE 78 10.654 -10.493 0.452 654 HD13 ILE 78 2HD1 ILE 78 10.236 -12.163 0.068 655 H GLU 79 H GLU 79 6.073 -11.579 -2.579 656 HA GLU 79 HA GLU 79 5.887 -9.513 -4.482 657 HB2 GLU 79 2HB GLU 79 4.560 -12.226 -4.560 658 HB3 GLU 79 1HB GLU 79 4.875 -11.181 -5.939 659 HG2 GLU 79 2HG GLU 79 7.225 -11.498 -5.735 660 HG3 GLU 79 1HG GLU 79 7.035 -12.329 -4.191 661 H LEU 80 H LEU 80 3.510 -11.104 -2.445 662 HA LEU 80 HA LEU 80 1.158 -10.025 -3.447 663 HB2 LEU 80 2HB LEU 80 1.315 -11.787 -1.725 664 HB3 LEU 80 1HB LEU 80 1.901 -10.609 -0.574 665 HG LEU 80 HG LEU 80 -0.762 -10.124 -1.805 666 HD11 LEU 80 1HD1 LEU 80 -1.831 -11.565 -0.137 667 HD12 LEU 80 2HD1 LEU 80 -0.247 -12.148 0.373 668 HD13 LEU 80 3HD1 LEU 80 -0.836 -12.502 -1.251 669 HD21 LEU 80 3HD2 LEU 80 0.371 -9.775 0.967 670 HD22 LEU 80 1HD2 LEU 80 -1.234 -9.269 0.439 671 HD23 LEU 80 2HD2 LEU 80 0.202 -8.511 -0.252 672 H ASN 81 H ASN 81 3.320 -8.711 -0.936 673 HA ASN 81 HA ASN 81 1.944 -6.256 -0.635 674 HB2 ASN 81 2HB ASN 81 4.824 -6.998 -0.060 675 HB3 ASN 81 1HB ASN 81 4.110 -5.448 0.376 676 HD21 ASN 81 1HD2 ASN 81 5.244 -7.409 2.143 677 HD22 ASN 81 2HD2 ASN 81 3.967 -7.911 3.199 678 H TYR 82 H TYR 82 4.573 -7.288 -2.714 679 HA TYR 82 HA TYR 82 5.328 -4.831 -3.804 680 HB2 TYR 82 2HB TYR 82 6.167 -7.388 -4.077 681 HB3 TYR 82 1HB TYR 82 5.315 -7.191 -5.602 682 HD1 TYR 82 HD2 TYR 82 5.936 -4.903 -6.860 683 HD2 TYR 82 HD1 TYR 82 8.398 -6.905 -4.036 684 HE1 TYR 82 HE2 TYR 82 7.913 -3.798 -7.817 685 HE2 TYR 82 HE1 TYR 82 10.383 -5.812 -4.978 686 HH TYR 82 HH TYR 82 11.037 -4.781 -7.246 687 H LYS 83 H LYS 83 2.966 -7.207 -4.958 688 HA LYS 83 HA LYS 83 2.217 -5.747 -7.279 689 HB2 LYS 83 2HB LYS 83 0.701 -7.937 -5.840 690 HB3 LYS 83 1HB LYS 83 0.425 -7.402 -7.492 691 HG2 LYS 83 2HG LYS 83 2.437 -8.334 -8.252 692 HG3 LYS 83 1HG LYS 83 3.079 -8.496 -6.616 693 HD2 LYS 83 2HD LYS 83 2.443 -10.653 -6.910 694 HD3 LYS 83 1HD LYS 83 0.889 -10.019 -6.372 695 HE2 LYS 83 2HE LYS 83 0.474 -11.349 -8.297 696 HE3 LYS 83 1HE LYS 83 0.310 -9.665 -8.791 697 HZ1 LYS 83 3HZ LYS 83 1.633 -11.213 -10.299 698 HZ2 LYS 83 1HZ LYS 83 2.855 -11.136 -9.129 699 HZ3 LYS 83 2HZ LYS 83 2.340 -9.726 -9.918 700 H HIS 84 H HIS 84 1.188 -5.621 -3.961 701 HA HIS 84 HA HIS 84 -1.268 -4.218 -4.657 702 HB2 HIS 84 2HB HIS 84 -0.098 -5.083 -2.020 703 HB3 HIS 84 1HB HIS 84 -1.532 -4.067 -2.130 704 HD1 HIS 84 HD1 HIS 84 -1.300 -7.081 -1.015 705 HD2 HIS 84 HD2 HIS 84 -2.891 -5.846 -4.656 706 HE1 HIS 84 HE1 HIS 84 -2.905 -8.899 -1.710 707 HE2 HIS 84 HE2 HIS 84 -3.825 -8.153 -3.943 708 H LEU 85 H LEU 85 1.873 -3.475 -3.207 709 HA LEU 85 HA LEU 85 0.967 -0.788 -2.569 710 HB2 LEU 85 2HB LEU 85 3.611 -2.148 -2.065 711 HB3 LEU 85 1HB LEU 85 3.182 -0.544 -1.502 712 HG LEU 85 HG LEU 85 1.798 -3.103 -0.691 713 HD11 LEU 85 1HD1 LEU 85 2.824 -2.717 1.487 714 HD12 LEU 85 2HD1 LEU 85 3.685 -1.322 0.839 715 HD13 LEU 85 3HD1 LEU 85 4.043 -2.939 0.233 716 HD21 LEU 85 3HD2 LEU 85 0.283 -1.194 -0.704 717 HD22 LEU 85 1HD2 LEU 85 1.426 -0.269 0.271 718 HD23 LEU 85 2HD2 LEU 85 0.644 -1.699 0.947 719 H LEU 86 H LEU 86 3.398 -2.323 -4.676 720 HA LEU 86 HA LEU 86 3.889 0.295 -5.884 721 HB2 LEU 86 2HB LEU 86 5.267 -2.362 -6.246 722 HB3 LEU 86 1HB LEU 86 5.654 -0.936 -7.191 723 HG LEU 86 HG LEU 86 5.999 -1.269 -4.210 724 HD11 LEU 86 1HD1 LEU 86 7.972 -0.926 -6.461 725 HD12 LEU 86 2HD1 LEU 86 7.722 -2.378 -5.489 726 HD13 LEU 86 3HD1 LEU 86 8.379 -0.920 -4.745 727 HD21 LEU 86 3HD2 LEU 86 6.493 1.147 -5.943 728 HD22 LEU 86 1HD2 LEU 86 6.981 0.980 -4.257 729 HD23 LEU 86 2HD2 LEU 86 5.269 0.995 -4.684 730 H GLY 87 H GLY 87 2.218 -2.654 -6.430 731 HA2 GLY 87 2HA GLY 87 0.431 -2.884 -7.906 732 HA3 GLY 87 1HA GLY 87 0.963 -1.432 -8.740 733 H ARG 88 H ARG 88 3.392 -3.806 -8.201 734 HA ARG 88 HA ARG 88 2.796 -5.314 -10.568 735 HB2 ARG 88 2HB ARG 88 4.895 -4.809 -11.762 736 HB3 ARG 88 1HB ARG 88 3.811 -3.435 -11.683 737 HG2 ARG 88 2HG ARG 88 6.015 -3.711 -9.684 738 HG3 ARG 88 1HG ARG 88 6.357 -3.112 -11.308 739 HD2 ARG 88 2HD ARG 88 4.275 -1.560 -10.762 740 HD3 ARG 88 1HD ARG 88 4.792 -1.875 -9.105 741 HE ARG 88 HE ARG 88 7.092 -1.139 -10.330 742 HH11 ARG 88 1HH1 ARG 88 3.919 0.327 -10.044 743 HH12 ARG 88 2HH1 ARG 88 4.494 1.937 -10.331 744 HH21 ARG 88 1HH2 ARG 88 7.861 1.001 -10.642 745 HH22 ARG 88 2HH2 ARG 88 6.731 2.317 -10.660 746 H ALA 89 H ALA 89 4.857 -6.746 -11.079 747 HA ALA 89 HA ALA 89 5.453 -8.063 -8.551 748 HB1 ALA 89 3HB ALA 89 6.006 -8.934 -11.390 749 HB2 ALA 89 1HB ALA 89 4.608 -9.405 -10.427 750 HB3 ALA 89 2HB ALA 89 6.224 -9.919 -9.943 751 HA PRO 90 HA PRO 90 9.670 -6.765 -8.101 752 HB2 PRO 90 2HB PRO 90 10.415 -9.649 -8.108 753 HB3 PRO 90 1HB PRO 90 10.802 -8.389 -6.931 754 HG2 PRO 90 2HG PRO 90 8.947 -10.227 -6.399 755 HG3 PRO 90 1HG PRO 90 8.737 -8.542 -5.890 756 HD2 PRO 90 2HD PRO 90 7.453 -10.018 -8.142 757 HD3 PRO 90 1HD PRO 90 6.783 -8.756 -7.089 758 H TYR 91 H TYR 91 11.398 -6.328 -9.406 759 HA TYR 91 HA TYR 91 11.096 -7.122 -12.166 760 HB2 TYR 91 2HB TYR 91 13.252 -5.418 -10.894 761 HB3 TYR 91 1HB TYR 91 12.889 -5.535 -12.613 762 HD1 TYR 91 HD1 TYR 91 10.434 -4.888 -13.295 763 HD2 TYR 91 HD2 TYR 91 12.301 -3.703 -9.657 764 HE1 TYR 91 HE1 TYR 91 8.830 -3.036 -13.080 765 HE2 TYR 91 HE2 TYR 91 10.697 -1.854 -9.429 766 HH TYR 91 HH TYR 91 9.263 -0.469 -10.973 767 H ASP 92 H ASP 92 13.226 -7.779 -9.488 768 HA ASP 92 HA ASP 92 14.211 -10.129 -10.898 769 HB2 ASP 92 2HB ASP 92 15.838 -8.167 -11.226 770 HB3 ASP 92 1HB ASP 92 16.171 -8.306 -9.502 771 H GLU 93 H GLU 93 15.231 -11.672 -9.367 772 HA GLU 93 HA GLU 93 13.704 -11.704 -6.943 773 HB2 GLU 93 2HB GLU 93 14.722 -13.878 -6.523 774 HB3 GLU 93 1HB GLU 93 14.103 -13.777 -8.164 775 HG2 GLU 93 2HG GLU 93 16.360 -13.405 -9.000 776 HG3 GLU 93 1HG GLU 93 16.986 -13.490 -7.351 777 H SER 94 H SER 94 16.695 -10.415 -7.829 778 HA SER 94 HA SER 94 18.135 -10.506 -5.432 779 HB2 SER 94 2HB SER 94 19.132 -8.347 -6.245 780 HB3 SER 94 1HB SER 94 19.141 -9.636 -7.450 781 HG SER 94 HG SER 94 18.374 -7.842 -8.477 782 H GLU 95 H GLU 95 15.530 -8.380 -6.519 783 HA GLU 95 HA GLU 95 15.462 -6.689 -4.256 784 HB2 GLU 95 2HB GLU 95 13.118 -7.500 -5.984 785 HB3 GLU 95 1HB GLU 95 13.238 -6.065 -4.981 786 HG2 GLU 95 2HG GLU 95 15.134 -5.315 -6.429 787 HG3 GLU 95 1HG GLU 95 14.764 -6.669 -7.499 788 H VAL 96 H VAL 96 13.927 -9.747 -5.043 789 HA VAL 96 HA VAL 96 12.280 -9.985 -2.787 790 HB VAL 96 HB VAL 96 13.614 -12.198 -4.360 791 HG11 VAL 96 1HG1 VAL 96 11.790 -13.605 -3.546 792 HG12 VAL 96 2HG1 VAL 96 11.189 -12.264 -2.571 793 HG13 VAL 96 3HG1 VAL 96 12.762 -12.976 -2.215 794 HG21 VAL 96 3HG2 VAL 96 11.527 -12.290 -5.627 795 HG22 VAL 96 1HG2 VAL 96 12.299 -10.712 -5.781 796 HG23 VAL 96 2HG2 VAL 96 10.907 -10.914 -4.715 797 H ILE 97 H ILE 97 15.613 -11.064 -3.376 798 HA ILE 97 HA ILE 97 16.112 -12.305 -0.936 799 HB ILE 97 HB ILE 97 18.028 -10.731 -2.662 800 HG12 ILE 97 2HG1 ILE 97 17.429 -13.693 -2.533 801 HG13 ILE 97 1HG1 ILE 97 16.906 -12.600 -3.811 802 HG21 ILE 97 1HG2 ILE 97 18.956 -10.999 -0.443 803 HG22 ILE 97 2HG2 ILE 97 19.791 -12.071 -1.568 804 HG23 ILE 97 3HG2 ILE 97 18.578 -12.721 -0.464 805 HD11 ILE 97 3HD1 ILE 97 19.241 -12.194 -4.403 806 HD12 ILE 97 1HD1 ILE 97 18.823 -13.904 -4.506 807 HD13 ILE 97 2HD1 ILE 97 19.749 -13.303 -3.130 808 H PHE 98 H PHE 98 16.535 -8.897 -1.854 809 HA PHE 98 HA PHE 98 17.488 -7.931 0.587 810 HB2 PHE 98 2HB PHE 98 17.590 -6.519 -1.341 811 HB3 PHE 98 1HB PHE 98 15.848 -6.604 -1.579 812 HD1 PHE 98 HD2 PHE 98 18.347 -5.510 0.961 813 HD2 PHE 98 HD1 PHE 98 14.552 -4.846 -0.845 814 HE1 PHE 98 HE2 PHE 98 18.072 -3.464 2.298 815 HE2 PHE 98 HE1 PHE 98 14.270 -2.799 0.490 816 HZ PHE 98 HZ PHE 98 16.033 -2.108 2.068 817 H HIS 99 H HIS 99 14.167 -8.383 -0.557 818 HA HIS 99 HA HIS 99 13.000 -7.195 1.760 819 HB2 HIS 99 2HB HIS 99 11.898 -8.759 -0.551 820 HB3 HIS 99 1HB HIS 99 10.885 -8.383 0.841 821 HD1 HIS 99 HD1 HIS 99 9.992 -6.051 1.054 822 HD2 HIS 99 HD2 HIS 99 12.762 -6.449 -2.030 823 HE1 HIS 99 HE1 HIS 99 9.920 -3.875 -0.220 824 HE2 HIS 99 HE2 HIS 99 11.485 -4.202 -2.175 825 H LEU 100 H LEU 100 13.777 -10.499 0.807 826 HA LEU 100 HA LEU 100 12.539 -11.847 2.933 827 HB2 LEU 100 2HB LEU 100 15.064 -12.457 1.398 828 HB3 LEU 100 1HB LEU 100 14.396 -13.544 2.597 829 HG LEU 100 HG LEU 100 12.886 -12.652 0.144 830 HD11 LEU 100 1HD1 LEU 100 13.444 -14.817 -0.814 831 HD12 LEU 100 2HD1 LEU 100 14.445 -15.198 0.589 832 HD13 LEU 100 3HD1 LEU 100 14.906 -13.884 -0.495 833 HD21 LEU 100 3HD2 LEU 100 11.454 -14.553 0.665 834 HD22 LEU 100 1HD2 LEU 100 11.504 -13.422 2.015 835 HD23 LEU 100 2HD2 LEU 100 12.433 -14.921 2.084 836 H ASP 101 H ASP 101 15.814 -10.538 2.634 837 HA ASP 101 HA ASP 101 16.757 -11.104 5.195 838 HB2 ASP 101 2HB ASP 101 18.259 -10.339 3.480 839 HB3 ASP 101 1HB ASP 101 17.388 -8.821 3.315 840 H LEU 102 H LEU 102 15.126 -8.205 3.990 841 HA LEU 102 HA LEU 102 15.053 -6.745 6.374 842 HB2 LEU 102 2HB LEU 102 14.583 -5.852 4.115 843 HB3 LEU 102 1HB LEU 102 13.082 -6.751 4.083 844 HG LEU 102 HG LEU 102 12.262 -5.401 5.990 845 HD11 LEU 102 1HD1 LEU 102 14.810 -3.848 5.563 846 HD12 LEU 102 2HD1 LEU 102 14.407 -4.819 6.981 847 HD13 LEU 102 3HD1 LEU 102 13.472 -3.370 6.608 848 HD21 LEU 102 3HD2 LEU 102 11.720 -4.781 3.690 849 HD22 LEU 102 1HD2 LEU 102 13.184 -3.800 3.606 850 HD23 LEU 102 2HD2 LEU 102 11.886 -3.355 4.715 851 H TYR 103 H TYR 103 12.738 -9.022 4.984 852 HA TYR 103 HA TYR 103 10.726 -8.712 6.929 853 HB2 TYR 103 2HB TYR 103 10.126 -9.609 4.814 854 HB3 TYR 103 1HB TYR 103 11.342 -10.874 4.919 855 HD1 TYR 103 HD1 TYR 103 8.188 -9.702 6.520 856 HD2 TYR 103 HD2 TYR 103 10.764 -12.983 5.686 857 HE1 TYR 103 HE1 TYR 103 6.497 -11.251 7.411 858 HE2 TYR 103 HE2 TYR 103 9.086 -14.541 6.576 859 HH TYR 103 HH TYR 103 7.197 -14.542 8.080 860 H GLU 104 H GLU 104 13.493 -10.925 6.745 861 HA GLU 104 HA GLU 104 12.533 -12.432 9.007 862 HB2 GLU 104 2HB GLU 104 15.162 -12.567 7.534 863 HB3 GLU 104 1HB GLU 104 14.677 -13.666 8.819 864 HG2 GLU 104 2HG GLU 104 12.653 -14.209 7.391 865 HG3 GLU 104 1HG GLU 104 13.479 -13.361 6.085 866 H ASN 105 H ASN 105 14.881 -9.861 8.479 867 HA ASN 105 HA ASN 105 15.950 -10.120 11.152 868 HB2 ASN 105 2HB ASN 105 16.440 -8.195 8.903 869 HB3 ASN 105 1HB ASN 105 17.027 -7.835 10.523 870 HD21 ASN 105 1HD2 ASN 105 17.425 -9.747 7.698 871 HD22 ASN 105 2HD2 ASN 105 18.887 -10.537 8.181 872 H GLU 106 H GLU 106 14.106 -7.553 9.476 873 HA GLU 106 HA GLU 106 13.582 -6.364 12.089 874 HB2 GLU 106 2HB GLU 106 13.097 -5.302 9.303 875 HB3 GLU 106 1HB GLU 106 12.753 -4.420 10.786 876 HG2 GLU 106 2HG GLU 106 15.159 -4.626 11.387 877 HG3 GLU 106 1HG GLU 106 15.444 -5.330 9.799 878 H GLY 107 H GLY 107 11.881 -7.845 9.392 879 HA2 GLY 107 2HA GLY 107 9.981 -9.235 10.122 880 HA3 GLY 107 1HA GLY 107 9.492 -7.883 11.131 881 H PHE 108 H PHE 108 7.569 -8.788 9.647 882 HA PHE 108 HA PHE 108 7.360 -7.847 7.006 883 HB2 PHE 108 2HB PHE 108 4.894 -8.125 7.344 884 HB3 PHE 108 1HB PHE 108 5.843 -9.543 7.775 885 HD1 PHE 108 HD2 PHE 108 6.077 -10.224 10.103 886 HD2 PHE 108 HD1 PHE 108 3.705 -6.859 9.019 887 HE1 PHE 108 HE2 PHE 108 5.023 -10.256 12.325 888 HE2 PHE 108 HE1 PHE 108 2.647 -6.890 11.240 889 HZ PHE 108 HZ PHE 108 3.307 -8.588 12.894 890 H ASP 109 H ASP 109 7.014 -6.289 10.059 891 HA ASP 109 HA ASP 109 5.508 -4.040 9.436 892 HB2 ASP 109 2HB ASP 109 6.141 -4.438 11.715 893 HB3 ASP 109 1HB ASP 109 7.854 -4.410 11.307 894 H ALA 110 H ALA 110 8.997 -4.569 9.096 895 HA ALA 110 HA ALA 110 9.461 -1.973 7.985 896 HB1 ALA 110 3HB ALA 110 11.183 -3.107 9.292 897 HB2 ALA 110 1HB ALA 110 11.754 -2.741 7.664 898 HB3 ALA 110 2HB ALA 110 11.267 -4.384 8.077 899 H ASP 111 H ASP 111 8.991 -5.223 6.708 900 HA ASP 111 HA ASP 111 9.831 -4.763 4.078 901 HB2 ASP 111 2HB ASP 111 9.391 -7.026 4.834 902 HB3 ASP 111 1HB ASP 111 7.688 -6.647 5.090 903 H ILE 112 H ILE 112 6.501 -4.721 5.351 904 HA ILE 112 HA ILE 112 5.316 -3.715 3.013 905 HB ILE 112 HB ILE 112 4.357 -3.367 5.860 906 HG12 ILE 112 2HG1 ILE 112 3.718 -5.553 3.864 907 HG13 ILE 112 1HG1 ILE 112 4.795 -5.730 5.246 908 HG21 ILE 112 1HG2 ILE 112 3.188 -1.892 4.346 909 HG22 ILE 112 2HG2 ILE 112 2.120 -3.207 4.833 910 HG23 ILE 112 3HG2 ILE 112 2.872 -3.228 3.238 911 HD11 ILE 112 3HD1 ILE 112 2.611 -6.672 5.708 912 HD12 ILE 112 1HD1 ILE 112 1.852 -5.117 5.366 913 HD13 ILE 112 2HD1 ILE 112 2.929 -5.287 6.751 914 H ASP 113 H ASP 113 6.775 -2.114 5.779 915 HA ASP 113 HA ASP 113 5.755 0.476 5.260 916 HB2 ASP 113 2HB ASP 113 6.946 -0.597 7.375 917 HB3 ASP 113 1HB ASP 113 8.374 0.121 6.639 918 H SER 114 H SER 114 8.596 -1.250 4.120 919 HA SER 114 HA SER 114 10.169 0.913 3.339 920 HB2 SER 114 2HB SER 114 11.405 -0.644 1.954 921 HB3 SER 114 1HB SER 114 10.956 -1.440 3.462 922 HG SER 114 HG SER 114 9.340 -2.549 2.380 923 H TYR 115 H TYR 115 7.599 -0.758 1.570 924 HA TYR 115 HA TYR 115 8.000 0.495 -0.930 925 HB2 TYR 115 2HB TYR 115 5.444 -0.576 0.282 926 HB3 TYR 115 1HB TYR 115 5.662 -0.161 -1.410 927 HD1 TYR 115 HD1 TYR 115 7.017 -1.588 -2.869 928 HD2 TYR 115 HD2 TYR 115 6.315 -2.621 1.194 929 HE1 TYR 115 HE1 TYR 115 7.706 -3.899 -3.346 930 HE2 TYR 115 HE2 TYR 115 7.003 -4.935 0.733 931 HH TYR 115 HH TYR 115 7.173 -6.466 -1.160 932 H ILE 116 H ILE 116 6.292 1.428 1.959 933 HA ILE 116 HA ILE 116 4.809 3.528 0.597 934 HB ILE 116 HB ILE 116 4.725 2.712 3.508 935 HG12 ILE 116 2HG1 ILE 116 2.903 1.825 1.262 936 HG13 ILE 116 1HG1 ILE 116 4.227 0.852 1.892 937 HG21 ILE 116 1HG2 ILE 116 3.770 4.909 3.088 938 HG22 ILE 116 2HG2 ILE 116 2.500 3.749 3.477 939 HG23 ILE 116 3HG2 ILE 116 2.761 4.244 1.805 940 HD11 ILE 116 3HD1 ILE 116 1.840 1.789 3.461 941 HD12 ILE 116 1HD1 ILE 116 3.155 0.787 4.070 942 HD13 ILE 116 2HD1 ILE 116 2.085 0.167 2.813 943 H ASP 117 H ASP 117 7.694 3.166 2.328 944 HA ASP 117 HA ASP 117 7.759 5.727 3.601 945 HB2 ASP 117 2HB ASP 117 9.034 3.800 4.462 946 HB3 ASP 117 1HB ASP 117 10.014 3.797 3.001 947 H SER 118 H SER 118 8.289 4.671 0.412 948 HA SER 118 HA SER 118 10.078 6.879 -0.241 949 HB2 SER 118 2HB SER 118 10.534 4.688 -1.261 950 HB3 SER 118 1HB SER 118 8.937 4.700 -2.007 951 HG SER 118 HG SER 118 11.188 6.316 -2.577 952 HA PRO 119 HA PRO 119 6.383 9.260 -1.298 953 HB2 PRO 119 2HB PRO 119 7.663 11.626 -1.575 954 HB3 PRO 119 1HB PRO 119 7.252 10.949 0.005 955 HG2 PRO 119 2HG PRO 119 9.864 10.918 -1.451 956 HG3 PRO 119 1HG PRO 119 9.544 11.210 0.269 957 HD2 PRO 119 2HD PRO 119 10.412 8.816 -0.705 958 HD3 PRO 119 1HD PRO 119 9.409 8.969 0.752 959 H GLU 120 H GLU 120 9.409 8.963 -2.994 960 HA GLU 120 HA GLU 120 8.806 10.320 -5.365 961 HB2 GLU 120 2HB GLU 120 11.064 9.493 -4.714 962 HB3 GLU 120 1HB GLU 120 10.527 7.851 -5.035 963 HG2 GLU 120 2HG GLU 120 11.800 8.616 -6.899 964 HG3 GLU 120 1HG GLU 120 10.109 8.507 -7.390 965 H TYR 121 H TYR 121 8.498 6.861 -4.574 966 HA TYR 121 HA TYR 121 7.164 6.251 -7.021 967 HB2 TYR 121 2HB TYR 121 7.577 4.670 -4.485 968 HB3 TYR 121 1HB TYR 121 6.699 4.034 -5.874 969 HD1 TYR 121 HD2 TYR 121 7.874 3.669 -8.019 970 HD2 TYR 121 HD1 TYR 121 9.967 4.823 -4.503 971 HE1 TYR 121 HE2 TYR 121 9.993 2.988 -9.063 972 HE2 TYR 121 HE1 TYR 121 12.091 4.147 -5.536 973 HH TYR 121 HH TYR 121 12.875 2.627 -7.318 974 H THR 122 H THR 122 6.108 7.028 -3.762 975 HA THR 122 HA THR 122 3.405 6.374 -3.984 976 HB THR 122 HB THR 122 4.640 8.703 -2.496 977 HG1 THR 122 HG1 THR 122 5.443 6.691 -1.779 978 HG21 THR 122 3HG2 THR 122 2.618 8.622 -1.101 979 HG22 THR 122 1HG2 THR 122 1.942 7.388 -2.165 980 HG23 THR 122 2HG2 THR 122 2.239 9.015 -2.778 981 H ASN 123 H ASN 123 4.978 9.515 -4.596 982 HA ASN 123 HA ASN 123 2.662 10.779 -5.606 983 HB2 ASN 123 2HB ASN 123 4.689 11.943 -4.710 984 HB3 ASN 123 1HB ASN 123 5.553 11.479 -6.170 985 HD21 ASN 123 1HD2 ASN 123 2.194 12.558 -5.912 986 HD22 ASN 123 2HD2 ASN 123 2.417 13.996 -6.856 987 H SER 124 H SER 124 5.011 8.689 -7.055 988 HA SER 124 HA SER 124 4.496 9.504 -9.763 989 HB2 SER 124 2HB SER 124 6.689 8.622 -9.085 990 HB3 SER 124 1HB SER 124 5.949 7.069 -8.700 991 HG SER 124 HG SER 124 5.192 7.362 -11.077 992 H PHE 125 H PHE 125 2.924 7.386 -7.567 993 HA PHE 125 HA PHE 125 1.660 5.983 -9.829 994 HB2 PHE 125 2HB PHE 125 3.030 4.614 -8.180 995 HB3 PHE 125 1HB PHE 125 1.778 4.960 -6.995 996 HD1 PHE 125 HD1 PHE 125 0.777 4.536 -10.454 997 HD2 PHE 125 HD2 PHE 125 1.428 2.538 -6.758 998 HE1 PHE 125 HE1 PHE 125 -0.502 2.603 -11.278 999 HE2 PHE 125 HE2 PHE 125 0.147 0.605 -7.573 1000 HZ PHE 125 HZ PHE 125 -0.821 0.636 -9.835 1001 H GLY 126 H GLY 126 1.058 7.534 -6.697 1002 HA2 GLY 126 2HA GLY 126 -1.166 8.914 -7.287 1003 HA3 GLY 126 1HA GLY 126 -1.814 7.297 -7.059 1004 H ASP 127 H ASP 127 -0.735 10.149 -5.564 1005 HA ASP 127 HA ASP 127 -0.233 9.217 -2.946 1006 HB2 ASP 127 2HB ASP 127 -1.296 11.919 -3.812 1007 HB3 ASP 127 1HB ASP 127 -0.562 11.551 -2.255 1008 H TRP 128 H TRP 128 -3.148 10.110 -4.651 1009 HA TRP 128 HA TRP 128 -4.745 9.291 -2.318 1010 HB2 TRP 128 2HB TRP 128 -5.411 11.345 -4.441 1011 HB3 TRP 128 1HB TRP 128 -6.526 10.801 -3.192 1012 HD1 TRP 128 HD1 TRP 128 -3.482 13.035 -3.727 1013 HE1 TRP 128 HE1 TRP 128 -3.140 14.497 -1.635 1014 HE3 TRP 128 HE3 TRP 128 -6.913 10.840 -0.627 1015 HZ2 TRP 128 HZ2 TRP 128 -4.187 14.694 0.977 1016 HZ3 TRP 128 HZ3 TRP 128 -7.182 11.732 1.650 1017 HH2 TRP 128 HH2 TRP 128 -5.848 13.617 2.434 1018 H VAL 129 H VAL 129 -3.641 7.687 -4.531 1019 HA VAL 129 HA VAL 129 -6.162 6.807 -5.772 1020 HB VAL 129 HB VAL 129 -3.403 6.682 -7.011 1021 HG11 VAL 129 1HG1 VAL 129 -4.580 5.941 -9.034 1022 HG12 VAL 129 2HG1 VAL 129 -6.094 5.914 -8.129 1023 HG13 VAL 129 3HG1 VAL 129 -4.789 4.812 -7.694 1024 HG21 VAL 129 3HG2 VAL 129 -4.259 8.330 -8.620 1025 HG22 VAL 129 1HG2 VAL 129 -4.239 8.968 -6.976 1026 HG23 VAL 129 2HG2 VAL 129 -5.759 8.440 -7.700 1027 H VAL 130 H VAL 130 -6.644 4.685 -5.624 1028 HA VAL 130 HA VAL 130 -5.010 2.964 -3.986 1029 HB VAL 130 HB VAL 130 -7.530 2.325 -5.537 1030 HG11 VAL 130 1HG1 VAL 130 -7.718 0.409 -4.015 1031 HG12 VAL 130 2HG1 VAL 130 -6.164 0.836 -3.297 1032 HG13 VAL 130 3HG1 VAL 130 -6.247 0.331 -4.985 1033 HG21 VAL 130 3HG2 VAL 130 -7.925 4.082 -3.902 1034 HG22 VAL 130 1HG2 VAL 130 -7.170 3.104 -2.645 1035 HG23 VAL 130 2HG2 VAL 130 -8.684 2.576 -3.380 1036 HA PRO 131 HA PRO 131 -2.412 1.700 -7.354 1037 HB2 PRO 131 2HB PRO 131 -1.984 -0.623 -5.542 1038 HB3 PRO 131 1HB PRO 131 -0.800 0.430 -6.324 1039 HG2 PRO 131 2HG PRO 131 -1.317 0.691 -3.732 1040 HG3 PRO 131 1HG PRO 131 -1.076 2.123 -4.753 1041 HD2 PRO 131 2HD PRO 131 -3.615 0.950 -3.695 1042 HD3 PRO 131 1HD PRO 131 -3.149 2.654 -3.877 1043 H TYR 132 H TYR 132 -2.615 0.440 -9.093 1044 HA TYR 132 HA TYR 132 -4.336 -1.943 -8.947 1045 HB2 TYR 132 2HB TYR 132 -5.021 -1.504 -11.277 1046 HB3 TYR 132 1HB TYR 132 -5.486 -0.180 -10.215 1047 HD1 TYR 132 HD1 TYR 132 -3.047 -1.228 -12.789 1048 HD2 TYR 132 HD2 TYR 132 -4.685 2.032 -10.604 1049 HE1 TYR 132 HE1 TYR 132 -1.902 0.336 -14.292 1050 HE2 TYR 132 HE2 TYR 132 -3.546 3.614 -12.105 1051 HH TYR 132 HH TYR 132 -1.641 3.674 -13.612 1052 H TYR 133 H TYR 133 -3.794 -3.406 -10.981 1053 HA TYR 133 HA TYR 133 -0.968 -3.920 -10.696 1054 HB2 TYR 133 2HB TYR 133 -2.867 -5.682 -10.772 1055 HB3 TYR 133 1HB TYR 133 -2.760 -5.490 -12.521 1056 HD1 TYR 133 HD2 TYR 133 -0.006 -5.382 -10.044 1057 HD2 TYR 133 HD1 TYR 133 -1.834 -7.550 -13.219 1058 HE1 TYR 133 HE2 TYR 133 1.895 -6.935 -10.067 1059 HE2 TYR 133 HE1 TYR 133 0.070 -9.110 -13.250 1060 HH TYR 133 HH TYR 133 2.432 -9.162 -12.582 1061 H ARG 134 H ARG 134 0.575 -3.501 -12.033 1062 HA ARG 134 HA ARG 134 1.781 -2.721 -13.750 1063 HB2 ARG 134 2HB ARG 134 0.550 -4.434 -15.113 1064 HB3 ARG 134 1HB ARG 134 -0.591 -3.168 -15.558 1065 HG2 ARG 134 2HG ARG 134 1.270 -1.868 -16.521 1066 HG3 ARG 134 1HG ARG 134 2.365 -3.195 -16.136 1067 HD2 ARG 134 2HD ARG 134 1.018 -4.679 -17.576 1068 HD3 ARG 134 1HD ARG 134 0.002 -3.301 -18.002 1069 HE ARG 134 HE ARG 134 2.896 -3.210 -18.528 1070 HH11 ARG 134 1HH1 ARG 134 -0.411 -3.204 -19.718 1071 HH12 ARG 134 2HH1 ARG 134 0.046 -2.731 -21.334 1072 HH21 ARG 134 1HH2 ARG 134 3.480 -2.588 -20.637 1073 HH22 ARG 134 2HH2 ARG 134 2.257 -2.394 -21.857 1074 H GLY 135 H GLY 135 1.449 -0.797 -12.410 1075 HA2 GLY 135 2HA GLY 135 0.142 1.304 -14.020 1076 HA3 GLY 135 1HA GLY 135 0.274 1.366 -12.270 1077 H LEU 136 H LEU 136 2.179 1.313 -15.239 1078 HA LEU 136 HA LEU 136 4.051 2.392 -15.880 1079 HB2 LEU 136 2HB LEU 136 3.227 4.188 -13.616 1080 HB3 LEU 136 1HB LEU 136 4.619 4.529 -14.631 1081 HG LEU 136 HG LEU 136 1.906 4.082 -15.826 1082 HD11 LEU 136 1HD1 LEU 136 1.587 6.515 -15.806 1083 HD12 LEU 136 2HD1 LEU 136 3.051 6.695 -14.839 1084 HD13 LEU 136 3HD1 LEU 136 1.650 5.856 -14.172 1085 HD21 LEU 136 3HD2 LEU 136 3.792 4.009 -17.340 1086 HD22 LEU 136 1HD2 LEU 136 4.372 5.562 -16.732 1087 HD23 LEU 136 2HD2 LEU 136 2.851 5.473 -17.620 1088 H GLU 137 H GLU 137 5.527 0.846 -15.568 1089 HA GLU 137 HA GLU 137 6.868 0.515 -13.029 1090 HB2 GLU 137 2HB GLU 137 8.479 -0.765 -14.838 1091 HB3 GLU 137 1HB GLU 137 7.140 -1.506 -13.978 1092 HG2 GLU 137 2HG GLU 137 7.022 -2.057 -16.313 1093 HG3 GLU 137 1HG GLU 137 5.668 -1.020 -15.875 1094 H HIS 138 H HIS 138 7.309 2.247 -15.991 1095 HA HIS 138 HA HIS 138 9.567 3.672 -14.735 1096 HB2 HIS 138 2HB HIS 138 9.070 3.192 -17.690 1097 HB3 HIS 138 1HB HIS 138 10.323 4.246 -17.046 1098 HD1 HIS 138 HD1 HIS 138 9.455 0.641 -17.558 1099 HD2 HIS 138 HD2 HIS 138 12.564 2.919 -15.972 1100 HE1 HIS 138 HE1 HIS 138 11.380 -0.943 -17.255 1101 HE2 HIS 138 HE2 HIS 138 13.282 0.466 -16.402 1102 H HIS 139 H HIS 139 8.952 5.674 -14.149 1103 HA HIS 139 HA HIS 139 6.338 6.548 -14.613 1104 HB2 HIS 139 2HB HIS 139 6.885 8.564 -13.432 1105 HB3 HIS 139 1HB HIS 139 7.688 7.217 -12.648 1106 HD1 HIS 139 HD1 HIS 139 8.393 10.423 -12.748 1107 HD2 HIS 139 HD2 HIS 139 10.463 7.243 -14.457 1108 HE1 HIS 139 HE1 HIS 139 10.756 11.234 -13.047 1109 HE2 HIS 139 HE2 HIS 139 11.929 9.368 -14.275 1110 H HIS 140 H HIS 140 5.460 7.188 -16.355 1111 HA HIS 140 HA HIS 140 4.995 8.137 -18.329 1112 HB2 HIS 140 2HB HIS 140 7.028 10.107 -17.315 1113 HB3 HIS 140 1HB HIS 140 6.250 10.309 -18.884 1114 HD1 HIS 140 HD1 HIS 140 5.913 11.806 -15.853 1115 HD2 HIS 140 HD2 HIS 140 3.194 9.652 -18.152 1116 HE1 HIS 140 HE1 HIS 140 3.631 12.526 -15.066 1117 HE2 HIS 140 HE2 HIS 140 2.019 11.038 -16.321 1118 H HIS 141 H HIS 141 8.398 9.064 -18.612 1119 HA HIS 141 HA HIS 141 9.045 6.902 -20.359 1120 HB2 HIS 141 2HB HIS 141 9.239 8.210 -22.446 1121 HB3 HIS 141 1HB HIS 141 7.576 8.097 -21.891 1122 HD1 HIS 141 HD1 HIS 141 6.342 10.253 -21.481 1123 HD2 HIS 141 HD2 HIS 141 10.417 10.822 -22.101 1124 HE1 HIS 141 HE1 HIS 141 6.660 12.736 -21.712 1125 HE2 HIS 141 HE2 HIS 141 9.145 13.065 -21.928 1126 H HIS 142 H HIS 142 11.042 7.909 -21.863 1127 HA HIS 142 HA HIS 142 12.768 9.392 -19.999 1128 HB2 HIS 142 2HB HIS 142 14.652 7.944 -20.514 1129 HB3 HIS 142 1HB HIS 142 13.327 6.975 -19.886 1130 HD1 HIS 142 HD1 HIS 142 12.234 5.271 -21.489 1131 HD2 HIS 142 HD2 HIS 142 15.334 7.467 -23.185 1132 HE1 HIS 142 HE1 HIS 142 12.819 4.086 -23.632 1133 HE2 HIS 142 HE2 HIS 142 14.820 5.327 -24.541 1134 H HIS 143 H HIS 143 14.941 9.897 -21.379 1135 HA HIS 143 HA HIS 143 13.964 11.224 -23.808 1136 HB2 HIS 143 2HB HIS 143 15.177 12.551 -22.037 1137 HB3 HIS 143 1HB HIS 143 16.620 11.616 -22.417 1138 HD1 HIS 143 HD1 HIS 143 17.708 12.031 -24.778 1139 HD2 HIS 143 HD2 HIS 143 14.579 14.591 -23.806 1140 HE1 HIS 143 HE1 HIS 143 17.841 13.922 -26.429 1141 HE2 HIS 143 HE2 HIS 143 16.093 15.567 -25.664 Start of MODEL 19 1 H1 MET 1 1H MET 1 -12.195 4.413 -15.807 2 H2 MET 1 2H MET 1 -10.652 4.175 -16.466 3 H3 MET 1 3H MET 1 -11.612 5.464 -17.004 4 HA MET 1 HA MET 1 -9.910 6.278 -15.537 5 HB2 MET 1 2HB MET 1 -12.093 7.397 -15.500 6 HB3 MET 1 1HB MET 1 -12.666 6.269 -14.279 7 HG2 MET 1 2HG MET 1 -10.944 7.123 -12.731 8 HG3 MET 1 1HG MET 1 -10.468 8.302 -13.952 9 HE1 MET 1 3HE MET 1 -13.769 10.438 -14.264 10 HE2 MET 1 1HE MET 1 -13.318 9.018 -15.208 11 HE3 MET 1 2HE MET 1 -12.111 10.249 -14.834 12 HA PRO 2 HA PRO 2 -8.558 3.389 -12.397 13 HB2 PRO 2 2HB PRO 2 -7.006 5.680 -11.388 14 HB3 PRO 2 1HB PRO 2 -6.441 4.108 -11.963 15 HG2 PRO 2 2HG PRO 2 -6.071 6.351 -13.392 16 HG3 PRO 2 1HG PRO 2 -6.380 4.785 -14.168 17 HD2 PRO 2 2HD PRO 2 -8.244 7.078 -13.707 18 HD3 PRO 2 1HD PRO 2 -8.090 6.013 -15.120 19 H VAL 3 H VAL 3 -8.801 3.126 -10.132 20 HA VAL 3 HA VAL 3 -10.876 4.778 -8.985 21 HB VAL 3 HB VAL 3 -9.443 2.466 -7.671 22 HG11 VAL 3 1HG1 VAL 3 -10.697 3.881 -6.140 23 HG12 VAL 3 2HG1 VAL 3 -11.487 2.314 -6.324 24 HG13 VAL 3 3HG1 VAL 3 -12.134 3.730 -7.154 25 HG21 VAL 3 3HG2 VAL 3 -10.388 1.708 -9.783 26 HG22 VAL 3 1HG2 VAL 3 -11.947 2.415 -9.357 27 HG23 VAL 3 2HG2 VAL 3 -11.309 1.061 -8.425 28 H GLU 4 H GLU 4 -10.274 6.657 -8.153 29 HA GLU 4 HA GLU 4 -8.086 6.698 -6.219 30 HB2 GLU 4 2HB GLU 4 -7.289 8.868 -7.200 31 HB3 GLU 4 1HB GLU 4 -6.987 7.452 -8.196 32 HG2 GLU 4 2HG GLU 4 -8.943 8.018 -9.567 33 HG3 GLU 4 1HG GLU 4 -9.193 9.460 -8.585 34 H LEU 5 H LEU 5 -8.261 8.301 -4.639 35 HA LEU 5 HA LEU 5 -10.969 9.438 -4.428 36 HB2 LEU 5 2HB LEU 5 -10.205 7.818 -2.675 37 HB3 LEU 5 1HB LEU 5 -8.953 8.960 -2.233 38 HG LEU 5 HG LEU 5 -10.746 10.621 -1.690 39 HD11 LEU 5 1HD1 LEU 5 -13.022 9.795 -1.383 40 HD12 LEU 5 2HD1 LEU 5 -12.549 8.235 -2.055 41 HD13 LEU 5 3HD1 LEU 5 -12.519 9.678 -3.069 42 HD21 LEU 5 3HD2 LEU 5 -11.337 9.589 0.436 43 HD22 LEU 5 1HD2 LEU 5 -9.646 9.288 0.041 44 HD23 LEU 5 2HD2 LEU 5 -10.845 8.012 -0.180 45 H ARG 6 H ARG 6 -10.861 11.470 -5.267 46 HA ARG 6 HA ARG 6 -8.570 13.153 -4.912 47 HB2 ARG 6 2HB ARG 6 -11.309 13.534 -6.069 48 HB3 ARG 6 1HB ARG 6 -10.271 14.927 -5.780 49 HG2 ARG 6 2HG ARG 6 -8.608 14.092 -7.259 50 HG3 ARG 6 1HG ARG 6 -9.432 12.539 -7.398 51 HD2 ARG 6 2HD ARG 6 -10.688 15.132 -8.254 52 HD3 ARG 6 1HD ARG 6 -9.705 14.147 -9.336 53 HE ARG 6 HE ARG 6 -12.308 13.395 -8.195 54 HH11 ARG 6 1HH1 ARG 6 -9.648 12.764 -10.372 55 HH12 ARG 6 2HH1 ARG 6 -10.525 11.603 -11.326 56 HH21 ARG 6 1HH2 ARG 6 -13.479 11.865 -9.417 57 HH22 ARG 6 2HH2 ARG 6 -12.712 11.087 -10.773 58 H ALA 7 H ALA 7 -8.478 15.114 -3.737 59 HA ALA 7 HA ALA 7 -9.149 14.873 -1.070 60 HB1 ALA 7 3HB ALA 7 -7.388 16.346 -1.917 61 HB2 ALA 7 1HB ALA 7 -8.480 17.191 -0.821 62 HB3 ALA 7 2HB ALA 7 -8.616 17.434 -2.562 63 H ASN 8 H ASN 8 -10.880 16.697 -3.587 64 HA ASN 8 HA ASN 8 -13.070 17.110 -1.697 65 HB2 ASN 8 2HB ASN 8 -12.474 18.985 -3.196 66 HB3 ASN 8 1HB ASN 8 -12.857 17.978 -4.590 67 HD21 ASN 8 1HD2 ASN 8 -14.169 19.611 -1.793 68 HD22 ASN 8 2HD2 ASN 8 -15.817 19.641 -2.342 69 H TRP 9 H TRP 9 -13.806 15.049 -1.374 70 HA TRP 9 HA TRP 9 -14.858 13.669 -3.748 71 HB2 TRP 9 2HB TRP 9 -14.666 11.578 -2.372 72 HB3 TRP 9 1HB TRP 9 -13.128 12.338 -2.765 73 HD1 TRP 9 HD1 TRP 9 -11.663 13.245 -0.771 74 HE1 TRP 9 HE1 TRP 9 -11.809 12.973 1.781 75 HE3 TRP 9 HE3 TRP 9 -16.400 11.355 -0.409 76 HZ2 TRP 9 HZ2 TRP 9 -13.669 12.081 3.691 77 HZ3 TRP 9 HZ3 TRP 9 -17.286 10.817 1.821 78 HH2 TRP 9 HH2 TRP 9 -15.947 11.173 3.827 79 H SER 10 H SER 10 -16.811 12.455 -3.481 80 HA SER 10 HA SER 10 -18.519 13.424 -1.285 81 HB2 SER 10 2HB SER 10 -19.368 12.178 -3.915 82 HB3 SER 10 1HB SER 10 -20.417 12.935 -2.715 83 HG SER 10 HG SER 10 -18.487 14.654 -3.397 84 H GLU 11 H GLU 11 -20.205 11.665 -0.622 85 HA GLU 11 HA GLU 11 -18.850 9.500 0.489 86 HB2 GLU 11 2HB GLU 11 -21.018 10.308 1.318 87 HB3 GLU 11 1HB GLU 11 -21.805 9.704 -0.134 88 HG2 GLU 11 2HG GLU 11 -21.257 7.429 0.470 89 HG3 GLU 11 1HG GLU 11 -20.352 7.996 1.871 90 H GLU 12 H GLU 12 -20.585 9.731 -2.559 91 HA GLU 12 HA GLU 12 -20.542 7.020 -3.273 92 HB2 GLU 12 2HB GLU 12 -20.595 9.546 -4.915 93 HB3 GLU 12 1HB GLU 12 -20.704 7.945 -5.637 94 HG2 GLU 12 2HG GLU 12 -22.774 7.522 -4.714 95 HG3 GLU 12 1HG GLU 12 -22.561 8.715 -3.436 96 H ASP 13 H ASP 13 -18.111 9.558 -3.732 97 HA ASP 13 HA ASP 13 -16.280 8.048 -5.263 98 HB2 ASP 13 2HB ASP 13 -15.806 10.321 -3.324 99 HB3 ASP 13 1HB ASP 13 -14.531 9.599 -4.293 100 H LEU 14 H LEU 14 -16.510 8.647 -1.799 101 HA LEU 14 HA LEU 14 -14.302 7.168 -0.974 102 HB2 LEU 14 2HB LEU 14 -15.581 8.757 0.436 103 HB3 LEU 14 1HB LEU 14 -16.891 7.595 0.518 104 HG LEU 14 HG LEU 14 -15.315 5.997 1.632 105 HD11 LEU 14 1HD1 LEU 14 -13.531 8.424 1.756 106 HD12 LEU 14 2HD1 LEU 14 -13.223 6.952 0.836 107 HD13 LEU 14 3HD1 LEU 14 -13.263 6.899 2.599 108 HD21 LEU 14 3HD2 LEU 14 -15.755 8.647 3.004 109 HD22 LEU 14 1HD2 LEU 14 -15.407 7.114 3.802 110 HD23 LEU 14 2HD2 LEU 14 -16.914 7.318 2.910 111 H GLU 15 H GLU 15 -17.685 6.183 -1.363 112 HA GLU 15 HA GLU 15 -17.538 3.591 -0.397 113 HB2 GLU 15 2HB GLU 15 -19.624 4.756 -1.021 114 HB3 GLU 15 1HB GLU 15 -19.182 4.619 -2.718 115 HG2 GLU 15 2HG GLU 15 -20.728 2.913 -2.324 116 HG3 GLU 15 1HG GLU 15 -19.153 2.125 -2.380 117 H THR 16 H THR 16 -17.086 4.720 -3.748 118 HA THR 16 HA THR 16 -16.543 2.211 -4.872 119 HB THR 16 HB THR 16 -15.521 4.900 -5.815 120 HG1 THR 16 HG1 THR 16 -17.456 5.058 -6.918 121 HG21 THR 16 3HG2 THR 16 -16.011 2.319 -7.306 122 HG22 THR 16 1HG2 THR 16 -14.436 3.022 -6.939 123 HG23 THR 16 2HG2 THR 16 -15.539 3.852 -8.038 124 H VAL 17 H VAL 17 -14.404 4.631 -3.440 125 HA VAL 17 HA VAL 17 -11.969 3.360 -4.103 126 HB VAL 17 HB VAL 17 -12.599 5.267 -1.845 127 HG11 VAL 17 1HG1 VAL 17 -10.180 5.691 -1.764 128 HG12 VAL 17 2HG1 VAL 17 -9.923 4.394 -2.931 129 HG13 VAL 17 3HG1 VAL 17 -10.571 4.026 -1.333 130 HG21 VAL 17 3HG2 VAL 17 -11.623 6.950 -3.311 131 HG22 VAL 17 1HG2 VAL 17 -13.008 6.171 -4.074 132 HG23 VAL 17 2HG2 VAL 17 -11.371 5.728 -4.557 133 H ILE 18 H ILE 18 -13.900 3.326 -1.106 134 HA ILE 18 HA ILE 18 -12.277 1.551 0.337 135 HB ILE 18 HB ILE 18 -15.242 2.103 0.515 136 HG12 ILE 18 2HG1 ILE 18 -12.908 3.020 2.210 137 HG13 ILE 18 1HG1 ILE 18 -13.741 3.999 1.007 138 HG21 ILE 18 1HG2 ILE 18 -13.511 0.558 2.441 139 HG22 ILE 18 2HG2 ILE 18 -14.819 -0.094 1.453 140 HG23 ILE 18 3HG2 ILE 18 -15.176 1.063 2.736 141 HD11 ILE 18 3HD1 ILE 18 -15.784 3.886 2.321 142 HD12 ILE 18 1HD1 ILE 18 -14.449 4.541 3.270 143 HD13 ILE 18 2HD1 ILE 18 -14.968 2.873 3.513 144 H ARG 19 H ARG 19 -14.916 0.987 -1.921 145 HA ARG 19 HA ARG 19 -15.183 -1.795 -1.492 146 HB2 ARG 19 2HB ARG 19 -16.700 -0.034 -2.736 147 HB3 ARG 19 1HB ARG 19 -15.769 -0.521 -4.143 148 HG2 ARG 19 2HG ARG 19 -17.133 -2.553 -2.420 149 HG3 ARG 19 1HG ARG 19 -18.009 -1.680 -3.677 150 HD2 ARG 19 2HD ARG 19 -15.475 -3.222 -4.182 151 HD3 ARG 19 1HD ARG 19 -17.085 -3.920 -4.347 152 HE ARG 19 HE ARG 19 -16.831 -1.515 -5.861 153 HH11 ARG 19 1HH1 ARG 19 -16.075 -4.936 -5.858 154 HH12 ARG 19 2HH1 ARG 19 -15.972 -5.053 -7.594 155 HH21 ARG 19 1HH2 ARG 19 -16.712 -1.655 -8.147 156 HH22 ARG 19 2HH2 ARG 19 -16.333 -3.178 -8.896 157 H ALA 20 H ALA 20 -13.024 0.124 -3.464 158 HA ALA 20 HA ALA 20 -12.058 -2.150 -4.969 159 HB1 ALA 20 3HB ALA 20 -12.200 0.090 -5.990 160 HB2 ALA 20 1HB ALA 20 -10.573 -0.586 -6.055 161 HB3 ALA 20 2HB ALA 20 -10.964 0.657 -4.868 162 H VAL 21 H VAL 21 -10.935 -0.135 -2.280 163 HA VAL 21 HA VAL 21 -8.354 -1.270 -2.063 164 HB VAL 21 HB VAL 21 -10.057 0.012 0.088 165 HG11 VAL 21 1HG1 VAL 21 -8.337 -1.406 1.077 166 HG12 VAL 21 2HG1 VAL 21 -7.955 0.298 1.322 167 HG13 VAL 21 3HG1 VAL 21 -7.105 -0.625 0.083 168 HG21 VAL 21 3HG2 VAL 21 -7.850 1.126 -1.642 169 HG22 VAL 21 1HG2 VAL 21 -8.635 1.979 -0.313 170 HG23 VAL 21 2HG2 VAL 21 -9.564 1.528 -1.743 171 H TYR 22 H TYR 22 -11.357 -1.961 -0.253 172 HA TYR 22 HA TYR 22 -10.220 -4.419 0.765 173 HB2 TYR 22 2HB TYR 22 -13.044 -3.346 0.965 174 HB3 TYR 22 1HB TYR 22 -12.440 -4.775 1.795 175 HD1 TYR 22 HD2 TYR 22 -10.353 -4.382 3.343 176 HD2 TYR 22 HD1 TYR 22 -12.980 -1.307 2.038 177 HE1 TYR 22 HE2 TYR 22 -9.616 -2.963 5.213 178 HE2 TYR 22 HE1 TYR 22 -12.248 0.118 3.896 179 HH TYR 22 HH TYR 22 -11.248 -0.204 6.177 180 H ARG 23 H ARG 23 -9.725 -5.135 -1.411 181 HA ARG 23 HA ARG 23 -11.879 -5.886 -3.164 182 HB2 ARG 23 2HB ARG 23 -9.485 -5.171 -3.808 183 HB3 ARG 23 1HB ARG 23 -9.021 -6.810 -3.379 184 HG2 ARG 23 2HG ARG 23 -10.466 -7.715 -5.071 185 HG3 ARG 23 1HG ARG 23 -11.092 -6.106 -5.445 186 HD2 ARG 23 2HD ARG 23 -8.304 -7.153 -5.873 187 HD3 ARG 23 1HD ARG 23 -9.458 -6.623 -7.097 188 HE ARG 23 HE ARG 23 -9.191 -4.371 -5.800 189 HH11 ARG 23 1HH1 ARG 23 -6.688 -6.686 -6.606 190 HH12 ARG 23 2HH1 ARG 23 -5.408 -5.504 -6.589 191 HH21 ARG 23 1HH2 ARG 23 -7.526 -2.817 -5.781 192 HH22 ARG 23 2HH2 ARG 23 -5.896 -3.288 -6.143 193 H GLN 24 H GLN 24 -13.157 -7.430 -2.374 194 HA GLN 24 HA GLN 24 -12.104 -9.495 -0.671 195 HB2 GLN 24 2HB GLN 24 -14.914 -9.083 -1.697 196 HB3 GLN 24 1HB GLN 24 -14.435 -10.191 -0.417 197 HG2 GLN 24 2HG GLN 24 -13.662 -8.283 0.922 198 HG3 GLN 24 1HG GLN 24 -14.201 -7.189 -0.350 199 HE21 GLN 24 1HE2 GLN 24 -15.636 -6.136 0.971 200 HE22 GLN 24 2HE2 GLN 24 -17.103 -6.856 1.534 201 H VAL 25 H VAL 25 -10.743 -10.630 -2.040 202 HA VAL 25 HA VAL 25 -11.758 -12.097 -4.286 203 HB VAL 25 HB VAL 25 -9.307 -12.736 -2.626 204 HG11 VAL 25 1HG1 VAL 25 -8.486 -13.771 -4.697 205 HG12 VAL 25 2HG1 VAL 25 -10.027 -13.413 -5.475 206 HG13 VAL 25 3HG1 VAL 25 -9.967 -14.530 -4.112 207 HG21 VAL 25 3HG2 VAL 25 -9.222 -10.410 -3.367 208 HG22 VAL 25 1HG2 VAL 25 -9.510 -10.924 -5.030 209 HG23 VAL 25 2HG2 VAL 25 -8.021 -11.391 -4.208 210 H LEU 26 H LEU 26 -10.827 -12.918 -0.976 211 HA LEU 26 HA LEU 26 -12.972 -14.920 -0.908 212 HB2 LEU 26 2HB LEU 26 -10.147 -15.152 0.075 213 HB3 LEU 26 1HB LEU 26 -11.424 -16.014 0.906 214 HG LEU 26 HG LEU 26 -10.432 -17.557 -0.578 215 HD11 LEU 26 1HD1 LEU 26 -12.836 -17.703 -0.517 216 HD12 LEU 26 2HD1 LEU 26 -12.253 -18.101 -2.134 217 HD13 LEU 26 3HD1 LEU 26 -12.972 -16.522 -1.818 218 HD21 LEU 26 3HD2 LEU 26 -10.793 -15.565 -2.810 219 HD22 LEU 26 1HD2 LEU 26 -10.100 -17.180 -2.944 220 HD23 LEU 26 2HD2 LEU 26 -9.266 -15.938 -2.009 221 H GLY 27 H GLY 27 -13.042 -15.489 1.736 222 HA2 GLY 27 2HA GLY 27 -12.859 -13.001 3.242 223 HA3 GLY 27 1HA GLY 27 -14.473 -13.663 3.021 224 H ASN 28 H ASN 28 -12.658 -13.278 5.408 225 HA ASN 28 HA ASN 28 -12.265 -15.968 6.377 226 HB2 ASN 28 2HB ASN 28 -12.019 -13.255 7.686 227 HB3 ASN 28 1HB ASN 28 -11.807 -14.760 8.575 228 HD21 ASN 28 1HD2 ASN 28 -9.995 -16.001 8.238 229 HD22 ASN 28 2HD2 ASN 28 -8.617 -15.411 7.366 230 H ASP 29 H ASP 29 -13.291 -16.662 8.432 231 HA ASP 29 HA ASP 29 -16.154 -16.289 8.197 232 HB2 ASP 29 2HB ASP 29 -16.336 -18.149 9.767 233 HB3 ASP 29 1HB ASP 29 -15.249 -18.563 8.449 234 H TYR 30 H TYR 30 -17.143 -16.582 10.662 235 HA TYR 30 HA TYR 30 -16.710 -13.956 11.736 236 HB2 TYR 30 2HB TYR 30 -18.566 -16.170 12.631 237 HB3 TYR 30 1HB TYR 30 -18.551 -14.542 13.300 238 HD1 TYR 30 HD2 TYR 30 -19.070 -12.602 11.734 239 HD2 TYR 30 HD1 TYR 30 -19.805 -16.663 10.703 240 HE1 TYR 30 HE2 TYR 30 -20.633 -11.867 9.985 241 HE2 TYR 30 HE1 TYR 30 -21.367 -15.940 8.946 242 HH TYR 30 HH TYR 30 -21.521 -12.796 7.808 243 H VAL 31 H VAL 31 -14.520 -14.230 12.406 244 HA VAL 31 HA VAL 31 -13.980 -15.902 14.703 245 HB VAL 31 HB VAL 31 -11.740 -14.857 14.685 246 HG11 VAL 31 1HG1 VAL 31 -12.140 -16.833 13.323 247 HG12 VAL 31 2HG1 VAL 31 -10.995 -15.750 12.530 248 HG13 VAL 31 3HG1 VAL 31 -12.669 -15.818 11.981 249 HG21 VAL 31 3HG2 VAL 31 -12.353 -12.631 13.922 250 HG22 VAL 31 1HG2 VAL 31 -12.806 -13.277 12.345 251 HG23 VAL 31 2HG2 VAL 31 -11.122 -13.328 12.868 252 H MET 32 H MET 32 -15.646 -13.174 14.282 253 HA MET 32 HA MET 32 -16.590 -11.681 15.681 254 HB2 MET 32 2HB MET 32 -15.128 -13.233 17.817 255 HB3 MET 32 1HB MET 32 -16.293 -11.955 18.140 256 HG2 MET 32 2HG MET 32 -16.834 -14.555 16.727 257 HG3 MET 32 1HG MET 32 -17.324 -14.128 18.365 258 HE1 MET 32 3HE MET 32 -19.295 -15.235 16.065 259 HE2 MET 32 1HE MET 32 -20.703 -14.208 16.342 260 HE3 MET 32 2HE MET 32 -19.813 -14.873 17.712 261 H ALA 33 H ALA 33 -13.947 -11.245 14.434 262 HA ALA 33 HA ALA 33 -12.516 -9.462 16.148 263 HB1 ALA 33 3HB ALA 33 -12.590 -9.569 13.129 264 HB2 ALA 33 1HB ALA 33 -11.468 -10.453 14.165 265 HB3 ALA 33 2HB ALA 33 -11.413 -8.691 14.106 266 H SER 34 H SER 34 -14.765 -8.964 13.458 267 HA SER 34 HA SER 34 -16.378 -7.444 13.054 268 HB2 SER 34 2HB SER 34 -16.274 -7.013 16.048 269 HB3 SER 34 1HB SER 34 -17.619 -6.610 14.976 270 HG SER 34 HG SER 34 -18.024 -8.605 15.930 271 H GLU 35 H GLU 35 -13.488 -6.502 13.210 272 HA GLU 35 HA GLU 35 -13.974 -3.649 13.642 273 HB2 GLU 35 2HB GLU 35 -11.925 -4.547 14.620 274 HB3 GLU 35 1HB GLU 35 -11.413 -5.148 13.050 275 HG2 GLU 35 2HG GLU 35 -10.245 -3.096 13.707 276 HG3 GLU 35 1HG GLU 35 -11.164 -2.902 12.217 277 H ARG 36 H ARG 36 -12.352 -5.647 11.175 278 HA ARG 36 HA ARG 36 -12.276 -5.556 8.920 279 HB2 ARG 36 2HB ARG 36 -14.920 -4.137 9.246 280 HB3 ARG 36 1HB ARG 36 -14.264 -4.664 7.704 281 HG2 ARG 36 2HG ARG 36 -14.248 -6.986 8.554 282 HG3 ARG 36 1HG ARG 36 -15.038 -6.414 10.023 283 HD2 ARG 36 2HD ARG 36 -16.129 -6.185 7.222 284 HD3 ARG 36 1HD ARG 36 -16.646 -7.353 8.436 285 HE ARG 36 HE ARG 36 -17.007 -4.932 9.644 286 HH11 ARG 36 1HH1 ARG 36 -18.103 -6.392 6.644 287 HH12 ARG 36 2HH1 ARG 36 -19.578 -5.470 6.592 288 HH21 ARG 36 1HH2 ARG 36 -18.949 -3.712 9.563 289 HH22 ARG 36 2HH2 ARG 36 -20.068 -3.970 8.253 290 H LEU 37 H LEU 37 -11.503 -3.192 10.745 291 HA LEU 37 HA LEU 37 -10.317 -1.285 10.529 292 HB2 LEU 37 2HB LEU 37 -10.282 -2.025 7.604 293 HB3 LEU 37 1HB LEU 37 -9.294 -0.776 8.339 294 HG LEU 37 HG LEU 37 -9.155 -3.709 9.059 295 HD11 LEU 37 1HD1 LEU 37 -7.045 -3.711 7.830 296 HD12 LEU 37 2HD1 LEU 37 -7.334 -2.046 7.325 297 HD13 LEU 37 3HD1 LEU 37 -8.407 -3.334 6.775 298 HD21 LEU 37 3HD2 LEU 37 -8.489 -2.237 10.881 299 HD22 LEU 37 1HD2 LEU 37 -7.394 -1.372 9.801 300 HD23 LEU 37 2HD2 LEU 37 -7.085 -3.060 10.205 301 H VAL 38 H VAL 38 -13.251 -1.287 10.319 302 HA VAL 38 HA VAL 38 -14.064 0.756 8.536 303 HB VAL 38 HB VAL 38 -15.673 -0.763 9.634 304 HG11 VAL 38 1HG1 VAL 38 -16.361 -0.349 11.962 305 HG12 VAL 38 2HG1 VAL 38 -15.026 0.791 12.132 306 HG13 VAL 38 3HG1 VAL 38 -14.695 -0.915 11.836 307 HG21 VAL 38 3HG2 VAL 38 -17.401 0.898 10.129 308 HG22 VAL 38 1HG2 VAL 38 -16.471 1.334 8.695 309 HG23 VAL 38 2HG2 VAL 38 -16.165 2.154 10.226 310 H SER 39 H SER 39 -12.507 0.755 11.629 311 HA SER 39 HA SER 39 -12.847 3.459 12.324 312 HB2 SER 39 2HB SER 39 -10.598 3.036 13.541 313 HB3 SER 39 1HB SER 39 -11.992 2.061 14.014 314 HG SER 39 HG SER 39 -11.131 0.323 13.090 315 H ALA 40 H ALA 40 -10.453 1.802 10.313 316 HA ALA 40 HA ALA 40 -8.853 4.069 9.748 317 HB1 ALA 40 3HB ALA 40 -9.234 1.569 8.094 318 HB2 ALA 40 1HB ALA 40 -8.073 1.764 9.407 319 HB3 ALA 40 2HB ALA 40 -7.914 2.730 7.941 320 H GLU 41 H GLU 41 -11.665 2.624 8.185 321 HA GLU 41 HA GLU 41 -11.858 4.281 5.945 322 HB2 GLU 41 2HB GLU 41 -14.062 3.061 7.623 323 HB3 GLU 41 1HB GLU 41 -14.304 3.794 6.043 324 HG2 GLU 41 2HG GLU 41 -12.899 2.116 5.014 325 HG3 GLU 41 1HG GLU 41 -12.553 1.411 6.591 326 H SER 42 H SER 42 -13.069 4.715 9.239 327 HA SER 42 HA SER 42 -14.314 7.206 8.832 328 HB2 SER 42 2HB SER 42 -14.782 5.840 10.794 329 HB3 SER 42 1HB SER 42 -13.115 6.011 11.343 330 HG SER 42 HG SER 42 -14.905 7.475 12.202 331 H LEU 43 H LEU 43 -11.017 6.341 9.812 332 HA LEU 43 HA LEU 43 -10.061 8.908 10.370 333 HB2 LEU 43 2HB LEU 43 -8.546 6.603 9.134 334 HB3 LEU 43 1HB LEU 43 -7.827 8.001 9.906 335 HG LEU 43 HG LEU 43 -9.508 5.904 11.282 336 HD11 LEU 43 1HD1 LEU 43 -6.554 6.479 11.442 337 HD12 LEU 43 2HD1 LEU 43 -7.291 5.105 10.621 338 HD13 LEU 43 3HD1 LEU 43 -7.431 5.265 12.373 339 HD21 LEU 43 3HD2 LEU 43 -9.794 8.114 12.283 340 HD22 LEU 43 1HD2 LEU 43 -8.043 8.289 12.407 341 HD23 LEU 43 2HD2 LEU 43 -8.874 7.048 13.344 342 H LEU 44 H LEU 44 -10.084 7.091 7.327 343 HA LEU 44 HA LEU 44 -8.933 9.133 5.745 344 HB2 LEU 44 2HB LEU 44 -8.980 6.805 5.034 345 HB3 LEU 44 1HB LEU 44 -10.731 6.823 4.995 346 HG LEU 44 HG LEU 44 -10.639 8.479 3.147 347 HD11 LEU 44 1HD1 LEU 44 -8.518 8.842 1.990 348 HD12 LEU 44 2HD1 LEU 44 -7.676 7.939 3.249 349 HD13 LEU 44 3HD1 LEU 44 -8.469 9.465 3.639 350 HD21 LEU 44 3HD2 LEU 44 -9.907 6.891 1.434 351 HD22 LEU 44 1HD2 LEU 44 -10.882 6.104 2.677 352 HD23 LEU 44 2HD2 LEU 44 -9.130 5.913 2.679 353 H ARG 45 H ARG 45 -12.276 8.232 6.466 354 HA ARG 45 HA ARG 45 -13.534 9.973 4.669 355 HB2 ARG 45 2HB ARG 45 -14.665 8.088 5.793 356 HB3 ARG 45 1HB ARG 45 -14.584 8.963 7.318 357 HG2 ARG 45 2HG ARG 45 -16.014 10.703 6.429 358 HG3 ARG 45 1HG ARG 45 -16.043 9.904 4.857 359 HD2 ARG 45 2HD ARG 45 -17.028 7.898 6.044 360 HD3 ARG 45 1HD ARG 45 -17.233 8.947 7.447 361 HE ARG 45 HE ARG 45 -18.470 10.410 5.663 362 HH11 ARG 45 1HH1 ARG 45 -18.684 6.936 6.152 363 HH12 ARG 45 2HH1 ARG 45 -20.245 6.817 5.380 364 HH21 ARG 45 1HH2 ARG 45 -20.481 10.244 4.663 365 HH22 ARG 45 2HH2 ARG 45 -21.253 8.689 4.500 366 H ASN 46 H ASN 46 -12.423 10.500 7.980 367 HA ASN 46 HA ASN 46 -13.681 13.129 8.000 368 HB2 ASN 46 2HB ASN 46 -13.470 11.359 9.981 369 HB3 ASN 46 1HB ASN 46 -11.964 12.231 10.258 370 HD21 ASN 46 1HD2 ASN 46 -14.768 13.777 8.891 371 HD22 ASN 46 2HD2 ASN 46 -15.157 14.754 10.268 372 H GLY 47 H GLY 47 -11.041 12.064 6.589 373 HA2 GLY 47 2HA GLY 47 -9.268 13.204 5.675 374 HA3 GLY 47 1HA GLY 47 -9.904 14.664 6.414 375 H LYS 48 H LYS 48 -9.047 11.799 8.241 376 HA LYS 48 HA LYS 48 -7.065 13.359 9.693 377 HB2 LYS 48 2HB LYS 48 -8.230 10.611 10.130 378 HB3 LYS 48 1HB LYS 48 -6.935 11.267 11.121 379 HG2 LYS 48 2HG LYS 48 -8.410 13.140 11.755 380 HG3 LYS 48 1HG LYS 48 -9.711 12.392 10.824 381 HD2 LYS 48 2HD LYS 48 -9.888 11.865 13.211 382 HD3 LYS 48 1HD LYS 48 -9.619 10.419 12.239 383 HE2 LYS 48 2HE LYS 48 -8.247 10.299 14.211 384 HE3 LYS 48 1HE LYS 48 -7.210 10.539 12.807 385 HZ1 LYS 48 3HZ LYS 48 -8.038 12.595 14.781 386 HZ2 LYS 48 1HZ LYS 48 -7.156 12.926 13.367 387 HZ3 LYS 48 2HZ LYS 48 -6.485 11.945 14.576 388 H ILE 49 H ILE 49 -7.266 10.711 7.442 389 HA ILE 49 HA ILE 49 -4.348 10.780 7.159 390 HB ILE 49 HB ILE 49 -4.261 8.355 6.829 391 HG12 ILE 49 2HG1 ILE 49 -7.145 8.340 7.755 392 HG13 ILE 49 1HG1 ILE 49 -6.614 8.067 6.099 393 HG21 ILE 49 1HG2 ILE 49 -3.768 9.237 9.044 394 HG22 ILE 49 2HG2 ILE 49 -4.544 7.657 9.160 395 HG23 ILE 49 3HG2 ILE 49 -5.473 9.121 9.482 396 HD11 ILE 49 3HD1 ILE 49 -5.919 6.344 8.466 397 HD12 ILE 49 1HD1 ILE 49 -5.434 6.058 6.794 398 HD13 ILE 49 2HD1 ILE 49 -7.138 5.983 7.244 399 H THR 50 H THR 50 -3.663 9.794 5.038 400 HA THR 50 HA THR 50 -5.645 10.442 2.974 401 HB THR 50 HB THR 50 -3.800 10.434 1.391 402 HG1 THR 50 HG1 THR 50 -2.160 9.698 3.623 403 HG21 THR 50 3HG2 THR 50 -4.147 12.506 2.612 404 HG22 THR 50 1HG2 THR 50 -2.427 12.262 2.311 405 HG23 THR 50 2HG2 THR 50 -3.096 11.941 3.912 406 H VAL 51 H VAL 51 -5.093 8.927 0.896 407 HA VAL 51 HA VAL 51 -6.083 6.366 1.497 408 HB VAL 51 HB VAL 51 -4.636 7.301 -0.993 409 HG11 VAL 51 1HG1 VAL 51 -5.741 5.422 -2.121 410 HG12 VAL 51 2HG1 VAL 51 -6.392 4.881 -0.573 411 HG13 VAL 51 3HG1 VAL 51 -4.651 4.863 -0.851 412 HG21 VAL 51 3HG2 VAL 51 -6.637 8.601 -0.474 413 HG22 VAL 51 1HG2 VAL 51 -7.582 7.115 -0.382 414 HG23 VAL 51 2HG2 VAL 51 -6.869 7.613 -1.915 415 H ARG 52 H ARG 52 -2.861 7.649 1.350 416 HA ARG 52 HA ARG 52 -1.415 5.251 1.039 417 HB2 ARG 52 2HB ARG 52 -0.506 7.673 2.598 418 HB3 ARG 52 1HB ARG 52 0.503 6.483 1.786 419 HG2 ARG 52 2HG ARG 52 -0.472 7.234 -0.379 420 HG3 ARG 52 1HG ARG 52 -1.294 8.524 0.500 421 HD2 ARG 52 2HD ARG 52 1.675 8.089 0.253 422 HD3 ARG 52 1HD ARG 52 0.728 9.391 -0.465 423 HE ARG 52 HE ARG 52 0.719 9.197 2.444 424 HH11 ARG 52 1HH1 ARG 52 1.879 10.798 -0.451 425 HH12 ARG 52 2HH1 ARG 52 2.585 12.125 0.416 426 HH21 ARG 52 1HH2 ARG 52 1.652 10.957 3.588 427 HH22 ARG 52 2HH2 ARG 52 2.461 12.220 2.699 428 H GLU 53 H GLU 53 -2.298 7.055 3.986 429 HA GLU 53 HA GLU 53 -1.286 5.120 5.790 430 HB2 GLU 53 2HB GLU 53 -3.391 7.251 6.190 431 HB3 GLU 53 1HB GLU 53 -2.731 6.267 7.484 432 HG2 GLU 53 2HG GLU 53 -1.646 8.373 7.535 433 HG3 GLU 53 1HG GLU 53 -0.484 7.186 6.946 434 H PHE 54 H PHE 54 -4.354 5.582 4.203 435 HA PHE 54 HA PHE 54 -5.904 3.781 5.697 436 HB2 PHE 54 2HB PHE 54 -6.826 5.448 4.115 437 HB3 PHE 54 1HB PHE 54 -6.163 4.523 2.773 438 HD1 PHE 54 HD1 PHE 54 -8.415 4.103 5.711 439 HD2 PHE 54 HD2 PHE 54 -7.529 3.028 1.692 440 HE1 PHE 54 HE1 PHE 54 -10.497 2.799 5.601 441 HE2 PHE 54 HE2 PHE 54 -9.608 1.723 1.577 442 HZ PHE 54 HZ PHE 54 -11.096 1.608 3.535 443 H VAL 55 H VAL 55 -4.221 3.310 2.587 444 HA VAL 55 HA VAL 55 -4.689 0.534 2.424 445 HB VAL 55 HB VAL 55 -2.441 2.153 1.205 446 HG11 VAL 55 1HG1 VAL 55 -1.901 -0.222 1.234 447 HG12 VAL 55 2HG1 VAL 55 -2.252 0.316 -0.408 448 HG13 VAL 55 3HG1 VAL 55 -3.458 -0.598 0.498 449 HG21 VAL 55 3HG2 VAL 55 -3.854 2.090 -0.823 450 HG22 VAL 55 1HG2 VAL 55 -4.600 2.973 0.509 451 HG23 VAL 55 2HG2 VAL 55 -5.137 1.338 0.128 452 H ARG 56 H ARG 56 -2.132 2.423 3.929 453 HA ARG 56 HA ARG 56 -0.377 0.317 4.527 454 HB2 ARG 56 2HB ARG 56 0.280 2.664 4.725 455 HB3 ARG 56 1HB ARG 56 -0.860 2.890 6.041 456 HG2 ARG 56 2HG ARG 56 0.393 1.445 7.468 457 HG3 ARG 56 1HG ARG 56 1.450 0.968 6.140 458 HD2 ARG 56 2HD ARG 56 2.470 2.623 7.690 459 HD3 ARG 56 1HD ARG 56 2.391 3.171 6.016 460 HE ARG 56 HE ARG 56 1.052 4.887 6.680 461 HH11 ARG 56 1HH1 ARG 56 1.046 2.453 9.206 462 HH12 ARG 56 2HH1 ARG 56 0.079 3.399 10.298 463 HH21 ARG 56 1HH2 ARG 56 -0.189 6.136 8.125 464 HH22 ARG 56 2HH2 ARG 56 -0.615 5.496 9.680 465 H ALA 57 H ALA 57 -3.135 1.643 6.312 466 HA ALA 57 HA ALA 57 -2.838 0.023 8.608 467 HB1 ALA 57 3HB ALA 57 -5.339 1.291 7.486 468 HB2 ALA 57 1HB ALA 57 -4.211 2.041 8.614 469 HB3 ALA 57 2HB ALA 57 -5.155 0.638 9.114 470 H VAL 58 H VAL 58 -4.465 -0.444 5.536 471 HA VAL 58 HA VAL 58 -5.813 -2.843 6.254 472 HB VAL 58 HB VAL 58 -5.032 -1.837 3.508 473 HG11 VAL 58 1HG1 VAL 58 -6.830 -3.306 2.692 474 HG12 VAL 58 2HG1 VAL 58 -7.037 -3.939 4.325 475 HG13 VAL 58 3HG1 VAL 58 -5.526 -4.212 3.458 476 HG21 VAL 58 3HG2 VAL 58 -6.448 -0.248 4.683 477 HG22 VAL 58 1HG2 VAL 58 -7.606 -1.528 5.052 478 HG23 VAL 58 2HG2 VAL 58 -7.346 -1.028 3.382 479 H ALA 59 H ALA 59 -2.754 -2.169 4.582 480 HA ALA 59 HA ALA 59 -2.188 -4.923 4.063 481 HB1 ALA 59 3HB ALA 59 -0.356 -2.530 3.999 482 HB2 ALA 59 1HB ALA 59 -1.306 -3.145 2.648 483 HB3 ALA 59 2HB ALA 59 -0.002 -4.121 3.327 484 H LYS 60 H LYS 60 -1.388 -2.699 6.649 485 HA LYS 60 HA LYS 60 0.430 -4.675 7.819 486 HB2 LYS 60 2HB LYS 60 -0.042 -1.790 8.587 487 HB3 LYS 60 1HB LYS 60 1.157 -2.859 9.306 488 HG2 LYS 60 2HG LYS 60 2.235 -3.073 7.089 489 HG3 LYS 60 1HG LYS 60 1.082 -1.899 6.451 490 HD2 LYS 60 2HD LYS 60 3.135 -0.761 6.974 491 HD3 LYS 60 1HD LYS 60 1.905 -0.265 8.140 492 HE2 LYS 60 2HE LYS 60 2.801 -1.822 9.774 493 HE3 LYS 60 1HE LYS 60 3.992 -2.389 8.606 494 HZ1 LYS 60 3HZ LYS 60 4.908 -0.793 10.197 495 HZ2 LYS 60 1HZ LYS 60 3.822 0.388 9.648 496 HZ3 LYS 60 2HZ LYS 60 5.015 -0.216 8.600 497 H SER 61 H SER 61 -2.653 -4.579 7.840 498 HA SER 61 HA SER 61 -3.439 -4.266 10.544 499 HB2 SER 61 2HB SER 61 -5.476 -5.523 9.852 500 HB3 SER 61 1HB SER 61 -5.095 -4.191 8.762 501 HG SER 61 HG SER 61 -4.532 -5.583 7.214 502 H GLU 62 H GLU 62 -4.439 -6.279 11.738 503 HA GLU 62 HA GLU 62 -2.163 -7.977 12.223 504 HB2 GLU 62 2HB GLU 62 -3.508 -8.850 14.113 505 HB3 GLU 62 1HB GLU 62 -3.318 -7.103 14.133 506 HG2 GLU 62 2HG GLU 62 -5.580 -6.883 13.168 507 HG3 GLU 62 1HG GLU 62 -5.761 -8.636 13.279 508 H LEU 63 H LEU 63 -2.563 -10.346 12.697 509 HA LEU 63 HA LEU 63 -3.040 -12.452 12.000 510 HB2 LEU 63 2HB LEU 63 -5.349 -11.167 10.541 511 HB3 LEU 63 1HB LEU 63 -5.085 -12.894 10.666 512 HG LEU 63 HG LEU 63 -5.618 -11.042 12.989 513 HD11 LEU 63 1HD1 LEU 63 -7.776 -12.172 13.108 514 HD12 LEU 63 2HD1 LEU 63 -7.380 -13.094 11.659 515 HD13 LEU 63 3HD1 LEU 63 -7.575 -11.344 11.564 516 HD21 LEU 63 3HD2 LEU 63 -5.823 -13.104 14.286 517 HD22 LEU 63 1HD2 LEU 63 -4.204 -12.926 13.610 518 HD23 LEU 63 2HD2 LEU 63 -5.350 -14.042 12.869 519 H TYR 64 H TYR 64 -3.239 -13.801 9.919 520 HA TYR 64 HA TYR 64 -2.426 -14.405 7.870 521 HB2 TYR 64 2HB TYR 64 -4.167 -12.567 7.351 522 HB3 TYR 64 1HB TYR 64 -2.787 -11.531 7.033 523 HD1 TYR 64 HD2 TYR 64 -4.438 -14.681 5.986 524 HD2 TYR 64 HD1 TYR 64 -1.720 -11.583 4.932 525 HE1 TYR 64 HE2 TYR 64 -4.395 -15.513 3.675 526 HE2 TYR 64 HE1 TYR 64 -1.676 -12.405 2.613 527 HH TYR 64 HH TYR 64 -3.928 -14.573 1.398 528 H LYS 65 H LYS 65 -0.294 -14.506 9.170 529 HA LYS 65 HA LYS 65 1.727 -13.074 7.654 530 HB2 LYS 65 2HB LYS 65 1.532 -12.821 10.654 531 HB3 LYS 65 1HB LYS 65 2.950 -12.372 9.715 532 HG2 LYS 65 2HG LYS 65 1.554 -10.772 8.459 533 HG3 LYS 65 1HG LYS 65 0.206 -11.169 9.526 534 HD2 LYS 65 2HD LYS 65 1.604 -10.442 11.450 535 HD3 LYS 65 1HD LYS 65 2.831 -9.907 10.294 536 HE2 LYS 65 2HE LYS 65 1.434 -8.042 10.941 537 HE3 LYS 65 1HE LYS 65 1.176 -8.436 9.245 538 HZ1 LYS 65 3HZ LYS 65 -0.575 -9.238 11.502 539 HZ2 LYS 65 1HZ LYS 65 -0.814 -9.664 9.877 540 HZ3 LYS 65 2HZ LYS 65 -0.919 -8.042 10.349 541 H GLU 66 H GLU 66 3.984 -13.687 8.550 542 HA GLU 66 HA GLU 66 5.592 -15.179 9.067 543 HB2 GLU 66 2HB GLU 66 3.390 -16.859 10.271 544 HB3 GLU 66 1HB GLU 66 5.119 -17.100 10.502 545 HG2 GLU 66 2HG GLU 66 5.239 -14.848 11.524 546 HG3 GLU 66 1HG GLU 66 3.484 -14.739 11.400 547 H LYS 67 H LYS 67 6.075 -15.550 6.952 548 HA LYS 67 HA LYS 67 6.495 -16.724 5.072 549 HB2 LYS 67 2HB LYS 67 5.504 -19.043 6.730 550 HB3 LYS 67 1HB LYS 67 6.248 -19.209 5.146 551 HG2 LYS 67 2HG LYS 67 8.272 -18.088 6.045 552 HG3 LYS 67 1HG LYS 67 7.524 -18.127 7.642 553 HD2 LYS 67 2HD LYS 67 7.381 -20.589 7.479 554 HD3 LYS 67 1HD LYS 67 8.206 -20.508 5.918 555 HE2 LYS 67 2HE LYS 67 10.147 -19.488 6.994 556 HE3 LYS 67 1HE LYS 67 9.322 -19.548 8.552 557 HZ1 LYS 67 3HZ LYS 67 10.313 -21.810 6.918 558 HZ2 LYS 67 1HZ LYS 67 9.189 -22.027 8.174 559 HZ3 LYS 67 2HZ LYS 67 10.722 -21.393 8.512 560 H PHE 68 H PHE 68 5.419 -16.511 3.239 561 HA PHE 68 HA PHE 68 3.709 -16.205 1.771 562 HB2 PHE 68 2HB PHE 68 3.191 -18.515 1.840 563 HB3 PHE 68 1HB PHE 68 2.553 -18.414 3.474 564 HD1 PHE 68 HD2 PHE 68 0.322 -17.531 3.881 565 HD2 PHE 68 HD1 PHE 68 1.816 -18.015 -0.069 566 HE1 PHE 68 HE2 PHE 68 -1.961 -17.304 3.014 567 HE2 PHE 68 HE1 PHE 68 -0.469 -17.800 -0.958 568 HZ PHE 68 HZ PHE 68 -2.360 -17.448 0.578 569 H LEU 69 H LEU 69 3.567 -15.374 4.949 570 HA LEU 69 HA LEU 69 2.300 -14.117 6.307 571 HB2 LEU 69 2HB LEU 69 1.052 -13.288 3.703 572 HB3 LEU 69 1HB LEU 69 0.483 -12.679 5.246 573 HG LEU 69 HG LEU 69 3.284 -12.337 4.158 574 HD11 LEU 69 1HD1 LEU 69 1.015 -10.382 4.430 575 HD12 LEU 69 2HD1 LEU 69 1.649 -11.040 2.922 576 HD13 LEU 69 3HD1 LEU 69 2.656 -9.991 3.921 577 HD21 LEU 69 3HD2 LEU 69 3.623 -10.835 6.039 578 HD22 LEU 69 1HD2 LEU 69 3.196 -12.444 6.616 579 HD23 LEU 69 2HD2 LEU 69 1.988 -11.156 6.621 580 H TYR 70 H TYR 70 1.764 -16.856 5.941 581 HA TYR 70 HA TYR 70 -0.470 -17.112 7.546 582 HB2 TYR 70 2HB TYR 70 -1.512 -16.465 5.195 583 HB3 TYR 70 1HB TYR 70 -1.291 -18.182 4.882 584 HD1 TYR 70 HD2 TYR 70 -1.983 -17.217 8.308 585 HD2 TYR 70 HD1 TYR 70 -3.755 -18.307 4.596 586 HE1 TYR 70 HE2 TYR 70 -4.108 -17.670 9.460 587 HE2 TYR 70 HE1 TYR 70 -5.882 -18.759 5.737 588 HH TYR 70 HH TYR 70 -6.472 -17.800 8.967 589 H GLY 71 H GLY 71 1.443 -18.639 4.993 590 HA2 GLY 71 2HA GLY 71 1.207 -21.194 6.459 591 HA3 GLY 71 1HA GLY 71 1.176 -21.110 4.708 592 H ASN 72 H ASN 72 3.066 -21.121 3.590 593 HA ASN 72 HA ASN 72 5.551 -21.149 5.173 594 HB2 ASN 72 2HB ASN 72 4.664 -23.101 3.051 595 HB3 ASN 72 1HB ASN 72 6.346 -22.945 3.547 596 HD21 ASN 72 1HD2 ASN 72 3.169 -23.992 4.467 597 HD22 ASN 72 2HD2 ASN 72 3.649 -24.879 5.876 598 H PHE 73 H PHE 73 7.513 -21.158 3.599 599 HA PHE 73 HA PHE 73 8.790 -20.119 2.055 600 HB2 PHE 73 2HB PHE 73 6.170 -19.684 0.613 601 HB3 PHE 73 1HB PHE 73 7.749 -19.294 -0.060 602 HD1 PHE 73 HD2 PHE 73 9.389 -21.140 -0.450 603 HD2 PHE 73 HD1 PHE 73 5.319 -21.868 0.554 604 HE1 PHE 73 HE2 PHE 73 9.596 -23.441 -1.292 605 HE2 PHE 73 HE1 PHE 73 5.518 -24.171 -0.283 606 HZ PHE 73 HZ PHE 73 7.658 -24.958 -1.209 607 H GLN 74 H GLN 74 9.682 -18.449 3.069 608 HA GLN 74 HA GLN 74 8.366 -16.075 3.850 609 HB2 GLN 74 2HB GLN 74 11.188 -16.945 3.568 610 HB3 GLN 74 1HB GLN 74 10.895 -15.213 3.603 611 HG2 GLN 74 2HG GLN 74 10.059 -17.195 5.710 612 HG3 GLN 74 1HG GLN 74 11.411 -16.066 5.815 613 HE21 GLN 74 1HE2 GLN 74 9.179 -16.251 7.596 614 HE22 GLN 74 2HE2 GLN 74 8.355 -14.728 7.525 615 H THR 75 H THR 75 10.117 -16.954 0.924 616 HA THR 75 HA THR 75 10.293 -14.476 -0.309 617 HB THR 75 HB THR 75 9.777 -17.104 -1.709 618 HG1 THR 75 HG1 THR 75 12.286 -16.855 -1.713 619 HG21 THR 75 3HG2 THR 75 11.109 -16.127 -3.505 620 HG22 THR 75 1HG2 THR 75 11.304 -14.645 -2.570 621 HG23 THR 75 2HG2 THR 75 9.708 -15.115 -3.150 622 H ARG 76 H ARG 76 7.570 -16.633 0.014 623 HA ARG 76 HA ARG 76 6.003 -15.569 -2.097 624 HB2 ARG 76 2HB ARG 76 5.762 -17.830 -0.940 625 HB3 ARG 76 1HB ARG 76 4.958 -16.968 0.362 626 HG2 ARG 76 2HG ARG 76 3.393 -18.024 -1.210 627 HG3 ARG 76 1HG ARG 76 3.194 -16.273 -1.119 628 HD2 ARG 76 2HD ARG 76 3.173 -17.423 -3.439 629 HD3 ARG 76 1HD ARG 76 4.089 -15.933 -3.229 630 HE ARG 76 HE ARG 76 6.060 -17.098 -3.529 631 HH11 ARG 76 1HH1 ARG 76 3.379 -19.371 -3.308 632 HH12 ARG 76 2HH1 ARG 76 4.326 -20.720 -3.856 633 HH21 ARG 76 1HH2 ARG 76 7.291 -18.874 -4.231 634 HH22 ARG 76 2HH2 ARG 76 6.546 -20.441 -4.381 635 H VAL 77 H VAL 77 6.589 -14.604 1.181 636 HA VAL 77 HA VAL 77 4.340 -12.960 1.635 637 HB VAL 77 HB VAL 77 7.180 -12.608 2.632 638 HG11 VAL 77 1HG1 VAL 77 5.959 -10.542 2.885 639 HG12 VAL 77 2HG1 VAL 77 6.158 -11.306 4.463 640 HG13 VAL 77 3HG1 VAL 77 4.606 -11.395 3.630 641 HG21 VAL 77 3HG2 VAL 77 4.818 -13.969 3.917 642 HG22 VAL 77 1HG2 VAL 77 6.391 -13.705 4.671 643 HG23 VAL 77 2HG2 VAL 77 6.254 -14.761 3.264 644 H ILE 78 H ILE 78 7.567 -12.212 0.411 645 HA ILE 78 HA ILE 78 7.258 -9.504 -0.131 646 HB ILE 78 HB ILE 78 8.913 -11.464 -1.733 647 HG12 ILE 78 2HG1 ILE 78 9.756 -9.935 0.733 648 HG13 ILE 78 1HG1 ILE 78 9.224 -11.612 0.771 649 HG21 ILE 78 1HG2 ILE 78 10.385 -9.522 -2.084 650 HG22 ILE 78 2HG2 ILE 78 9.226 -8.508 -1.226 651 HG23 ILE 78 3HG2 ILE 78 8.771 -9.269 -2.750 652 HD11 ILE 78 3HD1 ILE 78 11.066 -12.245 -0.676 653 HD12 ILE 78 1HD1 ILE 78 11.649 -11.428 0.773 654 HD13 ILE 78 2HD1 ILE 78 11.589 -10.562 -0.762 655 H GLU 79 H GLU 79 6.683 -12.318 -2.190 656 HA GLU 79 HA GLU 79 6.068 -10.933 -4.551 657 HB2 GLU 79 2HB GLU 79 5.117 -13.662 -3.658 658 HB3 GLU 79 1HB GLU 79 5.100 -13.056 -5.308 659 HG2 GLU 79 2HG GLU 79 7.552 -12.894 -5.259 660 HG3 GLU 79 1HG GLU 79 7.546 -13.546 -3.621 661 H LEU 80 H LEU 80 3.993 -12.099 -1.918 662 HA LEU 80 HA LEU 80 1.565 -11.343 -3.200 663 HB2 LEU 80 2HB LEU 80 2.171 -11.930 -0.307 664 HB3 LEU 80 1HB LEU 80 0.560 -11.631 -0.931 665 HG LEU 80 HG LEU 80 2.364 -13.930 -1.683 666 HD11 LEU 80 1HD1 LEU 80 1.402 -14.165 0.525 667 HD12 LEU 80 2HD1 LEU 80 0.633 -15.289 -0.597 668 HD13 LEU 80 3HD1 LEU 80 -0.203 -13.812 -0.112 669 HD21 LEU 80 3HD2 LEU 80 -0.436 -13.291 -2.612 670 HD22 LEU 80 1HD2 LEU 80 0.476 -14.750 -2.994 671 HD23 LEU 80 2HD2 LEU 80 1.027 -13.185 -3.593 672 H ASN 81 H ASN 81 3.711 -9.746 -0.880 673 HA ASN 81 HA ASN 81 2.038 -7.548 -0.345 674 HB2 ASN 81 2HB ASN 81 5.047 -7.797 -0.268 675 HB3 ASN 81 1HB ASN 81 4.197 -6.332 0.213 676 HD21 ASN 81 1HD2 ASN 81 5.855 -7.860 1.905 677 HD22 ASN 81 2HD2 ASN 81 4.857 -8.525 3.157 678 H TYR 82 H TYR 82 4.491 -8.051 -2.848 679 HA TYR 82 HA TYR 82 4.244 -5.508 -4.027 680 HB2 TYR 82 2HB TYR 82 5.412 -8.104 -4.824 681 HB3 TYR 82 1HB TYR 82 4.994 -7.006 -6.140 682 HD1 TYR 82 HD1 TYR 82 7.111 -7.452 -3.159 683 HD2 TYR 82 HD2 TYR 82 6.175 -4.949 -6.468 684 HE1 TYR 82 HE1 TYR 82 9.157 -6.150 -2.750 685 HE2 TYR 82 HE2 TYR 82 8.220 -3.646 -6.074 686 HH TYR 82 HH TYR 82 9.756 -3.149 -4.242 687 H LYS 83 H LYS 83 2.580 -8.567 -4.718 688 HA LYS 83 HA LYS 83 1.021 -7.635 -6.865 689 HB2 LYS 83 2HB LYS 83 0.537 -9.819 -4.845 690 HB3 LYS 83 1HB LYS 83 -0.567 -9.498 -6.172 691 HG2 LYS 83 2HG LYS 83 1.248 -9.948 -7.765 692 HG3 LYS 83 1HG LYS 83 2.319 -10.324 -6.412 693 HD2 LYS 83 2HD LYS 83 0.847 -12.142 -5.735 694 HD3 LYS 83 1HD LYS 83 -0.267 -11.743 -7.043 695 HE2 LYS 83 2HE LYS 83 2.591 -12.643 -7.391 696 HE3 LYS 83 1HE LYS 83 1.168 -13.667 -7.577 697 HZ1 LYS 83 3HZ LYS 83 1.744 -13.010 -9.727 698 HZ2 LYS 83 1HZ LYS 83 2.029 -11.399 -9.275 699 HZ3 LYS 83 2HZ LYS 83 0.444 -11.999 -9.323 700 H HIS 84 H HIS 84 0.632 -7.321 -3.416 701 HA HIS 84 HA HIS 84 -2.129 -6.525 -3.578 702 HB2 HIS 84 2HB HIS 84 -1.322 -7.771 -1.639 703 HB3 HIS 84 1HB HIS 84 -0.185 -6.481 -1.261 704 HD1 HIS 84 HD1 HIS 84 -0.981 -5.220 0.689 705 HD2 HIS 84 HD2 HIS 84 -4.134 -6.427 -1.739 706 HE1 HIS 84 HE1 HIS 84 -3.057 -4.308 1.781 707 HE2 HIS 84 HE2 HIS 84 -4.937 -4.941 0.225 708 H LEU 85 H LEU 85 0.959 -4.895 -3.504 709 HA LEU 85 HA LEU 85 -0.393 -2.346 -2.973 710 HB2 LEU 85 2HB LEU 85 2.548 -3.027 -2.971 711 HB3 LEU 85 1HB LEU 85 1.881 -1.444 -2.620 712 HG LEU 85 HG LEU 85 1.409 -3.942 -0.988 713 HD11 LEU 85 1HD1 LEU 85 3.682 -3.118 -0.757 714 HD12 LEU 85 2HD1 LEU 85 2.759 -2.804 0.711 715 HD13 LEU 85 3HD1 LEU 85 3.078 -1.495 -0.427 716 HD21 LEU 85 3HD2 LEU 85 0.312 -2.457 0.599 717 HD22 LEU 85 1HD2 LEU 85 -0.506 -2.418 -0.962 718 HD23 LEU 85 2HD2 LEU 85 0.557 -1.091 -0.491 719 H LEU 86 H LEU 86 2.014 -3.709 -5.244 720 HA LEU 86 HA LEU 86 1.539 -1.386 -6.985 721 HB2 LEU 86 2HB LEU 86 3.840 -3.339 -6.942 722 HB3 LEU 86 1HB LEU 86 3.682 -1.990 -8.049 723 HG LEU 86 HG LEU 86 3.913 -1.718 -5.050 724 HD11 LEU 86 1HD1 LEU 86 5.965 -2.608 -6.031 725 HD12 LEU 86 2HD1 LEU 86 6.182 -0.945 -5.484 726 HD13 LEU 86 3HD1 LEU 86 5.979 -1.289 -7.202 727 HD21 LEU 86 3HD2 LEU 86 3.966 0.309 -7.283 728 HD22 LEU 86 1HD2 LEU 86 4.342 0.653 -5.594 729 HD23 LEU 86 2HD2 LEU 86 2.720 0.132 -6.048 730 H GLY 87 H GLY 87 1.282 -4.824 -6.788 731 HA2 GLY 87 2HA GLY 87 0.218 -6.314 -8.194 732 HA3 GLY 87 1HA GLY 87 -0.207 -4.961 -9.234 733 H ARG 88 H ARG 88 3.075 -5.172 -8.428 734 HA ARG 88 HA ARG 88 3.689 -6.369 -11.042 735 HB2 ARG 88 2HB ARG 88 4.022 -3.964 -11.176 736 HB3 ARG 88 1HB ARG 88 4.998 -3.984 -9.716 737 HG2 ARG 88 2HG ARG 88 6.767 -5.132 -10.813 738 HG3 ARG 88 1HG ARG 88 5.765 -5.441 -12.230 739 HD2 ARG 88 2HD ARG 88 7.321 -3.625 -12.666 740 HD3 ARG 88 1HD ARG 88 5.659 -3.042 -12.685 741 HE ARG 88 HE ARG 88 7.239 -2.722 -10.233 742 HH11 ARG 88 1HH1 ARG 88 5.695 -1.307 -13.033 743 HH12 ARG 88 2HH1 ARG 88 5.790 0.324 -12.440 744 HH21 ARG 88 1HH2 ARG 88 7.409 -0.568 -9.445 745 HH22 ARG 88 2HH2 ARG 88 6.753 0.745 -10.385 746 H ALA 89 H ALA 89 5.185 -7.928 -11.042 747 HA ALA 89 HA ALA 89 5.961 -9.189 -8.664 748 HB1 ALA 89 3HB ALA 89 7.302 -10.642 -10.083 749 HB2 ALA 89 1HB ALA 89 7.163 -9.495 -11.416 750 HB3 ALA 89 2HB ALA 89 5.731 -10.337 -10.826 751 HA PRO 90 HA PRO 90 9.681 -7.297 -7.167 752 HB2 PRO 90 2HB PRO 90 11.337 -9.570 -7.159 753 HB3 PRO 90 1HB PRO 90 10.335 -8.997 -5.824 754 HG2 PRO 90 2HG PRO 90 9.784 -11.127 -7.830 755 HG3 PRO 90 1HG PRO 90 9.314 -11.037 -6.122 756 HD2 PRO 90 2HD PRO 90 7.543 -10.595 -8.077 757 HD3 PRO 90 1HD PRO 90 7.503 -9.651 -6.572 758 H TYR 91 H TYR 91 11.569 -6.426 -7.938 759 HA TYR 91 HA TYR 91 11.665 -6.300 -10.765 760 HB2 TYR 91 2HB TYR 91 13.535 -5.124 -8.706 761 HB3 TYR 91 1HB TYR 91 13.497 -4.688 -10.412 762 HD1 TYR 91 HD2 TYR 91 11.284 -3.733 -11.329 763 HD2 TYR 91 HD1 TYR 91 12.168 -3.998 -7.173 764 HE1 TYR 91 HE2 TYR 91 9.563 -2.040 -10.863 765 HE2 TYR 91 HE1 TYR 91 10.446 -2.303 -6.698 766 HH TYR 91 HH TYR 91 9.334 -0.397 -7.985 767 H ASP 92 H ASP 92 13.665 -7.946 -8.392 768 HA ASP 92 HA ASP 92 14.931 -9.487 -10.486 769 HB2 ASP 92 2HB ASP 92 16.319 -7.405 -10.345 770 HB3 ASP 92 1HB ASP 92 16.653 -7.789 -8.662 771 H GLU 93 H GLU 93 16.419 -11.164 -9.517 772 HA GLU 93 HA GLU 93 15.241 -12.463 -7.310 773 HB2 GLU 93 2HB GLU 93 16.611 -13.552 -9.111 774 HB3 GLU 93 1HB GLU 93 18.045 -12.844 -8.380 775 HG2 GLU 93 2HG GLU 93 17.926 -15.076 -7.632 776 HG3 GLU 93 1HG GLU 93 17.446 -14.062 -6.272 777 H SER 94 H SER 94 18.088 -10.400 -7.664 778 HA SER 94 HA SER 94 19.002 -10.568 -4.988 779 HB2 SER 94 2HB SER 94 19.357 -8.153 -6.754 780 HB3 SER 94 1HB SER 94 20.477 -8.823 -5.566 781 HG SER 94 HG SER 94 19.868 -9.726 -8.166 782 H GLU 95 H GLU 95 16.702 -8.524 -6.654 783 HA GLU 95 HA GLU 95 16.149 -6.640 -4.672 784 HB2 GLU 95 2HB GLU 95 15.266 -7.157 -7.196 785 HB3 GLU 95 1HB GLU 95 13.869 -7.653 -6.255 786 HG2 GLU 95 2HG GLU 95 15.190 -4.965 -6.048 787 HG3 GLU 95 1HG GLU 95 13.786 -5.315 -7.056 788 H VAL 96 H VAL 96 14.777 -9.839 -5.313 789 HA VAL 96 HA VAL 96 13.006 -9.953 -3.140 790 HB VAL 96 HB VAL 96 14.497 -12.233 -4.457 791 HG11 VAL 96 1HG1 VAL 96 12.014 -12.253 -2.742 792 HG12 VAL 96 2HG1 VAL 96 13.593 -12.905 -2.308 793 HG13 VAL 96 3HG1 VAL 96 12.665 -13.642 -3.614 794 HG21 VAL 96 3HG2 VAL 96 12.429 -12.530 -5.760 795 HG22 VAL 96 1HG2 VAL 96 13.199 -10.975 -6.070 796 HG23 VAL 96 2HG2 VAL 96 11.777 -11.063 -5.031 797 H ILE 97 H ILE 97 16.413 -10.889 -3.427 798 HA ILE 97 HA ILE 97 16.767 -11.990 -0.879 799 HB ILE 97 HB ILE 97 18.810 -10.437 -2.483 800 HG12 ILE 97 2HG1 ILE 97 17.855 -12.253 -3.811 801 HG13 ILE 97 1HG1 ILE 97 19.509 -12.638 -3.355 802 HG21 ILE 97 1HG2 ILE 97 20.466 -11.769 -1.259 803 HG22 ILE 97 2HG2 ILE 97 19.170 -12.498 -0.312 804 HG23 ILE 97 3HG2 ILE 97 19.496 -10.770 -0.175 805 HD11 ILE 97 3HD1 ILE 97 18.703 -14.121 -1.617 806 HD12 ILE 97 1HD1 ILE 97 18.032 -14.570 -3.185 807 HD13 ILE 97 2HD1 ILE 97 17.037 -13.702 -2.014 808 H PHE 98 H PHE 98 17.065 -8.652 -2.011 809 HA PHE 98 HA PHE 98 17.906 -7.461 0.372 810 HB2 PHE 98 2HB PHE 98 17.908 -6.255 -1.744 811 HB3 PHE 98 1HB PHE 98 16.152 -6.342 -1.826 812 HD1 PHE 98 HD1 PHE 98 18.954 -4.938 0.152 813 HD2 PHE 98 HD2 PHE 98 14.826 -4.685 -0.854 814 HE1 PHE 98 HE1 PHE 98 18.802 -2.790 1.335 815 HE2 PHE 98 HE2 PHE 98 14.668 -2.532 0.331 816 HZ PHE 98 HZ PHE 98 16.661 -1.582 1.426 817 H HIS 99 H HIS 99 14.643 -8.173 -0.806 818 HA HIS 99 HA HIS 99 13.322 -6.984 1.426 819 HB2 HIS 99 2HB HIS 99 12.406 -8.835 -0.757 820 HB3 HIS 99 1HB HIS 99 11.344 -8.394 0.575 821 HD1 HIS 99 HD1 HIS 99 10.238 -6.128 0.498 822 HD2 HIS 99 HD2 HIS 99 13.119 -6.657 -2.460 823 HE1 HIS 99 HE1 HIS 99 9.980 -4.167 -1.069 824 HE2 HIS 99 HE2 HIS 99 11.541 -4.681 -2.987 825 H LEU 100 H LEU 100 14.381 -10.268 0.672 826 HA LEU 100 HA LEU 100 13.219 -11.602 2.842 827 HB2 LEU 100 2HB LEU 100 15.845 -12.068 1.426 828 HB3 LEU 100 1HB LEU 100 15.222 -13.144 2.661 829 HG LEU 100 HG LEU 100 13.780 -12.525 0.080 830 HD11 LEU 100 1HD1 LEU 100 14.483 -14.740 -0.643 831 HD12 LEU 100 2HD1 LEU 100 15.416 -14.941 0.840 832 HD13 LEU 100 3HD1 LEU 100 15.883 -13.711 -0.335 833 HD21 LEU 100 3HD2 LEU 100 13.315 -14.636 2.186 834 HD22 LEU 100 1HD2 LEU 100 12.407 -14.446 0.689 835 HD23 LEU 100 2HD2 LEU 100 12.324 -13.199 1.934 836 H ASP 101 H ASP 101 16.350 -9.984 2.570 837 HA ASP 101 HA ASP 101 17.123 -10.290 5.266 838 HB2 ASP 101 2HB ASP 101 18.748 -9.726 3.566 839 HB3 ASP 101 1HB ASP 101 17.898 -8.227 3.197 840 H LEU 102 H LEU 102 15.227 -7.853 3.587 841 HA LEU 102 HA LEU 102 15.083 -5.950 5.655 842 HB2 LEU 102 2HB LEU 102 14.440 -5.516 3.307 843 HB3 LEU 102 1HB LEU 102 13.053 -6.568 3.502 844 HG LEU 102 HG LEU 102 12.157 -5.011 5.218 845 HD11 LEU 102 1HD1 LEU 102 14.480 -3.285 4.370 846 HD12 LEU 102 2HD1 LEU 102 14.226 -3.995 5.964 847 HD13 LEU 102 3HD1 LEU 102 13.123 -2.756 5.365 848 HD21 LEU 102 3HD2 LEU 102 11.435 -4.889 2.884 849 HD22 LEU 102 1HD2 LEU 102 12.745 -3.760 2.538 850 HD23 LEU 102 2HD2 LEU 102 11.448 -3.296 3.641 851 H TYR 103 H TYR 103 13.050 -8.727 4.848 852 HA TYR 103 HA TYR 103 11.084 -8.351 6.825 853 HB2 TYR 103 2HB TYR 103 11.006 -9.934 4.828 854 HB3 TYR 103 1HB TYR 103 12.018 -11.024 5.765 855 HD1 TYR 103 HD1 TYR 103 11.097 -11.920 7.974 856 HD2 TYR 103 HD2 TYR 103 8.677 -9.908 5.106 857 HE1 TYR 103 HE1 TYR 103 9.083 -12.907 8.987 858 HE2 TYR 103 HE2 TYR 103 6.661 -10.886 6.113 859 HH TYR 103 HH TYR 103 6.665 -12.444 9.138 860 H GLU 104 H GLU 104 14.224 -9.949 6.878 861 HA GLU 104 HA GLU 104 13.885 -11.033 9.509 862 HB2 GLU 104 2HB GLU 104 16.437 -10.573 7.957 863 HB3 GLU 104 1HB GLU 104 16.258 -11.582 9.385 864 HG2 GLU 104 2HG GLU 104 14.701 -13.020 8.122 865 HG3 GLU 104 1HG GLU 104 15.018 -12.046 6.685 866 H ASN 105 H ASN 105 15.609 -8.240 8.156 867 HA ASN 105 HA ASN 105 16.768 -7.440 10.630 868 HB2 ASN 105 2HB ASN 105 16.788 -6.541 7.870 869 HB3 ASN 105 1HB ASN 105 16.705 -5.181 8.984 870 HD21 ASN 105 1HD2 ASN 105 18.574 -7.859 7.858 871 HD22 ASN 105 2HD2 ASN 105 20.054 -7.418 8.631 872 H GLU 106 H GLU 106 14.179 -5.966 8.680 873 HA GLU 106 HA GLU 106 13.505 -4.284 10.994 874 HB2 GLU 106 2HB GLU 106 12.713 -3.955 8.094 875 HB3 GLU 106 1HB GLU 106 12.434 -2.800 9.389 876 HG2 GLU 106 2HG GLU 106 15.181 -3.679 8.560 877 HG3 GLU 106 1HG GLU 106 14.352 -2.306 7.831 878 H GLY 107 H GLY 107 12.148 -6.499 8.622 879 HA2 GLY 107 2HA GLY 107 10.472 -8.070 9.437 880 HA3 GLY 107 1HA GLY 107 9.786 -6.750 10.373 881 H PHE 108 H PHE 108 8.013 -8.015 9.014 882 HA PHE 108 HA PHE 108 7.590 -7.345 6.328 883 HB2 PHE 108 2HB PHE 108 5.145 -7.812 6.899 884 HB3 PHE 108 1HB PHE 108 6.286 -9.112 7.222 885 HD1 PHE 108 HD2 PHE 108 4.133 -6.556 8.727 886 HD2 PHE 108 HD1 PHE 108 6.770 -9.813 9.466 887 HE1 PHE 108 HE2 PHE 108 3.373 -6.642 11.067 888 HE2 PHE 108 HE1 PHE 108 6.011 -9.905 11.804 889 HZ PHE 108 HZ PHE 108 4.311 -8.316 12.606 890 H ASP 109 H ASP 109 7.144 -5.518 9.238 891 HA ASP 109 HA ASP 109 5.396 -3.523 8.446 892 HB2 ASP 109 2HB ASP 109 7.686 -3.660 10.341 893 HB3 ASP 109 1HB ASP 109 7.126 -2.056 9.883 894 H ALA 110 H ALA 110 8.941 -3.438 8.201 895 HA ALA 110 HA ALA 110 9.010 -1.071 6.670 896 HB1 ALA 110 3HB ALA 110 10.902 -1.831 8.014 897 HB2 ALA 110 1HB ALA 110 11.364 -1.560 6.333 898 HB3 ALA 110 2HB ALA 110 11.122 -3.203 6.927 899 H ASP 111 H ASP 111 8.717 -4.452 5.799 900 HA ASP 111 HA ASP 111 9.418 -4.183 3.077 901 HB2 ASP 111 2HB ASP 111 9.122 -6.371 4.305 902 HB3 ASP 111 1HB ASP 111 7.382 -6.132 4.176 903 H ILE 112 H ILE 112 6.298 -3.937 4.753 904 HA ILE 112 HA ILE 112 4.783 -3.209 2.465 905 HB ILE 112 HB ILE 112 4.264 -2.463 5.355 906 HG12 ILE 112 2HG1 ILE 112 4.492 -4.911 5.024 907 HG13 ILE 112 1HG1 ILE 112 2.865 -4.441 5.499 908 HG21 ILE 112 1HG2 ILE 112 2.967 -1.132 3.796 909 HG22 ILE 112 2HG2 ILE 112 1.926 -2.251 4.675 910 HG23 ILE 112 3HG2 ILE 112 2.383 -2.595 3.005 911 HD11 ILE 112 3HD1 ILE 112 2.128 -4.651 3.186 912 HD12 ILE 112 1HD1 ILE 112 2.825 -6.153 3.793 913 HD13 ILE 112 2HD1 ILE 112 3.761 -5.122 2.711 914 H ASP 113 H ASP 113 6.432 -1.362 4.983 915 HA ASP 113 HA ASP 113 5.640 1.197 4.126 916 HB2 ASP 113 2HB ASP 113 7.864 0.206 5.876 917 HB3 ASP 113 1HB ASP 113 7.778 1.907 5.426 918 H SER 114 H SER 114 8.029 -0.946 2.862 919 HA SER 114 HA SER 114 9.893 0.686 1.706 920 HB2 SER 114 2HB SER 114 8.543 -1.710 0.444 921 HB3 SER 114 1HB SER 114 10.051 -0.988 -0.119 922 HG SER 114 HG SER 114 9.671 -1.964 2.522 923 H TYR 115 H TYR 115 6.623 0.029 0.478 924 HA TYR 115 HA TYR 115 6.995 1.927 -1.690 925 HB2 TYR 115 2HB TYR 115 5.721 0.088 -2.382 926 HB3 TYR 115 1HB TYR 115 4.765 0.074 -0.904 927 HD1 TYR 115 HD2 TYR 115 5.438 2.236 -3.881 928 HD2 TYR 115 HD1 TYR 115 2.634 0.976 -0.941 929 HE1 TYR 115 HE2 TYR 115 3.690 3.568 -4.983 930 HE2 TYR 115 HE1 TYR 115 0.878 2.305 -2.034 931 HH TYR 115 HH TYR 115 0.742 4.300 -3.531 932 H ILE 116 H ILE 116 4.983 1.664 1.232 933 HA ILE 116 HA ILE 116 3.473 3.997 0.561 934 HB ILE 116 HB ILE 116 3.554 2.498 3.182 935 HG12 ILE 116 2HG1 ILE 116 1.706 2.165 0.804 936 HG13 ILE 116 1HG1 ILE 116 3.010 1.063 1.229 937 HG21 ILE 116 1HG2 ILE 116 2.541 4.692 3.403 938 HG22 ILE 116 2HG2 ILE 116 1.297 3.447 3.487 939 HG23 ILE 116 3HG2 ILE 116 1.510 4.382 2.008 940 HD11 ILE 116 3HD1 ILE 116 0.841 0.217 1.926 941 HD12 ILE 116 1HD1 ILE 116 0.595 1.655 2.918 942 HD13 ILE 116 2HD1 ILE 116 1.887 0.520 3.313 943 H ASP 117 H ASP 117 6.283 3.413 2.564 944 HA ASP 117 HA ASP 117 5.993 5.942 3.951 945 HB2 ASP 117 2HB ASP 117 6.918 3.831 5.014 946 HB3 ASP 117 1HB ASP 117 8.366 4.071 4.042 947 H SER 118 H SER 118 7.267 4.898 1.011 948 HA SER 118 HA SER 118 9.264 7.038 0.929 949 HB2 SER 118 2HB SER 118 10.022 5.921 -1.178 950 HB3 SER 118 1HB SER 118 10.122 4.887 0.246 951 HG SER 118 HG SER 118 8.847 3.552 -0.735 952 HA PRO 119 HA PRO 119 6.193 9.520 -1.128 953 HB2 PRO 119 2HB PRO 119 7.961 11.515 -1.847 954 HB3 PRO 119 1HB PRO 119 7.145 11.404 -0.285 955 HG2 PRO 119 2HG PRO 119 9.915 10.588 -1.042 956 HG3 PRO 119 1HG PRO 119 9.339 11.362 0.447 957 HD2 PRO 119 2HD PRO 119 9.911 8.735 0.341 958 HD3 PRO 119 1HD PRO 119 8.584 9.364 1.342 959 H GLU 120 H GLU 120 9.373 8.847 -2.585 960 HA GLU 120 HA GLU 120 8.761 9.708 -5.175 961 HB2 GLU 120 2HB GLU 120 11.049 9.175 -4.299 962 HB3 GLU 120 1HB GLU 120 10.651 7.469 -4.446 963 HG2 GLU 120 2HG GLU 120 11.962 8.194 -6.339 964 HG3 GLU 120 1HG GLU 120 10.334 7.749 -6.855 965 H TYR 121 H TYR 121 8.414 6.510 -3.682 966 HA TYR 121 HA TYR 121 7.605 5.248 -6.099 967 HB2 TYR 121 2HB TYR 121 7.554 4.399 -3.212 968 HB3 TYR 121 1HB TYR 121 6.874 3.392 -4.489 969 HD1 TYR 121 HD1 TYR 121 8.306 2.377 -6.171 970 HD2 TYR 121 HD2 TYR 121 9.950 4.695 -3.006 971 HE1 TYR 121 HE1 TYR 121 10.531 1.464 -6.669 972 HE2 TYR 121 HE2 TYR 121 12.184 3.794 -3.499 973 HH TYR 121 HH TYR 121 12.932 2.207 -6.337 974 H THR 122 H THR 122 5.883 6.743 -3.419 975 HA THR 122 HA THR 122 3.313 5.823 -4.308 976 HB THR 122 HB THR 122 3.909 8.129 -2.442 977 HG1 THR 122 HG1 THR 122 4.798 6.014 -1.797 978 HG21 THR 122 3HG2 THR 122 1.659 7.670 -1.577 979 HG22 THR 122 1HG2 THR 122 1.450 6.407 -2.790 980 HG23 THR 122 2HG2 THR 122 1.616 8.091 -3.289 981 H ASN 123 H ASN 123 4.996 8.967 -4.406 982 HA ASN 123 HA ASN 123 3.038 10.367 -5.848 983 HB2 ASN 123 2HB ASN 123 6.024 10.799 -5.661 984 HB3 ASN 123 1HB ASN 123 4.937 11.909 -6.485 985 HD21 ASN 123 1HD2 ASN 123 5.401 13.603 -5.123 986 HD22 ASN 123 2HD2 ASN 123 4.849 13.659 -3.483 987 H SER 124 H SER 124 5.293 7.999 -6.840 988 HA SER 124 HA SER 124 5.875 8.548 -9.444 989 HB2 SER 124 2HB SER 124 6.653 6.548 -8.214 990 HB3 SER 124 1HB SER 124 5.041 5.851 -8.354 991 HG SER 124 HG SER 124 6.424 6.683 -10.663 992 H PHE 125 H PHE 125 2.843 7.006 -8.287 993 HA PHE 125 HA PHE 125 1.687 7.779 -10.875 994 HB2 PHE 125 2HB PHE 125 0.351 5.711 -10.918 995 HB3 PHE 125 1HB PHE 125 2.080 5.409 -11.005 996 HD1 PHE 125 HD2 PHE 125 3.251 4.366 -9.153 997 HD2 PHE 125 HD1 PHE 125 -0.953 5.000 -9.041 998 HE1 PHE 125 HE2 PHE 125 3.063 2.765 -7.292 999 HE2 PHE 125 HE1 PHE 125 -1.151 3.399 -7.189 1000 HZ PHE 125 HZ PHE 125 0.860 2.278 -6.310 1001 H GLY 126 H GLY 126 1.359 7.889 -7.482 1002 HA2 GLY 126 2HA GLY 126 -0.453 9.835 -7.350 1003 HA3 GLY 126 1HA GLY 126 -1.495 8.457 -7.646 1004 H ASP 127 H ASP 127 -1.200 10.320 -5.367 1005 HA ASP 127 HA ASP 127 -0.274 8.645 -3.175 1006 HB2 ASP 127 2HB ASP 127 -1.620 11.361 -3.113 1007 HB3 ASP 127 1HB ASP 127 -0.862 10.552 -1.748 1008 H TRP 128 H TRP 128 -3.195 9.713 -4.700 1009 HA TRP 128 HA TRP 128 -4.835 8.609 -2.526 1010 HB2 TRP 128 2HB TRP 128 -5.572 10.449 -4.814 1011 HB3 TRP 128 1HB TRP 128 -6.667 9.917 -3.544 1012 HD1 TRP 128 HD1 TRP 128 -3.744 12.305 -4.176 1013 HE1 TRP 128 HE1 TRP 128 -3.619 13.995 -2.230 1014 HE3 TRP 128 HE3 TRP 128 -7.214 10.213 -1.062 1015 HZ2 TRP 128 HZ2 TRP 128 -4.832 14.376 0.288 1016 HZ3 TRP 128 HZ3 TRP 128 -7.674 11.298 1.095 1017 HH2 TRP 128 HH2 TRP 128 -6.507 13.339 1.755 1018 H VAL 129 H VAL 129 -3.449 7.143 -4.813 1019 HA VAL 129 HA VAL 129 -5.741 6.132 -6.311 1020 HB VAL 129 HB VAL 129 -2.804 5.490 -6.638 1021 HG11 VAL 129 1HG1 VAL 129 -4.213 3.703 -7.476 1022 HG12 VAL 129 2HG1 VAL 129 -3.463 4.569 -8.817 1023 HG13 VAL 129 3HG1 VAL 129 -5.156 4.860 -8.419 1024 HG21 VAL 129 3HG2 VAL 129 -2.922 6.945 -8.621 1025 HG22 VAL 129 1HG2 VAL 129 -3.230 7.823 -7.124 1026 HG23 VAL 129 2HG2 VAL 129 -4.572 7.386 -8.182 1027 H VAL 130 H VAL 130 -6.495 4.072 -6.173 1028 HA VAL 130 HA VAL 130 -5.905 2.556 -3.815 1029 HB VAL 130 HB VAL 130 -7.649 1.931 -6.208 1030 HG11 VAL 130 1HG1 VAL 130 -8.653 0.169 -4.846 1031 HG12 VAL 130 2HG1 VAL 130 -7.483 0.486 -3.566 1032 HG13 VAL 130 3HG1 VAL 130 -6.939 -0.137 -5.123 1033 HG21 VAL 130 3HG2 VAL 130 -8.330 2.893 -3.436 1034 HG22 VAL 130 1HG2 VAL 130 -9.494 2.469 -4.690 1035 HG23 VAL 130 2HG2 VAL 130 -8.409 3.841 -4.923 1036 HA PRO 131 HA PRO 131 -2.430 0.069 -4.998 1037 HB2 PRO 131 2HB PRO 131 -3.759 -2.314 -4.081 1038 HB3 PRO 131 1HB PRO 131 -2.455 -1.414 -3.307 1039 HG2 PRO 131 2HG PRO 131 -5.354 -1.313 -2.808 1040 HG3 PRO 131 1HG PRO 131 -4.013 -0.857 -1.744 1041 HD2 PRO 131 2HD PRO 131 -5.626 0.981 -2.865 1042 HD3 PRO 131 1HD PRO 131 -3.893 1.290 -2.612 1043 H TYR 132 H TYR 132 -2.007 -0.515 -6.968 1044 HA TYR 132 HA TYR 132 -4.104 -1.426 -8.752 1045 HB2 TYR 132 2HB TYR 132 -1.635 0.027 -8.969 1046 HB3 TYR 132 1HB TYR 132 -1.595 -1.351 -10.058 1047 HD1 TYR 132 HD1 TYR 132 -3.297 1.799 -9.263 1048 HD2 TYR 132 HD2 TYR 132 -3.013 -1.445 -11.995 1049 HE1 TYR 132 HE1 TYR 132 -4.591 3.084 -10.912 1050 HE2 TYR 132 HE2 TYR 132 -4.309 -0.176 -13.651 1051 HH TYR 132 HH TYR 132 -4.865 3.153 -13.363 1052 H TYR 133 H TYR 133 -4.245 -3.473 -9.632 1053 HA TYR 133 HA TYR 133 -1.856 -5.170 -9.380 1054 HB2 TYR 133 2HB TYR 133 -4.098 -6.118 -8.563 1055 HB3 TYR 133 1HB TYR 133 -4.569 -6.162 -10.262 1056 HD1 TYR 133 HD2 TYR 133 -2.022 -7.400 -7.862 1057 HD2 TYR 133 HD1 TYR 133 -3.889 -7.956 -11.645 1058 HE1 TYR 133 HE2 TYR 133 -0.864 -9.553 -8.106 1059 HE2 TYR 133 HE1 TYR 133 -2.731 -10.112 -11.904 1060 HH TYR 133 HH TYR 133 -0.865 -11.324 -11.092 1061 H ARG 134 H ARG 134 -0.650 -5.381 -11.163 1062 HA ARG 134 HA ARG 134 -1.414 -3.925 -13.500 1063 HB2 ARG 134 2HB ARG 134 0.958 -4.434 -12.392 1064 HB3 ARG 134 1HB ARG 134 0.919 -5.781 -13.518 1065 HG2 ARG 134 2HG ARG 134 0.530 -2.918 -14.344 1066 HG3 ARG 134 1HG ARG 134 2.094 -3.730 -14.328 1067 HD2 ARG 134 2HD ARG 134 1.144 -5.439 -15.866 1068 HD3 ARG 134 1HD ARG 134 -0.327 -4.470 -15.962 1069 HE ARG 134 HE ARG 134 0.920 -2.761 -17.076 1070 HH11 ARG 134 1HH1 ARG 134 2.684 -5.746 -16.563 1071 HH12 ARG 134 2HH1 ARG 134 3.856 -5.404 -17.796 1072 HH21 ARG 134 1HH2 ARG 134 2.467 -2.312 -18.685 1073 HH22 ARG 134 2HH2 ARG 134 3.746 -3.451 -18.998 1074 H GLY 135 H GLY 135 -3.058 -4.809 -14.623 1075 HA2 GLY 135 2HA GLY 135 -3.555 -6.241 -16.500 1076 HA3 GLY 135 1HA GLY 135 -2.639 -7.516 -15.705 1077 H LEU 136 H LEU 136 -3.894 -9.074 -14.988 1078 HA LEU 136 HA LEU 136 -5.433 -10.209 -13.837 1079 HB2 LEU 136 2HB LEU 136 -5.161 -8.418 -12.135 1080 HB3 LEU 136 1HB LEU 136 -6.485 -7.546 -12.891 1081 HG LEU 136 HG LEU 136 -7.834 -9.679 -12.513 1082 HD11 LEU 136 1HD1 LEU 136 -5.610 -10.153 -10.543 1083 HD12 LEU 136 2HD1 LEU 136 -5.990 -11.145 -11.950 1084 HD13 LEU 136 3HD1 LEU 136 -7.133 -11.044 -10.613 1085 HD21 LEU 136 3HD2 LEU 136 -8.442 -8.968 -10.243 1086 HD22 LEU 136 1HD2 LEU 136 -8.238 -7.589 -11.324 1087 HD23 LEU 136 2HD2 LEU 136 -6.974 -7.992 -10.164 1088 H GLU 137 H GLU 137 -6.852 -7.305 -15.326 1089 HA GLU 137 HA GLU 137 -9.330 -8.696 -15.847 1090 HB2 GLU 137 2HB GLU 137 -9.304 -6.305 -15.228 1091 HB3 GLU 137 1HB GLU 137 -8.422 -5.943 -16.707 1092 HG2 GLU 137 2HG GLU 137 -10.752 -5.410 -16.989 1093 HG3 GLU 137 1HG GLU 137 -10.321 -6.772 -18.021 1094 H HIS 138 H HIS 138 -9.456 -10.082 -17.467 1095 HA HIS 138 HA HIS 138 -8.546 -9.140 -20.075 1096 HB2 HIS 138 2HB HIS 138 -8.000 -11.596 -20.638 1097 HB3 HIS 138 1HB HIS 138 -6.830 -10.658 -19.727 1098 HD1 HIS 138 HD1 HIS 138 -6.172 -11.511 -17.452 1099 HD2 HIS 138 HD2 HIS 138 -9.372 -13.592 -19.110 1100 HE1 HIS 138 HE1 HIS 138 -6.508 -13.529 -15.984 1101 HE2 HIS 138 HE2 HIS 138 -8.320 -14.863 -17.116 1102 H HIS 139 H HIS 139 -10.787 -8.505 -19.997 1103 HA HIS 139 HA HIS 139 -12.439 -10.608 -21.210 1104 HB2 HIS 139 2HB HIS 139 -13.297 -8.548 -19.172 1105 HB3 HIS 139 1HB HIS 139 -14.449 -9.324 -20.251 1106 HD1 HIS 139 HD1 HIS 139 -12.779 -9.732 -17.055 1107 HD2 HIS 139 HD2 HIS 139 -14.552 -12.226 -19.875 1108 HE1 HIS 139 HE1 HIS 139 -13.260 -11.892 -15.848 1109 HE2 HIS 139 HE2 HIS 139 -14.486 -13.318 -17.530 1110 H HIS 140 H HIS 140 -12.347 -10.036 -23.296 1111 HA HIS 140 HA HIS 140 -13.611 -7.565 -24.054 1112 HB2 HIS 140 2HB HIS 140 -11.167 -6.960 -23.769 1113 HB3 HIS 140 1HB HIS 140 -10.807 -8.078 -25.077 1114 HD1 HIS 140 HD1 HIS 140 -10.877 -4.685 -24.700 1115 HD2 HIS 140 HD2 HIS 140 -12.886 -7.200 -27.335 1116 HE1 HIS 140 HE1 HIS 140 -11.508 -3.251 -26.669 1117 HE2 HIS 140 HE2 HIS 140 -12.852 -4.760 -28.178 1118 H HIS 141 H HIS 141 -15.097 -9.159 -24.765 1119 HA HIS 141 HA HIS 141 -16.218 -10.104 -26.472 1120 HB2 HIS 141 2HB HIS 141 -15.789 -9.310 -28.516 1121 HB3 HIS 141 1HB HIS 141 -14.427 -8.475 -27.795 1122 HD1 HIS 141 HD1 HIS 141 -12.036 -9.533 -28.230 1123 HD2 HIS 141 HD2 HIS 141 -15.174 -11.317 -30.297 1124 HE1 HIS 141 HE1 HIS 141 -10.967 -10.893 -30.059 1125 HE2 HIS 141 HE2 HIS 141 -12.887 -11.889 -31.352 1126 H HIS 142 H HIS 142 -16.627 -12.142 -27.068 1127 HA HIS 142 HA HIS 142 -14.409 -14.075 -26.894 1128 HB2 HIS 142 2HB HIS 142 -16.097 -15.720 -25.969 1129 HB3 HIS 142 1HB HIS 142 -15.643 -14.414 -24.885 1130 HD1 HIS 142 HD1 HIS 142 -18.538 -15.955 -26.585 1131 HD2 HIS 142 HD2 HIS 142 -17.708 -12.471 -24.462 1132 HE1 HIS 142 HE1 HIS 142 -20.775 -14.969 -25.986 1133 HE2 HIS 142 HE2 HIS 142 -20.252 -12.819 -24.778 1134 H HIS 143 H HIS 143 -16.814 -12.735 -28.740 1135 HA HIS 143 HA HIS 143 -16.502 -14.888 -30.717 1136 HB2 HIS 143 2HB HIS 143 -18.778 -15.091 -30.040 1137 HB3 HIS 143 1HB HIS 143 -19.004 -13.346 -30.029 1138 HD1 HIS 143 HD1 HIS 143 -19.945 -12.322 -32.093 1139 HD2 HIS 143 HD2 HIS 143 -18.486 -16.160 -32.767 1140 HE1 HIS 143 HE1 HIS 143 -20.593 -12.891 -34.454 1141 HE2 HIS 143 HE2 HIS 143 -19.531 -15.127 -34.900 Start of MODEL 20 1 H1 MET 1 1H MET 1 -10.018 6.509 -15.743 2 H2 MET 1 2H MET 1 -9.316 7.965 -16.236 3 H3 MET 1 3H MET 1 -9.946 7.817 -14.667 4 HA MET 1 HA MET 1 -7.596 6.387 -15.768 5 HB2 MET 1 2HB MET 1 -7.937 8.647 -13.793 6 HB3 MET 1 1HB MET 1 -6.480 7.669 -13.836 7 HG2 MET 1 2HG MET 1 -6.086 9.674 -15.058 8 HG3 MET 1 1HG MET 1 -6.155 8.334 -16.199 9 HE1 MET 1 3HE MET 1 -9.484 11.486 -15.628 10 HE2 MET 1 1HE MET 1 -7.903 11.568 -14.850 11 HE3 MET 1 2HE MET 1 -9.050 10.315 -14.383 12 HA PRO 2 HA PRO 2 -7.824 3.318 -12.494 13 HB2 PRO 2 2HB PRO 2 -5.487 4.564 -11.136 14 HB3 PRO 2 1HB PRO 2 -5.741 2.884 -11.619 15 HG2 PRO 2 2HG PRO 2 -4.098 4.489 -12.986 16 HG3 PRO 2 1HG PRO 2 -5.106 3.282 -13.809 17 HD2 PRO 2 2HD PRO 2 -5.428 6.235 -13.649 18 HD3 PRO 2 1HD PRO 2 -5.848 5.122 -14.966 19 H VAL 3 H VAL 3 -8.526 3.068 -10.346 20 HA VAL 3 HA VAL 3 -10.166 5.067 -9.353 21 HB VAL 3 HB VAL 3 -8.989 2.767 -7.779 22 HG11 VAL 3 1HG1 VAL 3 -10.001 4.417 -6.325 23 HG12 VAL 3 2HG1 VAL 3 -11.011 2.974 -6.400 24 HG13 VAL 3 3HG1 VAL 3 -11.468 4.418 -7.305 25 HG21 VAL 3 3HG2 VAL 3 -11.535 2.918 -9.393 26 HG22 VAL 3 1HG2 VAL 3 -11.033 1.562 -8.381 27 HG23 VAL 3 2HG2 VAL 3 -10.092 1.993 -9.808 28 H GLU 4 H GLU 4 -9.541 6.994 -8.688 29 HA GLU 4 HA GLU 4 -7.364 7.143 -6.713 30 HB2 GLU 4 2HB GLU 4 -6.839 9.370 -7.513 31 HB3 GLU 4 1HB GLU 4 -6.779 8.244 -8.858 32 HG2 GLU 4 2HG GLU 4 -9.211 9.911 -8.293 33 HG3 GLU 4 1HG GLU 4 -7.865 10.512 -9.256 34 H LEU 5 H LEU 5 -7.621 8.761 -5.055 35 HA LEU 5 HA LEU 5 -10.440 9.493 -4.606 36 HB2 LEU 5 2HB LEU 5 -9.417 7.935 -2.937 37 HB3 LEU 5 1HB LEU 5 -8.258 9.188 -2.538 38 HG LEU 5 HG LEU 5 -10.139 10.645 -1.816 39 HD11 LEU 5 1HD1 LEU 5 -12.337 9.650 -1.463 40 HD12 LEU 5 2HD1 LEU 5 -11.795 8.164 -2.241 41 HD13 LEU 5 3HD1 LEU 5 -11.902 9.660 -3.172 42 HD21 LEU 5 3HD2 LEU 5 -10.594 9.452 0.269 43 HD22 LEU 5 1HD2 LEU 5 -8.894 9.329 -0.184 44 HD23 LEU 5 2HD2 LEU 5 -9.977 7.963 -0.445 45 H ARG 6 H ARG 6 -10.599 11.491 -5.442 46 HA ARG 6 HA ARG 6 -8.453 13.402 -5.198 47 HB2 ARG 6 2HB ARG 6 -11.260 13.813 -6.252 48 HB3 ARG 6 1HB ARG 6 -9.896 14.903 -6.465 49 HG2 ARG 6 2HG ARG 6 -8.732 13.055 -7.695 50 HG3 ARG 6 1HG ARG 6 -10.249 12.155 -7.635 51 HD2 ARG 6 2HD ARG 6 -11.361 14.029 -8.798 52 HD3 ARG 6 1HD ARG 6 -9.802 14.844 -8.922 53 HE ARG 6 HE ARG 6 -10.772 12.708 -10.552 54 HH11 ARG 6 1HH1 ARG 6 -7.856 14.170 -9.262 55 HH12 ARG 6 2HH1 ARG 6 -6.831 13.534 -10.518 56 HH21 ARG 6 1HH2 ARG 6 -9.432 11.911 -12.213 57 HH22 ARG 6 2HH2 ARG 6 -7.729 12.244 -12.180 58 H ALA 7 H ALA 7 -8.759 15.535 -4.249 59 HA ALA 7 HA ALA 7 -9.827 15.329 -1.598 60 HB1 ALA 7 3HB ALA 7 -8.649 17.720 -3.007 61 HB2 ALA 7 1HB ALA 7 -7.742 16.525 -2.080 62 HB3 ALA 7 2HB ALA 7 -8.919 17.559 -1.272 63 H ASN 8 H ASN 8 -11.845 15.095 -3.554 64 HA ASN 8 HA ASN 8 -13.801 16.796 -2.448 65 HB2 ASN 8 2HB ASN 8 -12.708 18.391 -4.067 66 HB3 ASN 8 1HB ASN 8 -13.211 17.320 -5.369 67 HD21 ASN 8 1HD2 ASN 8 -15.346 17.238 -5.956 68 HD22 ASN 8 2HD2 ASN 8 -16.517 18.392 -5.407 69 H TRP 9 H TRP 9 -14.435 14.627 -2.081 70 HA TRP 9 HA TRP 9 -15.469 13.215 -4.450 71 HB2 TRP 9 2HB TRP 9 -15.134 11.130 -3.018 72 HB3 TRP 9 1HB TRP 9 -13.674 11.917 -3.609 73 HD1 TRP 9 HD1 TRP 9 -11.966 12.768 -1.847 74 HE1 TRP 9 HE1 TRP 9 -11.831 12.702 0.718 75 HE3 TRP 9 HE3 TRP 9 -16.729 11.226 -0.823 76 HZ2 TRP 9 HZ2 TRP 9 -13.520 12.087 2.890 77 HZ3 TRP 9 HZ3 TRP 9 -17.389 10.928 1.525 78 HH2 TRP 9 HH2 TRP 9 -15.818 11.348 3.342 79 H SER 10 H SER 10 -17.246 11.673 -3.939 80 HA SER 10 HA SER 10 -18.920 12.612 -1.709 81 HB2 SER 10 2HB SER 10 -19.938 12.936 -3.967 82 HB3 SER 10 1HB SER 10 -19.818 11.199 -4.240 83 HG SER 10 HG SER 10 -21.900 12.021 -3.436 84 H GLU 11 H GLU 11 -20.448 10.700 -1.008 85 HA GLU 11 HA GLU 11 -18.761 8.765 0.152 86 HB2 GLU 11 2HB GLU 11 -21.769 8.827 -0.100 87 HB3 GLU 11 1HB GLU 11 -20.881 7.679 0.892 88 HG2 GLU 11 2HG GLU 11 -19.966 9.535 2.205 89 HG3 GLU 11 1HG GLU 11 -20.888 10.670 1.223 90 H GLU 12 H GLU 12 -20.766 8.712 -2.721 91 HA GLU 12 HA GLU 12 -20.709 5.937 -3.217 92 HB2 GLU 12 2HB GLU 12 -22.004 7.994 -4.335 93 HB3 GLU 12 1HB GLU 12 -20.692 7.859 -5.496 94 HG2 GLU 12 2HG GLU 12 -22.413 5.527 -4.720 95 HG3 GLU 12 1HG GLU 12 -22.837 6.629 -6.027 96 H ASP 13 H ASP 13 -18.578 8.582 -4.244 97 HA ASP 13 HA ASP 13 -16.774 6.993 -5.733 98 HB2 ASP 13 2HB ASP 13 -16.271 9.619 -4.309 99 HB3 ASP 13 1HB ASP 13 -15.208 8.893 -5.509 100 H LEU 14 H LEU 14 -16.798 8.114 -2.385 101 HA LEU 14 HA LEU 14 -14.315 7.100 -1.599 102 HB2 LEU 14 2HB LEU 14 -15.687 8.693 -0.291 103 HB3 LEU 14 1HB LEU 14 -16.810 7.397 0.075 104 HG LEU 14 HG LEU 14 -14.926 6.192 1.215 105 HD11 LEU 14 1HD1 LEU 14 -12.958 7.484 1.851 106 HD12 LEU 14 2HD1 LEU 14 -13.524 8.839 0.873 107 HD13 LEU 14 3HD1 LEU 14 -13.072 7.318 0.099 108 HD21 LEU 14 3HD2 LEU 14 -15.037 7.544 3.232 109 HD22 LEU 14 1HD2 LEU 14 -16.614 7.465 2.448 110 HD23 LEU 14 2HD2 LEU 14 -15.624 8.918 2.296 111 H GLU 15 H GLU 15 -17.543 5.618 -1.456 112 HA GLU 15 HA GLU 15 -16.837 3.206 -0.244 113 HB2 GLU 15 2HB GLU 15 -19.151 3.983 -0.565 114 HB3 GLU 15 1HB GLU 15 -18.994 3.743 -2.299 115 HG2 GLU 15 2HG GLU 15 -20.218 1.925 -1.342 116 HG3 GLU 15 1HG GLU 15 -18.653 1.341 -1.904 117 H THR 16 H THR 16 -16.738 4.228 -3.603 118 HA THR 16 HA THR 16 -16.137 1.757 -4.784 119 HB THR 16 HB THR 16 -15.230 4.499 -5.693 120 HG1 THR 16 HG1 THR 16 -17.454 4.555 -5.534 121 HG21 THR 16 3HG2 THR 16 -15.632 1.922 -7.217 122 HG22 THR 16 1HG2 THR 16 -14.089 2.708 -6.883 123 HG23 THR 16 2HG2 THR 16 -15.265 3.487 -7.944 124 H VAL 17 H VAL 17 -14.060 4.277 -3.407 125 HA VAL 17 HA VAL 17 -11.598 3.040 -4.115 126 HB VAL 17 HB VAL 17 -12.165 5.080 -1.953 127 HG11 VAL 17 1HG1 VAL 17 -9.789 5.633 -2.111 128 HG12 VAL 17 2HG1 VAL 17 -9.557 4.323 -3.270 129 HG13 VAL 17 3HG1 VAL 17 -10.026 3.959 -1.609 130 HG21 VAL 17 3HG2 VAL 17 -11.403 6.725 -3.608 131 HG22 VAL 17 1HG2 VAL 17 -12.852 5.873 -4.141 132 HG23 VAL 17 2HG2 VAL 17 -11.280 5.443 -4.815 133 H ILE 18 H ILE 18 -13.455 3.190 -1.081 134 HA ILE 18 HA ILE 18 -11.654 1.793 0.538 135 HB ILE 18 HB ILE 18 -14.670 1.907 0.758 136 HG12 ILE 18 2HG1 ILE 18 -12.516 3.545 2.113 137 HG13 ILE 18 1HG1 ILE 18 -13.546 4.110 0.801 138 HG21 ILE 18 1HG2 ILE 18 -14.332 1.343 3.129 139 HG22 ILE 18 2HG2 ILE 18 -12.611 1.106 2.815 140 HG23 ILE 18 3HG2 ILE 18 -13.800 0.047 2.057 141 HD11 ILE 18 3HD1 ILE 18 -14.326 4.948 2.930 142 HD12 ILE 18 1HD1 ILE 18 -14.456 3.303 3.554 143 HD13 ILE 18 2HD1 ILE 18 -15.507 3.835 2.241 144 H ARG 19 H ARG 19 -14.456 0.556 -1.278 145 HA ARG 19 HA ARG 19 -14.106 -2.133 -0.477 146 HB2 ARG 19 2HB ARG 19 -16.256 -1.413 -1.250 147 HB3 ARG 19 1HB ARG 19 -15.590 -0.877 -2.785 148 HG2 ARG 19 2HG ARG 19 -15.068 -3.219 -3.341 149 HG3 ARG 19 1HG ARG 19 -15.828 -3.722 -1.831 150 HD2 ARG 19 2HD ARG 19 -17.952 -2.955 -2.542 151 HD3 ARG 19 1HD ARG 19 -17.258 -2.103 -3.922 152 HE ARG 19 HE ARG 19 -16.702 -4.897 -4.034 153 HH11 ARG 19 1HH1 ARG 19 -19.232 -2.536 -4.583 154 HH12 ARG 19 2HH1 ARG 19 -20.054 -3.493 -5.779 155 HH21 ARG 19 1HH2 ARG 19 -17.761 -6.146 -5.631 156 HH22 ARG 19 2HH2 ARG 19 -19.196 -5.535 -6.403 157 H ALA 20 H ALA 20 -12.799 -0.247 -3.130 158 HA ALA 20 HA ALA 20 -11.871 -2.398 -4.709 159 HB1 ALA 20 3HB ALA 20 -12.041 -0.078 -5.533 160 HB2 ALA 20 1HB ALA 20 -10.445 -0.780 -5.810 161 HB3 ALA 20 2HB ALA 20 -10.686 0.369 -4.494 162 H VAL 21 H VAL 21 -10.563 -0.744 -1.921 163 HA VAL 21 HA VAL 21 -7.965 -1.940 -2.122 164 HB VAL 21 HB VAL 21 -9.274 -0.546 0.222 165 HG11 VAL 21 1HG1 VAL 21 -7.004 -0.282 1.093 166 HG12 VAL 21 2HG1 VAL 21 -6.373 -1.228 -0.255 167 HG13 VAL 21 3HG1 VAL 21 -7.436 -1.984 0.933 168 HG21 VAL 21 3HG2 VAL 21 -7.926 1.392 -0.465 169 HG22 VAL 21 1HG2 VAL 21 -9.080 0.917 -1.711 170 HG23 VAL 21 2HG2 VAL 21 -7.376 0.498 -1.882 171 H TYR 22 H TYR 22 -10.768 -2.444 0.039 172 HA TYR 22 HA TYR 22 -10.063 -5.228 0.354 173 HB2 TYR 22 2HB TYR 22 -9.589 -5.226 2.675 174 HB3 TYR 22 1HB TYR 22 -8.601 -3.939 1.995 175 HD1 TYR 22 HD2 TYR 22 -10.088 -1.581 1.919 176 HD2 TYR 22 HD1 TYR 22 -10.459 -4.747 4.738 177 HE1 TYR 22 HE2 TYR 22 -11.057 -0.014 3.545 178 HE2 TYR 22 HE1 TYR 22 -11.439 -3.189 6.366 179 HH TYR 22 HH TYR 22 -11.473 -0.788 6.830 180 H ARG 23 H ARG 23 -11.515 -5.944 2.492 181 HA ARG 23 HA ARG 23 -13.589 -6.399 3.281 182 HB2 ARG 23 2HB ARG 23 -13.554 -3.856 3.651 183 HB3 ARG 23 1HB ARG 23 -14.533 -3.747 2.195 184 HG2 ARG 23 2HG ARG 23 -16.228 -5.182 3.260 185 HG3 ARG 23 1HG ARG 23 -15.255 -5.204 4.731 186 HD2 ARG 23 2HD ARG 23 -16.507 -2.790 3.426 187 HD3 ARG 23 1HD ARG 23 -17.021 -3.558 4.927 188 HE ARG 23 HE ARG 23 -14.348 -2.823 5.223 189 HH11 ARG 23 1HH1 ARG 23 -17.478 -1.311 4.836 190 HH12 ARG 23 2HH1 ARG 23 -17.000 0.159 5.644 191 HH21 ARG 23 1HH2 ARG 23 -13.731 -0.855 6.281 192 HH22 ARG 23 2HH2 ARG 23 -14.920 0.405 6.448 193 H GLN 24 H GLN 24 -12.799 -7.291 0.784 194 HA GLN 24 HA GLN 24 -14.860 -6.882 -1.164 195 HB2 GLN 24 2HB GLN 24 -13.609 -8.372 -2.565 196 HB3 GLN 24 1HB GLN 24 -12.484 -7.300 -1.749 197 HG2 GLN 24 2HG GLN 24 -13.065 -10.135 -0.912 198 HG3 GLN 24 1HG GLN 24 -11.704 -9.639 -1.911 199 HE21 GLN 24 1HE2 GLN 24 -11.691 -10.985 0.634 200 HE22 GLN 24 2HE2 GLN 24 -10.775 -9.990 1.717 201 H VAL 25 H VAL 25 -15.325 -8.296 1.558 202 HA VAL 25 HA VAL 25 -16.294 -10.887 0.744 203 HB VAL 25 HB VAL 25 -17.155 -11.051 3.081 204 HG11 VAL 25 1HG1 VAL 25 -14.942 -11.878 2.518 205 HG12 VAL 25 2HG1 VAL 25 -14.943 -11.185 4.139 206 HG13 VAL 25 3HG1 VAL 25 -14.253 -10.279 2.793 207 HG21 VAL 25 3HG2 VAL 25 -16.470 -9.358 4.715 208 HG22 VAL 25 1HG2 VAL 25 -17.568 -8.687 3.510 209 HG23 VAL 25 2HG2 VAL 25 -15.839 -8.353 3.409 210 H LEU 26 H LEU 26 -18.335 -11.437 0.255 211 HA LEU 26 HA LEU 26 -20.305 -9.257 0.199 212 HB2 LEU 26 2HB LEU 26 -20.116 -11.721 -1.536 213 HB3 LEU 26 1HB LEU 26 -21.409 -10.539 -1.612 214 HG LEU 26 HG LEU 26 -18.504 -10.020 -2.246 215 HD11 LEU 26 1HD1 LEU 26 -19.305 -9.729 -4.538 216 HD12 LEU 26 2HD1 LEU 26 -20.930 -10.190 -4.026 217 HD13 LEU 26 3HD1 LEU 26 -19.612 -11.359 -3.941 218 HD21 LEU 26 3HD2 LEU 26 -19.563 -8.056 -1.267 219 HD22 LEU 26 1HD2 LEU 26 -20.895 -8.187 -2.416 220 HD23 LEU 26 2HD2 LEU 26 -19.269 -7.820 -2.988 221 H GLY 27 H GLY 27 -22.023 -9.420 1.468 222 HA2 GLY 27 2HA GLY 27 -23.127 -12.061 2.074 223 HA3 GLY 27 1HA GLY 27 -22.600 -11.087 3.438 224 H ASN 28 H ASN 28 -25.265 -12.058 2.128 225 HA ASN 28 HA ASN 28 -26.662 -9.493 2.016 226 HB2 ASN 28 2HB ASN 28 -27.647 -12.325 1.580 227 HB3 ASN 28 1HB ASN 28 -28.648 -10.886 1.439 228 HD21 ASN 28 1HD2 ASN 28 -28.385 -9.521 -0.312 229 HD22 ASN 28 2HD2 ASN 28 -27.494 -9.993 -1.723 230 H ASP 29 H ASP 29 -26.787 -12.559 3.783 231 HA ASP 29 HA ASP 29 -27.823 -11.071 6.105 232 HB2 ASP 29 2HB ASP 29 -28.657 -13.828 5.174 233 HB3 ASP 29 1HB ASP 29 -29.064 -13.156 6.750 234 H TYR 30 H TYR 30 -26.735 -11.380 7.934 235 HA TYR 30 HA TYR 30 -25.185 -12.090 9.420 236 HB2 TYR 30 2HB TYR 30 -25.370 -14.737 7.965 237 HB3 TYR 30 1HB TYR 30 -24.615 -14.479 9.533 238 HD1 TYR 30 HD2 TYR 30 -26.075 -13.729 11.461 239 HD2 TYR 30 HD1 TYR 30 -27.678 -15.151 7.787 240 HE1 TYR 30 HE2 TYR 30 -28.224 -14.163 12.571 241 HE2 TYR 30 HE1 TYR 30 -29.830 -15.591 8.890 242 HH TYR 30 HH TYR 30 -30.522 -14.469 12.078 243 H VAL 31 H VAL 31 -23.700 -10.616 8.526 244 HA VAL 31 HA VAL 31 -21.797 -11.676 6.574 245 HB VAL 31 HB VAL 31 -20.924 -9.383 6.425 246 HG11 VAL 31 1HG1 VAL 31 -23.920 -9.564 6.165 247 HG12 VAL 31 2HG1 VAL 31 -22.734 -10.042 4.951 248 HG13 VAL 31 3HG1 VAL 31 -22.897 -8.345 5.405 249 HG21 VAL 31 3HG2 VAL 31 -21.319 -8.641 8.703 250 HG22 VAL 31 1HG2 VAL 31 -23.061 -8.718 8.445 251 HG23 VAL 31 2HG2 VAL 31 -22.092 -7.542 7.559 252 H MET 32 H MET 32 -19.589 -11.791 6.944 253 HA MET 32 HA MET 32 -18.757 -11.434 9.746 254 HB2 MET 32 2HB MET 32 -17.191 -13.312 9.463 255 HB3 MET 32 1HB MET 32 -18.860 -13.811 9.235 256 HG2 MET 32 2HG MET 32 -18.551 -13.821 6.829 257 HG3 MET 32 1HG MET 32 -16.896 -13.249 7.021 258 HE1 MET 32 3HE MET 32 -17.488 -15.769 5.271 259 HE2 MET 32 1HE MET 32 -16.246 -16.883 5.841 260 HE3 MET 32 2HE MET 32 -15.863 -15.177 5.616 261 H ALA 33 H ALA 33 -17.606 -9.624 9.797 262 HA ALA 33 HA ALA 33 -15.736 -9.096 7.594 263 HB1 ALA 33 3HB ALA 33 -15.710 -6.777 8.391 264 HB2 ALA 33 1HB ALA 33 -16.822 -7.217 9.688 265 HB3 ALA 33 2HB ALA 33 -17.344 -7.318 8.005 266 H SER 34 H SER 34 -13.983 -10.316 8.175 267 HA SER 34 HA SER 34 -12.817 -10.300 10.760 268 HB2 SER 34 2HB SER 34 -11.406 -10.856 8.145 269 HB3 SER 34 1HB SER 34 -10.990 -11.476 9.744 270 HG SER 34 HG SER 34 -12.427 -12.697 8.015 271 H GLU 35 H GLU 35 -12.362 -8.420 7.845 272 HA GLU 35 HA GLU 35 -10.520 -6.631 9.280 273 HB2 GLU 35 2HB GLU 35 -10.754 -7.092 6.294 274 HB3 GLU 35 1HB GLU 35 -9.599 -6.030 7.089 275 HG2 GLU 35 2HG GLU 35 -8.354 -7.787 7.926 276 HG3 GLU 35 1HG GLU 35 -9.685 -8.932 7.777 277 H ARG 36 H ARG 36 -11.970 -5.191 10.112 278 HA ARG 36 HA ARG 36 -13.918 -4.030 8.252 279 HB2 ARG 36 2HB ARG 36 -15.035 -3.160 10.337 280 HB3 ARG 36 1HB ARG 36 -15.041 -4.906 10.147 281 HG2 ARG 36 2HG ARG 36 -13.114 -5.024 11.708 282 HG3 ARG 36 1HG ARG 36 -13.270 -3.286 11.967 283 HD2 ARG 36 2HD ARG 36 -15.540 -3.604 12.797 284 HD3 ARG 36 1HD ARG 36 -15.415 -5.337 12.505 285 HE ARG 36 HE ARG 36 -13.585 -3.990 14.384 286 HH11 ARG 36 1HH1 ARG 36 -16.025 -6.427 13.714 287 HH12 ARG 36 2HH1 ARG 36 -15.872 -7.178 15.279 288 HH21 ARG 36 1HH2 ARG 36 -13.353 -5.021 16.414 289 HH22 ARG 36 2HH2 ARG 36 -14.356 -6.384 16.800 290 H LEU 37 H LEU 37 -11.556 -3.108 10.743 291 HA LEU 37 HA LEU 37 -10.464 -1.152 11.163 292 HB2 LEU 37 2HB LEU 37 -10.678 -0.910 8.160 293 HB3 LEU 37 1HB LEU 37 -9.598 0.032 9.174 294 HG LEU 37 HG LEU 37 -9.494 -2.968 8.831 295 HD11 LEU 37 1HD1 LEU 37 -7.418 -2.524 7.611 296 HD12 LEU 37 2HD1 LEU 37 -7.720 -0.791 7.741 297 HD13 LEU 37 3HD1 LEU 37 -8.818 -1.810 6.810 298 HD21 LEU 37 3HD2 LEU 37 -7.662 -1.073 10.301 299 HD22 LEU 37 1HD2 LEU 37 -7.359 -2.789 10.031 300 HD23 LEU 37 2HD2 LEU 37 -8.720 -2.282 11.030 301 H VAL 38 H VAL 38 -13.093 -0.920 11.697 302 HA VAL 38 HA VAL 38 -14.546 1.001 10.268 303 HB VAL 38 HB VAL 38 -15.956 1.178 12.332 304 HG11 VAL 38 1HG1 VAL 38 -15.305 -1.603 11.364 305 HG12 VAL 38 2HG1 VAL 38 -16.431 -0.473 10.610 306 HG13 VAL 38 3HG1 VAL 38 -16.778 -1.129 12.209 307 HG21 VAL 38 3HG2 VAL 38 -15.514 -0.402 14.164 308 HG22 VAL 38 1HG2 VAL 38 -14.241 0.812 14.021 309 HG23 VAL 38 2HG2 VAL 38 -13.973 -0.823 13.418 310 H SER 39 H SER 39 -12.269 1.340 12.926 311 HA SER 39 HA SER 39 -12.804 4.060 13.488 312 HB2 SER 39 2HB SER 39 -10.179 2.597 13.854 313 HB3 SER 39 1HB SER 39 -10.738 4.022 14.733 314 HG SER 39 HG SER 39 -10.984 1.848 15.761 315 H ALA 40 H ALA 40 -10.559 2.437 11.301 316 HA ALA 40 HA ALA 40 -9.249 4.797 10.404 317 HB1 ALA 40 3HB ALA 40 -9.480 2.104 9.061 318 HB2 ALA 40 1HB ALA 40 -8.224 2.585 10.198 319 HB3 ALA 40 2HB ALA 40 -8.345 3.383 8.629 320 H GLU 41 H GLU 41 -12.041 2.953 9.314 321 HA GLU 41 HA GLU 41 -12.498 4.225 6.875 322 HB2 GLU 41 2HB GLU 41 -13.713 2.214 7.564 323 HB3 GLU 41 1HB GLU 41 -14.522 3.122 8.834 324 HG2 GLU 41 2HG GLU 41 -15.516 4.569 7.068 325 HG3 GLU 41 1HG GLU 41 -14.824 3.484 5.863 326 H SER 42 H SER 42 -13.743 5.022 10.113 327 HA SER 42 HA SER 42 -15.241 7.261 9.392 328 HB2 SER 42 2HB SER 42 -13.770 6.770 11.994 329 HB3 SER 42 1HB SER 42 -15.093 7.912 11.754 330 HG SER 42 HG SER 42 -15.961 5.603 10.855 331 H LEU 43 H LEU 43 -11.819 6.987 10.295 332 HA LEU 43 HA LEU 43 -11.229 9.726 10.348 333 HB2 LEU 43 2HB LEU 43 -9.451 7.391 9.648 334 HB3 LEU 43 1HB LEU 43 -8.878 9.017 9.968 335 HG LEU 43 HG LEU 43 -10.308 7.245 11.952 336 HD11 LEU 43 1HD1 LEU 43 -8.134 7.178 13.093 337 HD12 LEU 43 2HD1 LEU 43 -7.413 8.059 11.744 338 HD13 LEU 43 3HD1 LEU 43 -8.071 6.442 11.493 339 HD21 LEU 43 3HD2 LEU 43 -9.054 9.966 12.297 340 HD22 LEU 43 1HD2 LEU 43 -9.731 8.968 13.584 341 HD23 LEU 43 2HD2 LEU 43 -10.781 9.609 12.320 342 H LEU 44 H LEU 44 -11.265 7.416 7.679 343 HA LEU 44 HA LEU 44 -10.225 9.300 5.775 344 HB2 LEU 44 2HB LEU 44 -9.897 6.864 5.556 345 HB3 LEU 44 1HB LEU 44 -11.625 6.661 5.336 346 HG LEU 44 HG LEU 44 -11.462 8.066 3.270 347 HD11 LEU 44 1HD1 LEU 44 -9.252 8.397 2.276 348 HD12 LEU 44 2HD1 LEU 44 -8.499 7.765 3.741 349 HD13 LEU 44 3HD1 LEU 44 -9.422 9.268 3.798 350 HD21 LEU 44 3HD2 LEU 44 -11.533 5.640 3.144 351 HD22 LEU 44 1HD2 LEU 44 -9.781 5.564 3.337 352 HD23 LEU 44 2HD2 LEU 44 -10.479 6.299 1.893 353 H ARG 45 H ARG 45 -13.399 8.079 6.684 354 HA ARG 45 HA ARG 45 -14.811 9.189 4.496 355 HB2 ARG 45 2HB ARG 45 -15.611 7.287 5.869 356 HB3 ARG 45 1HB ARG 45 -15.869 8.390 7.212 357 HG2 ARG 45 2HG ARG 45 -17.558 9.582 5.953 358 HG3 ARG 45 1HG ARG 45 -17.261 8.557 4.546 359 HD2 ARG 45 2HD ARG 45 -17.972 6.600 5.811 360 HD3 ARG 45 1HD ARG 45 -18.231 7.602 7.236 361 HE ARG 45 HE ARG 45 -19.741 8.295 4.846 362 HH11 ARG 45 1HH1 ARG 45 -19.671 6.729 7.974 363 HH12 ARG 45 2HH1 ARG 45 -21.404 6.670 8.120 364 HH21 ARG 45 1HH2 ARG 45 -22.015 8.222 5.032 365 HH22 ARG 45 2HH2 ARG 45 -22.731 7.542 6.469 366 H ASN 46 H ASN 46 -14.045 10.415 7.723 367 HA ASN 46 HA ASN 46 -15.614 12.806 7.259 368 HB2 ASN 46 2HB ASN 46 -13.762 12.022 9.512 369 HB3 ASN 46 1HB ASN 46 -14.589 13.575 9.433 370 HD21 ASN 46 1HD2 ASN 46 -16.820 13.658 9.715 371 HD22 ASN 46 2HD2 ASN 46 -17.707 12.326 10.394 372 H GLY 47 H GLY 47 -12.360 11.734 6.827 373 HA2 GLY 47 2HA GLY 47 -10.903 12.763 5.286 374 HA3 GLY 47 1HA GLY 47 -11.780 14.270 5.496 375 H LYS 48 H LYS 48 -10.220 12.099 7.855 376 HA LYS 48 HA LYS 48 -8.727 14.416 8.867 377 HB2 LYS 48 2HB LYS 48 -9.343 11.710 10.035 378 HB3 LYS 48 1HB LYS 48 -8.068 12.716 10.700 379 HG2 LYS 48 2HG LYS 48 -9.965 13.098 12.027 380 HG3 LYS 48 1HG LYS 48 -9.801 14.521 10.996 381 HD2 LYS 48 2HD LYS 48 -11.551 13.729 9.545 382 HD3 LYS 48 1HD LYS 48 -11.639 12.199 10.422 383 HE2 LYS 48 2HE LYS 48 -13.456 13.564 11.148 384 HE3 LYS 48 1HE LYS 48 -12.282 13.483 12.458 385 HZ1 LYS 48 3HZ LYS 48 -12.836 15.747 10.633 386 HZ2 LYS 48 1HZ LYS 48 -11.418 15.673 11.570 387 HZ3 LYS 48 2HZ LYS 48 -12.935 15.704 12.325 388 H ILE 49 H ILE 49 -8.224 11.082 7.763 389 HA ILE 49 HA ILE 49 -5.331 11.502 7.821 390 HB ILE 49 HB ILE 49 -5.133 9.088 7.438 391 HG12 ILE 49 2HG1 ILE 49 -8.158 9.052 7.577 392 HG13 ILE 49 1HG1 ILE 49 -7.219 8.830 6.106 393 HG21 ILE 49 1HG2 ILE 49 -6.019 8.342 9.599 394 HG22 ILE 49 2HG2 ILE 49 -7.004 9.802 9.692 395 HG23 ILE 49 3HG2 ILE 49 -5.246 9.924 9.717 396 HD11 ILE 49 3HD1 ILE 49 -8.004 6.710 7.010 397 HD12 ILE 49 1HD1 ILE 49 -7.144 7.031 8.517 398 HD13 ILE 49 2HD1 ILE 49 -6.242 6.802 7.019 399 H THR 50 H THR 50 -4.127 10.381 5.968 400 HA THR 50 HA THR 50 -5.363 11.201 3.436 401 HB THR 50 HB THR 50 -3.040 11.012 2.514 402 HG1 THR 50 HG1 THR 50 -1.959 11.091 5.091 403 HG21 THR 50 3HG2 THR 50 -2.207 13.074 3.556 404 HG22 THR 50 1HG2 THR 50 -3.378 12.885 4.863 405 HG23 THR 50 2HG2 THR 50 -3.935 13.175 3.214 406 H VAL 51 H VAL 51 -4.719 9.791 1.524 407 HA VAL 51 HA VAL 51 -5.631 7.155 1.941 408 HB VAL 51 HB VAL 51 -4.142 8.243 -0.460 409 HG11 VAL 51 1HG1 VAL 51 -4.220 5.803 -0.416 410 HG12 VAL 51 2HG1 VAL 51 -5.239 6.452 -1.702 411 HG13 VAL 51 3HG1 VAL 51 -5.970 5.858 -0.210 412 HG21 VAL 51 3HG2 VAL 51 -6.365 8.621 -1.419 413 HG22 VAL 51 1HG2 VAL 51 -6.110 9.579 0.041 414 HG23 VAL 51 2HG2 VAL 51 -7.102 8.122 0.104 415 H ARG 52 H ARG 52 -2.472 8.606 1.886 416 HA ARG 52 HA ARG 52 -0.823 6.399 1.580 417 HB2 ARG 52 2HB ARG 52 -0.240 8.916 1.894 418 HB3 ARG 52 1HB ARG 52 -0.224 8.537 3.611 419 HG2 ARG 52 2HG ARG 52 1.978 8.242 3.113 420 HG3 ARG 52 1HG ARG 52 1.380 6.605 2.841 421 HD2 ARG 52 2HD ARG 52 2.095 8.708 0.824 422 HD3 ARG 52 1HD ARG 52 2.709 7.063 0.965 423 HE ARG 52 HE ARG 52 -0.051 7.696 0.113 424 HH11 ARG 52 1HH1 ARG 52 2.950 5.928 -0.262 425 HH12 ARG 52 2HH1 ARG 52 2.344 4.922 -1.536 426 HH21 ARG 52 1HH2 ARG 52 -0.845 6.377 -1.587 427 HH22 ARG 52 2HH2 ARG 52 0.190 5.174 -2.295 428 H GLU 53 H GLU 53 -2.404 7.648 4.494 429 HA GLU 53 HA GLU 53 -1.271 5.644 6.202 430 HB2 GLU 53 2HB GLU 53 -3.586 7.524 6.683 431 HB3 GLU 53 1HB GLU 53 -2.784 6.553 7.912 432 HG2 GLU 53 2HG GLU 53 -0.687 7.757 7.439 433 HG3 GLU 53 1HG GLU 53 -1.566 8.781 6.303 434 H PHE 54 H PHE 54 -4.301 6.085 4.481 435 HA PHE 54 HA PHE 54 -5.741 3.959 5.608 436 HB2 PHE 54 2HB PHE 54 -6.736 5.697 4.141 437 HB3 PHE 54 1HB PHE 54 -5.885 5.000 2.767 438 HD1 PHE 54 HD2 PHE 54 -8.311 4.102 5.438 439 HD2 PHE 54 HD1 PHE 54 -6.939 3.403 1.470 440 HE1 PHE 54 HE2 PHE 54 -10.208 2.581 5.053 441 HE2 PHE 54 HE1 PHE 54 -8.831 1.884 1.079 442 HZ PHE 54 HZ PHE 54 -10.467 1.473 2.871 443 H VAL 55 H VAL 55 -3.654 4.083 2.725 444 HA VAL 55 HA VAL 55 -3.736 1.331 2.148 445 HB VAL 55 HB VAL 55 -1.544 3.343 1.591 446 HG11 VAL 55 1HG1 VAL 55 -1.920 0.563 0.471 447 HG12 VAL 55 2HG1 VAL 55 -0.618 1.091 1.539 448 HG13 VAL 55 3HG1 VAL 55 -0.739 1.744 -0.095 449 HG21 VAL 55 3HG2 VAL 55 -2.479 3.329 -0.688 450 HG22 VAL 55 1HG2 VAL 55 -3.646 3.891 0.511 451 HG23 VAL 55 2HG2 VAL 55 -3.764 2.255 -0.137 452 H ARG 56 H ARG 56 -1.492 3.251 4.129 453 HA ARG 56 HA ARG 56 0.319 1.340 4.910 454 HB2 ARG 56 2HB ARG 56 0.639 3.598 5.607 455 HB3 ARG 56 1HB ARG 56 -0.890 3.624 6.471 456 HG2 ARG 56 2HG ARG 56 0.038 1.954 8.055 457 HG3 ARG 56 1HG ARG 56 1.588 2.094 7.228 458 HD2 ARG 56 2HD ARG 56 0.158 4.464 8.399 459 HD3 ARG 56 1HD ARG 56 1.279 3.480 9.335 460 HE ARG 56 HE ARG 56 2.893 4.076 7.410 461 HH11 ARG 56 1HH1 ARG 56 0.429 6.199 8.719 462 HH12 ARG 56 2HH1 ARG 56 1.316 7.651 8.361 463 HH21 ARG 56 1HH2 ARG 56 4.063 5.977 6.968 464 HH22 ARG 56 2HH2 ARG 56 3.370 7.524 7.374 465 H ALA 57 H ALA 57 -2.781 2.066 6.488 466 HA ALA 57 HA ALA 57 -2.537 0.239 8.591 467 HB1 ALA 57 3HB ALA 57 -4.135 2.075 8.605 468 HB2 ALA 57 1HB ALA 57 -4.946 0.535 8.887 469 HB3 ALA 57 2HB ALA 57 -5.046 1.308 7.306 470 H VAL 58 H VAL 58 -4.121 -0.118 5.427 471 HA VAL 58 HA VAL 58 -5.065 -2.757 6.013 472 HB VAL 58 HB VAL 58 -4.806 -1.471 3.289 473 HG11 VAL 58 1HG1 VAL 58 -6.555 -3.707 4.302 474 HG12 VAL 58 2HG1 VAL 58 -5.198 -3.858 3.184 475 HG13 VAL 58 3HG1 VAL 58 -6.652 -2.985 2.696 476 HG21 VAL 58 3HG2 VAL 58 -6.078 -0.015 4.762 477 HG22 VAL 58 1HG2 VAL 58 -7.109 -1.364 5.233 478 HG23 VAL 58 2HG2 VAL 58 -7.138 -0.768 3.571 479 H ALA 59 H ALA 59 -2.317 -1.414 4.272 480 HA ALA 59 HA ALA 59 -1.469 -3.658 2.873 481 HB1 ALA 59 3HB ALA 59 0.277 -1.490 4.025 482 HB2 ALA 59 1HB ALA 59 -0.627 -1.377 2.513 483 HB3 ALA 59 2HB ALA 59 0.672 -2.559 2.679 484 H LYS 60 H LYS 60 -0.344 -2.543 6.076 485 HA LYS 60 HA LYS 60 1.256 -4.941 6.342 486 HB2 LYS 60 2HB LYS 60 1.947 -3.962 8.524 487 HB3 LYS 60 1HB LYS 60 2.266 -2.935 7.135 488 HG2 LYS 60 2HG LYS 60 0.329 -1.568 7.671 489 HG3 LYS 60 1HG LYS 60 -0.054 -2.623 9.035 490 HD2 LYS 60 2HD LYS 60 1.114 -0.592 9.759 491 HD3 LYS 60 1HD LYS 60 2.058 -2.042 10.104 492 HE2 LYS 60 2HE LYS 60 3.302 -1.614 7.960 493 HE3 LYS 60 1HE LYS 60 2.479 -0.058 7.872 494 HZ1 LYS 60 3HZ LYS 60 4.655 0.180 8.880 495 HZ2 LYS 60 1HZ LYS 60 4.272 -0.972 10.065 496 HZ3 LYS 60 2HZ LYS 60 3.458 0.515 10.029 497 H SER 61 H SER 61 -1.830 -4.833 6.436 498 HA SER 61 HA SER 61 -2.079 -6.339 8.944 499 HB2 SER 61 2HB SER 61 -4.210 -4.949 7.313 500 HB3 SER 61 1HB SER 61 -4.544 -5.980 8.703 501 HG SER 61 HG SER 61 -3.513 -3.411 8.592 502 H GLU 62 H GLU 62 -4.286 -6.527 6.212 503 HA GLU 62 HA GLU 62 -5.235 -8.337 5.227 504 HB2 GLU 62 2HB GLU 62 -2.309 -9.014 4.905 505 HB3 GLU 62 1HB GLU 62 -3.607 -9.862 4.076 506 HG2 GLU 62 2HG GLU 62 -4.262 -7.432 3.313 507 HG3 GLU 62 1HG GLU 62 -2.561 -7.113 3.651 508 H LEU 63 H LEU 63 -5.015 -8.561 8.071 509 HA LEU 63 HA LEU 63 -5.523 -10.030 9.713 510 HB2 LEU 63 2HB LEU 63 -5.702 -11.952 7.409 511 HB3 LEU 63 1HB LEU 63 -5.998 -12.439 9.066 512 HG LEU 63 HG LEU 63 -7.559 -10.341 7.555 513 HD11 LEU 63 1HD1 LEU 63 -9.369 -11.969 7.583 514 HD12 LEU 63 2HD1 LEU 63 -8.316 -13.142 8.373 515 HD13 LEU 63 3HD1 LEU 63 -7.963 -12.607 6.731 516 HD21 LEU 63 3HD2 LEU 63 -7.460 -9.864 9.941 517 HD22 LEU 63 1HD2 LEU 63 -7.970 -11.513 10.306 518 HD23 LEU 63 2HD2 LEU 63 -9.072 -10.411 9.481 519 H TYR 64 H TYR 64 -2.714 -9.886 8.225 520 HA TYR 64 HA TYR 64 -0.599 -10.395 8.809 521 HB2 TYR 64 2HB TYR 64 -1.845 -11.735 11.215 522 HB3 TYR 64 1HB TYR 64 -0.124 -11.435 10.996 523 HD1 TYR 64 HD1 TYR 64 0.632 -9.005 10.728 524 HD2 TYR 64 HD2 TYR 64 -3.218 -10.099 12.173 525 HE1 TYR 64 HE1 TYR 64 0.378 -6.773 11.726 526 HE2 TYR 64 HE2 TYR 64 -3.483 -7.870 13.174 527 HH TYR 64 HH TYR 64 -1.566 -5.265 12.378 528 H LYS 65 H LYS 65 -2.358 -13.315 9.891 529 HA LYS 65 HA LYS 65 -1.283 -14.754 7.633 530 HB2 LYS 65 2HB LYS 65 -0.109 -16.445 8.828 531 HB3 LYS 65 1HB LYS 65 0.509 -14.901 9.383 532 HG2 LYS 65 2HG LYS 65 -1.587 -16.426 10.901 533 HG3 LYS 65 1HG LYS 65 0.138 -16.707 11.125 534 HD2 LYS 65 2HD LYS 65 -1.227 -14.042 11.482 535 HD3 LYS 65 1HD LYS 65 -0.845 -15.157 12.796 536 HE2 LYS 65 2HE LYS 65 1.563 -15.035 11.970 537 HE3 LYS 65 1HE LYS 65 1.043 -13.654 11.006 538 HZ1 LYS 65 3HZ LYS 65 1.953 -12.892 13.073 539 HZ2 LYS 65 1HZ LYS 65 0.914 -13.896 13.961 540 HZ3 LYS 65 2HZ LYS 65 0.282 -12.594 13.082 541 H GLU 66 H GLU 66 -3.018 -15.671 6.837 542 HA GLU 66 HA GLU 66 -4.583 -17.367 8.630 543 HB2 GLU 66 2HB GLU 66 -6.573 -16.713 7.008 544 HB3 GLU 66 1HB GLU 66 -6.203 -15.774 8.444 545 HG2 GLU 66 2HG GLU 66 -6.625 -14.275 6.642 546 HG3 GLU 66 1HG GLU 66 -4.907 -14.206 7.025 547 H LYS 67 H LYS 67 -3.493 -16.675 5.360 548 HA LYS 67 HA LYS 67 -3.576 -19.574 4.868 549 HB2 LYS 67 2HB LYS 67 -5.422 -18.266 3.687 550 HB3 LYS 67 1HB LYS 67 -4.148 -17.520 2.733 551 HG2 LYS 67 2HG LYS 67 -3.504 -19.663 1.838 552 HG3 LYS 67 1HG LYS 67 -4.670 -20.481 2.880 553 HD2 LYS 67 2HD LYS 67 -6.494 -19.269 1.749 554 HD3 LYS 67 1HD LYS 67 -5.308 -18.521 0.676 555 HE2 LYS 67 2HE LYS 67 -4.667 -20.717 -0.162 556 HE3 LYS 67 1HE LYS 67 -5.813 -21.483 0.938 557 HZ1 LYS 67 3HZ LYS 67 -7.614 -20.358 -0.209 558 HZ2 LYS 67 1HZ LYS 67 -6.711 -21.304 -1.290 559 HZ3 LYS 67 2HZ LYS 67 -6.512 -19.618 -1.269 560 H PHE 68 H PHE 68 -1.709 -16.881 5.186 561 HA PHE 68 HA PHE 68 0.469 -18.157 3.721 562 HB2 PHE 68 2HB PHE 68 1.233 -16.086 2.738 563 HB3 PHE 68 1HB PHE 68 -0.436 -16.359 2.261 564 HD1 PHE 68 HD2 PHE 68 -2.246 -15.016 3.334 565 HD2 PHE 68 HD1 PHE 68 1.877 -14.160 3.940 566 HE1 PHE 68 HE2 PHE 68 -2.828 -12.757 4.117 567 HE2 PHE 68 HE1 PHE 68 1.301 -11.903 4.723 568 HZ PHE 68 HZ PHE 68 -1.057 -11.198 4.811 569 H LEU 69 H LEU 69 2.565 -16.762 4.244 570 HA LEU 69 HA LEU 69 4.087 -15.982 5.733 571 HB2 LEU 69 2HB LEU 69 2.247 -14.396 6.411 572 HB3 LEU 69 1HB LEU 69 1.823 -15.533 7.676 573 HG LEU 69 HG LEU 69 4.104 -15.250 8.637 574 HD11 LEU 69 1HD1 LEU 69 4.330 -13.055 6.581 575 HD12 LEU 69 2HD1 LEU 69 5.263 -14.552 6.608 576 HD13 LEU 69 3HD1 LEU 69 5.465 -13.364 7.897 577 HD21 LEU 69 3HD2 LEU 69 2.216 -13.991 9.515 578 HD22 LEU 69 1HD2 LEU 69 2.490 -12.725 8.318 579 HD23 LEU 69 2HD2 LEU 69 3.695 -13.031 9.571 580 H TYR 70 H TYR 70 5.151 -16.592 7.781 581 HA TYR 70 HA TYR 70 5.982 -18.105 9.233 582 HB2 TYR 70 2HB TYR 70 3.707 -18.140 10.210 583 HB3 TYR 70 1HB TYR 70 3.272 -19.446 9.113 584 HD1 TYR 70 HD2 TYR 70 5.528 -18.540 11.915 585 HD2 TYR 70 HD1 TYR 70 3.784 -21.692 9.652 586 HE1 TYR 70 HE2 TYR 70 6.364 -20.170 13.553 587 HE2 TYR 70 HE1 TYR 70 4.617 -23.331 11.287 588 HH TYR 70 HH TYR 70 6.375 -23.526 12.983 589 H GLY 71 H GLY 71 3.862 -19.990 7.064 590 HA2 GLY 71 2HA GLY 71 6.046 -21.922 6.736 591 HA3 GLY 71 1HA GLY 71 4.358 -22.192 6.329 592 H ASN 72 H ASN 72 5.778 -23.042 4.433 593 HA ASN 72 HA ASN 72 6.243 -22.942 2.216 594 HB2 ASN 72 2HB ASN 72 3.970 -21.633 2.342 595 HB3 ASN 72 1HB ASN 72 4.973 -20.224 2.018 596 HD21 ASN 72 1HD2 ASN 72 3.708 -23.189 0.754 597 HD22 ASN 72 2HD2 ASN 72 4.115 -22.899 -0.905 598 H PHE 73 H PHE 73 6.831 -20.554 0.655 599 HA PHE 73 HA PHE 73 9.505 -20.064 1.700 600 HB2 PHE 73 2HB PHE 73 8.256 -19.387 -0.973 601 HB3 PHE 73 1HB PHE 73 9.932 -19.070 -0.537 602 HD1 PHE 73 HD1 PHE 73 7.474 -21.651 -1.370 603 HD2 PHE 73 HD2 PHE 73 11.542 -20.857 -0.403 604 HE1 PHE 73 HE1 PHE 73 8.089 -23.911 -2.117 605 HE2 PHE 73 HE2 PHE 73 12.163 -23.116 -1.148 606 HZ PHE 73 HZ PHE 73 10.437 -24.648 -2.007 607 H GLN 74 H GLN 74 10.153 -18.211 2.561 608 HA GLN 74 HA GLN 74 8.272 -16.239 3.310 609 HB2 GLN 74 2HB GLN 74 11.293 -16.119 3.336 610 HB3 GLN 74 1HB GLN 74 10.228 -15.001 4.174 611 HG2 GLN 74 2HG GLN 74 10.222 -17.956 4.703 612 HG3 GLN 74 1HG GLN 74 11.277 -16.838 5.559 613 HE21 GLN 74 1HE2 GLN 74 8.014 -16.006 4.591 614 HE22 GLN 74 2HE2 GLN 74 7.356 -15.968 6.185 615 H THR 75 H THR 75 10.374 -16.574 0.576 616 HA THR 75 HA THR 75 10.433 -13.924 -0.346 617 HB THR 75 HB THR 75 10.831 -14.932 -2.590 618 HG1 THR 75 HG1 THR 75 10.227 -16.924 -2.951 619 HG21 THR 75 3HG2 THR 75 12.900 -16.135 -2.003 620 HG22 THR 75 1HG2 THR 75 12.369 -16.198 -0.321 621 HG23 THR 75 2HG2 THR 75 12.714 -14.643 -1.080 622 H ARG 76 H ARG 76 8.173 -16.571 -0.931 623 HA ARG 76 HA ARG 76 6.604 -15.194 -2.833 624 HB2 ARG 76 2HB ARG 76 5.974 -17.616 -1.150 625 HB3 ARG 76 1HB ARG 76 4.970 -17.037 -2.475 626 HG2 ARG 76 2HG ARG 76 6.861 -17.348 -4.014 627 HG3 ARG 76 1HG ARG 76 7.813 -17.998 -2.678 628 HD2 ARG 76 2HD ARG 76 6.225 -19.815 -2.407 629 HD3 ARG 76 1HD ARG 76 5.223 -19.151 -3.698 630 HE ARG 76 HE ARG 76 7.635 -19.476 -4.889 631 HH11 ARG 76 1HH1 ARG 76 5.553 -21.600 -3.054 632 HH12 ARG 76 2HH1 ARG 76 6.067 -23.037 -3.883 633 HH21 ARG 76 1HH2 ARG 76 8.318 -21.339 -5.982 634 HH22 ARG 76 2HH2 ARG 76 7.660 -22.892 -5.553 635 H VAL 77 H VAL 77 6.486 -15.399 0.652 636 HA VAL 77 HA VAL 77 3.914 -14.363 1.072 637 HB VAL 77 HB VAL 77 6.383 -13.826 2.744 638 HG11 VAL 77 1HG1 VAL 77 4.557 -12.289 3.246 639 HG12 VAL 77 2HG1 VAL 77 4.794 -13.429 4.571 640 HG13 VAL 77 3HG1 VAL 77 3.452 -13.649 3.446 641 HG21 VAL 77 3HG2 VAL 77 4.325 -16.023 2.968 642 HG22 VAL 77 1HG2 VAL 77 5.625 -15.713 4.119 643 HG23 VAL 77 2HG2 VAL 77 6.006 -16.217 2.472 644 H ILE 78 H ILE 78 7.036 -12.715 0.759 645 HA ILE 78 HA ILE 78 6.076 -10.082 0.849 646 HB ILE 78 HB ILE 78 8.508 -11.134 -0.613 647 HG12 ILE 78 2HG1 ILE 78 8.246 -10.000 2.183 648 HG13 ILE 78 1HG1 ILE 78 8.434 -11.708 1.805 649 HG21 ILE 78 1HG2 ILE 78 9.375 -8.858 -0.407 650 HG22 ILE 78 2HG2 ILE 78 7.862 -8.344 0.343 651 HG23 ILE 78 3HG2 ILE 78 7.876 -8.884 -1.336 652 HD11 ILE 78 3HD1 ILE 78 10.628 -11.244 0.836 653 HD12 ILE 78 1HD1 ILE 78 10.532 -10.734 2.521 654 HD13 ILE 78 2HD1 ILE 78 10.435 -9.537 1.229 655 H GLU 79 H GLU 79 6.592 -12.304 -1.869 656 HA GLU 79 HA GLU 79 5.956 -10.560 -3.960 657 HB2 GLU 79 2HB GLU 79 5.464 -13.541 -3.782 658 HB3 GLU 79 1HB GLU 79 5.397 -12.595 -5.263 659 HG2 GLU 79 2HG GLU 79 7.770 -12.016 -4.970 660 HG3 GLU 79 1HG GLU 79 7.820 -13.035 -3.532 661 H LEU 80 H LEU 80 3.876 -12.516 -1.888 662 HA LEU 80 HA LEU 80 1.460 -12.128 -3.266 663 HB2 LEU 80 2HB LEU 80 1.970 -12.585 -0.328 664 HB3 LEU 80 1HB LEU 80 0.376 -12.604 -1.057 665 HG LEU 80 HG LEU 80 2.631 -14.506 -1.709 666 HD11 LEU 80 1HD1 LEU 80 0.068 -14.931 -0.180 667 HD12 LEU 80 2HD1 LEU 80 1.694 -14.889 0.504 668 HD13 LEU 80 3HD1 LEU 80 1.236 -16.180 -0.608 669 HD21 LEU 80 3HD2 LEU 80 -0.227 -14.436 -2.675 670 HD22 LEU 80 1HD2 LEU 80 0.944 -15.713 -3.009 671 HD23 LEU 80 2HD2 LEU 80 1.206 -14.088 -3.642 672 H ASN 81 H ASN 81 2.703 -10.386 -0.404 673 HA ASN 81 HA ASN 81 0.594 -8.494 -0.387 674 HB2 ASN 81 2HB ASN 81 3.369 -8.180 0.783 675 HB3 ASN 81 1HB ASN 81 1.946 -7.239 1.212 676 HD21 ASN 81 1HD2 ASN 81 0.222 -8.307 2.338 677 HD22 ASN 81 2HD2 ASN 81 0.560 -9.715 3.284 678 H TYR 82 H TYR 82 3.782 -8.537 -1.855 679 HA TYR 82 HA TYR 82 3.997 -5.931 -2.804 680 HB2 TYR 82 2HB TYR 82 5.576 -8.047 -2.960 681 HB3 TYR 82 1HB TYR 82 4.793 -8.264 -4.516 682 HD1 TYR 82 HD1 TYR 82 7.073 -6.184 -2.557 683 HD2 TYR 82 HD2 TYR 82 5.256 -6.745 -6.359 684 HE1 TYR 82 HE1 TYR 82 8.723 -4.664 -3.559 685 HE2 TYR 82 HE2 TYR 82 6.896 -5.219 -7.374 686 HH TYR 82 HH TYR 82 9.727 -4.233 -5.757 687 H LYS 83 H LYS 83 2.537 -8.772 -4.326 688 HA LYS 83 HA LYS 83 1.619 -7.484 -6.661 689 HB2 LYS 83 2HB LYS 83 1.943 -9.946 -6.356 690 HB3 LYS 83 1HB LYS 83 0.515 -9.968 -5.336 691 HG2 LYS 83 2HG LYS 83 -0.769 -9.064 -7.305 692 HG3 LYS 83 1HG LYS 83 0.669 -9.379 -8.277 693 HD2 LYS 83 2HD LYS 83 0.585 -11.749 -7.534 694 HD3 LYS 83 1HD LYS 83 -0.930 -11.395 -6.703 695 HE2 LYS 83 2HE LYS 83 -0.373 -11.322 -9.659 696 HE3 LYS 83 1HE LYS 83 -1.494 -12.369 -8.789 697 HZ1 LYS 83 3HZ LYS 83 -2.647 -10.200 -8.137 698 HZ2 LYS 83 1HZ LYS 83 -2.834 -10.749 -9.730 699 HZ3 LYS 83 2HZ LYS 83 -1.750 -9.494 -9.396 700 H HIS 84 H HIS 84 0.110 -8.130 -3.529 701 HA HIS 84 HA HIS 84 -2.527 -7.402 -4.212 702 HB2 HIS 84 2HB HIS 84 -1.118 -7.278 -1.535 703 HB3 HIS 84 1HB HIS 84 -2.845 -7.044 -1.754 704 HD1 HIS 84 HD1 HIS 84 -1.957 -9.238 0.089 705 HD2 HIS 84 HD2 HIS 84 -2.581 -9.817 -3.991 706 HE1 HIS 84 HE1 HIS 84 -2.332 -11.713 -0.203 707 HE2 HIS 84 HE2 HIS 84 -2.529 -12.059 -2.695 708 H LEU 85 H LEU 85 0.202 -5.513 -3.027 709 HA LEU 85 HA LEU 85 -1.442 -3.173 -2.629 710 HB2 LEU 85 2HB LEU 85 1.530 -3.587 -2.369 711 HB3 LEU 85 1HB LEU 85 0.691 -2.106 -1.954 712 HG LEU 85 HG LEU 85 0.297 -4.787 -0.626 713 HD11 LEU 85 1HD1 LEU 85 1.608 -2.261 0.364 714 HD12 LEU 85 2HD1 LEU 85 2.433 -3.759 -0.070 715 HD13 LEU 85 3HD1 LEU 85 1.334 -3.725 1.309 716 HD21 LEU 85 3HD2 LEU 85 -1.085 -3.525 0.975 717 HD22 LEU 85 1HD2 LEU 85 -1.770 -3.527 -0.650 718 HD23 LEU 85 2HD2 LEU 85 -0.933 -2.097 -0.051 719 H LEU 86 H LEU 86 1.217 -4.095 -4.821 720 HA LEU 86 HA LEU 86 1.008 -1.448 -6.044 721 HB2 LEU 86 2HB LEU 86 3.093 -3.591 -6.407 722 HB3 LEU 86 1HB LEU 86 3.151 -1.983 -7.102 723 HG LEU 86 HG LEU 86 3.257 -2.645 -4.159 724 HD11 LEU 86 1HD1 LEU 86 5.311 -3.204 -5.355 725 HD12 LEU 86 2HD1 LEU 86 5.548 -1.818 -4.290 726 HD13 LEU 86 3HD1 LEU 86 5.369 -1.574 -6.028 727 HD21 LEU 86 3HD2 LEU 86 3.398 0.013 -5.581 728 HD22 LEU 86 1HD2 LEU 86 3.697 -0.247 -3.860 729 HD23 LEU 86 2HD2 LEU 86 2.094 -0.547 -4.533 730 H GLY 87 H GLY 87 -0.159 -4.540 -6.633 731 HA2 GLY 87 2HA GLY 87 -1.010 -5.597 -8.501 732 HA3 GLY 87 1HA GLY 87 -1.153 -3.991 -9.204 733 H ARG 88 H ARG 88 1.817 -5.421 -8.119 734 HA ARG 88 HA ARG 88 2.817 -5.715 -10.845 735 HB2 ARG 88 2HB ARG 88 3.138 -3.336 -10.047 736 HB3 ARG 88 1HB ARG 88 4.153 -3.970 -8.763 737 HG2 ARG 88 2HG ARG 88 5.699 -4.858 -10.456 738 HG3 ARG 88 1HG ARG 88 4.690 -4.148 -11.721 739 HD2 ARG 88 2HD ARG 88 5.001 -1.933 -10.589 740 HD3 ARG 88 1HD ARG 88 6.184 -2.705 -9.540 741 HE ARG 88 HE ARG 88 6.829 -3.127 -12.274 742 HH11 ARG 88 1HH1 ARG 88 6.887 -0.711 -9.746 743 HH12 ARG 88 2HH1 ARG 88 8.193 0.191 -10.439 744 HH21 ARG 88 1HH2 ARG 88 8.561 -1.946 -13.203 745 HH22 ARG 88 2HH2 ARG 88 9.157 -0.517 -12.408 746 H ALA 89 H ALA 89 4.456 -7.243 -10.963 747 HA ALA 89 HA ALA 89 5.143 -8.555 -8.418 748 HB1 ALA 89 3HB ALA 89 5.119 -9.716 -11.204 749 HB2 ALA 89 1HB ALA 89 3.883 -9.964 -9.972 750 HB3 ALA 89 2HB ALA 89 5.513 -10.588 -9.722 751 HA PRO 90 HA PRO 90 9.404 -7.449 -8.881 752 HB2 PRO 90 2HB PRO 90 10.559 -9.768 -7.925 753 HB3 PRO 90 1HB PRO 90 9.940 -8.462 -6.909 754 HG2 PRO 90 2HG PRO 90 8.651 -11.048 -7.675 755 HG3 PRO 90 1HG PRO 90 8.638 -10.206 -6.114 756 HD2 PRO 90 2HD PRO 90 6.531 -10.124 -7.774 757 HD3 PRO 90 1HD PRO 90 6.992 -8.723 -6.785 758 H TYR 91 H TYR 91 10.675 -7.472 -10.604 759 HA TYR 91 HA TYR 91 10.212 -9.403 -12.692 760 HB2 TYR 91 2HB TYR 91 12.137 -7.069 -12.609 761 HB3 TYR 91 1HB TYR 91 11.674 -7.981 -14.040 762 HD1 TYR 91 HD2 TYR 91 10.535 -5.558 -11.524 763 HD2 TYR 91 HD1 TYR 91 9.587 -7.560 -15.155 764 HE1 TYR 91 HE2 TYR 91 8.675 -3.999 -11.889 765 HE2 TYR 91 HE1 TYR 91 7.724 -5.999 -15.537 766 HH TYR 91 HH TYR 91 6.311 -4.493 -14.362 767 H ASP 92 H ASP 92 12.882 -8.476 -10.571 768 HA ASP 92 HA ASP 92 14.341 -10.849 -11.512 769 HB2 ASP 92 2HB ASP 92 16.432 -9.679 -10.920 770 HB3 ASP 92 1HB ASP 92 15.521 -8.818 -12.155 771 H GLU 93 H GLU 93 16.149 -11.346 -9.754 772 HA GLU 93 HA GLU 93 14.603 -12.137 -7.428 773 HB2 GLU 93 2HB GLU 93 16.027 -13.757 -8.675 774 HB3 GLU 93 1HB GLU 93 17.444 -12.832 -8.205 775 HG2 GLU 93 2HG GLU 93 16.875 -13.281 -5.828 776 HG3 GLU 93 1HG GLU 93 15.571 -14.327 -6.389 777 H SER 94 H SER 94 17.099 -9.895 -8.293 778 HA SER 94 HA SER 94 18.365 -9.629 -5.785 779 HB2 SER 94 2HB SER 94 19.312 -8.859 -7.977 780 HB3 SER 94 1HB SER 94 18.154 -7.528 -7.954 781 HG SER 94 HG SER 94 19.390 -7.563 -5.607 782 H GLU 95 H GLU 95 15.640 -7.948 -7.284 783 HA GLU 95 HA GLU 95 15.147 -6.029 -5.316 784 HB2 GLU 95 2HB GLU 95 13.887 -6.902 -7.628 785 HB3 GLU 95 1HB GLU 95 12.716 -7.279 -6.372 786 HG2 GLU 95 2HG GLU 95 13.954 -4.570 -6.825 787 HG3 GLU 95 1HG GLU 95 12.371 -5.070 -7.412 788 H VAL 96 H VAL 96 14.060 -9.390 -5.564 789 HA VAL 96 HA VAL 96 12.499 -9.417 -3.209 790 HB VAL 96 HB VAL 96 13.891 -11.769 -4.500 791 HG11 VAL 96 1HG1 VAL 96 13.051 -12.261 -2.270 792 HG12 VAL 96 2HG1 VAL 96 12.086 -13.087 -3.494 793 HG13 VAL 96 3HG1 VAL 96 11.464 -11.633 -2.716 794 HG21 VAL 96 3HG2 VAL 96 12.548 -10.561 -6.135 795 HG22 VAL 96 1HG2 VAL 96 11.157 -10.623 -5.052 796 HG23 VAL 96 2HG2 VAL 96 11.811 -12.113 -5.737 797 H ILE 97 H ILE 97 15.887 -10.237 -3.833 798 HA ILE 97 HA ILE 97 16.536 -11.302 -1.326 799 HB ILE 97 HB ILE 97 18.326 -9.724 -3.182 800 HG12 ILE 97 2HG1 ILE 97 17.327 -11.653 -4.300 801 HG13 ILE 97 1HG1 ILE 97 19.040 -11.937 -4.009 802 HG21 ILE 97 1HG2 ILE 97 19.279 -9.888 -0.956 803 HG22 ILE 97 2HG2 ILE 97 20.170 -10.912 -2.081 804 HG23 ILE 97 3HG2 ILE 97 19.022 -11.633 -0.955 805 HD11 ILE 97 3HD1 ILE 97 16.757 -13.049 -2.396 806 HD12 ILE 97 1HD1 ILE 97 18.470 -13.322 -2.077 807 HD13 ILE 97 2HD1 ILE 97 17.744 -13.928 -3.565 808 H PHE 98 H PHE 98 16.513 -7.950 -2.467 809 HA PHE 98 HA PHE 98 17.611 -6.779 -0.154 810 HB2 PHE 98 2HB PHE 98 17.402 -5.564 -2.282 811 HB3 PHE 98 1HB PHE 98 15.648 -5.606 -2.138 812 HD1 PHE 98 HD2 PHE 98 18.709 -4.335 -0.467 813 HD2 PHE 98 HD1 PHE 98 14.512 -3.919 -1.019 814 HE1 PHE 98 HE2 PHE 98 18.759 -2.211 0.776 815 HE2 PHE 98 HE1 PHE 98 14.554 -1.795 0.220 816 HZ PHE 98 HZ PHE 98 16.680 -0.939 1.118 817 H HIS 99 H HIS 99 14.287 -7.544 -1.079 818 HA HIS 99 HA HIS 99 13.064 -6.415 1.218 819 HB2 HIS 99 2HB HIS 99 12.137 -8.520 -0.735 820 HB3 HIS 99 1HB HIS 99 11.143 -7.973 0.610 821 HD1 HIS 99 HD1 HIS 99 10.489 -5.388 0.581 822 HD2 HIS 99 HD2 HIS 99 12.052 -6.938 -2.948 823 HE1 HIS 99 HE1 HIS 99 9.897 -3.722 -1.223 824 HE2 HIS 99 HE2 HIS 99 11.027 -4.597 -3.313 825 H LEU 100 H LEU 100 14.333 -9.622 0.478 826 HA LEU 100 HA LEU 100 13.388 -11.000 2.715 827 HB2 LEU 100 2HB LEU 100 15.938 -11.360 1.149 828 HB3 LEU 100 1HB LEU 100 15.386 -12.483 2.379 829 HG LEU 100 HG LEU 100 13.919 -11.813 -0.174 830 HD11 LEU 100 1HD1 LEU 100 14.484 -14.100 -0.820 831 HD12 LEU 100 2HD1 LEU 100 15.419 -14.289 0.663 832 HD13 LEU 100 3HD1 LEU 100 15.931 -13.127 -0.560 833 HD21 LEU 100 3HD2 LEU 100 12.386 -12.341 1.647 834 HD22 LEU 100 1HD2 LEU 100 13.292 -13.814 1.998 835 HD23 LEU 100 2HD2 LEU 100 12.430 -13.651 0.468 836 H ASP 101 H ASP 101 16.446 -9.236 2.294 837 HA ASP 101 HA ASP 101 17.442 -9.708 4.876 838 HB2 ASP 101 2HB ASP 101 18.814 -8.795 3.023 839 HB3 ASP 101 1HB ASP 101 17.950 -7.266 3.168 840 H LEU 102 H LEU 102 15.518 -7.007 3.612 841 HA LEU 102 HA LEU 102 15.414 -5.529 5.995 842 HB2 LEU 102 2HB LEU 102 14.813 -4.624 3.802 843 HB3 LEU 102 1HB LEU 102 13.411 -5.673 3.744 844 HG LEU 102 HG LEU 102 12.408 -4.477 5.624 845 HD11 LEU 102 1HD1 LEU 102 14.838 -2.698 5.489 846 HD12 LEU 102 2HD1 LEU 102 14.474 -3.843 6.778 847 HD13 LEU 102 3HD1 LEU 102 13.420 -2.455 6.511 848 HD21 LEU 102 3HD2 LEU 102 11.966 -3.701 3.354 849 HD22 LEU 102 1HD2 LEU 102 13.376 -2.642 3.435 850 HD23 LEU 102 2HD2 LEU 102 11.992 -2.353 4.491 851 H TYR 103 H TYR 103 13.200 -7.954 4.682 852 HA TYR 103 HA TYR 103 11.248 -7.900 6.672 853 HB2 TYR 103 2HB TYR 103 10.729 -9.054 4.682 854 HB3 TYR 103 1HB TYR 103 12.188 -10.035 4.767 855 HD1 TYR 103 HD2 TYR 103 8.934 -9.460 6.493 856 HD2 TYR 103 HD1 TYR 103 12.105 -12.174 5.672 857 HE1 TYR 103 HE2 TYR 103 7.665 -11.266 7.579 858 HE2 TYR 103 HE1 TYR 103 10.845 -13.984 6.755 859 HH TYR 103 HH TYR 103 9.092 -14.293 8.355 860 H GLU 104 H GLU 104 14.276 -9.749 6.522 861 HA GLU 104 HA GLU 104 13.620 -11.087 9.016 862 HB2 GLU 104 2HB GLU 104 16.085 -11.277 7.281 863 HB3 GLU 104 1HB GLU 104 15.747 -12.286 8.680 864 HG2 GLU 104 2HG GLU 104 13.646 -13.016 7.488 865 HG3 GLU 104 1HG GLU 104 14.289 -12.210 6.058 866 H ASN 105 H ASN 105 15.281 -8.280 8.034 867 HA ASN 105 HA ASN 105 17.091 -8.212 10.295 868 HB2 ASN 105 2HB ASN 105 16.990 -6.974 7.773 869 HB3 ASN 105 1HB ASN 105 16.809 -5.675 8.947 870 HD21 ASN 105 1HD2 ASN 105 19.001 -6.453 7.110 871 HD22 ASN 105 2HD2 ASN 105 20.397 -6.610 8.119 872 H GLU 106 H GLU 106 14.417 -6.144 9.151 873 HA GLU 106 HA GLU 106 14.233 -5.092 11.886 874 HB2 GLU 106 2HB GLU 106 13.359 -3.883 9.262 875 HB3 GLU 106 1HB GLU 106 13.033 -3.163 10.834 876 HG2 GLU 106 2HG GLU 106 15.471 -3.075 11.247 877 HG3 GLU 106 1HG GLU 106 15.735 -3.680 9.615 878 H GLY 107 H GLY 107 12.339 -6.527 9.276 879 HA2 GLY 107 2HA GLY 107 10.732 -8.146 10.495 880 HA3 GLY 107 1HA GLY 107 10.050 -6.651 11.114 881 H PHE 108 H PHE 108 8.373 -8.252 9.886 882 HA PHE 108 HA PHE 108 8.123 -7.919 7.074 883 HB2 PHE 108 2HB PHE 108 7.022 -9.754 8.275 884 HB3 PHE 108 1HB PHE 108 6.056 -8.601 9.183 885 HD1 PHE 108 HD1 PHE 108 6.746 -9.738 5.709 886 HD2 PHE 108 HD2 PHE 108 3.960 -7.994 8.417 887 HE1 PHE 108 HE1 PHE 108 4.996 -9.862 3.985 888 HE2 PHE 108 HE2 PHE 108 2.208 -8.117 6.696 889 HZ PHE 108 HZ PHE 108 2.724 -9.052 4.477 890 H ASP 109 H ASP 109 6.870 -6.244 9.889 891 HA ASP 109 HA ASP 109 5.139 -4.432 8.685 892 HB2 ASP 109 2HB ASP 109 5.343 -4.702 11.117 893 HB3 ASP 109 1HB ASP 109 6.961 -4.013 11.068 894 H ALA 110 H ALA 110 8.634 -4.336 9.064 895 HA ALA 110 HA ALA 110 8.969 -1.656 8.196 896 HB1 ALA 110 3HB ALA 110 10.597 -2.813 9.611 897 HB2 ALA 110 1HB ALA 110 11.337 -2.167 8.147 898 HB3 ALA 110 2HB ALA 110 10.985 -3.890 8.271 899 H ASP 111 H ASP 111 9.147 -4.790 6.545 900 HA ASP 111 HA ASP 111 10.138 -3.712 4.112 901 HB2 ASP 111 2HB ASP 111 10.293 -6.125 4.720 902 HB3 ASP 111 1HB ASP 111 8.556 -6.266 4.444 903 H ILE 112 H ILE 112 6.880 -4.441 5.280 904 HA ILE 112 HA ILE 112 5.485 -3.659 2.953 905 HB ILE 112 HB ILE 112 4.642 -3.589 5.856 906 HG12 ILE 112 2HG1 ILE 112 5.186 -5.826 4.937 907 HG13 ILE 112 1HG1 ILE 112 3.484 -5.666 5.360 908 HG21 ILE 112 1HG2 ILE 112 3.284 -2.034 4.584 909 HG22 ILE 112 2HG2 ILE 112 2.338 -3.451 5.037 910 HG23 ILE 112 3HG2 ILE 112 2.938 -3.283 3.388 911 HD11 ILE 112 3HD1 ILE 112 2.936 -5.305 3.012 912 HD12 ILE 112 1HD1 ILE 112 3.751 -6.849 3.267 913 HD13 ILE 112 2HD1 ILE 112 4.640 -5.484 2.589 914 H ASP 113 H ASP 113 6.855 -1.894 5.617 915 HA ASP 113 HA ASP 113 5.423 0.526 5.230 916 HB2 ASP 113 2HB ASP 113 6.610 -0.280 7.355 917 HB3 ASP 113 1HB ASP 113 8.095 0.290 6.602 918 H SER 114 H SER 114 8.137 -0.860 3.655 919 HA SER 114 HA SER 114 9.692 1.335 2.992 920 HB2 SER 114 2HB SER 114 10.485 0.020 1.073 921 HB3 SER 114 1HB SER 114 10.363 -0.980 2.520 922 HG SER 114 HG SER 114 8.746 -2.080 1.660 923 H TYR 115 H TYR 115 6.878 0.048 1.223 924 HA TYR 115 HA TYR 115 6.958 1.882 -0.906 925 HB2 TYR 115 2HB TYR 115 5.608 -0.012 -1.256 926 HB3 TYR 115 1HB TYR 115 4.772 0.185 0.279 927 HD1 TYR 115 HD1 TYR 115 5.239 1.974 -2.974 928 HD2 TYR 115 HD2 TYR 115 2.635 1.060 0.267 929 HE1 TYR 115 HE1 TYR 115 3.421 3.189 -4.097 930 HE2 TYR 115 HE2 TYR 115 0.814 2.274 -0.852 931 HH TYR 115 HH TYR 115 0.936 3.229 -4.080 932 H ILE 116 H ILE 116 5.775 2.170 2.333 933 HA ILE 116 HA ILE 116 4.141 4.497 1.774 934 HB ILE 116 HB ILE 116 4.887 3.451 4.501 935 HG12 ILE 116 2HG1 ILE 116 2.506 2.516 2.884 936 HG13 ILE 116 1HG1 ILE 116 4.027 1.631 2.924 937 HG21 ILE 116 1HG2 ILE 116 2.447 4.889 3.451 938 HG22 ILE 116 2HG2 ILE 116 3.741 5.605 4.412 939 HG23 ILE 116 3HG2 ILE 116 2.698 4.369 5.117 940 HD11 ILE 116 3HD1 ILE 116 3.807 1.350 5.331 941 HD12 ILE 116 1HD1 ILE 116 2.409 0.699 4.475 942 HD13 ILE 116 2HD1 ILE 116 2.292 2.254 5.301 943 H ASP 117 H ASP 117 7.269 3.703 3.094 944 HA ASP 117 HA ASP 117 7.742 6.333 4.179 945 HB2 ASP 117 2HB ASP 117 8.639 4.278 5.247 946 HB3 ASP 117 1HB ASP 117 9.660 4.020 3.836 947 H SER 118 H SER 118 8.533 4.587 1.247 948 HA SER 118 HA SER 118 10.505 6.556 0.462 949 HB2 SER 118 2HB SER 118 10.666 5.202 -1.628 950 HB3 SER 118 1HB SER 118 10.933 4.259 -0.164 951 HG SER 118 HG SER 118 8.967 3.331 -0.380 952 HA PRO 119 HA PRO 119 7.416 9.193 -1.422 953 HB2 PRO 119 2HB PRO 119 9.222 10.928 -2.533 954 HB3 PRO 119 1HB PRO 119 8.692 11.009 -0.850 955 HG2 PRO 119 2HG PRO 119 11.195 9.840 -1.996 956 HG3 PRO 119 1HG PRO 119 10.976 10.789 -0.515 957 HD2 PRO 119 2HD PRO 119 11.250 8.102 -0.485 958 HD3 PRO 119 1HD PRO 119 10.249 8.971 0.697 959 H GLU 120 H GLU 120 10.138 7.647 -2.936 960 HA GLU 120 HA GLU 120 9.624 8.221 -5.628 961 HB2 GLU 120 2HB GLU 120 11.720 7.226 -4.803 962 HB3 GLU 120 1HB GLU 120 10.863 5.738 -4.424 963 HG2 GLU 120 2HG GLU 120 10.316 5.507 -6.830 964 HG3 GLU 120 1HG GLU 120 11.319 6.924 -7.151 965 H TYR 121 H TYR 121 8.804 5.263 -3.805 966 HA TYR 121 HA TYR 121 7.159 4.163 -5.808 967 HB2 TYR 121 2HB TYR 121 7.430 3.671 -2.855 968 HB3 TYR 121 1HB TYR 121 6.197 2.844 -3.799 969 HD1 TYR 121 HD1 TYR 121 9.862 3.341 -3.481 970 HD2 TYR 121 HD2 TYR 121 6.726 0.962 -5.092 971 HE1 TYR 121 HE1 TYR 121 11.500 1.621 -4.116 972 HE2 TYR 121 HE2 TYR 121 8.354 -0.764 -5.732 973 HH TYR 121 HH TYR 121 10.699 -0.997 -6.185 974 H THR 122 H THR 122 6.475 6.212 -3.029 975 HA THR 122 HA THR 122 3.701 6.197 -3.091 976 HB THR 122 HB THR 122 5.586 8.438 -2.343 977 HG1 THR 122 HG1 THR 122 5.886 6.724 -0.970 978 HG21 THR 122 3HG2 THR 122 3.718 9.374 -1.064 979 HG22 THR 122 1HG2 THR 122 2.651 8.123 -1.700 980 HG23 THR 122 2HG2 THR 122 3.347 9.324 -2.786 981 H ASN 123 H ASN 123 5.928 8.446 -4.748 982 HA ASN 123 HA ASN 123 3.775 9.824 -6.053 983 HB2 ASN 123 2HB ASN 123 6.205 10.634 -5.406 984 HB3 ASN 123 1HB ASN 123 6.610 10.008 -6.998 985 HD21 ASN 123 1HD2 ASN 123 3.960 10.725 -8.084 986 HD22 ASN 123 2HD2 ASN 123 3.998 12.445 -8.301 987 H SER 124 H SER 124 5.635 7.022 -6.727 988 HA SER 124 HA SER 124 5.589 7.023 -9.544 989 HB2 SER 124 2HB SER 124 7.009 5.534 -8.101 990 HB3 SER 124 1HB SER 124 5.563 4.604 -7.716 991 HG SER 124 HG SER 124 6.601 5.018 -10.336 992 H PHE 125 H PHE 125 3.391 5.532 -7.174 993 HA PHE 125 HA PHE 125 1.525 4.905 -9.338 994 HB2 PHE 125 2HB PHE 125 1.531 4.078 -6.427 995 HB3 PHE 125 1HB PHE 125 0.309 3.599 -7.601 996 HD1 PHE 125 HD2 PHE 125 0.825 2.003 -9.358 997 HD2 PHE 125 HD1 PHE 125 3.749 3.125 -6.472 998 HE1 PHE 125 HE2 PHE 125 2.210 0.075 -10.013 999 HE2 PHE 125 HE1 PHE 125 5.136 1.203 -7.125 1000 HZ PHE 125 HZ PHE 125 4.368 -0.328 -8.896 1001 H GLY 126 H GLY 126 1.834 6.865 -6.455 1002 HA2 GLY 126 2HA GLY 126 0.572 9.018 -6.623 1003 HA3 GLY 126 1HA GLY 126 -0.825 8.018 -7.000 1004 H ASP 127 H ASP 127 0.111 9.878 -4.678 1005 HA ASP 127 HA ASP 127 0.123 8.243 -2.348 1006 HB2 ASP 127 2HB ASP 127 0.948 10.622 -2.479 1007 HB3 ASP 127 1HB ASP 127 -0.728 11.142 -2.568 1008 H TRP 128 H TRP 128 -2.359 10.187 -3.945 1009 HA TRP 128 HA TRP 128 -4.425 9.056 -2.225 1010 HB2 TRP 128 2HB TRP 128 -4.501 11.308 -4.245 1011 HB3 TRP 128 1HB TRP 128 -5.888 10.772 -3.303 1012 HD1 TRP 128 HD1 TRP 128 -2.336 12.191 -2.655 1013 HE1 TRP 128 HE1 TRP 128 -2.433 13.647 -0.536 1014 HE3 TRP 128 HE3 TRP 128 -7.216 11.396 -1.370 1015 HZ2 TRP 128 HZ2 TRP 128 -4.347 14.364 1.422 1016 HZ3 TRP 128 HZ3 TRP 128 -8.103 12.504 0.639 1017 HH2 TRP 128 HH2 TRP 128 -6.696 13.957 2.005 1018 H VAL 129 H VAL 129 -2.968 7.827 -4.691 1019 HA VAL 129 HA VAL 129 -5.405 7.030 -6.148 1020 HB VAL 129 HB VAL 129 -2.548 6.911 -7.141 1021 HG11 VAL 129 1HG1 VAL 129 -3.592 6.435 -9.332 1022 HG12 VAL 129 2HG1 VAL 129 -5.162 6.341 -8.533 1023 HG13 VAL 129 3HG1 VAL 129 -3.900 5.175 -8.136 1024 HG21 VAL 129 3HG2 VAL 129 -4.762 8.839 -7.818 1025 HG22 VAL 129 1HG2 VAL 129 -3.236 8.708 -8.692 1026 HG23 VAL 129 2HG2 VAL 129 -3.244 9.212 -7.002 1027 H VAL 130 H VAL 130 -5.927 4.900 -6.217 1028 HA VAL 130 HA VAL 130 -4.441 3.058 -4.569 1029 HB VAL 130 HB VAL 130 -6.789 2.474 -6.394 1030 HG11 VAL 130 1HG1 VAL 130 -5.696 0.961 -4.022 1031 HG12 VAL 130 2HG1 VAL 130 -5.549 0.482 -5.711 1032 HG13 VAL 130 3HG1 VAL 130 -7.137 0.528 -4.942 1033 HG21 VAL 130 3HG2 VAL 130 -6.775 3.213 -3.467 1034 HG22 VAL 130 1HG2 VAL 130 -8.188 2.690 -4.385 1035 HG23 VAL 130 2HG2 VAL 130 -7.385 4.207 -4.790 1036 HA PRO 131 HA PRO 131 -1.531 2.109 -7.798 1037 HB2 PRO 131 2HB PRO 131 -1.263 -0.372 -6.165 1038 HB3 PRO 131 1HB PRO 131 -0.011 0.716 -6.778 1039 HG2 PRO 131 2HG PRO 131 -0.715 0.793 -4.219 1040 HG3 PRO 131 1HG PRO 131 -0.371 2.287 -5.107 1041 HD2 PRO 131 2HD PRO 131 -2.997 1.125 -4.296 1042 HD3 PRO 131 1HD PRO 131 -2.489 2.824 -4.371 1043 H TYR 132 H TYR 132 -2.107 1.416 -9.700 1044 HA TYR 132 HA TYR 132 -4.215 -0.545 -9.987 1045 HB2 TYR 132 2HB TYR 132 -4.097 0.109 -12.403 1046 HB3 TYR 132 1HB TYR 132 -4.430 1.450 -11.313 1047 HD1 TYR 132 HD2 TYR 132 -1.942 -0.060 -13.555 1048 HD2 TYR 132 HD1 TYR 132 -2.816 3.232 -11.004 1049 HE1 TYR 132 HE2 TYR 132 -0.045 1.179 -14.514 1050 HE2 TYR 132 HE1 TYR 132 -0.923 4.477 -11.954 1051 HH TYR 132 HH TYR 132 0.773 3.386 -14.768 1052 H TYR 133 H TYR 133 -4.054 -2.261 -11.574 1053 HA TYR 133 HA TYR 133 -1.579 -3.710 -11.344 1054 HB2 TYR 133 2HB TYR 133 -4.201 -4.296 -12.728 1055 HB3 TYR 133 1HB TYR 133 -2.815 -5.376 -12.828 1056 HD1 TYR 133 HD2 TYR 133 -5.104 -3.751 -10.371 1057 HD2 TYR 133 HD1 TYR 133 -2.456 -6.985 -11.182 1058 HE1 TYR 133 HE2 TYR 133 -5.784 -4.831 -8.268 1059 HE2 TYR 133 HE1 TYR 133 -3.130 -8.070 -9.084 1060 HH TYR 133 HH TYR 133 -5.775 -6.866 -7.152 1061 H ARG 134 H ARG 134 -0.040 -3.990 -12.869 1062 HA ARG 134 HA ARG 134 -0.004 -2.182 -15.098 1063 HB2 ARG 134 2HB ARG 134 2.199 -3.209 -15.590 1064 HB3 ARG 134 1HB ARG 134 2.066 -2.646 -13.930 1065 HG2 ARG 134 2HG ARG 134 1.681 -4.914 -13.165 1066 HG3 ARG 134 1HG ARG 134 1.728 -5.502 -14.827 1067 HD2 ARG 134 2HD ARG 134 4.003 -4.115 -13.416 1068 HD3 ARG 134 1HD ARG 134 3.843 -5.861 -13.598 1069 HE ARG 134 HE ARG 134 4.196 -3.971 -15.848 1070 HH11 ARG 134 1HH1 ARG 134 4.635 -7.120 -14.366 1071 HH12 ARG 134 2HH1 ARG 134 5.592 -7.739 -15.679 1072 HH21 ARG 134 1HH2 ARG 134 5.446 -4.795 -17.580 1073 HH22 ARG 134 2HH2 ARG 134 6.059 -6.424 -17.499 1074 H GLY 135 H GLY 135 -1.313 -5.213 -14.624 1075 HA2 GLY 135 2HA GLY 135 -1.301 -5.756 -17.522 1076 HA3 GLY 135 1HA GLY 135 -1.203 -7.039 -16.324 1077 H LEU 136 H LEU 136 -3.078 -8.051 -17.019 1078 HA LEU 136 HA LEU 136 -5.267 -8.527 -17.202 1079 HB2 LEU 136 2HB LEU 136 -4.987 -7.845 -14.729 1080 HB3 LEU 136 1HB LEU 136 -5.797 -6.358 -15.195 1081 HG LEU 136 HG LEU 136 -7.628 -7.858 -16.129 1082 HD11 LEU 136 1HD1 LEU 136 -6.233 -9.846 -14.353 1083 HD12 LEU 136 2HD1 LEU 136 -6.425 -9.951 -16.103 1084 HD13 LEU 136 3HD1 LEU 136 -7.838 -10.052 -15.055 1085 HD21 LEU 136 3HD2 LEU 136 -7.925 -6.492 -14.139 1086 HD22 LEU 136 1HD2 LEU 136 -7.156 -7.735 -13.152 1087 HD23 LEU 136 2HD2 LEU 136 -8.705 -8.058 -13.927 1088 H GLU 137 H GLU 137 -4.166 -6.625 -18.980 1089 HA GLU 137 HA GLU 137 -5.757 -4.310 -19.274 1090 HB2 GLU 137 2HB GLU 137 -4.094 -5.758 -21.338 1091 HB3 GLU 137 1HB GLU 137 -4.705 -4.116 -21.480 1092 HG2 GLU 137 2HG GLU 137 -3.334 -3.426 -19.598 1093 HG3 GLU 137 1HG GLU 137 -2.753 -5.081 -19.403 1094 H HIS 138 H HIS 138 -7.524 -3.894 -20.460 1095 HA HIS 138 HA HIS 138 -9.304 -5.921 -21.255 1096 HB2 HIS 138 2HB HIS 138 -9.974 -3.591 -20.696 1097 HB3 HIS 138 1HB HIS 138 -9.180 -3.027 -22.159 1098 HD1 HIS 138 HD1 HIS 138 -12.148 -5.064 -21.029 1099 HD2 HIS 138 HD2 HIS 138 -10.699 -3.188 -24.445 1100 HE1 HIS 138 HE1 HIS 138 -14.029 -5.150 -22.704 1101 HE2 HIS 138 HE2 HIS 138 -13.193 -3.828 -24.685 1102 H HIS 139 H HIS 139 -9.206 -7.208 -23.002 1103 HA HIS 139 HA HIS 139 -6.990 -7.160 -24.696 1104 HB2 HIS 139 2HB HIS 139 -8.451 -9.163 -24.172 1105 HB3 HIS 139 1HB HIS 139 -9.584 -8.544 -25.371 1106 HD1 HIS 139 HD1 HIS 139 -6.017 -9.772 -25.100 1107 HD2 HIS 139 HD2 HIS 139 -8.962 -9.182 -27.980 1108 HE1 HIS 139 HE1 HIS 139 -5.101 -10.772 -27.220 1109 HE2 HIS 139 HE2 HIS 139 -6.805 -10.213 -28.994 1110 H HIS 140 H HIS 140 -10.329 -6.143 -25.340 1111 HA HIS 140 HA HIS 140 -11.138 -4.508 -26.677 1112 HB2 HIS 140 2HB HIS 140 -9.615 -2.959 -25.794 1113 HB3 HIS 140 1HB HIS 140 -8.239 -3.722 -26.577 1114 HD1 HIS 140 HD1 HIS 140 -7.313 -2.009 -28.072 1115 HD2 HIS 140 HD2 HIS 140 -11.459 -2.185 -28.326 1116 HE1 HIS 140 HE1 HIS 140 -7.944 -0.444 -29.934 1117 HE2 HIS 140 HE2 HIS 140 -10.419 -0.773 -30.233 1118 H HIS 141 H HIS 141 -11.902 -5.906 -28.230 1119 HA HIS 141 HA HIS 141 -10.590 -5.433 -30.800 1120 HB2 HIS 141 2HB HIS 141 -10.003 -7.759 -30.157 1121 HB3 HIS 141 1HB HIS 141 -11.717 -8.141 -30.036 1122 HD1 HIS 141 HD1 HIS 141 -9.099 -7.187 -32.608 1123 HD2 HIS 141 HD2 HIS 141 -12.940 -8.782 -32.415 1124 HE1 HIS 141 HE1 HIS 141 -9.651 -7.922 -34.947 1125 HE2 HIS 141 HE2 HIS 141 -11.995 -8.841 -34.828 1126 H HIS 142 H HIS 142 -13.468 -6.452 -29.029 1127 HA HIS 142 HA HIS 142 -15.178 -5.504 -31.175 1128 HB2 HIS 142 2HB HIS 142 -15.892 -7.457 -29.830 1129 HB3 HIS 142 1HB HIS 142 -15.926 -6.439 -28.393 1130 HD1 HIS 142 HD1 HIS 142 -17.575 -6.548 -31.821 1131 HD2 HIS 142 HD2 HIS 142 -18.358 -5.325 -27.921 1132 HE1 HIS 142 HE1 HIS 142 -19.969 -5.774 -31.816 1133 HE2 HIS 142 HE2 HIS 142 -20.360 -4.863 -29.499 1134 H HIS 143 H HIS 143 -14.677 -3.378 -31.359 1135 HA HIS 143 HA HIS 143 -15.631 -1.658 -29.183 1136 HB2 HIS 143 2HB HIS 143 -13.180 -1.621 -29.137 1137 HB3 HIS 143 1HB HIS 143 -13.139 -1.226 -30.851 1138 HD1 HIS 143 HD1 HIS 143 -13.750 0.280 -27.477 1139 HD2 HIS 143 HD2 HIS 143 -13.657 1.462 -31.464 1140 HE1 HIS 143 HE1 HIS 143 -13.698 2.791 -27.443 1141 HE2 HIS 143 HE2 HIS 143 -13.411 3.469 -29.854
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