NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
622166 | 5h3m | 36026 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLU 1 H1 GLU 1 113.585 -10.150 25.475 2 H2 GLU 1 H2 GLU 1 114.153 -8.667 25.916 3 H3 GLU 1 H3 GLU 1 112.615 -9.111 26.312 4 HA GLU 1 HA GLU 1 111.759 -8.506 24.369 5 HB2 GLU 1 HB2 GLU 1 114.527 -7.266 24.392 6 HB3 GLU 1 HB3 GLU 1 113.398 -6.965 23.049 7 HG2 GLU 1 HG2 GLU 1 113.229 -5.219 24.825 8 HG3 GLU 1 HG3 GLU 1 111.708 -6.122 24.629 9 H HIS 2 H HIS 2 111.650 -8.928 22.081 10 HA HIS 2 HA HIS 2 113.858 -10.562 20.904 11 HB2 HIS 2 HB2 HIS 2 111.811 -12.177 20.181 12 HB3 HIS 2 HB3 HIS 2 112.778 -12.460 21.648 13 HD2 HIS 2 HD2 HIS 2 111.037 -12.908 23.735 14 HE1 HIS 2 HE1 HIS 2 107.980 -10.226 22.599 15 HE2 HIS 2 HE2 HIS 2 108.698 -11.905 24.383 16 HA PRO 3 HA PRO 3 112.509 -8.477 17.256 17 HB2 PRO 3 HB2 PRO 3 113.154 -10.348 15.317 18 HB3 PRO 3 HB3 PRO 3 114.356 -9.325 16.156 19 HG2 PRO 3 HG3 PRO 3 113.607 -12.180 16.637 20 HG3 PRO 3 HG2 PRO 3 115.207 -11.394 16.705 21 HD2 PRO 3 HD3 PRO 3 113.710 -12.023 18.940 22 HD3 PRO 3 HD2 PRO 3 114.892 -10.679 18.898 23 H GLU 4 H GLU 4 110.639 -8.243 16.050 24 HA GLU 4 HA GLU 4 108.547 -10.312 16.444 25 HB2 GLU 4 HB3 GLU 4 108.352 -7.790 14.754 26 HB3 GLU 4 HB2 GLU 4 107.032 -8.695 15.533 27 HG2 GLU 4 HG2 GLU 4 107.958 -8.115 17.764 28 HG3 GLU 4 HG3 GLU 4 109.265 -7.196 16.978 29 H PHE 5 H PHE 5 110.083 -8.711 13.597 30 HA PHE 5 HA PHE 5 108.873 -10.149 11.531 31 HB2 PHE 5 HB2 PHE 5 111.352 -10.155 10.534 32 HB3 PHE 5 HB3 PHE 5 110.449 -8.635 10.741 33 HD1 PHE 5 HD1 PHE 5 113.334 -10.583 11.783 34 HD2 PHE 5 HD2 PHE 5 110.824 -7.259 12.828 35 HE1 PHE 5 HE1 PHE 5 115.082 -9.753 13.332 36 HE2 PHE 5 HE2 PHE 5 112.572 -6.427 14.380 37 HZ PHE 5 HZ PHE 5 114.701 -7.676 14.632 38 H LEU 6 H LEU 6 111.403 -11.298 13.754 39 HA LEU 6 HA LEU 6 111.566 -13.909 12.349 40 HB2 LEU 6 HB3 LEU 6 113.383 -12.587 13.815 41 HB3 LEU 6 HB2 LEU 6 112.627 -13.514 15.133 42 HG LEU 6 HG LEU 6 112.885 -15.538 13.434 43 HD11 LEU 6 HD11 LEU 6 113.698 -14.128 11.563 44 HD12 LEU 6 HD12 LEU 6 115.078 -13.606 12.557 45 HD13 LEU 6 HD13 LEU 6 114.934 -15.308 12.058 46 HD21 LEU 6 HD21 LEU 6 113.978 -15.350 15.654 47 HD22 LEU 6 HD22 LEU 6 115.242 -14.319 14.943 48 HD23 LEU 6 HD23 LEU 6 115.098 -16.021 14.444 49 H LYS 7 H LYS 7 109.710 -12.445 14.908 50 HA LYS 7 HA LYS 7 109.013 -14.864 16.348 51 HB2 LYS 7 HB3 LYS 7 108.603 -12.494 17.135 52 HB3 LYS 7 HB2 LYS 7 107.286 -12.385 15.943 53 HG2 LYS 7 HG2 LYS 7 106.465 -14.630 17.080 54 HG3 LYS 7 HG3 LYS 7 107.469 -14.076 18.441 55 HD2 LYS 7 HD2 LYS 7 106.243 -11.956 18.533 56 HD3 LYS 7 HD3 LYS 7 105.299 -12.407 17.093 57 HE2 LYS 7 HE3 LYS 7 104.781 -14.573 18.621 58 HE3 LYS 7 HE2 LYS 7 105.077 -13.390 19.918 59 HZ1 LYS 7 HZ1 LYS 7 102.767 -13.411 19.241 60 HZ2 LYS 7 HZ2 LYS 7 103.448 -11.951 18.887 61 HZ3 LYS 7 HZ3 LYS 7 103.174 -13.046 17.685 62 H ALA 8 H ALA 8 107.564 -13.197 13.540 63 HA ALA 8 HA ALA 8 105.186 -14.650 13.217 64 HB1 ALA 8 HB1 ALA 8 107.226 -13.858 11.092 65 HB2 ALA 8 HB2 ALA 8 105.815 -12.915 11.631 66 HB3 ALA 8 HB3 ALA 8 105.581 -14.431 10.728 67 H GLY 9 H GLY 9 104.613 -16.705 12.477 68 HA2 GLY 9 HA2 GLY 9 105.101 -18.864 11.469 69 HA3 GLY 9 HA3 GLY 9 106.841 -18.538 11.647 70 H LYS 10 H LYS 10 104.228 -18.269 14.086 71 HA LYS 10 HA LYS 10 105.716 -20.373 15.675 72 HB2 LYS 10 HB2 LYS 10 104.231 -17.874 16.591 73 HB3 LYS 10 HB3 LYS 10 104.741 -19.170 17.699 74 HG2 LYS 10 HG2 LYS 10 106.774 -18.007 15.800 75 HG3 LYS 10 HG3 LYS 10 106.320 -17.070 17.243 76 HD2 LYS 10 HD3 LYS 10 107.122 -18.711 18.721 77 HD3 LYS 10 HD2 LYS 10 107.016 -20.002 17.500 78 HE2 LYS 10 HE2 LYS 10 108.903 -19.060 16.269 79 HE3 LYS 10 HE3 LYS 10 108.955 -17.652 17.356 80 HZ1 LYS 10 HZ1 LYS 10 110.582 -19.313 17.972 81 HZ2 LYS 10 HZ2 LYS 10 109.409 -20.456 18.160 82 HZ3 LYS 10 HZ3 LYS 10 109.458 -19.152 19.168 83 H GLU 11 H GLU 11 103.020 -19.898 13.859 84 HA GLU 11 HA GLU 11 101.650 -22.199 15.011 85 HB2 GLU 11 HB2 GLU 11 99.615 -21.089 15.807 86 HB3 GLU 11 HB3 GLU 11 101.017 -20.443 16.693 87 HG2 GLU 11 HG2 GLU 11 99.880 -18.479 16.092 88 HG3 GLU 11 HG3 GLU 11 101.056 -18.642 14.765 89 HA PRO 12 HA PRO 12 100.248 -21.963 10.796 90 HB2 PRO 12 HB3 PRO 12 98.348 -23.953 10.876 91 HB3 PRO 12 HB2 PRO 12 100.104 -24.283 10.865 92 HG2 PRO 12 HG2 PRO 12 98.161 -24.287 13.146 93 HG3 PRO 12 HG3 PRO 12 99.534 -25.377 12.814 94 HD2 PRO 12 HD2 PRO 12 99.639 -23.296 14.640 95 HD3 PRO 12 HD3 PRO 12 101.072 -23.945 13.786 96 H GLY 13 H GLY 13 97.974 -21.986 9.581 97 HA2 GLY 13 HA2 GLY 13 95.612 -21.310 9.697 98 HA3 GLY 13 HA3 GLY 13 95.934 -20.543 11.271 99 H LEU 14 H LEU 14 95.471 -18.401 10.921 100 HA LEU 14 HA LEU 14 97.062 -17.060 8.730 101 HB2 LEU 14 HB3 LEU 14 94.745 -17.308 7.924 102 HB3 LEU 14 HB2 LEU 14 94.132 -16.555 9.416 103 HG LEU 14 HG LEU 14 96.207 -14.966 8.008 104 HD11 LEU 14 HD11 LEU 14 95.000 -15.913 6.058 105 HD12 LEU 14 HD12 LEU 14 93.453 -15.387 6.763 106 HD13 LEU 14 HD13 LEU 14 94.652 -14.178 6.247 107 HD21 LEU 14 HD21 LEU 14 94.902 -14.153 9.958 108 HD22 LEU 14 HD22 LEU 14 93.395 -14.363 9.034 109 HD23 LEU 14 HD23 LEU 14 94.595 -13.153 8.518 110 H GLN 15 H GLN 15 98.112 -15.248 9.419 111 HA GLN 15 HA GLN 15 97.250 -14.097 12.087 112 HB2 GLN 15 HB2 GLN 15 100.099 -14.320 11.019 113 HB3 GLN 15 HB3 GLN 15 99.606 -13.695 12.611 114 HG2 GLN 15 HG3 GLN 15 99.366 -15.789 13.480 115 HG3 GLN 15 HG2 GLN 15 98.546 -16.394 12.021 116 HE21 GLN 15 HE21 GLN 15 101.819 -15.589 13.331 117 HE22 GLN 15 HE22 GLN 15 102.669 -16.709 12.290 118 H ILE 16 H ILE 16 97.337 -11.813 12.251 119 HA ILE 16 HA ILE 16 97.997 -10.402 9.651 120 HB ILE 16 HB ILE 16 95.941 -9.217 11.474 121 HG12 ILE 16 HG12 ILE 16 95.550 -11.775 9.876 122 HG13 ILE 16 HG13 ILE 16 95.142 -11.469 11.581 123 HG21 ILE 16 HG21 ILE 16 96.853 -8.441 9.115 124 HG22 ILE 16 HG22 ILE 16 95.717 -9.663 8.495 125 HG23 ILE 16 HG23 ILE 16 95.116 -8.308 9.480 126 HD11 ILE 16 HD11 ILE 16 93.045 -11.256 10.555 127 HD12 ILE 16 HD12 ILE 16 93.729 -10.534 9.079 128 HD13 ILE 16 HD13 ILE 16 93.606 -9.567 10.569 129 H TRP 17 H TRP 17 99.230 -8.566 9.826 130 HA TRP 17 HA TRP 17 99.589 -7.329 12.537 131 HB2 TRP 17 HB3 TRP 17 101.966 -8.151 10.815 132 HB3 TRP 17 HB2 TRP 17 102.003 -7.452 12.451 133 HD1 TRP 17 HD1 TRP 17 100.184 -9.108 14.137 134 HE1 TRP 17 HE1 TRP 17 100.479 -11.642 14.529 135 HE3 TRP 17 HE3 TRP 17 103.001 -10.236 10.035 136 HZ2 TRP 17 HZ2 TRP 17 101.782 -13.855 13.213 137 HZ3 TRP 17 HZ3 TRP 17 103.757 -12.560 9.628 138 HH2 TRP 17 HH2 TRP 17 103.154 -14.368 11.213 139 H ARG 18 H ARG 18 100.233 -5.125 12.404 140 HA ARG 18 HA ARG 18 100.051 -4.010 9.599 141 HB2 ARG 18 HB2 ARG 18 98.358 -3.279 11.350 142 HB3 ARG 18 HB3 ARG 18 99.704 -2.533 12.244 143 HG2 ARG 18 HG3 ARG 18 100.263 -1.284 10.069 144 HG3 ARG 18 HG2 ARG 18 98.682 -1.834 9.466 145 HD2 ARG 18 HD2 ARG 18 99.284 -0.001 11.809 146 HD3 ARG 18 HD3 ARG 18 98.222 0.294 10.411 147 HE ARG 18 HE ARG 18 97.310 -1.997 12.000 148 HH11 ARG 18 HH11 ARG 18 95.419 -1.658 13.189 149 HH12 ARG 18 HH12 ARG 18 94.843 -0.031 13.473 150 HH21 ARG 18 HH21 ARG 18 97.456 1.473 11.731 151 HH22 ARG 18 HH22 ARG 18 95.991 1.735 12.651 152 H VAL 19 H VAL 19 101.822 -3.007 8.740 153 HA VAL 19 HA VAL 19 104.294 -2.934 10.373 154 HB VAL 19 HB VAL 19 104.189 -1.613 7.690 155 HG11 VAL 19 HG11 VAL 19 106.302 -1.941 8.945 156 HG12 VAL 19 HG12 VAL 19 106.304 -2.873 7.429 157 HG13 VAL 19 HG13 VAL 19 106.009 -3.696 8.979 158 HG21 VAL 19 HG21 VAL 19 104.332 -3.975 6.661 159 HG22 VAL 19 HG22 VAL 19 102.718 -3.419 7.163 160 HG23 VAL 19 HG23 VAL 19 103.625 -4.559 8.186 161 H GLU 20 H GLU 20 105.365 -1.085 11.073 162 HA GLU 20 HA GLU 20 104.162 1.578 10.427 163 HB2 GLU 20 HB2 GLU 20 103.303 0.255 12.703 164 HB3 GLU 20 HB3 GLU 20 104.658 1.225 13.328 165 HG2 GLU 20 HG3 GLU 20 102.339 2.303 11.664 166 HG3 GLU 20 HG2 GLU 20 102.503 2.470 13.428 167 H LYS 21 H LYS 21 106.111 2.227 9.487 168 HA LYS 21 HA LYS 21 108.386 2.880 9.425 169 HB2 LYS 21 HB2 LYS 21 107.241 4.264 11.388 170 HB3 LYS 21 HB3 LYS 21 108.303 3.270 12.416 171 HG2 LYS 21 HG2 LYS 21 110.244 3.963 10.949 172 HG3 LYS 21 HG3 LYS 21 109.144 5.086 10.114 173 HD2 LYS 21 HD2 LYS 21 108.602 5.886 12.591 174 HD3 LYS 21 HD3 LYS 21 110.200 5.183 12.937 175 HE2 LYS 21 HE3 LYS 21 109.475 7.571 11.278 176 HE3 LYS 21 HE2 LYS 21 110.888 7.299 12.326 177 HZ1 LYS 21 HZ1 LYS 21 111.687 7.207 10.154 178 HZ2 LYS 21 HZ2 LYS 21 110.432 6.292 9.601 179 HZ3 LYS 21 HZ3 LYS 21 111.567 5.622 10.591 180 H PHE 22 H PHE 22 107.885 0.051 9.791 181 HA PHE 22 HA PHE 22 109.225 -1.854 10.219 182 HB2 PHE 22 HB2 PHE 22 111.405 -0.161 11.429 183 HB3 PHE 22 HB3 PHE 22 111.534 -1.586 10.370 184 HD1 PHE 22 HD1 PHE 22 109.981 -1.061 8.058 185 HD2 PHE 22 HD2 PHE 22 112.257 1.740 10.390 186 HE1 PHE 22 HE1 PHE 22 110.179 0.425 6.082 187 HE2 PHE 22 HE2 PHE 22 112.457 3.222 8.413 188 HZ PHE 22 HZ PHE 22 111.416 2.567 6.261 189 H ASP 23 H ASP 23 107.305 -1.133 12.102 190 HA ASP 23 HA ASP 23 108.728 -1.873 14.671 191 HB2 ASP 23 HB2 ASP 23 106.337 -0.016 14.296 192 HB3 ASP 23 HB3 ASP 23 106.952 -0.572 15.871 193 H LEU 24 H LEU 24 106.139 -2.413 12.410 194 HA LEU 24 HA LEU 24 104.461 -4.073 12.353 195 HB2 LEU 24 HB2 LEU 24 106.505 -5.354 14.207 196 HB3 LEU 24 HB3 LEU 24 105.028 -6.196 13.681 197 HG LEU 24 HG LEU 24 106.783 -4.878 11.608 198 HD11 LEU 24 HD11 LEU 24 108.333 -6.210 13.015 199 HD12 LEU 24 HD12 LEU 24 108.099 -6.971 11.423 200 HD13 LEU 24 HD13 LEU 24 107.264 -7.623 12.853 201 HD21 LEU 24 HD21 LEU 24 104.581 -5.839 10.992 202 HD22 LEU 24 HD22 LEU 24 105.076 -7.407 11.674 203 HD23 LEU 24 HD23 LEU 24 105.912 -6.755 10.243 204 H VAL 25 H VAL 25 102.482 -3.865 13.256 205 HA VAL 25 HA VAL 25 102.295 -3.881 16.263 206 HB VAL 25 HB VAL 25 101.162 -1.772 14.379 207 HG11 VAL 25 HG11 VAL 25 99.407 -2.530 15.960 208 HG12 VAL 25 HG12 VAL 25 99.967 -0.889 16.364 209 HG13 VAL 25 HG13 VAL 25 100.527 -2.282 17.321 210 HG21 VAL 25 HG21 VAL 25 103.469 -1.407 15.215 211 HG22 VAL 25 HG22 VAL 25 102.897 -1.627 16.886 212 HG23 VAL 25 HG23 VAL 25 102.337 -0.234 15.930 213 HA PRO 26 HA PRO 26 99.359 -7.035 14.795 214 HB2 PRO 26 HB3 PRO 26 98.608 -6.769 17.703 215 HB3 PRO 26 HB2 PRO 26 98.889 -8.246 16.735 216 HG2 PRO 26 HG2 PRO 26 100.709 -7.316 18.477 217 HG3 PRO 26 HG3 PRO 26 101.179 -8.096 16.943 218 HD2 PRO 26 HD3 PRO 26 101.294 -5.206 17.719 219 HD3 PRO 26 HD2 PRO 26 102.299 -6.107 16.545 220 H VAL 27 H VAL 27 97.582 -6.340 13.701 221 HA VAL 27 HA VAL 27 96.134 -3.933 14.316 222 HB VAL 27 HB VAL 27 96.095 -5.133 12.111 223 HG11 VAL 27 HG11 VAL 27 95.020 -7.188 11.813 224 HG12 VAL 27 HG12 VAL 27 94.015 -6.989 13.268 225 HG13 VAL 27 HG13 VAL 27 95.739 -7.404 13.427 226 HG21 VAL 27 HG21 VAL 27 93.688 -4.761 11.669 227 HG22 VAL 27 HG22 VAL 27 94.352 -3.462 12.688 228 HG23 VAL 27 HG23 VAL 27 93.364 -4.750 13.419 229 HA PRO 28 HA PRO 28 93.846 -4.893 18.010 230 HB2 PRO 28 HB2 PRO 28 91.613 -3.587 16.451 231 HB3 PRO 28 HB3 PRO 28 92.152 -3.292 18.129 232 HG2 PRO 28 HG3 PRO 28 92.793 -1.655 16.074 233 HG3 PRO 28 HG2 PRO 28 93.860 -1.911 17.480 234 HD2 PRO 28 HD3 PRO 28 94.193 -2.816 14.670 235 HD3 PRO 28 HD2 PRO 28 95.421 -2.670 15.962 236 H THR 29 H THR 29 93.160 -6.958 18.362 237 HA THR 29 HA THR 29 91.861 -8.551 16.298 238 HB THR 29 HB THR 29 91.762 -9.092 19.289 239 HG1 THR 29 HG1 THR 29 93.827 -10.083 18.938 240 HG21 THR 29 HG21 THR 29 91.875 -11.443 18.515 241 HG22 THR 29 HG22 THR 29 91.950 -10.884 16.827 242 HG23 THR 29 HG23 THR 29 90.483 -10.600 17.795 243 H ASN 30 H ASN 30 90.701 -6.378 18.798 244 HA ASN 30 HA ASN 30 88.039 -7.327 19.140 245 HB2 ASN 30 HB2 ASN 30 88.953 -4.425 18.894 246 HB3 ASN 30 HB3 ASN 30 87.449 -4.988 19.660 247 HD21 ASN 30 HD21 ASN 30 89.465 -7.437 20.437 248 HD22 ASN 30 HD22 ASN 30 90.145 -6.825 21.928 249 H LEU 31 H LEU 31 89.281 -5.035 16.651 250 HA LEU 31 HA LEU 31 86.686 -5.082 15.238 251 HB2 LEU 31 HB3 LEU 31 89.415 -3.880 14.702 252 HB3 LEU 31 HB2 LEU 31 88.173 -3.909 13.428 253 HG LEU 31 HG LEU 31 88.192 -1.795 14.837 254 HD11 LEU 31 HD11 LEU 31 86.177 -2.524 13.586 255 HD12 LEU 31 HD12 LEU 31 85.678 -3.521 14.973 256 HD13 LEU 31 HD13 LEU 31 85.730 -1.748 15.124 257 HD21 LEU 31 HD21 LEU 31 87.457 -1.872 17.116 258 HD22 LEU 31 HD22 LEU 31 86.986 -3.583 16.982 259 HD23 LEU 31 HD23 LEU 31 88.708 -3.130 16.973 260 H TYR 32 H TYR 32 90.005 -6.235 14.467 261 HA TYR 32 HA TYR 32 90.684 -7.945 12.985 262 HB2 TYR 32 HB2 TYR 32 89.124 -9.150 14.732 263 HB3 TYR 32 HB3 TYR 32 87.979 -9.245 13.372 264 HD1 TYR 32 HD1 TYR 32 88.126 -11.086 11.952 265 HD2 TYR 32 HD2 TYR 32 91.629 -9.827 14.098 266 HE1 TYR 32 HE1 TYR 32 89.384 -13.015 11.031 267 HE2 TYR 32 HE2 TYR 32 92.886 -11.757 13.175 268 HH TYR 32 HH TYR 32 92.229 -14.135 12.253 269 H GLY 33 H GLY 33 90.700 -6.754 11.045 270 HA2 GLY 33 HA2 GLY 33 89.798 -7.295 8.706 271 HA3 GLY 33 HA3 GLY 33 88.177 -7.021 9.388 272 H ASP 34 H ASP 34 89.260 -4.774 11.102 273 HA ASP 34 HA ASP 34 88.671 -2.611 9.275 274 HB2 ASP 34 HB2 ASP 34 89.579 -1.149 11.117 275 HB3 ASP 34 HB3 ASP 34 88.380 -2.335 11.686 276 H PHE 35 H PHE 35 90.025 -1.242 8.086 277 HA PHE 35 HA PHE 35 92.985 -1.677 8.352 278 HB2 PHE 35 HB2 PHE 35 91.387 -2.082 5.788 279 HB3 PHE 35 HB3 PHE 35 93.157 -1.902 5.836 280 HD1 PHE 35 HD1 PHE 35 90.533 -4.245 5.852 281 HD2 PHE 35 HD2 PHE 35 94.337 -3.458 7.686 282 HE1 PHE 35 HE1 PHE 35 90.765 -6.651 6.404 283 HE2 PHE 35 HE2 PHE 35 94.568 -5.863 8.239 284 HZ PHE 35 HZ PHE 35 92.781 -7.461 7.599 285 H PHE 36 H PHE 36 94.140 0.178 7.962 286 HA PHE 36 HA PHE 36 92.511 2.607 7.272 287 HB2 PHE 36 HB2 PHE 36 95.309 2.236 8.426 288 HB3 PHE 36 HB3 PHE 36 94.617 3.822 8.007 289 HD1 PHE 36 HD1 PHE 36 93.725 0.703 9.919 290 HD2 PHE 36 HD2 PHE 36 93.438 4.982 9.652 291 HE1 PHE 36 HE1 PHE 36 92.537 0.760 12.096 292 HE2 PHE 36 HE2 PHE 36 92.248 5.036 11.827 293 HZ PHE 36 HZ PHE 36 91.799 2.926 13.049 294 H THR 37 H THR 37 92.439 3.057 5.120 295 HA THR 37 HA THR 37 94.421 2.007 3.257 296 HB THR 37 HB THR 37 93.204 3.161 1.564 297 HG1 THR 37 HG1 THR 37 93.001 5.223 2.150 298 HG21 THR 37 HG21 THR 37 91.023 2.377 1.937 299 HG22 THR 37 HG22 THR 37 91.038 2.855 3.651 300 HG23 THR 37 HG23 THR 37 91.959 1.429 3.117 301 H GLY 38 H GLY 38 96.437 2.720 4.105 302 HA2 GLY 38 HA3 GLY 38 97.457 5.129 2.926 303 HA3 GLY 38 HA2 GLY 38 97.093 5.475 4.635 304 H ASP 39 H ASP 39 97.614 2.660 5.433 305 HA ASP 39 HA ASP 39 100.630 2.805 5.316 306 HB2 ASP 39 HB2 ASP 39 99.326 2.895 7.564 307 HB3 ASP 39 HB3 ASP 39 98.992 1.169 7.282 308 H ALA 40 H ALA 40 100.858 0.046 6.318 309 HA ALA 40 HA ALA 40 99.721 -1.502 3.994 310 HB1 ALA 40 HB1 ALA 40 101.923 -2.577 3.619 311 HB2 ALA 40 HB2 ALA 40 102.645 -1.531 4.866 312 HB3 ALA 40 HB3 ALA 40 102.017 -0.819 3.360 313 H TYR 41 H TYR 41 99.181 -3.617 4.514 314 HA TYR 41 HA TYR 41 99.763 -4.413 7.380 315 HB2 TYR 41 HB2 TYR 41 97.348 -4.870 5.593 316 HB3 TYR 41 HB3 TYR 41 97.647 -5.866 7.037 317 HD1 TYR 41 HD1 TYR 41 97.322 -2.308 5.899 318 HD2 TYR 41 HD2 TYR 41 97.037 -5.078 9.171 319 HE1 TYR 41 HE1 TYR 41 96.366 -0.522 7.329 320 HE2 TYR 41 HE2 TYR 41 96.081 -3.291 10.600 321 HH TYR 41 HH TYR 41 96.288 -0.114 9.994 322 H VAL 42 H VAL 42 100.359 -6.596 7.760 323 HA VAL 42 HA VAL 42 101.067 -8.132 5.246 324 HB VAL 42 HB VAL 42 102.566 -7.903 7.892 325 HG11 VAL 42 HG11 VAL 42 102.553 -10.244 7.029 326 HG12 VAL 42 HG12 VAL 42 104.168 -9.505 6.917 327 HG13 VAL 42 HG13 VAL 42 103.155 -9.654 5.461 328 HG21 VAL 42 HG21 VAL 42 102.887 -6.050 6.254 329 HG22 VAL 42 HG22 VAL 42 104.366 -7.019 6.457 330 HG23 VAL 42 HG23 VAL 42 103.346 -7.243 5.016 331 H ILE 43 H ILE 43 100.313 -10.217 5.157 332 HA ILE 43 HA ILE 43 99.308 -11.419 7.740 333 HB ILE 43 HB ILE 43 97.787 -11.938 5.200 334 HG12 ILE 43 HG13 ILE 43 97.316 -9.485 6.944 335 HG13 ILE 43 HG12 ILE 43 98.124 -9.433 5.359 336 HG21 ILE 43 HG21 ILE 43 95.947 -12.230 6.749 337 HG22 ILE 43 HG22 ILE 43 97.355 -13.086 7.421 338 HG23 ILE 43 HG23 ILE 43 96.882 -11.500 8.076 339 HD11 ILE 43 HD11 ILE 43 95.711 -8.909 5.145 340 HD12 ILE 43 HD12 ILE 43 95.305 -10.476 5.886 341 HD13 ILE 43 HD13 ILE 43 96.114 -10.424 4.301 342 H LEU 44 H LEU 44 99.515 -13.645 7.879 343 HA LEU 44 HA LEU 44 100.951 -14.966 5.557 344 HB2 LEU 44 HB2 LEU 44 101.322 -15.408 8.557 345 HB3 LEU 44 HB3 LEU 44 102.100 -16.375 7.283 346 HG LEU 44 HG LEU 44 102.483 -13.401 7.835 347 HD11 LEU 44 HD11 LEU 44 103.741 -14.968 9.293 348 HD12 LEU 44 HD12 LEU 44 104.836 -14.107 8.185 349 HD13 LEU 44 HD13 LEU 44 104.380 -15.794 7.851 350 HD21 LEU 44 HD21 LEU 44 104.292 -13.855 5.938 351 HD22 LEU 44 HD22 LEU 44 103.149 -15.131 5.455 352 HD23 LEU 44 HD23 LEU 44 102.619 -13.433 5.504 353 H LYS 45 H LYS 45 100.343 -17.195 5.157 354 HA LYS 45 HA LYS 45 98.006 -18.146 6.811 355 HB2 LYS 45 HB3 LYS 45 97.581 -16.979 4.383 356 HB3 LYS 45 HB2 LYS 45 97.831 -18.668 3.882 357 HG2 LYS 45 HG2 LYS 45 96.116 -19.407 5.513 358 HG3 LYS 45 HG3 LYS 45 95.867 -17.719 6.019 359 HD2 LYS 45 HD3 LYS 45 94.175 -17.892 4.442 360 HD3 LYS 45 HD2 LYS 45 95.507 -17.379 3.380 361 HE2 LYS 45 HE2 LYS 45 95.985 -19.734 2.815 362 HE3 LYS 45 HE3 LYS 45 94.685 -20.270 3.907 363 HZ1 LYS 45 HZ1 LYS 45 93.305 -19.995 2.224 364 HZ2 LYS 45 HZ2 LYS 45 93.603 -18.373 2.226 365 HZ3 LYS 45 HZ3 LYS 45 94.487 -19.373 1.256 366 H THR 46 H THR 46 99.262 -19.770 7.753 367 HA THR 46 HA THR 46 100.790 -21.659 6.055 368 HB THR 46 HB THR 46 100.181 -22.628 8.741 369 HG1 THR 46 HG1 THR 46 100.126 -20.744 9.700 370 HG21 THR 46 HG21 THR 46 102.648 -22.531 8.937 371 HG22 THR 46 HG22 THR 46 102.729 -21.571 7.440 372 HG23 THR 46 HG23 THR 46 102.157 -23.255 7.387 373 H VAL 47 H VAL 47 99.552 -22.954 4.758 374 HA VAL 47 HA VAL 47 96.953 -23.995 5.808 375 HB VAL 47 HB VAL 47 97.967 -24.970 3.195 376 HG11 VAL 47 HG11 VAL 47 95.646 -25.308 3.999 377 HG12 VAL 47 HG12 VAL 47 95.676 -24.327 2.515 378 HG13 VAL 47 HG13 VAL 47 95.424 -23.544 4.093 379 HG21 VAL 47 HG21 VAL 47 97.415 -22.709 2.134 380 HG22 VAL 47 HG22 VAL 47 97.525 -22.013 3.769 381 HG23 VAL 47 HG23 VAL 47 98.951 -22.780 3.031 382 H GLN 48 H GLN 48 96.514 -26.361 5.513 383 HA GLN 48 HA GLN 48 99.014 -27.945 6.164 384 HB2 GLN 48 HB2 GLN 48 97.489 -27.794 8.087 385 HB3 GLN 48 HB3 GLN 48 96.133 -28.360 7.083 386 HG2 GLN 48 HG2 GLN 48 97.042 -30.538 6.874 387 HG3 GLN 48 HG3 GLN 48 98.667 -30.003 7.366 388 HE21 GLN 48 HE21 GLN 48 99.102 -30.937 9.370 389 HE22 GLN 48 HE22 GLN 48 97.977 -30.969 10.709 390 H LEU 49 H LEU 49 99.557 -29.259 4.499 391 HA LEU 49 HA LEU 49 97.700 -29.860 2.335 392 HB2 LEU 49 HB2 LEU 49 100.254 -31.366 3.028 393 HB3 LEU 49 HB3 LEU 49 99.478 -31.222 1.434 394 HG LEU 49 HG LEU 49 100.902 -29.065 3.036 395 HD11 LEU 49 HD11 LEU 49 101.281 -29.486 0.103 396 HD12 LEU 49 HD12 LEU 49 101.855 -30.797 1.161 397 HD13 LEU 49 HD13 LEU 49 102.483 -29.145 1.370 398 HD21 LEU 49 HD21 LEU 49 100.142 -27.655 0.931 399 HD22 LEU 49 HD22 LEU 49 99.037 -27.844 2.314 400 HD23 LEU 49 HD23 LEU 49 98.819 -28.844 0.858 401 H ARG 50 H ARG 50 99.416 -32.636 3.592 402 HA ARG 50 HA ARG 50 96.813 -34.055 3.820 403 HB2 ARG 50 HB2 ARG 50 99.446 -35.306 4.582 404 HB3 ARG 50 HB3 ARG 50 98.057 -36.022 3.730 405 HG2 ARG 50 HG2 ARG 50 98.583 -34.514 1.767 406 HG3 ARG 50 HG3 ARG 50 100.068 -34.019 2.615 407 HD2 ARG 50 HD3 ARG 50 100.350 -36.701 2.805 408 HD3 ARG 50 HD2 ARG 50 99.383 -36.630 1.312 409 HE ARG 50 HE ARG 50 102.180 -35.720 1.631 410 HH11 ARG 50 HH11 ARG 50 103.126 -34.947 -0.270 411 HH12 ARG 50 HH12 ARG 50 102.127 -34.574 -1.656 412 HH21 ARG 50 HH21 ARG 50 99.155 -35.461 -0.076 413 HH22 ARG 50 HH22 ARG 50 99.888 -34.863 -1.547 414 H ASN 51 H ASN 51 99.690 -33.831 5.961 415 HA ASN 51 HA ASN 51 98.117 -33.007 8.265 416 HB2 ASN 51 HB2 ASN 51 97.418 -35.483 7.868 417 HB3 ASN 51 HB3 ASN 51 99.058 -35.890 8.426 418 HD21 ASN 51 HD21 ASN 51 96.243 -36.219 9.715 419 HD22 ASN 51 HD22 ASN 51 96.446 -35.509 11.301 420 H GLY 52 H GLY 52 100.729 -32.664 6.742 421 HA2 GLY 52 HA3 GLY 52 102.417 -32.457 9.183 422 HA3 GLY 52 HA2 GLY 52 103.036 -33.565 7.936 423 H ASN 53 H ASN 53 102.545 -32.339 5.578 424 HA ASN 53 HA ASN 53 104.542 -30.238 5.528 425 HB2 ASN 53 HB2 ASN 53 103.810 -31.784 3.608 426 HB3 ASN 53 HB3 ASN 53 102.409 -30.704 3.409 427 HD21 ASN 53 HD21 ASN 53 103.226 -28.187 3.506 428 HD22 ASN 53 HD22 ASN 53 104.582 -27.865 2.448 429 H LEU 54 H LEU 54 104.256 -27.969 5.089 430 HA LEU 54 HA LEU 54 101.470 -26.917 5.507 431 HB2 LEU 54 HB2 LEU 54 102.320 -25.288 7.187 432 HB3 LEU 54 HB3 LEU 54 102.508 -26.966 7.747 433 HG LEU 54 HG LEU 54 104.715 -25.385 6.357 434 HD11 LEU 54 HD11 LEU 54 104.110 -24.344 8.524 435 HD12 LEU 54 HD12 LEU 54 105.699 -25.141 8.616 436 HD13 LEU 54 HD13 LEU 54 104.268 -25.926 9.326 437 HD21 LEU 54 HD21 LEU 54 105.914 -27.333 7.855 438 HD22 LEU 54 HD22 LEU 54 105.458 -27.548 6.148 439 HD23 LEU 54 HD23 LEU 54 104.388 -28.148 7.437 440 H GLN 55 H GLN 55 101.173 -24.781 4.628 441 HA GLN 55 HA GLN 55 103.553 -23.754 3.070 442 HB2 GLN 55 HB2 GLN 55 101.962 -25.077 1.612 443 HB3 GLN 55 HB3 GLN 55 100.700 -23.884 2.005 444 HG2 GLN 55 HG2 GLN 55 102.487 -22.120 1.228 445 HG3 GLN 55 HG3 GLN 55 103.251 -23.509 0.419 446 HE21 GLN 55 HE21 GLN 55 99.723 -22.904 0.919 447 HE22 GLN 55 HE22 GLN 55 99.343 -22.844 -0.788 448 H TYR 56 H TYR 56 103.965 -21.747 3.813 449 HA TYR 56 HA TYR 56 101.816 -20.134 5.094 450 HB2 TYR 56 HB2 TYR 56 104.753 -20.138 4.953 451 HB3 TYR 56 HB3 TYR 56 104.088 -18.507 4.713 452 HD1 TYR 56 HD1 TYR 56 105.501 -20.321 7.148 453 HD2 TYR 56 HD2 TYR 56 101.727 -18.414 6.386 454 HE1 TYR 56 HE1 TYR 56 105.103 -20.128 9.589 455 HE2 TYR 56 HE2 TYR 56 101.330 -18.223 8.826 456 HH TYR 56 HH TYR 56 103.318 -18.220 11.038 457 H ASP 57 H ASP 57 100.649 -18.545 4.055 458 HA ASP 57 HA ASP 57 101.502 -17.912 1.222 459 HB2 ASP 57 HB2 ASP 57 98.770 -17.321 2.395 460 HB3 ASP 57 HB3 ASP 57 99.228 -17.541 0.689 461 H LEU 58 H LEU 58 102.095 -15.837 0.751 462 HA LEU 58 HA LEU 58 102.007 -13.881 3.023 463 HB2 LEU 58 HB2 LEU 58 103.296 -13.579 0.279 464 HB3 LEU 58 HB3 LEU 58 103.591 -12.579 1.721 465 HG LEU 58 HG LEU 58 104.038 -15.566 1.841 466 HD11 LEU 58 HD11 LEU 58 105.240 -14.206 -0.152 467 HD12 LEU 58 HD12 LEU 58 106.335 -13.755 1.177 468 HD13 LEU 58 HD13 LEU 58 106.085 -15.471 0.772 469 HD21 LEU 58 HD21 LEU 58 105.973 -13.864 3.172 470 HD22 LEU 58 HD22 LEU 58 104.826 -15.020 3.889 471 HD23 LEU 58 HD23 LEU 58 104.327 -13.337 3.596 472 H HIS 59 H HIS 59 100.698 -12.110 3.034 473 HA HIS 59 HA HIS 59 99.399 -11.269 0.467 474 HB2 HIS 59 HB2 HIS 59 97.868 -12.076 2.980 475 HB3 HIS 59 HB3 HIS 59 97.152 -11.236 1.585 476 HD2 HIS 59 HD2 HIS 59 99.069 -14.706 2.143 477 HE1 HIS 59 HE1 HIS 59 96.318 -15.111 -1.037 478 H TYR 60 H TYR 60 100.078 -9.161 0.443 479 HA TYR 60 HA TYR 60 99.941 -7.667 3.063 480 HB2 TYR 60 HB2 TYR 60 101.181 -5.948 1.304 481 HB3 TYR 60 HB3 TYR 60 102.034 -7.073 2.386 482 HD1 TYR 60 HD1 TYR 60 101.814 -5.996 -0.919 483 HD2 TYR 60 HD2 TYR 60 102.085 -9.612 1.384 484 HE1 TYR 60 HE1 TYR 60 102.743 -7.179 -2.888 485 HE2 TYR 60 HE2 TYR 60 103.007 -10.797 -0.589 486 HH TYR 60 HH TYR 60 104.268 -9.301 -3.236 487 H TRP 61 H TRP 61 98.352 -6.185 3.337 488 HA TRP 61 HA TRP 61 96.621 -5.607 0.955 489 HB2 TRP 61 HB3 TRP 61 95.786 -6.384 3.320 490 HB3 TRP 61 HB2 TRP 61 96.048 -4.684 3.779 491 HD1 TRP 61 HD1 TRP 61 94.217 -6.703 1.019 492 HE1 TRP 61 HE1 TRP 61 92.076 -5.437 0.341 493 HE3 TRP 61 HE3 TRP 61 94.774 -2.546 3.932 494 HZ2 TRP 61 HZ2 TRP 61 90.789 -2.937 0.987 495 HZ3 TRP 61 HZ3 TRP 61 93.079 -0.739 3.883 496 HH2 TRP 61 HH2 TRP 61 91.089 -0.930 2.415 497 H LEU 62 H LEU 62 96.808 -3.736 -0.110 498 HA LEU 62 HA LEU 62 98.014 -1.386 1.374 499 HB2 LEU 62 HB2 LEU 62 98.188 -1.605 -1.626 500 HB3 LEU 62 HB3 LEU 62 99.302 -0.820 -0.483 501 HG LEU 62 HG LEU 62 98.925 -3.840 -0.654 502 HD11 LEU 62 HD11 LEU 62 100.037 -3.647 -2.636 503 HD12 LEU 62 HD12 LEU 62 100.483 -1.953 -2.323 504 HD13 LEU 62 HD13 LEU 62 101.454 -3.273 -1.626 505 HD21 LEU 62 HD21 LEU 62 99.811 -2.953 1.487 506 HD22 LEU 62 HD22 LEU 62 101.066 -3.849 0.598 507 HD23 LEU 62 HD23 LEU 62 101.074 -2.069 0.597 508 H GLY 63 H GLY 63 96.259 -0.097 1.815 509 HA2 GLY 63 HA2 GLY 63 93.822 -0.087 0.273 510 HA3 GLY 63 HA3 GLY 63 94.323 1.199 1.396 511 H ASN 64 H ASN 64 96.651 0.542 -1.016 512 HA ASN 64 HA ASN 64 97.309 1.762 -2.927 513 HB2 ASN 64 HB3 ASN 64 94.843 1.104 -3.539 514 HB3 ASN 64 HB2 ASN 64 94.485 2.815 -3.201 515 HD21 ASN 64 HD21 ASN 64 97.359 1.224 -4.755 516 HD22 ASN 64 HD22 ASN 64 97.257 2.167 -6.224 517 H GLU 65 H GLU 65 96.280 3.109 -0.087 518 HA GLU 65 HA GLU 65 96.747 5.927 -1.080 519 HB2 GLU 65 HB2 GLU 65 95.151 4.712 1.130 520 HB3 GLU 65 HB3 GLU 65 96.002 6.222 1.534 521 HG2 GLU 65 HG3 GLU 65 94.435 6.026 -1.045 522 HG3 GLU 65 HG2 GLU 65 93.581 6.332 0.486 523 H CYS 66 H CYS 66 98.565 3.455 -0.150 524 HA CYS 66 HA CYS 66 100.204 5.036 1.831 525 HB2 CYS 66 HB2 CYS 66 99.472 2.645 2.357 526 HB3 CYS 66 HB3 CYS 66 100.539 2.116 1.034 527 HG CYS 66 HG CYS 66 101.957 1.801 3.504 528 H SER 67 H SER 67 102.277 5.683 1.311 529 HA SER 67 HA SER 67 103.013 5.983 -1.438 530 HB2 SER 67 HB3 SER 67 105.404 6.242 -0.387 531 HB3 SER 67 HB2 SER 67 104.138 7.411 0.061 532 HG SER 67 HG SER 67 105.430 6.288 1.819 533 H GLN 68 H GLN 68 104.878 4.964 -2.569 534 HA GLN 68 HA GLN 68 104.680 2.034 -2.382 535 HB2 GLN 68 HB2 GLN 68 106.466 2.123 -4.184 536 HB3 GLN 68 HB3 GLN 68 104.983 3.030 -4.569 537 HG2 GLN 68 HG2 GLN 68 106.039 5.132 -3.923 538 HG3 GLN 68 HG3 GLN 68 107.486 4.272 -3.343 539 HE21 GLN 68 HE21 GLN 68 105.559 4.941 -6.325 540 HE22 GLN 68 HE22 GLN 68 106.906 4.724 -7.419 541 H ASP 69 H ASP 69 106.842 4.511 -1.154 542 HA ASP 69 HA ASP 69 109.180 2.906 -0.703 543 HB2 ASP 69 HB3 ASP 69 107.987 5.268 0.797 544 HB3 ASP 69 HB2 ASP 69 109.537 4.528 1.266 545 H GLU 70 H GLU 70 106.224 3.355 1.271 546 HA GLU 70 HA GLU 70 107.278 1.450 3.310 547 HB2 GLU 70 HB3 GLU 70 104.427 2.455 3.198 548 HB3 GLU 70 HB2 GLU 70 105.426 2.066 4.619 549 HG2 GLU 70 HG2 GLU 70 106.906 4.024 4.028 550 HG3 GLU 70 HG3 GLU 70 105.747 4.452 2.747 551 H SER 71 H SER 71 104.927 1.554 0.659 552 HA SER 71 HA SER 71 103.588 -0.928 1.208 553 HB2 SER 71 HB2 SER 71 103.158 0.919 -0.618 554 HB3 SER 71 HB3 SER 71 104.264 -0.061 -1.609 555 HG SER 71 HG SER 71 102.050 -0.710 -1.841 556 H GLY 72 H GLY 72 106.327 -0.331 -1.064 557 HA2 GLY 72 HA2 GLY 72 106.833 -3.116 -1.567 558 HA3 GLY 72 HA3 GLY 72 108.029 -1.813 -1.762 559 H ALA 73 H ALA 73 108.100 -0.903 0.944 560 HA ALA 73 HA ALA 73 110.096 -2.548 2.072 561 HB1 ALA 73 HB1 ALA 73 109.578 -1.449 4.234 562 HB2 ALA 73 HB2 ALA 73 108.024 -0.884 3.575 563 HB3 ALA 73 HB3 ALA 73 109.553 -0.273 2.898 564 H ALA 74 H ALA 74 106.566 -2.625 2.751 565 HA ALA 74 HA ALA 74 106.743 -4.838 4.612 566 HB1 ALA 74 HB1 ALA 74 104.311 -5.092 4.204 567 HB2 ALA 74 HB2 ALA 74 104.746 -3.381 4.432 568 HB3 ALA 74 HB3 ALA 74 104.434 -4.009 2.796 569 H ALA 75 H ALA 75 105.939 -4.733 1.110 570 HA ALA 75 HA ALA 75 105.686 -7.584 0.802 571 HB1 ALA 75 HB1 ALA 75 106.110 -7.156 -1.604 572 HB2 ALA 75 HB2 ALA 75 104.984 -5.953 -0.931 573 HB3 ALA 75 HB3 ALA 75 106.687 -5.519 -1.212 574 H ILE 76 H ILE 76 108.473 -5.505 1.176 575 HA ILE 76 HA ILE 76 110.371 -7.519 0.119 576 HB ILE 76 HB ILE 76 110.818 -4.994 1.770 577 HG12 ILE 76 HG13 ILE 76 109.836 -5.172 -0.803 578 HG13 ILE 76 HG12 ILE 76 110.771 -3.798 -0.171 579 HG21 ILE 76 HG21 ILE 76 112.728 -6.445 2.009 580 HG22 ILE 76 HG22 ILE 76 113.160 -5.221 0.791 581 HG23 ILE 76 HG23 ILE 76 112.702 -6.863 0.279 582 HD11 ILE 76 HD11 ILE 76 111.616 -4.760 -2.375 583 HD12 ILE 76 HD12 ILE 76 112.060 -6.229 -1.474 584 HD13 ILE 76 HD13 ILE 76 112.828 -4.674 -1.074 585 H PHE 77 H PHE 77 109.806 -6.078 3.383 586 HA PHE 77 HA PHE 77 111.437 -8.023 4.757 587 HB2 PHE 77 HB2 PHE 77 110.040 -5.747 5.480 588 HB3 PHE 77 HB3 PHE 77 109.072 -7.028 6.247 589 HD1 PHE 77 HD1 PHE 77 111.439 -4.783 7.076 590 HD2 PHE 77 HD2 PHE 77 110.964 -9.053 7.024 591 HE1 PHE 77 HE1 PHE 77 113.139 -4.995 8.869 592 HE2 PHE 77 HE2 PHE 77 112.667 -9.264 8.815 593 HZ PHE 77 HZ PHE 77 113.756 -7.235 9.736 594 H THR 78 H THR 78 107.987 -7.974 3.872 595 HA THR 78 HA THR 78 107.319 -10.416 5.315 596 HB THR 78 HB THR 78 106.036 -8.990 2.947 597 HG1 THR 78 HG1 THR 78 105.891 -7.910 4.937 598 HG21 THR 78 HG21 THR 78 104.076 -10.453 3.351 599 HG22 THR 78 HG22 THR 78 105.501 -11.408 2.875 600 HG23 THR 78 HG23 THR 78 104.999 -11.349 4.582 601 H VAL 79 H VAL 79 108.351 -9.737 1.948 602 HA VAL 79 HA VAL 79 108.073 -12.535 1.120 603 HB VAL 79 HB VAL 79 109.576 -10.155 -0.038 604 HG11 VAL 79 HG11 VAL 79 110.739 -12.258 -0.650 605 HG12 VAL 79 HG12 VAL 79 109.903 -11.557 -2.056 606 HG13 VAL 79 HG13 VAL 79 109.195 -12.950 -1.203 607 HG21 VAL 79 HG21 VAL 79 107.245 -11.644 -1.263 608 HG22 VAL 79 HG22 VAL 79 106.954 -10.444 0.018 609 HG23 VAL 79 HG23 VAL 79 107.747 -9.952 -1.497 610 H GLN 80 H GLN 80 110.976 -10.505 1.817 611 HA GLN 80 HA GLN 80 112.902 -12.575 1.572 612 HB2 GLN 80 HB2 GLN 80 112.804 -10.191 3.464 613 HB3 GLN 80 HB3 GLN 80 114.237 -11.228 3.264 614 HG2 GLN 80 HG3 GLN 80 112.859 -9.944 0.881 615 HG3 GLN 80 HG2 GLN 80 114.107 -9.081 1.811 616 HE21 GLN 80 HE21 GLN 80 113.668 -11.121 -0.852 617 HE22 GLN 80 HE22 GLN 80 115.286 -11.780 -0.940 618 H LEU 81 H LEU 81 111.397 -11.481 4.679 619 HA LEU 81 HA LEU 81 112.469 -13.592 6.257 620 HB2 LEU 81 HB3 LEU 81 110.674 -11.506 6.679 621 HB3 LEU 81 HB2 LEU 81 109.667 -12.950 6.930 622 HG LEU 81 HG LEU 81 110.801 -12.140 9.028 623 HD11 LEU 81 HD11 LEU 81 110.456 -14.317 9.538 624 HD12 LEU 81 HD12 LEU 81 112.155 -14.601 9.088 625 HD13 LEU 81 HD13 LEU 81 110.864 -14.838 7.886 626 HD21 LEU 81 HD21 LEU 81 113.118 -12.044 9.260 627 HD22 LEU 81 HD22 LEU 81 113.403 -13.229 7.963 628 HD23 LEU 81 HD23 LEU 81 112.944 -11.558 7.556 629 H ASP 82 H ASP 82 109.488 -13.556 4.242 630 HA ASP 82 HA ASP 82 108.435 -16.069 4.965 631 HB2 ASP 82 HB3 ASP 82 107.129 -15.746 3.141 632 HB3 ASP 82 HB2 ASP 82 108.081 -14.278 2.820 633 H ASP 83 H ASP 83 111.058 -15.413 2.587 634 HA ASP 83 HA ASP 83 111.608 -18.196 2.067 635 HB2 ASP 83 HB2 ASP 83 113.641 -15.921 2.145 636 HB3 ASP 83 HB3 ASP 83 113.765 -17.440 1.227 637 H TYR 84 H TYR 84 112.486 -15.984 4.668 638 HA TYR 84 HA TYR 84 114.427 -17.822 5.890 639 HB2 TYR 84 HB3 TYR 84 114.358 -15.322 6.291 640 HB3 TYR 84 HB2 TYR 84 112.853 -15.566 7.210 641 HD1 TYR 84 HD1 TYR 84 116.468 -15.726 7.289 642 HD2 TYR 84 HD2 TYR 84 112.901 -17.148 9.214 643 HE1 TYR 84 HE1 TYR 84 117.793 -16.337 9.295 644 HE2 TYR 84 HE2 TYR 84 114.227 -17.759 11.219 645 HH TYR 84 HH TYR 84 117.257 -16.642 11.855 646 H LEU 85 H LEU 85 110.950 -17.451 5.864 647 HA LEU 85 HA LEU 85 110.592 -19.060 8.333 648 HB2 LEU 85 HB3 LEU 85 108.991 -17.295 6.784 649 HB3 LEU 85 HB2 LEU 85 108.219 -18.894 6.661 650 HG LEU 85 HG LEU 85 108.248 -19.102 9.132 651 HD11 LEU 85 HD11 LEU 85 108.721 -16.712 10.259 652 HD12 LEU 85 HD12 LEU 85 110.031 -17.887 9.993 653 HD13 LEU 85 HD13 LEU 85 109.800 -16.539 8.854 654 HD21 LEU 85 HD21 LEU 85 106.570 -17.336 9.607 655 HD22 LEU 85 HD22 LEU 85 107.066 -16.470 8.133 656 HD23 LEU 85 HD23 LEU 85 106.294 -18.069 8.009 657 H ASN 86 H ASN 86 109.815 -19.523 4.836 658 HA ASN 86 HA ASN 86 110.073 -22.494 5.379 659 HB2 ASN 86 HB2 ASN 86 107.736 -21.920 4.931 660 HB3 ASN 86 HB3 ASN 86 108.205 -21.044 3.454 661 HD21 ASN 86 HD21 ASN 86 110.251 -23.734 3.811 662 HD22 ASN 86 HD22 ASN 86 109.381 -24.847 2.778 663 H GLY 87 H GLY 87 110.442 -19.881 2.969 664 HA2 GLY 87 HA2 GLY 87 112.779 -20.026 1.846 665 HA3 GLY 87 HA3 GLY 87 112.333 -21.708 1.469 666 H ARG 88 H ARG 88 109.505 -21.072 0.987 667 HA ARG 88 HA ARG 88 109.775 -19.430 -1.538 668 HB2 ARG 88 HB3 ARG 88 108.160 -21.995 -1.170 669 HB3 ARG 88 HB2 ARG 88 108.250 -21.017 -2.654 670 HG2 ARG 88 HG3 ARG 88 110.830 -21.957 -1.426 671 HG3 ARG 88 HG2 ARG 88 109.832 -23.151 -2.289 672 HD2 ARG 88 HD2 ARG 88 111.349 -22.199 -3.909 673 HD3 ARG 88 HD3 ARG 88 109.741 -21.510 -4.236 674 HE ARG 88 HE ARG 88 111.229 -19.805 -2.397 675 HH11 ARG 88 HH11 ARG 88 112.043 -17.881 -3.259 676 HH12 ARG 88 HH12 ARG 88 112.182 -17.690 -4.992 677 HH21 ARG 88 HH21 ARG 88 110.920 -20.858 -5.700 678 HH22 ARG 88 HH22 ARG 88 111.549 -19.368 -6.369 679 H ALA 89 H ALA 89 106.931 -21.140 -0.263 680 HA ALA 89 HA ALA 89 104.985 -20.252 0.787 681 HB1 ALA 89 HB1 ALA 89 105.151 -18.325 2.029 682 HB2 ALA 89 HB2 ALA 89 105.939 -17.422 0.713 683 HB3 ALA 89 HB3 ALA 89 106.889 -18.545 1.715 684 H VAL 90 H VAL 90 103.324 -18.329 0.256 685 HA VAL 90 HA VAL 90 103.288 -18.159 -2.763 686 HB VAL 90 HB VAL 90 100.894 -17.624 -0.993 687 HG11 VAL 90 HG11 VAL 90 101.277 -18.863 -3.756 688 HG12 VAL 90 HG12 VAL 90 99.712 -18.542 -2.970 689 HG13 VAL 90 HG13 VAL 90 100.771 -17.188 -3.431 690 HG21 VAL 90 HG21 VAL 90 100.427 -20.166 -1.412 691 HG22 VAL 90 HG22 VAL 90 101.527 -19.714 -0.088 692 HG23 VAL 90 HG23 VAL 90 102.188 -20.289 -1.638 693 H GLN 91 H GLN 91 102.719 -16.135 -3.750 694 HA GLN 91 HA GLN 91 103.120 -13.783 -1.881 695 HB2 GLN 91 HB2 GLN 91 103.879 -14.189 -4.802 696 HB3 GLN 91 HB3 GLN 91 103.916 -12.602 -3.997 697 HG2 GLN 91 HG3 GLN 91 105.502 -13.456 -2.324 698 HG3 GLN 91 HG2 GLN 91 105.421 -15.081 -3.048 699 HE21 GLN 91 HE21 GLN 91 107.743 -15.016 -3.567 700 HE22 GLN 91 HE22 GLN 91 108.326 -14.020 -4.882 701 H HIS 92 H HIS 92 101.376 -12.484 -1.654 702 HA HIS 92 HA HIS 92 99.465 -12.292 -3.987 703 HB2 HIS 92 HB2 HIS 92 98.794 -12.782 -1.059 704 HB3 HIS 92 HB3 HIS 92 97.603 -12.178 -2.235 705 HD2 HIS 92 HD2 HIS 92 100.000 -15.381 -2.018 706 HE1 HIS 92 HE1 HIS 92 96.465 -16.404 -4.091 707 H ARG 93 H ARG 93 99.274 -10.202 -4.574 708 HA ARG 93 HA ARG 93 99.822 -8.104 -2.459 709 HB2 ARG 93 HB2 ARG 93 101.421 -8.187 -4.398 710 HB3 ARG 93 HB3 ARG 93 100.054 -7.865 -5.491 711 HG2 ARG 93 HG2 ARG 93 99.649 -5.710 -4.481 712 HG3 ARG 93 HG3 ARG 93 100.783 -6.054 -3.153 713 HD2 ARG 93 HD2 ARG 93 101.425 -4.688 -5.477 714 HD3 ARG 93 HD3 ARG 93 102.599 -5.492 -4.409 715 HE ARG 93 HE ARG 93 101.478 -7.391 -6.320 716 HH11 ARG 93 HH11 ARG 93 102.842 -8.028 -8.004 717 HH12 ARG 93 HH12 ARG 93 104.262 -7.080 -8.388 718 HH21 ARG 93 HH21 ARG 93 103.674 -4.723 -5.894 719 HH22 ARG 93 HH22 ARG 93 104.730 -5.216 -7.198 720 H GLU 94 H GLU 94 98.016 -7.046 -1.807 721 HA GLU 94 HA GLU 94 95.717 -6.908 -3.771 722 HB2 GLU 94 HB2 GLU 94 95.776 -6.759 -0.725 723 HB3 GLU 94 HB3 GLU 94 94.320 -6.487 -1.711 724 HG2 GLU 94 HG3 GLU 94 94.134 -8.769 -1.204 725 HG3 GLU 94 HG2 GLU 94 94.955 -8.814 -2.783 726 H VAL 95 H VAL 95 96.312 -5.006 -4.866 727 HA VAL 95 HA VAL 95 97.030 -2.588 -3.297 728 HB VAL 95 HB VAL 95 96.351 -2.747 -6.259 729 HG11 VAL 95 HG11 VAL 95 96.575 -0.487 -5.259 730 HG12 VAL 95 HG12 VAL 95 97.919 -0.830 -6.374 731 HG13 VAL 95 HG13 VAL 95 98.174 -0.931 -4.615 732 HG21 VAL 95 HG21 VAL 95 98.994 -2.910 -6.345 733 HG22 VAL 95 HG22 VAL 95 98.802 -3.622 -4.726 734 HG23 VAL 95 HG23 VAL 95 98.019 -4.384 -6.131 735 H GLN 96 H GLN 96 94.450 -3.709 -2.662 736 HA GLN 96 HA GLN 96 92.180 -3.054 -2.496 737 HB2 GLN 96 HB2 GLN 96 93.742 -0.952 -1.761 738 HB3 GLN 96 HB3 GLN 96 92.860 -0.210 -3.117 739 HG2 GLN 96 HG3 GLN 96 90.748 -1.309 -1.965 740 HG3 GLN 96 HG2 GLN 96 91.788 -1.325 -0.521 741 HE21 GLN 96 HE21 GLN 96 90.570 0.358 0.576 742 HE22 GLN 96 HE22 GLN 96 90.604 2.015 0.017 743 H GLY 97 H GLY 97 91.172 -3.930 -4.311 744 HA2 GLY 97 HA2 GLY 97 89.713 -2.641 -6.128 745 HA3 GLY 97 HA3 GLY 97 91.307 -2.315 -6.850 746 H PHE 98 H PHE 98 92.695 -4.583 -6.713 747 HA PHE 98 HA PHE 98 90.873 -6.675 -7.930 748 HB2 PHE 98 HB3 PHE 98 92.540 -5.276 -9.456 749 HB3 PHE 98 HB2 PHE 98 93.754 -6.389 -8.780 750 HD1 PHE 98 HD1 PHE 98 93.568 -8.826 -9.158 751 HD2 PHE 98 HD2 PHE 98 90.813 -6.065 -10.956 752 HE1 PHE 98 HE1 PHE 98 92.817 -10.595 -10.726 753 HE2 PHE 98 HE2 PHE 98 90.063 -7.834 -12.525 754 HZ PHE 98 HZ PHE 98 91.065 -10.099 -12.408 755 H GLU 99 H GLU 99 91.032 -7.208 -5.449 756 HA GLU 99 HA GLU 99 93.550 -8.338 -4.490 757 HB2 GLU 99 HB2 GLU 99 90.789 -9.147 -3.518 758 HB3 GLU 99 HB3 GLU 99 92.306 -9.048 -2.592 759 HG2 GLU 99 HG2 GLU 99 92.295 -6.535 -3.090 760 HG3 GLU 99 HG3 GLU 99 90.632 -6.752 -3.688 761 H SER 100 H SER 100 93.240 -10.822 -3.617 762 HA SER 100 HA SER 100 92.870 -12.376 -6.166 763 HB2 SER 100 HB3 SER 100 93.950 -13.527 -3.587 764 HB3 SER 100 HB2 SER 100 94.341 -13.968 -5.267 765 HG SER 100 HG SER 100 95.419 -11.953 -5.465 766 H ALA 101 H ALA 101 92.058 -14.758 -5.653 767 HA ALA 101 HA ALA 101 89.340 -14.422 -4.569 768 HB1 ALA 101 HB1 ALA 101 89.083 -16.818 -5.152 769 HB2 ALA 101 HB2 ALA 101 90.831 -16.927 -5.469 770 HB3 ALA 101 HB3 ALA 101 89.802 -15.904 -6.500 771 H THR 102 H THR 102 92.311 -16.148 -3.560 772 HA THR 102 HA THR 102 91.140 -17.372 -1.215 773 HB THR 102 HB THR 102 93.996 -16.518 -1.854 774 HG1 THR 102 HG1 THR 102 94.173 -18.807 -2.177 775 HG21 THR 102 HG21 THR 102 93.946 -16.619 0.521 776 HG22 THR 102 HG22 THR 102 92.804 -17.984 0.523 777 HG23 THR 102 HG23 THR 102 94.494 -18.238 0.026 778 H PHE 103 H PHE 103 92.620 -14.191 -1.802 779 HA PHE 103 HA PHE 103 92.642 -13.397 1.005 780 HB2 PHE 103 HB2 PHE 103 93.985 -12.266 -0.769 781 HB3 PHE 103 HB3 PHE 103 92.479 -11.657 -1.497 782 HD1 PHE 103 HD1 PHE 103 91.015 -10.093 -0.190 783 HD2 PHE 103 HD2 PHE 103 94.914 -11.251 1.187 784 HE1 PHE 103 HE1 PHE 103 91.025 -8.181 1.391 785 HE2 PHE 103 HE2 PHE 103 94.924 -9.340 2.768 786 HZ PHE 103 HZ PHE 103 92.979 -7.806 2.869 787 H LEU 104 H LEU 104 90.366 -12.723 -1.703 788 HA LEU 104 HA LEU 104 88.492 -11.265 -0.023 789 HB2 LEU 104 HB3 LEU 104 88.266 -12.676 -2.704 790 HB3 LEU 104 HB2 LEU 104 86.863 -11.896 -1.936 791 HG LEU 104 HG LEU 104 89.443 -10.351 -2.167 792 HD11 LEU 104 HD11 LEU 104 89.071 -11.307 -4.425 793 HD12 LEU 104 HD12 LEU 104 88.751 -9.556 -4.410 794 HD13 LEU 104 HD13 LEU 104 87.394 -10.708 -4.401 795 HD21 LEU 104 HD21 LEU 104 87.510 -9.443 -0.904 796 HD22 LEU 104 HD22 LEU 104 86.484 -9.622 -2.348 797 HD23 LEU 104 HD23 LEU 104 87.841 -8.469 -2.357 798 H GLY 105 H GLY 105 89.201 -14.637 -0.413 799 HA2 GLY 105 HA2 GLY 105 86.536 -15.549 0.493 800 HA3 GLY 105 HA3 GLY 105 87.983 -16.565 0.286 801 H TYR 106 H TYR 106 89.805 -15.207 1.934 802 HA TYR 106 HA TYR 106 88.834 -16.109 4.572 803 HB2 TYR 106 HB2 TYR 106 91.275 -16.139 3.518 804 HB3 TYR 106 HB3 TYR 106 91.360 -14.501 4.209 805 HD1 TYR 106 HD1 TYR 106 90.769 -14.210 6.687 806 HD2 TYR 106 HD2 TYR 106 91.531 -18.039 4.896 807 HE1 TYR 106 HE1 TYR 106 91.180 -15.180 8.934 808 HE2 TYR 106 HE2 TYR 106 91.948 -19.007 7.142 809 HH TYR 106 HH TYR 106 91.032 -17.596 9.973 810 H PHE 107 H PHE 107 89.088 -13.072 2.838 811 HA PHE 107 HA PHE 107 88.272 -11.646 5.384 812 HB2 PHE 107 HB3 PHE 107 89.800 -10.670 2.936 813 HB3 PHE 107 HB2 PHE 107 89.124 -9.572 4.164 814 HD1 PHE 107 HD1 PHE 107 91.993 -11.393 3.229 815 HD2 PHE 107 HD2 PHE 107 89.683 -10.303 6.684 816 HE1 PHE 107 HE1 PHE 107 93.965 -11.797 4.676 817 HE2 PHE 107 HE2 PHE 107 91.657 -10.707 8.131 818 HZ PHE 107 HZ PHE 107 93.796 -11.458 7.127 819 H LYS 108 H LYS 108 86.091 -12.634 4.583 820 HA LYS 108 HA LYS 108 84.830 -11.609 2.205 821 HB2 LYS 108 HB2 LYS 108 82.698 -11.930 3.836 822 HB3 LYS 108 HB3 LYS 108 83.555 -13.309 3.107 823 HG2 LYS 108 HG2 LYS 108 84.703 -13.813 5.097 824 HG3 LYS 108 HG3 LYS 108 84.476 -12.176 5.757 825 HD2 LYS 108 HD3 LYS 108 83.008 -13.888 6.862 826 HD3 LYS 108 HD2 LYS 108 82.083 -12.590 6.070 827 HE2 LYS 108 HE2 LYS 108 82.754 -15.129 4.564 828 HE3 LYS 108 HE3 LYS 108 81.362 -15.082 5.672 829 HZ1 LYS 108 HZ1 LYS 108 80.284 -14.186 3.973 830 HZ2 LYS 108 HZ2 LYS 108 81.655 -13.907 3.099 831 HZ3 LYS 108 HZ3 LYS 108 81.152 -12.805 4.219 832 H SER 109 H SER 109 84.416 -10.506 5.606 833 HA SER 109 HA SER 109 83.545 -7.842 4.484 834 HB2 SER 109 HB2 SER 109 82.198 -9.329 6.250 835 HB3 SER 109 HB3 SER 109 83.310 -8.548 7.401 836 HG SER 109 HG SER 109 81.380 -7.310 7.049 837 H GLY 110 H GLY 110 86.343 -9.211 5.249 838 HA2 GLY 110 HA2 GLY 110 87.393 -7.337 7.261 839 HA3 GLY 110 HA3 GLY 110 88.353 -8.463 6.271 840 H LEU 111 H LEU 111 86.198 -5.662 5.575 841 HA LEU 111 HA LEU 111 88.529 -4.322 4.247 842 HB2 LEU 111 HB2 LEU 111 85.859 -4.848 2.883 843 HB3 LEU 111 HB3 LEU 111 87.157 -3.814 2.242 844 HG LEU 111 HG LEU 111 88.613 -6.031 2.679 845 HD11 LEU 111 HD11 LEU 111 86.704 -7.297 3.631 846 HD12 LEU 111 HD12 LEU 111 87.277 -8.042 2.120 847 HD13 LEU 111 HD13 LEU 111 85.793 -7.058 2.121 848 HD21 LEU 111 HD21 LEU 111 88.324 -4.850 0.515 849 HD22 LEU 111 HD22 LEU 111 86.738 -5.630 0.303 850 HD23 LEU 111 HD23 LEU 111 88.221 -6.614 0.301 851 H LYS 112 H LYS 112 88.431 -2.799 5.889 852 HA LYS 112 HA LYS 112 85.995 -1.008 5.782 853 HB2 LYS 112 HB3 LYS 112 86.775 -2.485 7.991 854 HB3 LYS 112 HB2 LYS 112 87.591 -0.930 8.276 855 HG2 LYS 112 HG2 LYS 112 85.449 0.264 7.966 856 HG3 LYS 112 HG3 LYS 112 84.626 -1.281 7.645 857 HD2 LYS 112 HD2 LYS 112 86.082 -0.561 10.229 858 HD3 LYS 112 HD3 LYS 112 84.317 -0.542 10.004 859 HE2 LYS 112 HE2 LYS 112 84.756 -3.038 9.150 860 HE3 LYS 112 HE3 LYS 112 86.202 -2.881 10.177 861 HZ1 LYS 112 HZ1 LYS 112 84.320 -3.724 11.413 862 HZ2 LYS 112 HZ2 LYS 112 84.762 -2.245 11.994 863 HZ3 LYS 112 HZ3 LYS 112 83.423 -2.391 11.043 864 H TYR 113 H TYR 113 86.666 0.770 4.682 865 HA TYR 113 HA TYR 113 89.513 1.589 4.768 866 HB2 TYR 113 HB3 TYR 113 87.349 3.333 3.611 867 HB3 TYR 113 HB2 TYR 113 88.987 3.001 2.998 868 HD1 TYR 113 HD1 TYR 113 88.976 -0.002 3.195 869 HD2 TYR 113 HD2 TYR 113 86.004 2.735 1.743 870 HE1 TYR 113 HE1 TYR 113 88.066 -1.775 1.721 871 HE2 TYR 113 HE2 TYR 113 85.091 0.962 0.268 872 HH TYR 113 HH TYR 113 86.068 -1.223 -0.837 873 H LYS 114 H LYS 114 90.187 2.547 6.635 874 HA LYS 114 HA LYS 114 88.440 4.783 7.702 875 HB2 LYS 114 HB2 LYS 114 90.168 2.785 9.227 876 HB3 LYS 114 HB3 LYS 114 89.452 4.240 9.959 877 HG2 LYS 114 HG3 LYS 114 87.281 3.100 8.660 878 HG3 LYS 114 HG2 LYS 114 88.180 1.671 9.223 879 HD2 LYS 114 HD2 LYS 114 87.424 4.046 10.985 880 HD3 LYS 114 HD3 LYS 114 86.520 2.515 10.913 881 HE2 LYS 114 HE3 LYS 114 89.498 2.540 11.489 882 HE3 LYS 114 HE2 LYS 114 88.313 2.804 12.791 883 HZ1 LYS 114 HZ1 LYS 114 88.876 0.478 12.558 884 HZ2 LYS 114 HZ2 LYS 114 88.384 0.470 10.984 885 HZ3 LYS 114 HZ3 LYS 114 87.286 0.715 12.190 886 H LYS 115 H LYS 115 89.466 6.625 7.053 887 HA LYS 115 HA LYS 115 92.332 6.742 6.547 888 HB2 LYS 115 HB3 LYS 115 91.985 9.104 6.192 889 HB3 LYS 115 HB2 LYS 115 90.545 8.270 5.562 890 HG2 LYS 115 HG2 LYS 115 89.600 8.636 7.994 891 HG3 LYS 115 HG3 LYS 115 90.856 9.894 8.097 892 HD2 LYS 115 HD2 LYS 115 89.953 10.840 5.920 893 HD3 LYS 115 HD3 LYS 115 88.599 9.693 6.057 894 HE2 LYS 115 HE2 LYS 115 87.884 10.678 8.152 895 HE3 LYS 115 HE3 LYS 115 89.350 11.683 8.242 896 HZ1 LYS 115 HZ1 LYS 115 87.468 12.927 7.410 897 HZ2 LYS 115 HZ2 LYS 115 87.266 11.872 6.159 898 HZ3 LYS 115 HZ3 LYS 115 88.625 12.803 6.242 899 H GLY 116 H GLY 116 93.920 6.800 8.047 900 HA2 GLY 116 HA3 GLY 116 94.238 8.586 10.150 901 HA3 GLY 116 HA2 GLY 116 93.246 7.302 10.883 902 H GLY 117 H GLY 117 94.933 6.601 12.282 903 HA2 GLY 117 HA3 GLY 117 96.730 4.626 11.089 904 HA3 GLY 117 HA2 GLY 117 97.625 6.077 11.600 905 H VAL 118 H VAL 118 98.657 5.420 13.452 906 HA VAL 118 HA VAL 118 96.874 4.285 15.622 907 HB VAL 118 HB VAL 118 99.847 3.724 15.276 908 HG11 VAL 118 HG11 VAL 118 98.924 3.481 17.565 909 HG12 VAL 118 HG12 VAL 118 97.647 2.412 16.936 910 HG13 VAL 118 HG13 VAL 118 99.349 1.896 16.876 911 HG21 VAL 118 HG21 VAL 118 98.573 2.810 13.354 912 HG22 VAL 118 HG22 VAL 118 99.145 1.505 14.420 913 HG23 VAL 118 HG23 VAL 118 97.442 2.021 14.480 914 H ALA 119 H ALA 119 100.175 5.687 15.307 915 HA ALA 119 HA ALA 119 99.869 7.061 17.895 916 HB1 ALA 119 HB1 ALA 119 102.088 8.029 17.355 917 HB2 ALA 119 HB2 ALA 119 102.075 6.270 17.089 918 HB3 ALA 119 HB3 ALA 119 101.968 7.381 15.702 919 H SER 120 H SER 120 99.424 7.877 14.490 920 HA SER 120 HA SER 120 99.190 10.778 15.128 921 HB2 SER 120 HB3 SER 120 98.859 9.157 12.577 922 HB3 SER 120 HB2 SER 120 98.520 10.903 12.661 923 HG SER 120 HG SER 120 100.707 10.449 12.032 924 H GLY 121 H GLY 121 97.327 8.259 15.791 925 HA2 GLY 121 HA2 GLY 121 94.731 9.147 14.735 926 HA3 GLY 121 HA3 GLY 121 94.989 7.911 15.989 927 H PHE 122 H PHE 122 96.736 9.994 17.456 928 HA PHE 122 HA PHE 122 94.529 11.034 19.105 929 HB2 PHE 122 HB3 PHE 122 97.547 11.449 19.155 930 HB3 PHE 122 HB2 PHE 122 96.440 12.186 20.338 931 HD1 PHE 122 HD1 PHE 122 97.295 8.857 18.814 932 HD2 PHE 122 HD2 PHE 122 95.842 10.984 22.252 933 HE1 PHE 122 HE1 PHE 122 97.267 6.742 20.111 934 HE2 PHE 122 HE2 PHE 122 95.814 8.869 23.549 935 HZ PHE 122 HZ PHE 122 96.528 6.750 22.478 936 H LYS 123 H LYS 123 96.780 12.352 16.688 937 HA LYS 123 HA LYS 123 95.728 15.105 17.124 938 HB2 LYS 123 HB3 LYS 123 98.152 14.445 16.438 939 HB3 LYS 123 HB2 LYS 123 97.473 14.208 14.810 940 HG2 LYS 123 HG2 LYS 123 98.285 16.480 14.911 941 HG3 LYS 123 HG3 LYS 123 96.509 16.560 14.985 942 HD2 LYS 123 HD2 LYS 123 96.494 17.217 17.207 943 HD3 LYS 123 HD3 LYS 123 98.001 16.349 17.584 944 HE2 LYS 123 HE2 LYS 123 97.992 18.760 15.739 945 HE3 LYS 123 HE3 LYS 123 98.088 18.950 17.506 946 HZ1 LYS 123 HZ1 LYS 123 100.271 18.824 16.505 947 HZ2 LYS 123 HZ2 LYS 123 99.935 17.347 15.851 948 HZ3 LYS 123 HZ3 LYS 123 100.024 17.523 17.489 949 H HIS 124 H HIS 124 95.038 12.320 15.164 950 HA HIS 124 HA HIS 124 93.387 12.006 13.498 951 HB2 HIS 124 HB2 HIS 124 92.114 13.451 15.286 952 HB3 HIS 124 HB3 HIS 124 92.309 14.769 14.106 953 HD2 HIS 124 HD2 HIS 124 89.264 14.020 14.217 954 HE1 HIS 124 HE1 HIS 124 89.895 11.278 11.068 955 HE2 HIS 124 HE2 HIS 124 88.109 12.574 12.355 956 H VAL 125 H VAL 125 95.667 12.610 12.353 957 HA VAL 125 HA VAL 125 94.867 14.539 10.193 958 HB VAL 125 HB VAL 125 97.597 14.617 11.549 959 HG11 VAL 125 HG11 VAL 125 97.562 15.264 9.155 960 HG12 VAL 125 HG12 VAL 125 97.863 16.677 10.196 961 HG13 VAL 125 HG13 VAL 125 96.250 16.420 9.488 962 HG21 VAL 125 HG21 VAL 125 96.706 16.951 12.251 963 HG22 VAL 125 HG22 VAL 125 96.101 15.540 13.150 964 HG23 VAL 125 HG23 VAL 125 95.091 16.295 11.894 965 H VAL 126 H VAL 126 95.791 14.033 8.167 966 HA VAL 126 HA VAL 126 97.383 11.452 8.145 967 HB VAL 126 HB VAL 126 95.447 12.406 5.993 968 HG11 VAL 126 HG11 VAL 126 97.221 10.831 5.273 969 HG12 VAL 126 HG12 VAL 126 96.761 9.715 6.581 970 HG13 VAL 126 HG13 VAL 126 95.624 10.046 5.252 971 HG21 VAL 126 HG21 VAL 126 94.235 11.977 8.114 972 HG22 VAL 126 HG22 VAL 126 93.882 10.715 6.910 973 HG23 VAL 126 HG23 VAL 126 95.019 10.383 8.238 974 HA PRO 127 HA PRO 127 99.997 14.925 6.433 975 HB2 PRO 127 HB2 PRO 127 102.002 12.766 7.046 976 HB3 PRO 127 HB3 PRO 127 102.071 14.518 7.393 977 HG2 PRO 127 HG2 PRO 127 101.555 12.706 9.310 978 HG3 PRO 127 HG3 PRO 127 100.812 14.329 9.304 979 HD2 PRO 127 HD3 PRO 127 99.586 11.669 8.650 980 HD3 PRO 127 HD2 PRO 127 98.821 13.134 9.338 981 H ASN 128 H ASN 128 100.241 15.071 4.252 982 HA ASN 128 HA ASN 128 100.232 12.558 2.645 983 HB2 ASN 128 HB2 ASN 128 100.381 15.447 1.687 984 HB3 ASN 128 HB3 ASN 128 99.924 14.016 0.731 985 HD21 ASN 128 HD21 ASN 128 97.701 14.079 0.373 986 HD22 ASN 128 HD22 ASN 128 96.514 14.501 1.588 987 H GLU 129 H GLU 129 101.829 12.440 0.763 988 HA GLU 129 HA GLU 129 104.506 12.350 1.760 989 HB2 GLU 129 HB2 GLU 129 103.619 12.691 -1.139 990 HB3 GLU 129 HB3 GLU 129 105.186 12.055 -0.584 991 HG2 GLU 129 HG3 GLU 129 102.464 10.818 0.032 992 HG3 GLU 129 HG2 GLU 129 103.607 10.226 -1.198 993 H VAL 130 H VAL 130 102.625 15.047 0.695 994 HA VAL 130 HA VAL 130 104.591 16.796 -0.374 995 HB VAL 130 HB VAL 130 102.347 17.492 1.573 996 HG11 VAL 130 HG11 VAL 130 104.012 19.306 1.278 997 HG12 VAL 130 HG12 VAL 130 103.845 19.170 -0.489 998 HG13 VAL 130 HG13 VAL 130 102.468 19.722 0.495 999 HG21 VAL 130 HG21 VAL 130 101.042 17.924 -0.492 1000 HG22 VAL 130 HG22 VAL 130 101.570 16.226 -0.412 1001 HG23 VAL 130 HG23 VAL 130 102.419 17.373 -1.476 1002 H VAL 131 H VAL 131 104.199 15.603 2.900 1003 HA VAL 131 HA VAL 131 105.507 17.554 4.445 1004 HB VAL 131 HB VAL 131 105.778 14.521 4.510 1005 HG11 VAL 131 HG11 VAL 131 107.757 15.571 5.570 1006 HG12 VAL 131 HG12 VAL 131 106.697 14.826 6.791 1007 HG13 VAL 131 HG13 VAL 131 106.685 16.591 6.560 1008 HG21 VAL 131 HG21 VAL 131 104.226 14.762 6.431 1009 HG22 VAL 131 HG22 VAL 131 104.215 16.527 6.199 1010 HG23 VAL 131 HG23 VAL 131 103.525 15.461 4.951 1011 H VAL 132 H VAL 132 107.012 15.092 2.316 1012 HA VAL 132 HA VAL 132 109.739 15.927 2.957 1013 HB VAL 132 HB VAL 132 108.553 14.416 0.588 1014 HG11 VAL 132 HG11 VAL 132 110.668 15.545 -0.051 1015 HG12 VAL 132 HG12 VAL 132 111.470 14.850 1.378 1016 HG13 VAL 132 HG13 VAL 132 110.896 13.784 0.073 1017 HG21 VAL 132 HG21 VAL 132 109.572 12.467 1.732 1018 HG22 VAL 132 HG22 VAL 132 110.148 13.533 3.036 1019 HG23 VAL 132 HG23 VAL 132 108.401 13.290 2.791 1020 H GLN 133 H GLN 133 107.275 17.020 0.682 1021 HA GLN 133 HA GLN 133 107.339 18.773 -0.907 1022 HB2 GLN 133 HB3 GLN 133 109.383 19.783 1.120 1023 HB3 GLN 133 HB2 GLN 133 108.679 20.773 -0.182 1024 HG2 GLN 133 HG2 GLN 133 106.377 19.997 0.794 1025 HG3 GLN 133 HG3 GLN 133 107.317 19.573 2.245 1026 HE21 GLN 133 HE21 GLN 133 105.378 21.629 2.413 1027 HE22 GLN 133 HE22 GLN 133 106.196 23.165 2.586 Start of MODEL 2 1 H1 GLU 1 H1 GLU 1 112.519 -4.868 22.128 2 H2 GLU 1 H2 GLU 1 111.985 -5.213 23.649 3 H3 GLU 1 H3 GLU 1 113.564 -5.474 23.250 4 HA GLU 1 HA GLU 1 113.175 -7.380 22.116 5 HB2 GLU 1 HB2 GLU 1 110.790 -7.182 24.011 6 HB3 GLU 1 HB3 GLU 1 111.480 -8.685 23.352 7 HG2 GLU 1 HG3 GLU 1 113.680 -8.069 24.423 8 HG3 GLU 1 HG2 GLU 1 112.865 -6.686 25.192 9 H HIS 2 H HIS 2 112.423 -7.874 20.118 10 HA HIS 2 HA HIS 2 109.547 -7.333 19.496 11 HB2 HIS 2 HB2 HIS 2 110.508 -6.372 17.199 12 HB3 HIS 2 HB3 HIS 2 110.270 -5.308 18.606 13 HD2 HIS 2 HD2 HIS 2 112.542 -3.769 18.858 14 HE1 HIS 2 HE1 HIS 2 115.403 -6.685 17.788 15 HE2 HIS 2 HE2 HIS 2 115.101 -4.266 18.551 16 HA PRO 3 HA PRO 3 111.533 -11.171 17.637 17 HB2 PRO 3 HB3 PRO 3 110.062 -13.025 19.038 18 HB3 PRO 3 HB2 PRO 3 111.605 -12.353 19.641 19 HG2 PRO 3 HG2 PRO 3 108.785 -11.665 20.383 20 HG3 PRO 3 HG3 PRO 3 110.243 -11.769 21.407 21 HD2 PRO 3 HD2 PRO 3 109.165 -9.379 20.478 22 HD3 PRO 3 HD3 PRO 3 110.881 -9.599 20.935 23 H GLU 4 H GLU 4 108.817 -9.456 17.355 24 HA GLU 4 HA GLU 4 106.723 -11.179 16.532 25 HB2 GLU 4 HB2 GLU 4 107.645 -8.528 15.344 26 HB3 GLU 4 HB3 GLU 4 106.109 -9.322 14.922 27 HG2 GLU 4 HG2 GLU 4 106.893 -8.693 17.794 28 HG3 GLU 4 HG3 GLU 4 105.987 -7.548 16.776 29 H PHE 5 H PHE 5 109.448 -9.933 14.534 30 HA PHE 5 HA PHE 5 108.689 -11.385 12.152 31 HB2 PHE 5 HB2 PHE 5 111.416 -10.445 13.143 32 HB3 PHE 5 HB3 PHE 5 111.107 -11.077 11.508 33 HD1 PHE 5 HD1 PHE 5 110.685 -8.244 13.791 34 HD2 PHE 5 HD2 PHE 5 109.595 -9.852 9.960 35 HE1 PHE 5 HE1 PHE 5 109.901 -6.003 13.073 36 HE2 PHE 5 HE2 PHE 5 108.808 -7.613 9.244 37 HZ PHE 5 HZ PHE 5 108.963 -5.688 10.799 38 H LEU 6 H LEU 6 110.601 -12.277 15.009 39 HA LEU 6 HA LEU 6 111.416 -14.858 13.811 40 HB2 LEU 6 HB2 LEU 6 111.632 -13.642 16.592 41 HB3 LEU 6 HB3 LEU 6 112.154 -15.306 16.239 42 HG LEU 6 HG LEU 6 114.019 -13.626 16.079 43 HD11 LEU 6 HD11 LEU 6 114.086 -15.738 14.779 44 HD12 LEU 6 HD12 LEU 6 113.211 -14.945 13.448 45 HD13 LEU 6 HD13 LEU 6 114.852 -14.408 13.880 46 HD21 LEU 6 HD21 LEU 6 114.012 -11.907 14.450 47 HD22 LEU 6 HD22 LEU 6 112.364 -11.854 15.121 48 HD23 LEU 6 HD23 LEU 6 112.662 -12.641 13.552 49 H LYS 7 H LYS 7 108.765 -13.623 15.764 50 HA LYS 7 HA LYS 7 107.901 -16.243 16.750 51 HB2 LYS 7 HB2 LYS 7 106.811 -13.459 16.671 52 HB3 LYS 7 HB3 LYS 7 105.613 -14.770 16.787 53 HG2 LYS 7 HG2 LYS 7 108.054 -14.586 18.600 54 HG3 LYS 7 HG3 LYS 7 106.479 -13.872 19.021 55 HD2 LYS 7 HD3 LYS 7 105.632 -16.343 18.349 56 HD3 LYS 7 HD2 LYS 7 107.291 -16.757 18.843 57 HE2 LYS 7 HE3 LYS 7 105.078 -15.494 20.483 58 HE3 LYS 7 HE2 LYS 7 106.073 -16.921 20.860 59 HZ1 LYS 7 HZ1 LYS 7 107.009 -15.267 22.130 60 HZ2 LYS 7 HZ2 LYS 7 106.804 -14.088 20.995 61 HZ3 LYS 7 HZ3 LYS 7 107.978 -15.230 20.796 62 H ALA 8 H ALA 8 107.332 -14.342 13.819 63 HA ALA 8 HA ALA 8 105.066 -15.917 12.882 64 HB1 ALA 8 HB1 ALA 8 107.151 -14.356 11.287 65 HB2 ALA 8 HB2 ALA 8 105.646 -13.682 11.958 66 HB3 ALA 8 HB3 ALA 8 105.575 -14.916 10.677 67 H GLY 9 H GLY 9 105.102 -17.525 11.147 68 HA2 GLY 9 HA2 GLY 9 106.178 -19.228 9.834 69 HA3 GLY 9 HA3 GLY 9 107.743 -18.772 10.546 70 H LYS 10 H LYS 10 105.145 -19.159 12.802 71 HA LYS 10 HA LYS 10 105.916 -22.022 13.298 72 HB2 LYS 10 HB3 LYS 10 106.204 -19.712 15.252 73 HB3 LYS 10 HB2 LYS 10 106.059 -21.400 15.797 74 HG2 LYS 10 HG2 LYS 10 108.020 -22.008 14.389 75 HG3 LYS 10 HG3 LYS 10 108.177 -20.306 13.892 76 HD2 LYS 10 HD2 LYS 10 108.700 -19.604 16.124 77 HD3 LYS 10 HD3 LYS 10 108.200 -21.170 16.808 78 HE2 LYS 10 HE3 LYS 10 110.060 -22.279 15.568 79 HE3 LYS 10 HE2 LYS 10 110.576 -20.691 14.953 80 HZ1 LYS 10 HZ1 LYS 10 111.809 -21.327 16.916 81 HZ2 LYS 10 HZ2 LYS 10 110.422 -21.459 17.799 82 HZ3 LYS 10 HZ3 LYS 10 110.900 -19.987 17.228 83 H GLU 11 H GLU 11 103.677 -19.346 13.559 84 HA GLU 11 HA GLU 11 101.717 -21.047 15.063 85 HB2 GLU 11 HB3 GLU 11 101.956 -18.145 14.321 86 HB3 GLU 11 HB2 GLU 11 100.319 -18.808 14.536 87 HG2 GLU 11 HG2 GLU 11 102.522 -19.246 16.584 88 HG3 GLU 11 HG3 GLU 11 101.450 -17.826 16.635 89 HA PRO 12 HA PRO 12 100.159 -22.190 10.981 90 HB2 PRO 12 HB2 PRO 12 98.431 -24.140 11.841 91 HB3 PRO 12 HB3 PRO 12 100.197 -24.388 11.731 92 HG2 PRO 12 HG3 PRO 12 98.488 -23.842 14.120 93 HG3 PRO 12 HG2 PRO 12 99.922 -24.892 13.958 94 HD2 PRO 12 HD2 PRO 12 99.944 -22.323 15.073 95 HD3 PRO 12 HD3 PRO 12 101.377 -23.155 14.401 96 H GLY 13 H GLY 13 98.003 -22.181 9.893 97 HA2 GLY 13 HA2 GLY 13 95.616 -21.629 9.940 98 HA3 GLY 13 HA3 GLY 13 95.852 -20.833 11.515 99 H LEU 14 H LEU 14 95.689 -18.654 11.384 100 HA LEU 14 HA LEU 14 96.921 -17.317 8.976 101 HB2 LEU 14 HB2 LEU 14 94.485 -17.476 8.576 102 HB3 LEU 14 HB3 LEU 14 94.170 -16.706 10.149 103 HG LEU 14 HG LEU 14 96.045 -15.216 8.385 104 HD11 LEU 14 HD11 LEU 14 94.441 -16.082 6.702 105 HD12 LEU 14 HD12 LEU 14 94.234 -14.331 6.946 106 HD13 LEU 14 HD13 LEU 14 93.086 -15.474 7.684 107 HD21 LEU 14 HD21 LEU 14 95.179 -14.345 10.543 108 HD22 LEU 14 HD22 LEU 14 94.663 -13.319 9.183 109 HD23 LEU 14 HD23 LEU 14 93.516 -14.463 9.920 110 H GLN 15 H GLN 15 97.827 -15.283 9.401 111 HA GLN 15 HA GLN 15 97.582 -14.270 12.235 112 HB2 GLN 15 HB2 GLN 15 100.234 -14.400 10.749 113 HB3 GLN 15 HB3 GLN 15 99.956 -14.043 12.470 114 HG2 GLN 15 HG3 GLN 15 98.826 -16.452 12.453 115 HG3 GLN 15 HG2 GLN 15 99.855 -16.687 11.021 116 HE21 GLN 15 HE21 GLN 15 102.126 -16.932 11.335 117 HE22 GLN 15 HE22 GLN 15 102.866 -16.924 12.920 118 H ILE 16 H ILE 16 97.724 -11.988 12.392 119 HA ILE 16 HA ILE 16 97.996 -10.575 9.725 120 HB ILE 16 HB ILE 16 96.140 -9.821 12.024 121 HG12 ILE 16 HG12 ILE 16 95.202 -10.779 9.323 122 HG13 ILE 16 HG13 ILE 16 95.709 -11.983 10.532 123 HG21 ILE 16 HG21 ILE 16 96.925 -7.920 10.639 124 HG22 ILE 16 HG22 ILE 16 96.409 -8.780 9.168 125 HG23 ILE 16 HG23 ILE 16 95.198 -8.247 10.359 126 HD11 ILE 16 HD11 ILE 16 93.278 -11.526 10.697 127 HD12 ILE 16 HD12 ILE 16 93.621 -9.799 10.962 128 HD13 ILE 16 HD13 ILE 16 94.128 -11.003 12.171 129 H TRP 17 H TRP 17 99.383 -8.867 9.692 130 HA TRP 17 HA TRP 17 100.172 -7.618 12.314 131 HB2 TRP 17 HB2 TRP 17 102.202 -8.535 10.228 132 HB3 TRP 17 HB3 TRP 17 102.546 -7.807 11.816 133 HD1 TRP 17 HD1 TRP 17 100.805 -9.387 13.749 134 HE1 TRP 17 HE1 TRP 17 101.118 -11.910 14.177 135 HE3 TRP 17 HE3 TRP 17 103.256 -10.640 9.449 136 HZ2 TRP 17 HZ2 TRP 17 102.290 -14.167 12.814 137 HZ3 TRP 17 HZ3 TRP 17 103.960 -12.979 9.040 138 HH2 TRP 17 HH2 TRP 17 103.481 -14.743 10.714 139 H ARG 18 H ARG 18 99.758 -5.481 12.020 140 HA ARG 18 HA ARG 18 99.850 -4.379 9.236 141 HB2 ARG 18 HB2 ARG 18 97.908 -3.832 10.671 142 HB3 ARG 18 HB3 ARG 18 98.997 -3.112 11.880 143 HG2 ARG 18 HG3 ARG 18 99.782 -1.480 10.154 144 HG3 ARG 18 HG2 ARG 18 98.614 -2.171 9.003 145 HD2 ARG 18 HD2 ARG 18 97.396 -0.373 9.874 146 HD3 ARG 18 HD3 ARG 18 96.874 -1.699 10.940 147 HE ARG 18 HE ARG 18 99.178 -0.542 12.159 148 HH11 ARG 18 HH11 ARG 18 98.912 1.019 13.772 149 HH12 ARG 18 HH12 ARG 18 97.412 1.913 13.884 150 HH21 ARG 18 HH21 ARG 18 95.951 0.304 11.163 151 HH22 ARG 18 HH22 ARG 18 95.743 1.510 12.413 152 H VAL 19 H VAL 19 101.238 -2.692 8.609 153 HA VAL 19 HA VAL 19 103.585 -2.294 10.467 154 HB VAL 19 HB VAL 19 103.704 -1.387 7.622 155 HG11 VAL 19 HG11 VAL 19 105.635 -1.232 9.173 156 HG12 VAL 19 HG12 VAL 19 105.562 -2.990 9.437 157 HG13 VAL 19 HG13 VAL 19 105.979 -2.349 7.830 158 HG21 VAL 19 HG21 VAL 19 104.292 -3.815 6.986 159 HG22 VAL 19 HG22 VAL 19 102.564 -3.446 7.201 160 HG23 VAL 19 HG23 VAL 19 103.459 -4.293 8.485 161 H GLU 20 H GLU 20 104.252 -0.210 10.996 162 HA GLU 20 HA GLU 20 102.500 2.031 9.959 163 HB2 GLU 20 HB2 GLU 20 101.872 1.333 12.298 164 HB3 GLU 20 HB3 GLU 20 103.528 1.731 12.815 165 HG2 GLU 20 HG3 GLU 20 103.241 4.054 12.234 166 HG3 GLU 20 HG2 GLU 20 101.707 3.717 11.395 167 H LYS 21 H LYS 21 103.840 3.298 8.770 168 HA LYS 21 HA LYS 21 105.730 4.612 8.236 169 HB2 LYS 21 HB2 LYS 21 105.262 5.235 10.778 170 HB3 LYS 21 HB3 LYS 21 106.772 4.333 11.052 171 HG2 LYS 21 HG2 LYS 21 107.985 5.780 9.518 172 HG3 LYS 21 HG3 LYS 21 106.481 6.595 9.027 173 HD2 LYS 21 HD2 LYS 21 106.237 7.125 11.590 174 HD3 LYS 21 HD3 LYS 21 107.981 6.776 11.650 175 HE2 LYS 21 HE2 LYS 21 107.801 9.137 11.263 176 HE3 LYS 21 HE3 LYS 21 108.230 8.421 9.691 177 HZ1 LYS 21 HZ1 LYS 21 106.412 9.983 9.491 178 HZ2 LYS 21 HZ2 LYS 21 105.897 8.464 9.108 179 HZ3 LYS 21 HZ3 LYS 21 105.499 9.127 10.565 180 H PHE 22 H PHE 22 107.038 2.473 10.823 181 HA PHE 22 HA PHE 22 108.444 0.807 8.838 182 HB2 PHE 22 HB3 PHE 22 109.868 2.848 8.824 183 HB3 PHE 22 HB2 PHE 22 110.068 2.708 10.587 184 HD1 PHE 22 HD1 PHE 22 110.449 0.657 7.455 185 HD2 PHE 22 HD2 PHE 22 111.886 1.499 11.415 186 HE1 PHE 22 HE1 PHE 22 112.318 -0.938 7.117 187 HE2 PHE 22 HE2 PHE 22 113.755 -0.096 11.077 188 HZ PHE 22 HZ PHE 22 113.971 -1.315 8.927 189 H ASP 23 H ASP 23 106.713 0.823 11.407 190 HA ASP 23 HA ASP 23 108.457 -1.167 12.883 191 HB2 ASP 23 HB3 ASP 23 107.129 -0.440 14.952 192 HB3 ASP 23 HB2 ASP 23 108.298 0.748 14.326 193 H LEU 24 H LEU 24 107.590 -3.154 12.572 194 HA LEU 24 HA LEU 24 104.977 -3.669 11.544 195 HB2 LEU 24 HB3 LEU 24 106.911 -5.309 11.703 196 HB3 LEU 24 HB2 LEU 24 106.530 -5.490 13.432 197 HG LEU 24 HG LEU 24 104.192 -6.155 12.799 198 HD11 LEU 24 HD11 LEU 24 104.127 -5.013 10.595 199 HD12 LEU 24 HD12 LEU 24 103.752 -6.745 10.429 200 HD13 LEU 24 HD13 LEU 24 105.363 -6.136 9.978 201 HD21 LEU 24 HD21 LEU 24 104.812 -8.408 11.963 202 HD22 LEU 24 HD22 LEU 24 105.940 -7.861 13.227 203 HD23 LEU 24 HD23 LEU 24 106.423 -7.797 11.516 204 H VAL 25 H VAL 25 102.998 -4.268 12.554 205 HA VAL 25 HA VAL 25 102.877 -3.923 15.542 206 HB VAL 25 HB VAL 25 101.045 -2.471 13.578 207 HG11 VAL 25 HG11 VAL 25 100.200 -1.364 15.631 208 HG12 VAL 25 HG12 VAL 25 99.958 -3.126 15.704 209 HG13 VAL 25 HG13 VAL 25 101.285 -2.372 16.618 210 HG21 VAL 25 HG21 VAL 25 102.159 -0.418 14.417 211 HG22 VAL 25 HG22 VAL 25 103.254 -1.417 15.402 212 HG23 VAL 25 HG23 VAL 25 103.327 -1.503 13.626 213 HA PRO 26 HA PRO 26 100.257 -7.471 14.821 214 HB2 PRO 26 HB2 PRO 26 99.299 -7.759 17.388 215 HB3 PRO 26 HB3 PRO 26 100.950 -8.237 16.896 216 HG2 PRO 26 HG2 PRO 26 100.022 -5.790 18.348 217 HG3 PRO 26 HG3 PRO 26 101.493 -6.773 18.584 218 HD2 PRO 26 HD2 PRO 26 101.460 -4.358 17.221 219 HD3 PRO 26 HD3 PRO 26 102.660 -5.652 16.930 220 H VAL 27 H VAL 27 97.942 -8.082 14.950 221 HA VAL 27 HA VAL 27 96.107 -5.749 15.491 222 HB VAL 27 HB VAL 27 96.034 -7.482 12.979 223 HG11 VAL 27 HG11 VAL 27 94.291 -5.867 12.264 224 HG12 VAL 27 HG12 VAL 27 94.424 -5.033 13.831 225 HG13 VAL 27 HG13 VAL 27 93.814 -6.704 13.761 226 HG21 VAL 27 HG21 VAL 27 97.942 -5.897 12.980 227 HG22 VAL 27 HG22 VAL 27 96.699 -5.400 11.808 228 HG23 VAL 27 HG23 VAL 27 96.832 -4.562 13.372 229 HA PRO 28 HA PRO 28 93.969 -9.135 17.473 230 HB2 PRO 28 HB3 PRO 28 91.656 -7.786 18.113 231 HB3 PRO 28 HB2 PRO 28 93.190 -7.570 19.006 232 HG2 PRO 28 HG3 PRO 28 91.929 -5.854 16.902 233 HG3 PRO 28 HG2 PRO 28 92.818 -5.380 18.375 234 HD2 PRO 28 HD2 PRO 28 93.928 -5.366 15.832 235 HD3 PRO 28 HD3 PRO 28 94.881 -5.567 17.333 236 H THR 29 H THR 29 93.327 -10.692 16.015 237 HA THR 29 HA THR 29 91.738 -10.261 13.681 238 HB THR 29 HB THR 29 91.895 -12.744 15.449 239 HG1 THR 29 HG1 THR 29 93.532 -13.301 13.904 240 HG21 THR 29 HG21 THR 29 91.266 -13.948 13.378 241 HG22 THR 29 HG22 THR 29 91.105 -12.395 12.524 242 HG23 THR 29 HG23 THR 29 89.997 -12.796 13.858 243 H ASN 30 H ASN 30 90.815 -10.423 17.050 244 HA ASN 30 HA ASN 30 87.970 -10.992 16.434 245 HB2 ASN 30 HB2 ASN 30 87.716 -10.354 18.921 246 HB3 ASN 30 HB3 ASN 30 88.719 -11.780 18.560 247 HD21 ASN 30 HD21 ASN 30 88.758 -9.488 20.758 248 HD22 ASN 30 HD22 ASN 30 90.449 -9.038 20.784 249 H LEU 31 H LEU 31 90.041 -8.189 16.699 250 HA LEU 31 HA LEU 31 87.563 -6.458 16.529 251 HB2 LEU 31 HB2 LEU 31 90.051 -6.220 18.151 252 HB3 LEU 31 HB3 LEU 31 89.507 -4.721 17.362 253 HG LEU 31 HG LEU 31 87.214 -5.112 18.322 254 HD11 LEU 31 HD11 LEU 31 87.407 -7.571 18.591 255 HD12 LEU 31 HD12 LEU 31 86.992 -6.790 20.136 256 HD13 LEU 31 HD13 LEU 31 88.659 -7.336 19.835 257 HD21 LEU 31 HD21 LEU 31 87.836 -4.494 20.642 258 HD22 LEU 31 HD22 LEU 31 89.503 -5.041 20.340 259 HD23 LEU 31 HD23 LEU 31 88.853 -3.638 19.458 260 H TYR 32 H TYR 32 89.667 -7.797 14.553 261 HA TYR 32 HA TYR 32 90.867 -5.458 13.252 262 HB2 TYR 32 HB2 TYR 32 91.479 -7.032 11.471 263 HB3 TYR 32 HB3 TYR 32 91.836 -7.737 13.062 264 HD1 TYR 32 HD1 TYR 32 91.664 -9.497 10.765 265 HD2 TYR 32 HD2 TYR 32 88.486 -8.019 13.254 266 HE1 TYR 32 HE1 TYR 32 90.286 -11.469 10.180 267 HE2 TYR 32 HE2 TYR 32 87.113 -9.997 12.666 268 HH TYR 32 HH TYR 32 87.704 -11.981 10.108 269 H GLY 33 H GLY 33 89.273 -7.507 10.996 270 HA2 GLY 33 HA3 GLY 33 87.574 -7.009 9.429 271 HA3 GLY 33 HA2 GLY 33 86.709 -6.252 10.788 272 H ASP 34 H ASP 34 89.764 -4.852 10.433 273 HA ASP 34 HA ASP 34 88.879 -2.864 8.383 274 HB2 ASP 34 HB2 ASP 34 87.888 -1.846 10.313 275 HB3 ASP 34 HB3 ASP 34 89.304 -2.217 11.325 276 H PHE 35 H PHE 35 90.647 -1.620 7.563 277 HA PHE 35 HA PHE 35 93.343 -2.199 8.739 278 HB2 PHE 35 HB2 PHE 35 93.111 -2.526 5.770 279 HB3 PHE 35 HB3 PHE 35 94.190 -3.344 6.925 280 HD1 PHE 35 HD1 PHE 35 90.542 -3.070 6.045 281 HD2 PHE 35 HD2 PHE 35 93.713 -5.543 7.555 282 HE1 PHE 35 HE1 PHE 35 88.996 -5.007 6.121 283 HE2 PHE 35 HE2 PHE 35 92.165 -7.478 7.635 284 HZ PHE 35 HZ PHE 35 89.807 -7.211 6.915 285 H PHE 36 H PHE 36 95.029 -0.784 7.775 286 HA PHE 36 HA PHE 36 93.825 1.869 7.091 287 HB2 PHE 36 HB3 PHE 36 96.532 0.884 8.000 288 HB3 PHE 36 HB2 PHE 36 96.410 2.460 7.181 289 HD1 PHE 36 HD1 PHE 36 94.174 0.648 9.608 290 HD2 PHE 36 HD2 PHE 36 96.473 4.174 8.757 291 HE1 PHE 36 HE1 PHE 36 93.368 1.681 11.715 292 HE2 PHE 36 HE2 PHE 36 95.669 5.207 10.863 293 HZ PHE 36 HZ PHE 36 94.116 3.962 12.342 294 H THR 37 H THR 37 93.778 2.646 5.037 295 HA THR 37 HA THR 37 94.837 0.963 2.859 296 HB THR 37 HB THR 37 94.028 2.978 1.453 297 HG1 THR 37 HG1 THR 37 93.076 3.710 4.045 298 HG21 THR 37 HG21 THR 37 92.707 0.890 1.885 299 HG22 THR 37 HG22 THR 37 92.037 1.652 3.348 300 HG23 THR 37 HG23 THR 37 91.679 2.336 1.744 301 H GLY 38 H GLY 38 95.837 3.892 4.569 302 HA2 GLY 38 HA2 GLY 38 97.902 4.560 2.567 303 HA3 GLY 38 HA3 GLY 38 97.718 5.300 4.175 304 H ASP 39 H ASP 39 97.620 2.344 5.208 305 HA ASP 39 HA ASP 39 100.620 2.135 5.413 306 HB2 ASP 39 HB2 ASP 39 98.574 0.599 7.053 307 HB3 ASP 39 HB3 ASP 39 100.275 0.942 7.448 308 H ALA 40 H ALA 40 100.549 -0.650 6.253 309 HA ALA 40 HA ALA 40 99.561 -2.020 3.758 310 HB1 ALA 40 HB1 ALA 40 101.723 -3.217 3.551 311 HB2 ALA 40 HB2 ALA 40 101.946 -1.459 3.387 312 HB3 ALA 40 HB3 ALA 40 102.375 -2.273 4.911 313 H TYR 41 H TYR 41 98.905 -4.151 4.107 314 HA TYR 41 HA TYR 41 99.118 -5.086 6.983 315 HB2 TYR 41 HB2 TYR 41 96.840 -4.883 5.093 316 HB3 TYR 41 HB3 TYR 41 96.966 -6.457 5.913 317 HD1 TYR 41 HD1 TYR 41 97.050 -2.766 6.600 318 HD2 TYR 41 HD2 TYR 41 96.177 -6.692 8.106 319 HE1 TYR 41 HE1 TYR 41 96.109 -1.764 8.664 320 HE2 TYR 41 HE2 TYR 41 95.236 -5.691 10.172 321 HH TYR 41 HH TYR 41 95.694 -3.246 11.429 322 H VAL 42 H VAL 42 100.342 -6.883 7.198 323 HA VAL 42 HA VAL 42 100.661 -8.649 4.763 324 HB VAL 42 HB VAL 42 102.427 -8.849 7.200 325 HG11 VAL 42 HG11 VAL 42 102.659 -10.441 5.313 326 HG12 VAL 42 HG12 VAL 42 102.893 -9.078 4.193 327 HG13 VAL 42 HG13 VAL 42 104.101 -9.407 5.458 328 HG21 VAL 42 HG21 VAL 42 103.902 -7.101 5.950 329 HG22 VAL 42 HG22 VAL 42 102.389 -6.614 5.149 330 HG23 VAL 42 HG23 VAL 42 102.536 -6.498 6.919 331 H ILE 43 H ILE 43 100.008 -10.790 4.898 332 HA ILE 43 HA ILE 43 99.142 -11.735 7.639 333 HB ILE 43 HB ILE 43 97.591 -12.771 5.326 334 HG12 ILE 43 HG13 ILE 43 97.280 -9.887 6.266 335 HG13 ILE 43 HG12 ILE 43 97.913 -10.387 4.680 336 HG21 ILE 43 HG21 ILE 43 95.721 -12.324 6.942 337 HG22 ILE 43 HG22 ILE 43 97.010 -13.337 7.637 338 HG23 ILE 43 HG23 ILE 43 96.906 -11.612 8.064 339 HD11 ILE 43 HD11 ILE 43 95.690 -10.094 4.107 340 HD12 ILE 43 HD12 ILE 43 95.107 -10.488 5.742 341 HD13 ILE 43 HD13 ILE 43 95.620 -11.790 4.642 342 H LEU 44 H LEU 44 99.522 -13.866 8.093 343 HA LEU 44 HA LEU 44 101.045 -15.426 5.984 344 HB2 LEU 44 HB2 LEU 44 101.447 -14.980 8.914 345 HB3 LEU 44 HB3 LEU 44 101.690 -16.649 8.350 346 HG LEU 44 HG LEU 44 103.748 -15.085 8.343 347 HD11 LEU 44 HD11 LEU 44 104.259 -15.891 5.848 348 HD12 LEU 44 HD12 LEU 44 104.135 -17.055 7.188 349 HD13 LEU 44 HD13 LEU 44 102.755 -16.811 6.092 350 HD21 LEU 44 HD21 LEU 44 103.948 -13.423 6.700 351 HD22 LEU 44 HD22 LEU 44 102.253 -13.239 7.212 352 HD23 LEU 44 HD23 LEU 44 102.639 -14.107 5.707 353 H LYS 45 H LYS 45 99.819 -17.124 5.215 354 HA LYS 45 HA LYS 45 97.755 -18.240 7.131 355 HB2 LYS 45 HB2 LYS 45 97.176 -17.055 4.786 356 HB3 LYS 45 HB3 LYS 45 97.505 -18.695 4.179 357 HG2 LYS 45 HG2 LYS 45 95.934 -19.545 6.018 358 HG3 LYS 45 HG3 LYS 45 95.457 -17.848 6.266 359 HD2 LYS 45 HD3 LYS 45 95.198 -19.477 3.701 360 HD3 LYS 45 HD2 LYS 45 93.875 -18.862 4.722 361 HE2 LYS 45 HE3 LYS 45 94.868 -16.513 4.281 362 HE3 LYS 45 HE2 LYS 45 95.803 -17.289 2.980 363 HZ1 LYS 45 HZ1 LYS 45 93.001 -16.693 3.104 364 HZ2 LYS 45 HZ2 LYS 45 93.975 -16.908 1.791 365 HZ3 LYS 45 HZ3 LYS 45 93.329 -18.216 2.561 366 H THR 46 H THR 46 99.023 -19.885 8.021 367 HA THR 46 HA THR 46 100.469 -21.778 6.262 368 HB THR 46 HB THR 46 99.932 -22.808 8.927 369 HG1 THR 46 HG1 THR 46 99.727 -20.876 9.829 370 HG21 THR 46 HG21 THR 46 101.903 -23.436 7.675 371 HG22 THR 46 HG22 THR 46 102.389 -21.734 7.483 372 HG23 THR 46 HG23 THR 46 102.449 -22.501 9.088 373 H VAL 47 H VAL 47 99.149 -22.986 4.958 374 HA VAL 47 HA VAL 47 96.607 -24.075 6.122 375 HB VAL 47 HB VAL 47 97.350 -24.758 3.332 376 HG11 VAL 47 HG11 VAL 47 95.115 -25.186 4.318 377 HG12 VAL 47 HG12 VAL 47 94.920 -23.443 4.625 378 HG13 VAL 47 HG13 VAL 47 95.009 -24.048 2.953 379 HG21 VAL 47 HG21 VAL 47 96.716 -22.396 2.584 380 HG22 VAL 47 HG22 VAL 47 98.332 -22.563 3.310 381 HG23 VAL 47 HG23 VAL 47 96.993 -21.883 4.266 382 H GLN 48 H GLN 48 96.107 -26.387 5.613 383 HA GLN 48 HA GLN 48 98.612 -28.042 5.965 384 HB2 GLN 48 HB3 GLN 48 96.910 -28.099 7.818 385 HB3 GLN 48 HB2 GLN 48 95.726 -28.750 6.659 386 HG2 GLN 48 HG2 GLN 48 96.948 -30.766 6.369 387 HG3 GLN 48 HG3 GLN 48 98.427 -30.071 7.074 388 HE21 GLN 48 HE21 GLN 48 98.801 -30.687 9.204 389 HE22 GLN 48 HE22 GLN 48 97.555 -31.165 10.335 390 H LEU 49 H LEU 49 99.194 -28.716 3.928 391 HA LEU 49 HA LEU 49 97.569 -29.068 1.666 392 HB2 LEU 49 HB2 LEU 49 99.845 -30.915 2.517 393 HB3 LEU 49 HB3 LEU 49 99.242 -30.681 0.859 394 HG LEU 49 HG LEU 49 100.443 -28.496 2.618 395 HD11 LEU 49 HD11 LEU 49 102.351 -28.617 1.038 396 HD12 LEU 49 HD12 LEU 49 101.568 -29.977 0.198 397 HD13 LEU 49 HD13 LEU 49 102.119 -30.168 1.880 398 HD21 LEU 49 HD21 LEU 49 98.747 -27.684 0.999 399 HD22 LEU 49 HD22 LEU 49 99.600 -28.527 -0.316 400 HD23 LEU 49 HD23 LEU 49 100.382 -27.167 0.524 401 H ARG 50 H ARG 50 98.726 -32.100 3.096 402 HA ARG 50 HA ARG 50 95.867 -32.983 3.425 403 HB2 ARG 50 HB3 ARG 50 97.901 -34.759 2.041 404 HB3 ARG 50 HB2 ARG 50 96.127 -34.902 2.062 405 HG2 ARG 50 HG2 ARG 50 96.010 -32.719 0.792 406 HG3 ARG 50 HG3 ARG 50 97.783 -32.771 0.644 407 HD2 ARG 50 HD3 ARG 50 96.097 -35.140 -0.208 408 HD3 ARG 50 HD2 ARG 50 96.333 -33.757 -1.303 409 HE ARG 50 HE ARG 50 98.669 -34.327 -1.496 410 HH11 ARG 50 HH11 ARG 50 100.284 -35.894 -1.299 411 HH12 ARG 50 HH12 ARG 50 100.063 -37.249 -0.215 412 HH21 ARG 50 HH21 ARG 50 96.902 -36.228 0.830 413 HH22 ARG 50 HH22 ARG 50 98.157 -37.437 0.984 414 H ASN 51 H ASN 51 99.187 -34.366 3.546 415 HA ASN 51 HA ASN 51 98.864 -34.789 6.477 416 HB2 ASN 51 HB2 ASN 51 99.070 -37.173 6.425 417 HB3 ASN 51 HB3 ASN 51 97.800 -36.783 5.241 418 HD21 ASN 51 HD21 ASN 51 99.347 -39.222 5.096 419 HD22 ASN 51 HD22 ASN 51 100.331 -39.136 3.651 420 H GLY 52 H GLY 52 100.634 -33.146 4.955 421 HA2 GLY 52 HA2 GLY 52 103.228 -34.522 5.650 422 HA3 GLY 52 HA3 GLY 52 103.057 -33.709 4.076 423 H ASN 53 H ASN 53 103.309 -31.493 3.975 424 HA ASN 53 HA ASN 53 103.942 -30.154 6.610 425 HB2 ASN 53 HB2 ASN 53 104.774 -29.503 3.750 426 HB3 ASN 53 HB3 ASN 53 105.151 -28.481 5.157 427 HD21 ASN 53 HD21 ASN 53 105.823 -31.621 3.594 428 HD22 ASN 53 HD22 ASN 53 107.216 -32.000 4.582 429 H LEU 54 H LEU 54 103.767 -27.492 5.680 430 HA LEU 54 HA LEU 54 100.850 -27.264 4.917 431 HB2 LEU 54 HB3 LEU 54 101.122 -25.119 6.547 432 HB3 LEU 54 HB2 LEU 54 100.586 -26.709 7.140 433 HG LEU 54 HG LEU 54 102.965 -27.272 7.681 434 HD11 LEU 54 HD11 LEU 54 104.490 -25.144 7.782 435 HD12 LEU 54 HD12 LEU 54 104.270 -25.958 6.215 436 HD13 LEU 54 HD13 LEU 54 103.360 -24.474 6.583 437 HD21 LEU 54 HD21 LEU 54 102.270 -26.524 9.707 438 HD22 LEU 54 HD22 LEU 54 103.011 -24.958 9.299 439 HD23 LEU 54 HD23 LEU 54 101.287 -25.243 8.960 440 H GLN 55 H GLN 55 100.581 -24.560 4.692 441 HA GLN 55 HA GLN 55 102.949 -23.643 3.069 442 HB2 GLN 55 HB2 GLN 55 100.985 -24.794 1.714 443 HB3 GLN 55 HB3 GLN 55 100.170 -23.233 1.970 444 HG2 GLN 55 HG2 GLN 55 101.342 -23.004 -0.102 445 HG3 GLN 55 HG3 GLN 55 102.332 -22.138 1.097 446 HE21 GLN 55 HE21 GLN 55 104.434 -22.964 1.587 447 HE22 GLN 55 HE22 GLN 55 105.108 -24.359 0.774 448 H TYR 56 H TYR 56 103.508 -21.713 3.911 449 HA TYR 56 HA TYR 56 101.500 -20.051 5.347 450 HB2 TYR 56 HB2 TYR 56 104.449 -20.174 5.034 451 HB3 TYR 56 HB3 TYR 56 103.804 -18.518 5.088 452 HD1 TYR 56 HD1 TYR 56 105.184 -20.922 7.094 453 HD2 TYR 56 HD2 TYR 56 101.684 -18.437 6.927 454 HE1 TYR 56 HE1 TYR 56 104.942 -21.100 9.553 455 HE2 TYR 56 HE2 TYR 56 101.439 -18.621 9.389 456 HH TYR 56 HH TYR 56 103.909 -20.040 11.403 457 H ASP 57 H ASP 57 100.173 -18.706 4.181 458 HA ASP 57 HA ASP 57 101.043 -17.885 1.443 459 HB2 ASP 57 HB3 ASP 57 98.479 -17.150 2.909 460 HB3 ASP 57 HB2 ASP 57 98.785 -17.081 1.157 461 H LEU 58 H LEU 58 101.941 -15.938 0.999 462 HA LEU 58 HA LEU 58 102.052 -13.934 3.249 463 HB2 LEU 58 HB3 LEU 58 103.681 -14.401 0.730 464 HB3 LEU 58 HB2 LEU 58 103.757 -12.850 1.597 465 HG LEU 58 HG LEU 58 105.492 -14.705 2.206 466 HD11 LEU 58 HD11 LEU 58 104.759 -14.109 4.807 467 HD12 LEU 58 HD12 LEU 58 105.713 -13.047 3.744 468 HD13 LEU 58 HD13 LEU 58 103.953 -12.819 3.883 469 HD21 LEU 58 HD21 LEU 58 104.736 -16.315 3.891 470 HD22 LEU 58 HD22 LEU 58 103.777 -16.520 2.406 471 HD23 LEU 58 HD23 LEU 58 103.080 -15.668 3.805 472 H HIS 59 H HIS 59 100.195 -12.693 3.125 473 HA HIS 59 HA HIS 59 99.507 -11.599 0.387 474 HB2 HIS 59 HB3 HIS 59 97.812 -11.993 2.890 475 HB3 HIS 59 HB2 HIS 59 97.256 -11.117 1.445 476 HD2 HIS 59 HD2 HIS 59 98.952 -14.734 1.837 477 HE1 HIS 59 HE1 HIS 59 95.644 -14.990 -0.776 478 H TYR 60 H TYR 60 100.484 -9.622 0.189 479 HA TYR 60 HA TYR 60 100.308 -7.793 2.590 480 HB2 TYR 60 HB2 TYR 60 102.013 -6.415 1.175 481 HB3 TYR 60 HB3 TYR 60 102.590 -7.882 1.998 482 HD1 TYR 60 HD1 TYR 60 102.389 -10.112 0.584 483 HD2 TYR 60 HD2 TYR 60 102.443 -6.158 -1.095 484 HE1 TYR 60 HE1 TYR 60 103.137 -11.044 -1.589 485 HE2 TYR 60 HE2 TYR 60 103.180 -7.092 -3.271 486 HH TYR 60 HH TYR 60 104.523 -9.981 -3.688 487 H TRP 61 H TRP 61 98.562 -6.495 2.447 488 HA TRP 61 HA TRP 61 97.641 -5.716 -0.318 489 HB2 TRP 61 HB3 TRP 61 95.899 -6.808 0.937 490 HB3 TRP 61 HB2 TRP 61 96.223 -5.809 2.373 491 HD1 TRP 61 HD1 TRP 61 95.979 -4.461 -1.225 492 HE1 TRP 61 HE1 TRP 61 94.028 -2.784 -1.372 493 HE3 TRP 61 HE3 TRP 61 94.041 -5.054 3.461 494 HZ2 TRP 61 HZ2 TRP 61 91.907 -1.836 0.334 495 HZ3 TRP 61 HZ3 TRP 61 92.058 -3.752 4.175 496 HH2 TRP 61 HH2 TRP 61 90.991 -2.142 2.620 497 H LEU 62 H LEU 62 97.517 -3.618 -0.924 498 HA LEU 62 HA LEU 62 98.221 -1.535 1.150 499 HB2 LEU 62 HB2 LEU 62 99.082 -0.694 -1.466 500 HB3 LEU 62 HB3 LEU 62 100.080 -0.993 -0.023 501 HG LEU 62 HG LEU 62 99.130 -3.191 -1.913 502 HD11 LEU 62 HD11 LEU 62 101.450 -3.171 -2.794 503 HD12 LEU 62 HD12 LEU 62 100.637 -1.615 -3.090 504 HD13 LEU 62 HD13 LEU 62 101.824 -1.762 -1.772 505 HD21 LEU 62 HD21 LEU 62 101.552 -3.743 -0.431 506 HD22 LEU 62 HD22 LEU 62 100.293 -3.198 0.703 507 HD23 LEU 62 HD23 LEU 62 99.990 -4.592 -0.360 508 H GLY 63 H GLY 63 96.487 -0.193 1.341 509 HA2 GLY 63 HA3 GLY 63 94.271 -0.209 -0.508 510 HA3 GLY 63 HA2 GLY 63 94.562 1.036 0.729 511 H ASN 64 H ASN 64 97.020 0.370 -1.664 512 HA ASN 64 HA ASN 64 97.901 1.756 -3.356 513 HB2 ASN 64 HB2 ASN 64 95.712 1.128 -4.414 514 HB3 ASN 64 HB3 ASN 64 94.989 2.592 -3.706 515 HD21 ASN 64 HD21 ASN 64 97.948 1.699 -5.632 516 HD22 ASN 64 HD22 ASN 64 97.851 3.099 -6.676 517 H GLU 65 H GLU 65 96.646 2.952 -0.545 518 HA GLU 65 HA GLU 65 97.126 5.826 -1.338 519 HB2 GLU 65 HB2 GLU 65 95.818 4.524 1.085 520 HB3 GLU 65 HB3 GLU 65 96.207 6.260 1.015 521 HG2 GLU 65 HG2 GLU 65 94.871 6.386 -1.135 522 HG3 GLU 65 HG3 GLU 65 94.359 4.706 -0.847 523 H CYS 66 H CYS 66 98.861 3.231 -0.332 524 HA CYS 66 HA CYS 66 100.463 4.726 1.720 525 HB2 CYS 66 HB2 CYS 66 99.825 2.293 2.039 526 HB3 CYS 66 HB3 CYS 66 100.864 1.898 0.650 527 HG CYS 66 HG CYS 66 102.494 1.351 2.848 528 H SER 67 H SER 67 102.646 5.278 1.386 529 HA SER 67 HA SER 67 103.373 5.634 -1.474 530 HB2 SER 67 HB2 SER 67 105.255 6.933 -0.602 531 HB3 SER 67 HB3 SER 67 103.770 7.413 0.254 532 HG SER 67 HG SER 67 105.538 7.011 1.699 533 H GLN 68 H GLN 68 105.011 4.553 -2.554 534 HA GLN 68 HA GLN 68 105.670 1.903 -1.941 535 HB2 GLN 68 HB2 GLN 68 107.719 2.232 -3.348 536 HB3 GLN 68 HB3 GLN 68 106.259 2.932 -4.086 537 HG2 GLN 68 HG2 GLN 68 106.955 5.137 -2.907 538 HG3 GLN 68 HG3 GLN 68 108.541 4.361 -2.680 539 HE21 GLN 68 HE21 GLN 68 107.292 6.602 -4.609 540 HE22 GLN 68 HE22 GLN 68 107.989 6.159 -6.151 541 H ASP 69 H ASP 69 106.942 4.814 -0.471 542 HA ASP 69 HA ASP 69 109.394 3.792 0.604 543 HB2 ASP 69 HB2 ASP 69 107.394 5.759 1.805 544 HB3 ASP 69 HB3 ASP 69 109.042 5.495 2.421 545 H GLU 70 H GLU 70 106.176 3.950 2.228 546 HA GLU 70 HA GLU 70 107.144 1.950 4.220 547 HB2 GLU 70 HB3 GLU 70 104.300 2.974 3.999 548 HB3 GLU 70 HB2 GLU 70 105.191 2.453 5.449 549 HG2 GLU 70 HG2 GLU 70 106.733 4.429 5.120 550 HG3 GLU 70 HG3 GLU 70 105.662 4.981 3.809 551 H SER 71 H SER 71 104.804 2.222 1.553 552 HA SER 71 HA SER 71 103.628 -0.395 1.875 553 HB2 SER 71 HB3 SER 71 103.090 1.706 0.277 554 HB3 SER 71 HB2 SER 71 104.033 0.731 -0.877 555 HG SER 71 HG SER 71 101.775 0.201 -0.900 556 H GLY 72 H GLY 72 106.137 0.681 -0.483 557 HA2 GLY 72 HA2 GLY 72 106.827 -1.896 -1.447 558 HA3 GLY 72 HA3 GLY 72 107.972 -0.536 -1.350 559 H ALA 73 H ALA 73 107.967 -0.202 1.491 560 HA ALA 73 HA ALA 73 109.997 -2.038 2.273 561 HB1 ALA 73 HB1 ALA 73 109.524 -1.311 4.595 562 HB2 ALA 73 HB2 ALA 73 107.977 -0.610 4.062 563 HB3 ALA 73 HB3 ALA 73 109.514 0.076 3.479 564 H ALA 74 H ALA 74 106.491 -2.122 3.131 565 HA ALA 74 HA ALA 74 106.560 -4.585 4.560 566 HB1 ALA 74 HB1 ALA 74 104.171 -4.821 3.939 567 HB2 ALA 74 HB2 ALA 74 104.545 -3.144 4.403 568 HB3 ALA 74 HB3 ALA 74 104.374 -3.575 2.684 569 H ALA 75 H ALA 75 106.138 -4.009 1.049 570 HA ALA 75 HA ALA 75 105.947 -6.819 0.359 571 HB1 ALA 75 HB1 ALA 75 106.495 -6.058 -1.937 572 HB2 ALA 75 HB2 ALA 75 106.984 -4.472 -1.294 573 HB3 ALA 75 HB3 ALA 75 105.285 -4.991 -1.184 574 H ILE 76 H ILE 76 108.616 -4.732 1.204 575 HA ILE 76 HA ILE 76 110.657 -6.509 -0.000 576 HB ILE 76 HB ILE 76 110.822 -4.174 1.952 577 HG12 ILE 76 HG13 ILE 76 110.183 -4.005 -0.631 578 HG13 ILE 76 HG12 ILE 76 111.315 -2.847 0.104 579 HG21 ILE 76 HG21 ILE 76 112.744 -5.473 2.443 580 HG22 ILE 76 HG22 ILE 76 112.943 -5.980 0.749 581 HG23 ILE 76 HG23 ILE 76 113.317 -4.307 1.227 582 HD11 ILE 76 HD11 ILE 76 112.016 -3.972 -2.133 583 HD12 ILE 76 HD12 ILE 76 112.300 -5.428 -1.148 584 HD13 ILE 76 HD13 ILE 76 113.210 -3.935 -0.813 585 H PHE 77 H PHE 77 109.697 -5.637 3.367 586 HA PHE 77 HA PHE 77 111.347 -7.729 4.541 587 HB2 PHE 77 HB3 PHE 77 109.095 -5.957 5.484 588 HB3 PHE 77 HB2 PHE 77 109.559 -7.356 6.483 589 HD1 PHE 77 HD1 PHE 77 111.480 -7.270 7.848 590 HD2 PHE 77 HD2 PHE 77 110.948 -4.334 4.760 591 HE1 PHE 77 HE1 PHE 77 113.435 -6.009 8.712 592 HE2 PHE 77 HE2 PHE 77 112.900 -3.070 5.625 593 HZ PHE 77 HZ PHE 77 114.144 -3.908 7.599 594 H THR 78 H THR 78 108.069 -7.608 3.234 595 HA THR 78 HA THR 78 107.260 -10.180 4.384 596 HB THR 78 HB THR 78 106.185 -8.746 1.914 597 HG1 THR 78 HG1 THR 78 105.068 -7.531 3.281 598 HG21 THR 78 HG21 THR 78 105.415 -11.046 2.021 599 HG22 THR 78 HG22 THR 78 105.065 -10.898 3.760 600 HG23 THR 78 HG23 THR 78 104.085 -10.001 2.576 601 H VAL 79 H VAL 79 108.633 -9.138 1.233 602 HA VAL 79 HA VAL 79 108.530 -11.866 0.145 603 HB VAL 79 HB VAL 79 109.992 -9.330 -0.685 604 HG11 VAL 79 HG11 VAL 79 111.347 -11.307 -1.325 605 HG12 VAL 79 HG12 VAL 79 109.913 -12.044 -2.080 606 HG13 VAL 79 HG13 VAL 79 110.606 -10.550 -2.755 607 HG21 VAL 79 HG21 VAL 79 107.532 -9.395 -1.005 608 HG22 VAL 79 HG22 VAL 79 108.382 -9.435 -2.569 609 HG23 VAL 79 HG23 VAL 79 107.689 -10.929 -1.894 610 H GLN 80 H GLN 80 111.247 -9.774 1.263 611 HA GLN 80 HA GLN 80 113.227 -11.860 1.088 612 HB2 GLN 80 HB2 GLN 80 113.136 -9.475 2.987 613 HB3 GLN 80 HB3 GLN 80 114.582 -10.426 2.567 614 HG2 GLN 80 HG2 GLN 80 114.167 -9.818 0.138 615 HG3 GLN 80 HG3 GLN 80 112.893 -8.709 0.697 616 HE21 GLN 80 HE21 GLN 80 116.275 -8.998 0.096 617 HE22 GLN 80 HE22 GLN 80 116.772 -7.529 0.905 618 H LEU 81 H LEU 81 111.603 -10.586 4.065 619 HA LEU 81 HA LEU 81 112.612 -12.608 5.801 620 HB2 LEU 81 HB2 LEU 81 111.139 -10.506 6.326 621 HB3 LEU 81 HB3 LEU 81 109.765 -11.602 6.054 622 HG LEU 81 HG LEU 81 110.399 -11.517 8.455 623 HD11 LEU 81 HD11 LEU 81 109.999 -13.752 8.754 624 HD12 LEU 81 HD12 LEU 81 111.353 -14.238 7.707 625 HD13 LEU 81 HD13 LEU 81 109.804 -13.742 6.984 626 HD21 LEU 81 HD21 LEU 81 112.539 -11.942 9.250 627 HD22 LEU 81 HD22 LEU 81 112.964 -12.974 7.863 628 HD23 LEU 81 HD23 LEU 81 112.943 -11.203 7.682 629 H ASP 82 H ASP 82 109.684 -12.648 3.717 630 HA ASP 82 HA ASP 82 108.596 -15.119 4.542 631 HB2 ASP 82 HB2 ASP 82 107.420 -13.935 2.845 632 HB3 ASP 82 HB3 ASP 82 108.849 -13.866 1.787 633 H ASP 83 H ASP 83 111.234 -14.593 2.138 634 HA ASP 83 HA ASP 83 111.699 -17.398 1.677 635 HB2 ASP 83 HB2 ASP 83 113.518 -14.963 1.566 636 HB3 ASP 83 HB3 ASP 83 114.105 -16.597 1.173 637 H TYR 84 H TYR 84 112.748 -15.158 4.203 638 HA TYR 84 HA TYR 84 114.531 -17.103 5.495 639 HB2 TYR 84 HB2 TYR 84 114.882 -14.724 5.882 640 HB3 TYR 84 HB3 TYR 84 113.215 -14.532 6.475 641 HD1 TYR 84 HD1 TYR 84 116.616 -15.339 7.355 642 HD2 TYR 84 HD2 TYR 84 112.527 -15.861 8.568 643 HE1 TYR 84 HE1 TYR 84 117.368 -15.911 9.647 644 HE2 TYR 84 HE2 TYR 84 113.280 -16.436 10.859 645 HH TYR 84 HH TYR 84 115.495 -17.414 11.899 646 H LEU 85 H LEU 85 111.116 -16.453 5.425 647 HA LEU 85 HA LEU 85 110.584 -17.826 7.994 648 HB2 LEU 85 HB3 LEU 85 109.197 -15.960 6.655 649 HB3 LEU 85 HB2 LEU 85 108.443 -17.401 5.930 650 HG LEU 85 HG LEU 85 108.266 -18.230 8.426 651 HD11 LEU 85 HD11 LEU 85 109.639 -16.392 9.368 652 HD12 LEU 85 HD12 LEU 85 108.464 -15.202 8.757 653 HD13 LEU 85 HD13 LEU 85 107.986 -16.356 10.026 654 HD21 LEU 85 HD21 LEU 85 106.063 -17.106 8.617 655 HD22 LEU 85 HD22 LEU 85 106.348 -17.678 6.955 656 HD23 LEU 85 HD23 LEU 85 106.543 -15.953 7.349 657 H ASN 86 H ASN 86 109.846 -18.554 4.527 658 HA ASN 86 HA ASN 86 109.836 -21.465 5.369 659 HB2 ASN 86 HB3 ASN 86 108.215 -20.342 3.061 660 HB3 ASN 86 HB2 ASN 86 108.016 -21.899 3.903 661 HD21 ASN 86 HD21 ASN 86 107.980 -21.254 6.574 662 HD22 ASN 86 HD22 ASN 86 106.693 -20.121 6.921 663 H GLY 87 H GLY 87 110.446 -19.177 2.681 664 HA2 GLY 87 HA3 GLY 87 112.451 -19.375 1.294 665 HA3 GLY 87 HA2 GLY 87 112.564 -21.096 1.737 666 H ARG 88 H ARG 88 109.422 -20.997 1.254 667 HA ARG 88 HA ARG 88 109.364 -20.763 -1.706 668 HB2 ARG 88 HB3 ARG 88 108.991 -23.051 -2.211 669 HB3 ARG 88 HB2 ARG 88 110.357 -23.077 -1.070 670 HG2 ARG 88 HG2 ARG 88 108.547 -23.324 0.780 671 HG3 ARG 88 HG3 ARG 88 107.442 -23.747 -0.550 672 HD2 ARG 88 HD2 ARG 88 110.129 -25.120 -0.166 673 HD3 ARG 88 HD3 ARG 88 108.638 -25.710 0.606 674 HE ARG 88 HE ARG 88 108.379 -25.284 -2.311 675 HH11 ARG 88 HH11 ARG 88 108.048 -27.183 -3.497 676 HH12 ARG 88 HH12 ARG 88 108.336 -28.739 -2.753 677 HH21 ARG 88 HH21 ARG 88 109.292 -27.385 0.310 678 HH22 ARG 88 HH22 ARG 88 109.037 -28.853 -0.606 679 H ALA 89 H ALA 89 107.958 -19.888 0.929 680 HA ALA 89 HA ALA 89 105.314 -21.010 0.976 681 HB1 ALA 89 HB1 ALA 89 106.688 -18.686 2.072 682 HB2 ALA 89 HB2 ALA 89 105.276 -19.560 2.713 683 HB3 ALA 89 HB3 ALA 89 105.050 -18.244 1.536 684 H VAL 90 H VAL 90 103.423 -19.137 0.461 685 HA VAL 90 HA VAL 90 103.629 -18.882 -2.529 686 HB VAL 90 HB VAL 90 101.213 -18.503 -0.704 687 HG11 VAL 90 HG11 VAL 90 101.052 -17.387 -2.915 688 HG12 VAL 90 HG12 VAL 90 99.949 -18.780 -2.820 689 HG13 VAL 90 HG13 VAL 90 101.480 -18.917 -3.718 690 HG21 VAL 90 HG21 VAL 90 102.117 -20.809 -0.577 691 HG22 VAL 90 HG22 VAL 90 102.102 -20.913 -2.353 692 HG23 VAL 90 HG23 VAL 90 100.571 -20.777 -1.457 693 H GLN 91 H GLN 91 103.182 -16.863 -3.575 694 HA GLN 91 HA GLN 91 103.577 -14.499 -1.727 695 HB2 GLN 91 HB2 GLN 91 104.159 -14.657 -4.714 696 HB3 GLN 91 HB3 GLN 91 104.644 -13.369 -3.585 697 HG2 GLN 91 HG2 GLN 91 105.944 -15.129 -2.291 698 HG3 GLN 91 HG3 GLN 91 105.610 -16.258 -3.626 699 HE21 GLN 91 HE21 GLN 91 105.726 -13.852 -5.578 700 HE22 GLN 91 HE22 GLN 91 107.442 -13.576 -5.779 701 H HIS 92 H HIS 92 101.647 -13.532 -1.356 702 HA HIS 92 HA HIS 92 99.726 -13.313 -3.684 703 HB2 HIS 92 HB3 HIS 92 99.380 -13.520 -0.695 704 HB3 HIS 92 HB2 HIS 92 98.161 -12.630 -1.639 705 HD2 HIS 92 HD2 HIS 92 99.747 -16.298 -1.708 706 HE1 HIS 92 HE1 HIS 92 95.861 -16.423 -3.358 707 H ARG 93 H ARG 93 99.666 -11.329 -4.612 708 HA ARG 93 HA ARG 93 100.493 -8.982 -2.888 709 HB2 ARG 93 HB2 ARG 93 101.508 -7.997 -4.757 710 HB3 ARG 93 HB3 ARG 93 101.854 -9.722 -5.021 711 HG2 ARG 93 HG2 ARG 93 99.693 -9.801 -6.403 712 HG3 ARG 93 HG3 ARG 93 99.697 -8.022 -6.332 713 HD2 ARG 93 HD3 ARG 93 102.220 -8.327 -7.128 714 HD3 ARG 93 HD2 ARG 93 101.609 -9.889 -7.725 715 HE ARG 93 HE ARG 93 99.717 -8.150 -8.718 716 HH11 ARG 93 HH11 ARG 93 99.945 -6.991 -10.645 717 HH12 ARG 93 HH12 ARG 93 101.541 -6.597 -11.244 718 HH21 ARG 93 HH21 ARG 93 103.197 -8.144 -8.599 719 HH22 ARG 93 HH22 ARG 93 103.374 -7.247 -10.091 720 H GLU 94 H GLU 94 98.932 -7.512 -2.467 721 HA GLU 94 HA GLU 94 96.622 -7.354 -4.417 722 HB2 GLU 94 HB2 GLU 94 96.153 -6.704 -1.529 723 HB3 GLU 94 HB3 GLU 94 95.060 -7.449 -2.720 724 HG2 GLU 94 HG2 GLU 94 95.583 -9.239 -1.266 725 HG3 GLU 94 HG3 GLU 94 96.703 -9.476 -2.628 726 H VAL 95 H VAL 95 96.542 -5.362 -5.315 727 HA VAL 95 HA VAL 95 97.742 -3.075 -3.730 728 HB VAL 95 HB VAL 95 97.287 -3.121 -6.733 729 HG11 VAL 95 HG11 VAL 95 97.728 -0.938 -5.642 730 HG12 VAL 95 HG12 VAL 95 99.206 -1.604 -4.907 731 HG13 VAL 95 HG13 VAL 95 99.093 -1.424 -6.675 732 HG21 VAL 95 HG21 VAL 95 99.876 -3.639 -6.668 733 HG22 VAL 95 HG22 VAL 95 98.710 -4.977 -6.530 734 HG23 VAL 95 HG23 VAL 95 99.504 -4.334 -5.072 735 H GLN 96 H GLN 96 95.022 -3.976 -3.327 736 HA GLN 96 HA GLN 96 92.853 -3.038 -3.226 737 HB2 GLN 96 HB3 GLN 96 94.449 -1.020 -2.599 738 HB3 GLN 96 HB2 GLN 96 93.963 -0.401 -4.195 739 HG2 GLN 96 HG2 GLN 96 91.525 -0.988 -3.367 740 HG3 GLN 96 HG3 GLN 96 92.264 -0.921 -1.749 741 HE21 GLN 96 HE21 GLN 96 91.621 1.094 -0.926 742 HE22 GLN 96 HE22 GLN 96 91.845 2.609 -1.773 743 H GLY 97 H GLY 97 91.271 -3.381 -4.701 744 HA2 GLY 97 HA2 GLY 97 90.137 -2.614 -6.779 745 HA3 GLY 97 HA3 GLY 97 91.741 -2.343 -7.503 746 H PHE 98 H PHE 98 92.933 -4.815 -6.559 747 HA PHE 98 HA PHE 98 91.244 -6.851 -8.023 748 HB2 PHE 98 HB3 PHE 98 93.248 -5.755 -9.343 749 HB3 PHE 98 HB2 PHE 98 94.253 -6.808 -8.318 750 HD1 PHE 98 HD1 PHE 98 94.642 -9.003 -9.015 751 HD2 PHE 98 HD2 PHE 98 91.157 -6.942 -10.453 752 HE1 PHE 98 HE1 PHE 98 94.100 -10.935 -10.472 753 HE2 PHE 98 HE2 PHE 98 90.617 -8.874 -11.912 754 HZ PHE 98 HZ PHE 98 92.085 -10.873 -11.918 755 H GLU 99 H GLU 99 91.158 -6.785 -5.313 756 HA GLU 99 HA GLU 99 93.258 -8.158 -3.916 757 HB2 GLU 99 HB2 GLU 99 90.246 -8.297 -3.436 758 HB3 GLU 99 HB3 GLU 99 91.509 -8.740 -2.263 759 HG2 GLU 99 HG3 GLU 99 92.213 -6.512 -1.986 760 HG3 GLU 99 HG2 GLU 99 91.515 -5.996 -3.539 761 H SER 100 H SER 100 92.642 -10.480 -2.883 762 HA SER 100 HA SER 100 92.262 -12.264 -5.288 763 HB2 SER 100 HB3 SER 100 93.364 -13.029 -2.557 764 HB3 SER 100 HB2 SER 100 93.512 -13.930 -4.085 765 HG SER 100 HG SER 100 95.417 -12.704 -3.587 766 H ALA 101 H ALA 101 90.944 -14.207 -5.030 767 HA ALA 101 HA ALA 101 88.452 -13.657 -3.631 768 HB1 ALA 101 HB1 ALA 101 87.831 -15.961 -4.310 769 HB2 ALA 101 HB2 ALA 101 89.521 -16.280 -4.769 770 HB3 ALA 101 HB3 ALA 101 88.568 -15.071 -5.664 771 H THR 102 H THR 102 91.304 -15.665 -2.891 772 HA THR 102 HA THR 102 90.144 -16.945 -0.558 773 HB THR 102 HB THR 102 93.083 -16.271 -0.702 774 HG1 THR 102 HG1 THR 102 92.708 -16.846 -2.806 775 HG21 THR 102 HG21 THR 102 91.799 -18.972 -0.245 776 HG22 THR 102 HG22 THR 102 93.338 -18.338 0.385 777 HG23 THR 102 HG23 THR 102 91.795 -17.753 1.053 778 H PHE 103 H PHE 103 92.208 -14.038 -0.939 779 HA PHE 103 HA PHE 103 92.303 -13.342 1.843 780 HB2 PHE 103 HB3 PHE 103 93.756 -12.157 0.369 781 HB3 PHE 103 HB2 PHE 103 92.418 -11.699 -0.712 782 HD1 PHE 103 HD1 PHE 103 91.008 -9.811 -0.222 783 HD2 PHE 103 HD2 PHE 103 93.969 -11.098 2.611 784 HE1 PHE 103 HE1 PHE 103 90.689 -7.714 1.064 785 HE2 PHE 103 HE2 PHE 103 93.650 -9.000 3.896 786 HZ PHE 103 HZ PHE 103 92.005 -7.312 3.126 787 H LEU 104 H LEU 104 89.931 -12.461 -0.706 788 HA LEU 104 HA LEU 104 88.318 -10.798 1.053 789 HB2 LEU 104 HB2 LEU 104 87.625 -12.338 -1.488 790 HB3 LEU 104 HB3 LEU 104 86.529 -11.184 -0.691 791 HG LEU 104 HG LEU 104 89.348 -10.494 -1.631 792 HD11 LEU 104 HD11 LEU 104 88.213 -9.305 -3.489 793 HD12 LEU 104 HD12 LEU 104 87.873 -11.051 -3.544 794 HD13 LEU 104 HD13 LEU 104 86.642 -9.924 -2.924 795 HD21 LEU 104 HD21 LEU 104 88.460 -9.102 0.222 796 HD22 LEU 104 HD22 LEU 104 88.559 -8.167 -1.289 797 HD23 LEU 104 HD23 LEU 104 86.987 -8.782 -0.724 798 H GLY 105 H GLY 105 88.464 -14.273 0.416 799 HA2 GLY 105 HA2 GLY 105 85.913 -14.967 1.585 800 HA3 GLY 105 HA3 GLY 105 87.318 -16.054 1.465 801 H TYR 106 H TYR 106 89.201 -14.743 3.022 802 HA TYR 106 HA TYR 106 88.306 -15.453 5.697 803 HB2 TYR 106 HB2 TYR 106 90.765 -14.791 4.406 804 HB3 TYR 106 HB3 TYR 106 90.578 -13.657 5.764 805 HD1 TYR 106 HD1 TYR 106 91.463 -16.999 4.802 806 HD2 TYR 106 HD2 TYR 106 89.914 -14.667 8.058 807 HE1 TYR 106 HE1 TYR 106 92.088 -18.800 6.389 808 HE2 TYR 106 HE2 TYR 106 90.538 -16.466 9.644 809 HH TYR 106 HH TYR 106 91.242 -19.561 8.765 810 H PHE 107 H PHE 107 88.981 -12.272 4.146 811 HA PHE 107 HA PHE 107 87.623 -10.962 6.489 812 HB2 PHE 107 HB2 PHE 107 89.017 -9.644 4.122 813 HB3 PHE 107 HB3 PHE 107 88.577 -8.893 5.676 814 HD1 PHE 107 HD1 PHE 107 91.086 -10.749 3.867 815 HD2 PHE 107 HD2 PHE 107 89.646 -9.839 7.809 816 HE1 PHE 107 HE1 PHE 107 93.258 -11.467 4.827 817 HE2 PHE 107 HE2 PHE 107 91.814 -10.557 8.768 818 HZ PHE 107 HZ PHE 107 93.623 -11.369 7.278 819 H LYS 108 H LYS 108 85.612 -12.135 5.460 820 HA LYS 108 HA LYS 108 84.527 -10.673 3.097 821 HB2 LYS 108 HB2 LYS 108 84.013 -13.014 3.142 822 HB3 LYS 108 HB3 LYS 108 83.498 -12.942 4.845 823 HG2 LYS 108 HG2 LYS 108 81.532 -11.674 4.289 824 HG3 LYS 108 HG3 LYS 108 82.111 -11.377 2.633 825 HD2 LYS 108 HD3 LYS 108 81.920 -13.761 2.096 826 HD3 LYS 108 HD2 LYS 108 81.462 -14.130 3.776 827 HE2 LYS 108 HE2 LYS 108 79.423 -12.783 3.551 828 HE3 LYS 108 HE3 LYS 108 79.895 -12.300 1.904 829 HZ1 LYS 108 HZ1 LYS 108 78.343 -14.137 1.883 830 HZ2 LYS 108 HZ2 LYS 108 79.796 -14.617 1.268 831 HZ3 LYS 108 HZ3 LYS 108 79.359 -15.064 2.794 832 H SER 109 H SER 109 84.076 -10.857 6.614 833 HA SER 109 HA SER 109 81.837 -8.867 6.410 834 HB2 SER 109 HB2 SER 109 82.928 -10.651 8.595 835 HB3 SER 109 HB3 SER 109 81.937 -9.234 9.015 836 HG SER 109 HG SER 109 80.662 -11.143 8.676 837 H GLY 110 H GLY 110 85.125 -8.746 6.387 838 HA2 GLY 110 HA2 GLY 110 85.429 -6.555 8.384 839 HA3 GLY 110 HA3 GLY 110 86.712 -7.214 7.340 840 H LEU 111 H LEU 111 87.214 -6.128 5.474 841 HA LEU 111 HA LEU 111 87.195 -4.348 3.933 842 HB2 LEU 111 HB2 LEU 111 84.272 -5.066 4.203 843 HB3 LEU 111 HB3 LEU 111 84.788 -3.719 3.161 844 HG LEU 111 HG LEU 111 84.588 -5.976 1.993 845 HD11 LEU 111 HD11 LEU 111 85.972 -4.126 1.082 846 HD12 LEU 111 HD12 LEU 111 86.724 -5.707 0.760 847 HD13 LEU 111 HD13 LEU 111 87.350 -4.673 2.067 848 HD21 LEU 111 HD21 LEU 111 86.232 -7.675 2.429 849 HD22 LEU 111 HD22 LEU 111 87.162 -6.596 3.495 850 HD23 LEU 111 HD23 LEU 111 85.574 -7.208 4.016 851 H LYS 112 H LYS 112 87.999 -2.621 4.998 852 HA LYS 112 HA LYS 112 86.145 -0.482 5.739 853 HB2 LYS 112 HB2 LYS 112 86.727 -2.342 7.792 854 HB3 LYS 112 HB3 LYS 112 87.763 -0.934 8.126 855 HG2 LYS 112 HG3 LYS 112 85.681 0.518 7.780 856 HG3 LYS 112 HG2 LYS 112 84.736 -0.991 7.796 857 HD2 LYS 112 HD2 LYS 112 85.654 -1.539 10.034 858 HD3 LYS 112 HD3 LYS 112 86.591 -0.025 10.018 859 HE2 LYS 112 HE2 LYS 112 84.561 1.306 9.970 860 HE3 LYS 112 HE3 LYS 112 83.557 -0.147 9.748 861 HZ1 LYS 112 HZ1 LYS 112 83.584 0.575 12.042 862 HZ2 LYS 112 HZ2 LYS 112 84.296 -0.906 11.906 863 HZ3 LYS 112 HZ3 LYS 112 85.226 0.440 12.112 864 H TYR 113 H TYR 113 87.436 0.680 4.247 865 HA TYR 113 HA TYR 113 90.366 0.830 4.674 866 HB2 TYR 113 HB3 TYR 113 89.850 2.839 2.921 867 HB3 TYR 113 HB2 TYR 113 89.975 1.134 2.424 868 HD1 TYR 113 HD1 TYR 113 87.707 3.964 3.019 869 HD2 TYR 113 HD2 TYR 113 87.943 -0.206 2.023 870 HE1 TYR 113 HE1 TYR 113 85.345 4.011 2.262 871 HE2 TYR 113 HE2 TYR 113 85.583 -0.161 1.264 872 HH TYR 113 HH TYR 113 83.432 2.214 2.027 873 H LYS 114 H LYS 114 91.023 1.929 6.468 874 HA LYS 114 HA LYS 114 89.491 4.388 7.269 875 HB2 LYS 114 HB2 LYS 114 90.144 2.602 8.958 876 HB3 LYS 114 HB3 LYS 114 91.841 3.065 8.687 877 HG2 LYS 114 HG2 LYS 114 91.320 4.437 10.493 878 HG3 LYS 114 HG3 LYS 114 90.890 5.514 9.143 879 HD2 LYS 114 HD3 LYS 114 88.529 4.314 9.352 880 HD3 LYS 114 HD2 LYS 114 89.091 3.964 11.004 881 HE2 LYS 114 HE2 LYS 114 88.473 6.610 9.710 882 HE3 LYS 114 HE3 LYS 114 88.100 6.038 11.353 883 HZ1 LYS 114 HZ1 LYS 114 89.821 7.549 11.621 884 HZ2 LYS 114 HZ2 LYS 114 90.599 6.096 11.669 885 HZ3 LYS 114 HZ3 LYS 114 90.662 7.020 10.304 886 H LYS 115 H LYS 115 90.158 6.240 6.297 887 HA LYS 115 HA LYS 115 92.786 6.504 5.065 888 HB2 LYS 115 HB2 LYS 115 90.377 8.183 5.475 889 HB3 LYS 115 HB3 LYS 115 91.902 9.100 5.437 890 HG2 LYS 115 HG3 LYS 115 91.335 6.975 3.353 891 HG3 LYS 115 HG2 LYS 115 90.666 8.615 3.175 892 HD2 LYS 115 HD2 LYS 115 93.595 8.269 3.826 893 HD3 LYS 115 HD3 LYS 115 93.038 8.040 2.151 894 HE2 LYS 115 HE3 LYS 115 92.079 10.472 3.637 895 HE3 LYS 115 HE2 LYS 115 93.764 10.454 3.063 896 HZ1 LYS 115 HZ1 LYS 115 92.268 11.350 1.405 897 HZ2 LYS 115 HZ2 LYS 115 92.940 9.945 0.862 898 HZ3 LYS 115 HZ3 LYS 115 91.378 9.962 1.393 899 H GLY 116 H GLY 116 94.666 7.424 5.859 900 HA2 GLY 116 HA2 GLY 116 94.592 8.799 8.508 901 HA3 GLY 116 HA3 GLY 116 95.507 7.273 8.448 902 H GLY 117 H GLY 117 96.738 7.350 6.006 903 HA2 GLY 117 HA2 GLY 117 98.798 8.203 5.167 904 HA3 GLY 117 HA3 GLY 117 97.855 9.704 5.003 905 H VAL 118 H VAL 118 98.530 8.175 8.123 906 HA VAL 118 HA VAL 118 99.411 10.536 9.402 907 HB VAL 118 HB VAL 118 100.424 7.703 9.917 908 HG11 VAL 118 HG11 VAL 118 101.725 9.473 11.066 909 HG12 VAL 118 HG12 VAL 118 100.751 8.540 12.227 910 HG13 VAL 118 HG13 VAL 118 100.217 10.159 11.717 911 HG21 VAL 118 HG21 VAL 118 98.546 7.595 11.535 912 HG22 VAL 118 HG22 VAL 118 97.949 7.853 9.878 913 HG23 VAL 118 HG23 VAL 118 98.012 9.214 11.023 914 H ALA 119 H ALA 119 101.153 8.442 7.181 915 HA ALA 119 HA ALA 119 103.823 9.388 7.875 916 HB1 ALA 119 HB1 ALA 119 102.950 8.450 5.120 917 HB2 ALA 119 HB2 ALA 119 103.163 7.315 6.474 918 HB3 ALA 119 HB3 ALA 119 104.544 8.276 5.893 919 H SER 120 H SER 120 101.222 10.600 5.816 920 HA SER 120 HA SER 120 103.005 12.626 4.570 921 HB2 SER 120 HB2 SER 120 100.072 11.929 4.379 922 HB3 SER 120 HB3 SER 120 100.652 13.499 3.775 923 HG SER 120 HG SER 120 100.725 11.841 2.155 924 H GLY 121 H GLY 121 101.928 12.281 7.566 925 HA2 GLY 121 HA2 GLY 121 100.531 14.633 8.308 926 HA3 GLY 121 HA3 GLY 121 101.727 13.824 9.348 927 H PHE 122 H PHE 122 103.833 14.268 7.192 928 HA PHE 122 HA PHE 122 104.989 16.657 8.264 929 HB2 PHE 122 HB3 PHE 122 105.426 15.506 5.472 930 HB3 PHE 122 HB2 PHE 122 106.546 16.551 6.379 931 HD1 PHE 122 HD1 PHE 122 106.973 15.624 8.908 932 HD2 PHE 122 HD2 PHE 122 105.911 13.235 5.500 933 HE1 PHE 122 HE1 PHE 122 107.948 13.623 10.005 934 HE2 PHE 122 HE2 PHE 122 106.888 11.238 6.594 935 HZ PHE 122 HZ PHE 122 107.911 11.432 8.846 936 H LYS 123 H LYS 123 102.600 16.195 5.728 937 HA LYS 123 HA LYS 123 102.927 18.844 4.530 938 HB2 LYS 123 HB2 LYS 123 100.622 16.851 4.556 939 HB3 LYS 123 HB3 LYS 123 100.591 18.373 3.633 940 HG2 LYS 123 HG2 LYS 123 102.642 17.682 2.425 941 HG3 LYS 123 HG3 LYS 123 102.674 16.160 3.349 942 HD2 LYS 123 HD3 LYS 123 100.365 15.653 2.450 943 HD3 LYS 123 HD2 LYS 123 100.514 17.088 1.407 944 HE2 LYS 123 HE2 LYS 123 101.887 14.438 1.223 945 HE3 LYS 123 HE3 LYS 123 101.369 15.546 -0.071 946 HZ1 LYS 123 HZ1 LYS 123 103.687 15.643 -0.024 947 HZ2 LYS 123 HZ2 LYS 123 103.767 15.737 1.621 948 HZ3 LYS 123 HZ3 LYS 123 103.211 17.021 0.748 949 H HIS 124 H HIS 124 100.539 17.488 6.864 950 HA HIS 124 HA HIS 124 99.339 20.117 7.349 951 HB2 HIS 124 HB3 HIS 124 99.254 17.660 9.151 952 HB3 HIS 124 HB2 HIS 124 98.088 19.004 9.101 953 HD2 HIS 124 HD2 HIS 124 95.886 17.681 8.006 954 HE1 HIS 124 HE1 HIS 124 97.825 16.086 4.611 955 HE2 HIS 124 HE2 HIS 124 95.559 16.379 5.749 956 H VAL 125 H VAL 125 102.133 20.370 7.576 957 HA VAL 125 HA VAL 125 102.733 20.355 10.503 958 HB VAL 125 HB VAL 125 104.500 19.681 8.912 959 HG11 VAL 125 HG11 VAL 125 103.742 21.057 6.993 960 HG12 VAL 125 HG12 VAL 125 104.216 22.533 7.866 961 HG13 VAL 125 HG13 VAL 125 105.457 21.362 7.361 962 HG21 VAL 125 HG21 VAL 125 105.146 20.805 11.027 963 HG22 VAL 125 HG22 VAL 125 106.276 21.215 9.714 964 HG23 VAL 125 HG23 VAL 125 105.035 22.387 10.219 965 H VAL 126 H VAL 126 102.623 22.147 11.788 966 HA VAL 126 HA VAL 126 101.709 24.689 10.457 967 HB VAL 126 HB VAL 126 101.737 23.830 13.387 968 HG11 VAL 126 HG11 VAL 126 101.953 26.284 13.098 969 HG12 VAL 126 HG12 VAL 126 100.348 25.854 13.737 970 HG13 VAL 126 HG13 VAL 126 100.538 26.281 12.019 971 HG21 VAL 126 HG21 VAL 126 100.122 22.583 11.976 972 HG22 VAL 126 HG22 VAL 126 99.470 24.122 11.364 973 HG23 VAL 126 HG23 VAL 126 99.280 23.695 13.082 974 HA PRO 127 HA PRO 127 106.052 25.981 10.727 975 HB2 PRO 127 HB3 PRO 127 104.637 28.620 10.364 976 HB3 PRO 127 HB2 PRO 127 106.078 27.983 9.520 977 HG2 PRO 127 HG2 PRO 127 103.651 28.012 8.371 978 HG3 PRO 127 HG3 PRO 127 104.821 26.696 8.080 979 HD2 PRO 127 HD3 PRO 127 102.299 26.676 9.693 980 HD3 PRO 127 HD2 PRO 127 103.126 25.325 8.860 981 H ASN 128 H ASN 128 107.314 27.106 12.293 982 HA ASN 128 HA ASN 128 106.472 27.134 14.954 983 HB2 ASN 128 HB3 ASN 128 108.185 29.068 15.242 984 HB3 ASN 128 HB2 ASN 128 108.779 27.534 14.563 985 HD21 ASN 128 HD21 ASN 128 106.705 29.647 12.613 986 HD22 ASN 128 HD22 ASN 128 107.968 30.182 11.527 987 H GLU 129 H GLU 129 105.692 28.783 16.410 988 HA GLU 129 HA GLU 129 103.463 30.282 15.428 989 HB2 GLU 129 HB3 GLU 129 104.043 29.635 17.858 990 HB3 GLU 129 HB2 GLU 129 105.091 31.074 17.870 991 HG2 GLU 129 HG2 GLU 129 103.039 32.388 17.046 992 HG3 GLU 129 HG3 GLU 129 102.081 30.946 17.462 993 H VAL 130 H VAL 130 106.847 30.953 15.237 994 HA VAL 130 HA VAL 130 107.012 33.758 15.330 995 HB VAL 130 HB VAL 130 108.250 31.841 13.310 996 HG11 VAL 130 HG11 VAL 130 109.986 33.813 13.246 997 HG12 VAL 130 HG12 VAL 130 108.621 34.802 13.818 998 HG13 VAL 130 HG13 VAL 130 108.505 33.936 12.267 999 HG21 VAL 130 HG21 VAL 130 110.225 32.056 14.794 1000 HG22 VAL 130 HG22 VAL 130 108.819 31.428 15.687 1001 HG23 VAL 130 HG23 VAL 130 109.300 33.132 15.868 1002 H VAL 131 H VAL 131 105.100 31.824 13.194 1003 HA VAL 131 HA VAL 131 104.937 33.525 10.896 1004 HB VAL 131 HB VAL 131 103.885 31.241 11.146 1005 HG11 VAL 131 HG11 VAL 131 101.874 30.944 12.366 1006 HG12 VAL 131 HG12 VAL 131 101.590 32.696 12.496 1007 HG13 VAL 131 HG13 VAL 131 102.885 31.931 13.449 1008 HG21 VAL 131 HG21 VAL 131 101.867 31.808 9.819 1009 HG22 VAL 131 HG22 VAL 131 102.020 33.510 10.314 1010 HG23 VAL 131 HG23 VAL 131 103.271 32.766 9.289 1011 H VAL 132 H VAL 132 103.412 33.770 14.095 1012 HA VAL 132 HA VAL 132 101.594 35.933 13.318 1013 HB VAL 132 HB VAL 132 102.694 35.243 16.079 1014 HG11 VAL 132 HG11 VAL 132 101.573 37.448 15.914 1015 HG12 VAL 132 HG12 VAL 132 100.591 36.300 16.855 1016 HG13 VAL 132 HG13 VAL 132 100.155 36.671 15.169 1017 HG21 VAL 132 HG21 VAL 132 100.643 33.865 16.303 1018 HG22 VAL 132 HG22 VAL 132 100.210 34.236 14.617 1019 HG23 VAL 132 HG23 VAL 132 101.667 33.276 14.971 1020 H GLN 133 H GLN 133 104.952 35.731 14.364 1021 HA GLN 133 HA GLN 133 105.072 38.687 14.796 1022 HB2 GLN 133 HB2 GLN 133 107.028 36.388 15.089 1023 HB3 GLN 133 HB3 GLN 133 107.596 38.075 15.095 1024 HG2 GLN 133 HG2 GLN 133 105.271 37.280 16.854 1025 HG3 GLN 133 HG3 GLN 133 106.932 36.904 17.373 1026 HE21 GLN 133 HE21 GLN 133 108.511 38.926 17.067 1027 HE22 GLN 133 HE22 GLN 133 107.847 40.457 17.591 Start of MODEL 3 1 H1 GLU 1 H1 GLU 1 114.331 -12.754 22.968 2 H2 GLU 1 H2 GLU 1 114.534 -12.148 24.488 3 H3 GLU 1 H3 GLU 1 113.536 -13.438 24.241 4 HA GLU 1 HA GLU 1 111.805 -12.125 23.953 5 HB2 GLU 1 HB3 GLU 1 113.098 -10.624 25.495 6 HB3 GLU 1 HB2 GLU 1 113.823 -9.839 24.071 7 HG2 GLU 1 HG2 GLU 1 111.809 -8.846 23.425 8 HG3 GLU 1 HG3 GLU 1 110.819 -10.078 24.244 9 H HIS 2 H HIS 2 113.999 -12.684 21.666 10 HA HIS 2 HA HIS 2 113.885 -10.745 19.656 11 HB2 HIS 2 HB2 HIS 2 113.499 -12.896 18.100 12 HB3 HIS 2 HB3 HIS 2 115.033 -12.641 18.965 13 HD2 HIS 2 HD2 HIS 2 112.405 -15.363 18.666 14 HE1 HIS 2 HE1 HIS 2 114.281 -16.039 22.388 15 HE2 HIS 2 HE2 HIS 2 112.715 -17.058 20.647 16 HA PRO 3 HA PRO 3 109.636 -10.134 18.626 17 HB2 PRO 3 HB3 PRO 3 109.832 -9.599 15.921 18 HB3 PRO 3 HB2 PRO 3 110.303 -8.436 17.194 19 HG2 PRO 3 HG2 PRO 3 112.004 -10.238 15.512 20 HG3 PRO 3 HG3 PRO 3 112.309 -8.570 16.069 21 HD2 PRO 3 HD3 PRO 3 113.440 -10.805 17.239 22 HD3 PRO 3 HD2 PRO 3 113.147 -9.275 18.120 23 H GLU 4 H GLU 4 107.873 -11.364 18.015 24 HA GLU 4 HA GLU 4 108.325 -14.090 17.114 25 HB2 GLU 4 HB2 GLU 4 105.718 -13.903 16.714 26 HB3 GLU 4 HB3 GLU 4 106.364 -13.845 18.371 27 HG2 GLU 4 HG2 GLU 4 106.182 -11.458 18.464 28 HG3 GLU 4 HG3 GLU 4 105.918 -11.337 16.708 29 H PHE 5 H PHE 5 107.751 -11.056 15.454 30 HA PHE 5 HA PHE 5 106.695 -12.029 12.981 31 HB2 PHE 5 HB2 PHE 5 106.852 -9.650 13.353 32 HB3 PHE 5 HB3 PHE 5 108.614 -9.743 13.588 33 HD1 PHE 5 HD1 PHE 5 109.953 -9.156 11.780 34 HD2 PHE 5 HD2 PHE 5 106.038 -10.755 11.031 35 HE1 PHE 5 HE1 PHE 5 110.294 -8.849 9.342 36 HE2 PHE 5 HE2 PHE 5 106.376 -10.447 8.594 37 HZ PHE 5 HZ PHE 5 108.509 -9.497 7.749 38 H LEU 6 H LEU 6 109.897 -12.336 14.378 39 HA LEU 6 HA LEU 6 111.384 -12.829 11.961 40 HB2 LEU 6 HB3 LEU 6 112.058 -12.679 14.574 41 HB3 LEU 6 HB2 LEU 6 112.017 -14.449 14.402 42 HG LEU 6 HG LEU 6 113.608 -12.517 12.656 43 HD11 LEU 6 HD11 LEU 6 114.540 -12.816 14.936 44 HD12 LEU 6 HD12 LEU 6 114.479 -14.582 14.728 45 HD13 LEU 6 HD13 LEU 6 115.569 -13.605 13.716 46 HD21 LEU 6 HD21 LEU 6 114.620 -14.862 11.978 47 HD22 LEU 6 HD22 LEU 6 113.106 -14.307 11.224 48 HD23 LEU 6 HD23 LEU 6 113.057 -15.489 12.554 49 H LYS 7 H LYS 7 109.195 -14.858 13.858 50 HA LYS 7 HA LYS 7 109.836 -17.165 12.018 51 HB2 LYS 7 HB2 LYS 7 108.638 -16.930 14.780 52 HB3 LYS 7 HB3 LYS 7 108.237 -18.341 13.772 53 HG2 LYS 7 HG3 LYS 7 110.700 -18.732 13.437 54 HG3 LYS 7 HG2 LYS 7 111.025 -17.405 14.578 55 HD2 LYS 7 HD2 LYS 7 109.907 -18.589 16.376 56 HD3 LYS 7 HD3 LYS 7 109.330 -19.846 15.256 57 HE2 LYS 7 HE3 LYS 7 111.635 -20.562 14.816 58 HE3 LYS 7 HE2 LYS 7 112.265 -19.244 15.833 59 HZ1 LYS 7 HZ1 LYS 7 112.154 -21.323 17.038 60 HZ2 LYS 7 HZ2 LYS 7 110.533 -21.448 16.761 61 HZ3 LYS 7 HZ3 LYS 7 111.117 -20.227 17.704 62 H ALA 8 H ALA 8 107.084 -15.332 13.412 63 HA ALA 8 HA ALA 8 104.905 -15.023 12.555 64 HB1 ALA 8 HB1 ALA 8 106.645 -15.289 10.115 65 HB2 ALA 8 HB2 ALA 8 104.880 -15.334 9.892 66 HB3 ALA 8 HB3 ALA 8 105.645 -13.918 10.652 67 H GLY 9 H GLY 9 103.029 -16.225 11.833 68 HA2 GLY 9 HA3 GLY 9 101.793 -18.237 11.695 69 HA3 GLY 9 HA2 GLY 9 103.097 -18.813 10.630 70 H LYS 10 H LYS 10 103.694 -17.811 13.960 71 HA LYS 10 HA LYS 10 105.219 -20.009 14.738 72 HB2 LYS 10 HB2 LYS 10 103.981 -19.596 17.086 73 HB3 LYS 10 HB3 LYS 10 105.118 -18.404 16.410 74 HG2 LYS 10 HG2 LYS 10 103.333 -17.051 15.547 75 HG3 LYS 10 HG3 LYS 10 102.131 -18.333 15.829 76 HD2 LYS 10 HD3 LYS 10 102.153 -16.435 17.549 77 HD3 LYS 10 HD2 LYS 10 102.288 -18.080 18.214 78 HE2 LYS 10 HE2 LYS 10 104.620 -17.851 18.609 79 HE3 LYS 10 HE3 LYS 10 104.748 -16.435 17.538 80 HZ1 LYS 10 HZ1 LYS 10 104.747 -15.799 19.858 81 HZ2 LYS 10 HZ2 LYS 10 103.403 -15.208 19.109 82 HZ3 LYS 10 HZ3 LYS 10 103.284 -16.520 20.101 83 H GLU 11 H GLU 11 101.746 -19.930 14.220 84 HA GLU 11 HA GLU 11 101.718 -22.896 14.656 85 HB2 GLU 11 HB2 GLU 11 99.466 -21.293 15.867 86 HB3 GLU 11 HB3 GLU 11 100.058 -22.916 16.299 87 HG2 GLU 11 HG2 GLU 11 102.140 -21.893 17.211 88 HG3 GLU 11 HG3 GLU 11 101.503 -20.278 16.820 89 HA PRO 12 HA PRO 12 99.304 -23.045 10.963 90 HB2 PRO 12 HB3 PRO 12 97.316 -24.603 12.614 91 HB3 PRO 12 HB2 PRO 12 98.031 -25.005 11.026 92 HG2 PRO 12 HG2 PRO 12 98.847 -26.151 13.336 93 HG3 PRO 12 HG3 PRO 12 99.945 -25.853 11.962 94 HD2 PRO 12 HD3 PRO 12 99.824 -24.499 14.608 95 HD3 PRO 12 HD2 PRO 12 101.174 -24.579 13.437 96 H GLY 13 H GLY 13 97.813 -21.641 10.083 97 HA2 GLY 13 HA3 GLY 13 95.310 -20.912 10.563 98 HA3 GLY 13 HA2 GLY 13 96.016 -20.214 12.040 99 H LEU 14 H LEU 14 95.278 -18.114 11.234 100 HA LEU 14 HA LEU 14 97.153 -17.035 9.113 101 HB2 LEU 14 HB2 LEU 14 94.978 -17.038 8.114 102 HB3 LEU 14 HB3 LEU 14 94.207 -16.466 9.613 103 HG LEU 14 HG LEU 14 96.352 -14.700 8.535 104 HD11 LEU 14 HD11 LEU 14 95.256 -15.440 6.434 105 HD12 LEU 14 HD12 LEU 14 93.667 -15.017 7.116 106 HD13 LEU 14 HD13 LEU 14 94.867 -13.741 6.795 107 HD21 LEU 14 HD21 LEU 14 94.942 -14.123 10.495 108 HD22 LEU 14 HD22 LEU 14 94.684 -12.974 9.161 109 HD23 LEU 14 HD23 LEU 14 93.484 -14.249 9.481 110 H GLN 15 H GLN 15 98.110 -15.039 9.570 111 HA GLN 15 HA GLN 15 97.373 -13.815 12.237 112 HB2 GLN 15 HB2 GLN 15 100.202 -14.162 11.148 113 HB3 GLN 15 HB3 GLN 15 99.745 -13.462 12.720 114 HG2 GLN 15 HG3 GLN 15 98.480 -15.806 12.990 115 HG3 GLN 15 HG2 GLN 15 99.709 -16.333 11.816 116 HE21 GLN 15 HE21 GLN 15 101.863 -16.612 12.557 117 HE22 GLN 15 HE22 GLN 15 102.356 -16.280 14.202 118 H ILE 16 H ILE 16 97.551 -11.539 12.324 119 HA ILE 16 HA ILE 16 98.026 -10.248 9.625 120 HB ILE 16 HB ILE 16 96.278 -9.205 11.893 121 HG12 ILE 16 HG12 ILE 16 95.413 -10.641 9.346 122 HG13 ILE 16 HG13 ILE 16 95.489 -11.413 10.948 123 HG21 ILE 16 HG21 ILE 16 97.117 -7.513 10.286 124 HG22 ILE 16 HG22 ILE 16 95.364 -7.759 10.101 125 HG23 ILE 16 HG23 ILE 16 96.493 -8.489 8.934 126 HD11 ILE 16 HD11 ILE 16 93.195 -10.611 10.454 127 HD12 ILE 16 HD12 ILE 16 93.821 -8.960 10.230 128 HD13 ILE 16 HD13 ILE 16 93.896 -9.731 11.833 129 H TRP 17 H TRP 17 99.459 -8.542 9.535 130 HA TRP 17 HA TRP 17 100.412 -7.375 12.137 131 HB2 TRP 17 HB3 TRP 17 102.286 -8.456 9.984 132 HB3 TRP 17 HB2 TRP 17 102.765 -7.672 11.508 133 HD1 TRP 17 HD1 TRP 17 101.093 -9.026 13.635 134 HE1 TRP 17 HE1 TRP 17 101.264 -11.541 14.181 135 HE3 TRP 17 HE3 TRP 17 103.094 -10.678 9.236 136 HZ2 TRP 17 HZ2 TRP 17 102.158 -13.944 12.861 137 HZ3 TRP 17 HZ3 TRP 17 103.593 -13.082 8.908 138 HH2 TRP 17 HH2 TRP 17 103.128 -14.716 10.712 139 H ARG 18 H ARG 18 99.985 -5.235 11.838 140 HA ARG 18 HA ARG 18 100.087 -4.095 9.091 141 HB2 ARG 18 HB2 ARG 18 99.021 -2.203 9.999 142 HB3 ARG 18 HB3 ARG 18 98.391 -3.525 11.009 143 HG2 ARG 18 HG2 ARG 18 100.339 -3.025 12.614 144 HG3 ARG 18 HG3 ARG 18 100.582 -1.526 11.684 145 HD2 ARG 18 HD3 ARG 18 98.090 -1.046 12.078 146 HD3 ARG 18 HD2 ARG 18 98.122 -2.375 13.261 147 HE ARG 18 HE ARG 18 100.297 -0.619 13.891 148 HH11 ARG 18 HH11 ARG 18 100.010 0.908 15.536 149 HH12 ARG 18 HH12 ARG 18 98.396 1.388 16.011 150 HH21 ARG 18 HH21 ARG 18 96.820 -0.694 13.708 151 HH22 ARG 18 HH22 ARG 18 96.598 0.486 14.981 152 H VAL 19 H VAL 19 101.583 -2.532 8.380 153 HA VAL 19 HA VAL 19 104.182 -2.616 9.826 154 HB VAL 19 HB VAL 19 103.788 -0.832 7.455 155 HG11 VAL 19 HG11 VAL 19 106.009 -1.213 8.495 156 HG12 VAL 19 HG12 VAL 19 105.960 -1.849 6.833 157 HG13 VAL 19 HG13 VAL 19 105.837 -2.963 8.217 158 HG21 VAL 19 HG21 VAL 19 104.020 -2.950 5.996 159 HG22 VAL 19 HG22 VAL 19 102.412 -2.625 6.686 160 HG23 VAL 19 HG23 VAL 19 103.466 -3.855 7.425 161 H GLU 20 H GLU 20 105.185 -0.855 10.798 162 HA GLU 20 HA GLU 20 103.915 1.822 10.683 163 HB2 GLU 20 HB3 GLU 20 102.498 0.733 12.371 164 HB3 GLU 20 HB2 GLU 20 103.941 0.206 13.270 165 HG2 GLU 20 HG2 GLU 20 104.487 2.406 13.929 166 HG3 GLU 20 HG3 GLU 20 103.496 3.137 12.643 167 H LYS 21 H LYS 21 106.117 2.171 9.834 168 HA LYS 21 HA LYS 21 108.267 3.097 10.212 169 HB2 LYS 21 HB2 LYS 21 106.989 3.846 12.439 170 HB3 LYS 21 HB3 LYS 21 108.075 2.647 13.183 171 HG2 LYS 21 HG2 LYS 21 110.004 3.799 11.993 172 HG3 LYS 21 HG3 LYS 21 108.861 5.081 11.526 173 HD2 LYS 21 HD3 LYS 21 108.436 5.662 13.822 174 HD3 LYS 21 HD2 LYS 21 109.269 4.204 14.413 175 HE2 LYS 21 HE2 LYS 21 110.700 6.225 14.643 176 HE3 LYS 21 HE3 LYS 21 111.410 5.049 13.510 177 HZ1 LYS 21 HZ1 LYS 21 111.155 7.558 12.886 178 HZ2 LYS 21 HZ2 LYS 21 110.959 6.379 11.750 179 HZ3 LYS 21 HZ3 LYS 21 109.639 7.091 12.436 180 H PHE 22 H PHE 22 107.728 0.224 9.847 181 HA PHE 22 HA PHE 22 109.040 -1.744 9.832 182 HB2 PHE 22 HB3 PHE 22 111.269 -0.326 11.294 183 HB3 PHE 22 HB2 PHE 22 111.363 -1.534 9.989 184 HD1 PHE 22 HD1 PHE 22 109.380 -0.366 8.066 185 HD2 PHE 22 HD2 PHE 22 112.476 1.504 10.384 186 HE1 PHE 22 HE1 PHE 22 109.535 1.456 6.390 187 HE2 PHE 22 HE2 PHE 22 112.629 3.327 8.710 188 HZ PHE 22 HZ PHE 22 111.158 3.303 6.712 189 H ASP 23 H ASP 23 107.516 -0.575 12.315 190 HA ASP 23 HA ASP 23 108.909 -2.155 14.455 191 HB2 ASP 23 HB2 ASP 23 107.849 0.226 14.741 192 HB3 ASP 23 HB3 ASP 23 106.301 -0.652 14.798 193 H LEU 24 H LEU 24 106.106 -2.231 12.332 194 HA LEU 24 HA LEU 24 104.538 -3.959 11.970 195 HB2 LEU 24 HB2 LEU 24 106.975 -5.241 12.765 196 HB3 LEU 24 HB3 LEU 24 105.640 -6.078 13.593 197 HG LEU 24 HG LEU 24 104.446 -6.134 11.324 198 HD11 LEU 24 HD11 LEU 24 105.814 -4.373 10.238 199 HD12 LEU 24 HD12 LEU 24 107.257 -5.405 10.384 200 HD13 LEU 24 HD13 LEU 24 105.909 -5.903 9.335 201 HD21 LEU 24 HD21 LEU 24 105.580 -8.108 12.315 202 HD22 LEU 24 HD22 LEU 24 107.121 -7.584 11.595 203 HD23 LEU 24 HD23 LEU 24 105.772 -8.083 10.546 204 H VAL 25 H VAL 25 102.594 -4.356 12.948 205 HA VAL 25 HA VAL 25 102.510 -4.732 15.913 206 HB VAL 25 HB VAL 25 101.632 -2.266 14.464 207 HG11 VAL 25 HG11 VAL 25 99.848 -1.926 16.289 208 HG12 VAL 25 HG12 VAL 25 99.430 -3.050 14.973 209 HG13 VAL 25 HG13 VAL 25 99.941 -3.684 16.556 210 HG21 VAL 25 HG21 VAL 25 103.465 -2.287 16.135 211 HG22 VAL 25 HG22 VAL 25 102.333 -2.900 17.364 212 HG23 VAL 25 HG23 VAL 25 102.108 -1.273 16.679 213 HA PRO 26 HA PRO 26 99.365 -7.490 14.362 214 HB2 PRO 26 HB3 PRO 26 98.262 -8.196 16.800 215 HB3 PRO 26 HB2 PRO 26 99.792 -8.872 16.170 216 HG2 PRO 26 HG2 PRO 26 99.331 -6.728 18.205 217 HG3 PRO 26 HG3 PRO 26 100.581 -8.002 18.147 218 HD2 PRO 26 HD3 PRO 26 101.042 -5.364 17.447 219 HD3 PRO 26 HD2 PRO 26 101.982 -6.738 16.790 220 H VAL 27 H VAL 27 97.692 -6.478 13.319 221 HA VAL 27 HA VAL 27 96.163 -4.283 14.075 222 HB VAL 27 HB VAL 27 95.963 -5.707 11.951 223 HG11 VAL 27 HG11 VAL 27 94.534 -7.599 11.930 224 HG12 VAL 27 HG12 VAL 27 95.506 -7.812 13.406 225 HG13 VAL 27 HG13 VAL 27 93.838 -7.200 13.519 226 HG21 VAL 27 HG21 VAL 27 93.550 -5.147 11.637 227 HG22 VAL 27 HG22 VAL 27 93.413 -4.840 13.385 228 HG23 VAL 27 HG23 VAL 27 94.458 -3.808 12.379 229 HA PRO 28 HA PRO 28 94.254 -5.445 17.928 230 HB2 PRO 28 HB3 PRO 28 92.041 -3.719 17.744 231 HB3 PRO 28 HB2 PRO 28 93.647 -3.280 18.391 232 HG2 PRO 28 HG3 PRO 28 92.448 -2.761 15.710 233 HG3 PRO 28 HG2 PRO 28 93.562 -1.756 16.677 234 HD2 PRO 28 HD2 PRO 28 94.394 -3.206 14.504 235 HD3 PRO 28 HD3 PRO 28 95.450 -2.892 15.915 236 H THR 29 H THR 29 92.994 -7.182 18.362 237 HA THR 29 HA THR 29 91.317 -8.397 16.344 238 HB THR 29 HB THR 29 91.497 -8.767 19.361 239 HG1 THR 29 HG1 THR 29 92.555 -10.699 18.638 240 HG21 THR 29 HG21 THR 29 90.173 -10.834 19.020 241 HG22 THR 29 HG22 THR 29 89.954 -10.411 17.306 242 HG23 THR 29 HG23 THR 29 89.232 -9.391 18.573 243 H ASN 30 H ASN 30 90.662 -6.095 18.961 244 HA ASN 30 HA ASN 30 87.893 -6.238 19.259 245 HB2 ASN 30 HB2 ASN 30 89.323 -4.506 20.328 246 HB3 ASN 30 HB3 ASN 30 89.481 -3.679 18.759 247 HD21 ASN 30 HD21 ASN 30 88.397 -1.783 19.858 248 HD22 ASN 30 HD22 ASN 30 86.655 -1.798 20.019 249 H LEU 31 H LEU 31 89.688 -5.064 16.427 250 HA LEU 31 HA LEU 31 87.071 -4.490 15.058 251 HB2 LEU 31 HB3 LEU 31 89.959 -3.763 14.549 252 HB3 LEU 31 HB2 LEU 31 88.801 -3.752 13.197 253 HG LEU 31 HG LEU 31 87.366 -2.168 14.358 254 HD11 LEU 31 HD11 LEU 31 88.204 -1.256 16.615 255 HD12 LEU 31 HD12 LEU 31 87.511 -2.896 16.636 256 HD13 LEU 31 HD13 LEU 31 89.277 -2.676 16.670 257 HD21 LEU 31 HD21 LEU 31 89.316 -1.228 13.145 258 HD22 LEU 31 HD22 LEU 31 88.912 -0.239 14.569 259 HD23 LEU 31 HD23 LEU 31 90.297 -1.356 14.625 260 H TYR 32 H TYR 32 90.166 -6.205 14.394 261 HA TYR 32 HA TYR 32 90.560 -8.032 12.940 262 HB2 TYR 32 HB2 TYR 32 89.081 -8.918 14.952 263 HB3 TYR 32 HB3 TYR 32 87.834 -9.089 13.693 264 HD1 TYR 32 HD1 TYR 32 90.558 -10.692 15.280 265 HD2 TYR 32 HD2 TYR 32 88.707 -10.208 11.433 266 HE1 TYR 32 HE1 TYR 32 91.630 -12.787 14.500 267 HE2 TYR 32 HE2 TYR 32 89.785 -12.301 10.652 268 HH TYR 32 HH TYR 32 91.941 -13.652 11.340 269 H GLY 33 H GLY 33 90.441 -6.982 10.919 270 HA2 GLY 33 HA3 GLY 33 89.277 -7.664 8.734 271 HA3 GLY 33 HA2 GLY 33 87.753 -7.229 9.543 272 H ASP 34 H ASP 34 89.587 -4.997 10.865 273 HA ASP 34 HA ASP 34 88.912 -2.999 8.743 274 HB2 ASP 34 HB2 ASP 34 89.983 -2.681 11.583 275 HB3 ASP 34 HB3 ASP 34 89.539 -1.337 10.504 276 H PHE 35 H PHE 35 90.473 -1.720 7.681 277 HA PHE 35 HA PHE 35 93.349 -2.297 8.360 278 HB2 PHE 35 HB3 PHE 35 92.356 -2.356 5.489 279 HB3 PHE 35 HB2 PHE 35 93.929 -2.892 6.125 280 HD1 PHE 35 HD1 PHE 35 93.978 -4.889 7.714 281 HD2 PHE 35 HD2 PHE 35 90.515 -3.841 5.399 282 HE1 PHE 35 HE1 PHE 35 93.066 -7.170 8.048 283 HE2 PHE 35 HE2 PHE 35 89.600 -6.120 5.735 284 HZ PHE 35 HZ PHE 35 90.875 -7.787 7.058 285 H PHE 36 H PHE 36 94.726 -0.567 7.953 286 HA PHE 36 HA PHE 36 93.357 2.016 7.364 287 HB2 PHE 36 HB2 PHE 36 96.058 1.172 8.411 288 HB3 PHE 36 HB3 PHE 36 95.874 2.799 7.713 289 HD1 PHE 36 HD1 PHE 36 93.587 0.629 9.766 290 HD2 PHE 36 HD2 PHE 36 95.688 4.360 9.437 291 HE1 PHE 36 HE1 PHE 36 92.529 1.412 11.869 292 HE2 PHE 36 HE2 PHE 36 94.635 5.140 11.541 293 HZ PHE 36 HZ PHE 36 93.051 3.669 12.755 294 H THR 37 H THR 37 93.007 2.363 5.217 295 HA THR 37 HA THR 37 94.417 1.210 3.045 296 HB THR 37 HB THR 37 93.618 3.253 1.747 297 HG1 THR 37 HG1 THR 37 93.695 4.791 3.390 298 HG21 THR 37 HG21 THR 37 91.221 2.714 2.073 299 HG22 THR 37 HG22 THR 37 92.212 1.236 2.056 300 HG23 THR 37 HG23 THR 37 91.614 1.889 3.600 301 H GLY 38 H GLY 38 94.993 4.447 4.525 302 HA2 GLY 38 HA2 GLY 38 97.279 5.054 2.876 303 HA3 GLY 38 HA3 GLY 38 96.943 5.781 4.465 304 H ASP 39 H ASP 39 97.017 2.402 4.722 305 HA ASP 39 HA ASP 39 99.979 2.436 5.324 306 HB2 ASP 39 HB2 ASP 39 97.879 1.134 7.107 307 HB3 ASP 39 HB3 ASP 39 99.621 1.303 7.432 308 H ALA 40 H ALA 40 100.719 0.054 5.744 309 HA ALA 40 HA ALA 40 99.313 -1.667 3.687 310 HB1 ALA 40 HB1 ALA 40 101.516 -2.760 3.359 311 HB2 ALA 40 HB2 ALA 40 102.230 -1.689 4.587 312 HB3 ALA 40 HB3 ALA 40 101.620 -1.008 3.060 313 H TYR 41 H TYR 41 99.099 -3.929 4.159 314 HA TYR 41 HA TYR 41 99.583 -4.632 7.060 315 HB2 TYR 41 HB3 TYR 41 97.068 -5.012 5.395 316 HB3 TYR 41 HB2 TYR 41 97.392 -5.979 6.853 317 HD1 TYR 41 HD1 TYR 41 97.011 -5.083 9.011 318 HD2 TYR 41 HD2 TYR 41 97.070 -2.470 5.603 319 HE1 TYR 41 HE1 TYR 41 96.201 -3.215 10.429 320 HE2 TYR 41 HE2 TYR 41 96.260 -0.603 7.019 321 HH TYR 41 HH TYR 41 96.372 -0.041 9.601 322 H VAL 42 H VAL 42 100.853 -6.402 7.182 323 HA VAL 42 HA VAL 42 101.023 -8.180 4.763 324 HB VAL 42 HB VAL 42 102.733 -8.202 7.288 325 HG11 VAL 42 HG11 VAL 42 102.533 -10.161 5.467 326 HG12 VAL 42 HG12 VAL 42 103.641 -9.098 4.567 327 HG13 VAL 42 HG13 VAL 42 104.102 -9.707 6.175 328 HG21 VAL 42 HG21 VAL 42 102.852 -5.997 6.157 329 HG22 VAL 42 HG22 VAL 42 103.203 -6.809 4.613 330 HG23 VAL 42 HG23 VAL 42 104.371 -6.903 5.953 331 H ILE 43 H ILE 43 99.782 -9.989 4.766 332 HA ILE 43 HA ILE 43 99.106 -11.176 7.470 333 HB ILE 43 HB ILE 43 97.316 -12.117 5.419 334 HG12 ILE 43 HG13 ILE 43 97.671 -9.093 5.568 335 HG13 ILE 43 HG12 ILE 43 97.910 -10.122 4.136 336 HG21 ILE 43 HG21 ILE 43 97.145 -11.600 8.036 337 HG22 ILE 43 HG22 ILE 43 95.705 -11.536 6.992 338 HG23 ILE 43 HG23 ILE 43 96.541 -10.032 7.448 339 HD11 ILE 43 HD11 ILE 43 95.736 -9.395 3.749 340 HD12 ILE 43 HD12 ILE 43 95.404 -10.869 4.690 341 HD13 ILE 43 HD13 ILE 43 95.355 -9.277 5.484 342 H LEU 44 H LEU 44 99.351 -13.377 7.732 343 HA LEU 44 HA LEU 44 100.580 -14.853 5.391 344 HB2 LEU 44 HB2 LEU 44 101.679 -14.264 8.012 345 HB3 LEU 44 HB3 LEU 44 101.476 -16.023 7.831 346 HG LEU 44 HG LEU 44 102.605 -15.794 5.549 347 HD11 LEU 44 HD11 LEU 44 103.969 -13.750 5.218 348 HD12 LEU 44 HD12 LEU 44 102.235 -13.356 5.300 349 HD13 LEU 44 HD13 LEU 44 103.284 -13.053 6.706 350 HD21 LEU 44 HD21 LEU 44 104.447 -14.816 7.742 351 HD22 LEU 44 HD22 LEU 44 104.738 -16.058 6.500 352 HD23 LEU 44 HD23 LEU 44 103.672 -16.412 7.881 353 H LYS 45 H LYS 45 99.544 -16.739 4.886 354 HA LYS 45 HA LYS 45 97.564 -17.763 6.934 355 HB2 LYS 45 HB3 LYS 45 96.942 -17.011 4.448 356 HB3 LYS 45 HB2 LYS 45 97.516 -18.650 4.057 357 HG2 LYS 45 HG2 LYS 45 95.969 -19.556 5.821 358 HG3 LYS 45 HG3 LYS 45 95.334 -17.910 6.057 359 HD2 LYS 45 HD2 LYS 45 93.807 -18.762 4.506 360 HD3 LYS 45 HD3 LYS 45 94.997 -17.993 3.428 361 HE2 LYS 45 HE2 LYS 45 96.111 -20.135 3.055 362 HE3 LYS 45 HE3 LYS 45 95.054 -20.932 4.245 363 HZ1 LYS 45 HZ1 LYS 45 94.285 -21.285 1.994 364 HZ2 LYS 45 HZ2 LYS 45 93.179 -20.399 2.838 365 HZ3 LYS 45 HZ3 LYS 45 94.158 -19.661 1.735 366 H THR 46 H THR 46 98.958 -19.109 8.106 367 HA THR 46 HA THR 46 100.769 -21.002 6.791 368 HB THR 46 HB THR 46 99.670 -21.348 9.592 369 HG1 THR 46 HG1 THR 46 100.270 -19.337 9.911 370 HG21 THR 46 HG21 THR 46 101.237 -23.021 9.138 371 HG22 THR 46 HG22 THR 46 102.276 -21.756 9.835 372 HG23 THR 46 HG23 THR 46 102.200 -21.973 8.070 373 H VAL 47 H VAL 47 99.786 -22.456 5.430 374 HA VAL 47 HA VAL 47 97.348 -23.895 6.460 375 HB VAL 47 HB VAL 47 98.322 -24.482 3.725 376 HG11 VAL 47 HG11 VAL 47 96.128 -25.218 4.615 377 HG12 VAL 47 HG12 VAL 47 95.664 -23.519 4.872 378 HG13 VAL 47 HG13 VAL 47 95.924 -24.130 3.221 379 HG21 VAL 47 HG21 VAL 47 97.400 -22.254 2.888 380 HG22 VAL 47 HG22 VAL 47 98.975 -22.164 3.712 381 HG23 VAL 47 HG23 VAL 47 97.493 -21.677 4.569 382 H GLN 48 H GLN 48 97.282 -26.269 5.979 383 HA GLN 48 HA GLN 48 100.051 -27.480 6.172 384 HB2 GLN 48 HB2 GLN 48 98.808 -27.499 8.362 385 HB3 GLN 48 HB3 GLN 48 97.526 -28.456 7.581 386 HG2 GLN 48 HG2 GLN 48 98.907 -30.336 7.319 387 HG3 GLN 48 HG3 GLN 48 100.402 -29.374 7.410 388 HE21 GLN 48 HE21 GLN 48 100.644 -28.169 9.672 389 HE22 GLN 48 HE22 GLN 48 100.236 -29.137 11.070 390 H LEU 49 H LEU 49 100.438 -29.044 4.669 391 HA LEU 49 HA LEU 49 98.449 -29.618 2.627 392 HB2 LEU 49 HB2 LEU 49 101.052 -31.043 3.342 393 HB3 LEU 49 HB3 LEU 49 100.107 -31.337 1.863 394 HG LEU 49 HG LEU 49 100.910 -28.513 2.563 395 HD11 LEU 49 HD11 LEU 49 102.987 -29.850 2.771 396 HD12 LEU 49 HD12 LEU 49 103.025 -28.831 1.312 397 HD13 LEU 49 HD13 LEU 49 102.681 -30.572 1.173 398 HD21 LEU 49 HD21 LEU 49 99.361 -28.968 0.680 399 HD22 LEU 49 HD22 LEU 49 100.566 -30.058 -0.047 400 HD23 LEU 49 HD23 LEU 49 100.910 -28.317 0.091 401 H ARG 50 H ARG 50 100.047 -32.446 3.883 402 HA ARG 50 HA ARG 50 97.446 -33.371 5.105 403 HB2 ARG 50 HB3 ARG 50 99.174 -35.055 3.241 404 HB3 ARG 50 HB2 ARG 50 97.605 -35.502 3.950 405 HG2 ARG 50 HG2 ARG 50 96.446 -33.837 2.654 406 HG3 ARG 50 HG3 ARG 50 97.974 -33.086 2.135 407 HD2 ARG 50 HD2 ARG 50 96.805 -34.646 0.437 408 HD3 ARG 50 HD3 ARG 50 98.535 -34.940 0.740 409 HE ARG 50 HE ARG 50 97.970 -36.976 1.899 410 HH11 ARG 50 HH11 ARG 50 96.462 -38.611 2.295 411 HH12 ARG 50 HH12 ARG 50 94.758 -38.313 2.031 412 HH21 ARG 50 HH21 ARG 50 95.229 -35.028 0.981 413 HH22 ARG 50 HH22 ARG 50 94.064 -36.295 1.292 414 H ASN 51 H ASN 51 100.905 -34.172 4.565 415 HA ASN 51 HA ASN 51 101.221 -34.615 7.483 416 HB2 ASN 51 HB2 ASN 51 101.954 -36.932 5.674 417 HB3 ASN 51 HB3 ASN 51 101.729 -36.918 7.439 418 HD21 ASN 51 HD21 ASN 51 99.498 -36.857 8.278 419 HD22 ASN 51 HD22 ASN 51 98.157 -37.297 7.244 420 H GLY 52 H GLY 52 102.315 -32.853 5.369 421 HA2 GLY 52 HA2 GLY 52 105.195 -33.791 5.460 422 HA3 GLY 52 HA3 GLY 52 104.530 -32.780 4.154 423 H ASN 53 H ASN 53 104.035 -30.555 4.606 424 HA ASN 53 HA ASN 53 104.923 -29.541 7.293 425 HB2 ASN 53 HB2 ASN 53 105.924 -28.202 4.766 426 HB3 ASN 53 HB3 ASN 53 106.541 -28.054 6.429 427 HD21 ASN 53 HD21 ASN 53 106.961 -30.621 7.280 428 HD22 ASN 53 HD22 ASN 53 108.058 -31.464 6.208 429 H LEU 54 H LEU 54 104.848 -26.796 6.601 430 HA LEU 54 HA LEU 54 102.038 -26.476 5.533 431 HB2 LEU 54 HB2 LEU 54 102.009 -24.541 7.376 432 HB3 LEU 54 HB3 LEU 54 101.560 -26.212 7.795 433 HG LEU 54 HG LEU 54 103.876 -26.645 8.564 434 HD11 LEU 54 HD11 LEU 54 105.189 -24.318 8.868 435 HD12 LEU 54 HD12 LEU 54 105.354 -25.300 7.393 436 HD13 LEU 54 HD13 LEU 54 104.258 -23.898 7.410 437 HD21 LEU 54 HD21 LEU 54 103.826 -25.167 10.557 438 HD22 LEU 54 HD22 LEU 54 102.654 -24.106 9.740 439 HD23 LEU 54 HD23 LEU 54 102.198 -25.772 10.169 440 H GLN 55 H GLN 55 101.600 -24.163 4.889 441 HA GLN 55 HA GLN 55 104.151 -22.693 4.221 442 HB2 GLN 55 HB2 GLN 55 103.224 -24.113 2.273 443 HB3 GLN 55 HB3 GLN 55 101.857 -22.974 2.248 444 HG2 GLN 55 HG3 GLN 55 103.274 -21.122 1.731 445 HG3 GLN 55 HG2 GLN 55 104.745 -22.029 2.158 446 HE21 GLN 55 HE21 GLN 55 104.018 -24.517 0.785 447 HE22 GLN 55 HE22 GLN 55 104.086 -24.183 -0.930 448 H TYR 56 H TYR 56 103.968 -20.461 4.321 449 HA TYR 56 HA TYR 56 101.337 -19.456 5.395 450 HB2 TYR 56 HB2 TYR 56 103.778 -17.714 5.250 451 HB3 TYR 56 HB3 TYR 56 102.545 -17.837 6.527 452 HD1 TYR 56 HD1 TYR 56 102.921 -19.175 8.426 453 HD2 TYR 56 HD2 TYR 56 105.403 -19.687 4.961 454 HE1 TYR 56 HE1 TYR 56 104.401 -20.694 9.713 455 HE2 TYR 56 HE2 TYR 56 106.881 -21.211 6.244 456 HH TYR 56 HH TYR 56 106.924 -21.429 9.527 457 H ASP 57 H ASP 57 100.003 -18.475 3.950 458 HA ASP 57 HA ASP 57 100.993 -17.689 1.296 459 HB2 ASP 57 HB2 ASP 57 98.348 -17.122 2.711 460 HB3 ASP 57 HB3 ASP 57 98.679 -16.776 0.997 461 H LEU 58 H LEU 58 102.067 -15.841 0.881 462 HA LEU 58 HA LEU 58 101.976 -13.664 2.939 463 HB2 LEU 58 HB3 LEU 58 104.182 -14.382 2.197 464 HB3 LEU 58 HB2 LEU 58 103.727 -14.162 0.493 465 HG LEU 58 HG LEU 58 105.136 -12.299 1.619 466 HD11 LEU 58 HD11 LEU 58 104.300 -10.778 0.089 467 HD12 LEU 58 HD12 LEU 58 102.605 -11.132 0.500 468 HD13 LEU 58 HD13 LEU 58 103.527 -12.260 -0.522 469 HD21 LEU 58 HD21 LEU 58 104.091 -10.787 3.079 470 HD22 LEU 58 HD22 LEU 58 103.470 -12.355 3.646 471 HD23 LEU 58 HD23 LEU 58 102.456 -11.316 2.616 472 H HIS 59 H HIS 59 100.457 -12.106 2.677 473 HA HIS 59 HA HIS 59 99.975 -11.129 -0.146 474 HB2 HIS 59 HB3 HIS 59 97.573 -10.724 1.318 475 HB3 HIS 59 HB2 HIS 59 97.833 -11.846 -0.037 476 HD2 HIS 59 HD2 HIS 59 99.205 -14.385 1.131 477 HE1 HIS 59 HE1 HIS 59 96.730 -14.104 4.541 478 H TYR 60 H TYR 60 100.478 -8.981 -0.253 479 HA TYR 60 HA TYR 60 100.378 -7.436 2.332 480 HB2 TYR 60 HB2 TYR 60 101.453 -5.645 0.629 481 HB3 TYR 60 HB3 TYR 60 102.432 -6.869 1.467 482 HD1 TYR 60 HD1 TYR 60 101.160 -5.698 -1.738 483 HD2 TYR 60 HD2 TYR 60 103.052 -8.983 0.276 484 HE1 TYR 60 HE1 TYR 60 101.889 -6.619 -3.925 485 HE2 TYR 60 HE2 TYR 60 103.775 -9.909 -1.909 486 HH TYR 60 HH TYR 60 102.752 -9.607 -4.488 487 H TRP 61 H TRP 61 98.807 -5.947 2.684 488 HA TRP 61 HA TRP 61 96.960 -5.378 0.359 489 HB2 TRP 61 HB3 TRP 61 96.122 -6.550 2.517 490 HB3 TRP 61 HB2 TRP 61 96.311 -4.961 3.296 491 HD1 TRP 61 HD1 TRP 61 94.422 -6.649 0.385 492 HE1 TRP 61 HE1 TRP 61 92.278 -5.309 -0.119 493 HE3 TRP 61 HE3 TRP 61 95.136 -2.734 3.586 494 HZ2 TRP 61 HZ2 TRP 61 91.044 -2.859 0.768 495 HZ3 TRP 61 HZ3 TRP 61 93.461 -0.914 3.739 496 HH2 TRP 61 HH2 TRP 61 91.418 -0.971 2.334 497 H LEU 62 H LEU 62 96.914 -3.352 -0.418 498 HA LEU 62 HA LEU 62 97.736 -1.110 1.432 499 HB2 LEU 62 HB3 LEU 62 98.488 -0.537 -1.317 500 HB3 LEU 62 HB2 LEU 62 99.511 -0.558 0.138 501 HG LEU 62 HG LEU 62 98.689 -3.081 -1.357 502 HD11 LEU 62 HD11 LEU 62 100.128 -2.413 -2.978 503 HD12 LEU 62 HD12 LEU 62 100.693 -1.032 -2.008 504 HD13 LEU 62 HD13 LEU 62 101.422 -2.640 -1.777 505 HD21 LEU 62 HD21 LEU 62 101.204 -3.127 0.115 506 HD22 LEU 62 HD22 LEU 62 99.873 -2.610 1.177 507 HD23 LEU 62 HD23 LEU 62 99.769 -4.162 0.312 508 H GLY 63 H GLY 63 95.985 0.207 1.583 509 HA2 GLY 63 HA2 GLY 63 93.791 0.082 -0.335 510 HA3 GLY 63 HA3 GLY 63 93.978 1.300 0.950 511 H ASN 64 H ASN 64 96.380 0.632 -1.559 512 HA ASN 64 HA ASN 64 97.344 2.122 -3.121 513 HB2 ASN 64 HB2 ASN 64 95.296 1.576 -4.343 514 HB3 ASN 64 HB3 ASN 64 94.392 2.816 -3.442 515 HD21 ASN 64 HD21 ASN 64 97.746 3.446 -4.391 516 HD22 ASN 64 HD22 ASN 64 97.363 4.601 -5.647 517 H GLU 65 H GLU 65 96.363 3.165 -0.241 518 HA GLU 65 HA GLU 65 96.715 6.089 -0.944 519 HB2 GLU 65 HB2 GLU 65 95.406 4.672 1.406 520 HB3 GLU 65 HB3 GLU 65 95.859 6.392 1.479 521 HG2 GLU 65 HG2 GLU 65 94.478 6.852 -0.517 522 HG3 GLU 65 HG3 GLU 65 94.047 5.129 -0.628 523 H CYS 66 H CYS 66 98.511 3.493 -0.119 524 HA CYS 66 HA CYS 66 100.130 4.929 1.972 525 HB2 CYS 66 HB2 CYS 66 99.585 2.565 2.411 526 HB3 CYS 66 HB3 CYS 66 100.322 2.092 0.861 527 HG CYS 66 HG CYS 66 102.019 1.676 3.311 528 H SER 67 H SER 67 102.279 5.535 1.602 529 HA SER 67 HA SER 67 102.979 6.149 -1.157 530 HB2 SER 67 HB3 SER 67 105.322 6.527 0.014 531 HB3 SER 67 HB2 SER 67 103.960 7.611 0.388 532 HG SER 67 HG SER 67 105.198 6.571 2.223 533 H GLN 68 H GLN 68 103.900 4.841 -2.651 534 HA GLN 68 HA GLN 68 104.420 2.086 -2.257 535 HB2 GLN 68 HB2 GLN 68 104.281 3.134 -4.488 536 HB3 GLN 68 HB3 GLN 68 105.810 3.994 -4.191 537 HG2 GLN 68 HG2 GLN 68 107.068 1.964 -4.173 538 HG3 GLN 68 HG3 GLN 68 105.603 0.966 -4.022 539 HE21 GLN 68 HE21 GLN 68 106.221 3.750 -6.249 540 HE22 GLN 68 HE22 GLN 68 105.998 2.814 -7.711 541 H ASP 69 H ASP 69 106.134 4.704 -0.946 542 HA ASP 69 HA ASP 69 108.806 3.469 -0.965 543 HB2 ASP 69 HB2 ASP 69 108.077 5.988 -0.602 544 HB3 ASP 69 HB3 ASP 69 107.924 5.489 1.100 545 H GLU 70 H GLU 70 106.132 3.738 1.418 546 HA GLU 70 HA GLU 70 107.645 1.997 3.309 547 HB2 GLU 70 HB2 GLU 70 104.804 3.104 3.451 548 HB3 GLU 70 HB3 GLU 70 105.682 2.305 4.777 549 HG2 GLU 70 HG2 GLU 70 107.505 4.127 4.376 550 HG3 GLU 70 HG3 GLU 70 106.231 4.993 3.484 551 H SER 71 H SER 71 104.654 1.871 1.347 552 HA SER 71 HA SER 71 103.781 -0.731 2.059 553 HB2 SER 71 HB2 SER 71 102.725 0.991 0.430 554 HB3 SER 71 HB3 SER 71 103.774 0.264 -0.811 555 HG SER 71 HG SER 71 101.467 -0.632 -0.189 556 H GLY 72 H GLY 72 106.088 0.186 -0.550 557 HA2 GLY 72 HA2 GLY 72 106.681 -2.472 -1.416 558 HA3 GLY 72 HA3 GLY 72 107.815 -1.103 -1.522 559 H ALA 73 H ALA 73 108.393 -0.474 1.049 560 HA ALA 73 HA ALA 73 110.347 -2.314 1.865 561 HB1 ALA 73 HB1 ALA 73 110.175 -1.309 4.126 562 HB2 ALA 73 HB2 ALA 73 110.070 -0.060 2.862 563 HB3 ALA 73 HB3 ALA 73 108.596 -0.610 3.694 564 H ALA 74 H ALA 74 106.871 -2.319 2.703 565 HA ALA 74 HA ALA 74 107.085 -4.553 4.561 566 HB1 ALA 74 HB1 ALA 74 104.603 -4.060 2.912 567 HB2 ALA 74 HB2 ALA 74 104.748 -4.499 4.631 568 HB3 ALA 74 HB3 ALA 74 105.114 -2.839 4.103 569 H ALA 75 H ALA 75 106.455 -4.288 1.061 570 HA ALA 75 HA ALA 75 105.932 -7.126 0.686 571 HB1 ALA 75 HB1 ALA 75 106.349 -6.644 -1.711 572 HB2 ALA 75 HB2 ALA 75 105.299 -5.404 -0.984 573 HB3 ALA 75 HB3 ALA 75 107.020 -5.054 -1.275 574 H ILE 76 H ILE 76 108.866 -5.158 0.857 575 HA ILE 76 HA ILE 76 110.572 -7.357 -0.154 576 HB ILE 76 HB ILE 76 111.383 -4.809 1.309 577 HG12 ILE 76 HG12 ILE 76 110.559 -5.364 -1.543 578 HG13 ILE 76 HG13 ILE 76 110.205 -3.951 -0.522 579 HG21 ILE 76 HG21 ILE 76 113.008 -6.814 0.934 580 HG22 ILE 76 HG22 ILE 76 112.939 -6.354 -0.784 581 HG23 ILE 76 HG23 ILE 76 113.543 -5.195 0.424 582 HD11 ILE 76 HD11 ILE 76 111.820 -3.136 -2.048 583 HD12 ILE 76 HD12 ILE 76 112.780 -3.527 -0.601 584 HD13 ILE 76 HD13 ILE 76 112.768 -4.641 -1.989 585 H PHE 77 H PHE 77 110.025 -5.763 3.035 586 HA PHE 77 HA PHE 77 111.819 -7.523 4.472 587 HB2 PHE 77 HB2 PHE 77 109.656 -5.587 5.146 588 HB3 PHE 77 HB3 PHE 77 109.950 -6.854 6.362 589 HD1 PHE 77 HD1 PHE 77 111.258 -3.847 4.751 590 HD2 PHE 77 HD2 PHE 77 112.242 -7.139 7.329 591 HE1 PHE 77 HE1 PHE 77 113.285 -2.642 5.517 592 HE2 PHE 77 HE2 PHE 77 114.269 -5.935 8.095 593 HZ PHE 77 HZ PHE 77 114.794 -3.688 7.184 594 H THR 78 H THR 78 108.423 -7.795 3.504 595 HA THR 78 HA THR 78 108.021 -10.243 5.121 596 HB THR 78 HB THR 78 106.261 -8.454 4.349 597 HG1 THR 78 HG1 THR 78 106.009 -11.263 4.429 598 HG21 THR 78 HG21 THR 78 105.165 -8.916 2.241 599 HG22 THR 78 HG22 THR 78 106.904 -8.730 1.908 600 HG23 THR 78 HG23 THR 78 106.178 -10.354 1.968 601 H VAL 79 H VAL 79 108.380 -9.458 1.630 602 HA VAL 79 HA VAL 79 108.203 -12.193 0.726 603 HB VAL 79 HB VAL 79 109.656 -9.777 -0.430 604 HG11 VAL 79 HG11 VAL 79 110.677 -11.885 -1.245 605 HG12 VAL 79 HG12 VAL 79 109.064 -12.492 -1.691 606 HG13 VAL 79 HG13 VAL 79 109.749 -11.083 -2.536 607 HG21 VAL 79 HG21 VAL 79 107.190 -11.101 -1.559 608 HG22 VAL 79 HG22 VAL 79 107.712 -9.403 -1.670 609 HG23 VAL 79 HG23 VAL 79 107.024 -10.025 -0.151 610 H GLN 80 H GLN 80 111.036 -10.184 1.644 611 HA GLN 80 HA GLN 80 112.963 -12.304 1.123 612 HB2 GLN 80 HB3 GLN 80 113.063 -9.843 2.918 613 HB3 GLN 80 HB2 GLN 80 114.455 -10.914 2.633 614 HG2 GLN 80 HG2 GLN 80 113.900 -10.521 0.091 615 HG3 GLN 80 HG3 GLN 80 113.017 -9.096 0.689 616 HE21 GLN 80 HE21 GLN 80 114.814 -8.543 2.955 617 HE22 GLN 80 HE22 GLN 80 116.315 -7.966 2.267 618 H LEU 81 H LEU 81 111.670 -11.046 4.259 619 HA LEU 81 HA LEU 81 112.820 -13.069 5.892 620 HB2 LEU 81 HB3 LEU 81 111.461 -11.005 6.613 621 HB3 LEU 81 HB2 LEU 81 110.008 -11.981 6.300 622 HG LEU 81 HG LEU 81 110.739 -12.041 8.703 623 HD11 LEU 81 HD11 LEU 81 110.180 -14.284 8.960 624 HD12 LEU 81 HD12 LEU 81 111.218 -14.807 7.612 625 HD13 LEU 81 HD13 LEU 81 109.658 -14.018 7.280 626 HD21 LEU 81 HD21 LEU 81 112.820 -12.839 9.377 627 HD22 LEU 81 HD22 LEU 81 113.047 -13.805 7.900 628 HD23 LEU 81 HD23 LEU 81 113.266 -12.039 7.851 629 H ASP 82 H ASP 82 109.610 -13.096 4.247 630 HA ASP 82 HA ASP 82 108.721 -15.636 5.067 631 HB2 ASP 82 HB2 ASP 82 108.523 -14.191 2.408 632 HB3 ASP 82 HB3 ASP 82 107.823 -15.814 2.614 633 H ASP 83 H ASP 83 110.945 -14.914 2.316 634 HA ASP 83 HA ASP 83 111.436 -17.640 1.609 635 HB2 ASP 83 HB2 ASP 83 113.191 -15.159 1.534 636 HB3 ASP 83 HB3 ASP 83 113.792 -16.740 0.982 637 H TYR 84 H TYR 84 112.597 -15.636 4.272 638 HA TYR 84 HA TYR 84 114.659 -17.454 5.199 639 HB2 TYR 84 HB2 TYR 84 114.049 -14.981 5.929 640 HB3 TYR 84 HB3 TYR 84 112.996 -15.804 7.105 641 HD1 TYR 84 HD1 TYR 84 113.902 -16.581 9.113 642 HD2 TYR 84 HD2 TYR 84 116.516 -15.852 5.785 643 HE1 TYR 84 HE1 TYR 84 115.866 -17.047 10.554 644 HE2 TYR 84 HE2 TYR 84 118.480 -16.322 7.225 645 HH TYR 84 HH TYR 84 118.884 -17.716 9.423 646 H LEU 85 H LEU 85 111.147 -17.369 5.500 647 HA LEU 85 HA LEU 85 111.156 -19.423 7.644 648 HB2 LEU 85 HB2 LEU 85 108.808 -18.473 5.958 649 HB3 LEU 85 HB3 LEU 85 108.754 -19.255 7.556 650 HG LEU 85 HG LEU 85 109.825 -16.486 6.875 651 HD11 LEU 85 HD11 LEU 85 107.491 -16.353 7.219 652 HD12 LEU 85 HD12 LEU 85 107.513 -17.610 8.479 653 HD13 LEU 85 HD13 LEU 85 108.163 -15.989 8.827 654 HD21 LEU 85 HD21 LEU 85 110.122 -16.535 9.514 655 HD22 LEU 85 HD22 LEU 85 111.404 -17.166 8.453 656 HD23 LEU 85 HD23 LEU 85 110.276 -18.288 9.251 657 H ASN 86 H ASN 86 109.887 -19.333 4.260 658 HA ASN 86 HA ASN 86 110.399 -22.321 4.211 659 HB2 ASN 86 HB3 ASN 86 107.939 -21.429 4.203 660 HB3 ASN 86 HB2 ASN 86 108.286 -20.964 2.521 661 HD21 ASN 86 HD21 ASN 86 107.063 -23.485 4.389 662 HD22 ASN 86 HD22 ASN 86 107.378 -24.807 3.287 663 H GLY 87 H GLY 87 111.834 -19.660 3.171 664 HA2 GLY 87 HA3 GLY 87 113.057 -19.102 1.212 665 HA3 GLY 87 HA2 GLY 87 113.206 -20.863 0.995 666 H ARG 88 H ARG 88 109.946 -20.043 1.115 667 HA ARG 88 HA ARG 88 109.765 -19.399 -1.804 668 HB2 ARG 88 HB3 ARG 88 108.769 -21.956 -0.502 669 HB3 ARG 88 HB2 ARG 88 108.004 -21.306 -1.972 670 HG2 ARG 88 HG2 ARG 88 110.143 -21.375 -3.164 671 HG3 ARG 88 HG3 ARG 88 110.984 -21.897 -1.684 672 HD2 ARG 88 HD3 ARG 88 110.562 -23.860 -3.068 673 HD3 ARG 88 HD2 ARG 88 109.503 -23.939 -1.640 674 HE ARG 88 HE ARG 88 107.852 -22.690 -3.447 675 HH11 ARG 88 HH11 ARG 88 106.619 -23.761 -5.009 676 HH12 ARG 88 HH12 ARG 88 107.140 -25.314 -5.623 677 HH21 ARG 88 HH21 ARG 88 110.003 -25.422 -3.643 678 HH22 ARG 88 HH22 ARG 88 109.049 -26.251 -4.853 679 H ALA 89 H ALA 89 107.288 -20.823 0.320 680 HA ALA 89 HA ALA 89 105.271 -19.881 1.120 681 HB1 ALA 89 HB1 ALA 89 105.628 -18.060 2.431 682 HB2 ALA 89 HB2 ALA 89 106.141 -17.068 1.046 683 HB3 ALA 89 HB3 ALA 89 107.313 -18.129 1.863 684 H VAL 90 H VAL 90 103.376 -19.102 0.180 685 HA VAL 90 HA VAL 90 103.525 -18.472 -2.685 686 HB VAL 90 HB VAL 90 101.075 -18.076 -0.941 687 HG11 VAL 90 HG11 VAL 90 101.506 -19.132 -3.772 688 HG12 VAL 90 HG12 VAL 90 100.988 -17.480 -3.358 689 HG13 VAL 90 HG13 VAL 90 99.933 -18.864 -2.982 690 HG21 VAL 90 HG21 VAL 90 100.618 -20.504 -1.213 691 HG22 VAL 90 HG22 VAL 90 102.105 -20.227 -0.275 692 HG23 VAL 90 HG23 VAL 90 102.209 -20.711 -1.985 693 H GLN 91 H GLN 91 103.295 -16.483 -3.693 694 HA GLN 91 HA GLN 91 103.393 -14.108 -1.833 695 HB2 GLN 91 HB3 GLN 91 105.151 -14.647 -3.735 696 HB3 GLN 91 HB2 GLN 91 103.907 -13.960 -4.806 697 HG2 GLN 91 HG2 GLN 91 103.841 -11.920 -3.347 698 HG3 GLN 91 HG3 GLN 91 105.177 -12.601 -2.389 699 HE21 GLN 91 HE21 GLN 91 107.282 -12.221 -3.140 700 HE22 GLN 91 HE22 GLN 91 107.653 -11.573 -4.723 701 H HIS 92 H HIS 92 101.816 -12.529 -1.919 702 HA HIS 92 HA HIS 92 99.779 -12.728 -4.128 703 HB2 HIS 92 HB2 HIS 92 99.289 -12.951 -1.146 704 HB3 HIS 92 HB3 HIS 92 98.033 -12.300 -2.226 705 HD2 HIS 92 HD2 HIS 92 100.195 -15.663 -2.071 706 HE1 HIS 92 HE1 HIS 92 96.438 -16.485 -3.816 707 H ARG 93 H ARG 93 99.095 -10.734 -4.820 708 HA ARG 93 HA ARG 93 100.007 -8.370 -3.157 709 HB2 ARG 93 HB2 ARG 93 100.212 -7.139 -5.308 710 HB3 ARG 93 HB3 ARG 93 101.259 -8.578 -5.282 711 HG2 ARG 93 HG2 ARG 93 99.276 -9.813 -6.400 712 HG3 ARG 93 HG3 ARG 93 98.612 -8.192 -6.719 713 HD2 ARG 93 HD2 ARG 93 99.872 -8.726 -8.670 714 HD3 ARG 93 HD3 ARG 93 100.926 -7.639 -7.734 715 HE ARG 93 HE ARG 93 102.390 -9.489 -7.265 716 HH11 ARG 93 HH11 ARG 93 103.079 -11.586 -7.749 717 HH12 ARG 93 HH12 ARG 93 102.008 -12.688 -8.585 718 HH21 ARG 93 HH21 ARG 93 99.402 -10.389 -8.814 719 HH22 ARG 93 HH22 ARG 93 99.935 -12.013 -9.185 720 H GLU 94 H GLU 94 98.430 -6.999 -2.509 721 HA GLU 94 HA GLU 94 95.806 -7.100 -4.013 722 HB2 GLU 94 HB3 GLU 94 96.163 -6.880 -0.991 723 HB3 GLU 94 HB2 GLU 94 94.617 -6.909 -1.871 724 HG2 GLU 94 HG2 GLU 94 95.459 -9.174 -2.846 725 HG3 GLU 94 HG3 GLU 94 96.638 -9.142 -1.513 726 H VAL 95 H VAL 95 96.684 -5.181 -5.112 727 HA VAL 95 HA VAL 95 97.271 -2.778 -3.492 728 HB VAL 95 HB VAL 95 96.667 -2.933 -6.475 729 HG11 VAL 95 HG11 VAL 95 96.755 -0.666 -5.470 730 HG12 VAL 95 HG12 VAL 95 98.146 -0.944 -6.544 731 HG13 VAL 95 HG13 VAL 95 98.353 -1.035 -4.778 732 HG21 VAL 95 HG21 VAL 95 99.111 -3.236 -6.773 733 HG22 VAL 95 HG22 VAL 95 99.313 -3.330 -5.007 734 HG23 VAL 95 HG23 VAL 95 98.403 -4.595 -5.867 735 H GLN 96 H GLN 96 94.691 -3.940 -2.927 736 HA GLN 96 HA GLN 96 92.477 -3.180 -2.608 737 HB2 GLN 96 HB3 GLN 96 93.955 -0.962 -2.317 738 HB3 GLN 96 HB2 GLN 96 93.119 -0.504 -3.820 739 HG2 GLN 96 HG2 GLN 96 90.965 -1.340 -2.533 740 HG3 GLN 96 HG3 GLN 96 91.965 -1.068 -1.086 741 HE21 GLN 96 HE21 GLN 96 90.669 0.796 -0.416 742 HE22 GLN 96 HE22 GLN 96 90.762 2.310 -1.287 743 H GLY 97 H GLY 97 92.167 -4.725 -4.520 744 HA2 GLY 97 HA2 GLY 97 90.199 -4.018 -6.263 745 HA3 GLY 97 HA3 GLY 97 91.610 -3.334 -7.105 746 H PHE 98 H PHE 98 93.567 -5.055 -7.047 747 HA PHE 98 HA PHE 98 92.433 -7.452 -8.418 748 HB2 PHE 98 HB2 PHE 98 94.525 -5.950 -9.102 749 HB3 PHE 98 HB3 PHE 98 95.387 -7.030 -7.980 750 HD1 PHE 98 HD1 PHE 98 93.305 -6.909 -11.062 751 HD2 PHE 98 HD2 PHE 98 95.800 -9.325 -8.535 752 HE1 PHE 98 HE1 PHE 98 93.362 -8.674 -12.805 753 HE2 PHE 98 HE2 PHE 98 95.855 -11.091 -10.276 754 HZ PHE 98 HZ PHE 98 94.638 -10.766 -12.411 755 H GLU 99 H GLU 99 91.631 -7.793 -5.929 756 HA GLU 99 HA GLU 99 93.677 -9.059 -4.220 757 HB2 GLU 99 HB2 GLU 99 90.665 -9.385 -3.973 758 HB3 GLU 99 HB3 GLU 99 91.891 -9.456 -2.685 759 HG2 GLU 99 HG2 GLU 99 91.050 -7.295 -2.388 760 HG3 GLU 99 HG3 GLU 99 92.422 -6.981 -3.478 761 H SER 100 H SER 100 92.383 -11.367 -3.312 762 HA SER 100 HA SER 100 92.157 -13.065 -5.802 763 HB2 SER 100 HB3 SER 100 93.575 -14.781 -4.759 764 HB3 SER 100 HB2 SER 100 94.468 -13.245 -4.859 765 HG SER 100 HG SER 100 94.624 -14.229 -2.765 766 H ALA 101 H ALA 101 91.056 -15.151 -5.374 767 HA ALA 101 HA ALA 101 88.675 -14.797 -3.800 768 HB1 ALA 101 HB1 ALA 101 88.309 -17.220 -4.177 769 HB2 ALA 101 HB2 ALA 101 89.995 -17.390 -4.720 770 HB3 ALA 101 HB3 ALA 101 88.848 -16.414 -5.669 771 H THR 102 H THR 102 91.797 -16.340 -3.049 772 HA THR 102 HA THR 102 90.988 -17.540 -0.555 773 HB THR 102 HB THR 102 93.703 -16.370 -1.313 774 HG1 THR 102 HG1 THR 102 94.086 -18.561 -1.964 775 HG21 THR 102 HG21 THR 102 94.562 -18.006 0.341 776 HG22 THR 102 HG22 THR 102 92.893 -18.497 0.721 777 HG23 THR 102 HG23 THR 102 93.447 -16.849 1.106 778 H PHE 103 H PHE 103 92.788 -14.465 -1.064 779 HA PHE 103 HA PHE 103 92.611 -13.530 1.613 780 HB2 PHE 103 HB2 PHE 103 93.978 -12.311 0.066 781 HB3 PHE 103 HB3 PHE 103 92.611 -12.042 -1.042 782 HD1 PHE 103 HD1 PHE 103 94.049 -11.137 2.266 783 HD2 PHE 103 HD2 PHE 103 91.024 -10.278 -0.659 784 HE1 PHE 103 HE1 PHE 103 93.503 -9.028 3.450 785 HE2 PHE 103 HE2 PHE 103 90.477 -8.170 0.526 786 HZ PHE 103 HZ PHE 103 91.716 -7.544 2.581 787 H LEU 104 H LEU 104 90.213 -13.324 -1.027 788 HA LEU 104 HA LEU 104 88.375 -11.640 0.514 789 HB2 LEU 104 HB2 LEU 104 87.950 -13.461 -1.895 790 HB3 LEU 104 HB3 LEU 104 86.704 -12.378 -1.230 791 HG LEU 104 HG LEU 104 89.455 -11.468 -2.185 792 HD11 LEU 104 HD11 LEU 104 88.225 -10.536 -4.127 793 HD12 LEU 104 HD12 LEU 104 86.718 -11.263 -3.522 794 HD13 LEU 104 HD13 LEU 104 88.059 -12.306 -4.055 795 HD21 LEU 104 HD21 LEU 104 88.415 -10.037 -0.442 796 HD22 LEU 104 HD22 LEU 104 86.927 -9.937 -1.413 797 HD23 LEU 104 HD23 LEU 104 88.435 -9.211 -2.019 798 H GLY 105 H GLY 105 88.923 -15.122 0.177 799 HA2 GLY 105 HA2 GLY 105 86.429 -15.979 1.374 800 HA3 GLY 105 HA3 GLY 105 87.934 -16.929 1.337 801 H TYR 106 H TYR 106 89.582 -15.027 2.751 802 HA TYR 106 HA TYR 106 88.771 -15.737 5.491 803 HB2 TYR 106 HB3 TYR 106 91.178 -15.124 4.221 804 HB3 TYR 106 HB2 TYR 106 90.878 -13.688 5.228 805 HD1 TYR 106 HD1 TYR 106 90.515 -13.953 7.694 806 HD2 TYR 106 HD2 TYR 106 91.720 -17.241 5.204 807 HE1 TYR 106 HE1 TYR 106 91.222 -15.220 9.707 808 HE2 TYR 106 HE2 TYR 106 92.421 -18.509 7.218 809 HH TYR 106 HH TYR 106 91.557 -18.258 9.968 810 H PHE 107 H PHE 107 89.227 -12.611 3.748 811 HA PHE 107 HA PHE 107 87.522 -11.341 5.896 812 HB2 PHE 107 HB2 PHE 107 89.194 -9.913 3.793 813 HB3 PHE 107 HB3 PHE 107 88.538 -9.250 5.309 814 HD1 PHE 107 HD1 PHE 107 91.345 -10.864 3.751 815 HD2 PHE 107 HD2 PHE 107 89.354 -10.318 7.518 816 HE1 PHE 107 HE1 PHE 107 93.412 -11.542 4.942 817 HE2 PHE 107 HE2 PHE 107 91.421 -10.996 8.709 818 HZ PHE 107 HZ PHE 107 93.451 -11.605 7.421 819 H LYS 108 H LYS 108 85.571 -12.254 4.857 820 HA LYS 108 HA LYS 108 84.936 -11.065 2.173 821 HB2 LYS 108 HB3 LYS 108 84.472 -13.491 2.609 822 HB3 LYS 108 HB2 LYS 108 83.332 -13.013 3.888 823 HG2 LYS 108 HG2 LYS 108 82.087 -11.649 2.151 824 HG3 LYS 108 HG3 LYS 108 83.143 -12.372 0.914 825 HD2 LYS 108 HD2 LYS 108 81.337 -13.849 0.867 826 HD3 LYS 108 HD3 LYS 108 82.390 -14.648 2.058 827 HE2 LYS 108 HE3 LYS 108 81.142 -13.631 3.904 828 HE3 LYS 108 HE2 LYS 108 80.148 -12.700 2.757 829 HZ1 LYS 108 HZ1 LYS 108 79.026 -14.697 3.490 830 HZ2 LYS 108 HZ2 LYS 108 79.335 -14.783 1.873 831 HZ3 LYS 108 HZ3 LYS 108 80.256 -15.646 2.934 832 H SER 109 H SER 109 83.862 -11.045 5.570 833 HA SER 109 HA SER 109 81.862 -8.908 4.845 834 HB2 SER 109 HB2 SER 109 82.189 -10.823 7.157 835 HB3 SER 109 HB3 SER 109 81.285 -9.308 7.396 836 HG SER 109 HG SER 109 79.932 -11.047 6.671 837 H GLY 110 H GLY 110 85.021 -8.937 5.454 838 HA2 GLY 110 HA2 GLY 110 85.029 -6.898 7.640 839 HA3 GLY 110 HA3 GLY 110 86.463 -7.594 6.847 840 H LEU 111 H LEU 111 87.449 -6.392 5.286 841 HA LEU 111 HA LEU 111 87.861 -4.501 3.941 842 HB2 LEU 111 HB2 LEU 111 84.976 -5.177 3.301 843 HB3 LEU 111 HB3 LEU 111 85.845 -3.860 2.477 844 HG LEU 111 HG LEU 111 85.941 -6.068 1.255 845 HD11 LEU 111 HD11 LEU 111 87.691 -4.336 0.942 846 HD12 LEU 111 HD12 LEU 111 88.385 -5.972 0.841 847 HD13 LEU 111 HD13 LEU 111 88.598 -5.004 2.319 848 HD21 LEU 111 HD21 LEU 111 87.117 -7.922 2.166 849 HD22 LEU 111 HD22 LEU 111 86.095 -7.348 3.505 850 HD23 LEU 111 HD23 LEU 111 87.827 -6.939 3.469 851 H LYS 112 H LYS 112 88.271 -2.855 5.324 852 HA LYS 112 HA LYS 112 86.026 -0.930 5.769 853 HB2 LYS 112 HB2 LYS 112 86.783 -2.693 7.817 854 HB3 LYS 112 HB3 LYS 112 87.668 -1.195 8.192 855 HG2 LYS 112 HG2 LYS 112 85.531 0.088 7.963 856 HG3 LYS 112 HG3 LYS 112 84.668 -1.444 7.683 857 HD2 LYS 112 HD2 LYS 112 85.677 -2.230 9.925 858 HD3 LYS 112 HD3 LYS 112 86.103 -0.523 10.200 859 HE2 LYS 112 HE2 LYS 112 83.555 -0.127 9.527 860 HE3 LYS 112 HE3 LYS 112 83.386 -1.821 10.048 861 HZ1 LYS 112 HZ1 LYS 112 83.050 -0.291 11.874 862 HZ2 LYS 112 HZ2 LYS 112 84.394 -1.208 12.144 863 HZ3 LYS 112 HZ3 LYS 112 84.550 0.361 11.662 864 H TYR 113 H TYR 113 86.847 0.899 4.900 865 HA TYR 113 HA TYR 113 89.782 1.312 4.801 866 HB2 TYR 113 HB3 TYR 113 87.894 3.527 4.101 867 HB3 TYR 113 HB2 TYR 113 89.321 2.926 3.222 868 HD1 TYR 113 HD1 TYR 113 86.009 3.335 2.738 869 HD2 TYR 113 HD2 TYR 113 88.856 0.121 2.827 870 HE1 TYR 113 HE1 TYR 113 84.535 1.989 1.269 871 HE2 TYR 113 HE2 TYR 113 87.381 -1.227 1.358 872 HH TYR 113 HH TYR 113 85.508 -0.669 -0.412 873 H LYS 114 H LYS 114 90.794 1.995 6.623 874 HA LYS 114 HA LYS 114 89.309 3.934 8.401 875 HB2 LYS 114 HB3 LYS 114 91.679 2.083 8.889 876 HB3 LYS 114 HB2 LYS 114 91.159 3.326 10.052 877 HG2 LYS 114 HG3 LYS 114 88.901 1.713 9.095 878 HG3 LYS 114 HG2 LYS 114 90.157 0.709 9.857 879 HD2 LYS 114 HD2 LYS 114 88.603 1.442 11.585 880 HD3 LYS 114 HD3 LYS 114 90.146 2.297 11.817 881 HE2 LYS 114 HE2 LYS 114 89.291 4.319 10.902 882 HE3 LYS 114 HE3 LYS 114 87.894 3.494 10.170 883 HZ1 LYS 114 HZ1 LYS 114 87.284 4.664 12.181 884 HZ2 LYS 114 HZ2 LYS 114 87.084 3.040 12.388 885 HZ3 LYS 114 HZ3 LYS 114 88.379 3.805 13.066 886 H LYS 115 H LYS 115 89.814 6.023 7.942 887 HA LYS 115 HA LYS 115 92.025 6.893 6.371 888 HB2 LYS 115 HB2 LYS 115 90.223 8.199 8.400 889 HB3 LYS 115 HB3 LYS 115 91.664 9.088 7.851 890 HG2 LYS 115 HG2 LYS 115 89.750 9.645 6.415 891 HG3 LYS 115 HG3 LYS 115 90.950 8.719 5.482 892 HD2 LYS 115 HD2 LYS 115 89.651 6.650 5.840 893 HD3 LYS 115 HD3 LYS 115 88.464 7.551 6.812 894 HE2 LYS 115 HE2 LYS 115 89.131 8.371 3.967 895 HE3 LYS 115 HE3 LYS 115 87.897 7.136 4.313 896 HZ1 LYS 115 HZ1 LYS 115 86.939 9.338 4.178 897 HZ2 LYS 115 HZ2 LYS 115 87.919 9.887 5.386 898 HZ3 LYS 115 HZ3 LYS 115 86.775 8.743 5.707 899 H GLY 116 H GLY 116 94.175 6.951 6.769 900 HA2 GLY 116 HA3 GLY 116 95.059 6.544 9.622 901 HA3 GLY 116 HA2 GLY 116 96.046 6.214 8.178 902 H GLY 117 H GLY 117 97.695 7.645 8.028 903 HA2 GLY 117 HA2 GLY 117 98.740 9.771 7.850 904 HA3 GLY 117 HA3 GLY 117 97.139 10.533 8.004 905 H VAL 118 H VAL 118 98.286 8.188 10.369 906 HA VAL 118 HA VAL 118 98.111 10.321 12.449 907 HB VAL 118 HB VAL 118 98.934 7.478 13.030 908 HG11 VAL 118 HG11 VAL 118 98.739 9.153 14.850 909 HG12 VAL 118 HG12 VAL 118 97.501 7.884 15.013 910 HG13 VAL 118 HG13 VAL 118 97.058 9.482 14.365 911 HG21 VAL 118 HG21 VAL 118 96.367 7.038 13.116 912 HG22 VAL 118 HG22 VAL 118 96.238 8.437 12.023 913 HG23 VAL 118 HG23 VAL 118 97.166 7.002 11.526 914 H ALA 119 H ALA 119 100.520 8.649 10.586 915 HA ALA 119 HA ALA 119 102.723 8.874 12.467 916 HB1 ALA 119 HB1 ALA 119 104.160 8.607 10.464 917 HB2 ALA 119 HB2 ALA 119 102.751 8.894 9.415 918 HB3 ALA 119 HB3 ALA 119 102.814 7.443 10.444 919 H SER 120 H SER 120 101.090 11.165 10.382 920 HA SER 120 HA SER 120 103.293 13.164 10.889 921 HB2 SER 120 HB2 SER 120 102.316 12.693 8.518 922 HB3 SER 120 HB3 SER 120 100.905 13.621 9.082 923 HG SER 120 HG SER 120 102.509 14.962 8.076 924 H GLY 121 H GLY 121 100.689 12.079 12.406 925 HA2 GLY 121 HA2 GLY 121 99.266 14.607 12.948 926 HA3 GLY 121 HA3 GLY 121 99.022 13.059 13.791 927 H PHE 122 H PHE 122 102.035 12.902 14.250 928 HA PHE 122 HA PHE 122 102.069 13.976 16.906 929 HB2 PHE 122 HB3 PHE 122 104.216 13.113 14.957 930 HB3 PHE 122 HB2 PHE 122 104.667 13.851 16.512 931 HD1 PHE 122 HD1 PHE 122 104.055 12.761 18.642 932 HD2 PHE 122 HD2 PHE 122 103.179 10.923 14.859 933 HE1 PHE 122 HE1 PHE 122 103.647 10.600 19.787 934 HE2 PHE 122 HE2 PHE 122 102.771 8.762 16.005 935 HZ PHE 122 HZ PHE 122 103.006 8.600 18.469 936 H LYS 123 H LYS 123 102.515 15.531 13.829 937 HA LYS 123 HA LYS 123 104.163 17.750 14.666 938 HB2 LYS 123 HB3 LYS 123 101.963 17.592 12.559 939 HB3 LYS 123 HB2 LYS 123 103.107 18.945 12.726 940 HG2 LYS 123 HG2 LYS 123 104.925 17.017 12.636 941 HG3 LYS 123 HG3 LYS 123 103.618 16.104 11.844 942 HD2 LYS 123 HD2 LYS 123 104.605 17.128 9.996 943 HD3 LYS 123 HD3 LYS 123 103.370 18.339 10.417 944 HE2 LYS 123 HE3 LYS 123 105.569 19.415 10.046 945 HE3 LYS 123 HE2 LYS 123 105.057 19.591 11.742 946 HZ1 LYS 123 HZ1 LYS 123 107.350 18.888 11.573 947 HZ2 LYS 123 HZ2 LYS 123 106.922 17.545 10.717 948 HZ3 LYS 123 HZ3 LYS 123 106.447 17.707 12.288 949 H HIS 124 H HIS 124 101.354 16.799 16.045 950 HA HIS 124 HA HIS 124 100.015 17.968 17.627 951 HB2 HIS 124 HB2 HIS 124 102.181 19.570 17.542 952 HB3 HIS 124 HB3 HIS 124 101.016 20.659 16.753 953 HD2 HIS 124 HD2 HIS 124 100.348 18.284 19.902 954 HE1 HIS 124 HE1 HIS 124 99.327 22.256 20.908 955 HE2 HIS 124 HE2 HIS 124 99.352 19.849 21.760 956 H VAL 125 H VAL 125 97.947 17.853 16.894 957 HA VAL 125 HA VAL 125 97.126 19.894 14.826 958 HB VAL 125 HB VAL 125 96.034 17.059 14.855 959 HG11 VAL 125 HG11 VAL 125 94.715 18.821 13.711 960 HG12 VAL 125 HG12 VAL 125 96.144 19.264 12.748 961 HG13 VAL 125 HG13 VAL 125 95.391 17.665 12.538 962 HG21 VAL 125 HG21 VAL 125 97.604 16.906 12.738 963 HG22 VAL 125 HG22 VAL 125 98.532 18.178 13.567 964 HG23 VAL 125 HG23 VAL 125 98.283 16.602 14.355 965 H VAL 126 H VAL 126 95.422 21.066 15.554 966 HA VAL 126 HA VAL 126 93.643 19.765 17.631 967 HB VAL 126 HB VAL 126 94.598 22.661 17.503 968 HG11 VAL 126 HG11 VAL 126 92.248 22.457 18.273 969 HG12 VAL 126 HG12 VAL 126 93.324 22.917 19.615 970 HG13 VAL 126 HG13 VAL 126 92.748 21.239 19.471 971 HG21 VAL 126 HG21 VAL 126 96.292 21.062 18.353 972 HG22 VAL 126 HG22 VAL 126 95.106 20.425 19.517 973 HG23 VAL 126 HG23 VAL 126 95.682 22.103 19.661 974 HA PRO 127 HA PRO 127 91.184 20.877 13.823 975 HB2 PRO 127 HB2 PRO 127 89.402 18.931 15.271 976 HB3 PRO 127 HB3 PRO 127 89.826 19.017 13.537 977 HG2 PRO 127 HG3 PRO 127 90.891 17.178 15.181 978 HG3 PRO 127 HG2 PRO 127 91.809 17.891 13.826 979 HD2 PRO 127 HD2 PRO 127 92.072 18.383 16.778 980 HD3 PRO 127 HD3 PRO 127 93.305 18.495 15.486 981 H ASN 128 H ASN 128 88.919 21.764 13.703 982 HA ASN 128 HA ASN 128 88.473 23.611 15.945 983 HB2 ASN 128 HB3 ASN 128 87.937 23.804 13.324 984 HB3 ASN 128 HB2 ASN 128 86.372 23.134 13.846 985 HD21 ASN 128 HD21 ASN 128 86.329 25.731 12.857 986 HD22 ASN 128 HD22 ASN 128 86.114 26.867 14.170 987 H GLU 129 H GLU 129 85.825 23.768 16.417 988 HA GLU 129 HA GLU 129 85.355 21.359 18.053 989 HB2 GLU 129 HB2 GLU 129 83.111 23.270 17.654 990 HB3 GLU 129 HB3 GLU 129 83.834 22.660 19.162 991 HG2 GLU 129 HG3 GLU 129 84.477 24.917 19.198 992 HG3 GLU 129 HG2 GLU 129 85.895 24.146 18.447 993 H VAL 130 H VAL 130 84.260 22.613 14.945 994 HA VAL 130 HA VAL 130 81.860 21.204 14.536 995 HB VAL 130 HB VAL 130 84.198 21.659 12.637 996 HG11 VAL 130 HG11 VAL 130 82.596 21.135 10.818 997 HG12 VAL 130 HG12 VAL 130 81.366 20.699 12.028 998 HG13 VAL 130 HG13 VAL 130 82.847 19.725 11.874 999 HG21 VAL 130 HG21 VAL 130 82.710 23.444 11.770 1000 HG22 VAL 130 HG22 VAL 130 81.480 23.005 12.979 1001 HG23 VAL 130 HG23 VAL 130 83.043 23.675 13.503 1002 H VAL 131 H VAL 131 85.154 19.919 14.697 1003 HA VAL 131 HA VAL 131 84.368 17.267 13.679 1004 HB VAL 131 HB VAL 131 86.825 18.321 15.132 1005 HG11 VAL 131 HG11 VAL 131 86.446 15.952 15.758 1006 HG12 VAL 131 HG12 VAL 131 86.293 15.523 14.037 1007 HG13 VAL 131 HG13 VAL 131 87.848 16.111 14.673 1008 HG21 VAL 131 HG21 VAL 131 86.509 19.015 12.772 1009 HG22 VAL 131 HG22 VAL 131 87.885 17.898 12.931 1010 HG23 VAL 131 HG23 VAL 131 86.330 17.310 12.295 1011 H VAL 132 H VAL 132 85.298 18.517 16.934 1012 HA VAL 132 HA VAL 132 84.578 16.063 18.299 1013 HB VAL 132 HB VAL 132 84.583 18.912 19.391 1014 HG11 VAL 132 HG11 VAL 132 83.484 17.238 20.856 1015 HG12 VAL 132 HG12 VAL 132 84.919 16.192 20.736 1016 HG13 VAL 132 HG13 VAL 132 85.035 17.772 21.547 1017 HG21 VAL 132 HG21 VAL 132 86.922 18.408 20.039 1018 HG22 VAL 132 HG22 VAL 132 86.716 18.328 18.273 1019 HG23 VAL 132 HG23 VAL 132 86.806 16.828 19.228 1020 H GLN 133 H GLN 133 82.715 18.849 17.202 1021 HA GLN 133 HA GLN 133 80.213 17.386 17.619 1022 HB2 GLN 133 HB2 GLN 133 79.239 19.075 19.239 1023 HB3 GLN 133 HB3 GLN 133 80.490 18.023 19.942 1024 HG2 GLN 133 HG2 GLN 133 82.147 19.747 19.825 1025 HG3 GLN 133 HG3 GLN 133 81.136 20.748 18.755 1026 HE21 GLN 133 HE21 GLN 133 79.803 22.284 19.751 1027 HE22 GLN 133 HE22 GLN 133 79.468 22.325 21.467 Start of MODEL 4 1 H1 GLU 1 H1 GLU 1 111.187 -9.233 23.268 2 H2 GLU 1 H2 GLU 1 112.495 -10.163 22.889 3 H3 GLU 1 H3 GLU 1 112.696 -8.766 23.742 4 HA GLU 1 HA GLU 1 112.364 -7.394 21.948 5 HB2 GLU 1 HB2 GLU 1 113.487 -9.842 20.552 6 HB3 GLU 1 HB3 GLU 1 113.931 -8.133 20.332 7 HG2 GLU 1 HG2 GLU 1 114.688 -8.199 22.808 8 HG3 GLU 1 HG3 GLU 1 114.588 -9.971 22.661 9 H HIS 2 H HIS 2 110.046 -9.451 22.337 10 HA HIS 2 HA HIS 2 108.181 -10.174 21.063 11 HB2 HIS 2 HB2 HIS 2 108.866 -7.803 19.282 12 HB3 HIS 2 HB3 HIS 2 107.261 -8.502 19.604 13 HD2 HIS 2 HD2 HIS 2 108.679 -5.357 20.597 14 HE1 HIS 2 HE1 HIS 2 107.253 -6.798 24.302 15 HE2 HIS 2 HE2 HIS 2 108.064 -4.714 23.066 16 HA PRO 3 HA PRO 3 111.013 -11.891 17.724 17 HB2 PRO 3 HB3 PRO 3 111.019 -14.493 18.638 18 HB3 PRO 3 HB2 PRO 3 112.211 -13.269 19.161 19 HG2 PRO 3 HG2 PRO 3 109.774 -14.299 20.557 20 HG3 PRO 3 HG3 PRO 3 111.364 -13.838 21.223 21 HD2 PRO 3 HD3 PRO 3 109.100 -12.232 21.338 22 HD3 PRO 3 HD2 PRO 3 110.775 -11.604 21.406 23 H GLU 4 H GLU 4 107.962 -11.580 18.123 24 HA GLU 4 HA GLU 4 106.790 -14.060 17.095 25 HB2 GLU 4 HB2 GLU 4 105.653 -12.035 18.323 26 HB3 GLU 4 HB3 GLU 4 105.563 -11.322 16.695 27 HG2 GLU 4 HG2 GLU 4 103.530 -12.486 16.822 28 HG3 GLU 4 HG3 GLU 4 104.582 -13.678 16.021 29 H PHE 5 H PHE 5 107.897 -10.995 15.614 30 HA PHE 5 HA PHE 5 107.008 -11.680 12.932 31 HB2 PHE 5 HB2 PHE 5 108.371 -9.837 12.200 32 HB3 PHE 5 HB3 PHE 5 107.716 -9.376 13.789 33 HD1 PHE 5 HD1 PHE 5 109.150 -9.183 15.727 34 HD2 PHE 5 HD2 PHE 5 110.728 -10.562 11.978 35 HE1 PHE 5 HE1 PHE 5 111.456 -8.905 16.596 36 HE2 PHE 5 HE2 PHE 5 113.035 -10.286 12.846 37 HZ PHE 5 HZ PHE 5 113.398 -9.457 15.156 38 H LEU 6 H LEU 6 109.823 -12.548 14.858 39 HA LEU 6 HA LEU 6 111.476 -13.426 12.620 40 HB2 LEU 6 HB2 LEU 6 111.968 -13.041 15.246 41 HB3 LEU 6 HB3 LEU 6 111.685 -14.797 15.279 42 HG LEU 6 HG LEU 6 113.691 -13.309 13.526 43 HD11 LEU 6 HD11 LEU 6 114.368 -13.583 15.896 44 HD12 LEU 6 HD12 LEU 6 115.348 -14.614 14.826 45 HD13 LEU 6 HD13 LEU 6 114.032 -15.328 15.789 46 HD21 LEU 6 HD21 LEU 6 114.358 -15.797 13.043 47 HD22 LEU 6 HD22 LEU 6 112.967 -15.104 12.176 48 HD23 LEU 6 HD23 LEU 6 112.701 -16.173 13.575 49 H LYS 7 H LYS 7 108.958 -14.955 14.601 50 HA LYS 7 HA LYS 7 109.413 -17.544 13.145 51 HB2 LYS 7 HB2 LYS 7 107.868 -16.702 15.601 52 HB3 LYS 7 HB3 LYS 7 107.410 -18.194 14.746 53 HG2 LYS 7 HG3 LYS 7 109.074 -18.601 16.576 54 HG3 LYS 7 HG2 LYS 7 109.690 -19.067 14.972 55 HD2 LYS 7 HD2 LYS 7 111.021 -17.075 14.803 56 HD3 LYS 7 HD3 LYS 7 110.210 -16.332 16.203 57 HE2 LYS 7 HE3 LYS 7 111.677 -18.964 16.500 58 HE3 LYS 7 HE2 LYS 7 112.570 -17.424 16.542 59 HZ1 LYS 7 HZ1 LYS 7 111.870 -18.107 18.739 60 HZ2 LYS 7 HZ2 LYS 7 110.287 -18.129 18.277 61 HZ3 LYS 7 HZ3 LYS 7 111.115 -16.703 18.315 62 H ALA 8 H ALA 8 106.598 -15.468 14.005 63 HA ALA 8 HA ALA 8 104.631 -15.034 12.773 64 HB1 ALA 8 HB1 ALA 8 106.739 -15.398 10.649 65 HB2 ALA 8 HB2 ALA 8 105.768 -13.961 11.046 66 HB3 ALA 8 HB3 ALA 8 105.033 -15.311 10.149 67 H GLY 9 H GLY 9 102.822 -16.244 12.313 68 HA2 GLY 9 HA2 GLY 9 101.591 -18.273 12.177 69 HA3 GLY 9 HA3 GLY 9 102.601 -18.556 10.739 70 H LYS 10 H LYS 10 103.482 -18.412 14.220 71 HA LYS 10 HA LYS 10 105.416 -20.425 14.221 72 HB2 LYS 10 HB2 LYS 10 103.327 -20.361 16.418 73 HB3 LYS 10 HB3 LYS 10 105.080 -20.632 16.553 74 HG2 LYS 10 HG2 LYS 10 105.298 -18.212 15.590 75 HG3 LYS 10 HG3 LYS 10 103.590 -18.039 16.060 76 HD2 LYS 10 HD2 LYS 10 105.797 -18.965 17.949 77 HD3 LYS 10 HD3 LYS 10 105.217 -17.286 17.840 78 HE2 LYS 10 HE3 LYS 10 102.856 -18.261 18.242 79 HE3 LYS 10 HE2 LYS 10 103.690 -19.756 18.732 80 HZ1 LYS 10 HZ1 LYS 10 103.272 -18.314 20.610 81 HZ2 LYS 10 HZ2 LYS 10 104.896 -18.471 20.366 82 HZ3 LYS 10 HZ3 LYS 10 104.124 -17.086 19.913 83 H GLU 11 H GLU 11 101.894 -20.827 14.098 84 HA GLU 11 HA GLU 11 102.379 -23.716 13.410 85 HB2 GLU 11 HB2 GLU 11 99.932 -23.501 14.937 86 HB3 GLU 11 HB3 GLU 11 101.369 -24.494 15.277 87 HG2 GLU 11 HG3 GLU 11 100.980 -22.986 17.162 88 HG3 GLU 11 HG2 GLU 11 102.456 -22.474 16.308 89 HA PRO 12 HA PRO 12 99.405 -23.451 10.187 90 HB2 PRO 12 HB3 PRO 12 97.476 -25.097 11.818 91 HB3 PRO 12 HB2 PRO 12 98.029 -25.339 10.136 92 HG2 PRO 12 HG2 PRO 12 98.962 -26.813 12.189 93 HG3 PRO 12 HG3 PRO 12 99.977 -26.368 10.791 94 HD2 PRO 12 HD3 PRO 12 100.064 -25.350 13.597 95 HD3 PRO 12 HD2 PRO 12 101.361 -25.398 12.367 96 H GLY 13 H GLY 13 97.953 -21.868 9.634 97 HA2 GLY 13 HA3 GLY 13 95.534 -21.105 10.513 98 HA3 GLY 13 HA2 GLY 13 96.496 -20.527 11.894 99 H LEU 14 H LEU 14 95.495 -18.412 11.078 100 HA LEU 14 HA LEU 14 97.317 -17.258 8.948 101 HB2 LEU 14 HB2 LEU 14 95.045 -17.390 8.065 102 HB3 LEU 14 HB3 LEU 14 94.388 -16.637 9.537 103 HG LEU 14 HG LEU 14 96.540 -15.073 8.219 104 HD11 LEU 14 HD11 LEU 14 95.397 -15.998 6.221 105 HD12 LEU 14 HD12 LEU 14 93.830 -15.454 6.867 106 HD13 LEU 14 HD13 LEU 14 95.065 -14.259 6.402 107 HD21 LEU 14 HD21 LEU 14 95.173 -14.248 10.120 108 HD22 LEU 14 HD22 LEU 14 93.699 -14.434 9.139 109 HD23 LEU 14 HD23 LEU 14 94.934 -13.239 8.673 110 H GLN 15 H GLN 15 98.203 -15.219 9.399 111 HA GLN 15 HA GLN 15 97.486 -14.059 12.101 112 HB2 GLN 15 HB2 GLN 15 100.313 -14.155 10.985 113 HB3 GLN 15 HB3 GLN 15 99.799 -13.738 12.637 114 HG2 GLN 15 HG2 GLN 15 100.496 -15.953 12.918 115 HG3 GLN 15 HG3 GLN 15 98.757 -16.171 12.607 116 HE21 GLN 15 HE21 GLN 15 101.926 -16.026 10.841 117 HE22 GLN 15 HE22 GLN 15 101.452 -17.180 9.614 118 H ILE 16 H ILE 16 97.694 -11.767 12.239 119 HA ILE 16 HA ILE 16 98.152 -10.417 9.566 120 HB ILE 16 HB ILE 16 96.267 -9.286 11.639 121 HG12 ILE 16 HG12 ILE 16 94.538 -10.554 9.973 122 HG13 ILE 16 HG13 ILE 16 95.876 -11.728 9.945 123 HG21 ILE 16 HG21 ILE 16 95.210 -8.353 9.598 124 HG22 ILE 16 HG22 ILE 16 96.379 -9.237 8.589 125 HG23 ILE 16 HG23 ILE 16 96.939 -7.938 9.669 126 HD11 ILE 16 HD11 ILE 16 94.275 -12.245 11.768 127 HD12 ILE 16 HD12 ILE 16 95.867 -11.795 12.424 128 HD13 ILE 16 HD13 ILE 16 94.530 -10.621 12.452 129 H TRP 17 H TRP 17 99.581 -8.739 9.603 130 HA TRP 17 HA TRP 17 100.193 -7.451 12.254 131 HB2 TRP 17 HB2 TRP 17 102.356 -8.473 10.364 132 HB3 TRP 17 HB3 TRP 17 102.590 -7.721 11.960 133 HD1 TRP 17 HD1 TRP 17 100.719 -9.186 13.814 134 HE1 TRP 17 HE1 TRP 17 100.890 -11.711 14.305 135 HE3 TRP 17 HE3 TRP 17 103.295 -10.653 9.653 136 HZ2 TRP 17 HZ2 TRP 17 102.004 -14.051 13.040 137 HZ3 TRP 17 HZ3 TRP 17 103.895 -13.033 9.323 138 HH2 TRP 17 HH2 TRP 17 103.253 -14.732 11.008 139 H ARG 18 H ARG 18 100.221 -5.267 11.992 140 HA ARG 18 HA ARG 18 100.243 -4.218 9.193 141 HB2 ARG 18 HB3 ARG 18 98.991 -2.515 10.023 142 HB3 ARG 18 HB2 ARG 18 98.861 -3.495 11.501 143 HG2 ARG 18 HG2 ARG 18 100.994 -2.404 12.319 144 HG3 ARG 18 HG3 ARG 18 100.910 -1.317 10.912 145 HD2 ARG 18 HD2 ARG 18 98.402 -0.974 11.811 146 HD3 ARG 18 HD3 ARG 18 99.163 -1.433 13.353 147 HE ARG 18 HE ARG 18 100.639 0.650 11.847 148 HH11 ARG 18 HH11 ARG 18 100.713 2.656 12.883 149 HH12 ARG 18 HH12 ARG 18 99.657 2.979 14.240 150 HH21 ARG 18 HH21 ARG 18 98.163 -0.164 14.154 151 HH22 ARG 18 HH22 ARG 18 98.220 1.389 14.957 152 H VAL 19 H VAL 19 101.834 -2.819 8.379 153 HA VAL 19 HA VAL 19 104.317 -2.650 10.104 154 HB VAL 19 HB VAL 19 104.455 -2.292 7.130 155 HG11 VAL 19 HG11 VAL 19 106.454 -2.079 8.583 156 HG12 VAL 19 HG12 VAL 19 106.179 -3.725 9.201 157 HG13 VAL 19 HG13 VAL 19 106.602 -3.477 7.490 158 HG21 VAL 19 HG21 VAL 19 104.730 -4.864 7.016 159 HG22 VAL 19 HG22 VAL 19 103.071 -4.229 7.128 160 HG23 VAL 19 HG23 VAL 19 103.866 -4.899 8.572 161 H GLU 20 H GLU 20 105.365 -0.688 10.273 162 HA GLU 20 HA GLU 20 104.168 1.645 8.786 163 HB2 GLU 20 HB3 GLU 20 103.172 1.399 11.136 164 HB3 GLU 20 HB2 GLU 20 104.806 1.721 11.764 165 HG2 GLU 20 HG2 GLU 20 104.837 3.859 10.444 166 HG3 GLU 20 HG3 GLU 20 103.149 3.549 9.971 167 H LYS 21 H LYS 21 106.038 1.879 7.527 168 HA LYS 21 HA LYS 21 108.173 2.870 7.157 169 HB2 LYS 21 HB2 LYS 21 107.555 3.957 9.550 170 HB3 LYS 21 HB3 LYS 21 108.879 2.888 10.074 171 HG2 LYS 21 HG3 LYS 21 110.372 3.874 8.378 172 HG3 LYS 21 HG2 LYS 21 109.047 4.908 7.792 173 HD2 LYS 21 HD2 LYS 21 109.636 5.031 10.722 174 HD3 LYS 21 HD3 LYS 21 110.858 5.737 9.638 175 HE2 LYS 21 HE2 LYS 21 109.016 7.334 10.423 176 HE3 LYS 21 HE3 LYS 21 109.253 7.239 8.662 177 HZ1 LYS 21 HZ1 LYS 21 106.912 7.086 9.392 178 HZ2 LYS 21 HZ2 LYS 21 107.403 5.790 8.497 179 HZ3 LYS 21 HZ3 LYS 21 107.250 5.652 10.133 180 H PHE 22 H PHE 22 108.418 0.847 10.138 181 HA PHE 22 HA PHE 22 109.650 -1.369 8.700 182 HB2 PHE 22 HB2 PHE 22 111.424 0.735 9.922 183 HB3 PHE 22 HB3 PHE 22 111.909 -0.971 10.072 184 HD1 PHE 22 HD1 PHE 22 111.587 -2.367 7.791 185 HD2 PHE 22 HD2 PHE 22 112.152 1.884 8.036 186 HE1 PHE 22 HE1 PHE 22 112.401 -2.341 5.449 187 HE2 PHE 22 HE2 PHE 22 112.968 1.910 5.695 188 HZ PHE 22 HZ PHE 22 113.091 -0.201 4.401 189 H ASP 23 H ASP 23 107.702 -0.538 10.932 190 HA ASP 23 HA ASP 23 108.784 -2.501 12.968 191 HB2 ASP 23 HB2 ASP 23 107.258 -1.071 14.581 192 HB3 ASP 23 HB3 ASP 23 108.893 -0.495 14.174 193 H LEU 24 H LEU 24 107.556 -4.308 12.743 194 HA LEU 24 HA LEU 24 104.823 -4.190 11.671 195 HB2 LEU 24 HB3 LEU 24 106.531 -6.375 12.914 196 HB3 LEU 24 HB2 LEU 24 104.833 -6.658 12.464 197 HG LEU 24 HG LEU 24 105.473 -5.704 10.145 198 HD11 LEU 24 HD11 LEU 24 108.079 -6.402 9.868 199 HD12 LEU 24 HD12 LEU 24 108.110 -5.830 11.553 200 HD13 LEU 24 HD13 LEU 24 107.564 -4.742 10.255 201 HD21 LEU 24 HD21 LEU 24 106.361 -7.902 9.414 202 HD22 LEU 24 HD22 LEU 24 106.730 -8.314 11.105 203 HD23 LEU 24 HD23 LEU 24 105.040 -8.105 10.590 204 H VAL 25 H VAL 25 102.925 -4.025 12.791 205 HA VAL 25 HA VAL 25 103.037 -4.426 15.784 206 HB VAL 25 HB VAL 25 101.453 -2.176 14.498 207 HG11 VAL 25 HG11 VAL 25 100.861 -2.893 16.797 208 HG12 VAL 25 HG12 VAL 25 102.553 -2.667 17.303 209 HG13 VAL 25 HG13 VAL 25 101.578 -1.264 16.801 210 HG21 VAL 25 HG21 VAL 25 103.457 -0.773 15.480 211 HG22 VAL 25 HG22 VAL 25 103.620 -1.517 13.871 212 HG23 VAL 25 HG23 VAL 25 104.372 -2.288 15.288 213 HA PRO 26 HA PRO 26 99.741 -7.240 14.460 214 HB2 PRO 26 HB2 PRO 26 99.177 -6.995 17.416 215 HB3 PRO 26 HB3 PRO 26 99.281 -8.457 16.392 216 HG2 PRO 26 HG2 PRO 26 101.275 -7.730 18.040 217 HG3 PRO 26 HG3 PRO 26 101.575 -8.513 16.464 218 HD2 PRO 26 HD3 PRO 26 102.015 -5.671 17.286 219 HD3 PRO 26 HD2 PRO 26 102.836 -6.625 16.015 220 H VAL 27 H VAL 27 97.678 -6.799 13.800 221 HA VAL 27 HA VAL 27 96.530 -4.156 14.459 222 HB VAL 27 HB VAL 27 96.151 -4.860 12.225 223 HG11 VAL 27 HG11 VAL 27 94.861 -7.220 12.028 224 HG12 VAL 27 HG12 VAL 27 95.762 -7.528 13.532 225 HG13 VAL 27 HG13 VAL 27 96.637 -7.108 12.040 226 HG21 VAL 27 HG21 VAL 27 93.809 -4.820 12.022 227 HG22 VAL 27 HG22 VAL 27 93.568 -5.846 13.456 228 HG23 VAL 27 HG23 VAL 27 94.054 -4.145 13.650 229 HA PRO 28 HA PRO 28 94.463 -5.339 18.245 230 HB2 PRO 28 HB2 PRO 28 92.330 -3.574 17.026 231 HB3 PRO 28 HB3 PRO 28 92.985 -3.582 18.689 232 HG2 PRO 28 HG2 PRO 28 93.740 -1.761 16.847 233 HG3 PRO 28 HG3 PRO 28 94.843 -2.372 18.110 234 HD2 PRO 28 HD3 PRO 28 94.864 -2.888 15.182 235 HD3 PRO 28 HD2 PRO 28 96.185 -3.076 16.373 236 H THR 29 H THR 29 93.440 -7.263 18.504 237 HA THR 29 HA THR 29 91.961 -8.554 16.375 238 HB THR 29 HB THR 29 91.650 -9.158 19.340 239 HG1 THR 29 HG1 THR 29 93.556 -10.444 19.037 240 HG21 THR 29 HG21 THR 29 91.441 -11.476 18.488 241 HG22 THR 29 HG22 THR 29 91.675 -10.886 16.826 242 HG23 THR 29 HG23 THR 29 90.227 -10.409 17.744 243 H ASN 30 H ASN 30 91.025 -6.353 18.966 244 HA ASN 30 HA ASN 30 88.273 -6.834 19.228 245 HB2 ASN 30 HB2 ASN 30 89.562 -4.971 20.335 246 HB3 ASN 30 HB3 ASN 30 89.518 -4.081 18.794 247 HD21 ASN 30 HD21 ASN 30 86.987 -4.322 17.842 248 HD22 ASN 30 HD22 ASN 30 85.808 -3.773 19.013 249 H LEU 31 H LEU 31 89.933 -5.116 16.557 250 HA LEU 31 HA LEU 31 87.328 -4.891 15.108 251 HB2 LEU 31 HB2 LEU 31 90.165 -3.958 14.530 252 HB3 LEU 31 HB3 LEU 31 88.856 -3.826 13.331 253 HG LEU 31 HG LEU 31 87.507 -2.528 14.978 254 HD11 LEU 31 HD11 LEU 31 89.034 -1.618 16.948 255 HD12 LEU 31 HD12 LEU 31 88.192 -3.177 17.116 256 HD13 LEU 31 HD13 LEU 31 89.919 -3.140 16.686 257 HD21 LEU 31 HD21 LEU 31 88.979 -1.348 13.368 258 HD22 LEU 31 HD22 LEU 31 88.887 -0.470 14.913 259 HD23 LEU 31 HD23 LEU 31 90.325 -1.446 14.529 260 H TYR 32 H TYR 32 90.586 -6.294 14.512 261 HA TYR 32 HA TYR 32 91.200 -8.078 13.086 262 HB2 TYR 32 HB2 TYR 32 89.788 -9.235 14.865 263 HB3 TYR 32 HB3 TYR 32 88.419 -9.141 13.731 264 HD1 TYR 32 HD1 TYR 32 88.493 -10.360 11.575 265 HD2 TYR 32 HD2 TYR 32 91.630 -10.751 14.481 266 HE1 TYR 32 HE1 TYR 32 89.318 -12.387 10.410 267 HE2 TYR 32 HE2 TYR 32 92.458 -12.777 13.314 268 HH TYR 32 HH TYR 32 92.307 -13.699 10.851 269 H GLY 33 H GLY 33 91.242 -6.958 11.095 270 HA2 GLY 33 HA2 GLY 33 90.336 -7.600 8.783 271 HA3 GLY 33 HA3 GLY 33 88.719 -7.265 9.446 272 H ASP 34 H ASP 34 89.680 -4.931 11.020 273 HA ASP 34 HA ASP 34 89.306 -2.917 8.942 274 HB2 ASP 34 HB3 ASP 34 88.591 -2.550 11.280 275 HB3 ASP 34 HB2 ASP 34 90.286 -2.631 11.819 276 H PHE 35 H PHE 35 90.809 -1.772 7.782 277 HA PHE 35 HA PHE 35 93.680 -1.928 8.669 278 HB2 PHE 35 HB3 PHE 35 92.796 -2.542 5.817 279 HB3 PHE 35 HB2 PHE 35 94.445 -2.633 6.478 280 HD1 PHE 35 HD1 PHE 35 94.357 -4.050 8.902 281 HD2 PHE 35 HD2 PHE 35 91.868 -4.641 5.449 282 HE1 PHE 35 HE1 PHE 35 93.952 -6.397 9.593 283 HE2 PHE 35 HE2 PHE 35 91.465 -6.987 6.142 284 HZ PHE 35 HZ PHE 35 92.506 -7.865 8.216 285 H PHE 36 H PHE 36 94.831 -0.069 8.189 286 HA PHE 36 HA PHE 36 93.240 2.245 7.276 287 HB2 PHE 36 HB2 PHE 36 96.241 2.326 7.545 288 HB3 PHE 36 HB3 PHE 36 95.032 3.551 7.998 289 HD1 PHE 36 HD1 PHE 36 97.380 2.194 9.665 290 HD2 PHE 36 HD2 PHE 36 93.129 1.611 9.447 291 HE1 PHE 36 HE1 PHE 36 97.379 1.330 11.988 292 HE2 PHE 36 HE2 PHE 36 93.130 0.747 11.773 293 HZ PHE 36 HZ PHE 36 95.255 0.609 13.044 294 H THR 37 H THR 37 92.740 2.229 5.120 295 HA THR 37 HA THR 37 94.126 1.033 2.996 296 HB THR 37 HB THR 37 93.151 2.854 1.550 297 HG1 THR 37 HG1 THR 37 91.901 4.440 2.692 298 HG21 THR 37 HG21 THR 37 90.793 2.363 2.142 299 HG22 THR 37 HG22 THR 37 91.796 0.896 2.249 300 HG23 THR 37 HG23 THR 37 91.318 1.757 3.732 301 H GLY 38 H GLY 38 95.014 3.938 4.781 302 HA2 GLY 38 HA2 GLY 38 96.996 4.788 2.760 303 HA3 GLY 38 HA3 GLY 38 96.811 5.459 4.398 304 H ASP 39 H ASP 39 96.970 2.799 5.697 305 HA ASP 39 HA ASP 39 99.954 2.574 5.589 306 HB2 ASP 39 HB3 ASP 39 98.520 2.733 7.755 307 HB3 ASP 39 HB2 ASP 39 98.107 1.031 7.437 308 H ALA 40 H ALA 40 100.780 0.198 5.875 309 HA ALA 40 HA ALA 40 99.311 -1.478 3.824 310 HB1 ALA 40 HB1 ALA 40 101.515 -2.517 3.364 311 HB2 ALA 40 HB2 ALA 40 102.263 -1.482 4.604 312 HB3 ALA 40 HB3 ALA 40 101.581 -0.754 3.130 313 H TYR 41 H TYR 41 98.818 -3.610 4.337 314 HA TYR 41 HA TYR 41 99.578 -4.462 7.145 315 HB2 TYR 41 HB2 TYR 41 96.982 -4.786 5.599 316 HB3 TYR 41 HB3 TYR 41 97.375 -5.797 7.011 317 HD1 TYR 41 HD1 TYR 41 97.062 -4.969 9.201 318 HD2 TYR 41 HD2 TYR 41 97.072 -2.237 5.887 319 HE1 TYR 41 HE1 TYR 41 96.339 -3.139 10.710 320 HE2 TYR 41 HE2 TYR 41 96.350 -0.405 7.397 321 HH TYR 41 HH TYR 41 95.290 -0.981 10.646 322 H VAL 42 H VAL 42 100.486 -6.468 7.348 323 HA VAL 42 HA VAL 42 100.692 -8.088 4.799 324 HB VAL 42 HB VAL 42 102.542 -7.769 7.192 325 HG11 VAL 42 HG11 VAL 42 103.951 -9.527 5.988 326 HG12 VAL 42 HG12 VAL 42 102.504 -9.909 5.026 327 HG13 VAL 42 HG13 VAL 42 102.487 -10.146 6.790 328 HG21 VAL 42 HG21 VAL 42 102.488 -6.277 5.006 329 HG22 VAL 42 HG22 VAL 42 103.288 -7.685 4.266 330 HG23 VAL 42 HG23 VAL 42 104.046 -6.854 5.646 331 H ILE 43 H ILE 43 100.221 -10.303 4.882 332 HA ILE 43 HA ILE 43 99.303 -11.371 7.550 333 HB ILE 43 HB ILE 43 97.735 -12.131 5.107 334 HG12 ILE 43 HG13 ILE 43 97.259 -9.544 6.647 335 HG13 ILE 43 HG12 ILE 43 97.966 -9.625 5.015 336 HG21 ILE 43 HG21 ILE 43 95.929 -12.273 6.759 337 HG22 ILE 43 HG22 ILE 43 97.361 -13.133 7.373 338 HG23 ILE 43 HG23 ILE 43 96.963 -11.512 7.992 339 HD11 ILE 43 HD11 ILE 43 95.529 -9.187 4.908 340 HD12 ILE 43 HD12 ILE 43 95.927 -10.764 4.187 341 HD13 ILE 43 HD13 ILE 43 95.219 -10.684 5.818 342 H LEU 44 H LEU 44 99.607 -13.593 7.798 343 HA LEU 44 HA LEU 44 101.019 -14.959 5.494 344 HB2 LEU 44 HB2 LEU 44 101.942 -14.420 8.231 345 HB3 LEU 44 HB3 LEU 44 101.977 -16.157 7.845 346 HG LEU 44 HG LEU 44 103.144 -15.500 5.652 347 HD11 LEU 44 HD11 LEU 44 102.517 -13.102 5.712 348 HD12 LEU 44 HD12 LEU 44 104.285 -13.300 5.667 349 HD13 LEU 44 HD13 LEU 44 103.474 -12.889 7.197 350 HD21 LEU 44 HD21 LEU 44 104.341 -16.488 7.588 351 HD22 LEU 44 HD22 LEU 44 104.539 -14.866 8.293 352 HD23 LEU 44 HD23 LEU 44 105.351 -15.276 6.763 353 H LYS 45 H LYS 45 99.903 -16.735 4.857 354 HA LYS 45 HA LYS 45 98.044 -17.983 6.891 355 HB2 LYS 45 HB2 LYS 45 97.347 -17.071 4.474 356 HB3 LYS 45 HB3 LYS 45 97.933 -18.673 3.965 357 HG2 LYS 45 HG2 LYS 45 96.462 -19.621 5.872 358 HG3 LYS 45 HG3 LYS 45 95.700 -18.013 5.918 359 HD2 LYS 45 HD2 LYS 45 95.949 -19.714 3.400 360 HD3 LYS 45 HD3 LYS 45 94.500 -19.669 4.434 361 HE2 LYS 45 HE2 LYS 45 94.025 -18.060 2.768 362 HE3 LYS 45 HE3 LYS 45 94.638 -17.077 4.119 363 HZ1 LYS 45 HZ1 LYS 45 95.605 -16.998 1.633 364 HZ2 LYS 45 HZ2 LYS 45 96.657 -18.061 2.330 365 HZ3 LYS 45 HZ3 LYS 45 96.460 -16.554 2.971 366 H THR 46 H THR 46 99.490 -19.380 7.929 367 HA THR 46 HA THR 46 101.261 -21.165 6.388 368 HB THR 46 HB THR 46 100.394 -21.489 9.287 369 HG1 THR 46 HG1 THR 46 101.241 -19.558 9.514 370 HG21 THR 46 HG21 THR 46 101.708 -23.337 8.428 371 HG22 THR 46 HG22 THR 46 102.771 -22.345 9.455 372 HG23 THR 46 HG23 THR 46 102.878 -22.222 7.682 373 H VAL 47 H VAL 47 100.179 -22.605 5.075 374 HA VAL 47 HA VAL 47 97.768 -23.998 6.163 375 HB VAL 47 HB VAL 47 98.869 -24.857 3.550 376 HG11 VAL 47 HG11 VAL 47 96.619 -25.473 4.389 377 HG12 VAL 47 HG12 VAL 47 96.176 -23.751 4.461 378 HG13 VAL 47 HG13 VAL 47 96.508 -24.519 2.890 379 HG21 VAL 47 HG21 VAL 47 98.032 -22.704 2.462 380 HG22 VAL 47 HG22 VAL 47 99.566 -22.560 3.353 381 HG23 VAL 47 HG23 VAL 47 98.053 -21.973 4.084 382 H GLN 48 H GLN 48 97.674 -26.407 5.901 383 HA GLN 48 HA GLN 48 100.367 -27.588 6.617 384 HB2 GLN 48 HB2 GLN 48 98.577 -27.658 8.391 385 HB3 GLN 48 HB3 GLN 48 97.588 -28.649 7.291 386 HG2 GLN 48 HG2 GLN 48 99.029 -30.486 7.432 387 HG3 GLN 48 HG3 GLN 48 100.430 -29.482 7.880 388 HE21 GLN 48 HE21 GLN 48 97.204 -30.546 9.157 389 HE22 GLN 48 HE22 GLN 48 97.710 -30.539 10.832 390 H LEU 49 H LEU 49 101.150 -28.396 4.697 391 HA LEU 49 HA LEU 49 99.683 -29.329 2.478 392 HB2 LEU 49 HB3 LEU 49 102.369 -30.074 3.640 393 HB3 LEU 49 HB2 LEU 49 101.729 -30.998 2.260 394 HG LEU 49 HG LEU 49 101.655 -27.984 2.155 395 HD11 LEU 49 HD11 LEU 49 103.966 -28.241 0.972 396 HD12 LEU 49 HD12 LEU 49 103.933 -28.215 2.751 397 HD13 LEU 49 HD13 LEU 49 104.095 -29.763 1.887 398 HD21 LEU 49 HD21 LEU 49 100.575 -29.359 0.397 399 HD22 LEU 49 HD22 LEU 49 102.120 -30.191 0.100 400 HD23 LEU 49 HD23 LEU 49 101.961 -28.455 -0.260 401 H ARG 50 H ARG 50 100.979 -31.397 5.126 402 HA ARG 50 HA ARG 50 98.552 -33.139 4.767 403 HB2 ARG 50 HB3 ARG 50 101.254 -34.429 5.146 404 HB3 ARG 50 HB2 ARG 50 99.769 -35.108 4.439 405 HG2 ARG 50 HG2 ARG 50 100.068 -33.357 2.561 406 HG3 ARG 50 HG3 ARG 50 101.715 -33.130 3.197 407 HD2 ARG 50 HD2 ARG 50 101.987 -34.790 1.530 408 HD3 ARG 50 HD3 ARG 50 101.899 -35.727 3.041 409 HE ARG 50 HE ARG 50 99.256 -35.355 1.804 410 HH11 ARG 50 HH11 ARG 50 98.338 -37.226 0.932 411 HH12 ARG 50 HH12 ARG 50 99.333 -38.636 0.642 412 HH21 ARG 50 HH21 ARG 50 102.248 -37.136 1.817 413 HH22 ARG 50 HH22 ARG 50 101.538 -38.585 1.141 414 H ASN 51 H ASN 51 101.632 -33.093 6.623 415 HA ASN 51 HA ASN 51 100.240 -32.507 9.134 416 HB2 ASN 51 HB3 ASN 51 100.915 -35.366 8.414 417 HB3 ASN 51 HB2 ASN 51 101.028 -34.832 10.108 418 HD21 ASN 51 HD21 ASN 51 98.993 -33.750 11.020 419 HD22 ASN 51 HD22 ASN 51 97.447 -34.308 10.421 420 H GLY 52 H GLY 52 102.672 -31.883 7.382 421 HA2 GLY 52 HA2 GLY 52 104.557 -31.659 9.667 422 HA3 GLY 52 HA3 GLY 52 105.133 -32.688 8.334 423 H ASN 53 H ASN 53 104.520 -31.490 6.060 424 HA ASN 53 HA ASN 53 106.124 -28.996 6.180 425 HB2 ASN 53 HB2 ASN 53 104.796 -30.467 3.860 426 HB3 ASN 53 HB3 ASN 53 105.866 -29.055 3.687 427 HD21 ASN 53 HD21 ASN 53 107.123 -30.563 6.337 428 HD22 ASN 53 HD22 ASN 53 108.269 -31.631 5.559 429 H LEU 54 H LEU 54 105.361 -26.921 5.898 430 HA LEU 54 HA LEU 54 102.397 -26.638 5.359 431 HB2 LEU 54 HB3 LEU 54 102.787 -24.535 6.988 432 HB3 LEU 54 HB2 LEU 54 102.357 -26.141 7.623 433 HG LEU 54 HG LEU 54 105.269 -25.534 7.177 434 HD11 LEU 54 HD11 LEU 54 105.332 -24.569 9.526 435 HD12 LEU 54 HD12 LEU 54 103.559 -24.435 9.449 436 HD13 LEU 54 HD13 LEU 54 104.571 -23.509 8.315 437 HD21 LEU 54 HD21 LEU 54 104.495 -27.767 7.932 438 HD22 LEU 54 HD22 LEU 54 103.690 -27.015 9.330 439 HD23 LEU 54 HD23 LEU 54 105.464 -26.966 9.192 440 H GLN 55 H GLN 55 101.981 -24.115 4.955 441 HA GLN 55 HA GLN 55 104.308 -22.884 3.528 442 HB2 GLN 55 HB3 GLN 55 102.968 -24.430 1.935 443 HB3 GLN 55 HB2 GLN 55 101.664 -23.226 2.073 444 HG2 GLN 55 HG2 GLN 55 102.835 -22.431 0.208 445 HG3 GLN 55 HG3 GLN 55 103.595 -21.504 1.523 446 HE21 GLN 55 HE21 GLN 55 104.872 -22.235 -1.053 447 HE22 GLN 55 HE22 GLN 55 106.243 -23.241 -0.643 448 H TYR 56 H TYR 56 104.321 -20.750 3.986 449 HA TYR 56 HA TYR 56 101.854 -19.543 5.181 450 HB2 TYR 56 HB2 TYR 56 104.582 -18.259 4.732 451 HB3 TYR 56 HB3 TYR 56 103.300 -17.715 5.839 452 HD1 TYR 56 HD1 TYR 56 103.261 -18.481 8.058 453 HD2 TYR 56 HD2 TYR 56 105.554 -20.634 5.134 454 HE1 TYR 56 HE1 TYR 56 104.199 -19.913 9.849 455 HE2 TYR 56 HE2 TYR 56 106.490 -22.069 6.926 456 HH TYR 56 HH TYR 56 106.543 -21.372 10.031 457 H ASP 57 H ASP 57 100.533 -18.173 4.050 458 HA ASP 57 HA ASP 57 101.338 -17.555 1.228 459 HB2 ASP 57 HB2 ASP 57 98.708 -17.006 2.673 460 HB3 ASP 57 HB3 ASP 57 99.001 -16.890 0.921 461 H LEU 58 H LEU 58 102.179 -15.594 0.713 462 HA LEU 58 HA LEU 58 102.186 -13.488 2.832 463 HB2 LEU 58 HB2 LEU 58 103.404 -13.336 0.048 464 HB3 LEU 58 HB3 LEU 58 103.841 -12.383 1.487 465 HG LEU 58 HG LEU 58 104.349 -15.329 0.946 466 HD11 LEU 58 HD11 LEU 58 105.878 -13.011 0.632 467 HD12 LEU 58 HD12 LEU 58 106.511 -14.671 0.740 468 HD13 LEU 58 HD13 LEU 58 106.420 -13.656 2.199 469 HD21 LEU 58 HD21 LEU 58 105.314 -15.151 3.400 470 HD22 LEU 58 HD22 LEU 58 103.580 -15.474 3.161 471 HD23 LEU 58 HD23 LEU 58 104.132 -13.831 3.566 472 H HIS 59 H HIS 59 100.412 -12.229 2.932 473 HA HIS 59 HA HIS 59 99.299 -11.223 0.300 474 HB2 HIS 59 HB2 HIS 59 97.862 -12.012 2.866 475 HB3 HIS 59 HB3 HIS 59 97.098 -11.028 1.596 476 HD2 HIS 59 HD2 HIS 59 99.081 -14.515 1.461 477 HE1 HIS 59 HE1 HIS 59 95.669 -14.728 -1.017 478 H TYR 60 H TYR 60 100.038 -9.136 0.172 479 HA TYR 60 HA TYR 60 100.012 -7.531 2.726 480 HB2 TYR 60 HB2 TYR 60 101.170 -5.906 0.807 481 HB3 TYR 60 HB3 TYR 60 102.065 -6.950 1.935 482 HD1 TYR 60 HD1 TYR 60 101.760 -6.092 -1.415 483 HD2 TYR 60 HD2 TYR 60 102.062 -9.562 1.099 484 HE1 TYR 60 HE1 TYR 60 102.635 -7.403 -3.328 485 HE2 TYR 60 HE2 TYR 60 102.927 -10.875 -0.817 486 HH TYR 60 HH TYR 60 102.735 -10.692 -3.439 487 H TRP 61 H TRP 61 98.317 -6.197 3.030 488 HA TRP 61 HA TRP 61 96.543 -5.634 0.687 489 HB2 TRP 61 HB2 TRP 61 95.771 -6.400 3.066 490 HB3 TRP 61 HB3 TRP 61 96.042 -4.701 3.523 491 HD1 TRP 61 HD1 TRP 61 94.265 -6.589 0.628 492 HE1 TRP 61 HE1 TRP 61 92.063 -5.373 0.068 493 HE3 TRP 61 HE3 TRP 61 94.589 -2.742 3.971 494 HZ2 TRP 61 HZ2 TRP 61 90.638 -3.035 0.970 495 HZ3 TRP 61 HZ3 TRP 61 92.796 -1.037 4.102 496 HH2 TRP 61 HH2 TRP 61 90.824 -1.175 2.604 497 H LEU 62 H LEU 62 96.623 -3.763 -0.390 498 HA LEU 62 HA LEU 62 97.755 -1.353 1.046 499 HB2 LEU 62 HB3 LEU 62 98.113 -1.478 -1.906 500 HB3 LEU 62 HB2 LEU 62 99.240 -0.923 -0.646 501 HG LEU 62 HG LEU 62 98.584 -3.843 -1.249 502 HD11 LEU 62 HD11 LEU 62 100.191 -3.767 -2.833 503 HD12 LEU 62 HD12 LEU 62 100.298 -2.005 -2.607 504 HD13 LEU 62 HD13 LEU 62 101.346 -3.089 -1.660 505 HD21 LEU 62 HD21 LEU 62 101.040 -3.253 0.236 506 HD22 LEU 62 HD22 LEU 62 99.709 -4.361 0.648 507 HD23 LEU 62 HD23 LEU 62 99.601 -2.639 1.085 508 H GLY 63 H GLY 63 95.909 -0.156 1.368 509 HA2 GLY 63 HA2 GLY 63 93.612 -0.260 -0.405 510 HA3 GLY 63 HA3 GLY 63 93.907 0.984 0.833 511 H ASN 64 H ASN 64 96.451 0.521 -1.442 512 HA ASN 64 HA ASN 64 97.197 1.859 -3.241 513 HB2 ASN 64 HB2 ASN 64 94.724 1.307 -3.979 514 HB3 ASN 64 HB3 ASN 64 94.419 3.009 -3.559 515 HD21 ASN 64 HD21 ASN 64 94.038 3.352 -5.943 516 HD22 ASN 64 HD22 ASN 64 95.424 3.537 -6.995 517 H GLU 65 H GLU 65 96.071 2.992 -0.347 518 HA GLU 65 HA GLU 65 96.586 5.876 -1.084 519 HB2 GLU 65 HB2 GLU 65 95.202 4.528 1.261 520 HB3 GLU 65 HB3 GLU 65 95.721 6.229 1.336 521 HG2 GLU 65 HG2 GLU 65 94.013 5.133 -0.932 522 HG3 GLU 65 HG3 GLU 65 93.310 5.823 0.551 523 H CYS 66 H CYS 66 98.357 3.294 -0.283 524 HA CYS 66 HA CYS 66 99.980 4.710 1.826 525 HB2 CYS 66 HB2 CYS 66 99.249 2.264 2.092 526 HB3 CYS 66 HB3 CYS 66 100.373 1.883 0.766 527 HG CYS 66 HG CYS 66 101.185 1.923 3.856 528 H SER 67 H SER 67 101.915 5.617 1.307 529 HA SER 67 HA SER 67 102.725 6.058 -1.379 530 HB2 SER 67 HB2 SER 67 104.666 5.824 0.953 531 HB3 SER 67 HB3 SER 67 104.802 6.862 -0.486 532 HG SER 67 HG SER 67 104.024 8.015 1.372 533 H GLN 68 H GLN 68 104.448 5.128 -2.659 534 HA GLN 68 HA GLN 68 104.498 2.197 -2.501 535 HB2 GLN 68 HB2 GLN 68 106.454 3.781 -4.166 536 HB3 GLN 68 HB3 GLN 68 105.589 2.278 -4.566 537 HG2 GLN 68 HG3 GLN 68 103.432 3.752 -4.406 538 HG3 GLN 68 HG2 GLN 68 104.552 5.126 -4.562 539 HE21 GLN 68 HE21 GLN 68 102.544 4.308 -6.575 540 HE22 GLN 68 HE22 GLN 68 103.442 3.871 -8.011 541 H ASP 69 H ASP 69 106.229 4.634 -0.899 542 HA ASP 69 HA ASP 69 108.799 3.169 -0.764 543 HB2 ASP 69 HB3 ASP 69 109.326 4.906 1.002 544 HB3 ASP 69 HB2 ASP 69 108.856 5.590 -0.573 545 H GLU 70 H GLU 70 105.912 3.615 1.289 546 HA GLU 70 HA GLU 70 107.126 1.916 3.418 547 HB2 GLU 70 HB2 GLU 70 105.619 3.887 3.924 548 HB3 GLU 70 HB3 GLU 70 104.276 2.976 3.193 549 HG2 GLU 70 HG3 GLU 70 104.827 1.089 4.827 550 HG3 GLU 70 HG2 GLU 70 105.914 2.233 5.650 551 H SER 71 H SER 71 104.420 1.775 1.082 552 HA SER 71 HA SER 71 103.430 -0.806 1.762 553 HB2 SER 71 HB3 SER 71 102.484 0.836 0.053 554 HB3 SER 71 HB2 SER 71 103.729 0.253 -1.079 555 HG SER 71 HG SER 71 101.733 -0.915 -1.271 556 H GLY 72 H GLY 72 106.001 0.048 -0.611 557 HA2 GLY 72 HA2 GLY 72 106.640 -2.651 -1.344 558 HA3 GLY 72 HA3 GLY 72 107.774 -1.282 -1.427 559 H ALA 73 H ALA 73 107.997 -0.568 1.254 560 HA ALA 73 HA ALA 73 109.979 -2.306 2.248 561 HB1 ALA 73 HB1 ALA 73 109.553 -1.296 4.474 562 HB2 ALA 73 HB2 ALA 73 109.510 -0.060 3.194 563 HB3 ALA 73 HB3 ALA 73 107.991 -0.672 3.892 564 H ALA 74 H ALA 74 106.457 -2.372 2.960 565 HA ALA 74 HA ALA 74 106.582 -4.610 4.774 566 HB1 ALA 74 HB1 ALA 74 104.176 -4.906 4.249 567 HB2 ALA 74 HB2 ALA 74 104.566 -3.188 4.503 568 HB3 ALA 74 HB3 ALA 74 104.346 -3.817 2.852 569 H ALA 75 H ALA 75 105.918 -4.496 1.245 570 HA ALA 75 HA ALA 75 105.786 -7.365 0.924 571 HB1 ALA 75 HB1 ALA 75 106.201 -6.897 -1.477 572 HB2 ALA 75 HB2 ALA 75 106.690 -5.235 -1.070 573 HB3 ALA 75 HB3 ALA 75 105.010 -5.759 -0.805 574 H ILE 76 H ILE 76 108.434 -5.185 1.454 575 HA ILE 76 HA ILE 76 110.467 -7.027 0.328 576 HB ILE 76 HB ILE 76 110.669 -4.518 2.048 577 HG12 ILE 76 HG12 ILE 76 109.878 -4.578 -0.491 578 HG13 ILE 76 HG13 ILE 76 111.040 -3.350 0.063 579 HG21 ILE 76 HG21 ILE 76 112.649 -5.720 2.540 580 HG22 ILE 76 HG22 ILE 76 112.762 -6.383 0.892 581 HG23 ILE 76 HG23 ILE 76 113.122 -4.665 1.187 582 HD11 ILE 76 HD11 ILE 76 111.606 -4.674 -2.108 583 HD12 ILE 76 HD12 ILE 76 112.884 -4.498 -0.882 584 HD13 ILE 76 HD13 ILE 76 111.981 -6.026 -1.012 585 H PHE 77 H PHE 77 109.691 -5.815 3.643 586 HA PHE 77 HA PHE 77 111.391 -7.812 4.917 587 HB2 PHE 77 HB3 PHE 77 110.360 -5.572 5.859 588 HB3 PHE 77 HB2 PHE 77 108.971 -6.605 6.272 589 HD1 PHE 77 HD1 PHE 77 109.112 -8.243 8.025 590 HD2 PHE 77 HD2 PHE 77 112.611 -6.069 6.807 591 HE1 PHE 77 HE1 PHE 77 110.328 -9.084 10.016 592 HE2 PHE 77 HE2 PHE 77 113.825 -6.910 8.799 593 HZ PHE 77 HZ PHE 77 112.685 -8.418 10.403 594 H THR 78 H THR 78 108.115 -7.792 3.690 595 HA THR 78 HA THR 78 107.291 -10.208 5.173 596 HB THR 78 HB THR 78 106.127 -8.769 2.747 597 HG1 THR 78 HG1 THR 78 105.171 -7.609 4.234 598 HG21 THR 78 HG21 THR 78 105.469 -11.133 2.705 599 HG22 THR 78 HG22 THR 78 104.087 -10.140 3.226 600 HG23 THR 78 HG23 THR 78 105.022 -11.064 4.426 601 H VAL 79 H VAL 79 108.434 -9.460 1.856 602 HA VAL 79 HA VAL 79 108.247 -12.280 1.025 603 HB VAL 79 HB VAL 79 109.645 -9.854 -0.178 604 HG11 VAL 79 HG11 VAL 79 110.796 -11.951 -0.830 605 HG12 VAL 79 HG12 VAL 79 109.236 -12.652 -1.324 606 HG13 VAL 79 HG13 VAL 79 109.903 -11.257 -2.205 607 HG21 VAL 79 HG21 VAL 79 107.291 -11.348 -1.337 608 HG22 VAL 79 HG22 VAL 79 107.022 -10.185 -0.017 609 HG23 VAL 79 HG23 VAL 79 107.757 -9.643 -1.545 610 H GLN 80 H GLN 80 110.862 -10.093 2.120 611 HA GLN 80 HA GLN 80 112.966 -12.080 1.738 612 HB2 GLN 80 HB2 GLN 80 112.729 -9.534 3.376 613 HB3 GLN 80 HB3 GLN 80 114.185 -10.554 3.445 614 HG2 GLN 80 HG2 GLN 80 113.052 -9.722 0.766 615 HG3 GLN 80 HG3 GLN 80 114.065 -8.588 1.691 616 HE21 GLN 80 HE21 GLN 80 114.353 -10.696 -0.790 617 HE22 GLN 80 HE22 GLN 80 115.959 -11.320 -0.488 618 H LEU 81 H LEU 81 111.431 -10.859 4.781 619 HA LEU 81 HA LEU 81 112.590 -12.828 6.481 620 HB2 LEU 81 HB2 LEU 81 111.144 -10.799 7.131 621 HB3 LEU 81 HB3 LEU 81 109.733 -11.822 6.778 622 HG LEU 81 HG LEU 81 110.381 -11.848 9.204 623 HD11 LEU 81 HD11 LEU 81 109.905 -14.111 9.454 624 HD12 LEU 81 HD12 LEU 81 111.005 -14.596 8.142 625 HD13 LEU 81 HD13 LEU 81 109.427 -13.869 7.756 626 HD21 LEU 81 HD21 LEU 81 112.469 -12.560 9.956 627 HD22 LEU 81 HD22 LEU 81 112.781 -13.530 8.497 628 HD23 LEU 81 HD23 LEU 81 112.939 -11.758 8.438 629 H ASP 82 H ASP 82 109.404 -12.958 4.776 630 HA ASP 82 HA ASP 82 108.613 -15.542 5.546 631 HB2 ASP 82 HB3 ASP 82 107.159 -14.370 4.066 632 HB3 ASP 82 HB2 ASP 82 108.446 -14.129 2.860 633 H ASP 83 H ASP 83 110.931 -14.664 2.939 634 HA ASP 83 HA ASP 83 111.576 -17.324 2.132 635 HB2 ASP 83 HB3 ASP 83 112.435 -15.056 1.190 636 HB3 ASP 83 HB2 ASP 83 113.669 -15.145 2.468 637 H TYR 84 H TYR 84 112.533 -15.405 4.940 638 HA TYR 84 HA TYR 84 114.577 -17.229 5.909 639 HB2 TYR 84 HB3 TYR 84 114.055 -14.811 6.689 640 HB3 TYR 84 HB2 TYR 84 112.771 -15.547 7.679 641 HD1 TYR 84 HD1 TYR 84 116.401 -15.187 7.196 642 HD2 TYR 84 HD2 TYR 84 113.324 -17.117 9.489 643 HE1 TYR 84 HE1 TYR 84 118.078 -15.830 8.906 644 HE2 TYR 84 HE2 TYR 84 115.001 -17.758 11.200 645 HH TYR 84 HH TYR 84 117.606 -18.151 11.193 646 H LEU 85 H LEU 85 111.057 -17.182 6.042 647 HA LEU 85 HA LEU 85 110.891 -19.193 8.184 648 HB2 LEU 85 HB3 LEU 85 109.027 -17.692 6.433 649 HB3 LEU 85 HB2 LEU 85 108.481 -19.334 6.846 650 HG LEU 85 HG LEU 85 108.574 -18.886 9.194 651 HD11 LEU 85 HD11 LEU 85 109.408 -16.469 9.874 652 HD12 LEU 85 HD12 LEU 85 110.596 -17.764 9.591 653 HD13 LEU 85 HD13 LEU 85 110.287 -16.549 8.328 654 HD21 LEU 85 HD21 LEU 85 107.139 -16.876 9.434 655 HD22 LEU 85 HD22 LEU 85 106.642 -17.857 8.034 656 HD23 LEU 85 HD23 LEU 85 107.582 -16.365 7.787 657 H ASN 86 H ASN 86 110.129 -19.344 4.652 658 HA ASN 86 HA ASN 86 110.853 -22.282 4.836 659 HB2 ASN 86 HB3 ASN 86 108.374 -21.674 4.450 660 HB3 ASN 86 HB2 ASN 86 108.887 -21.099 2.845 661 HD21 ASN 86 HD21 ASN 86 108.029 -23.908 4.695 662 HD22 ASN 86 HD22 ASN 86 108.481 -25.098 3.495 663 H GLY 87 H GLY 87 110.757 -19.387 2.735 664 HA2 GLY 87 HA2 GLY 87 112.962 -18.956 1.527 665 HA3 GLY 87 HA3 GLY 87 112.965 -20.688 1.118 666 H ARG 88 H ARG 88 109.893 -20.427 0.844 667 HA ARG 88 HA ARG 88 109.902 -19.022 -1.834 668 HB2 ARG 88 HB2 ARG 88 108.486 -21.640 -1.164 669 HB3 ARG 88 HB3 ARG 88 108.514 -20.821 -2.744 670 HG2 ARG 88 HG3 ARG 88 110.920 -21.157 -2.937 671 HG3 ARG 88 HG2 ARG 88 111.002 -21.808 -1.283 672 HD2 ARG 88 HD2 ARG 88 109.211 -23.534 -2.192 673 HD3 ARG 88 HD3 ARG 88 109.864 -23.069 -3.781 674 HE ARG 88 HE ARG 88 111.910 -24.183 -3.238 675 HH11 ARG 88 HH11 ARG 88 113.124 -25.515 -1.877 676 HH12 ARG 88 HH12 ARG 88 112.610 -25.780 -0.225 677 HH21 ARG 88 HH21 ARG 88 109.792 -23.755 -0.507 678 HH22 ARG 88 HH22 ARG 88 110.732 -24.787 0.547 679 H ALA 89 H ALA 89 107.256 -20.819 -0.289 680 HA ALA 89 HA ALA 89 105.245 -20.017 0.681 681 HB1 ALA 89 HB1 ALA 89 105.386 -18.150 1.993 682 HB2 ALA 89 HB2 ALA 89 107.117 -18.221 1.585 683 HB3 ALA 89 HB3 ALA 89 106.030 -17.150 0.669 684 H VAL 90 H VAL 90 103.338 -18.665 0.048 685 HA VAL 90 HA VAL 90 103.375 -18.283 -2.919 686 HB VAL 90 HB VAL 90 100.979 -17.847 -1.116 687 HG11 VAL 90 HG11 VAL 90 101.376 -18.939 -3.939 688 HG12 VAL 90 HG12 VAL 90 100.775 -17.317 -3.517 689 HG13 VAL 90 HG13 VAL 90 99.807 -18.757 -3.119 690 HG21 VAL 90 HG21 VAL 90 100.590 -20.389 -1.647 691 HG22 VAL 90 HG22 VAL 90 101.665 -19.948 -0.299 692 HG23 VAL 90 HG23 VAL 90 102.356 -20.438 -1.864 693 H GLN 91 H GLN 91 102.748 -16.300 -3.928 694 HA GLN 91 HA GLN 91 103.125 -13.907 -2.114 695 HB2 GLN 91 HB3 GLN 91 103.784 -14.445 -5.022 696 HB3 GLN 91 HB2 GLN 91 103.587 -12.777 -4.432 697 HG2 GLN 91 HG2 GLN 91 105.970 -13.598 -4.345 698 HG3 GLN 91 HG3 GLN 91 105.331 -13.107 -2.758 699 HE21 GLN 91 HE21 GLN 91 104.799 -16.163 -4.638 700 HE22 GLN 91 HE22 GLN 91 105.411 -17.209 -3.377 701 H HIS 92 H HIS 92 101.479 -12.453 -1.937 702 HA HIS 92 HA HIS 92 99.308 -12.519 -4.027 703 HB2 HIS 92 HB2 HIS 92 98.988 -12.905 -1.032 704 HB3 HIS 92 HB3 HIS 92 97.662 -12.268 -2.033 705 HD2 HIS 92 HD2 HIS 92 99.902 -15.576 -1.969 706 HE1 HIS 92 HE1 HIS 92 96.185 -16.437 -3.782 707 H ARG 93 H ARG 93 99.350 -10.470 -4.805 708 HA ARG 93 HA ARG 93 99.922 -8.239 -2.855 709 HB2 ARG 93 HB2 ARG 93 101.352 -8.364 -4.886 710 HB3 ARG 93 HB3 ARG 93 99.899 -8.246 -5.907 711 HG2 ARG 93 HG2 ARG 93 99.372 -6.042 -4.897 712 HG3 ARG 93 HG3 ARG 93 100.831 -6.160 -3.884 713 HD2 ARG 93 HD2 ARG 93 100.616 -5.806 -6.884 714 HD3 ARG 93 HD3 ARG 93 101.575 -4.871 -5.711 715 HE ARG 93 HE ARG 93 102.670 -7.437 -5.542 716 HH11 ARG 93 HH11 ARG 93 104.367 -8.107 -6.877 717 HH12 ARG 93 HH12 ARG 93 104.614 -7.339 -8.429 718 HH21 ARG 93 HH21 ARG 93 101.923 -5.160 -8.067 719 HH22 ARG 93 HH22 ARG 93 103.236 -5.678 -9.100 720 H GLU 94 H GLU 94 98.239 -7.013 -2.175 721 HA GLU 94 HA GLU 94 95.745 -7.036 -3.897 722 HB2 GLU 94 HB3 GLU 94 96.161 -7.119 -0.906 723 HB3 GLU 94 HB2 GLU 94 94.683 -6.380 -1.566 724 HG2 GLU 94 HG2 GLU 94 93.851 -8.389 -2.306 725 HG3 GLU 94 HG3 GLU 94 95.460 -9.014 -2.737 726 H VAL 95 H VAL 95 96.501 -5.163 -5.069 727 HA VAL 95 HA VAL 95 97.085 -2.692 -3.520 728 HB VAL 95 HB VAL 95 96.561 -2.735 -6.494 729 HG11 VAL 95 HG11 VAL 95 97.115 -0.613 -5.334 730 HG12 VAL 95 HG12 VAL 95 98.604 -1.351 -4.697 731 HG13 VAL 95 HG13 VAL 95 98.418 -1.091 -6.448 732 HG21 VAL 95 HG21 VAL 95 99.097 -3.347 -6.629 733 HG22 VAL 95 HG22 VAL 95 97.929 -4.664 -6.368 734 HG23 VAL 95 HG23 VAL 95 98.866 -4.021 -4.998 735 H GLN 96 H GLN 96 94.481 -3.845 -3.044 736 HA GLN 96 HA GLN 96 92.221 -3.163 -2.966 737 HB2 GLN 96 HB2 GLN 96 93.776 -0.909 -2.555 738 HB3 GLN 96 HB3 GLN 96 92.736 -0.402 -3.907 739 HG2 GLN 96 HG2 GLN 96 90.751 -1.272 -2.569 740 HG3 GLN 96 HG3 GLN 96 91.861 -1.475 -1.192 741 HE21 GLN 96 HE21 GLN 96 91.108 1.093 -3.665 742 HE22 GLN 96 HE22 GLN 96 91.131 2.402 -2.506 743 H GLY 97 H GLY 97 91.506 -4.397 -4.766 744 HA2 GLY 97 HA2 GLY 97 89.963 -3.535 -6.731 745 HA3 GLY 97 HA3 GLY 97 91.499 -2.950 -7.414 746 H PHE 98 H PHE 98 93.281 -4.912 -7.034 747 HA PHE 98 HA PHE 98 92.054 -7.192 -8.576 748 HB2 PHE 98 HB2 PHE 98 94.092 -5.916 -9.454 749 HB3 PHE 98 HB3 PHE 98 95.009 -6.626 -8.104 750 HD1 PHE 98 HD1 PHE 98 96.004 -8.723 -8.386 751 HD2 PHE 98 HD2 PHE 98 92.698 -7.623 -10.899 752 HE1 PHE 98 HE1 PHE 98 96.291 -10.818 -9.681 753 HE2 PHE 98 HE2 PHE 98 92.985 -9.718 -12.194 754 HZ PHE 98 HZ PHE 98 94.779 -11.316 -11.585 755 H GLU 99 H GLU 99 91.247 -7.430 -6.053 756 HA GLU 99 HA GLU 99 93.258 -8.896 -4.428 757 HB2 GLU 99 HB3 GLU 99 90.293 -8.864 -3.846 758 HB3 GLU 99 HB2 GLU 99 91.664 -8.848 -2.711 759 HG2 GLU 99 HG2 GLU 99 90.933 -6.621 -2.612 760 HG3 GLU 99 HG3 GLU 99 92.214 -6.529 -3.844 761 H SER 100 H SER 100 92.897 -11.134 -3.719 762 HA SER 100 HA SER 100 91.746 -12.759 -5.971 763 HB2 SER 100 HB2 SER 100 93.759 -13.772 -5.554 764 HB3 SER 100 HB3 SER 100 93.844 -13.142 -3.891 765 HG SER 100 HG SER 100 93.488 -15.476 -4.071 766 H ALA 101 H ALA 101 90.509 -14.773 -5.308 767 HA ALA 101 HA ALA 101 88.312 -13.986 -3.545 768 HB1 ALA 101 HB1 ALA 101 87.470 -16.280 -3.962 769 HB2 ALA 101 HB2 ALA 101 89.030 -16.718 -4.699 770 HB3 ALA 101 HB3 ALA 101 87.988 -15.503 -5.478 771 H THR 102 H THR 102 91.267 -15.886 -3.154 772 HA THR 102 HA THR 102 90.535 -17.213 -0.696 773 HB THR 102 HB THR 102 93.339 -16.193 -1.198 774 HG1 THR 102 HG1 THR 102 93.466 -18.143 -2.600 775 HG21 THR 102 HG21 THR 102 93.901 -18.451 -0.339 776 HG22 THR 102 HG22 THR 102 92.848 -17.578 0.799 777 HG23 THR 102 HG23 THR 102 92.168 -18.847 -0.247 778 H PHE 103 H PHE 103 92.542 -14.260 -1.135 779 HA PHE 103 HA PHE 103 92.600 -13.504 1.611 780 HB2 PHE 103 HB3 PHE 103 94.012 -12.303 0.110 781 HB3 PHE 103 HB2 PHE 103 92.652 -11.883 -0.960 782 HD1 PHE 103 HD1 PHE 103 93.919 -11.389 2.538 783 HD2 PHE 103 HD2 PHE 103 91.511 -9.853 -0.669 784 HE1 PHE 103 HE1 PHE 103 93.560 -9.294 3.812 785 HE2 PHE 103 HE2 PHE 103 91.153 -7.755 0.606 786 HZ PHE 103 HZ PHE 103 92.180 -7.475 2.846 787 H LEU 104 H LEU 104 90.208 -12.617 -0.932 788 HA LEU 104 HA LEU 104 88.580 -11.031 0.891 789 HB2 LEU 104 HB3 LEU 104 88.089 -12.352 -1.796 790 HB3 LEU 104 HB2 LEU 104 86.772 -11.539 -0.917 791 HG LEU 104 HG LEU 104 89.445 -10.234 -1.595 792 HD11 LEU 104 HD11 LEU 104 88.161 -8.994 -3.316 793 HD12 LEU 104 HD12 LEU 104 86.713 -9.953 -2.925 794 HD13 LEU 104 HD13 LEU 104 88.139 -10.745 -3.638 795 HD21 LEU 104 HD21 LEU 104 88.280 -9.305 0.392 796 HD22 LEU 104 HD22 LEU 104 86.797 -9.107 -0.572 797 HD23 LEU 104 HD23 LEU 104 88.248 -8.153 -0.965 798 H GLY 105 H GLY 105 88.807 -14.469 0.154 799 HA2 GLY 105 HA3 GLY 105 86.242 -15.272 1.210 800 HA3 GLY 105 HA2 GLY 105 87.690 -16.305 1.143 801 H TYR 106 H TYR 106 89.430 -14.796 2.772 802 HA TYR 106 HA TYR 106 88.488 -15.614 5.412 803 HB2 TYR 106 HB3 TYR 106 90.887 -14.141 4.324 804 HB3 TYR 106 HB2 TYR 106 90.570 -14.100 6.075 805 HD1 TYR 106 HD1 TYR 106 91.334 -15.859 7.408 806 HD2 TYR 106 HD2 TYR 106 90.750 -16.522 3.204 807 HE1 TYR 106 HE1 TYR 106 92.284 -18.138 7.635 808 HE2 TYR 106 HE2 TYR 106 91.701 -18.802 3.432 809 HH TYR 106 HH TYR 106 92.001 -20.421 6.219 810 H PHE 107 H PHE 107 88.970 -12.410 3.847 811 HA PHE 107 HA PHE 107 87.388 -11.211 6.124 812 HB2 PHE 107 HB3 PHE 107 89.015 -9.782 3.978 813 HB3 PHE 107 HB2 PHE 107 88.338 -9.075 5.464 814 HD1 PHE 107 HD1 PHE 107 89.190 -9.883 7.708 815 HD2 PHE 107 HD2 PHE 107 91.104 -10.922 4.004 816 HE1 PHE 107 HE1 PHE 107 91.242 -10.523 8.946 817 HE2 PHE 107 HE2 PHE 107 93.154 -11.560 5.243 818 HZ PHE 107 HZ PHE 107 93.224 -11.357 7.714 819 H LYS 108 H LYS 108 85.774 -12.628 4.485 820 HA LYS 108 HA LYS 108 84.812 -10.944 2.244 821 HB2 LYS 108 HB2 LYS 108 84.714 -13.470 2.254 822 HB3 LYS 108 HB3 LYS 108 83.485 -13.366 3.537 823 HG2 LYS 108 HG2 LYS 108 82.051 -13.379 1.737 824 HG3 LYS 108 HG3 LYS 108 82.406 -11.635 1.745 825 HD2 LYS 108 HD3 LYS 108 84.174 -11.951 0.074 826 HD3 LYS 108 HD2 LYS 108 83.938 -13.715 0.120 827 HE2 LYS 108 HE3 LYS 108 81.397 -12.970 -0.413 828 HE3 LYS 108 HE2 LYS 108 82.247 -11.588 -1.145 829 HZ1 LYS 108 HZ1 LYS 108 81.965 -13.391 -2.712 830 HZ2 LYS 108 HZ2 LYS 108 83.567 -13.152 -2.406 831 HZ3 LYS 108 HZ3 LYS 108 82.780 -14.433 -1.728 832 H SER 109 H SER 109 83.998 -11.521 5.630 833 HA SER 109 HA SER 109 81.337 -10.454 5.634 834 HB2 SER 109 HB2 SER 109 83.537 -10.340 7.741 835 HB3 SER 109 HB3 SER 109 81.851 -9.853 8.041 836 HG SER 109 HG SER 109 82.248 -12.072 8.589 837 H GLY 110 H GLY 110 84.224 -8.913 4.753 838 HA2 GLY 110 HA2 GLY 110 84.151 -6.623 3.877 839 HA3 GLY 110 HA3 GLY 110 82.839 -6.251 5.021 840 H LEU 111 H LEU 111 86.162 -5.961 4.449 841 HA LEU 111 HA LEU 111 87.045 -6.029 7.255 842 HB2 LEU 111 HB2 LEU 111 88.998 -4.617 6.068 843 HB3 LEU 111 HB3 LEU 111 88.854 -6.376 5.838 844 HG LEU 111 HG LEU 111 87.310 -4.557 3.999 845 HD11 LEU 111 HD11 LEU 111 89.590 -3.580 4.056 846 HD12 LEU 111 HD12 LEU 111 89.279 -4.389 2.502 847 HD13 LEU 111 HD13 LEU 111 90.285 -5.186 3.735 848 HD21 LEU 111 HD21 LEU 111 88.854 -6.868 2.977 849 HD22 LEU 111 HD22 LEU 111 87.138 -6.456 2.750 850 HD23 LEU 111 HD23 LEU 111 87.663 -7.295 4.230 851 H LYS 112 H LYS 112 88.132 -3.214 5.642 852 HA LYS 112 HA LYS 112 86.137 -1.281 6.203 853 HB2 LYS 112 HB2 LYS 112 87.167 -2.404 8.631 854 HB3 LYS 112 HB3 LYS 112 87.815 -0.753 8.497 855 HG2 LYS 112 HG2 LYS 112 85.505 0.094 8.074 856 HG3 LYS 112 HG3 LYS 112 84.879 -1.559 8.283 857 HD2 LYS 112 HD2 LYS 112 85.289 -1.572 10.573 858 HD3 LYS 112 HD3 LYS 112 86.629 -0.407 10.446 859 HE2 LYS 112 HE3 LYS 112 83.759 0.382 9.840 860 HE3 LYS 112 HE2 LYS 112 84.421 0.447 11.491 861 HZ1 LYS 112 HZ1 LYS 112 84.685 2.544 10.344 862 HZ2 LYS 112 HZ2 LYS 112 85.549 1.826 9.136 863 HZ3 LYS 112 HZ3 LYS 112 86.162 1.886 10.666 864 H TYR 113 H TYR 113 86.943 0.180 4.779 865 HA TYR 113 HA TYR 113 89.893 0.521 4.546 866 HB2 TYR 113 HB3 TYR 113 88.849 2.427 2.901 867 HB3 TYR 113 HB2 TYR 113 89.054 0.727 2.415 868 HD1 TYR 113 HD1 TYR 113 87.131 -0.831 2.463 869 HD2 TYR 113 HD2 TYR 113 86.659 3.340 3.374 870 HE1 TYR 113 HE1 TYR 113 84.677 -1.047 2.179 871 HE2 TYR 113 HE2 TYR 113 84.205 3.123 3.094 872 HH TYR 113 HH TYR 113 82.578 0.261 3.089 873 H LYS 114 H LYS 114 90.807 1.737 6.146 874 HA LYS 114 HA LYS 114 89.336 4.258 6.954 875 HB2 LYS 114 HB2 LYS 114 90.104 2.261 8.614 876 HB3 LYS 114 HB3 LYS 114 91.613 3.205 8.594 877 HG2 LYS 114 HG2 LYS 114 90.451 4.237 10.345 878 HG3 LYS 114 HG3 LYS 114 89.980 5.259 8.966 879 HD2 LYS 114 HD2 LYS 114 87.884 4.036 8.709 880 HD3 LYS 114 HD3 LYS 114 88.370 2.865 9.959 881 HE2 LYS 114 HE2 LYS 114 86.777 4.794 10.668 882 HE3 LYS 114 HE3 LYS 114 88.192 4.473 11.697 883 HZ1 LYS 114 HZ1 LYS 114 87.704 6.860 10.934 884 HZ2 LYS 114 HZ2 LYS 114 88.385 6.400 9.504 885 HZ3 LYS 114 HZ3 LYS 114 89.262 6.321 10.899 886 H LYS 115 H LYS 115 90.457 6.221 6.883 887 HA LYS 115 HA LYS 115 92.702 6.346 5.015 888 HB2 LYS 115 HB3 LYS 115 92.722 8.765 5.589 889 HB3 LYS 115 HB2 LYS 115 91.073 8.192 5.244 890 HG2 LYS 115 HG2 LYS 115 90.706 7.896 7.707 891 HG3 LYS 115 HG3 LYS 115 92.317 8.592 8.000 892 HD2 LYS 115 HD2 LYS 115 91.673 10.726 7.288 893 HD3 LYS 115 HD3 LYS 115 90.340 10.101 6.287 894 HE2 LYS 115 HE3 LYS 115 89.818 11.279 8.603 895 HE3 LYS 115 HE2 LYS 115 88.914 9.824 8.120 896 HZ1 LYS 115 HZ1 LYS 115 89.955 9.892 10.426 897 HZ2 LYS 115 HZ2 LYS 115 90.165 8.521 9.534 898 HZ3 LYS 115 HZ3 LYS 115 91.394 9.612 9.670 899 H GLY 116 H GLY 116 94.885 6.479 5.428 900 HA2 GLY 116 HA3 GLY 116 95.732 5.846 8.213 901 HA3 GLY 116 HA2 GLY 116 96.781 5.881 6.775 902 H GLY 117 H GLY 117 97.944 7.072 8.813 903 HA2 GLY 117 HA2 GLY 117 98.851 9.513 8.262 904 HA3 GLY 117 HA3 GLY 117 97.203 9.990 8.734 905 H VAL 118 H VAL 118 99.690 7.710 10.020 906 HA VAL 118 HA VAL 118 98.939 8.608 12.777 907 HB VAL 118 HB VAL 118 100.791 6.424 11.730 908 HG11 VAL 118 HG11 VAL 118 100.678 5.754 14.254 909 HG12 VAL 118 HG12 VAL 118 100.229 7.454 14.526 910 HG13 VAL 118 HG13 VAL 118 101.794 7.056 13.776 911 HG21 VAL 118 HG21 VAL 118 98.358 6.004 11.492 912 HG22 VAL 118 HG22 VAL 118 98.128 6.361 13.220 913 HG23 VAL 118 HG23 VAL 118 99.074 4.937 12.724 914 H ALA 119 H ALA 119 101.450 9.027 10.376 915 HA ALA 119 HA ALA 119 103.419 10.047 12.343 916 HB1 ALA 119 HB1 ALA 119 104.752 10.609 10.329 917 HB2 ALA 119 HB2 ALA 119 104.160 8.933 10.257 918 HB3 ALA 119 HB3 ALA 119 103.362 10.201 9.296 919 H SER 120 H SER 120 100.792 11.308 10.415 920 HA SER 120 HA SER 120 101.745 14.087 10.447 921 HB2 SER 120 HB2 SER 120 98.971 12.903 10.001 922 HB3 SER 120 HB3 SER 120 99.388 14.618 9.771 923 HG SER 120 HG SER 120 99.544 13.393 7.808 924 H GLY 121 H GLY 121 101.060 12.160 12.911 925 HA2 GLY 121 HA2 GLY 121 99.175 13.767 14.470 926 HA3 GLY 121 HA3 GLY 121 100.241 12.493 15.108 927 H PHE 122 H PHE 122 102.745 13.552 14.285 928 HA PHE 122 HA PHE 122 103.476 15.199 16.438 929 HB2 PHE 122 HB3 PHE 122 105.508 15.541 15.334 930 HB3 PHE 122 HB2 PHE 122 104.892 14.105 14.484 931 HD1 PHE 122 HD1 PHE 122 106.416 17.160 13.941 932 HD2 PHE 122 HD2 PHE 122 103.079 14.851 12.533 933 HE1 PHE 122 HE1 PHE 122 106.451 18.414 11.802 934 HE2 PHE 122 HE2 PHE 122 103.113 16.105 10.393 935 HZ PHE 122 HZ PHE 122 104.804 17.882 10.025 936 H LYS 123 H LYS 123 101.700 16.075 13.570 937 HA LYS 123 HA LYS 123 102.102 18.755 13.122 938 HB2 LYS 123 HB2 LYS 123 100.178 17.348 12.249 939 HB3 LYS 123 HB3 LYS 123 99.333 17.666 13.782 940 HG2 LYS 123 HG3 LYS 123 99.430 20.089 13.364 941 HG3 LYS 123 HG2 LYS 123 100.355 19.813 11.869 942 HD2 LYS 123 HD2 LYS 123 98.172 20.028 11.042 943 HD3 LYS 123 HD3 LYS 123 98.313 18.263 11.229 944 HE2 LYS 123 HE2 LYS 123 97.174 18.356 13.389 945 HE3 LYS 123 HE3 LYS 123 97.144 20.135 13.335 946 HZ1 LYS 123 HZ1 LYS 123 95.054 19.187 12.615 947 HZ2 LYS 123 HZ2 LYS 123 95.802 18.338 11.415 948 HZ3 LYS 123 HZ3 LYS 123 95.774 19.986 11.364 949 H HIS 124 H HIS 124 100.877 17.366 16.137 950 HA HIS 124 HA HIS 124 99.966 19.857 17.309 951 HB2 HIS 124 HB3 HIS 124 100.811 17.159 18.358 952 HB3 HIS 124 HB2 HIS 124 100.633 18.507 19.505 953 HD2 HIS 124 HD2 HIS 124 97.918 19.875 18.957 954 HE1 HIS 124 HE1 HIS 124 96.180 16.118 18.122 955 HE2 HIS 124 HE2 HIS 124 95.665 18.555 18.683 956 H VAL 125 H VAL 125 101.132 21.569 18.036 957 HA VAL 125 HA VAL 125 104.033 21.598 17.760 958 HB VAL 125 HB VAL 125 102.368 23.524 19.428 959 HG11 VAL 125 HG11 VAL 125 104.835 23.765 19.516 960 HG12 VAL 125 HG12 VAL 125 104.090 25.134 18.656 961 HG13 VAL 125 HG13 VAL 125 104.892 23.836 17.739 962 HG21 VAL 125 HG21 VAL 125 102.379 24.776 17.094 963 HG22 VAL 125 HG22 VAL 125 102.559 23.131 16.439 964 HG23 VAL 125 HG23 VAL 125 101.141 23.543 17.433 965 H VAL 126 H VAL 126 105.630 21.274 19.280 966 HA VAL 126 HA VAL 126 104.695 20.651 22.092 967 HB VAL 126 HB VAL 126 106.962 19.228 20.635 968 HG11 VAL 126 HG11 VAL 126 107.056 19.243 23.113 969 HG12 VAL 126 HG12 VAL 126 105.393 18.613 23.179 970 HG13 VAL 126 HG13 VAL 126 106.697 17.612 22.497 971 HG21 VAL 126 HG21 VAL 126 104.802 18.763 19.508 972 HG22 VAL 126 HG22 VAL 126 105.382 17.332 20.393 973 HG23 VAL 126 HG23 VAL 126 104.078 18.332 21.075 974 HA PRO 127 HA PRO 127 107.759 24.197 21.994 975 HB2 PRO 127 HB3 PRO 127 106.392 24.455 24.666 976 HB3 PRO 127 HB2 PRO 127 106.811 25.724 23.480 977 HG2 PRO 127 HG2 PRO 127 104.296 24.822 23.779 978 HG3 PRO 127 HG3 PRO 127 104.946 25.309 22.189 979 HD2 PRO 127 HD3 PRO 127 104.378 22.565 23.254 980 HD3 PRO 127 HD2 PRO 127 104.360 23.155 21.564 981 H ASN 128 H ASN 128 109.824 23.861 22.678 982 HA ASN 128 HA ASN 128 110.579 21.623 24.304 983 HB2 ASN 128 HB3 ASN 128 112.095 24.239 23.884 984 HB3 ASN 128 HB2 ASN 128 112.797 22.694 24.419 985 HD21 ASN 128 HD21 ASN 128 111.261 24.364 21.641 986 HD22 ASN 128 HD22 ASN 128 111.816 23.216 20.442 987 H GLU 129 H GLU 129 110.508 21.308 26.473 988 HA GLU 129 HA GLU 129 109.308 23.238 28.244 989 HB2 GLU 129 HB3 GLU 129 110.041 21.739 30.056 990 HB3 GLU 129 HB2 GLU 129 109.415 20.784 28.691 991 HG2 GLU 129 HG2 GLU 129 111.837 20.621 27.869 992 HG3 GLU 129 HG3 GLU 129 112.319 21.281 29.451 993 H VAL 130 H VAL 130 112.545 22.939 27.031 994 HA VAL 130 HA VAL 130 113.943 24.212 29.234 995 HB VAL 130 HB VAL 130 114.969 22.983 27.233 996 HG11 VAL 130 HG11 VAL 130 115.284 24.178 25.176 997 HG12 VAL 130 HG12 VAL 130 113.558 24.344 25.575 998 HG13 VAL 130 HG13 VAL 130 114.677 25.694 25.883 999 HG21 VAL 130 HG21 VAL 130 116.311 24.315 28.837 1000 HG22 VAL 130 HG22 VAL 130 116.957 24.463 27.186 1001 HG23 VAL 130 HG23 VAL 130 115.991 25.784 27.885 1002 H VAL 131 H VAL 131 111.881 25.424 26.668 1003 HA VAL 131 HA VAL 131 112.707 28.106 26.421 1004 HB VAL 131 HB VAL 131 109.899 26.945 26.639 1005 HG11 VAL 131 HG11 VAL 131 109.873 29.355 27.225 1006 HG12 VAL 131 HG12 VAL 131 109.131 29.077 25.632 1007 HG13 VAL 131 HG13 VAL 131 110.785 29.725 25.742 1008 HG21 VAL 131 HG21 VAL 131 111.285 26.180 24.728 1009 HG22 VAL 131 HG22 VAL 131 109.954 27.225 24.175 1010 HG23 VAL 131 HG23 VAL 131 111.608 27.873 24.285 1011 H VAL 132 H VAL 132 110.443 26.825 28.921 1012 HA VAL 132 HA VAL 132 110.130 29.231 30.395 1013 HB VAL 132 HB VAL 132 110.449 26.455 31.614 1014 HG11 VAL 132 HG11 VAL 132 110.322 28.342 33.218 1015 HG12 VAL 132 HG12 VAL 132 108.832 28.912 32.428 1016 HG13 VAL 132 HG13 VAL 132 108.845 27.349 33.279 1017 HG21 VAL 132 HG21 VAL 132 108.894 26.403 29.681 1018 HG22 VAL 132 HG22 VAL 132 108.000 27.781 30.365 1019 HG23 VAL 132 HG23 VAL 132 108.013 26.218 31.216 1020 H GLN 133 H GLN 133 112.884 27.033 30.229 1021 HA GLN 133 HA GLN 133 114.273 28.763 32.290 1022 HB2 GLN 133 HB2 GLN 133 115.110 25.984 31.370 1023 HB3 GLN 133 HB3 GLN 133 115.686 26.883 32.795 1024 HG2 GLN 133 HG3 GLN 133 113.189 26.874 33.543 1025 HG3 GLN 133 HG2 GLN 133 112.984 25.582 32.336 1026 HE21 GLN 133 HE21 GLN 133 112.563 24.024 34.109 1027 HE22 GLN 133 HE22 GLN 133 113.896 23.423 35.070 Start of MODEL 5 1 H1 GLU 1 H1 GLU 1 106.552 -13.369 26.092 2 H2 GLU 1 H2 GLU 1 106.795 -11.904 25.376 3 H3 GLU 1 H3 GLU 1 105.354 -12.235 26.106 4 HA GLU 1 HA GLU 1 105.076 -14.109 24.467 5 HB2 GLU 1 HB2 GLU 1 104.337 -12.482 22.665 6 HB3 GLU 1 HB3 GLU 1 103.707 -12.112 24.288 7 HG2 GLU 1 HG2 GLU 1 106.283 -10.877 23.254 8 HG3 GLU 1 HG3 GLU 1 104.695 -10.142 22.927 9 H HIS 2 H HIS 2 105.824 -14.975 22.483 10 HA HIS 2 HA HIS 2 108.709 -14.489 21.990 11 HB2 HIS 2 HB2 HIS 2 106.963 -16.200 20.217 12 HB3 HIS 2 HB3 HIS 2 108.652 -16.453 20.718 13 HD2 HIS 2 HD2 HIS 2 105.421 -18.069 21.528 14 HE1 HIS 2 HE1 HIS 2 107.474 -18.107 25.218 15 HE2 HIS 2 HE2 HIS 2 105.487 -19.086 23.947 16 HA PRO 3 HA PRO 3 108.105 -11.594 18.691 17 HB2 PRO 3 HB3 PRO 3 110.416 -12.018 17.257 18 HB3 PRO 3 HB2 PRO 3 110.388 -11.171 18.831 19 HG2 PRO 3 HG2 PRO 3 111.144 -13.997 18.181 20 HG3 PRO 3 HG3 PRO 3 111.876 -12.857 19.343 21 HD2 PRO 3 HD2 PRO 3 110.140 -14.888 20.078 22 HD3 PRO 3 HD3 PRO 3 110.348 -13.372 21.005 23 H GLU 4 H GLU 4 106.270 -12.784 17.718 24 HA GLU 4 HA GLU 4 106.470 -14.964 15.919 25 HB2 GLU 4 HB3 GLU 4 104.634 -12.576 16.114 26 HB3 GLU 4 HB2 GLU 4 104.509 -13.649 14.699 27 HG2 GLU 4 HG2 GLU 4 102.986 -14.320 16.583 28 HG3 GLU 4 HG3 GLU 4 104.155 -15.588 16.144 29 H PHE 5 H PHE 5 107.516 -11.643 15.511 30 HA PHE 5 HA PHE 5 107.550 -11.298 12.730 31 HB2 PHE 5 HB2 PHE 5 108.461 -9.563 14.113 32 HB3 PHE 5 HB3 PHE 5 109.677 -10.660 14.811 33 HD1 PHE 5 HD1 PHE 5 111.838 -10.344 14.024 34 HD2 PHE 5 HD2 PHE 5 108.538 -9.652 11.360 35 HE1 PHE 5 HE1 PHE 5 113.424 -9.739 12.217 36 HE2 PHE 5 HE2 PHE 5 110.126 -9.043 9.554 37 HZ PHE 5 HZ PHE 5 112.568 -9.088 9.982 38 H LEU 6 H LEU 6 109.766 -13.296 14.692 39 HA LEU 6 HA LEU 6 111.092 -14.231 12.169 40 HB2 LEU 6 HB2 LEU 6 112.448 -13.633 14.215 41 HB3 LEU 6 HB3 LEU 6 111.681 -14.997 15.062 42 HG LEU 6 HG LEU 6 112.522 -16.527 13.255 43 HD11 LEU 6 HD11 LEU 6 112.714 -14.822 11.464 44 HD12 LEU 6 HD12 LEU 6 114.022 -14.022 12.367 45 HD13 LEU 6 HD13 LEU 6 114.263 -15.661 11.716 46 HD21 LEU 6 HD21 LEU 6 114.890 -16.473 13.995 47 HD22 LEU 6 HD22 LEU 6 113.784 -16.216 15.366 48 HD23 LEU 6 HD23 LEU 6 114.646 -14.835 14.648 49 H LYS 7 H LYS 7 108.933 -15.323 14.753 50 HA LYS 7 HA LYS 7 108.864 -18.053 13.469 51 HB2 LYS 7 HB2 LYS 7 107.521 -17.213 16.065 52 HB3 LYS 7 HB3 LYS 7 107.919 -18.858 15.514 53 HG2 LYS 7 HG2 LYS 7 110.325 -18.354 15.679 54 HG3 LYS 7 HG3 LYS 7 109.956 -16.681 16.165 55 HD2 LYS 7 HD3 LYS 7 108.788 -17.518 18.179 56 HD3 LYS 7 HD2 LYS 7 109.134 -19.194 17.690 57 HE2 LYS 7 HE2 LYS 7 110.734 -18.081 19.413 58 HE3 LYS 7 HE3 LYS 7 111.467 -18.937 18.035 59 HZ1 LYS 7 HZ1 LYS 7 112.238 -16.569 18.602 60 HZ2 LYS 7 HZ2 LYS 7 110.863 -16.079 17.834 61 HZ3 LYS 7 HZ3 LYS 7 111.993 -16.963 17.019 62 H ALA 8 H ALA 8 107.638 -15.693 12.230 63 HA ALA 8 HA ALA 8 104.932 -15.237 12.634 64 HB1 ALA 8 HB1 ALA 8 106.607 -15.563 10.163 65 HB2 ALA 8 HB2 ALA 8 105.690 -14.150 10.736 66 HB3 ALA 8 HB3 ALA 8 104.841 -15.505 9.955 67 H GLY 9 H GLY 9 102.972 -16.314 12.278 68 HA2 GLY 9 HA2 GLY 9 101.587 -18.230 12.211 69 HA3 GLY 9 HA3 GLY 9 102.586 -18.722 10.822 70 H LYS 10 H LYS 10 103.090 -18.438 14.383 71 HA LYS 10 HA LYS 10 105.016 -20.510 14.603 72 HB2 LYS 10 HB2 LYS 10 103.491 -18.915 16.373 73 HB3 LYS 10 HB3 LYS 10 103.135 -20.596 16.837 74 HG2 LYS 10 HG3 LYS 10 105.944 -19.474 16.439 75 HG3 LYS 10 HG2 LYS 10 105.142 -19.643 18.019 76 HD2 LYS 10 HD2 LYS 10 104.767 -22.144 17.208 77 HD3 LYS 10 HD3 LYS 10 106.147 -21.783 16.143 78 HE2 LYS 10 HE2 LYS 10 107.186 -22.618 18.091 79 HE3 LYS 10 HE3 LYS 10 107.276 -20.855 18.316 80 HZ1 LYS 10 HZ1 LYS 10 106.456 -21.962 20.287 81 HZ2 LYS 10 HZ2 LYS 10 105.284 -20.990 19.655 82 HZ3 LYS 10 HZ3 LYS 10 105.200 -22.624 19.447 83 H GLU 11 H GLU 11 101.536 -20.723 14.113 84 HA GLU 11 HA GLU 11 101.864 -23.681 13.762 85 HB2 GLU 11 HB3 GLU 11 99.482 -23.686 15.072 86 HB3 GLU 11 HB2 GLU 11 101.038 -23.956 15.893 87 HG2 GLU 11 HG2 GLU 11 101.109 -21.780 16.759 88 HG3 GLU 11 HG3 GLU 11 100.025 -21.136 15.503 89 HA PRO 12 HA PRO 12 99.267 -23.390 10.229 90 HB2 PRO 12 HB2 PRO 12 97.292 -25.118 11.725 91 HB3 PRO 12 HB3 PRO 12 97.944 -25.306 10.072 92 HG2 PRO 12 HG3 PRO 12 98.822 -26.765 12.179 93 HG3 PRO 12 HG2 PRO 12 99.862 -26.321 10.799 94 HD2 PRO 12 HD3 PRO 12 99.929 -25.341 13.600 95 HD3 PRO 12 HD2 PRO 12 101.195 -25.243 12.339 96 H GLY 13 H GLY 13 98.061 -21.611 9.739 97 HA2 GLY 13 HA2 GLY 13 95.458 -21.020 10.407 98 HA3 GLY 13 HA3 GLY 13 96.325 -20.417 11.839 99 H LEU 14 H LEU 14 95.235 -18.364 10.867 100 HA LEU 14 HA LEU 14 97.122 -17.171 8.818 101 HB2 LEU 14 HB2 LEU 14 94.883 -17.229 7.916 102 HB3 LEU 14 HB3 LEU 14 94.192 -16.603 9.432 103 HG LEU 14 HG LEU 14 96.311 -14.887 8.262 104 HD11 LEU 14 HD11 LEU 14 95.228 -15.696 6.182 105 HD12 LEU 14 HD12 LEU 14 93.636 -15.243 6.837 106 HD13 LEU 14 HD13 LEU 14 94.844 -13.984 6.482 107 HD21 LEU 14 HD21 LEU 14 94.892 -14.243 10.193 108 HD22 LEU 14 HD22 LEU 14 93.440 -14.395 9.175 109 HD23 LEU 14 HD23 LEU 14 94.647 -13.137 8.820 110 H GLN 15 H GLN 15 98.058 -15.167 9.292 111 HA GLN 15 HA GLN 15 97.329 -13.968 11.968 112 HB2 GLN 15 HB2 GLN 15 100.144 -14.497 10.917 113 HB3 GLN 15 HB3 GLN 15 99.755 -13.588 12.397 114 HG2 GLN 15 HG2 GLN 15 98.311 -15.867 12.831 115 HG3 GLN 15 HG3 GLN 15 99.662 -16.525 11.878 116 HE21 GLN 15 HE21 GLN 15 101.743 -16.637 12.867 117 HE22 GLN 15 HE22 GLN 15 102.034 -16.128 14.515 118 H ILE 16 H ILE 16 97.504 -11.704 12.054 119 HA ILE 16 HA ILE 16 98.150 -10.404 9.394 120 HB ILE 16 HB ILE 16 96.187 -9.453 11.529 121 HG12 ILE 16 HG12 ILE 16 95.363 -10.375 8.785 122 HG13 ILE 16 HG13 ILE 16 95.735 -11.613 10.009 123 HG21 ILE 16 HG21 ILE 16 95.499 -7.854 9.763 124 HG22 ILE 16 HG22 ILE 16 97.217 -7.649 10.178 125 HG23 ILE 16 HG23 ILE 16 96.759 -8.503 8.686 126 HD11 ILE 16 HD11 ILE 16 93.327 -11.017 10.048 127 HD12 ILE 16 HD12 ILE 16 94.124 -10.553 11.569 128 HD13 ILE 16 HD13 ILE 16 93.753 -9.315 10.345 129 H TRP 17 H TRP 17 99.533 -8.648 9.425 130 HA TRP 17 HA TRP 17 100.303 -7.519 12.103 131 HB2 TRP 17 HB2 TRP 17 102.318 -8.570 10.065 132 HB3 TRP 17 HB3 TRP 17 102.702 -7.772 11.609 133 HD1 TRP 17 HD1 TRP 17 100.909 -9.131 13.638 134 HE1 TRP 17 HE1 TRP 17 101.072 -11.639 14.213 135 HE3 TRP 17 HE3 TRP 17 103.212 -10.791 9.391 136 HZ2 TRP 17 HZ2 TRP 17 102.077 -14.042 12.973 137 HZ3 TRP 17 HZ3 TRP 17 103.759 -13.190 9.116 138 HH2 TRP 17 HH2 TRP 17 103.195 -14.816 10.899 139 H ARG 18 H ARG 18 99.842 -5.388 11.792 140 HA ARG 18 HA ARG 18 100.008 -4.188 9.099 141 HB2 ARG 18 HB2 ARG 18 98.326 -3.501 10.852 142 HB3 ARG 18 HB3 ARG 18 99.666 -2.798 11.790 143 HG2 ARG 18 HG3 ARG 18 100.250 -1.476 9.651 144 HG3 ARG 18 HG2 ARG 18 98.652 -1.972 9.045 145 HD2 ARG 18 HD2 ARG 18 99.361 -0.037 11.206 146 HD3 ARG 18 HD3 ARG 18 97.977 -0.040 10.086 147 HE ARG 18 HE ARG 18 97.347 -2.172 11.698 148 HH11 ARG 18 HH11 ARG 18 96.333 -2.003 13.711 149 HH12 ARG 18 HH12 ARG 18 96.514 -0.546 14.663 150 HH21 ARG 18 HH21 ARG 18 98.546 1.037 12.321 151 HH22 ARG 18 HH22 ARG 18 97.761 1.166 13.879 152 H VAL 19 H VAL 19 101.618 -2.856 8.294 153 HA VAL 19 HA VAL 19 104.199 -2.941 9.769 154 HB VAL 19 HB VAL 19 103.921 -1.309 7.282 155 HG11 VAL 19 HG11 VAL 19 106.106 -1.786 8.353 156 HG12 VAL 19 HG12 VAL 19 106.012 -2.519 6.734 157 HG13 VAL 19 HG13 VAL 19 105.807 -3.532 8.183 158 HG21 VAL 19 HG21 VAL 19 103.985 -3.510 5.948 159 HG22 VAL 19 HG22 VAL 19 102.409 -3.045 6.633 160 HG23 VAL 19 HG23 VAL 19 103.390 -4.299 7.429 161 H GLU 20 H GLU 20 105.256 -1.156 10.637 162 HA GLU 20 HA GLU 20 104.100 1.555 10.310 163 HB2 GLU 20 HB3 GLU 20 102.747 0.250 12.142 164 HB3 GLU 20 HB2 GLU 20 104.204 0.474 13.139 165 HG2 GLU 20 HG2 GLU 20 104.088 2.916 12.780 166 HG3 GLU 20 HG3 GLU 20 102.649 2.705 11.754 167 H LYS 21 H LYS 21 105.847 2.862 10.214 168 HA LYS 21 HA LYS 21 108.154 3.440 10.383 169 HB2 LYS 21 HB3 LYS 21 107.102 2.993 13.178 170 HB3 LYS 21 HB2 LYS 21 108.821 3.390 12.948 171 HG2 LYS 21 HG2 LYS 21 106.734 5.032 11.516 172 HG3 LYS 21 HG3 LYS 21 107.027 5.326 13.246 173 HD2 LYS 21 HD3 LYS 21 109.453 5.622 12.770 174 HD3 LYS 21 HD2 LYS 21 109.132 5.370 11.037 175 HE2 LYS 21 HE2 LYS 21 107.334 7.310 11.462 176 HE3 LYS 21 HE3 LYS 21 108.445 7.714 12.793 177 HZ1 LYS 21 HZ1 LYS 21 109.053 8.836 10.753 178 HZ2 LYS 21 HZ2 LYS 21 109.207 7.400 9.957 179 HZ3 LYS 21 HZ3 LYS 21 110.237 7.774 11.189 180 H PHE 22 H PHE 22 107.457 0.462 10.073 181 HA PHE 22 HA PHE 22 108.802 -1.474 9.846 182 HB2 PHE 22 HB3 PHE 22 111.170 -0.118 11.118 183 HB3 PHE 22 HB2 PHE 22 111.112 -1.236 9.734 184 HD1 PHE 22 HD1 PHE 22 109.560 -0.270 7.712 185 HD2 PHE 22 HD2 PHE 22 111.664 2.095 10.616 186 HE1 PHE 22 HE1 PHE 22 109.542 1.661 6.155 187 HE2 PHE 22 HE2 PHE 22 111.647 4.024 9.059 188 HZ PHE 22 HZ PHE 22 110.587 3.806 6.827 189 H ASP 23 H ASP 23 107.165 -1.163 12.102 190 HA ASP 23 HA ASP 23 108.871 -2.520 14.203 191 HB2 ASP 23 HB2 ASP 23 106.644 -0.471 14.541 192 HB3 ASP 23 HB3 ASP 23 107.207 -1.511 15.872 193 H LEU 24 H LEU 24 106.134 -2.605 12.138 194 HA LEU 24 HA LEU 24 104.423 -4.215 11.898 195 HB2 LEU 24 HB3 LEU 24 106.675 -5.650 13.225 196 HB3 LEU 24 HB2 LEU 24 105.080 -6.428 13.365 197 HG LEU 24 HG LEU 24 104.805 -6.223 10.882 198 HD11 LEU 24 HD11 LEU 24 106.312 -4.280 10.560 199 HD12 LEU 24 HD12 LEU 24 107.707 -5.287 11.016 200 HD13 LEU 24 HD13 LEU 24 106.799 -5.644 9.527 201 HD21 LEU 24 HD21 LEU 24 105.707 -8.299 11.894 202 HD22 LEU 24 HD22 LEU 24 107.354 -7.632 11.794 203 HD23 LEU 24 HD23 LEU 24 106.446 -7.989 10.305 204 H VAL 25 H VAL 25 102.446 -4.343 12.863 205 HA VAL 25 HA VAL 25 102.290 -4.610 15.835 206 HB VAL 25 HB VAL 25 101.051 -2.253 14.342 207 HG11 VAL 25 HG11 VAL 25 99.664 -3.116 16.207 208 HG12 VAL 25 HG12 VAL 25 101.068 -3.017 17.296 209 HG13 VAL 25 HG13 VAL 25 100.366 -1.531 16.612 210 HG21 VAL 25 HG21 VAL 25 102.601 -0.896 15.746 211 HG22 VAL 25 HG22 VAL 25 103.484 -1.985 14.649 212 HG23 VAL 25 HG23 VAL 25 103.324 -2.396 16.374 213 HA PRO 26 HA PRO 26 99.156 -7.379 14.068 214 HB2 PRO 26 HB2 PRO 26 98.340 -7.306 16.973 215 HB3 PRO 26 HB3 PRO 26 98.551 -8.707 15.884 216 HG2 PRO 26 HG3 PRO 26 100.378 -8.053 17.740 217 HG3 PRO 26 HG2 PRO 26 100.832 -8.753 16.162 218 HD2 PRO 26 HD3 PRO 26 101.153 -5.953 17.171 219 HD3 PRO 26 HD2 PRO 26 102.103 -6.828 15.933 220 H VAL 27 H VAL 27 97.344 -6.630 13.074 221 HA VAL 27 HA VAL 27 96.104 -4.122 13.673 222 HB VAL 27 HB VAL 27 95.830 -5.395 11.534 223 HG11 VAL 27 HG11 VAL 27 94.611 -7.384 11.391 224 HG12 VAL 27 HG12 VAL 27 95.399 -7.583 12.974 225 HG13 VAL 27 HG13 VAL 27 93.702 -7.054 12.886 226 HG21 VAL 27 HG21 VAL 27 93.422 -4.880 11.234 227 HG22 VAL 27 HG22 VAL 27 94.245 -3.585 12.136 228 HG23 VAL 27 HG23 VAL 27 93.227 -4.763 12.999 229 HA PRO 28 HA PRO 28 93.984 -4.752 17.536 230 HB2 PRO 28 HB3 PRO 28 91.788 -3.294 16.063 231 HB3 PRO 28 HB2 PRO 28 92.449 -2.991 17.695 232 HG2 PRO 28 HG3 PRO 28 93.101 -1.493 15.540 233 HG3 PRO 28 HG2 PRO 28 94.234 -1.797 16.884 234 HD2 PRO 28 HD2 PRO 28 94.307 -2.823 14.095 235 HD3 PRO 28 HD3 PRO 28 95.615 -2.748 15.313 236 H THR 29 H THR 29 93.375 -6.893 17.744 237 HA THR 29 HA THR 29 91.709 -8.335 15.906 238 HB THR 29 HB THR 29 92.252 -8.692 18.880 239 HG1 THR 29 HG1 THR 29 93.516 -10.427 18.004 240 HG21 THR 29 HG21 THR 29 91.338 -11.063 18.394 241 HG22 THR 29 HG22 THR 29 90.144 -9.757 18.585 242 HG23 THR 29 HG23 THR 29 90.573 -10.339 16.959 243 H ASN 30 H ASN 30 90.917 -6.046 18.446 244 HA ASN 30 HA ASN 30 88.234 -6.758 19.031 245 HB2 ASN 30 HB3 ASN 30 89.530 -4.027 18.665 246 HB3 ASN 30 HB2 ASN 30 87.870 -4.239 19.269 247 HD21 ASN 30 HD21 ASN 30 89.926 -3.065 20.907 248 HD22 ASN 30 HD22 ASN 30 90.265 -4.174 22.217 249 H LEU 31 H LEU 31 89.459 -4.778 16.291 250 HA LEU 31 HA LEU 31 86.724 -4.725 15.112 251 HB2 LEU 31 HB2 LEU 31 89.419 -3.664 14.160 252 HB3 LEU 31 HB3 LEU 31 87.902 -3.477 13.250 253 HG LEU 31 HG LEU 31 87.044 -2.558 15.629 254 HD11 LEU 31 HD11 LEU 31 89.220 -2.961 16.751 255 HD12 LEU 31 HD12 LEU 31 90.025 -1.902 15.568 256 HD13 LEU 31 HD13 LEU 31 88.835 -1.224 16.706 257 HD21 LEU 31 HD21 LEU 31 87.005 -1.338 13.468 258 HD22 LEU 31 HD22 LEU 31 87.544 -0.277 14.793 259 HD23 LEU 31 HD23 LEU 31 88.733 -0.954 13.655 260 H TYR 32 H TYR 32 89.970 -5.909 14.094 261 HA TYR 32 HA TYR 32 90.512 -7.635 12.572 262 HB2 TYR 32 HB2 TYR 32 89.310 -8.903 14.442 263 HB3 TYR 32 HB3 TYR 32 87.850 -8.847 13.425 264 HD1 TYR 32 HD1 TYR 32 87.561 -10.373 11.640 265 HD2 TYR 32 HD2 TYR 32 91.428 -9.947 13.461 266 HE1 TYR 32 HE1 TYR 32 88.382 -12.323 10.351 267 HE2 TYR 32 HE2 TYR 32 92.248 -11.902 12.176 268 HH TYR 32 HH TYR 32 90.301 -14.099 10.685 269 H GLY 33 H GLY 33 90.319 -6.469 10.621 270 HA2 GLY 33 HA2 GLY 33 89.191 -7.056 8.392 271 HA3 GLY 33 HA3 GLY 33 87.644 -6.791 9.231 272 H ASP 34 H ASP 34 89.605 -4.585 10.623 273 HA ASP 34 HA ASP 34 88.805 -2.482 8.602 274 HB2 ASP 34 HB3 ASP 34 87.903 -2.415 11.017 275 HB3 ASP 34 HB2 ASP 34 89.566 -2.016 11.509 276 H PHE 35 H PHE 35 90.406 -1.320 7.606 277 HA PHE 35 HA PHE 35 93.109 -1.237 8.901 278 HB2 PHE 35 HB2 PHE 35 93.371 -1.768 6.037 279 HB3 PHE 35 HB3 PHE 35 94.143 -2.593 7.412 280 HD1 PHE 35 HD1 PHE 35 92.854 -4.386 8.648 281 HD2 PHE 35 HD2 PHE 35 91.492 -2.721 4.931 282 HE1 PHE 35 HE1 PHE 35 91.347 -6.330 8.329 283 HE2 PHE 35 HE2 PHE 35 89.982 -4.662 4.614 284 HZ PHE 35 HZ PHE 35 89.908 -6.467 6.314 285 H PHE 36 H PHE 36 94.584 0.286 7.635 286 HA PHE 36 HA PHE 36 92.901 2.598 6.695 287 HB2 PHE 36 HB2 PHE 36 95.881 2.756 7.137 288 HB3 PHE 36 HB3 PHE 36 94.635 4.002 7.387 289 HD1 PHE 36 HD1 PHE 36 92.650 2.220 8.901 290 HD2 PHE 36 HD2 PHE 36 96.884 2.818 9.321 291 HE1 PHE 36 HE1 PHE 36 92.503 1.590 11.295 292 HE2 PHE 36 HE2 PHE 36 96.735 2.188 11.716 293 HZ PHE 36 HZ PHE 36 94.545 1.574 12.702 294 H THR 37 H THR 37 92.750 2.956 4.546 295 HA THR 37 HA THR 37 94.131 1.364 2.591 296 HB THR 37 HB THR 37 93.353 3.139 0.969 297 HG1 THR 37 HG1 THR 37 92.090 4.833 1.924 298 HG21 THR 37 HG21 THR 37 90.942 2.770 1.404 299 HG22 THR 37 HG22 THR 37 91.322 2.236 3.058 300 HG23 THR 37 HG23 THR 37 91.874 1.276 1.665 301 H GLY 38 H GLY 38 95.041 4.336 4.243 302 HA2 GLY 38 HA3 GLY 38 97.251 4.857 2.315 303 HA3 GLY 38 HA2 GLY 38 96.892 5.796 3.784 304 H ASP 39 H ASP 39 97.095 2.292 3.913 305 HA ASP 39 HA ASP 39 99.904 2.474 4.967 306 HB2 ASP 39 HB2 ASP 39 98.154 2.708 6.854 307 HB3 ASP 39 HB3 ASP 39 97.733 1.013 6.512 308 H ALA 40 H ALA 40 100.152 -0.143 5.878 309 HA ALA 40 HA ALA 40 99.155 -1.846 3.605 310 HB1 ALA 40 HB1 ALA 40 101.430 -2.772 3.262 311 HB2 ALA 40 HB2 ALA 40 102.075 -1.629 4.464 312 HB3 ALA 40 HB3 ALA 40 101.395 -1.023 2.935 313 H TYR 41 H TYR 41 98.777 -3.977 4.204 314 HA TYR 41 HA TYR 41 99.542 -4.674 7.051 315 HB2 TYR 41 HB3 TYR 41 96.954 -5.173 5.535 316 HB3 TYR 41 HB2 TYR 41 97.393 -6.088 6.997 317 HD1 TYR 41 HD1 TYR 41 96.766 -5.234 9.072 318 HD2 TYR 41 HD2 TYR 41 97.203 -2.539 5.757 319 HE1 TYR 41 HE1 TYR 41 95.961 -3.363 10.487 320 HE2 TYR 41 HE2 TYR 41 96.398 -0.668 7.172 321 HH TYR 41 HH TYR 41 94.742 -0.714 9.549 322 H VAL 42 H VAL 42 100.680 -6.533 7.254 323 HA VAL 42 HA VAL 42 100.936 -8.249 4.791 324 HB VAL 42 HB VAL 42 102.608 -8.241 7.344 325 HG11 VAL 42 HG11 VAL 42 102.558 -10.342 5.905 326 HG12 VAL 42 HG12 VAL 42 104.162 -9.593 6.082 327 HG13 VAL 42 HG13 VAL 42 103.233 -9.362 4.582 328 HG21 VAL 42 HG21 VAL 42 102.752 -6.081 6.134 329 HG22 VAL 42 HG22 VAL 42 103.119 -6.951 4.625 330 HG23 VAL 42 HG23 VAL 42 104.269 -7.000 5.983 331 H ILE 43 H ILE 43 100.279 -10.383 4.803 332 HA ILE 43 HA ILE 43 99.315 -11.483 7.448 333 HB ILE 43 HB ILE 43 97.791 -12.193 4.965 334 HG12 ILE 43 HG12 ILE 43 97.344 -9.591 6.487 335 HG13 ILE 43 HG13 ILE 43 98.097 -9.693 4.878 336 HG21 ILE 43 HG21 ILE 43 95.947 -12.304 6.565 337 HG22 ILE 43 HG22 ILE 43 97.348 -13.168 7.241 338 HG23 ILE 43 HG23 ILE 43 96.946 -11.534 7.821 339 HD11 ILE 43 HD11 ILE 43 95.678 -9.184 4.698 340 HD12 ILE 43 HD12 ILE 43 95.297 -10.671 5.599 341 HD13 ILE 43 HD13 ILE 43 96.050 -10.773 3.989 342 H LEU 44 H LEU 44 99.548 -13.712 7.685 343 HA LEU 44 HA LEU 44 100.952 -15.119 5.404 344 HB2 LEU 44 HB3 LEU 44 101.885 -14.584 8.145 345 HB3 LEU 44 HB2 LEU 44 101.905 -16.318 7.746 346 HG LEU 44 HG LEU 44 103.080 -15.671 5.565 347 HD11 LEU 44 HD11 LEU 44 104.216 -13.466 5.561 348 HD12 LEU 44 HD12 LEU 44 102.447 -13.275 5.600 349 HD13 LEU 44 HD13 LEU 44 103.400 -13.044 7.086 350 HD21 LEU 44 HD21 LEU 44 104.280 -16.641 7.506 351 HD22 LEU 44 HD22 LEU 44 105.286 -15.436 6.668 352 HD23 LEU 44 HD23 LEU 44 104.478 -15.013 8.197 353 H LYS 45 H LYS 45 100.052 -17.073 4.899 354 HA LYS 45 HA LYS 45 98.055 -18.177 6.891 355 HB2 LYS 45 HB2 LYS 45 97.534 -17.377 4.329 356 HB3 LYS 45 HB3 LYS 45 97.948 -19.086 4.052 357 HG2 LYS 45 HG3 LYS 45 96.279 -19.792 5.709 358 HG3 LYS 45 HG2 LYS 45 95.912 -18.094 6.097 359 HD2 LYS 45 HD2 LYS 45 94.220 -18.970 4.548 360 HD3 LYS 45 HD3 LYS 45 95.206 -17.739 3.723 361 HE2 LYS 45 HE2 LYS 45 96.336 -19.322 2.421 362 HE3 LYS 45 HE3 LYS 45 96.034 -20.640 3.579 363 HZ1 LYS 45 HZ1 LYS 45 94.648 -20.839 1.623 364 HZ2 LYS 45 HZ2 LYS 45 93.993 -19.347 1.881 365 HZ3 LYS 45 HZ3 LYS 45 93.713 -20.568 2.954 366 H THR 46 H THR 46 99.488 -19.523 8.014 367 HA THR 46 HA THR 46 101.284 -21.370 6.576 368 HB THR 46 HB THR 46 100.397 -21.587 9.476 369 HG1 THR 46 HG1 THR 46 101.147 -19.599 9.600 370 HG21 THR 46 HG21 THR 46 101.784 -23.416 8.683 371 HG22 THR 46 HG22 THR 46 102.926 -22.282 7.924 372 HG23 THR 46 HG23 THR 46 102.796 -22.360 9.698 373 H VAL 47 H VAL 47 100.275 -22.920 5.355 374 HA VAL 47 HA VAL 47 97.894 -24.315 6.557 375 HB VAL 47 HB VAL 47 98.798 -25.091 3.846 376 HG11 VAL 47 HG11 VAL 47 96.631 -25.766 4.846 377 HG12 VAL 47 HG12 VAL 47 96.385 -24.781 3.383 378 HG13 VAL 47 HG13 VAL 47 96.168 -24.053 4.993 379 HG21 VAL 47 HG21 VAL 47 97.847 -22.932 2.875 380 HG22 VAL 47 HG22 VAL 47 99.441 -22.778 3.651 381 HG23 VAL 47 HG23 VAL 47 97.978 -22.235 4.508 382 H GLN 48 H GLN 48 97.846 -26.727 6.249 383 HA GLN 48 HA GLN 48 100.640 -27.864 6.540 384 HB2 GLN 48 HB3 GLN 48 99.326 -27.839 8.680 385 HB3 GLN 48 HB2 GLN 48 98.080 -28.835 7.889 386 HG2 GLN 48 HG2 GLN 48 99.525 -30.697 7.683 387 HG3 GLN 48 HG3 GLN 48 100.985 -29.703 7.905 388 HE21 GLN 48 HE21 GLN 48 101.718 -29.306 10.052 389 HE22 GLN 48 HE22 GLN 48 100.902 -29.939 11.464 390 H LEU 49 H LEU 49 101.084 -29.739 5.390 391 HA LEU 49 HA LEU 49 99.184 -30.388 3.215 392 HB2 LEU 49 HB3 LEU 49 101.832 -31.689 3.997 393 HB3 LEU 49 HB2 LEU 49 100.950 -31.949 2.473 394 HG LEU 49 HG LEU 49 101.651 -29.133 3.305 395 HD11 LEU 49 HD11 LEU 49 103.756 -30.424 3.549 396 HD12 LEU 49 HD12 LEU 49 103.531 -31.097 1.917 397 HD13 LEU 49 HD13 LEU 49 103.823 -29.354 2.128 398 HD21 LEU 49 HD21 LEU 49 100.190 -29.560 1.347 399 HD22 LEU 49 HD22 LEU 49 101.451 -30.593 0.632 400 HD23 LEU 49 HD23 LEU 49 101.743 -28.850 0.843 401 H ARG 50 H ARG 50 100.971 -33.006 4.702 402 HA ARG 50 HA ARG 50 98.435 -34.043 5.948 403 HB2 ARG 50 HB2 ARG 50 100.181 -35.793 4.179 404 HB3 ARG 50 HB3 ARG 50 98.551 -36.137 4.807 405 HG2 ARG 50 HG3 ARG 50 97.612 -34.333 3.418 406 HG3 ARG 50 HG2 ARG 50 99.239 -33.918 2.828 407 HD2 ARG 50 HD2 ARG 50 98.260 -36.756 2.536 408 HD3 ARG 50 HD3 ARG 50 97.660 -35.517 1.407 409 HE ARG 50 HE ARG 50 100.386 -35.083 1.318 410 HH11 ARG 50 HH11 ARG 50 101.800 -36.235 -0.019 411 HH12 ARG 50 HH12 ARG 50 101.389 -37.855 -0.536 412 HH21 ARG 50 HH21 ARG 50 98.353 -37.906 1.167 413 HH22 ARG 50 HH22 ARG 50 99.447 -38.797 0.132 414 H ASN 51 H ASN 51 101.957 -34.205 5.549 415 HA ASN 51 HA ASN 51 102.364 -34.693 8.379 416 HB2 ASN 51 HB2 ASN 51 101.524 -36.950 7.843 417 HB3 ASN 51 HB3 ASN 51 102.721 -37.099 6.533 418 HD21 ASN 51 HD21 ASN 51 102.345 -36.886 10.096 419 HD22 ASN 51 HD22 ASN 51 103.935 -37.519 10.459 420 H GLY 52 H GLY 52 103.333 -33.020 6.168 421 HA2 GLY 52 HA2 GLY 52 106.243 -33.863 6.222 422 HA3 GLY 52 HA3 GLY 52 105.508 -33.023 4.837 423 H ASN 53 H ASN 53 104.978 -30.783 5.039 424 HA ASN 53 HA ASN 53 105.970 -29.460 7.563 425 HB2 ASN 53 HB2 ASN 53 106.712 -28.695 4.704 426 HB3 ASN 53 HB3 ASN 53 107.085 -27.720 6.146 427 HD21 ASN 53 HD21 ASN 53 107.665 -30.956 4.650 428 HD22 ASN 53 HD22 ASN 53 109.176 -31.235 5.486 429 H LEU 54 H LEU 54 105.629 -26.802 6.401 430 HA LEU 54 HA LEU 54 102.664 -26.816 5.828 431 HB2 LEU 54 HB3 LEU 54 103.209 -24.496 7.373 432 HB3 LEU 54 HB2 LEU 54 102.251 -25.914 7.859 433 HG LEU 54 HG LEU 54 104.402 -27.034 8.570 434 HD11 LEU 54 HD11 LEU 54 105.888 -24.531 8.846 435 HD12 LEU 54 HD12 LEU 54 105.553 -24.895 7.137 436 HD13 LEU 54 HD13 LEU 54 106.412 -26.082 8.147 437 HD21 LEU 54 HD21 LEU 54 104.637 -25.696 10.646 438 HD22 LEU 54 HD22 LEU 54 102.926 -25.883 10.196 439 HD23 LEU 54 HD23 LEU 54 103.767 -24.348 9.875 440 H GLN 55 H GLN 55 101.986 -24.487 5.121 441 HA GLN 55 HA GLN 55 104.257 -23.195 3.604 442 HB2 GLN 55 HB3 GLN 55 102.713 -24.824 2.234 443 HB3 GLN 55 HB2 GLN 55 101.519 -23.509 2.353 444 HG2 GLN 55 HG2 GLN 55 103.215 -21.929 1.408 445 HG3 GLN 55 HG3 GLN 55 104.342 -23.293 1.213 446 HE21 GLN 55 HE21 GLN 55 100.775 -23.322 0.666 447 HE22 GLN 55 HE22 GLN 55 100.892 -23.698 -1.039 448 H TYR 56 H TYR 56 104.322 -21.069 4.062 449 HA TYR 56 HA TYR 56 101.882 -19.790 5.265 450 HB2 TYR 56 HB2 TYR 56 104.682 -18.635 4.897 451 HB3 TYR 56 HB3 TYR 56 103.391 -18.008 5.948 452 HD1 TYR 56 HD1 TYR 56 103.367 -18.639 8.192 453 HD2 TYR 56 HD2 TYR 56 105.368 -21.156 5.344 454 HE1 TYR 56 HE1 TYR 56 104.159 -20.097 10.036 455 HE2 TYR 56 HE2 TYR 56 106.153 -22.616 7.187 456 HH TYR 56 HH TYR 56 104.980 -22.927 9.946 457 H ASP 57 H ASP 57 100.590 -18.503 4.017 458 HA ASP 57 HA ASP 57 101.632 -17.754 1.296 459 HB2 ASP 57 HB2 ASP 57 98.842 -17.750 2.520 460 HB3 ASP 57 HB3 ASP 57 99.205 -17.114 0.897 461 H LEU 58 H LEU 58 102.471 -15.751 1.051 462 HA LEU 58 HA LEU 58 102.025 -13.729 3.176 463 HB2 LEU 58 HB2 LEU 58 103.435 -13.115 0.584 464 HB3 LEU 58 HB3 LEU 58 103.819 -12.577 2.237 465 HG LEU 58 HG LEU 58 104.178 -15.399 1.136 466 HD11 LEU 58 HD11 LEU 58 105.777 -13.225 0.685 467 HD12 LEU 58 HD12 LEU 58 106.387 -14.892 0.806 468 HD13 LEU 58 HD13 LEU 58 106.455 -13.814 2.221 469 HD21 LEU 58 HD21 LEU 58 105.524 -15.424 3.452 470 HD22 LEU 58 HD22 LEU 58 103.786 -15.803 3.386 471 HD23 LEU 58 HD23 LEU 58 104.325 -14.180 3.880 472 H HIS 59 H HIS 59 100.852 -11.841 2.993 473 HA HIS 59 HA HIS 59 99.616 -11.198 0.337 474 HB2 HIS 59 HB2 HIS 59 97.864 -11.287 2.809 475 HB3 HIS 59 HB3 HIS 59 97.377 -11.246 1.099 476 HD2 HIS 59 HD2 HIS 59 98.817 -13.875 3.695 477 HE1 HIS 59 HE1 HIS 59 97.304 -15.956 0.345 478 H TYR 60 H TYR 60 100.383 -9.137 0.114 479 HA TYR 60 HA TYR 60 100.356 -7.390 2.567 480 HB2 TYR 60 HB2 TYR 60 101.486 -5.844 0.603 481 HB3 TYR 60 HB3 TYR 60 102.409 -6.902 1.694 482 HD1 TYR 60 HD1 TYR 60 102.368 -9.502 0.872 483 HD2 TYR 60 HD2 TYR 60 101.937 -6.055 -1.653 484 HE1 TYR 60 HE1 TYR 60 103.133 -10.832 -1.076 485 HE2 TYR 60 HE2 TYR 60 102.700 -7.384 -3.600 486 HH TYR 60 HH TYR 60 104.187 -9.538 -3.914 487 H TRP 61 H TRP 61 98.536 -6.240 2.840 488 HA TRP 61 HA TRP 61 96.811 -5.678 0.464 489 HB2 TRP 61 HB3 TRP 61 95.802 -6.528 2.575 490 HB3 TRP 61 HB2 TRP 61 96.386 -5.077 3.423 491 HD1 TRP 61 HD1 TRP 61 94.023 -6.076 0.533 492 HE1 TRP 61 HE1 TRP 61 92.187 -4.281 0.295 493 HE3 TRP 61 HE3 TRP 61 95.716 -2.714 3.986 494 HZ2 TRP 61 HZ2 TRP 61 91.554 -1.721 1.460 495 HZ3 TRP 61 HZ3 TRP 61 94.481 -0.608 4.400 496 HH2 TRP 61 HH2 TRP 61 92.402 -0.108 3.144 497 H LEU 62 H LEU 62 96.864 -3.777 -0.584 498 HA LEU 62 HA LEU 62 97.903 -1.366 0.921 499 HB2 LEU 62 HB2 LEU 62 98.371 -1.400 -2.010 500 HB3 LEU 62 HB3 LEU 62 99.459 -0.906 -0.691 501 HG LEU 62 HG LEU 62 98.805 -3.810 -1.351 502 HD11 LEU 62 HD11 LEU 62 100.255 -3.656 -3.074 503 HD12 LEU 62 HD12 LEU 62 100.506 -1.927 -2.734 504 HD13 LEU 62 HD13 LEU 62 101.523 -3.148 -1.933 505 HD21 LEU 62 HD21 LEU 62 101.334 -3.175 0.003 506 HD22 LEU 62 HD22 LEU 62 99.922 -2.615 0.930 507 HD23 LEU 62 HD23 LEU 62 100.061 -4.329 0.468 508 H GLY 63 H GLY 63 96.192 0.020 1.086 509 HA2 GLY 63 HA3 GLY 63 93.852 -0.187 -0.635 510 HA3 GLY 63 HA2 GLY 63 94.198 1.150 0.488 511 H ASN 64 H ASN 64 96.784 0.544 -1.629 512 HA ASN 64 HA ASN 64 97.572 1.695 -3.532 513 HB2 ASN 64 HB2 ASN 64 95.164 0.999 -4.333 514 HB3 ASN 64 HB3 ASN 64 94.783 2.721 -4.091 515 HD21 ASN 64 HD21 ASN 64 96.604 0.413 -6.073 516 HD22 ASN 64 HD22 ASN 64 97.139 1.583 -7.259 517 H GLU 65 H GLU 65 96.285 3.079 -0.833 518 HA GLU 65 HA GLU 65 96.920 5.874 -1.815 519 HB2 GLU 65 HB2 GLU 65 95.235 4.901 0.538 520 HB3 GLU 65 HB3 GLU 65 95.650 6.607 0.245 521 HG2 GLU 65 HG3 GLU 65 94.610 6.377 -2.055 522 HG3 GLU 65 HG2 GLU 65 94.044 4.760 -1.573 523 H CYS 66 H CYS 66 98.457 3.369 -0.556 524 HA CYS 66 HA CYS 66 99.740 4.850 1.726 525 HB2 CYS 66 HB2 CYS 66 100.586 2.753 2.435 526 HB3 CYS 66 HB3 CYS 66 98.970 2.357 1.804 527 HG CYS 66 HG CYS 66 100.390 0.327 0.648 528 H SER 67 H SER 67 101.656 5.875 1.425 529 HA SER 67 HA SER 67 102.899 6.265 -1.064 530 HB2 SER 67 HB2 SER 67 104.537 5.998 1.479 531 HB3 SER 67 HB3 SER 67 104.770 7.126 0.121 532 HG SER 67 HG SER 67 103.762 8.132 1.951 533 H GLN 68 H GLN 68 103.908 4.916 -2.459 534 HA GLN 68 HA GLN 68 104.278 2.149 -2.072 535 HB2 GLN 68 HB2 GLN 68 106.111 2.369 -3.853 536 HB3 GLN 68 HB3 GLN 68 104.524 3.051 -4.285 537 HG2 GLN 68 HG2 GLN 68 106.514 4.843 -2.911 538 HG3 GLN 68 HG3 GLN 68 106.780 4.454 -4.627 539 HE21 GLN 68 HE21 GLN 68 106.296 6.840 -4.986 540 HE22 GLN 68 HE22 GLN 68 104.620 7.334 -5.072 541 H ASP 69 H ASP 69 106.243 4.804 -0.891 542 HA ASP 69 HA ASP 69 108.714 3.469 -0.418 543 HB2 ASP 69 HB3 ASP 69 107.951 5.940 0.074 544 HB3 ASP 69 HB2 ASP 69 107.507 5.294 1.672 545 H GLU 70 H GLU 70 105.729 3.494 1.572 546 HA GLU 70 HA GLU 70 106.987 1.583 3.490 547 HB2 GLU 70 HB2 GLU 70 104.047 2.258 3.492 548 HB3 GLU 70 HB3 GLU 70 105.146 1.990 4.866 549 HG2 GLU 70 HG3 GLU 70 106.298 4.135 4.339 550 HG3 GLU 70 HG2 GLU 70 105.152 4.406 3.004 551 H SER 71 H SER 71 104.703 1.612 0.799 552 HA SER 71 HA SER 71 103.570 -1.007 1.222 553 HB2 SER 71 HB2 SER 71 103.087 0.967 -0.544 554 HB3 SER 71 HB3 SER 71 104.115 -0.059 -1.572 555 HG SER 71 HG SER 71 102.307 -1.143 -1.847 556 H GLY 72 H GLY 72 106.197 -0.041 -1.055 557 HA2 GLY 72 HA3 GLY 72 106.970 -2.695 -1.762 558 HA3 GLY 72 HA2 GLY 72 108.068 -1.293 -1.780 559 H ALA 73 H ALA 73 108.352 -0.591 0.820 560 HA ALA 73 HA ALA 73 110.258 -2.357 1.878 561 HB1 ALA 73 HB1 ALA 73 109.829 -1.303 4.082 562 HB2 ALA 73 HB2 ALA 73 109.825 -0.088 2.782 563 HB3 ALA 73 HB3 ALA 73 108.287 -0.657 3.473 564 H ALA 74 H ALA 74 106.716 -2.408 2.417 565 HA ALA 74 HA ALA 74 106.788 -4.596 4.325 566 HB1 ALA 74 HB1 ALA 74 104.381 -4.852 3.783 567 HB2 ALA 74 HB2 ALA 74 104.803 -3.139 4.017 568 HB3 ALA 74 HB3 ALA 74 104.585 -3.785 2.373 569 H ALA 75 H ALA 75 106.496 -4.454 0.770 570 HA ALA 75 HA ALA 75 106.099 -7.316 0.436 571 HB1 ALA 75 HB1 ALA 75 106.748 -6.896 -1.921 572 HB2 ALA 75 HB2 ALA 75 105.596 -5.666 -1.347 573 HB3 ALA 75 HB3 ALA 75 107.328 -5.274 -1.473 574 H ILE 76 H ILE 76 108.988 -5.224 0.580 575 HA ILE 76 HA ILE 76 110.839 -7.390 -0.088 576 HB ILE 76 HB ILE 76 111.393 -4.833 1.476 577 HG12 ILE 76 HG12 ILE 76 111.061 -5.402 -1.483 578 HG13 ILE 76 HG13 ILE 76 110.389 -4.064 -0.522 579 HG21 ILE 76 HG21 ILE 76 113.096 -6.822 1.282 580 HG22 ILE 76 HG22 ILE 76 113.655 -5.171 0.925 581 HG23 ILE 76 HG23 ILE 76 113.265 -6.285 -0.407 582 HD11 ILE 76 HD11 ILE 76 112.149 -3.019 -1.683 583 HD12 ILE 76 HD12 ILE 76 112.906 -3.425 -0.124 584 HD13 ILE 76 HD13 ILE 76 113.209 -4.443 -1.553 585 H PHE 77 H PHE 77 109.773 -5.879 2.998 586 HA PHE 77 HA PHE 77 111.425 -7.633 4.642 587 HB2 PHE 77 HB3 PHE 77 109.107 -5.768 5.093 588 HB3 PHE 77 HB2 PHE 77 109.482 -6.957 6.364 589 HD1 PHE 77 HD1 PHE 77 110.149 -3.701 5.294 590 HD2 PHE 77 HD2 PHE 77 112.163 -7.194 6.776 591 HE1 PHE 77 HE1 PHE 77 112.037 -2.287 6.063 592 HE2 PHE 77 HE2 PHE 77 114.049 -5.779 7.548 593 HZ PHE 77 HZ PHE 77 113.984 -3.326 7.190 594 H THR 78 H THR 78 108.132 -7.822 3.330 595 HA THR 78 HA THR 78 107.456 -10.245 4.856 596 HB THR 78 HB THR 78 106.232 -8.849 2.445 597 HG1 THR 78 HG1 THR 78 105.946 -7.888 4.509 598 HG21 THR 78 HG21 THR 78 104.337 -10.430 2.671 599 HG22 THR 78 HG22 THR 78 105.839 -11.288 2.252 600 HG23 THR 78 HG23 THR 78 105.231 -11.323 3.925 601 H VAL 79 H VAL 79 108.595 -9.551 1.527 602 HA VAL 79 HA VAL 79 108.506 -12.381 0.747 603 HB VAL 79 HB VAL 79 109.940 -9.972 -0.453 604 HG11 VAL 79 HG11 VAL 79 111.044 -12.104 -1.081 605 HG12 VAL 79 HG12 VAL 79 109.472 -12.770 -1.583 606 HG13 VAL 79 HG13 VAL 79 110.181 -11.399 -2.469 607 HG21 VAL 79 HG21 VAL 79 107.619 -11.368 -1.738 608 HG22 VAL 79 HG22 VAL 79 107.271 -10.371 -0.306 609 HG23 VAL 79 HG23 VAL 79 108.047 -9.640 -1.731 610 H GLN 80 H GLN 80 111.096 -10.133 1.812 611 HA GLN 80 HA GLN 80 113.208 -12.118 1.528 612 HB2 GLN 80 HB3 GLN 80 112.997 -9.596 3.226 613 HB3 GLN 80 HB2 GLN 80 114.483 -10.562 3.064 614 HG2 GLN 80 HG3 GLN 80 112.948 -9.349 0.724 615 HG3 GLN 80 HG2 GLN 80 114.389 -8.619 1.470 616 HE21 GLN 80 HE21 GLN 80 115.857 -11.082 1.967 617 HE22 GLN 80 HE22 GLN 80 116.318 -11.731 0.409 618 H LEU 81 H LEU 81 111.636 -10.834 4.526 619 HA LEU 81 HA LEU 81 112.817 -12.746 6.279 620 HB2 LEU 81 HB2 LEU 81 111.337 -10.711 6.862 621 HB3 LEU 81 HB3 LEU 81 109.949 -11.782 6.568 622 HG LEU 81 HG LEU 81 110.614 -11.709 8.980 623 HD11 LEU 81 HD11 LEU 81 110.262 -13.990 9.324 624 HD12 LEU 81 HD12 LEU 81 111.345 -14.464 7.993 625 HD13 LEU 81 HD13 LEU 81 109.725 -13.819 7.636 626 HD21 LEU 81 HD21 LEU 81 112.734 -12.293 9.742 627 HD22 LEU 81 HD22 LEU 81 113.080 -13.311 8.324 628 HD23 LEU 81 HD23 LEU 81 113.161 -11.538 8.188 629 H ASP 82 H ASP 82 109.636 -12.953 4.580 630 HA ASP 82 HA ASP 82 108.866 -15.514 5.446 631 HB2 ASP 82 HB3 ASP 82 107.387 -14.402 3.949 632 HB3 ASP 82 HB2 ASP 82 108.655 -14.197 2.717 633 H ASP 83 H ASP 83 111.176 -14.722 2.800 634 HA ASP 83 HA ASP 83 111.759 -17.460 2.141 635 HB2 ASP 83 HB2 ASP 83 112.547 -15.356 0.902 636 HB3 ASP 83 HB3 ASP 83 113.800 -15.199 2.156 637 H TYR 84 H TYR 84 112.775 -15.342 4.758 638 HA TYR 84 HA TYR 84 114.896 -17.082 5.750 639 HB2 TYR 84 HB3 TYR 84 114.440 -14.608 6.360 640 HB3 TYR 84 HB2 TYR 84 113.183 -15.237 7.453 641 HD1 TYR 84 HD1 TYR 84 116.773 -14.857 6.875 642 HD2 TYR 84 HD2 TYR 84 113.805 -16.792 9.302 643 HE1 TYR 84 HE1 TYR 84 118.504 -15.386 8.570 644 HE2 TYR 84 HE2 TYR 84 115.534 -17.321 10.998 645 HH TYR 84 HH TYR 84 118.152 -17.635 10.949 646 H LEU 85 H LEU 85 111.408 -17.103 5.887 647 HA LEU 85 HA LEU 85 111.336 -18.911 8.235 648 HB2 LEU 85 HB3 LEU 85 109.120 -18.175 6.276 649 HB3 LEU 85 HB2 LEU 85 108.920 -18.924 7.878 650 HG LEU 85 HG LEU 85 110.052 -16.153 7.292 651 HD11 LEU 85 HD11 LEU 85 107.583 -16.339 7.144 652 HD12 LEU 85 HD12 LEU 85 107.544 -17.094 8.756 653 HD13 LEU 85 HD13 LEU 85 108.068 -15.403 8.578 654 HD21 LEU 85 HD21 LEU 85 109.794 -16.159 9.953 655 HD22 LEU 85 HD22 LEU 85 110.040 -17.909 9.739 656 HD23 LEU 85 HD23 LEU 85 111.278 -16.761 9.175 657 H ASN 86 H ASN 86 110.227 -19.296 4.801 658 HA ASN 86 HA ASN 86 110.957 -22.220 5.149 659 HB2 ASN 86 HB3 ASN 86 108.819 -21.414 3.205 660 HB3 ASN 86 HB2 ASN 86 108.969 -22.892 4.186 661 HD21 ASN 86 HD21 ASN 86 108.774 -22.456 6.687 662 HD22 ASN 86 HD22 ASN 86 107.559 -21.290 7.161 663 H GLY 87 H GLY 87 110.571 -19.560 2.767 664 HA2 GLY 87 HA2 GLY 87 112.283 -19.161 1.059 665 HA3 GLY 87 HA3 GLY 87 112.806 -20.855 1.215 666 H ARG 88 H ARG 88 109.529 -21.054 1.277 667 HA ARG 88 HA ARG 88 109.099 -20.795 -1.668 668 HB2 ARG 88 HB2 ARG 88 108.414 -23.462 -0.441 669 HB3 ARG 88 HB3 ARG 88 108.768 -23.055 -2.137 670 HG2 ARG 88 HG2 ARG 88 111.151 -22.726 -1.574 671 HG3 ARG 88 HG3 ARG 88 110.807 -23.087 0.135 672 HD2 ARG 88 HD3 ARG 88 111.526 -24.950 -1.828 673 HD3 ARG 88 HD2 ARG 88 110.809 -25.325 -0.243 674 HE ARG 88 HE ARG 88 108.601 -24.729 -1.880 675 HH11 ARG 88 HH11 ARG 88 107.526 -26.352 -3.029 676 HH12 ARG 88 HH12 ARG 88 108.362 -27.833 -3.440 677 HH21 ARG 88 HH21 ARG 88 111.348 -26.868 -1.931 678 HH22 ARG 88 HH22 ARG 88 110.517 -28.124 -2.821 679 H ALA 89 H ALA 89 107.791 -19.153 -0.149 680 HA ALA 89 HA ALA 89 105.233 -20.492 0.726 681 HB1 ALA 89 HB1 ALA 89 106.782 -18.146 1.605 682 HB2 ALA 89 HB2 ALA 89 105.552 -19.086 2.482 683 HB3 ALA 89 HB3 ALA 89 105.055 -17.781 1.378 684 H VAL 90 H VAL 90 103.199 -19.159 0.228 685 HA VAL 90 HA VAL 90 103.205 -18.592 -2.690 686 HB VAL 90 HB VAL 90 100.831 -18.123 -0.882 687 HG11 VAL 90 HG11 VAL 90 101.195 -19.367 -3.645 688 HG12 VAL 90 HG12 VAL 90 99.640 -19.041 -2.843 689 HG13 VAL 90 HG13 VAL 90 100.693 -17.690 -3.326 690 HG21 VAL 90 HG21 VAL 90 102.010 -20.817 -1.696 691 HG22 VAL 90 HG22 VAL 90 101.729 -20.222 -0.042 692 HG23 VAL 90 HG23 VAL 90 100.347 -20.600 -1.099 693 H GLN 91 H GLN 91 102.592 -16.555 -3.623 694 HA GLN 91 HA GLN 91 102.964 -14.240 -1.704 695 HB2 GLN 91 HB3 GLN 91 104.004 -13.013 -3.497 696 HB3 GLN 91 HB2 GLN 91 104.757 -14.626 -3.485 697 HG2 GLN 91 HG2 GLN 91 102.798 -15.210 -5.180 698 HG3 GLN 91 HG3 GLN 91 102.782 -13.449 -5.442 699 HE21 GLN 91 HE21 GLN 91 105.838 -13.537 -4.686 700 HE22 GLN 91 HE22 GLN 91 106.585 -14.043 -6.184 701 H HIS 92 H HIS 92 101.401 -12.667 -1.666 702 HA HIS 92 HA HIS 92 99.330 -12.710 -3.861 703 HB2 HIS 92 HB3 HIS 92 98.809 -12.725 -0.855 704 HB3 HIS 92 HB2 HIS 92 97.571 -12.356 -2.080 705 HD2 HIS 92 HD2 HIS 92 100.055 -15.445 -1.478 706 HE1 HIS 92 HE1 HIS 92 96.359 -16.862 -2.952 707 H ARG 93 H ARG 93 99.103 -10.685 -4.666 708 HA ARG 93 HA ARG 93 99.932 -8.389 -2.872 709 HB2 ARG 93 HB2 ARG 93 101.379 -8.677 -4.855 710 HB3 ARG 93 HB3 ARG 93 99.951 -8.607 -5.916 711 HG2 ARG 93 HG3 ARG 93 99.500 -6.318 -5.290 712 HG3 ARG 93 HG2 ARG 93 100.709 -6.375 -3.985 713 HD2 ARG 93 HD2 ARG 93 102.448 -6.871 -5.805 714 HD3 ARG 93 HD3 ARG 93 101.193 -6.434 -6.989 715 HE ARG 93 HE ARG 93 101.289 -4.299 -5.108 716 HH11 ARG 93 HH11 ARG 93 102.534 -2.469 -5.567 717 HH12 ARG 93 HH12 ARG 93 103.852 -2.573 -6.713 718 HH21 ARG 93 HH21 ARG 93 103.343 -5.952 -7.380 719 HH22 ARG 93 HH22 ARG 93 104.307 -4.536 -7.735 720 H GLU 94 H GLU 94 98.263 -7.124 -2.224 721 HA GLU 94 HA GLU 94 95.811 -7.071 -4.002 722 HB2 GLU 94 HB2 GLU 94 95.459 -6.109 -1.238 723 HB3 GLU 94 HB3 GLU 94 94.507 -7.302 -2.155 724 HG2 GLU 94 HG2 GLU 94 97.182 -7.814 -0.777 725 HG3 GLU 94 HG3 GLU 94 95.590 -8.377 -0.215 726 H VAL 95 H VAL 95 96.435 -5.287 -5.276 727 HA VAL 95 HA VAL 95 97.299 -2.789 -3.894 728 HB VAL 95 HB VAL 95 96.593 -2.937 -6.825 729 HG11 VAL 95 HG11 VAL 95 99.151 -1.773 -5.961 730 HG12 VAL 95 HG12 VAL 95 97.757 -1.041 -5.131 731 HG13 VAL 95 HG13 VAL 95 97.835 -1.041 -6.910 732 HG21 VAL 95 HG21 VAL 95 99.067 -3.732 -7.085 733 HG22 VAL 95 HG22 VAL 95 97.833 -4.950 -6.683 734 HG23 VAL 95 HG23 VAL 95 98.899 -4.309 -5.409 735 H GLN 96 H GLN 96 94.661 -3.754 -3.212 736 HA GLN 96 HA GLN 96 92.485 -2.864 -2.972 737 HB2 GLN 96 HB2 GLN 96 94.086 -0.719 -2.817 738 HB3 GLN 96 HB3 GLN 96 93.285 -0.314 -4.354 739 HG2 GLN 96 HG3 GLN 96 91.063 -0.691 -3.212 740 HG3 GLN 96 HG2 GLN 96 91.942 -0.888 -1.677 741 HE21 GLN 96 HE21 GLN 96 92.560 1.427 -4.396 742 HE22 GLN 96 HE22 GLN 96 92.372 2.857 -3.405 743 H GLY 97 H GLY 97 91.065 -3.868 -4.320 744 HA2 GLY 97 HA2 GLY 97 89.540 -3.489 -6.250 745 HA3 GLY 97 HA3 GLY 97 90.916 -2.806 -7.148 746 H PHE 98 H PHE 98 92.854 -4.813 -6.420 747 HA PHE 98 HA PHE 98 91.705 -7.129 -7.996 748 HB2 PHE 98 HB2 PHE 98 94.442 -5.846 -7.871 749 HB3 PHE 98 HB3 PHE 98 94.288 -7.555 -8.342 750 HD1 PHE 98 HD1 PHE 98 93.456 -8.170 -10.489 751 HD2 PHE 98 HD2 PHE 98 93.169 -4.093 -9.171 752 HE1 PHE 98 HE1 PHE 98 92.772 -7.480 -12.771 753 HE2 PHE 98 HE2 PHE 98 92.485 -3.403 -11.453 754 HZ PHE 98 HZ PHE 98 92.288 -5.097 -13.254 755 H GLU 99 H GLU 99 91.110 -7.195 -5.325 756 HA GLU 99 HA GLU 99 93.190 -8.479 -3.725 757 HB2 GLU 99 HB2 GLU 99 90.159 -8.636 -3.412 758 HB3 GLU 99 HB3 GLU 99 91.374 -8.985 -2.159 759 HG2 GLU 99 HG2 GLU 99 92.078 -6.696 -2.067 760 HG3 GLU 99 HG3 GLU 99 91.207 -6.292 -3.566 761 H SER 100 H SER 100 93.234 -10.744 -3.065 762 HA SER 100 HA SER 100 92.555 -12.523 -5.362 763 HB2 SER 100 HB2 SER 100 94.636 -13.163 -4.597 764 HB3 SER 100 HB3 SER 100 94.286 -12.675 -2.921 765 HG SER 100 HG SER 100 94.346 -14.972 -3.159 766 H ALA 101 H ALA 101 91.281 -14.470 -5.096 767 HA ALA 101 HA ALA 101 88.849 -14.081 -3.618 768 HB1 ALA 101 HB1 ALA 101 88.397 -16.468 -4.116 769 HB2 ALA 101 HB2 ALA 101 89.045 -15.628 -5.545 770 HB3 ALA 101 HB3 ALA 101 90.100 -16.692 -4.585 771 H THR 102 H THR 102 91.901 -15.673 -2.757 772 HA THR 102 HA THR 102 90.904 -16.963 -0.354 773 HB THR 102 HB THR 102 93.676 -15.983 -1.156 774 HG1 THR 102 HG1 THR 102 93.947 -18.266 -1.455 775 HG21 THR 102 HG21 THR 102 94.510 -17.372 0.719 776 HG22 THR 102 HG22 THR 102 92.834 -17.718 1.208 777 HG23 THR 102 HG23 THR 102 93.467 -16.057 1.312 778 H PHE 103 H PHE 103 92.950 -14.020 -0.646 779 HA PHE 103 HA PHE 103 92.643 -13.130 2.031 780 HB2 PHE 103 HB3 PHE 103 94.206 -11.966 0.659 781 HB3 PHE 103 HB2 PHE 103 92.982 -11.623 -0.586 782 HD1 PHE 103 HD1 PHE 103 91.045 -10.074 0.012 783 HD2 PHE 103 HD2 PHE 103 94.548 -10.473 2.467 784 HE1 PHE 103 HE1 PHE 103 90.506 -7.927 1.129 785 HE2 PHE 103 HE2 PHE 103 94.009 -8.325 3.585 786 HZ PHE 103 HZ PHE 103 91.988 -7.053 2.916 787 H LEU 104 H LEU 104 90.392 -12.921 -0.692 788 HA LEU 104 HA LEU 104 88.606 -11.001 0.626 789 HB2 LEU 104 HB2 LEU 104 88.449 -12.830 -1.769 790 HB3 LEU 104 HB3 LEU 104 86.951 -12.116 -1.127 791 HG LEU 104 HG LEU 104 89.354 -10.345 -1.573 792 HD11 LEU 104 HD11 LEU 104 89.096 -11.633 -3.677 793 HD12 LEU 104 HD12 LEU 104 88.593 -9.940 -3.897 794 HD13 LEU 104 HD13 LEU 104 87.366 -11.218 -3.718 795 HD21 LEU 104 HD21 LEU 104 87.330 -9.482 -0.427 796 HD22 LEU 104 HD22 LEU 104 87.563 -8.686 -2.002 797 HD23 LEU 104 HD23 LEU 104 86.336 -9.963 -1.823 798 H GLY 105 H GLY 105 88.296 -14.539 -0.025 799 HA2 GLY 105 HA2 GLY 105 85.957 -15.051 1.429 800 HA3 GLY 105 HA3 GLY 105 87.319 -16.195 1.369 801 H TYR 106 H TYR 106 89.213 -14.414 2.711 802 HA TYR 106 HA TYR 106 88.439 -15.061 5.478 803 HB2 TYR 106 HB3 TYR 106 90.818 -13.835 4.101 804 HB3 TYR 106 HB2 TYR 106 90.621 -13.558 5.848 805 HD1 TYR 106 HD1 TYR 106 90.976 -16.165 3.219 806 HD2 TYR 106 HD2 TYR 106 90.914 -15.342 7.435 807 HE1 TYR 106 HE1 TYR 106 91.833 -18.445 3.677 808 HE2 TYR 106 HE2 TYR 106 91.774 -17.621 7.893 809 HH TYR 106 HH TYR 106 93.215 -19.390 6.455 810 H PHE 107 H PHE 107 89.282 -11.936 3.873 811 HA PHE 107 HA PHE 107 87.728 -10.550 6.040 812 HB2 PHE 107 HB2 PHE 107 89.293 -9.238 3.789 813 HB3 PHE 107 HB3 PHE 107 88.858 -8.557 5.375 814 HD1 PHE 107 HD1 PHE 107 91.412 -10.183 3.509 815 HD2 PHE 107 HD2 PHE 107 89.761 -9.892 7.464 816 HE1 PHE 107 HE1 PHE 107 93.538 -11.035 4.460 817 HE2 PHE 107 HE2 PHE 107 91.887 -10.745 8.414 818 HZ PHE 107 HZ PHE 107 93.774 -11.320 6.913 819 H LYS 108 H LYS 108 85.908 -11.856 4.629 820 HA LYS 108 HA LYS 108 85.037 -10.252 2.280 821 HB2 LYS 108 HB3 LYS 108 83.006 -11.843 2.464 822 HB3 LYS 108 HB2 LYS 108 84.580 -12.585 2.091 823 HG2 LYS 108 HG2 LYS 108 84.815 -13.488 4.237 824 HG3 LYS 108 HG3 LYS 108 83.728 -12.285 4.972 825 HD2 LYS 108 HD2 LYS 108 81.782 -13.352 4.104 826 HD3 LYS 108 HD3 LYS 108 82.731 -14.324 2.953 827 HE2 LYS 108 HE3 LYS 108 83.241 -14.597 5.921 828 HE3 LYS 108 HE2 LYS 108 81.852 -15.433 5.184 829 HZ1 LYS 108 HZ1 LYS 108 83.245 -16.942 4.420 830 HZ2 LYS 108 HZ2 LYS 108 84.086 -15.809 3.566 831 HZ3 LYS 108 HZ3 LYS 108 84.530 -16.174 5.112 832 H SER 109 H SER 109 84.210 -10.654 5.705 833 HA SER 109 HA SER 109 81.920 -8.744 5.365 834 HB2 SER 109 HB2 SER 109 81.755 -10.870 6.782 835 HB3 SER 109 HB3 SER 109 82.876 -10.088 7.924 836 HG SER 109 HG SER 109 80.650 -9.697 8.451 837 H GLY 110 H GLY 110 85.253 -8.738 6.100 838 HA2 GLY 110 HA2 GLY 110 85.157 -6.467 7.994 839 HA3 GLY 110 HA3 GLY 110 86.617 -7.142 7.233 840 H LEU 111 H LEU 111 87.477 -6.092 5.479 841 HA LEU 111 HA LEU 111 87.788 -4.263 4.021 842 HB2 LEU 111 HB3 LEU 111 84.852 -4.869 3.497 843 HB3 LEU 111 HB2 LEU 111 85.907 -3.893 2.448 844 HG LEU 111 HG LEU 111 86.313 -6.828 3.176 845 HD11 LEU 111 HD11 LEU 111 84.489 -6.420 1.547 846 HD12 LEU 111 HD12 LEU 111 85.598 -5.449 0.549 847 HD13 LEU 111 HD13 LEU 111 85.887 -7.193 0.762 848 HD21 LEU 111 HD21 LEU 111 88.049 -6.417 1.179 849 HD22 LEU 111 HD22 LEU 111 88.016 -4.754 1.813 850 HD23 LEU 111 HD23 LEU 111 88.499 -6.101 2.872 851 H LYS 112 H LYS 112 88.165 -2.527 5.308 852 HA LYS 112 HA LYS 112 85.904 -0.610 5.603 853 HB2 LYS 112 HB2 LYS 112 86.669 -2.275 7.783 854 HB3 LYS 112 HB3 LYS 112 87.345 -0.664 8.124 855 HG2 LYS 112 HG2 LYS 112 85.167 0.376 7.871 856 HG3 LYS 112 HG3 LYS 112 84.454 -1.143 7.280 857 HD2 LYS 112 HD2 LYS 112 85.809 -1.115 9.975 858 HD3 LYS 112 HD3 LYS 112 84.174 -0.428 9.824 859 HE2 LYS 112 HE2 LYS 112 83.423 -2.568 8.749 860 HE3 LYS 112 HE3 LYS 112 85.042 -3.247 9.043 861 HZ1 LYS 112 HZ1 LYS 112 83.502 -3.827 10.796 862 HZ2 LYS 112 HZ2 LYS 112 84.703 -2.866 11.392 863 HZ3 LYS 112 HZ3 LYS 112 83.203 -2.237 11.120 864 H TYR 113 H TYR 113 86.761 1.212 4.750 865 HA TYR 113 HA TYR 113 89.722 1.613 4.911 866 HB2 TYR 113 HB3 TYR 113 87.714 3.465 3.588 867 HB3 TYR 113 HB2 TYR 113 89.438 3.243 3.206 868 HD1 TYR 113 HD1 TYR 113 86.394 2.694 1.832 869 HD2 TYR 113 HD2 TYR 113 89.856 0.427 2.983 870 HE1 TYR 113 HE1 TYR 113 85.797 0.944 0.178 871 HE2 TYR 113 HE2 TYR 113 89.264 -1.320 1.325 872 HH TYR 113 HH TYR 113 87.142 -0.890 -1.156 873 H LYS 114 H LYS 114 90.372 2.489 6.829 874 HA LYS 114 HA LYS 114 88.717 4.784 7.910 875 HB2 LYS 114 HB2 LYS 114 90.369 2.621 9.201 876 HB3 LYS 114 HB3 LYS 114 90.276 4.206 10.005 877 HG2 LYS 114 HG2 LYS 114 87.732 4.039 9.754 878 HG3 LYS 114 HG3 LYS 114 87.980 2.342 9.275 879 HD2 LYS 114 HD2 LYS 114 88.939 1.780 11.395 880 HD3 LYS 114 HD3 LYS 114 89.135 3.491 11.844 881 HE2 LYS 114 HE2 LYS 114 86.603 3.708 11.731 882 HE3 LYS 114 HE3 LYS 114 86.529 1.938 11.549 883 HZ1 LYS 114 HZ1 LYS 114 86.316 2.607 13.849 884 HZ2 LYS 114 HZ2 LYS 114 87.703 1.741 13.638 885 HZ3 LYS 114 HZ3 LYS 114 87.772 3.381 13.806 886 H LYS 115 H LYS 115 89.620 6.656 7.170 887 HA LYS 115 HA LYS 115 92.299 6.974 6.255 888 HB2 LYS 115 HB2 LYS 115 90.272 8.909 7.416 889 HB3 LYS 115 HB3 LYS 115 91.893 9.461 6.926 890 HG2 LYS 115 HG3 LYS 115 91.500 8.444 4.662 891 HG3 LYS 115 HG2 LYS 115 89.840 8.046 5.167 892 HD2 LYS 115 HD2 LYS 115 90.834 10.878 5.475 893 HD3 LYS 115 HD3 LYS 115 90.331 10.304 3.867 894 HE2 LYS 115 HE3 LYS 115 88.112 10.008 4.518 895 HE3 LYS 115 HE2 LYS 115 88.538 9.759 6.228 896 HZ1 LYS 115 HZ1 LYS 115 87.527 11.911 5.867 897 HZ2 LYS 115 HZ2 LYS 115 88.695 12.326 4.779 898 HZ3 LYS 115 HZ3 LYS 115 89.089 12.095 6.364 899 H GLY 116 H GLY 116 94.183 6.784 7.342 900 HA2 GLY 116 HA2 GLY 116 94.128 6.963 10.329 901 HA3 GLY 116 HA3 GLY 116 95.485 6.378 9.337 902 H GLY 117 H GLY 117 95.548 8.615 7.505 903 HA2 GLY 117 HA2 GLY 117 95.811 11.102 7.722 904 HA3 GLY 117 HA3 GLY 117 96.337 10.840 9.402 905 H VAL 118 H VAL 118 97.415 8.579 6.976 906 HA VAL 118 HA VAL 118 100.207 9.550 7.414 907 HB VAL 118 HB VAL 118 99.418 7.228 5.636 908 HG11 VAL 118 HG11 VAL 118 101.791 7.933 5.757 909 HG12 VAL 118 HG12 VAL 118 101.561 6.331 6.497 910 HG13 VAL 118 HG13 VAL 118 101.749 7.769 7.529 911 HG21 VAL 118 HG21 VAL 118 99.701 5.889 7.876 912 HG22 VAL 118 HG22 VAL 118 98.139 6.671 7.538 913 HG23 VAL 118 HG23 VAL 118 99.293 7.436 8.656 914 H ALA 119 H ALA 119 97.667 9.841 5.096 915 HA ALA 119 HA ALA 119 99.123 10.046 2.649 916 HB1 ALA 119 HB1 ALA 119 97.290 11.538 1.897 917 HB2 ALA 119 HB2 ALA 119 96.756 11.731 3.584 918 HB3 ALA 119 HB3 ALA 119 96.649 10.140 2.793 919 H SER 120 H SER 120 99.122 12.122 5.450 920 HA SER 120 HA SER 120 99.996 14.554 4.129 921 HB2 SER 120 HB2 SER 120 100.342 13.511 6.964 922 HB3 SER 120 HB3 SER 120 100.934 15.108 6.444 923 HG SER 120 HG SER 120 98.782 15.194 7.308 924 H GLY 121 H GLY 121 101.374 11.667 3.962 925 HA2 GLY 121 HA2 GLY 121 104.095 11.923 4.720 926 HA3 GLY 121 HA3 GLY 121 103.542 10.996 3.305 927 H PHE 122 H PHE 122 102.322 13.662 2.290 928 HA PHE 122 HA PHE 122 104.469 14.348 0.504 929 HB2 PHE 122 HB2 PHE 122 101.897 15.707 1.338 930 HB3 PHE 122 HB3 PHE 122 103.047 16.546 0.269 931 HD1 PHE 122 HD1 PHE 122 102.738 16.264 -2.016 932 HD2 PHE 122 HD2 PHE 122 101.532 13.114 0.643 933 HE1 PHE 122 HE1 PHE 122 101.900 14.954 -3.949 934 HE2 PHE 122 HE2 PHE 122 100.696 11.804 -1.288 935 HZ PHE 122 HZ PHE 122 100.879 12.724 -3.585 936 H LYS 123 H LYS 123 103.753 15.359 3.776 937 HA LYS 123 HA LYS 123 105.059 17.881 3.889 938 HB2 LYS 123 HB3 LYS 123 103.860 16.748 5.791 939 HB3 LYS 123 HB2 LYS 123 105.259 15.663 5.973 940 HG2 LYS 123 HG2 LYS 123 106.691 17.790 6.182 941 HG3 LYS 123 HG3 LYS 123 105.159 18.678 6.361 942 HD2 LYS 123 HD2 LYS 123 104.589 17.489 8.358 943 HD3 LYS 123 HD3 LYS 123 105.849 16.264 8.077 944 HE2 LYS 123 HE2 LYS 123 106.510 19.206 8.463 945 HE3 LYS 123 HE3 LYS 123 106.374 18.078 9.834 946 HZ1 LYS 123 HZ1 LYS 123 108.636 18.231 9.028 947 HZ2 LYS 123 HZ2 LYS 123 108.051 16.708 8.787 948 HZ3 LYS 123 HZ3 LYS 123 108.177 17.753 7.517 949 H HIS 124 H HIS 124 106.436 14.610 3.731 950 HA HIS 124 HA HIS 124 109.192 15.759 4.021 951 HB2 HIS 124 HB3 HIS 124 108.333 13.522 5.076 952 HB3 HIS 124 HB2 HIS 124 108.542 12.857 3.438 953 HD2 HIS 124 HD2 HIS 124 110.931 11.453 3.890 954 HE1 HIS 124 HE1 HIS 124 113.215 14.726 5.272 955 HE2 HIS 124 HE2 HIS 124 113.329 12.270 4.581 956 H VAL 125 H VAL 125 109.815 16.761 2.140 957 HA VAL 125 HA VAL 125 109.000 15.667 -0.488 958 HB VAL 125 HB VAL 125 111.085 17.806 0.125 959 HG11 VAL 125 HG11 VAL 125 111.083 16.915 -2.190 960 HG12 VAL 125 HG12 VAL 125 110.486 18.591 -2.150 961 HG13 VAL 125 HG13 VAL 125 109.338 17.241 -2.314 962 HG21 VAL 125 HG21 VAL 125 109.224 19.421 -0.160 963 HG22 VAL 125 HG22 VAL 125 108.077 18.070 -0.322 964 HG23 VAL 125 HG23 VAL 125 108.925 18.338 1.220 965 H VAL 126 H VAL 126 110.142 14.223 -1.699 966 HA VAL 126 HA VAL 126 113.072 13.891 -1.142 967 HB VAL 126 HB VAL 126 111.069 11.589 -1.062 968 HG11 VAL 126 HG11 VAL 126 113.247 10.990 -2.085 969 HG12 VAL 126 HG12 VAL 126 114.096 11.671 -0.676 970 HG13 VAL 126 HG13 VAL 126 113.064 10.233 -0.485 971 HG21 VAL 126 HG21 VAL 126 111.802 11.396 1.311 972 HG22 VAL 126 HG22 VAL 126 112.794 12.860 1.112 973 HG23 VAL 126 HG23 VAL 126 111.021 12.963 0.990 974 HA PRO 127 HA PRO 127 112.053 14.084 -5.665 975 HB2 PRO 127 HB2 PRO 127 115.033 14.499 -5.619 976 HB3 PRO 127 HB3 PRO 127 113.770 15.398 -6.508 977 HG2 PRO 127 HG3 PRO 127 114.960 16.400 -4.320 978 HG3 PRO 127 HG2 PRO 127 113.246 16.718 -4.699 979 HD2 PRO 127 HD2 PRO 127 114.436 14.920 -2.606 980 HD3 PRO 127 HD3 PRO 127 112.883 15.809 -2.601 981 H ASN 128 H ASN 128 112.024 12.285 -6.942 982 HA ASN 128 HA ASN 128 113.249 9.815 -6.114 983 HB2 ASN 128 HB2 ASN 128 112.827 9.247 -8.664 984 HB3 ASN 128 HB3 ASN 128 111.444 9.522 -7.578 985 HD21 ASN 128 HD21 ASN 128 112.638 10.368 -10.600 986 HD22 ASN 128 HD22 ASN 128 111.834 11.911 -10.784 987 H GLU 129 H GLU 129 115.490 10.352 -5.701 988 HA GLU 129 HA GLU 129 117.133 11.196 -8.045 989 HB2 GLU 129 HB3 GLU 129 117.647 10.706 -5.105 990 HB3 GLU 129 HB2 GLU 129 119.010 10.778 -6.247 991 HG2 GLU 129 HG2 GLU 129 118.140 13.000 -7.056 992 HG3 GLU 129 HG3 GLU 129 116.903 12.934 -5.778 993 H VAL 130 H VAL 130 116.069 8.282 -6.516 994 HA VAL 130 HA VAL 130 118.221 6.498 -6.953 995 HB VAL 130 HB VAL 130 115.305 5.890 -7.596 996 HG11 VAL 130 HG11 VAL 130 116.947 4.130 -8.191 997 HG12 VAL 130 HG12 VAL 130 117.605 4.187 -6.538 998 HG13 VAL 130 HG13 VAL 130 115.939 3.625 -6.814 999 HG21 VAL 130 HG21 VAL 130 115.097 5.324 -5.189 1000 HG22 VAL 130 HG22 VAL 130 115.504 7.043 -5.409 1001 HG23 VAL 130 HG23 VAL 130 116.763 5.886 -4.914 1002 H VAL 131 H VAL 131 115.704 7.522 -9.309 1003 HA VAL 131 HA VAL 131 116.865 5.977 -11.495 1004 HB VAL 131 HB VAL 131 114.522 6.754 -11.536 1005 HG11 VAL 131 HG11 VAL 131 113.893 8.996 -11.448 1006 HG12 VAL 131 HG12 VAL 131 115.336 9.026 -10.407 1007 HG13 VAL 131 HG13 VAL 131 115.448 9.566 -12.099 1008 HG21 VAL 131 HG21 VAL 131 114.512 7.683 -13.837 1009 HG22 VAL 131 HG22 VAL 131 115.697 6.363 -13.685 1010 HG23 VAL 131 HG23 VAL 131 116.247 8.056 -13.692 1011 H VAL 132 H VAL 132 117.169 9.392 -10.444 1012 HA VAL 132 HA VAL 132 118.889 10.158 -12.661 1013 HB VAL 132 HB VAL 132 118.623 11.310 -9.848 1014 HG11 VAL 132 HG11 VAL 132 120.758 11.953 -10.932 1015 HG12 VAL 132 HG12 VAL 132 119.865 12.478 -12.379 1016 HG13 VAL 132 HG13 VAL 132 119.647 13.340 -10.837 1017 HG21 VAL 132 HG21 VAL 132 117.181 12.979 -10.984 1018 HG22 VAL 132 HG22 VAL 132 116.533 11.333 -11.182 1019 HG23 VAL 132 HG23 VAL 132 117.398 12.116 -12.526 1020 H GLN 133 H GLN 133 119.449 8.543 -9.580 1021 HA GLN 133 HA GLN 133 122.319 9.006 -9.473 1022 HB2 GLN 133 HB2 GLN 133 120.786 8.114 -7.609 1023 HB3 GLN 133 HB3 GLN 133 120.874 6.539 -8.433 1024 HG2 GLN 133 HG2 GLN 133 122.629 6.463 -6.829 1025 HG3 GLN 133 HG3 GLN 133 123.448 6.859 -8.359 1026 HE21 GLN 133 HE21 GLN 133 125.180 8.127 -7.510 1027 HE22 GLN 133 HE22 GLN 133 124.915 9.626 -6.647 Start of MODEL 6 1 H1 GLU 1 H1 GLU 1 110.425 -13.968 24.367 2 H2 GLU 1 H2 GLU 1 110.664 -14.368 25.949 3 H3 GLU 1 H3 GLU 1 111.317 -12.981 25.341 4 HA GLU 1 HA GLU 1 113.148 -13.989 24.664 5 HB2 GLU 1 HB2 GLU 1 111.710 -16.146 26.224 6 HB3 GLU 1 HB3 GLU 1 113.258 -16.507 25.424 7 HG2 GLU 1 HG3 GLU 1 113.400 -15.693 27.860 8 HG3 GLU 1 HG2 GLU 1 114.411 -14.825 26.681 9 H HIS 2 H HIS 2 110.257 -14.610 23.237 10 HA HIS 2 HA HIS 2 111.536 -15.751 20.856 11 HB2 HIS 2 HB2 HIS 2 111.186 -17.757 22.449 12 HB3 HIS 2 HB3 HIS 2 109.444 -17.521 22.169 13 HD2 HIS 2 HD2 HIS 2 112.613 -17.953 19.750 14 HE1 HIS 2 HE1 HIS 2 109.261 -19.873 18.043 15 HE2 HIS 2 HE2 HIS 2 111.747 -19.377 17.721 16 HA PRO 3 HA PRO 3 107.729 -13.005 20.461 17 HB2 PRO 3 HB2 PRO 3 109.354 -12.322 18.023 18 HB3 PRO 3 HB3 PRO 3 108.484 -11.245 19.152 19 HG2 PRO 3 HG3 PRO 3 111.159 -11.502 19.191 20 HG3 PRO 3 HG2 PRO 3 110.205 -11.224 20.674 21 HD2 PRO 3 HD3 PRO 3 111.551 -13.727 19.708 22 HD3 PRO 3 HD2 PRO 3 111.219 -13.193 21.383 23 H GLU 4 H GLU 4 105.937 -13.617 19.299 24 HA GLU 4 HA GLU 4 105.993 -16.031 17.715 25 HB2 GLU 4 HB2 GLU 4 103.951 -15.194 18.837 26 HB3 GLU 4 HB3 GLU 4 103.928 -13.783 17.752 27 HG2 GLU 4 HG3 GLU 4 103.342 -15.064 15.881 28 HG3 GLU 4 HG2 GLU 4 104.007 -16.563 16.573 29 H PHE 5 H PHE 5 106.421 -12.629 16.889 30 HA PHE 5 HA PHE 5 105.930 -12.854 14.052 31 HB2 PHE 5 HB2 PHE 5 106.128 -10.660 15.035 32 HB3 PHE 5 HB3 PHE 5 107.749 -11.025 15.672 33 HD1 PHE 5 HD1 PHE 5 109.458 -9.969 14.509 34 HD2 PHE 5 HD2 PHE 5 106.018 -11.353 12.339 35 HE1 PHE 5 HE1 PHE 5 110.473 -9.172 12.390 36 HE2 PHE 5 HE2 PHE 5 107.032 -10.552 10.222 37 HZ PHE 5 HZ PHE 5 109.259 -9.461 10.248 38 H LEU 6 H LEU 6 108.703 -13.700 16.074 39 HA LEU 6 HA LEU 6 110.774 -13.855 14.164 40 HB2 LEU 6 HB3 LEU 6 110.578 -14.605 16.739 41 HB3 LEU 6 HB2 LEU 6 110.403 -16.211 15.994 42 HG LEU 6 HG LEU 6 112.768 -15.798 16.445 43 HD11 LEU 6 HD11 LEU 6 113.614 -16.370 14.323 44 HD12 LEU 6 HD12 LEU 6 111.897 -16.821 14.192 45 HD13 LEU 6 HD13 LEU 6 112.475 -15.298 13.474 46 HD21 LEU 6 HD21 LEU 6 112.660 -13.318 16.490 47 HD22 LEU 6 HD22 LEU 6 113.947 -13.885 15.399 48 HD23 LEU 6 HD23 LEU 6 112.406 -13.299 14.728 49 H LYS 7 H LYS 7 107.999 -16.029 14.615 50 HA LYS 7 HA LYS 7 108.975 -17.616 12.234 51 HB2 LYS 7 HB2 LYS 7 107.038 -18.267 14.490 52 HB3 LYS 7 HB3 LYS 7 107.190 -19.272 13.029 53 HG2 LYS 7 HG3 LYS 7 109.691 -18.511 14.530 54 HG3 LYS 7 HG2 LYS 7 108.650 -19.792 15.196 55 HD2 LYS 7 HD2 LYS 7 108.965 -21.195 13.338 56 HD3 LYS 7 HD3 LYS 7 109.426 -19.845 12.273 57 HE2 LYS 7 HE2 LYS 7 111.527 -19.561 13.606 58 HE3 LYS 7 HE3 LYS 7 111.074 -20.986 14.573 59 HZ1 LYS 7 HZ1 LYS 7 112.550 -21.569 12.765 60 HZ2 LYS 7 HZ2 LYS 7 111.078 -22.280 12.545 61 HZ3 LYS 7 HZ3 LYS 7 111.498 -20.961 11.650 62 H ALA 8 H ALA 8 106.367 -15.604 13.502 63 HA ALA 8 HA ALA 8 104.413 -14.798 12.436 64 HB1 ALA 8 HB1 ALA 8 106.585 -14.838 10.421 65 HB2 ALA 8 HB2 ALA 8 104.948 -14.830 9.723 66 HB3 ALA 8 HB3 ALA 8 105.445 -13.537 10.841 67 H GLY 9 H GLY 9 103.759 -17.193 13.146 68 HA2 GLY 9 HA2 GLY 9 101.877 -18.558 12.284 69 HA3 GLY 9 HA3 GLY 9 102.593 -18.452 10.658 70 H LYS 10 H LYS 10 104.308 -19.134 13.712 71 HA LYS 10 HA LYS 10 105.982 -21.155 12.793 72 HB2 LYS 10 HB2 LYS 10 105.520 -22.201 15.203 73 HB3 LYS 10 HB3 LYS 10 106.345 -20.633 15.033 74 HG2 LYS 10 HG3 LYS 10 104.452 -19.416 15.675 75 HG3 LYS 10 HG2 LYS 10 103.330 -20.712 15.194 76 HD2 LYS 10 HD2 LYS 10 103.875 -22.033 17.112 77 HD3 LYS 10 HD3 LYS 10 105.309 -21.045 17.479 78 HE2 LYS 10 HE3 LYS 10 103.355 -20.539 18.978 79 HE3 LYS 10 HE2 LYS 10 103.898 -19.127 18.040 80 HZ1 LYS 10 HZ1 LYS 10 101.400 -19.803 18.118 81 HZ2 LYS 10 HZ2 LYS 10 102.063 -19.215 16.727 82 HZ3 LYS 10 HZ3 LYS 10 101.829 -20.838 16.908 83 H GLU 11 H GLU 11 102.513 -21.345 13.193 84 HA GLU 11 HA GLU 11 102.663 -24.177 12.169 85 HB2 GLU 11 HB3 GLU 11 100.453 -24.325 13.767 86 HB3 GLU 11 HB2 GLU 11 102.078 -24.827 14.292 87 HG2 GLU 11 HG2 GLU 11 102.439 -22.847 15.506 88 HG3 GLU 11 HG3 GLU 11 101.211 -21.944 14.587 89 HA PRO 12 HA PRO 12 99.661 -23.226 9.108 90 HB2 PRO 12 HB3 PRO 12 97.805 -25.089 10.598 91 HB3 PRO 12 HB2 PRO 12 98.189 -25.034 8.853 92 HG2 PRO 12 HG3 PRO 12 99.273 -26.847 10.546 93 HG3 PRO 12 HG2 PRO 12 100.137 -26.219 9.118 94 HD2 PRO 12 HD2 PRO 12 100.668 -25.729 11.996 95 HD3 PRO 12 HD3 PRO 12 101.727 -25.447 10.582 96 H GLY 13 H GLY 13 98.175 -21.580 8.886 97 HA2 GLY 13 HA2 GLY 13 95.857 -20.954 10.134 98 HA3 GLY 13 HA3 GLY 13 97.001 -20.496 11.418 99 H LEU 14 H LEU 14 95.608 -18.415 10.655 100 HA LEU 14 HA LEU 14 97.291 -17.012 8.563 101 HB2 LEU 14 HB2 LEU 14 94.977 -17.157 7.834 102 HB3 LEU 14 HB3 LEU 14 94.394 -16.576 9.411 103 HG LEU 14 HG LEU 14 96.374 -14.792 8.094 104 HD11 LEU 14 HD11 LEU 14 95.108 -15.579 6.110 105 HD12 LEU 14 HD12 LEU 14 94.726 -13.882 6.484 106 HD13 LEU 14 HD13 LEU 14 93.580 -15.170 6.926 107 HD21 LEU 14 HD21 LEU 14 95.134 -14.213 10.165 108 HD22 LEU 14 HD22 LEU 14 94.740 -13.086 8.845 109 HD23 LEU 14 HD23 LEU 14 93.594 -14.375 9.287 110 H GLN 15 H GLN 15 98.019 -14.891 9.032 111 HA GLN 15 HA GLN 15 97.424 -13.850 11.784 112 HB2 GLN 15 HB2 GLN 15 100.237 -14.396 10.737 113 HB3 GLN 15 HB3 GLN 15 99.851 -13.526 12.241 114 HG2 GLN 15 HG3 GLN 15 98.434 -15.682 12.794 115 HG3 GLN 15 HG2 GLN 15 99.479 -16.451 11.576 116 HE21 GLN 15 HE21 GLN 15 101.763 -16.688 12.055 117 HE22 GLN 15 HE22 GLN 15 102.390 -16.399 13.662 118 H ILE 16 H ILE 16 97.967 -11.591 12.026 119 HA ILE 16 HA ILE 16 98.473 -10.191 9.386 120 HB ILE 16 HB ILE 16 96.793 -8.836 11.459 121 HG12 ILE 16 HG12 ILE 16 95.984 -11.345 9.971 122 HG13 ILE 16 HG13 ILE 16 95.673 -10.898 11.665 123 HG21 ILE 16 HG21 ILE 16 97.496 -8.048 9.058 124 HG22 ILE 16 HG22 ILE 16 96.224 -9.162 8.502 125 HG23 ILE 16 HG23 ILE 16 95.811 -7.807 9.580 126 HD11 ILE 16 HD11 ILE 16 93.577 -10.554 10.642 127 HD12 ILE 16 HD12 ILE 16 94.289 -8.923 10.632 128 HD13 ILE 16 HD13 ILE 16 94.303 -9.909 9.150 129 H TRP 17 H TRP 17 99.590 -8.164 9.548 130 HA TRP 17 HA TRP 17 100.533 -7.276 12.227 131 HB2 TRP 17 HB2 TRP 17 102.511 -8.231 10.107 132 HB3 TRP 17 HB3 TRP 17 102.927 -7.471 11.662 133 HD1 TRP 17 HD1 TRP 17 101.695 -8.865 13.857 134 HE1 TRP 17 HE1 TRP 17 101.727 -11.408 14.287 135 HE3 TRP 17 HE3 TRP 17 102.748 -10.470 9.130 136 HZ2 TRP 17 HZ2 TRP 17 102.165 -13.816 12.756 137 HZ3 TRP 17 HZ3 TRP 17 102.968 -12.885 8.640 138 HH2 TRP 17 HH2 TRP 17 102.678 -14.560 10.443 139 H ARG 18 H ARG 18 100.055 -5.136 12.018 140 HA ARG 18 HA ARG 18 100.136 -3.800 9.395 141 HB2 ARG 18 HB3 ARG 18 98.517 -2.940 10.909 142 HB3 ARG 18 HB2 ARG 18 99.681 -2.882 12.254 143 HG2 ARG 18 HG2 ARG 18 100.804 -0.996 11.355 144 HG3 ARG 18 HG3 ARG 18 100.094 -1.234 9.740 145 HD2 ARG 18 HD2 ARG 18 99.143 0.601 11.479 146 HD3 ARG 18 HD3 ARG 18 98.088 -0.254 10.328 147 HE ARG 18 HE ARG 18 98.141 -1.927 12.588 148 HH11 ARG 18 HH11 ARG 18 96.610 -1.714 14.239 149 HH12 ARG 18 HH12 ARG 18 95.788 -0.189 14.477 150 HH21 ARG 18 HH21 ARG 18 97.440 1.408 11.862 151 HH22 ARG 18 HH22 ARG 18 96.255 1.570 13.138 152 H VAL 19 H VAL 19 101.889 -2.827 8.467 153 HA VAL 19 HA VAL 19 104.471 -2.953 9.815 154 HB VAL 19 HB VAL 19 104.768 -3.046 7.539 155 HG11 VAL 19 HG11 VAL 19 103.451 -1.299 6.046 156 HG12 VAL 19 HG12 VAL 19 102.383 -1.204 7.466 157 HG13 VAL 19 HG13 VAL 19 102.634 -2.763 6.645 158 HG21 VAL 19 HG21 VAL 19 105.634 -0.866 6.711 159 HG22 VAL 19 HG22 VAL 19 106.179 -1.203 8.371 160 HG23 VAL 19 HG23 VAL 19 104.857 -0.045 8.086 161 H GLU 20 H GLU 20 105.699 -1.347 10.708 162 HA GLU 20 HA GLU 20 104.667 1.439 10.802 163 HB2 GLU 20 HB3 GLU 20 103.408 0.240 12.627 164 HB3 GLU 20 HB2 GLU 20 104.970 -0.171 13.377 165 HG2 GLU 20 HG3 GLU 20 104.189 1.825 14.476 166 HG3 GLU 20 HG2 GLU 20 105.491 2.332 13.374 167 H LYS 21 H LYS 21 106.464 2.671 10.573 168 HA LYS 21 HA LYS 21 108.792 3.161 10.513 169 HB2 LYS 21 HB3 LYS 21 107.972 3.493 12.973 170 HB3 LYS 21 HB2 LYS 21 108.865 1.991 13.310 171 HG2 LYS 21 HG2 LYS 21 110.934 2.972 12.461 172 HG3 LYS 21 HG3 LYS 21 110.069 4.440 11.947 173 HD2 LYS 21 HD2 LYS 21 109.775 5.198 14.136 174 HD3 LYS 21 HD3 LYS 21 109.888 3.562 14.828 175 HE2 LYS 21 HE3 LYS 21 112.273 3.491 14.482 176 HE3 LYS 21 HE2 LYS 21 112.235 4.971 13.494 177 HZ1 LYS 21 HZ1 LYS 21 112.946 5.423 15.747 178 HZ2 LYS 21 HZ2 LYS 21 111.511 6.176 15.444 179 HZ3 LYS 21 HZ3 LYS 21 111.545 4.805 16.360 180 H PHE 22 H PHE 22 107.892 0.323 9.822 181 HA PHE 22 HA PHE 22 109.063 -1.608 9.104 182 HB2 PHE 22 HB2 PHE 22 111.669 -0.590 10.212 183 HB3 PHE 22 HB3 PHE 22 111.340 -1.434 8.680 184 HD1 PHE 22 HD1 PHE 22 112.579 1.507 9.732 185 HD2 PHE 22 HD2 PHE 22 109.249 0.095 7.414 186 HE1 PHE 22 HE1 PHE 22 112.472 3.688 8.557 187 HE2 PHE 22 HE2 PHE 22 109.142 2.277 6.239 188 HZ PHE 22 HZ PHE 22 110.757 4.072 6.807 189 H ASP 23 H ASP 23 107.808 -1.514 11.654 190 HA ASP 23 HA ASP 23 109.667 -3.337 13.198 191 HB2 ASP 23 HB2 ASP 23 109.124 -0.944 14.167 192 HB3 ASP 23 HB3 ASP 23 107.548 -1.670 14.565 193 H LEU 24 H LEU 24 106.647 -2.870 11.644 194 HA LEU 24 HA LEU 24 104.735 -4.250 11.512 195 HB2 LEU 24 HB2 LEU 24 106.743 -6.290 12.567 196 HB3 LEU 24 HB3 LEU 24 105.129 -6.696 11.937 197 HG LEU 24 HG LEU 24 106.953 -4.987 10.251 198 HD11 LEU 24 HD11 LEU 24 108.379 -6.872 10.995 199 HD12 LEU 24 HD12 LEU 24 107.959 -7.028 9.273 200 HD13 LEU 24 HD13 LEU 24 107.121 -8.024 10.487 201 HD21 LEU 24 HD21 LEU 24 104.609 -5.436 9.572 202 HD22 LEU 24 HD22 LEU 24 104.921 -7.186 9.656 203 HD23 LEU 24 HD23 LEU 24 105.759 -6.191 8.442 204 H VAL 25 H VAL 25 103.014 -4.100 12.836 205 HA VAL 25 HA VAL 25 103.363 -4.948 15.709 206 HB VAL 25 HB VAL 25 102.133 -2.339 14.712 207 HG11 VAL 25 HG11 VAL 25 100.733 -3.376 16.477 208 HG12 VAL 25 HG12 VAL 25 101.573 -1.933 17.094 209 HG13 VAL 25 HG13 VAL 25 102.171 -3.557 17.511 210 HG21 VAL 25 HG21 VAL 25 104.600 -2.341 14.968 211 HG22 VAL 25 HG22 VAL 25 104.427 -2.954 16.630 212 HG23 VAL 25 HG23 VAL 25 103.830 -1.329 16.214 213 HA PRO 26 HA PRO 26 99.825 -7.462 14.592 214 HB2 PRO 26 HB2 PRO 26 99.175 -6.930 17.493 215 HB3 PRO 26 HB3 PRO 26 99.181 -8.474 16.592 216 HG2 PRO 26 HG2 PRO 26 101.179 -7.767 18.260 217 HG3 PRO 26 HG3 PRO 26 101.449 -8.738 16.787 218 HD2 PRO 26 HD3 PRO 26 102.194 -5.908 17.347 219 HD3 PRO 26 HD2 PRO 26 102.879 -7.044 16.146 220 H VAL 27 H VAL 27 97.726 -7.017 13.950 221 HA VAL 27 HA VAL 27 96.828 -4.211 14.207 222 HB VAL 27 HB VAL 27 96.504 -5.583 12.127 223 HG11 VAL 27 HG11 VAL 27 95.122 -7.472 12.072 224 HG12 VAL 27 HG12 VAL 27 94.242 -6.996 13.544 225 HG13 VAL 27 HG13 VAL 27 95.893 -7.650 13.666 226 HG21 VAL 27 HG21 VAL 27 94.158 -4.895 11.743 227 HG22 VAL 27 HG22 VAL 27 95.050 -3.626 12.615 228 HG23 VAL 27 HG23 VAL 27 93.926 -4.689 13.495 229 HA PRO 28 HA PRO 28 94.612 -4.507 18.055 230 HB2 PRO 28 HB2 PRO 28 92.493 -3.062 16.459 231 HB3 PRO 28 HB3 PRO 28 93.151 -2.688 18.078 232 HG2 PRO 28 HG3 PRO 28 93.892 -1.355 15.841 233 HG3 PRO 28 HG2 PRO 28 94.979 -1.605 17.233 234 HD2 PRO 28 HD3 PRO 28 95.087 -2.806 14.524 235 HD3 PRO 28 HD2 PRO 28 96.368 -2.712 15.769 236 H THR 29 H THR 29 93.986 -6.653 18.311 237 HA THR 29 HA THR 29 92.358 -8.204 16.601 238 HB THR 29 HB THR 29 92.185 -8.289 19.641 239 HG1 THR 29 HG1 THR 29 94.045 -9.658 19.441 240 HG21 THR 29 HG21 THR 29 91.883 -10.715 19.227 241 HG22 THR 29 HG22 THR 29 90.633 -9.762 18.391 242 HG23 THR 29 HG23 THR 29 92.004 -10.430 17.474 243 H ASN 30 H ASN 30 91.357 -5.840 19.082 244 HA ASN 30 HA ASN 30 88.603 -6.349 19.249 245 HB2 ASN 30 HB2 ASN 30 88.431 -3.707 19.197 246 HB3 ASN 30 HB3 ASN 30 89.302 -4.514 20.523 247 HD21 ASN 30 HD21 ASN 30 90.310 -2.132 20.433 248 HD22 ASN 30 HD22 ASN 30 91.744 -1.986 19.443 249 H LEU 31 H LEU 31 90.356 -4.744 16.575 250 HA LEU 31 HA LEU 31 87.805 -4.372 15.085 251 HB2 LEU 31 HB2 LEU 31 90.723 -3.739 14.558 252 HB3 LEU 31 HB3 LEU 31 89.523 -3.658 13.246 253 HG LEU 31 HG LEU 31 88.241 -1.986 14.398 254 HD11 LEU 31 HD11 LEU 31 88.987 -1.224 16.718 255 HD12 LEU 31 HD12 LEU 31 90.026 -2.668 16.770 256 HD13 LEU 31 HD13 LEU 31 88.259 -2.847 16.651 257 HD21 LEU 31 HD21 LEU 31 90.309 -1.150 13.308 258 HD22 LEU 31 HD22 LEU 31 91.208 -1.404 14.822 259 HD23 LEU 31 HD23 LEU 31 89.912 -0.186 14.750 260 H TYR 32 H TYR 32 90.894 -6.133 14.526 261 HA TYR 32 HA TYR 32 91.294 -7.982 13.098 262 HB2 TYR 32 HB2 TYR 32 90.080 -8.959 15.112 263 HB3 TYR 32 HB3 TYR 32 88.584 -8.894 14.149 264 HD1 TYR 32 HD1 TYR 32 88.016 -10.787 12.923 265 HD2 TYR 32 HD2 TYR 32 92.157 -10.044 13.797 266 HE1 TYR 32 HE1 TYR 32 88.633 -12.921 11.818 267 HE2 TYR 32 HE2 TYR 32 92.772 -12.179 12.693 268 HH TYR 32 HH TYR 32 90.651 -14.604 12.021 269 H GLY 33 H GLY 33 91.114 -6.957 11.057 270 HA2 GLY 33 HA2 GLY 33 89.946 -7.732 8.906 271 HA3 GLY 33 HA3 GLY 33 88.417 -7.338 9.726 272 H ASP 34 H ASP 34 89.561 -4.917 11.026 273 HA ASP 34 HA ASP 34 89.201 -3.114 8.681 274 HB2 ASP 34 HB3 ASP 34 89.826 -2.229 11.514 275 HB3 ASP 34 HB2 ASP 34 88.887 -1.381 10.263 276 H PHE 35 H PHE 35 90.820 -1.883 7.747 277 HA PHE 35 HA PHE 35 93.488 -1.820 9.122 278 HB2 PHE 35 HB2 PHE 35 93.257 -2.689 6.218 279 HB3 PHE 35 HB3 PHE 35 94.686 -2.755 7.277 280 HD1 PHE 35 HD1 PHE 35 94.459 -4.218 9.435 281 HD2 PHE 35 HD2 PHE 35 91.883 -4.578 6.015 282 HE1 PHE 35 HE1 PHE 35 93.823 -6.503 10.155 283 HE2 PHE 35 HE2 PHE 35 91.244 -6.864 6.738 284 HZ PHE 35 HZ PHE 35 92.217 -7.827 8.805 285 H PHE 36 H PHE 36 94.882 -0.142 8.297 286 HA PHE 36 HA PHE 36 93.368 2.156 7.237 287 HB2 PHE 36 HB2 PHE 36 96.221 1.642 8.096 288 HB3 PHE 36 HB3 PHE 36 95.835 3.108 7.163 289 HD1 PHE 36 HD1 PHE 36 95.672 4.952 8.575 290 HD2 PHE 36 HD2 PHE 36 94.029 1.196 9.861 291 HE1 PHE 36 HE1 PHE 36 94.808 6.034 10.632 292 HE2 PHE 36 HE2 PHE 36 93.165 2.278 11.918 293 HZ PHE 36 HZ PHE 36 93.557 4.698 12.305 294 H THR 37 H THR 37 93.151 2.701 5.119 295 HA THR 37 HA THR 37 94.293 0.937 3.068 296 HB THR 37 HB THR 37 93.219 2.598 1.489 297 HG1 THR 37 HG1 THR 37 91.948 4.233 2.534 298 HG21 THR 37 HG21 THR 37 90.900 2.078 2.204 299 HG22 THR 37 HG22 THR 37 91.499 1.630 3.820 300 HG23 THR 37 HG23 THR 37 91.961 0.662 2.399 301 H GLY 38 H GLY 38 95.200 4.013 4.518 302 HA2 GLY 38 HA2 GLY 38 97.063 4.694 2.323 303 HA3 GLY 38 HA3 GLY 38 96.926 5.533 3.886 304 H ASP 39 H ASP 39 97.149 2.788 5.253 305 HA ASP 39 HA ASP 39 100.150 2.776 5.218 306 HB2 ASP 39 HB2 ASP 39 98.626 2.866 7.352 307 HB3 ASP 39 HB3 ASP 39 98.414 1.121 7.069 308 H ALA 40 H ALA 40 100.503 0.102 6.155 309 HA ALA 40 HA ALA 40 99.431 -1.538 3.860 310 HB1 ALA 40 HB1 ALA 40 101.492 -1.480 2.908 311 HB2 ALA 40 HB2 ALA 40 102.031 -2.492 4.269 312 HB3 ALA 40 HB3 ALA 40 102.215 -0.723 4.347 313 H TYR 41 H TYR 41 98.990 -3.674 4.410 314 HA TYR 41 HA TYR 41 99.697 -4.454 7.253 315 HB2 TYR 41 HB2 TYR 41 97.103 -4.884 5.715 316 HB3 TYR 41 HB3 TYR 41 97.493 -5.712 7.242 317 HD1 TYR 41 HD1 TYR 41 96.924 -4.686 9.261 318 HD2 TYR 41 HD2 TYR 41 97.393 -2.267 5.743 319 HE1 TYR 41 HE1 TYR 41 96.168 -2.695 10.530 320 HE2 TYR 41 HE2 TYR 41 96.636 -0.275 7.013 321 HH TYR 41 HH TYR 41 96.464 -0.156 10.357 322 H VAL 42 H VAL 42 100.856 -6.303 7.353 323 HA VAL 42 HA VAL 42 101.018 -7.981 4.872 324 HB VAL 42 HB VAL 42 102.571 -8.277 7.479 325 HG11 VAL 42 HG11 VAL 42 102.390 -10.081 5.519 326 HG12 VAL 42 HG12 VAL 42 103.950 -9.739 6.304 327 HG13 VAL 42 HG13 VAL 42 103.566 -9.002 4.730 328 HG21 VAL 42 HG21 VAL 42 104.349 -6.965 6.354 329 HG22 VAL 42 HG22 VAL 42 103.272 -6.699 4.962 330 HG23 VAL 42 HG23 VAL 42 102.868 -5.998 6.548 331 H ILE 43 H ILE 43 99.926 -9.885 4.710 332 HA ILE 43 HA ILE 43 99.097 -11.244 7.273 333 HB ILE 43 HB ILE 43 97.135 -11.298 5.018 334 HG12 ILE 43 HG12 ILE 43 97.469 -8.862 6.820 335 HG13 ILE 43 HG13 ILE 43 97.856 -8.910 5.083 336 HG21 ILE 43 HG21 ILE 43 95.542 -11.271 6.881 337 HG22 ILE 43 HG22 ILE 43 96.816 -12.469 7.210 338 HG23 ILE 43 HG23 ILE 43 96.849 -10.888 8.027 339 HD11 ILE 43 HD11 ILE 43 95.601 -7.958 5.467 340 HD12 ILE 43 HD12 ILE 43 95.116 -9.447 6.313 341 HD13 ILE 43 HD13 ILE 43 95.501 -9.496 4.576 342 H LEU 44 H LEU 44 99.021 -13.495 7.109 343 HA LEU 44 HA LEU 44 99.461 -14.653 4.377 344 HB2 LEU 44 HB2 LEU 44 101.281 -16.153 5.553 345 HB3 LEU 44 HB3 LEU 44 101.721 -14.541 4.941 346 HG LEU 44 HG LEU 44 101.376 -13.590 7.200 347 HD11 LEU 44 HD11 LEU 44 101.303 -15.630 8.987 348 HD12 LEU 44 HD12 LEU 44 100.358 -16.365 7.670 349 HD13 LEU 44 HD13 LEU 44 99.833 -14.824 8.388 350 HD21 LEU 44 HD21 LEU 44 103.321 -14.691 8.279 351 HD22 LEU 44 HD22 LEU 44 103.170 -16.059 7.150 352 HD23 LEU 44 HD23 LEU 44 103.607 -14.445 6.540 353 H LYS 45 H LYS 45 99.351 -17.109 4.468 354 HA LYS 45 HA LYS 45 97.840 -18.122 6.850 355 HB2 LYS 45 HB2 LYS 45 96.262 -17.146 4.997 356 HB3 LYS 45 HB3 LYS 45 96.714 -18.599 4.076 357 HG2 LYS 45 HG3 LYS 45 95.909 -19.021 6.928 358 HG3 LYS 45 HG2 LYS 45 94.618 -18.542 5.801 359 HD2 LYS 45 HD2 LYS 45 96.547 -20.733 5.018 360 HD3 LYS 45 HD3 LYS 45 95.197 -21.101 6.118 361 HE2 LYS 45 HE3 LYS 45 94.736 -19.601 3.522 362 HE3 LYS 45 HE2 LYS 45 94.800 -21.380 3.557 363 HZ1 LYS 45 HZ1 LYS 45 92.899 -21.487 4.749 364 HZ2 LYS 45 HZ2 LYS 45 93.127 -20.050 5.524 365 HZ3 LYS 45 HZ3 LYS 45 92.585 -20.070 3.967 366 H THR 46 H THR 46 99.554 -19.557 7.260 367 HA THR 46 HA THR 46 100.713 -21.209 5.141 368 HB THR 46 HB THR 46 100.743 -21.495 8.178 369 HG1 THR 46 HG1 THR 46 101.799 -19.634 7.453 370 HG21 THR 46 HG21 THR 46 101.190 -23.600 6.743 371 HG22 THR 46 HG22 THR 46 102.445 -23.136 7.916 372 HG23 THR 46 HG23 THR 46 102.658 -22.759 6.190 373 H VAL 47 H VAL 47 99.911 -23.032 4.279 374 HA VAL 47 HA VAL 47 97.553 -24.305 5.666 375 HB VAL 47 HB VAL 47 98.244 -25.134 2.901 376 HG11 VAL 47 HG11 VAL 47 96.169 -25.813 4.076 377 HG12 VAL 47 HG12 VAL 47 95.801 -24.849 2.626 378 HG13 VAL 47 HG13 VAL 47 95.703 -24.103 4.239 379 HG21 VAL 47 HG21 VAL 47 97.191 -22.989 1.991 380 HG22 VAL 47 HG22 VAL 47 98.850 -22.826 2.615 381 HG23 VAL 47 HG23 VAL 47 97.471 -22.274 3.597 382 H GLN 48 H GLN 48 97.422 -26.705 5.406 383 HA GLN 48 HA GLN 48 100.183 -27.948 5.402 384 HB2 GLN 48 HB2 GLN 48 99.281 -27.767 7.716 385 HB3 GLN 48 HB3 GLN 48 97.826 -28.657 7.208 386 HG2 GLN 48 HG2 GLN 48 99.250 -30.592 6.561 387 HG3 GLN 48 HG3 GLN 48 100.691 -29.702 7.108 388 HE21 GLN 48 HE21 GLN 48 97.517 -29.552 8.763 389 HE22 GLN 48 HE22 GLN 48 98.054 -30.371 10.212 390 H LEU 49 H LEU 49 100.125 -28.945 3.406 391 HA LEU 49 HA LEU 49 97.989 -29.931 1.937 392 HB2 LEU 49 HB2 LEU 49 100.600 -31.444 2.388 393 HB3 LEU 49 HB3 LEU 49 99.509 -31.616 0.992 394 HG LEU 49 HG LEU 49 100.920 -29.034 1.802 395 HD11 LEU 49 HD11 LEU 49 102.495 -30.753 0.958 396 HD12 LEU 49 HD12 LEU 49 101.467 -30.990 -0.476 397 HD13 LEU 49 HD13 LEU 49 102.295 -29.435 -0.222 398 HD21 LEU 49 HD21 LEU 49 100.110 -28.241 -0.405 399 HD22 LEU 49 HD22 LEU 49 99.283 -29.796 -0.660 400 HD23 LEU 49 HD23 LEU 49 98.750 -28.709 0.644 401 H ARG 50 H ARG 50 99.857 -32.435 3.644 402 HA ARG 50 HA ARG 50 97.299 -33.396 4.904 403 HB2 ARG 50 HB2 ARG 50 99.075 -35.483 3.704 404 HB3 ARG 50 HB3 ARG 50 97.302 -35.443 3.851 405 HG2 ARG 50 HG2 ARG 50 97.217 -33.714 2.052 406 HG3 ARG 50 HG3 ARG 50 98.985 -33.833 1.879 407 HD2 ARG 50 HD3 ARG 50 98.401 -36.446 1.649 408 HD3 ARG 50 HD2 ARG 50 96.845 -35.788 1.088 409 HE ARG 50 HE ARG 50 99.470 -35.534 -0.299 410 HH11 ARG 50 HH11 ARG 50 99.303 -34.645 -2.372 411 HH12 ARG 50 HH12 ARG 50 97.807 -33.895 -2.884 412 HH21 ARG 50 HH21 ARG 50 96.169 -34.504 0.126 413 HH22 ARG 50 HH22 ARG 50 96.042 -33.815 -1.477 414 H ASN 51 H ASN 51 100.787 -34.165 4.504 415 HA ASN 51 HA ASN 51 101.278 -33.850 7.372 416 HB2 ASN 51 HB2 ASN 51 100.030 -36.156 7.035 417 HB3 ASN 51 HB3 ASN 51 101.612 -36.703 6.430 418 HD21 ASN 51 HD21 ASN 51 102.682 -34.419 8.427 419 HD22 ASN 51 HD22 ASN 51 102.740 -35.290 9.943 420 H GLY 52 H GLY 52 102.294 -33.230 4.563 421 HA2 GLY 52 HA3 GLY 52 105.069 -34.394 4.871 422 HA3 GLY 52 HA2 GLY 52 104.389 -33.794 3.340 423 H ASN 53 H ASN 53 103.930 -31.431 3.213 424 HA ASN 53 HA ASN 53 105.551 -29.825 5.185 425 HB2 ASN 53 HB2 ASN 53 106.429 -28.498 3.192 426 HB3 ASN 53 HB3 ASN 53 107.081 -30.148 3.346 427 HD21 ASN 53 HD21 ASN 53 107.259 -29.114 0.816 428 HD22 ASN 53 HD22 ASN 53 106.031 -29.798 -0.225 429 H LEU 54 H LEU 54 104.975 -27.522 5.161 430 HA LEU 54 HA LEU 54 102.153 -27.130 4.144 431 HB2 LEU 54 HB2 LEU 54 102.405 -25.149 5.947 432 HB3 LEU 54 HB3 LEU 54 101.930 -26.796 6.425 433 HG LEU 54 HG LEU 54 104.316 -27.328 6.901 434 HD11 LEU 54 HD11 LEU 54 105.704 -25.026 7.106 435 HD12 LEU 54 HD12 LEU 54 105.698 -25.995 5.614 436 HD13 LEU 54 HD13 LEU 54 104.637 -24.574 5.756 437 HD21 LEU 54 HD21 LEU 54 102.855 -26.458 8.709 438 HD22 LEU 54 HD22 LEU 54 104.534 -25.905 8.920 439 HD23 LEU 54 HD23 LEU 54 103.306 -24.793 8.270 440 H GLN 55 H GLN 55 101.664 -24.757 3.607 441 HA GLN 55 HA GLN 55 104.122 -23.471 2.388 442 HB2 GLN 55 HB2 GLN 55 102.954 -24.404 0.530 443 HB3 GLN 55 HB3 GLN 55 101.369 -23.939 1.191 444 HG2 GLN 55 HG3 GLN 55 101.764 -21.614 0.761 445 HG3 GLN 55 HG2 GLN 55 103.494 -21.893 0.448 446 HE21 GLN 55 HE21 GLN 55 103.242 -24.243 -1.225 447 HE22 GLN 55 HE22 GLN 55 102.477 -23.745 -2.718 448 H TYR 56 H TYR 56 104.441 -21.532 3.354 449 HA TYR 56 HA TYR 56 102.332 -20.198 4.897 450 HB2 TYR 56 HB3 TYR 56 105.157 -19.539 4.040 451 HB3 TYR 56 HB2 TYR 56 104.126 -18.248 4.696 452 HD1 TYR 56 HD1 TYR 56 104.525 -21.898 5.535 453 HD2 TYR 56 HD2 TYR 56 104.684 -17.831 6.911 454 HE1 TYR 56 HE1 TYR 56 105.008 -22.693 7.836 455 HE2 TYR 56 HE2 TYR 56 105.158 -18.627 9.212 456 HH TYR 56 HH TYR 56 106.275 -21.512 9.984 457 H ASP 57 H ASP 57 100.596 -19.343 3.787 458 HA ASP 57 HA ASP 57 100.887 -18.304 1.057 459 HB2 ASP 57 HB3 ASP 57 98.675 -18.034 3.142 460 HB3 ASP 57 HB2 ASP 57 98.549 -17.414 1.479 461 H LEU 58 H LEU 58 101.872 -16.378 0.599 462 HA LEU 58 HA LEU 58 101.960 -14.332 2.817 463 HB2 LEU 58 HB2 LEU 58 103.793 -15.176 0.664 464 HB3 LEU 58 HB3 LEU 58 103.596 -13.410 0.755 465 HG LEU 58 HG LEU 58 105.458 -14.275 2.205 466 HD11 LEU 58 HD11 LEU 58 103.038 -12.918 3.437 467 HD12 LEU 58 HD12 LEU 58 104.567 -12.186 2.894 468 HD13 LEU 58 HD13 LEU 58 104.531 -13.179 4.370 469 HD21 LEU 58 HD21 LEU 58 105.114 -15.805 3.928 470 HD22 LEU 58 HD22 LEU 58 103.936 -16.402 2.735 471 HD23 LEU 58 HD23 LEU 58 103.391 -15.391 4.094 472 H HIS 59 H HIS 59 100.492 -12.701 2.682 473 HA HIS 59 HA HIS 59 99.945 -11.574 -0.046 474 HB2 HIS 59 HB3 HIS 59 97.430 -11.474 1.166 475 HB3 HIS 59 HB2 HIS 59 97.916 -12.571 -0.146 476 HD2 HIS 59 HD2 HIS 59 99.158 -15.092 1.039 477 HE1 HIS 59 HE1 HIS 59 96.582 -14.861 4.378 478 H TYR 60 H TYR 60 100.403 -9.444 0.149 479 HA TYR 60 HA TYR 60 99.960 -8.180 2.847 480 HB2 TYR 60 HB2 TYR 60 101.126 -6.276 1.124 481 HB3 TYR 60 HB3 TYR 60 101.949 -7.214 2.391 482 HD1 TYR 60 HD1 TYR 60 102.221 -6.313 -0.909 483 HD2 TYR 60 HD2 TYR 60 102.267 -9.851 1.527 484 HE1 TYR 60 HE1 TYR 60 103.548 -7.488 -2.642 485 HE2 TYR 60 HE2 TYR 60 103.584 -11.030 -0.211 486 HH TYR 60 HH TYR 60 105.232 -9.544 -2.620 487 H TRP 61 H TRP 61 98.511 -6.478 3.120 488 HA TRP 61 HA TRP 61 96.641 -6.080 0.793 489 HB2 TRP 61 HB2 TRP 61 95.873 -6.820 3.164 490 HB3 TRP 61 HB3 TRP 61 96.174 -5.129 3.634 491 HD1 TRP 61 HD1 TRP 61 94.235 -7.064 0.885 492 HE1 TRP 61 HE1 TRP 61 92.076 -5.771 0.323 493 HE3 TRP 61 HE3 TRP 61 94.899 -3.012 3.922 494 HZ2 TRP 61 HZ2 TRP 61 90.817 -3.295 1.100 495 HZ3 TRP 61 HZ3 TRP 61 93.210 -1.203 3.992 496 HH2 TRP 61 HH2 TRP 61 91.171 -1.336 2.586 497 H LEU 62 H LEU 62 96.649 -4.210 -0.302 498 HA LEU 62 HA LEU 62 97.811 -1.776 1.072 499 HB2 LEU 62 HB3 LEU 62 98.056 -1.946 -1.895 500 HB3 LEU 62 HB2 LEU 62 99.215 -1.336 -0.691 501 HG LEU 62 HG LEU 62 98.603 -4.284 -1.190 502 HD11 LEU 62 HD11 LEU 62 100.865 -4.339 -2.206 503 HD12 LEU 62 HD12 LEU 62 101.011 -2.580 -1.974 504 HD13 LEU 62 HD13 LEU 62 99.790 -3.232 -3.093 505 HD21 LEU 62 HD21 LEU 62 101.107 -3.584 0.166 506 HD22 LEU 62 HD22 LEU 62 99.686 -2.997 1.062 507 HD23 LEU 62 HD23 LEU 62 99.834 -4.725 0.661 508 H GLY 63 H GLY 63 96.030 -0.505 1.414 509 HA2 GLY 63 HA3 GLY 63 93.611 -0.668 -0.165 510 HA3 GLY 63 HA2 GLY 63 94.036 0.670 0.929 511 H ASN 64 H ASN 64 96.445 0.050 -1.403 512 HA ASN 64 HA ASN 64 97.077 1.213 -3.361 513 HB2 ASN 64 HB2 ASN 64 94.602 0.517 -3.944 514 HB3 ASN 64 HB3 ASN 64 94.252 2.242 -3.680 515 HD21 ASN 64 HD21 ASN 64 97.239 0.747 -5.065 516 HD22 ASN 64 HD22 ASN 64 97.098 1.551 -6.612 517 H GLU 65 H GLU 65 96.024 2.603 -0.554 518 HA GLU 65 HA GLU 65 96.422 5.409 -1.598 519 HB2 GLU 65 HB2 GLU 65 95.215 4.291 0.963 520 HB3 GLU 65 HB3 GLU 65 95.624 6.013 0.774 521 HG2 GLU 65 HG3 GLU 65 93.986 4.652 -1.363 522 HG3 GLU 65 HG2 GLU 65 93.195 5.138 0.155 523 H CYS 66 H CYS 66 98.261 2.937 -0.559 524 HA CYS 66 HA CYS 66 99.958 4.615 1.279 525 HB2 CYS 66 HB2 CYS 66 99.299 2.249 1.927 526 HB3 CYS 66 HB3 CYS 66 100.272 1.672 0.553 527 HG CYS 66 HG CYS 66 101.375 2.218 3.548 528 H SER 67 H SER 67 101.549 5.754 0.300 529 HA SER 67 HA SER 67 102.328 5.686 -2.375 530 HB2 SER 67 HB3 SER 67 104.260 6.871 -1.755 531 HB3 SER 67 HB2 SER 67 103.185 7.153 -0.365 532 HG SER 67 HG SER 67 105.167 6.465 0.431 533 H GLN 68 H GLN 68 103.207 4.172 -3.689 534 HA GLN 68 HA GLN 68 103.771 1.520 -2.984 535 HB2 GLN 68 HB3 GLN 68 105.635 2.743 -4.985 536 HB3 GLN 68 HB2 GLN 68 104.616 1.289 -5.117 537 HG2 GLN 68 HG2 GLN 68 103.486 2.758 -6.541 538 HG3 GLN 68 HG3 GLN 68 102.631 3.046 -5.007 539 HE21 GLN 68 HE21 GLN 68 102.213 5.264 -4.927 540 HE22 GLN 68 HE22 GLN 68 103.407 6.501 -5.246 541 H ASP 69 H ASP 69 105.793 4.364 -2.499 542 HA ASP 69 HA ASP 69 108.315 3.071 -2.076 543 HB2 ASP 69 HB2 ASP 69 107.641 5.618 -2.078 544 HB3 ASP 69 HB3 ASP 69 107.405 5.368 -0.332 545 H GLU 70 H GLU 70 105.584 3.631 0.177 546 HA GLU 70 HA GLU 70 107.063 2.197 2.335 547 HB2 GLU 70 HB2 GLU 70 104.191 3.223 2.274 548 HB3 GLU 70 HB3 GLU 70 105.099 2.700 3.712 549 HG2 GLU 70 HG3 GLU 70 106.552 4.563 3.621 550 HG3 GLU 70 HG2 GLU 70 106.160 4.901 1.918 551 H SER 71 H SER 71 104.296 1.706 0.153 552 HA SER 71 HA SER 71 103.379 -0.778 1.268 553 HB2 SER 71 HB2 SER 71 102.439 0.763 -0.678 554 HB3 SER 71 HB3 SER 71 103.397 -0.321 -1.715 555 HG SER 71 HG SER 71 102.243 -2.076 -0.874 556 H GLY 72 H GLY 72 105.560 -0.269 -1.562 557 HA2 GLY 72 HA2 GLY 72 106.271 -2.976 -1.974 558 HA3 GLY 72 HA3 GLY 72 107.373 -1.613 -2.284 559 H ALA 73 H ALA 73 107.604 -0.648 0.392 560 HA ALA 73 HA ALA 73 109.746 -2.255 1.378 561 HB1 ALA 73 HB1 ALA 73 109.903 -0.645 2.983 562 HB2 ALA 73 HB2 ALA 73 108.612 0.171 2.069 563 HB3 ALA 73 HB3 ALA 73 108.204 -0.843 3.474 564 H ALA 74 H ALA 74 106.344 -2.101 2.573 565 HA ALA 74 HA ALA 74 106.586 -4.147 4.541 566 HB1 ALA 74 HB1 ALA 74 104.148 -4.487 4.242 567 HB2 ALA 74 HB2 ALA 74 104.553 -2.754 4.250 568 HB3 ALA 74 HB3 ALA 74 104.208 -3.581 2.711 569 H ALA 75 H ALA 75 106.048 -4.393 1.027 570 HA ALA 75 HA ALA 75 105.718 -7.307 1.088 571 HB1 ALA 75 HB1 ALA 75 106.564 -5.489 -1.215 572 HB2 ALA 75 HB2 ALA 75 104.881 -5.864 -0.776 573 HB3 ALA 75 HB3 ALA 75 105.957 -7.156 -1.358 574 H ILE 76 H ILE 76 108.420 -5.127 1.204 575 HA ILE 76 HA ILE 76 110.365 -7.118 0.192 576 HB ILE 76 HB ILE 76 110.661 -4.437 1.611 577 HG12 ILE 76 HG13 ILE 76 109.832 -4.791 -0.889 578 HG13 ILE 76 HG12 ILE 76 111.034 -3.534 -0.511 579 HG21 ILE 76 HG21 ILE 76 112.630 -5.598 2.227 580 HG22 ILE 76 HG22 ILE 76 112.709 -6.469 0.676 581 HG23 ILE 76 HG23 ILE 76 113.100 -4.734 0.743 582 HD11 ILE 76 HD11 ILE 76 111.526 -5.136 -2.507 583 HD12 ILE 76 HD12 ILE 76 111.895 -6.345 -1.254 584 HD13 ILE 76 HD13 ILE 76 112.832 -4.834 -1.336 585 H PHE 77 H PHE 77 109.488 -5.718 3.388 586 HA PHE 77 HA PHE 77 111.369 -7.370 4.866 587 HB2 PHE 77 HB2 PHE 77 108.878 -5.802 5.572 588 HB3 PHE 77 HB3 PHE 77 109.640 -6.862 6.783 589 HD1 PHE 77 HD1 PHE 77 111.439 -6.053 8.043 590 HD2 PHE 77 HD2 PHE 77 110.483 -4.163 4.306 591 HE1 PHE 77 HE1 PHE 77 113.152 -4.314 8.484 592 HE2 PHE 77 HE2 PHE 77 112.195 -2.424 4.748 593 HZ PHE 77 HZ PHE 77 113.528 -2.499 6.837 594 H THR 78 H THR 78 107.998 -7.813 3.815 595 HA THR 78 HA THR 78 107.646 -10.297 5.345 596 HB THR 78 HB THR 78 105.890 -8.608 4.244 597 HG1 THR 78 HG1 THR 78 105.677 -11.432 4.501 598 HG21 THR 78 HG21 THR 78 104.961 -9.505 2.147 599 HG22 THR 78 HG22 THR 78 106.220 -10.762 2.109 600 HG23 THR 78 HG23 THR 78 106.667 -9.050 1.917 601 H VAL 79 H VAL 79 108.510 -9.477 1.977 602 HA VAL 79 HA VAL 79 108.534 -12.182 0.984 603 HB VAL 79 HB VAL 79 110.016 -9.652 0.187 604 HG11 VAL 79 HG11 VAL 79 110.447 -11.114 -1.969 605 HG12 VAL 79 HG12 VAL 79 111.554 -11.249 -0.582 606 HG13 VAL 79 HG13 VAL 79 110.297 -12.482 -0.841 607 HG21 VAL 79 HG21 VAL 79 108.082 -11.216 -1.515 608 HG22 VAL 79 HG22 VAL 79 107.439 -10.250 -0.165 609 HG23 VAL 79 HG23 VAL 79 108.376 -9.462 -1.457 610 H GLN 80 H GLN 80 111.244 -10.159 2.246 611 HA GLN 80 HA GLN 80 113.215 -12.253 2.065 612 HB2 GLN 80 HB2 GLN 80 112.951 -9.781 3.807 613 HB3 GLN 80 HB3 GLN 80 114.337 -10.887 3.964 614 HG2 GLN 80 HG3 GLN 80 114.849 -10.595 1.560 615 HG3 GLN 80 HG2 GLN 80 113.453 -9.503 1.392 616 HE21 GLN 80 HE21 GLN 80 115.998 -8.497 0.747 617 HE22 GLN 80 HE22 GLN 80 116.502 -7.365 1.983 618 H LEU 81 H LEU 81 111.468 -11.104 5.020 619 HA LEU 81 HA LEU 81 112.354 -13.216 6.710 620 HB2 LEU 81 HB3 LEU 81 110.590 -11.082 6.954 621 HB3 LEU 81 HB2 LEU 81 109.517 -12.491 7.111 622 HG LEU 81 HG LEU 81 110.467 -11.699 9.306 623 HD11 LEU 81 HD11 LEU 81 109.994 -13.858 9.793 624 HD12 LEU 81 HD12 LEU 81 110.538 -14.407 8.190 625 HD13 LEU 81 HD13 LEU 81 111.716 -14.208 9.510 626 HD21 LEU 81 HD21 LEU 81 112.752 -11.689 9.766 627 HD22 LEU 81 HD22 LEU 81 112.765 -11.209 8.053 628 HD23 LEU 81 HD23 LEU 81 113.119 -12.893 8.507 629 H ASP 82 H ASP 82 109.510 -13.115 4.503 630 HA ASP 82 HA ASP 82 108.372 -15.616 5.123 631 HB2 ASP 82 HB2 ASP 82 107.391 -14.227 3.388 632 HB3 ASP 82 HB3 ASP 82 108.854 -14.365 2.384 633 H ASP 83 H ASP 83 111.163 -14.978 2.936 634 HA ASP 83 HA ASP 83 111.699 -17.773 2.428 635 HB2 ASP 83 HB3 ASP 83 113.851 -15.638 2.667 636 HB3 ASP 83 HB2 ASP 83 113.818 -17.059 1.596 637 H TYR 84 H TYR 84 112.333 -15.609 5.109 638 HA TYR 84 HA TYR 84 114.239 -17.413 6.440 639 HB2 TYR 84 HB3 TYR 84 114.019 -14.888 6.826 640 HB3 TYR 84 HB2 TYR 84 112.534 -15.250 7.738 641 HD1 TYR 84 HD1 TYR 84 116.201 -15.472 7.700 642 HD2 TYR 84 HD2 TYR 84 112.633 -16.566 9.825 643 HE1 TYR 84 HE1 TYR 84 117.563 -16.039 9.694 644 HE2 TYR 84 HE2 TYR 84 113.994 -17.130 11.820 645 HH TYR 84 HH TYR 84 117.248 -17.628 11.772 646 H LEU 85 H LEU 85 110.758 -17.104 6.186 647 HA LEU 85 HA LEU 85 110.249 -18.737 8.605 648 HB2 LEU 85 HB3 LEU 85 108.378 -18.039 6.296 649 HB3 LEU 85 HB2 LEU 85 107.903 -18.669 7.891 650 HG LEU 85 HG LEU 85 109.216 -15.984 7.292 651 HD11 LEU 85 HD11 LEU 85 106.775 -16.117 6.870 652 HD12 LEU 85 HD12 LEU 85 107.125 -15.096 8.285 653 HD13 LEU 85 HD13 LEU 85 106.527 -16.757 8.512 654 HD21 LEU 85 HD21 LEU 85 108.745 -17.500 9.874 655 HD22 LEU 85 HD22 LEU 85 110.205 -16.636 9.336 656 HD23 LEU 85 HD23 LEU 85 108.769 -15.721 9.854 657 H ASN 86 H ASN 86 109.846 -19.243 5.058 658 HA ASN 86 HA ASN 86 110.159 -22.202 5.633 659 HB2 ASN 86 HB2 ASN 86 107.845 -21.347 4.840 660 HB3 ASN 86 HB3 ASN 86 108.633 -21.056 3.271 661 HD21 ASN 86 HD21 ASN 86 107.853 -23.623 5.671 662 HD22 ASN 86 HD22 ASN 86 107.994 -24.943 4.532 663 H GLY 87 H GLY 87 110.693 -19.568 3.274 664 HA2 GLY 87 HA2 GLY 87 113.097 -19.539 2.381 665 HA3 GLY 87 HA3 GLY 87 112.889 -21.282 2.082 666 H ARG 88 H ARG 88 109.971 -20.682 1.343 667 HA ARG 88 HA ARG 88 110.411 -19.243 -1.259 668 HB2 ARG 88 HB3 ARG 88 109.212 -22.041 -1.026 669 HB3 ARG 88 HB2 ARG 88 109.334 -21.078 -2.518 670 HG2 ARG 88 HG3 ARG 88 111.907 -20.967 -1.849 671 HG3 ARG 88 HG2 ARG 88 111.508 -22.442 -0.936 672 HD2 ARG 88 HD2 ARG 88 112.067 -23.365 -3.002 673 HD3 ARG 88 HD3 ARG 88 110.316 -23.130 -3.219 674 HE ARG 88 HE ARG 88 111.421 -20.716 -4.108 675 HH11 ARG 88 HH11 ARG 88 112.039 -20.409 -6.260 676 HH12 ARG 88 HH12 ARG 88 112.440 -21.787 -7.261 677 HH21 ARG 88 HH21 ARG 88 111.869 -24.112 -4.731 678 HH22 ARG 88 HH22 ARG 88 112.344 -23.876 -6.398 679 H ALA 89 H ALA 89 107.720 -21.380 -0.366 680 HA ALA 89 HA ALA 89 105.447 -20.851 0.012 681 HB1 ALA 89 HB1 ALA 89 107.035 -18.962 1.581 682 HB2 ALA 89 HB2 ALA 89 105.493 -18.238 1.066 683 HB3 ALA 89 HB3 ALA 89 105.497 -19.757 1.993 684 H VAL 90 H VAL 90 103.675 -19.386 -0.728 685 HA VAL 90 HA VAL 90 104.530 -18.008 -3.265 686 HB VAL 90 HB VAL 90 101.768 -18.825 -2.254 687 HG11 VAL 90 HG11 VAL 90 101.715 -16.864 -3.770 688 HG12 VAL 90 HG12 VAL 90 101.050 -18.308 -4.569 689 HG13 VAL 90 HG13 VAL 90 102.697 -17.755 -4.957 690 HG21 VAL 90 HG21 VAL 90 103.466 -20.008 -4.493 691 HG22 VAL 90 HG22 VAL 90 101.923 -20.632 -3.865 692 HG23 VAL 90 HG23 VAL 90 103.384 -20.689 -2.851 693 H GLN 91 H GLN 91 104.313 -15.801 -3.517 694 HA GLN 91 HA GLN 91 102.996 -14.339 -1.213 695 HB2 GLN 91 HB3 GLN 91 104.668 -12.512 -1.646 696 HB3 GLN 91 HB2 GLN 91 105.415 -14.034 -1.105 697 HG2 GLN 91 HG2 GLN 91 106.774 -13.653 -2.924 698 HG3 GLN 91 HG3 GLN 91 105.441 -14.458 -3.786 699 HE21 GLN 91 HE21 GLN 91 107.336 -12.311 -4.781 700 HE22 GLN 91 HE22 GLN 91 106.296 -11.001 -5.293 701 H HIS 92 H HIS 92 101.460 -12.868 -1.750 702 HA HIS 92 HA HIS 92 101.359 -11.935 -4.614 703 HB2 HIS 92 HB2 HIS 92 98.700 -12.121 -4.033 704 HB3 HIS 92 HB3 HIS 92 99.613 -13.390 -4.880 705 HD2 HIS 92 HD2 HIS 92 100.959 -15.090 -2.539 706 HE1 HIS 92 HE1 HIS 92 97.230 -15.007 -0.563 707 H ARG 93 H ARG 93 100.044 -9.940 -4.862 708 HA ARG 93 HA ARG 93 99.957 -8.389 -2.259 709 HB2 ARG 93 HB2 ARG 93 100.769 -6.455 -3.399 710 HB3 ARG 93 HB3 ARG 93 101.802 -7.790 -3.964 711 HG2 ARG 93 HG2 ARG 93 99.946 -8.004 -5.854 712 HG3 ARG 93 HG3 ARG 93 99.617 -6.309 -5.425 713 HD2 ARG 93 HD3 ARG 93 101.264 -6.323 -7.214 714 HD3 ARG 93 HD2 ARG 93 102.088 -5.837 -5.713 715 HE ARG 93 HE ARG 93 102.193 -8.749 -6.264 716 HH11 ARG 93 HH11 ARG 93 104.273 -9.532 -6.666 717 HH12 ARG 93 HH12 ARG 93 105.583 -8.415 -6.980 718 HH21 ARG 93 HH21 ARG 93 103.581 -5.583 -6.679 719 HH22 ARG 93 HH22 ARG 93 105.192 -6.189 -6.988 720 H GLU 94 H GLU 94 98.091 -7.279 -1.836 721 HA GLU 94 HA GLU 94 95.945 -7.440 -3.962 722 HB2 GLU 94 HB3 GLU 94 95.548 -6.920 -0.989 723 HB3 GLU 94 HB2 GLU 94 94.329 -7.420 -2.186 724 HG2 GLU 94 HG2 GLU 94 95.443 -9.587 -2.464 725 HG3 GLU 94 HG3 GLU 94 96.745 -9.089 -1.357 726 H VAL 95 H VAL 95 96.643 -5.506 -5.050 727 HA VAL 95 HA VAL 95 96.955 -2.993 -3.560 728 HB VAL 95 HB VAL 95 96.316 -3.142 -6.514 729 HG11 VAL 95 HG11 VAL 95 96.667 -0.940 -5.426 730 HG12 VAL 95 HG12 VAL 95 98.249 -1.491 -4.823 731 HG13 VAL 95 HG13 VAL 95 97.980 -1.303 -6.572 732 HG21 VAL 95 HG21 VAL 95 98.910 -3.468 -6.707 733 HG22 VAL 95 HG22 VAL 95 97.893 -4.897 -6.407 734 HG23 VAL 95 HG23 VAL 95 98.783 -4.141 -5.064 735 H GLN 96 H GLN 96 94.459 -4.320 -2.958 736 HA GLN 96 HA GLN 96 92.156 -3.799 -2.802 737 HB2 GLN 96 HB2 GLN 96 93.484 -1.528 -2.244 738 HB3 GLN 96 HB3 GLN 96 92.671 -0.990 -3.733 739 HG2 GLN 96 HG2 GLN 96 90.542 -2.099 -2.600 740 HG3 GLN 96 HG3 GLN 96 91.472 -1.856 -1.102 741 HE21 GLN 96 HE21 GLN 96 92.523 0.509 -1.010 742 HE22 GLN 96 HE22 GLN 96 91.444 1.802 -1.486 743 H GLY 97 H GLY 97 91.032 -4.816 -4.417 744 HA2 GLY 97 HA2 GLY 97 89.587 -3.846 -6.410 745 HA3 GLY 97 HA3 GLY 97 91.175 -3.614 -7.180 746 H PHE 98 H PHE 98 92.586 -5.826 -6.677 747 HA PHE 98 HA PHE 98 90.820 -8.050 -7.734 748 HB2 PHE 98 HB3 PHE 98 93.648 -7.188 -8.366 749 HB3 PHE 98 HB2 PHE 98 93.182 -8.893 -8.571 750 HD1 PHE 98 HD1 PHE 98 92.260 -9.537 -10.612 751 HD2 PHE 98 HD2 PHE 98 91.882 -5.447 -9.354 752 HE1 PHE 98 HE1 PHE 98 91.162 -8.978 -12.762 753 HE2 PHE 98 HE2 PHE 98 90.783 -4.887 -11.506 754 HZ PHE 98 HZ PHE 98 90.421 -6.655 -13.210 755 H GLU 99 H GLU 99 91.208 -7.467 -4.919 756 HA GLU 99 HA GLU 99 93.236 -8.842 -3.567 757 HB2 GLU 99 HB3 GLU 99 90.262 -9.037 -2.911 758 HB3 GLU 99 HB2 GLU 99 91.614 -9.273 -1.777 759 HG2 GLU 99 HG2 GLU 99 92.146 -7.004 -1.724 760 HG3 GLU 99 HG3 GLU 99 91.462 -6.698 -3.338 761 H SER 100 H SER 100 93.030 -11.073 -2.467 762 HA SER 100 HA SER 100 92.408 -13.047 -4.645 763 HB2 SER 100 HB2 SER 100 94.650 -13.036 -3.451 764 HB3 SER 100 HB3 SER 100 93.790 -13.527 -1.971 765 HG SER 100 HG SER 100 94.588 -15.338 -3.179 766 H ALA 101 H ALA 101 91.399 -15.159 -3.911 767 HA ALA 101 HA ALA 101 88.874 -14.584 -2.575 768 HB1 ALA 101 HB1 ALA 101 88.491 -17.027 -2.752 769 HB2 ALA 101 HB2 ALA 101 90.199 -17.263 -3.194 770 HB3 ALA 101 HB3 ALA 101 89.114 -16.365 -4.283 771 H THR 102 H THR 102 92.011 -15.772 -1.495 772 HA THR 102 HA THR 102 91.091 -16.903 1.021 773 HB THR 102 HB THR 102 93.789 -15.604 0.446 774 HG1 THR 102 HG1 THR 102 94.353 -17.750 -0.224 775 HG21 THR 102 HG21 THR 102 94.581 -17.244 2.129 776 HG22 THR 102 HG22 THR 102 93.337 -16.172 2.816 777 HG23 THR 102 HG23 THR 102 92.915 -17.834 2.338 778 H PHE 103 H PHE 103 92.472 -13.696 0.183 779 HA PHE 103 HA PHE 103 92.163 -12.600 2.845 780 HB2 PHE 103 HB2 PHE 103 93.589 -11.580 1.073 781 HB3 PHE 103 HB3 PHE 103 92.122 -11.153 0.159 782 HD1 PHE 103 HD1 PHE 103 93.519 -10.822 3.640 783 HD2 PHE 103 HD2 PHE 103 91.224 -9.032 0.482 784 HE1 PHE 103 HE1 PHE 103 93.278 -8.756 4.990 785 HE2 PHE 103 HE2 PHE 103 90.985 -6.963 1.830 786 HZ PHE 103 HZ PHE 103 92.013 -6.824 4.083 787 H LEU 104 H LEU 104 90.061 -12.455 -0.067 788 HA LEU 104 HA LEU 104 87.991 -10.897 1.276 789 HB2 LEU 104 HB2 LEU 104 88.111 -12.588 -1.233 790 HB3 LEU 104 HB3 LEU 104 86.556 -11.946 -0.655 791 HG LEU 104 HG LEU 104 89.037 -10.238 -1.134 792 HD11 LEU 104 HD11 LEU 104 87.866 -9.480 -3.185 793 HD12 LEU 104 HD12 LEU 104 88.206 -11.226 -3.249 794 HD13 LEU 104 HD13 LEU 104 86.563 -10.653 -2.873 795 HD21 LEU 104 HD21 LEU 104 87.408 -9.333 0.507 796 HD22 LEU 104 HD22 LEU 104 86.098 -9.542 -0.680 797 HD23 LEU 104 HD23 LEU 104 87.405 -8.374 -0.993 798 H GLY 105 H GLY 105 88.689 -14.360 0.967 799 HA2 GLY 105 HA2 GLY 105 86.149 -15.372 1.841 800 HA3 GLY 105 HA3 GLY 105 87.708 -16.196 2.084 801 H TYR 106 H TYR 106 89.098 -14.697 3.807 802 HA TYR 106 HA TYR 106 87.828 -15.183 6.342 803 HB2 TYR 106 HB3 TYR 106 90.232 -13.604 5.424 804 HB3 TYR 106 HB2 TYR 106 89.665 -13.420 7.101 805 HD1 TYR 106 HD1 TYR 106 90.953 -14.708 8.551 806 HD2 TYR 106 HD2 TYR 106 89.866 -16.339 4.728 807 HE1 TYR 106 HE1 TYR 106 92.045 -16.852 9.154 808 HE2 TYR 106 HE2 TYR 106 90.960 -18.482 5.330 809 HH TYR 106 HH TYR 106 91.552 -19.555 8.085 810 H PHE 107 H PHE 107 88.265 -12.132 4.490 811 HA PHE 107 HA PHE 107 86.231 -10.883 6.349 812 HB2 PHE 107 HB2 PHE 107 88.130 -9.467 4.431 813 HB3 PHE 107 HB3 PHE 107 87.162 -8.736 5.734 814 HD1 PHE 107 HD1 PHE 107 87.531 -10.117 8.098 815 HD2 PHE 107 HD2 PHE 107 90.390 -9.688 4.919 816 HE1 PHE 107 HE1 PHE 107 89.376 -10.530 9.700 817 HE2 PHE 107 HE2 PHE 107 92.235 -10.102 6.523 818 HZ PHE 107 HZ PHE 107 91.728 -10.525 8.914 819 H LYS 108 H LYS 108 85.164 -12.586 4.469 820 HA LYS 108 HA LYS 108 84.574 -11.262 1.937 821 HB2 LYS 108 HB2 LYS 108 84.349 -13.723 2.308 822 HB3 LYS 108 HB3 LYS 108 82.988 -13.413 3.412 823 HG2 LYS 108 HG2 LYS 108 81.787 -12.254 1.545 824 HG3 LYS 108 HG3 LYS 108 83.125 -12.684 0.453 825 HD2 LYS 108 HD2 LYS 108 82.655 -15.003 0.600 826 HD3 LYS 108 HD3 LYS 108 81.683 -14.803 2.077 827 HE2 LYS 108 HE2 LYS 108 80.928 -13.698 -0.665 828 HE3 LYS 108 HE3 LYS 108 80.275 -15.197 0.040 829 HZ1 LYS 108 HZ1 LYS 108 78.833 -13.316 0.454 830 HZ2 LYS 108 HZ2 LYS 108 79.438 -13.890 1.877 831 HZ3 LYS 108 HZ3 LYS 108 80.043 -12.501 1.224 832 H SER 109 H SER 109 83.281 -11.011 5.178 833 HA SER 109 HA SER 109 80.712 -9.844 4.337 834 HB2 SER 109 HB2 SER 109 81.292 -10.994 6.592 835 HB3 SER 109 HB3 SER 109 82.044 -9.442 7.036 836 HG SER 109 HG SER 109 79.809 -9.556 7.648 837 H GLY 110 H GLY 110 83.768 -8.720 3.925 838 HA2 GLY 110 HA2 GLY 110 84.177 -6.464 3.085 839 HA3 GLY 110 HA3 GLY 110 82.783 -5.879 4.025 840 H LEU 111 H LEU 111 86.167 -6.123 3.949 841 HA LEU 111 HA LEU 111 86.711 -6.321 6.801 842 HB2 LEU 111 HB2 LEU 111 88.830 -4.899 5.901 843 HB3 LEU 111 HB3 LEU 111 88.661 -6.647 5.611 844 HG LEU 111 HG LEU 111 87.383 -4.730 3.667 845 HD11 LEU 111 HD11 LEU 111 89.680 -3.850 3.992 846 HD12 LEU 111 HD12 LEU 111 89.507 -4.611 2.393 847 HD13 LEU 111 HD13 LEU 111 90.343 -5.476 3.704 848 HD21 LEU 111 HD21 LEU 111 88.935 -7.077 2.749 849 HD22 LEU 111 HD22 LEU 111 87.266 -6.594 2.362 850 HD23 LEU 111 HD23 LEU 111 87.610 -7.486 3.864 851 H LYS 112 H LYS 112 88.005 -3.438 5.399 852 HA LYS 112 HA LYS 112 86.044 -1.490 6.030 853 HB2 LYS 112 HB2 LYS 112 87.041 -2.771 8.408 854 HB3 LYS 112 HB3 LYS 112 87.661 -1.103 8.378 855 HG2 LYS 112 HG3 LYS 112 85.434 -0.194 8.165 856 HG3 LYS 112 HG2 LYS 112 84.740 -1.807 7.874 857 HD2 LYS 112 HD2 LYS 112 85.496 -2.490 10.172 858 HD3 LYS 112 HD3 LYS 112 86.036 -0.817 10.452 859 HE2 LYS 112 HE2 LYS 112 83.856 0.025 10.485 860 HE3 LYS 112 HE3 LYS 112 83.214 -1.313 9.501 861 HZ1 LYS 112 HZ1 LYS 112 82.567 -1.514 11.808 862 HZ2 LYS 112 HZ2 LYS 112 84.142 -1.530 12.296 863 HZ3 LYS 112 HZ3 LYS 112 83.548 -2.770 11.385 864 H TYR 113 H TYR 113 86.943 -0.103 4.585 865 HA TYR 113 HA TYR 113 89.897 0.262 4.521 866 HB2 TYR 113 HB2 TYR 113 88.622 2.194 2.872 867 HB3 TYR 113 HB3 TYR 113 89.396 0.677 2.355 868 HD1 TYR 113 HD1 TYR 113 86.172 2.071 3.670 869 HD2 TYR 113 HD2 TYR 113 88.097 -1.083 1.478 870 HE1 TYR 113 HE1 TYR 113 83.955 1.155 3.042 871 HE2 TYR 113 HE2 TYR 113 85.880 -1.999 0.850 872 HH TYR 113 HH TYR 113 83.050 -0.331 1.064 873 H LYS 114 H LYS 114 90.715 1.502 6.154 874 HA LYS 114 HA LYS 114 89.144 3.957 6.946 875 HB2 LYS 114 HB3 LYS 114 90.004 2.124 8.635 876 HB3 LYS 114 HB2 LYS 114 91.577 2.930 8.421 877 HG2 LYS 114 HG2 LYS 114 90.603 5.080 9.097 878 HG3 LYS 114 HG3 LYS 114 88.989 4.340 9.217 879 HD2 LYS 114 HD2 LYS 114 90.220 2.661 10.862 880 HD3 LYS 114 HD3 LYS 114 91.395 3.990 11.009 881 HE2 LYS 114 HE2 LYS 114 88.388 4.311 11.407 882 HE3 LYS 114 HE3 LYS 114 89.550 4.071 12.733 883 HZ1 LYS 114 HZ1 LYS 114 89.107 6.404 12.350 884 HZ2 LYS 114 HZ2 LYS 114 90.685 6.065 12.012 885 HZ3 LYS 114 HZ3 LYS 114 89.608 6.288 10.783 886 H LYS 115 H LYS 115 89.852 5.870 6.156 887 HA LYS 115 HA LYS 115 92.209 6.105 4.518 888 HB2 LYS 115 HB2 LYS 115 91.872 8.602 4.873 889 HB3 LYS 115 HB3 LYS 115 90.430 7.731 4.297 890 HG2 LYS 115 HG3 LYS 115 89.516 7.643 6.557 891 HG3 LYS 115 HG2 LYS 115 91.008 8.345 7.228 892 HD2 LYS 115 HD3 LYS 115 89.211 9.740 5.196 893 HD3 LYS 115 HD2 LYS 115 89.153 10.026 6.951 894 HE2 LYS 115 HE3 LYS 115 91.786 10.388 6.608 895 HE3 LYS 115 HE2 LYS 115 91.267 10.790 4.954 896 HZ1 LYS 115 HZ1 LYS 115 91.270 12.726 6.380 897 HZ2 LYS 115 HZ2 LYS 115 90.213 12.012 7.426 898 HZ3 LYS 115 HZ3 LYS 115 89.732 12.384 5.893 899 H GLY 116 H GLY 116 94.090 7.604 5.034 900 HA2 GLY 116 HA2 GLY 116 94.779 7.912 7.892 901 HA3 GLY 116 HA3 GLY 116 95.721 6.644 7.072 902 H GLY 117 H GLY 117 95.930 9.771 7.992 903 HA2 GLY 117 HA2 GLY 117 97.322 10.668 5.471 904 HA3 GLY 117 HA3 GLY 117 96.811 11.735 6.800 905 H VAL 118 H VAL 118 98.330 8.672 7.555 906 HA VAL 118 HA VAL 118 100.335 9.795 9.219 907 HB VAL 118 HB VAL 118 100.578 7.247 7.558 908 HG11 VAL 118 HG11 VAL 118 102.681 7.984 8.648 909 HG12 VAL 118 HG12 VAL 118 101.830 8.106 10.207 910 HG13 VAL 118 HG13 VAL 118 102.037 6.519 9.428 911 HG21 VAL 118 HG21 VAL 118 98.455 7.339 8.838 912 HG22 VAL 118 HG22 VAL 118 99.572 6.143 9.538 913 HG23 VAL 118 HG23 VAL 118 99.365 7.730 10.317 914 H ALA 119 H ALA 119 100.268 9.432 5.713 915 HA ALA 119 HA ALA 119 103.150 9.944 5.389 916 HB1 ALA 119 HB1 ALA 119 102.577 10.202 2.990 917 HB2 ALA 119 HB2 ALA 119 101.834 8.734 3.669 918 HB3 ALA 119 HB3 ALA 119 100.845 10.190 3.402 919 H SER 120 H SER 120 100.256 11.882 5.778 920 HA SER 120 HA SER 120 101.583 14.332 4.743 921 HB2 SER 120 HB3 SER 120 99.022 13.730 4.720 922 HB3 SER 120 HB2 SER 120 99.051 14.335 6.394 923 HG SER 120 HG SER 120 98.611 16.010 4.850 924 H GLY 121 H GLY 121 102.123 12.545 7.347 925 HA2 GLY 121 HA2 GLY 121 102.021 14.575 9.477 926 HA3 GLY 121 HA3 GLY 121 102.831 12.992 9.570 927 H PHE 122 H PHE 122 104.673 13.066 7.559 928 HA PHE 122 HA PHE 122 106.813 14.600 8.651 929 HB2 PHE 122 HB2 PHE 122 106.318 13.433 5.892 930 HB3 PHE 122 HB3 PHE 122 107.816 14.318 6.270 931 HD1 PHE 122 HD1 PHE 122 105.724 11.382 7.203 932 HD2 PHE 122 HD2 PHE 122 109.517 13.347 7.649 933 HE1 PHE 122 HE1 PHE 122 106.646 9.356 8.295 934 HE2 PHE 122 HE2 PHE 122 110.439 11.321 8.741 935 HZ PHE 122 HZ PHE 122 109.002 9.323 9.063 936 H LYS 123 H LYS 123 104.316 15.497 6.319 937 HA LYS 123 HA LYS 123 105.685 18.000 5.553 938 HB2 LYS 123 HB3 LYS 123 102.772 17.162 5.198 939 HB3 LYS 123 HB2 LYS 123 103.591 18.504 4.364 940 HG2 LYS 123 HG2 LYS 123 105.290 16.700 3.569 941 HG3 LYS 123 HG3 LYS 123 104.049 15.521 4.058 942 HD2 LYS 123 HD2 LYS 123 102.397 16.822 2.621 943 HD3 LYS 123 HD3 LYS 123 103.782 17.753 2.001 944 HE2 LYS 123 HE3 LYS 123 103.035 14.885 1.532 945 HE3 LYS 123 HE2 LYS 123 103.753 16.070 0.416 946 HZ1 LYS 123 HZ1 LYS 123 105.450 14.582 0.922 947 HZ2 LYS 123 HZ2 LYS 123 105.778 15.880 1.884 948 HZ3 LYS 123 HZ3 LYS 123 105.090 14.527 2.530 949 H HIS 124 H HIS 124 104.332 17.032 8.402 950 HA HIS 124 HA HIS 124 103.790 19.885 9.151 951 HB2 HIS 124 HB2 HIS 124 101.626 18.488 8.490 952 HB3 HIS 124 HB3 HIS 124 101.849 17.781 10.109 953 HD2 HIS 124 HD2 HIS 124 102.804 20.601 11.646 954 HE1 HIS 124 HE1 HIS 124 99.073 22.078 10.330 955 HE2 HIS 124 HE2 HIS 124 100.987 22.467 11.975 956 H VAL 125 H VAL 125 104.747 20.318 11.082 957 HA VAL 125 HA VAL 125 105.870 18.002 12.605 958 HB VAL 125 HB VAL 125 107.350 19.909 12.150 959 HG11 VAL 125 HG11 VAL 125 105.590 21.647 11.974 960 HG12 VAL 125 HG12 VAL 125 105.292 21.521 13.724 961 HG13 VAL 125 HG13 VAL 125 106.854 22.132 13.130 962 HG21 VAL 125 HG21 VAL 125 108.229 20.141 14.335 963 HG22 VAL 125 HG22 VAL 125 107.314 18.617 14.420 964 HG23 VAL 125 HG23 VAL 125 106.615 20.113 15.085 965 H VAL 126 H VAL 126 105.370 17.580 14.792 966 HA VAL 126 HA VAL 126 102.872 18.989 15.775 967 HB VAL 126 HB VAL 126 103.815 16.114 16.162 968 HG11 VAL 126 HG11 VAL 126 102.835 17.027 18.250 969 HG12 VAL 126 HG12 VAL 126 101.407 17.574 17.339 970 HG13 VAL 126 HG13 VAL 126 101.746 15.834 17.502 971 HG21 VAL 126 HG21 VAL 126 102.719 16.607 13.993 972 HG22 VAL 126 HG22 VAL 126 101.339 17.329 14.855 973 HG23 VAL 126 HG23 VAL 126 101.678 15.589 15.017 974 HA PRO 127 HA PRO 127 106.353 20.235 18.596 975 HB2 PRO 127 HB2 PRO 127 104.082 22.041 19.407 976 HB3 PRO 127 HB3 PRO 127 105.803 22.430 19.122 977 HG2 PRO 127 HG3 PRO 127 103.892 23.045 17.340 978 HG3 PRO 127 HG2 PRO 127 105.536 22.562 16.840 979 HD2 PRO 127 HD2 PRO 127 102.965 21.018 16.690 980 HD3 PRO 127 HD3 PRO 127 104.426 20.908 15.661 981 H ASN 128 H ASN 128 106.679 19.139 20.472 982 HA ASN 128 HA ASN 128 104.388 17.855 21.828 983 HB2 ASN 128 HB3 ASN 128 107.389 17.892 22.202 984 HB3 ASN 128 HB2 ASN 128 106.342 17.252 23.491 985 HD21 ASN 128 HD21 ASN 128 104.834 15.434 22.869 986 HD22 ASN 128 HD22 ASN 128 105.301 14.378 21.555 987 H GLU 129 H GLU 129 104.861 18.002 24.487 988 HA GLU 129 HA GLU 129 104.127 20.836 25.058 989 HB2 GLU 129 HB2 GLU 129 103.946 19.782 27.464 990 HB3 GLU 129 HB3 GLU 129 102.735 19.352 26.233 991 HG2 GLU 129 HG2 GLU 129 103.649 17.225 25.884 992 HG3 GLU 129 HG3 GLU 129 105.257 17.708 26.474 993 H VAL 130 H VAL 130 106.818 18.603 25.521 994 HA VAL 130 HA VAL 130 108.214 19.988 27.602 995 HB VAL 130 HB VAL 130 108.877 17.768 26.640 996 HG11 VAL 130 HG11 VAL 130 109.898 17.579 24.511 997 HG12 VAL 130 HG12 VAL 130 108.539 18.691 24.223 998 HG13 VAL 130 HG13 VAL 130 110.191 19.331 24.397 999 HG21 VAL 130 HG21 VAL 130 110.473 19.098 27.996 1000 HG22 VAL 130 HG22 VAL 130 111.025 19.934 26.525 1001 HG23 VAL 130 HG23 VAL 130 111.320 18.190 26.721 1002 H VAL 131 H VAL 131 107.764 20.775 24.202 1003 HA VAL 131 HA VAL 131 109.957 22.676 24.001 1004 HB VAL 131 HB VAL 131 107.303 22.805 22.514 1005 HG11 VAL 131 HG11 VAL 131 108.865 24.707 22.208 1006 HG12 VAL 131 HG12 VAL 131 108.740 23.737 20.721 1007 HG13 VAL 131 HG13 VAL 131 110.164 23.570 21.775 1008 HG21 VAL 131 HG21 VAL 131 108.188 20.489 22.453 1009 HG22 VAL 131 HG22 VAL 131 109.769 21.108 21.919 1010 HG23 VAL 131 HG23 VAL 131 108.345 21.275 20.864 1011 H VAL 132 H VAL 132 106.530 22.965 24.980 1012 HA VAL 132 HA VAL 132 106.647 25.873 25.271 1013 HB VAL 132 HB VAL 132 104.788 23.805 26.525 1014 HG11 VAL 132 HG11 VAL 132 104.819 25.944 27.781 1015 HG12 VAL 132 HG12 VAL 132 104.534 26.836 26.268 1016 HG13 VAL 132 HG13 VAL 132 103.284 25.740 26.904 1017 HG21 VAL 132 HG21 VAL 132 104.748 23.857 24.046 1018 HG22 VAL 132 HG22 VAL 132 103.242 24.522 24.724 1019 HG23 VAL 132 HG23 VAL 132 104.492 25.618 24.088 1020 H GLN 133 H GLN 133 107.500 23.131 27.311 1021 HA GLN 133 HA GLN 133 107.798 24.936 29.687 1022 HB2 GLN 133 HB2 GLN 133 107.978 21.947 29.222 1023 HB3 GLN 133 HB3 GLN 133 108.647 22.674 30.702 1024 HG2 GLN 133 HG2 GLN 133 106.413 23.772 31.099 1025 HG3 GLN 133 HG3 GLN 133 105.771 22.871 29.704 1026 HE21 GLN 133 HE21 GLN 133 107.707 20.554 30.496 1027 HE22 GLN 133 HE22 GLN 133 106.859 19.761 31.805 Start of MODEL 7 1 H1 GLU 1 H1 GLU 1 114.500 -11.935 25.386 2 H2 GLU 1 H2 GLU 1 115.396 -10.582 25.093 3 H3 GLU 1 H3 GLU 1 115.004 -11.596 23.853 4 HA GLU 1 HA GLU 1 113.091 -9.987 25.422 5 HB2 GLU 1 HB2 GLU 1 114.687 -8.857 23.691 6 HB3 GLU 1 HB3 GLU 1 113.716 -9.711 22.469 7 HG2 GLU 1 HG3 GLU 1 112.539 -7.702 22.641 8 HG3 GLU 1 HG2 GLU 1 111.679 -8.698 23.839 9 H HIS 2 H HIS 2 111.852 -10.013 22.512 10 HA HIS 2 HA HIS 2 110.829 -12.833 22.511 11 HB2 HIS 2 HB2 HIS 2 108.879 -10.506 22.504 12 HB3 HIS 2 HB3 HIS 2 108.541 -12.236 22.753 13 HD2 HIS 2 HD2 HIS 2 108.936 -13.142 25.400 14 HE1 HIS 2 HE1 HIS 2 110.170 -9.439 27.014 15 HE2 HIS 2 HE2 HIS 2 109.500 -11.832 27.604 16 HA PRO 3 HA PRO 3 111.821 -10.736 18.370 17 HB2 PRO 3 HB2 PRO 3 112.540 -13.627 17.923 18 HB3 PRO 3 HB3 PRO 3 113.402 -12.146 17.415 19 HG2 PRO 3 HG2 PRO 3 114.241 -13.652 19.478 20 HG3 PRO 3 HG3 PRO 3 114.422 -11.877 19.452 21 HD2 PRO 3 HD3 PRO 3 112.530 -13.574 21.040 22 HD3 PRO 3 HD2 PRO 3 113.217 -11.969 21.431 23 H GLU 4 H GLU 4 109.831 -10.413 17.434 24 HA GLU 4 HA GLU 4 107.915 -12.670 17.203 25 HB2 GLU 4 HB2 GLU 4 107.784 -9.831 16.091 26 HB3 GLU 4 HB3 GLU 4 106.435 -10.990 16.166 27 HG2 GLU 4 HG2 GLU 4 106.528 -11.017 18.604 28 HG3 GLU 4 HG3 GLU 4 107.987 -9.997 18.597 29 H PHE 5 H PHE 5 110.496 -11.350 15.349 30 HA PHE 5 HA PHE 5 109.592 -11.746 12.674 31 HB2 PHE 5 HB3 PHE 5 112.292 -12.014 14.021 32 HB3 PHE 5 HB2 PHE 5 112.102 -12.408 12.296 33 HD1 PHE 5 HD1 PHE 5 110.820 -9.742 14.632 34 HD2 PHE 5 HD2 PHE 5 112.668 -10.667 10.867 35 HE1 PHE 5 HE1 PHE 5 110.891 -7.326 14.074 36 HE2 PHE 5 HE2 PHE 5 112.739 -8.249 10.308 37 HZ PHE 5 HZ PHE 5 111.853 -6.581 11.914 38 H LEU 6 H LEU 6 110.713 -14.091 15.096 39 HA LEU 6 HA LEU 6 110.403 -16.294 13.082 40 HB2 LEU 6 HB2 LEU 6 111.514 -16.134 15.904 41 HB3 LEU 6 HB3 LEU 6 111.180 -17.696 15.119 42 HG LEU 6 HG LEU 6 113.558 -16.904 14.822 43 HD11 LEU 6 HD11 LEU 6 112.498 -18.445 13.190 44 HD12 LEU 6 HD12 LEU 6 111.871 -17.049 12.281 45 HD13 LEU 6 HD13 LEU 6 113.626 -17.332 12.380 46 HD21 LEU 6 HD21 LEU 6 114.057 -14.959 13.549 47 HD22 LEU 6 HD22 LEU 6 112.753 -14.443 14.644 48 HD23 LEU 6 HD23 LEU 6 112.388 -14.824 12.945 49 H LYS 7 H LYS 7 108.588 -14.640 15.459 50 HA LYS 7 HA LYS 7 106.946 -16.988 16.231 51 HB2 LYS 7 HB2 LYS 7 107.422 -14.846 17.637 52 HB3 LYS 7 HB3 LYS 7 106.175 -14.081 16.623 53 HG2 LYS 7 HG2 LYS 7 104.696 -16.124 17.226 54 HG3 LYS 7 HG3 LYS 7 105.889 -16.447 18.507 55 HD2 LYS 7 HD3 LYS 7 105.496 -14.283 19.519 56 HD3 LYS 7 HD2 LYS 7 104.495 -13.763 18.142 57 HE2 LYS 7 HE3 LYS 7 103.828 -16.116 19.965 58 HE3 LYS 7 HE2 LYS 7 103.142 -14.483 20.141 59 HZ1 LYS 7 HZ1 LYS 7 102.365 -14.712 17.824 60 HZ2 LYS 7 HZ2 LYS 7 102.854 -16.287 17.825 61 HZ3 LYS 7 HZ3 LYS 7 101.663 -15.792 18.854 62 H ALA 8 H ALA 8 107.022 -14.641 13.671 63 HA ALA 8 HA ALA 8 104.347 -14.289 12.939 64 HB1 ALA 8 HB1 ALA 8 106.867 -14.753 11.355 65 HB2 ALA 8 HB2 ALA 8 105.313 -14.761 10.488 66 HB3 ALA 8 HB3 ALA 8 105.810 -13.322 11.410 67 H GLY 9 H GLY 9 102.664 -15.609 12.404 68 HA2 GLY 9 HA2 GLY 9 101.536 -17.704 12.262 69 HA3 GLY 9 HA3 GLY 9 102.647 -17.948 10.893 70 H LYS 10 H LYS 10 103.457 -17.681 14.369 71 HA LYS 10 HA LYS 10 105.370 -19.754 14.401 72 HB2 LYS 10 HB2 LYS 10 104.784 -19.991 16.856 73 HB3 LYS 10 HB3 LYS 10 105.073 -18.315 16.333 74 HG2 LYS 10 HG2 LYS 10 102.798 -17.755 16.421 75 HG3 LYS 10 HG3 LYS 10 102.272 -19.446 16.244 76 HD2 LYS 10 HD3 LYS 10 103.179 -19.936 18.522 77 HD3 LYS 10 HD2 LYS 10 103.611 -18.218 18.696 78 HE2 LYS 10 HE2 LYS 10 101.441 -18.660 19.776 79 HE3 LYS 10 HE3 LYS 10 101.217 -17.603 18.362 80 HZ1 LYS 10 HZ1 LYS 10 99.611 -19.392 18.399 81 HZ2 LYS 10 HZ2 LYS 10 100.807 -20.527 18.401 82 HZ3 LYS 10 HZ3 LYS 10 100.600 -19.548 17.089 83 H GLU 11 H GLU 11 101.870 -19.995 14.297 84 HA GLU 11 HA GLU 11 102.194 -22.997 14.207 85 HB2 GLU 11 HB3 GLU 11 100.497 -21.339 16.032 86 HB3 GLU 11 HB2 GLU 11 99.715 -22.767 15.312 87 HG2 GLU 11 HG2 GLU 11 101.198 -24.262 16.334 88 HG3 GLU 11 HG3 GLU 11 102.476 -23.035 16.509 89 HA PRO 12 HA PRO 12 99.831 -22.938 10.502 90 HB2 PRO 12 HB3 PRO 12 97.818 -24.831 11.193 91 HB3 PRO 12 HB2 PRO 12 99.388 -25.185 10.420 92 HG2 PRO 12 HG2 PRO 12 98.555 -25.434 13.268 93 HG3 PRO 12 HG3 PRO 12 99.739 -26.387 12.332 94 HD2 PRO 12 HD2 PRO 12 100.511 -24.530 14.183 95 HD3 PRO 12 HD3 PRO 12 101.462 -24.856 12.701 96 H GLY 13 H GLY 13 98.529 -21.246 9.979 97 HA2 GLY 13 HA2 GLY 13 95.794 -21.024 10.417 98 HA3 GLY 13 HA3 GLY 13 96.478 -20.300 11.892 99 H LEU 14 H LEU 14 95.514 -18.255 11.173 100 HA LEU 14 HA LEU 14 97.210 -16.946 9.030 101 HB2 LEU 14 HB3 LEU 14 94.917 -17.262 8.199 102 HB3 LEU 14 HB2 LEU 14 94.258 -16.494 9.663 103 HG LEU 14 HG LEU 14 96.311 -14.878 8.254 104 HD11 LEU 14 HD11 LEU 14 95.173 -15.910 6.306 105 HD12 LEU 14 HD12 LEU 14 94.772 -14.182 6.443 106 HD13 LEU 14 HD13 LEU 14 93.596 -15.412 6.965 107 HD21 LEU 14 HD21 LEU 14 94.944 -14.056 10.157 108 HD22 LEU 14 HD22 LEU 14 94.638 -13.101 8.686 109 HD23 LEU 14 HD23 LEU 14 93.463 -14.331 9.209 110 H GLN 15 H GLN 15 97.832 -14.780 9.444 111 HA GLN 15 HA GLN 15 97.010 -13.618 12.091 112 HB2 GLN 15 HB2 GLN 15 99.890 -14.150 11.232 113 HB3 GLN 15 HB3 GLN 15 99.425 -13.130 12.615 114 HG2 GLN 15 HG2 GLN 15 97.988 -15.326 13.234 115 HG3 GLN 15 HG3 GLN 15 99.280 -16.112 12.296 116 HE21 GLN 15 HE21 GLN 15 101.412 -16.187 13.206 117 HE22 GLN 15 HE22 GLN 15 101.761 -15.597 14.816 118 H ILE 16 H ILE 16 97.009 -11.357 12.069 119 HA ILE 16 HA ILE 16 97.889 -10.112 9.446 120 HB ILE 16 HB ILE 16 95.624 -9.214 11.282 121 HG12 ILE 16 HG12 ILE 16 95.125 -10.265 8.522 122 HG13 ILE 16 HG13 ILE 16 95.535 -11.463 9.772 123 HG21 ILE 16 HG21 ILE 16 95.048 -7.749 9.366 124 HG22 ILE 16 HG22 ILE 16 96.467 -8.355 8.478 125 HG23 ILE 16 HG23 ILE 16 96.687 -7.404 9.967 126 HD11 ILE 16 HD11 ILE 16 93.084 -11.110 9.649 127 HD12 ILE 16 HD12 ILE 16 93.318 -9.375 9.968 128 HD13 ILE 16 HD13 ILE 16 93.728 -10.573 11.218 129 H TRP 17 H TRP 17 99.508 -8.655 9.669 130 HA TRP 17 HA TRP 17 99.681 -7.158 12.293 131 HB2 TRP 17 HB2 TRP 17 102.138 -8.014 10.729 132 HB3 TRP 17 HB3 TRP 17 102.030 -7.472 12.421 133 HD1 TRP 17 HD1 TRP 17 99.854 -9.244 13.615 134 HE1 TRP 17 HE1 TRP 17 100.099 -11.800 13.835 135 HE3 TRP 17 HE3 TRP 17 103.435 -10.026 10.060 136 HZ2 TRP 17 HZ2 TRP 17 101.657 -13.898 12.616 137 HZ3 TRP 17 HZ3 TRP 17 104.282 -12.309 9.611 138 HH2 TRP 17 HH2 TRP 17 103.398 -14.244 10.881 139 H ARG 18 H ARG 18 99.807 -4.979 12.004 140 HA ARG 18 HA ARG 18 99.968 -3.970 9.200 141 HB2 ARG 18 HB2 ARG 18 98.285 -3.067 10.816 142 HB3 ARG 18 HB3 ARG 18 99.616 -2.460 11.830 143 HG2 ARG 18 HG2 ARG 18 100.206 -1.529 9.232 144 HG3 ARG 18 HG3 ARG 18 98.451 -1.298 9.409 145 HD2 ARG 18 HD3 ARG 18 100.652 -0.259 11.243 146 HD3 ARG 18 HD2 ARG 18 99.526 0.699 10.251 147 HE ARG 18 HE ARG 18 97.962 -0.933 12.023 148 HH11 ARG 18 HH11 ARG 18 97.142 0.017 13.901 149 HH12 ARG 18 HH12 ARG 18 97.870 1.477 14.533 150 HH21 ARG 18 HH21 ARG 18 100.266 1.676 12.016 151 HH22 ARG 18 HH22 ARG 18 99.632 2.413 13.470 152 H VAL 19 H VAL 19 101.615 -2.618 8.410 153 HA VAL 19 HA VAL 19 104.201 -2.876 9.861 154 HB VAL 19 HB VAL 19 104.006 -1.196 7.400 155 HG11 VAL 19 HG11 VAL 19 106.164 -1.836 8.441 156 HG12 VAL 19 HG12 VAL 19 105.747 -3.555 8.247 157 HG13 VAL 19 HG13 VAL 19 106.006 -2.535 6.812 158 HG21 VAL 19 HG21 VAL 19 103.907 -3.371 6.028 159 HG22 VAL 19 HG22 VAL 19 102.374 -2.819 6.744 160 HG23 VAL 19 HG23 VAL 19 103.283 -4.148 7.502 161 H GLU 20 H GLU 20 105.364 -1.159 10.740 162 HA GLU 20 HA GLU 20 104.244 1.598 10.501 163 HB2 GLU 20 HB3 GLU 20 102.957 0.674 12.382 164 HB3 GLU 20 HB2 GLU 20 104.458 0.127 13.166 165 HG2 GLU 20 HG3 GLU 20 105.181 2.350 13.593 166 HG3 GLU 20 HG2 GLU 20 104.031 3.039 12.423 167 H LYS 21 H LYS 21 106.183 2.370 9.679 168 HA LYS 21 HA LYS 21 108.491 2.915 9.663 169 HB2 LYS 21 HB2 LYS 21 107.573 4.230 11.637 170 HB3 LYS 21 HB3 LYS 21 108.141 2.912 12.690 171 HG2 LYS 21 HG3 LYS 21 110.393 3.378 12.287 172 HG3 LYS 21 HG2 LYS 21 110.062 4.134 10.710 173 HD2 LYS 21 HD2 LYS 21 108.927 5.424 13.184 174 HD3 LYS 21 HD3 LYS 21 110.664 5.620 12.848 175 HE2 LYS 21 HE2 LYS 21 108.650 6.080 10.641 176 HE3 LYS 21 HE3 LYS 21 108.937 7.353 11.852 177 HZ1 LYS 21 HZ1 LYS 21 110.403 7.578 9.958 178 HZ2 LYS 21 HZ2 LYS 21 111.279 7.244 11.315 179 HZ3 LYS 21 HZ3 LYS 21 111.013 6.064 10.193 180 H PHE 22 H PHE 22 107.921 0.095 9.593 181 HA PHE 22 HA PHE 22 109.158 -1.913 9.771 182 HB2 PHE 22 HB3 PHE 22 111.447 -0.521 11.136 183 HB3 PHE 22 HB2 PHE 22 111.470 -1.747 9.846 184 HD1 PHE 22 HD1 PHE 22 109.778 -0.705 7.769 185 HD2 PHE 22 HD2 PHE 22 112.464 1.429 10.353 186 HE1 PHE 22 HE1 PHE 22 109.990 1.087 6.068 187 HE2 PHE 22 HE2 PHE 22 112.675 3.223 8.654 188 HZ PHE 22 HZ PHE 22 111.440 3.051 6.510 189 H ASP 23 H ASP 23 107.594 -0.569 12.080 190 HA ASP 23 HA ASP 23 108.943 -1.944 14.391 191 HB2 ASP 23 HB2 ASP 23 106.424 -0.231 14.420 192 HB3 ASP 23 HB3 ASP 23 107.443 -0.689 15.806 193 H LEU 24 H LEU 24 106.295 -2.253 12.151 194 HA LEU 24 HA LEU 24 104.631 -3.918 11.960 195 HB2 LEU 24 HB3 LEU 24 106.862 -5.269 13.463 196 HB3 LEU 24 HB2 LEU 24 105.297 -6.107 13.340 197 HG LEU 24 HG LEU 24 106.506 -4.886 10.861 198 HD11 LEU 24 HD11 LEU 24 108.342 -6.190 11.897 199 HD12 LEU 24 HD12 LEU 24 107.723 -7.003 10.439 200 HD13 LEU 24 HD13 LEU 24 107.257 -7.593 12.053 201 HD21 LEU 24 HD21 LEU 24 104.213 -5.834 10.833 202 HD22 LEU 24 HD22 LEU 24 104.848 -7.385 11.432 203 HD23 LEU 24 HD23 LEU 24 105.315 -6.796 9.819 204 H VAL 25 H VAL 25 102.666 -3.796 12.902 205 HA VAL 25 HA VAL 25 102.555 -3.966 15.921 206 HB VAL 25 HB VAL 25 100.900 -2.082 14.180 207 HG11 VAL 25 HG11 VAL 25 100.246 -1.129 16.386 208 HG12 VAL 25 HG12 VAL 25 99.770 -2.839 16.241 209 HG13 VAL 25 HG13 VAL 25 101.201 -2.391 17.201 210 HG21 VAL 25 HG21 VAL 25 102.265 -0.285 15.211 211 HG22 VAL 25 HG22 VAL 25 103.282 -1.399 14.267 212 HG23 VAL 25 HG23 VAL 25 103.250 -1.511 16.043 213 HA PRO 26 HA PRO 26 99.557 -7.071 14.763 214 HB2 PRO 26 HB2 PRO 26 98.569 -7.595 17.279 215 HB3 PRO 26 HB3 PRO 26 100.161 -8.176 16.711 216 HG2 PRO 26 HG2 PRO 26 99.493 -5.854 18.479 217 HG3 PRO 26 HG3 PRO 26 100.847 -7.014 18.575 218 HD2 PRO 26 HD2 PRO 26 101.087 -4.453 17.540 219 HD3 PRO 26 HD3 PRO 26 102.140 -5.823 17.073 220 H VAL 27 H VAL 27 97.685 -6.504 13.755 221 HA VAL 27 HA VAL 27 96.066 -4.241 14.497 222 HB VAL 27 HB VAL 27 96.138 -5.642 12.284 223 HG11 VAL 27 HG11 VAL 27 94.521 -7.413 12.088 224 HG12 VAL 27 HG12 VAL 27 95.487 -7.771 13.539 225 HG13 VAL 27 HG13 VAL 27 93.858 -7.073 13.704 226 HG21 VAL 27 HG21 VAL 27 93.927 -4.838 11.679 227 HG22 VAL 27 HG22 VAL 27 94.656 -3.659 12.795 228 HG23 VAL 27 HG23 VAL 27 93.424 -4.800 13.386 229 HA PRO 28 HA PRO 28 94.013 -5.987 18.055 230 HB2 PRO 28 HB2 PRO 28 91.954 -4.143 18.243 231 HB3 PRO 28 HB3 PRO 28 93.625 -3.834 18.797 232 HG2 PRO 28 HG2 PRO 28 92.252 -2.965 16.287 233 HG3 PRO 28 HG3 PRO 28 93.428 -2.096 17.310 234 HD2 PRO 28 HD3 PRO 28 94.088 -3.332 14.927 235 HD3 PRO 28 HD2 PRO 28 95.253 -3.076 16.261 236 H THR 29 H THR 29 92.453 -7.540 18.322 237 HA THR 29 HA THR 29 90.945 -8.511 16.088 238 HB THR 29 HB THR 29 90.257 -8.839 19.042 239 HG1 THR 29 HG1 THR 29 92.455 -9.376 18.549 240 HG21 THR 29 HG21 THR 29 89.321 -11.002 18.271 241 HG22 THR 29 HG22 THR 29 89.760 -10.594 16.596 242 HG23 THR 29 HG23 THR 29 88.531 -9.633 17.452 243 H ASN 30 H ASN 30 90.196 -6.061 18.525 244 HA ASN 30 HA ASN 30 87.402 -5.870 18.351 245 HB2 ASN 30 HB2 ASN 30 89.126 -4.336 19.573 246 HB3 ASN 30 HB3 ASN 30 89.124 -3.390 18.065 247 HD21 ASN 30 HD21 ASN 30 86.095 -4.719 18.107 248 HD22 ASN 30 HD22 ASN 30 85.237 -3.465 18.972 249 H LEU 31 H LEU 31 89.811 -4.691 15.981 250 HA LEU 31 HA LEU 31 87.593 -3.835 14.168 251 HB2 LEU 31 HB2 LEU 31 90.566 -3.483 14.299 252 HB3 LEU 31 HB3 LEU 31 89.829 -3.492 12.680 253 HG LEU 31 HG LEU 31 88.197 -1.753 13.464 254 HD11 LEU 31 HD11 LEU 31 89.049 -0.537 15.628 255 HD12 LEU 31 HD12 LEU 31 89.836 -2.092 15.989 256 HD13 LEU 31 HD13 LEU 31 88.067 -2.012 15.805 257 HD21 LEU 31 HD21 LEU 31 91.120 -0.990 13.898 258 HD22 LEU 31 HD22 LEU 31 89.796 0.103 13.428 259 HD23 LEU 31 HD23 LEU 31 90.346 -1.164 12.305 260 H TYR 32 H TYR 32 90.454 -6.008 13.986 261 HA TYR 32 HA TYR 32 90.828 -7.769 12.413 262 HB2 TYR 32 HB3 TYR 32 89.347 -8.601 14.417 263 HB3 TYR 32 HB2 TYR 32 88.049 -8.670 13.201 264 HD1 TYR 32 HD1 TYR 32 91.345 -10.026 14.205 265 HD2 TYR 32 HD2 TYR 32 88.129 -10.266 11.367 266 HE1 TYR 32 HE1 TYR 32 92.248 -12.176 13.362 267 HE2 TYR 32 HE2 TYR 32 89.035 -12.413 10.522 268 HH TYR 32 HH TYR 32 91.415 -13.542 10.487 269 H GLY 33 H GLY 33 90.674 -6.445 10.460 270 HA2 GLY 33 HA2 GLY 33 89.637 -7.113 8.209 271 HA3 GLY 33 HA3 GLY 33 88.058 -6.888 8.997 272 H ASP 34 H ASP 34 88.987 -4.510 10.530 273 HA ASP 34 HA ASP 34 88.673 -2.563 8.276 274 HB2 ASP 34 HB2 ASP 34 87.197 -2.110 10.092 275 HB3 ASP 34 HB3 ASP 34 88.476 -2.367 11.302 276 H PHE 35 H PHE 35 90.387 -1.455 7.463 277 HA PHE 35 HA PHE 35 92.730 -0.948 9.264 278 HB2 PHE 35 HB2 PHE 35 94.053 -1.693 6.984 279 HB3 PHE 35 HB3 PHE 35 93.775 -2.777 8.368 280 HD1 PHE 35 HD1 PHE 35 93.284 -4.902 7.524 281 HD2 PHE 35 HD2 PHE 35 91.449 -1.461 5.724 282 HE1 PHE 35 HE1 PHE 35 91.911 -6.386 6.088 283 HE2 PHE 35 HE2 PHE 35 90.074 -2.946 4.289 284 HZ PHE 35 HZ PHE 35 90.309 -5.408 4.468 285 H PHE 36 H PHE 36 94.353 0.516 8.112 286 HA PHE 36 HA PHE 36 92.824 2.694 6.811 287 HB2 PHE 36 HB2 PHE 36 95.828 2.701 6.963 288 HB3 PHE 36 HB3 PHE 36 94.675 4.025 7.255 289 HD1 PHE 36 HD1 PHE 36 92.787 2.591 9.124 290 HD2 PHE 36 HD2 PHE 36 97.079 2.721 8.991 291 HE1 PHE 36 HE1 PHE 36 92.876 2.131 11.560 292 HE2 PHE 36 HE2 PHE 36 97.167 2.261 11.427 293 HZ PHE 36 HZ PHE 36 95.066 1.968 12.711 294 H THR 37 H THR 37 93.470 3.613 4.706 295 HA THR 37 HA THR 37 94.320 1.403 2.841 296 HB THR 37 HB THR 37 93.429 3.135 1.100 297 HG1 THR 37 HG1 THR 37 91.906 4.583 2.082 298 HG21 THR 37 HG21 THR 37 91.103 2.374 1.500 299 HG22 THR 37 HG22 THR 37 92.261 1.043 1.737 300 HG23 THR 37 HG23 THR 37 91.553 1.867 3.147 301 H GLY 38 H GLY 38 95.499 4.222 4.356 302 HA2 GLY 38 HA2 GLY 38 97.388 4.831 2.108 303 HA3 GLY 38 HA3 GLY 38 97.213 5.769 3.610 304 H ASP 39 H ASP 39 97.198 2.747 4.762 305 HA ASP 39 HA ASP 39 100.199 2.767 5.116 306 HB2 ASP 39 HB2 ASP 39 98.561 2.905 7.124 307 HB3 ASP 39 HB3 ASP 39 98.205 1.195 6.783 308 H ALA 40 H ALA 40 100.248 0.032 6.117 309 HA ALA 40 HA ALA 40 99.372 -1.554 3.717 310 HB1 ALA 40 HB1 ALA 40 101.622 -2.576 3.515 311 HB2 ALA 40 HB2 ALA 40 102.226 -1.496 4.795 312 HB3 ALA 40 HB3 ALA 40 101.690 -0.818 3.239 313 H TYR 41 H TYR 41 98.872 -3.684 4.221 314 HA TYR 41 HA TYR 41 99.372 -4.494 7.098 315 HB2 TYR 41 HB3 TYR 41 96.887 -4.729 5.373 316 HB3 TYR 41 HB2 TYR 41 97.157 -5.825 6.750 317 HD1 TYR 41 HD1 TYR 41 96.486 -5.149 8.884 318 HD2 TYR 41 HD2 TYR 41 97.225 -2.166 5.883 319 HE1 TYR 41 HE1 TYR 41 95.698 -3.388 10.441 320 HE2 TYR 41 HE2 TYR 41 96.437 -0.405 7.441 321 HH TYR 41 HH TYR 41 94.616 -0.780 9.903 322 H VAL 42 H VAL 42 100.610 -6.289 7.208 323 HA VAL 42 HA VAL 42 100.729 -8.056 4.767 324 HB VAL 42 HB VAL 42 102.752 -8.991 6.208 325 HG11 VAL 42 HG11 VAL 42 102.699 -6.301 4.776 326 HG12 VAL 42 HG12 VAL 42 104.194 -7.153 5.229 327 HG13 VAL 42 HG13 VAL 42 103.067 -7.891 4.067 328 HG21 VAL 42 HG21 VAL 42 103.681 -7.471 7.781 329 HG22 VAL 42 HG22 VAL 42 101.944 -7.488 8.165 330 HG23 VAL 42 HG23 VAL 42 102.636 -6.137 7.236 331 H ILE 43 H ILE 43 100.033 -10.169 4.882 332 HA ILE 43 HA ILE 43 99.160 -11.120 7.621 333 HB ILE 43 HB ILE 43 97.851 -12.164 5.120 334 HG12 ILE 43 HG13 ILE 43 97.021 -9.575 6.496 335 HG13 ILE 43 HG12 ILE 43 97.905 -9.635 4.952 336 HG21 ILE 43 HG21 ILE 43 95.959 -12.415 6.640 337 HG22 ILE 43 HG22 ILE 43 97.412 -13.077 7.425 338 HG23 ILE 43 HG23 ILE 43 96.798 -11.475 7.898 339 HD11 ILE 43 HD11 ILE 43 95.465 -9.427 4.571 340 HD12 ILE 43 HD12 ILE 43 96.078 -10.981 3.956 341 HD13 ILE 43 HD13 ILE 43 95.193 -10.921 5.499 342 H LEU 44 H LEU 44 99.545 -13.262 8.121 343 HA LEU 44 HA LEU 44 101.327 -14.743 6.166 344 HB2 LEU 44 HB2 LEU 44 101.498 -14.256 9.123 345 HB3 LEU 44 HB3 LEU 44 101.980 -15.867 8.542 346 HG LEU 44 HG LEU 44 103.889 -14.238 8.636 347 HD11 LEU 44 HD11 LEU 44 104.724 -14.715 6.350 348 HD12 LEU 44 HD12 LEU 44 103.916 -16.139 7.049 349 HD13 LEU 44 HD13 LEU 44 103.074 -15.144 5.838 350 HD21 LEU 44 HD21 LEU 44 103.959 -12.329 7.192 351 HD22 LEU 44 HD22 LEU 44 102.369 -12.270 7.990 352 HD23 LEU 44 HD23 LEU 44 102.502 -12.850 6.313 353 H LYS 45 H LYS 45 100.460 -16.661 5.468 354 HA LYS 45 HA LYS 45 98.332 -17.887 7.243 355 HB2 LYS 45 HB2 LYS 45 97.881 -16.853 4.756 356 HB3 LYS 45 HB3 LYS 45 98.307 -18.528 4.332 357 HG2 LYS 45 HG3 LYS 45 96.598 -19.386 5.874 358 HG3 LYS 45 HG2 LYS 45 96.211 -17.731 6.401 359 HD2 LYS 45 HD2 LYS 45 94.566 -18.031 4.786 360 HD3 LYS 45 HD3 LYS 45 95.866 -17.354 3.776 361 HE2 LYS 45 HE2 LYS 45 95.075 -19.296 2.611 362 HE3 LYS 45 HE3 LYS 45 96.615 -19.775 3.364 363 HZ1 LYS 45 HZ1 LYS 45 94.719 -21.343 3.674 364 HZ2 LYS 45 HZ2 LYS 45 94.002 -20.221 4.647 365 HZ3 LYS 45 HZ3 LYS 45 95.458 -20.870 5.070 366 H THR 46 H THR 46 99.724 -19.329 8.278 367 HA THR 46 HA THR 46 101.466 -21.113 6.654 368 HB THR 46 HB THR 46 100.802 -21.103 9.633 369 HG1 THR 46 HG1 THR 46 101.931 -19.227 8.741 370 HG21 THR 46 HG21 THR 46 101.616 -23.273 9.097 371 HG22 THR 46 HG22 THR 46 102.787 -22.633 7.919 372 HG23 THR 46 HG23 THR 46 103.051 -22.384 9.662 373 H VAL 47 H VAL 47 100.219 -22.523 5.449 374 HA VAL 47 HA VAL 47 97.945 -23.919 6.814 375 HB VAL 47 HB VAL 47 98.694 -24.699 4.051 376 HG11 VAL 47 HG11 VAL 47 96.589 -25.388 5.167 377 HG12 VAL 47 HG12 VAL 47 96.131 -23.678 5.352 378 HG13 VAL 47 HG13 VAL 47 96.259 -24.394 3.727 379 HG21 VAL 47 HG21 VAL 47 97.670 -22.533 3.160 380 HG22 VAL 47 HG22 VAL 47 97.919 -21.850 4.785 381 HG23 VAL 47 HG23 VAL 47 99.316 -22.389 3.822 382 H GLN 48 H GLN 48 97.819 -26.327 6.509 383 HA GLN 48 HA GLN 48 100.597 -27.528 6.659 384 HB2 GLN 48 HB2 GLN 48 99.296 -27.449 8.847 385 HB3 GLN 48 HB3 GLN 48 98.105 -28.537 8.095 386 HG2 GLN 48 HG3 GLN 48 101.068 -29.203 8.136 387 HG3 GLN 48 HG2 GLN 48 99.996 -29.629 9.491 388 HE21 GLN 48 HE21 GLN 48 97.833 -30.775 8.688 389 HE22 GLN 48 HE22 GLN 48 98.061 -31.986 7.445 390 H LEU 49 H LEU 49 100.921 -28.685 4.824 391 HA LEU 49 HA LEU 49 99.004 -29.524 2.950 392 HB2 LEU 49 HB3 LEU 49 101.534 -30.999 3.812 393 HB3 LEU 49 HB2 LEU 49 100.632 -31.318 2.312 394 HG LEU 49 HG LEU 49 101.481 -28.490 2.914 395 HD11 LEU 49 HD11 LEU 49 103.515 -29.851 3.320 396 HD12 LEU 49 HD12 LEU 49 103.661 -28.915 1.813 397 HD13 LEU 49 HD13 LEU 49 103.290 -30.655 1.748 398 HD21 LEU 49 HD21 LEU 49 100.039 -29.021 0.965 399 HD22 LEU 49 HD22 LEU 49 101.263 -30.171 0.375 400 HD23 LEU 49 HD23 LEU 49 101.634 -28.432 0.439 401 H ARG 50 H ARG 50 100.525 -32.182 4.716 402 HA ARG 50 HA ARG 50 97.789 -33.072 5.626 403 HB2 ARG 50 HB2 ARG 50 99.861 -34.731 4.120 404 HB3 ARG 50 HB3 ARG 50 98.435 -35.414 4.936 405 HG2 ARG 50 HG3 ARG 50 98.071 -33.150 2.972 406 HG3 ARG 50 HG2 ARG 50 98.324 -34.802 2.361 407 HD2 ARG 50 HD2 ARG 50 96.299 -35.556 3.163 408 HD3 ARG 50 HD3 ARG 50 96.332 -34.469 4.572 409 HE ARG 50 HE ARG 50 95.057 -32.937 3.299 410 HH11 ARG 50 HH11 ARG 50 94.262 -32.086 1.362 411 HH12 ARG 50 HH12 ARG 50 94.821 -32.723 -0.168 412 HH21 ARG 50 HH21 ARG 50 96.954 -35.056 1.292 413 HH22 ARG 50 HH22 ARG 50 96.340 -34.398 -0.208 414 H ASN 51 H ASN 51 101.327 -33.470 5.820 415 HA ASN 51 HA ASN 51 101.324 -33.432 8.713 416 HB2 ASN 51 HB3 ASN 51 100.312 -35.788 8.026 417 HB3 ASN 51 HB2 ASN 51 102.012 -36.189 7.685 418 HD21 ASN 51 HD21 ASN 51 102.328 -37.602 9.505 419 HD22 ASN 51 HD22 ASN 51 102.276 -37.019 11.153 420 H GLY 52 H GLY 52 102.720 -32.421 6.283 421 HA2 GLY 52 HA2 GLY 52 105.493 -33.445 6.949 422 HA3 GLY 52 HA3 GLY 52 105.023 -32.912 5.318 423 H ASN 53 H ASN 53 105.195 -30.750 4.812 424 HA ASN 53 HA ASN 53 106.228 -28.989 7.032 425 HB2 ASN 53 HB2 ASN 53 107.655 -29.230 5.012 426 HB3 ASN 53 HB3 ASN 53 106.321 -28.623 4.003 427 HD21 ASN 53 HD21 ASN 53 107.609 -27.532 7.223 428 HD22 ASN 53 HD22 ASN 53 107.878 -25.882 6.707 429 H LEU 54 H LEU 54 105.652 -26.516 6.374 430 HA LEU 54 HA LEU 54 102.646 -26.483 5.990 431 HB2 LEU 54 HB2 LEU 54 104.150 -24.359 7.531 432 HB3 LEU 54 HB3 LEU 54 102.448 -24.859 7.675 433 HG LEU 54 HG LEU 54 103.597 -27.196 8.348 434 HD11 LEU 54 HD11 LEU 54 105.904 -26.342 8.015 435 HD12 LEU 54 HD12 LEU 54 105.604 -25.065 9.218 436 HD13 LEU 54 HD13 LEU 54 105.621 -26.773 9.719 437 HD21 LEU 54 HD21 LEU 54 102.007 -25.881 9.725 438 HD22 LEU 54 HD22 LEU 54 103.347 -26.504 10.716 439 HD23 LEU 54 HD23 LEU 54 103.330 -24.796 10.216 440 H GLN 55 H GLN 55 101.925 -24.141 5.310 441 HA GLN 55 HA GLN 55 103.990 -23.013 3.408 442 HB2 GLN 55 HB2 GLN 55 102.167 -24.532 2.341 443 HB3 GLN 55 HB3 GLN 55 101.046 -23.196 2.701 444 HG2 GLN 55 HG2 GLN 55 101.765 -22.629 0.546 445 HG3 GLN 55 HG3 GLN 55 102.913 -21.713 1.552 446 HE21 GLN 55 HE21 GLN 55 102.732 -25.215 0.581 447 HE22 GLN 55 HE22 GLN 55 104.365 -25.264 -0.045 448 H TYR 56 H TYR 56 104.390 -21.014 4.194 449 HA TYR 56 HA TYR 56 102.240 -19.468 5.570 450 HB2 TYR 56 HB2 TYR 56 105.180 -18.974 4.940 451 HB3 TYR 56 HB3 TYR 56 104.143 -17.718 5.654 452 HD1 TYR 56 HD1 TYR 56 104.331 -17.519 7.953 453 HD2 TYR 56 HD2 TYR 56 104.730 -21.411 6.176 454 HE1 TYR 56 HE1 TYR 56 104.698 -18.507 10.199 455 HE2 TYR 56 HE2 TYR 56 105.086 -22.399 8.423 456 HH TYR 56 HH TYR 56 105.810 -21.731 10.655 457 H ASP 57 H ASP 57 100.751 -18.507 4.194 458 HA ASP 57 HA ASP 57 101.638 -17.638 1.489 459 HB2 ASP 57 HB3 ASP 57 98.952 -17.057 2.787 460 HB3 ASP 57 HB2 ASP 57 99.337 -17.183 1.054 461 H LEU 58 H LEU 58 102.348 -15.622 1.012 462 HA LEU 58 HA LEU 58 102.217 -13.571 3.206 463 HB2 LEU 58 HB2 LEU 58 103.835 -13.818 0.641 464 HB3 LEU 58 HB3 LEU 58 103.806 -12.324 1.604 465 HG LEU 58 HG LEU 58 105.705 -14.063 2.051 466 HD11 LEU 58 HD11 LEU 58 104.020 -13.101 4.401 467 HD12 LEU 58 HD12 LEU 58 105.767 -13.442 4.404 468 HD13 LEU 58 HD13 LEU 58 105.130 -12.067 3.471 469 HD21 LEU 58 HD21 LEU 58 105.144 -15.842 3.626 470 HD22 LEU 58 HD22 LEU 58 104.134 -16.018 2.171 471 HD23 LEU 58 HD23 LEU 58 103.441 -15.324 3.657 472 H HIS 59 H HIS 59 100.328 -12.421 3.117 473 HA HIS 59 HA HIS 59 99.475 -11.443 0.378 474 HB2 HIS 59 HB2 HIS 59 97.769 -11.778 2.886 475 HB3 HIS 59 HB3 HIS 59 97.196 -11.300 1.271 476 HD2 HIS 59 HD2 HIS 59 98.407 -14.554 3.146 477 HE1 HIS 59 HE1 HIS 59 96.931 -15.680 -0.647 478 H TYR 60 H TYR 60 100.263 -9.378 0.183 479 HA TYR 60 HA TYR 60 100.157 -7.636 2.637 480 HB2 TYR 60 HB2 TYR 60 101.351 -6.056 0.781 481 HB3 TYR 60 HB3 TYR 60 102.250 -7.204 1.799 482 HD1 TYR 60 HD1 TYR 60 101.796 -6.124 -1.485 483 HD2 TYR 60 HD2 TYR 60 102.169 -9.740 0.804 484 HE1 TYR 60 HE1 TYR 60 102.551 -7.331 -3.515 485 HE2 TYR 60 HE2 TYR 60 102.917 -10.948 -1.229 486 HH TYR 60 HH TYR 60 102.474 -10.416 -3.979 487 H TRP 61 H TRP 61 98.437 -6.329 2.865 488 HA TRP 61 HA TRP 61 96.804 -5.746 0.400 489 HB2 TRP 61 HB3 TRP 61 95.643 -6.804 2.333 490 HB3 TRP 61 HB2 TRP 61 96.105 -5.419 3.352 491 HD1 TRP 61 HD1 TRP 61 94.176 -6.095 0.057 492 HE1 TRP 61 HE1 TRP 61 92.275 -4.367 -0.164 493 HE3 TRP 61 HE3 TRP 61 95.138 -3.290 4.214 494 HZ2 TRP 61 HZ2 TRP 61 91.313 -2.067 1.287 495 HZ3 TRP 61 HZ3 TRP 61 93.718 -1.338 4.769 496 HH2 TRP 61 HH2 TRP 61 91.809 -0.722 3.312 497 H LEU 62 H LEU 62 96.907 -3.765 -0.476 498 HA LEU 62 HA LEU 62 97.706 -1.473 1.329 499 HB2 LEU 62 HB2 LEU 62 98.527 -0.876 -1.339 500 HB3 LEU 62 HB3 LEU 62 99.564 -1.155 0.079 501 HG LEU 62 HG LEU 62 98.416 -3.468 -1.518 502 HD11 LEU 62 HD11 LEU 62 100.551 -3.514 -2.779 503 HD12 LEU 62 HD12 LEU 62 101.053 -2.003 -1.983 504 HD13 LEU 62 HD13 LEU 62 99.658 -2.006 -3.089 505 HD21 LEU 62 HD21 LEU 62 101.077 -3.791 -0.401 506 HD22 LEU 62 HD22 LEU 62 99.592 -4.697 -0.028 507 HD23 LEU 62 HD23 LEU 62 99.966 -3.198 0.856 508 H GLY 63 H GLY 63 96.044 -0.048 1.402 509 HA2 GLY 63 HA2 GLY 63 93.756 -0.188 -0.338 510 HA3 GLY 63 HA3 GLY 63 94.169 1.204 0.691 511 H ASN 64 H ASN 64 96.622 0.219 -1.509 512 HA ASN 64 HA ASN 64 97.469 1.255 -3.452 513 HB2 ASN 64 HB2 ASN 64 95.087 0.577 -4.228 514 HB3 ASN 64 HB3 ASN 64 94.670 2.291 -3.996 515 HD21 ASN 64 HD21 ASN 64 97.768 2.714 -4.725 516 HD22 ASN 64 HD22 ASN 64 97.714 2.725 -6.473 517 H GLU 65 H GLU 65 96.293 2.886 -0.836 518 HA GLU 65 HA GLU 65 96.940 5.581 -2.049 519 HB2 GLU 65 HB2 GLU 65 95.361 4.783 0.433 520 HB3 GLU 65 HB3 GLU 65 95.845 6.460 0.081 521 HG2 GLU 65 HG2 GLU 65 94.697 6.226 -2.168 522 HG3 GLU 65 HG3 GLU 65 94.070 4.654 -1.616 523 H CYS 66 H CYS 66 98.618 3.205 -0.778 524 HA CYS 66 HA CYS 66 100.007 4.840 1.334 525 HB2 CYS 66 HB3 CYS 66 99.460 2.540 1.973 526 HB3 CYS 66 HB2 CYS 66 100.270 1.912 0.518 527 HG CYS 66 HG CYS 66 102.129 1.440 2.545 528 H SER 67 H SER 67 102.120 5.547 1.069 529 HA SER 67 HA SER 67 103.105 5.909 -1.616 530 HB2 SER 67 HB2 SER 67 103.707 7.196 0.562 531 HB3 SER 67 HB3 SER 67 104.883 5.890 0.844 532 HG SER 67 HG SER 67 105.788 7.658 -0.353 533 H GLN 68 H GLN 68 104.758 4.842 -2.770 534 HA GLN 68 HA GLN 68 104.918 1.981 -2.397 535 HB2 GLN 68 HB2 GLN 68 107.014 2.335 -3.971 536 HB3 GLN 68 HB3 GLN 68 105.378 2.667 -4.590 537 HG2 GLN 68 HG3 GLN 68 106.891 4.883 -3.214 538 HG3 GLN 68 HG2 GLN 68 107.323 4.457 -4.887 539 HE21 GLN 68 HE21 GLN 68 105.530 6.677 -3.298 540 HE22 GLN 68 HE22 GLN 68 104.186 6.847 -4.406 541 H ASP 69 H ASP 69 106.727 4.642 -1.036 542 HA ASP 69 HA ASP 69 109.165 3.262 -0.378 543 HB2 ASP 69 HB3 ASP 69 108.858 5.710 -0.121 544 HB3 ASP 69 HB2 ASP 69 107.702 5.424 1.202 545 H GLU 70 H GLU 70 106.142 3.658 1.545 546 HA GLU 70 HA GLU 70 107.187 1.692 3.531 547 HB2 GLU 70 HB2 GLU 70 104.498 3.124 3.333 548 HB3 GLU 70 HB3 GLU 70 105.041 2.132 4.707 549 HG2 GLU 70 HG3 GLU 70 106.484 4.614 3.673 550 HG3 GLU 70 HG2 GLU 70 105.403 4.581 5.087 551 H SER 71 H SER 71 104.569 1.955 1.118 552 HA SER 71 HA SER 71 103.344 -0.581 1.589 553 HB2 SER 71 HB2 SER 71 102.762 1.393 -0.077 554 HB3 SER 71 HB3 SER 71 103.739 0.445 -1.224 555 HG SER 71 HG SER 71 101.500 -0.157 -1.253 556 H GLY 72 H GLY 72 105.946 0.232 -0.774 557 HA2 GLY 72 HA3 GLY 72 106.394 -2.486 -1.607 558 HA3 GLY 72 HA2 GLY 72 107.594 -1.176 -1.716 559 H ALA 73 H ALA 73 108.115 -0.518 0.874 560 HA ALA 73 HA ALA 73 109.976 -2.415 1.767 561 HB1 ALA 73 HB1 ALA 73 109.488 -1.428 4.121 562 HB2 ALA 73 HB2 ALA 73 110.004 -0.300 2.845 563 HB3 ALA 73 HB3 ALA 73 108.285 -0.409 3.294 564 H ALA 74 H ALA 74 106.470 -2.347 2.383 565 HA ALA 74 HA ALA 74 106.563 -4.542 4.324 566 HB1 ALA 74 HB1 ALA 74 104.207 -3.737 2.568 567 HB2 ALA 74 HB2 ALA 74 104.669 -2.851 4.041 568 HB3 ALA 74 HB3 ALA 74 104.158 -4.553 4.149 569 H ALA 75 H ALA 75 105.817 -4.311 0.827 570 HA ALA 75 HA ALA 75 105.288 -7.126 0.465 571 HB1 ALA 75 HB1 ALA 75 105.756 -6.688 -1.930 572 HB2 ALA 75 HB2 ALA 75 104.738 -5.405 -1.235 573 HB3 ALA 75 HB3 ALA 75 106.474 -5.116 -1.503 574 H ILE 76 H ILE 76 108.284 -5.245 0.629 575 HA ILE 76 HA ILE 76 109.929 -7.525 -0.299 576 HB ILE 76 HB ILE 76 110.784 -4.957 1.105 577 HG12 ILE 76 HG12 ILE 76 110.003 -5.598 -1.731 578 HG13 ILE 76 HG13 ILE 76 109.745 -4.107 -0.796 579 HG21 ILE 76 HG21 ILE 76 112.365 -7.008 0.898 580 HG22 ILE 76 HG22 ILE 76 112.963 -5.443 0.298 581 HG23 ILE 76 HG23 ILE 76 112.360 -6.663 -0.849 582 HD11 ILE 76 HD11 ILE 76 111.428 -3.518 -2.364 583 HD12 ILE 76 HD12 ILE 76 112.332 -3.854 -0.868 584 HD13 ILE 76 HD13 ILE 76 112.277 -5.070 -2.166 585 H PHE 77 H PHE 77 109.505 -5.780 2.839 586 HA PHE 77 HA PHE 77 111.150 -7.575 4.364 587 HB2 PHE 77 HB2 PHE 77 108.947 -5.635 4.965 588 HB3 PHE 77 HB3 PHE 77 109.326 -6.838 6.221 589 HD1 PHE 77 HD1 PHE 77 110.722 -5.927 7.849 590 HD2 PHE 77 HD2 PHE 77 111.401 -4.921 3.729 591 HE1 PHE 77 HE1 PHE 77 112.724 -4.618 8.498 592 HE2 PHE 77 HE2 PHE 77 113.403 -3.611 4.378 593 HZ PHE 77 HZ PHE 77 114.066 -3.459 6.764 594 H THR 78 H THR 78 107.643 -7.667 3.638 595 HA THR 78 HA THR 78 107.159 -10.086 5.175 596 HB THR 78 HB THR 78 105.510 -8.296 4.116 597 HG1 THR 78 HG1 THR 78 104.232 -9.673 5.060 598 HG21 THR 78 HG21 THR 78 104.474 -9.051 2.034 599 HG22 THR 78 HG22 THR 78 106.218 -8.821 1.766 600 HG23 THR 78 HG23 THR 78 105.558 -10.462 1.969 601 H VAL 79 H VAL 79 107.866 -9.485 1.714 602 HA VAL 79 HA VAL 79 107.726 -12.310 0.991 603 HB VAL 79 HB VAL 79 109.057 -9.910 -0.332 604 HG11 VAL 79 HG11 VAL 79 110.206 -12.010 -0.979 605 HG12 VAL 79 HG12 VAL 79 108.636 -12.742 -1.391 606 HG13 VAL 79 HG13 VAL 79 109.249 -11.362 -2.333 607 HG21 VAL 79 HG21 VAL 79 106.662 -11.469 -1.326 608 HG22 VAL 79 HG22 VAL 79 107.116 -9.778 -1.649 609 HG23 VAL 79 HG23 VAL 79 106.454 -10.234 -0.061 610 H GLN 80 H GLN 80 110.622 -10.156 1.119 611 HA GLN 80 HA GLN 80 112.602 -12.119 0.959 612 HB2 GLN 80 HB3 GLN 80 112.430 -9.561 2.565 613 HB3 GLN 80 HB2 GLN 80 113.862 -10.608 2.710 614 HG2 GLN 80 HG3 GLN 80 112.814 -9.850 -0.025 615 HG3 GLN 80 HG2 GLN 80 113.834 -8.709 0.885 616 HE21 GLN 80 HE21 GLN 80 113.763 -12.058 -0.454 617 HE22 GLN 80 HE22 GLN 80 115.503 -12.219 -0.541 618 H LEU 81 H LEU 81 111.239 -10.952 4.101 619 HA LEU 81 HA LEU 81 112.479 -12.936 5.714 620 HB2 LEU 81 HB3 LEU 81 110.918 -10.922 6.366 621 HB3 LEU 81 HB2 LEU 81 109.607 -12.113 6.209 622 HG LEU 81 HG LEU 81 110.448 -11.962 8.549 623 HD11 LEU 81 HD11 LEU 81 110.205 -14.215 8.891 624 HD12 LEU 81 HD12 LEU 81 111.466 -14.635 7.707 625 HD13 LEU 81 HD13 LEU 81 109.827 -14.220 7.152 626 HD21 LEU 81 HD21 LEU 81 112.670 -12.280 9.149 627 HD22 LEU 81 HD22 LEU 81 112.891 -11.519 7.556 628 HD23 LEU 81 HD23 LEU 81 113.022 -13.286 7.724 629 H ASP 82 H ASP 82 109.534 -13.136 3.704 630 HA ASP 82 HA ASP 82 108.561 -15.643 4.616 631 HB2 ASP 82 HB3 ASP 82 107.214 -15.559 2.777 632 HB3 ASP 82 HB2 ASP 82 107.929 -13.949 2.535 633 H ASP 83 H ASP 83 110.990 -15.049 2.012 634 HA ASP 83 HA ASP 83 111.591 -17.826 1.602 635 HB2 ASP 83 HB2 ASP 83 112.422 -15.997 0.126 636 HB3 ASP 83 HB3 ASP 83 113.498 -15.446 1.433 637 H TYR 84 H TYR 84 112.555 -15.521 4.084 638 HA TYR 84 HA TYR 84 114.597 -17.331 5.219 639 HB2 TYR 84 HB2 TYR 84 114.790 -14.895 5.517 640 HB3 TYR 84 HB3 TYR 84 113.226 -14.860 6.365 641 HD1 TYR 84 HD1 TYR 84 112.981 -15.988 8.577 642 HD2 TYR 84 HD2 TYR 84 116.788 -15.659 6.615 643 HE1 TYR 84 HE1 TYR 84 114.126 -16.533 10.708 644 HE2 TYR 84 HE2 TYR 84 117.933 -16.204 8.747 645 HH TYR 84 HH TYR 84 116.459 -17.572 11.352 646 H LEU 85 H LEU 85 111.144 -16.847 5.489 647 HA LEU 85 HA LEU 85 110.988 -18.291 8.081 648 HB2 LEU 85 HB2 LEU 85 109.394 -16.419 7.062 649 HB3 LEU 85 HB3 LEU 85 108.601 -17.819 6.304 650 HG LEU 85 HG LEU 85 108.375 -18.883 8.545 651 HD11 LEU 85 HD11 LEU 85 110.331 -17.801 9.625 652 HD12 LEU 85 HD12 LEU 85 109.504 -16.227 9.546 653 HD13 LEU 85 HD13 LEU 85 108.847 -17.527 10.569 654 HD21 LEU 85 HD21 LEU 85 107.298 -16.041 8.649 655 HD22 LEU 85 HD22 LEU 85 106.542 -17.529 9.266 656 HD23 LEU 85 HD23 LEU 85 106.663 -17.254 7.512 657 H ASN 86 H ASN 86 110.116 -18.922 4.649 658 HA ASN 86 HA ASN 86 110.029 -21.857 5.399 659 HB2 ASN 86 HB2 ASN 86 107.821 -20.656 4.688 660 HB3 ASN 86 HB3 ASN 86 108.522 -20.666 3.052 661 HD21 ASN 86 HD21 ASN 86 106.731 -22.195 2.452 662 HD22 ASN 86 HD22 ASN 86 106.887 -23.885 2.876 663 H GLY 87 H GLY 87 110.764 -19.471 2.836 664 HA2 GLY 87 HA2 GLY 87 112.876 -19.672 1.572 665 HA3 GLY 87 HA3 GLY 87 112.819 -21.435 1.815 666 H ARG 88 H ARG 88 109.747 -21.066 1.237 667 HA ARG 88 HA ARG 88 109.822 -20.472 -1.679 668 HB2 ARG 88 HB2 ARG 88 109.105 -22.683 -2.379 669 HB3 ARG 88 HB3 ARG 88 110.601 -22.868 -1.433 670 HG2 ARG 88 HG2 ARG 88 108.850 -23.082 0.590 671 HG3 ARG 88 HG3 ARG 88 107.777 -23.621 -0.724 672 HD2 ARG 88 HD2 ARG 88 110.500 -24.790 0.002 673 HD3 ARG 88 HD3 ARG 88 108.915 -25.568 0.225 674 HE ARG 88 HE ARG 88 109.329 -24.819 -2.571 675 HH11 ARG 88 HH11 ARG 88 109.739 -26.528 -3.995 676 HH12 ARG 88 HH12 ARG 88 110.240 -28.084 -3.374 677 HH21 ARG 88 HH21 ARG 88 110.161 -27.067 -0.044 678 HH22 ARG 88 HH22 ARG 88 110.478 -28.388 -1.146 679 H ALA 89 H ALA 89 108.437 -19.643 0.915 680 HA ALA 89 HA ALA 89 105.739 -20.533 0.998 681 HB1 ALA 89 HB1 ALA 89 107.253 -18.176 1.884 682 HB2 ALA 89 HB2 ALA 89 105.903 -19.020 2.679 683 HB3 ALA 89 HB3 ALA 89 105.573 -17.775 1.452 684 H VAL 90 H VAL 90 103.867 -18.812 0.371 685 HA VAL 90 HA VAL 90 104.188 -18.451 -2.608 686 HB VAL 90 HB VAL 90 101.601 -18.351 -1.009 687 HG11 VAL 90 HG11 VAL 90 101.567 -17.453 -3.321 688 HG12 VAL 90 HG12 VAL 90 102.258 -18.979 -3.923 689 HG13 VAL 90 HG13 VAL 90 100.628 -18.961 -3.207 690 HG21 VAL 90 HG21 VAL 90 101.455 -20.798 -2.006 691 HG22 VAL 90 HG22 VAL 90 102.320 -20.516 -0.476 692 HG23 VAL 90 HG23 VAL 90 103.232 -20.696 -1.994 693 H GLN 91 H GLN 91 103.549 -16.453 -3.585 694 HA GLN 91 HA GLN 91 103.567 -14.152 -1.620 695 HB2 GLN 91 HB2 GLN 91 104.321 -12.799 -3.607 696 HB3 GLN 91 HB3 GLN 91 105.454 -14.101 -3.169 697 HG2 GLN 91 HG3 GLN 91 104.255 -15.556 -4.898 698 HG3 GLN 91 HG2 GLN 91 103.423 -14.078 -5.438 699 HE21 GLN 91 HE21 GLN 91 104.572 -12.634 -6.791 700 HE22 GLN 91 HE22 GLN 91 106.250 -12.862 -7.231 701 H HIS 92 H HIS 92 101.825 -12.801 -1.544 702 HA HIS 92 HA HIS 92 99.815 -13.009 -3.795 703 HB2 HIS 92 HB3 HIS 92 99.387 -13.296 -0.812 704 HB3 HIS 92 HB2 HIS 92 98.089 -12.644 -1.842 705 HD2 HIS 92 HD2 HIS 92 100.325 -15.963 -1.821 706 HE1 HIS 92 HE1 HIS 92 96.562 -16.814 -3.541 707 H ARG 93 H ARG 93 99.505 -11.022 -4.650 708 HA ARG 93 HA ARG 93 100.098 -8.642 -2.880 709 HB2 ARG 93 HB3 ARG 93 101.507 -8.770 -4.883 710 HB3 ARG 93 HB2 ARG 93 100.068 -8.934 -5.917 711 HG2 ARG 93 HG2 ARG 93 99.335 -6.704 -5.413 712 HG3 ARG 93 HG3 ARG 93 100.504 -6.547 -4.080 713 HD2 ARG 93 HD2 ARG 93 102.334 -6.904 -5.867 714 HD3 ARG 93 HD3 ARG 93 101.053 -6.617 -7.069 715 HE ARG 93 HE ARG 93 101.021 -4.495 -5.089 716 HH11 ARG 93 HH11 ARG 93 101.907 -2.509 -5.707 717 HH12 ARG 93 HH12 ARG 93 102.985 -2.423 -7.081 718 HH21 ARG 93 HH21 ARG 93 102.811 -5.833 -7.758 719 HH22 ARG 93 HH22 ARG 93 103.495 -4.295 -8.237 720 H GLU 94 H GLU 94 98.419 -7.356 -2.301 721 HA GLU 94 HA GLU 94 95.914 -7.521 -3.996 722 HB2 GLU 94 HB3 GLU 94 96.150 -7.383 -0.957 723 HB3 GLU 94 HB2 GLU 94 94.626 -7.208 -1.858 724 HG2 GLU 94 HG3 GLU 94 94.709 -9.510 -1.240 725 HG3 GLU 94 HG2 GLU 94 95.210 -9.477 -2.947 726 H VAL 95 H VAL 95 96.902 -5.591 -5.041 727 HA VAL 95 HA VAL 95 97.380 -3.160 -3.503 728 HB VAL 95 HB VAL 95 96.542 -3.211 -6.417 729 HG11 VAL 95 HG11 VAL 95 96.969 -1.029 -5.320 730 HG12 VAL 95 HG12 VAL 95 98.579 -1.597 -4.817 731 HG13 VAL 95 HG13 VAL 95 98.210 -1.382 -6.545 732 HG21 VAL 95 HG21 VAL 95 99.132 -3.538 -6.742 733 HG22 VAL 95 HG22 VAL 95 99.064 -4.270 -5.121 734 HG23 VAL 95 HG23 VAL 95 98.109 -4.966 -6.453 735 H GLN 96 H GLN 96 94.870 -4.375 -2.771 736 HA GLN 96 HA GLN 96 92.538 -3.883 -2.665 737 HB2 GLN 96 HB2 GLN 96 93.405 -2.220 -1.146 738 HB3 GLN 96 HB3 GLN 96 93.904 -1.166 -2.490 739 HG2 GLN 96 HG2 GLN 96 91.731 -0.497 -1.333 740 HG3 GLN 96 HG3 GLN 96 91.613 -0.716 -3.095 741 HE21 GLN 96 HE21 GLN 96 91.559 -3.018 -0.276 742 HE22 GLN 96 HE22 GLN 96 90.078 -3.804 -0.776 743 H GLY 97 H GLY 97 91.709 -4.482 -4.696 744 HA2 GLY 97 HA2 GLY 97 90.240 -2.805 -6.253 745 HA3 GLY 97 HA3 GLY 97 91.860 -2.489 -6.919 746 H PHE 98 H PHE 98 92.504 -5.429 -6.141 747 HA PHE 98 HA PHE 98 90.786 -7.001 -7.952 748 HB2 PHE 98 HB2 PHE 98 93.487 -5.969 -8.846 749 HB3 PHE 98 HB3 PHE 98 92.907 -7.553 -9.412 750 HD1 PHE 98 HD1 PHE 98 92.706 -3.986 -9.850 751 HD2 PHE 98 HD2 PHE 98 90.558 -7.654 -10.467 752 HE1 PHE 98 HE1 PHE 98 91.262 -2.859 -11.521 753 HE2 PHE 98 HE2 PHE 98 89.116 -6.527 -12.140 754 HZ PHE 98 HZ PHE 98 89.468 -4.131 -12.668 755 H GLU 99 H GLU 99 91.400 -7.385 -5.280 756 HA GLU 99 HA GLU 99 93.735 -9.021 -4.806 757 HB2 GLU 99 HB2 GLU 99 91.206 -9.613 -3.307 758 HB3 GLU 99 HB3 GLU 99 92.854 -9.334 -2.693 759 HG2 GLU 99 HG3 GLU 99 92.561 -6.893 -3.431 760 HG3 GLU 99 HG2 GLU 99 90.836 -7.270 -3.653 761 H SER 100 H SER 100 93.229 -11.444 -3.945 762 HA SER 100 HA SER 100 92.111 -12.826 -6.370 763 HB2 SER 100 HB2 SER 100 93.498 -14.218 -4.070 764 HB3 SER 100 HB3 SER 100 93.455 -14.665 -5.793 765 HG SER 100 HG SER 100 95.439 -13.744 -5.488 766 H ALA 101 H ALA 101 90.976 -15.012 -5.791 767 HA ALA 101 HA ALA 101 88.614 -14.346 -4.225 768 HB1 ALA 101 HB1 ALA 101 87.981 -16.714 -4.603 769 HB2 ALA 101 HB2 ALA 101 89.627 -17.060 -5.184 770 HB3 ALA 101 HB3 ALA 101 88.571 -15.962 -6.104 771 H THR 102 H THR 102 91.642 -16.030 -3.515 772 HA THR 102 HA THR 102 90.789 -17.270 -1.043 773 HB THR 102 HB THR 102 93.579 -16.166 -1.458 774 HG1 THR 102 HG1 THR 102 93.199 -17.099 -3.416 775 HG21 THR 102 HG21 THR 102 94.183 -18.308 -0.367 776 HG22 THR 102 HG22 THR 102 93.038 -17.381 0.632 777 HG23 THR 102 HG23 THR 102 92.465 -18.770 -0.323 778 H PHE 103 H PHE 103 92.774 -14.299 -1.469 779 HA PHE 103 HA PHE 103 92.593 -13.398 1.218 780 HB2 PHE 103 HB2 PHE 103 94.069 -12.296 -0.369 781 HB3 PHE 103 HB3 PHE 103 92.690 -11.804 -1.381 782 HD1 PHE 103 HD1 PHE 103 94.733 -11.001 1.509 783 HD2 PHE 103 HD2 PHE 103 90.974 -10.204 -0.414 784 HE1 PHE 103 HE1 PHE 103 94.482 -8.935 2.855 785 HE2 PHE 103 HE2 PHE 103 90.726 -8.135 0.932 786 HZ PHE 103 HZ PHE 103 92.478 -7.501 2.567 787 H LEU 104 H LEU 104 90.290 -12.982 -1.480 788 HA LEU 104 HA LEU 104 88.519 -11.208 0.040 789 HB2 LEU 104 HB2 LEU 104 88.332 -12.797 -2.518 790 HB3 LEU 104 HB3 LEU 104 86.841 -12.149 -1.794 791 HG LEU 104 HG LEU 104 89.239 -10.342 -2.089 792 HD11 LEU 104 HD11 LEU 104 88.966 -11.423 -4.304 793 HD12 LEU 104 HD12 LEU 104 88.460 -9.718 -4.358 794 HD13 LEU 104 HD13 LEU 104 87.236 -11.008 -4.293 795 HD21 LEU 104 HD21 LEU 104 87.224 -9.596 -0.849 796 HD22 LEU 104 HD22 LEU 104 86.219 -9.943 -2.277 797 HD23 LEU 104 HD23 LEU 104 87.442 -8.652 -2.342 798 H GLY 105 H GLY 105 88.993 -14.674 -0.153 799 HA2 GLY 105 HA2 GLY 105 86.356 -15.404 0.883 800 HA3 GLY 105 HA3 GLY 105 87.798 -16.448 0.866 801 H TYR 106 H TYR 106 89.568 -14.854 2.384 802 HA TYR 106 HA TYR 106 88.626 -15.501 5.075 803 HB2 TYR 106 HB2 TYR 106 91.044 -14.095 3.923 804 HB3 TYR 106 HB3 TYR 106 90.744 -14.067 5.677 805 HD1 TYR 106 HD1 TYR 106 91.340 -15.912 7.008 806 HD2 TYR 106 HD2 TYR 106 91.008 -16.403 2.754 807 HE1 TYR 106 HE1 TYR 106 92.252 -18.211 7.202 808 HE2 TYR 106 HE2 TYR 106 91.916 -18.703 2.948 809 HH TYR 106 HH TYR 106 92.061 -20.500 4.756 810 H PHE 107 H PHE 107 89.032 -12.446 3.244 811 HA PHE 107 HA PHE 107 87.489 -11.086 5.469 812 HB2 PHE 107 HB2 PHE 107 89.142 -9.629 3.389 813 HB3 PHE 107 HB3 PHE 107 88.661 -9.089 5.016 814 HD1 PHE 107 HD1 PHE 107 89.469 -10.786 6.960 815 HD2 PHE 107 HD2 PHE 107 91.349 -10.314 3.127 816 HE1 PHE 107 HE1 PHE 107 91.585 -11.690 7.886 817 HE2 PHE 107 HE2 PHE 107 93.465 -11.215 4.052 818 HZ PHE 107 HZ PHE 107 93.584 -11.903 6.432 819 H LYS 108 H LYS 108 85.581 -12.078 4.268 820 HA LYS 108 HA LYS 108 84.962 -10.613 1.717 821 HB2 LYS 108 HB2 LYS 108 84.613 -13.068 1.754 822 HB3 LYS 108 HB3 LYS 108 83.494 -12.888 3.127 823 HG2 LYS 108 HG2 LYS 108 81.850 -11.844 1.820 824 HG3 LYS 108 HG3 LYS 108 83.022 -11.309 0.592 825 HD2 LYS 108 HD3 LYS 108 82.702 -14.266 1.013 826 HD3 LYS 108 HD2 LYS 108 81.388 -13.407 0.176 827 HE2 LYS 108 HE2 LYS 108 83.395 -14.375 -1.228 828 HE3 LYS 108 HE3 LYS 108 82.774 -12.750 -1.603 829 HZ1 LYS 108 HZ1 LYS 108 85.172 -12.767 -1.414 830 HZ2 LYS 108 HZ2 LYS 108 84.515 -11.836 -0.221 831 HZ3 LYS 108 HZ3 LYS 108 85.090 -13.342 0.130 832 H SER 109 H SER 109 83.960 -10.937 5.094 833 HA SER 109 HA SER 109 81.738 -8.967 4.563 834 HB2 SER 109 HB2 SER 109 81.495 -11.248 5.892 835 HB3 SER 109 HB3 SER 109 82.200 -10.306 7.228 836 HG SER 109 HG SER 109 79.887 -10.164 7.164 837 H GLY 110 H GLY 110 84.916 -8.783 5.168 838 HA2 GLY 110 HA3 GLY 110 84.649 -6.725 7.354 839 HA3 GLY 110 HA2 GLY 110 86.173 -7.484 6.833 840 H LEU 111 H LEU 111 87.431 -6.315 5.480 841 HA LEU 111 HA LEU 111 88.080 -4.521 4.097 842 HB2 LEU 111 HB3 LEU 111 85.441 -5.437 2.982 843 HB3 LEU 111 HB2 LEU 111 86.184 -3.956 2.332 844 HG LEU 111 HG LEU 111 88.213 -5.152 1.747 845 HD11 LEU 111 HD11 LEU 111 88.259 -7.686 2.151 846 HD12 LEU 111 HD12 LEU 111 88.473 -6.663 3.591 847 HD13 LEU 111 HD13 LEU 111 86.900 -7.433 3.272 848 HD21 LEU 111 HD21 LEU 111 87.311 -6.806 0.133 849 HD22 LEU 111 HD22 LEU 111 86.319 -5.328 0.157 850 HD23 LEU 111 HD23 LEU 111 85.753 -6.794 0.993 851 H LYS 112 H LYS 112 88.255 -2.767 5.361 852 HA LYS 112 HA LYS 112 85.922 -0.886 5.357 853 HB2 LYS 112 HB2 LYS 112 86.533 -2.422 7.630 854 HB3 LYS 112 HB3 LYS 112 87.299 -0.847 7.946 855 HG2 LYS 112 HG2 LYS 112 85.126 0.270 7.341 856 HG3 LYS 112 HG3 LYS 112 84.384 -1.341 7.190 857 HD2 LYS 112 HD2 LYS 112 84.901 -1.831 9.542 858 HD3 LYS 112 HD3 LYS 112 85.740 -0.270 9.706 859 HE2 LYS 112 HE2 LYS 112 82.845 -0.423 8.807 860 HE3 LYS 112 HE3 LYS 112 83.281 -0.407 10.532 861 HZ1 LYS 112 HZ1 LYS 112 82.891 1.812 9.692 862 HZ2 LYS 112 HZ2 LYS 112 84.468 1.647 10.146 863 HZ3 LYS 112 HZ3 LYS 112 84.065 1.632 8.547 864 H TYR 113 H TYR 113 86.837 0.770 4.259 865 HA TYR 113 HA TYR 113 89.727 1.365 4.556 866 HB2 TYR 113 HB2 TYR 113 87.727 3.159 3.165 867 HB3 TYR 113 HB3 TYR 113 89.430 2.844 2.752 868 HD1 TYR 113 HD1 TYR 113 86.257 2.299 1.583 869 HD2 TYR 113 HD2 TYR 113 89.794 0.063 2.558 870 HE1 TYR 113 HE1 TYR 113 85.547 0.498 0.032 871 HE2 TYR 113 HE2 TYR 113 89.082 -1.739 1.010 872 HH TYR 113 HH TYR 113 87.538 -1.856 -1.122 873 H LYS 114 H LYS 114 90.319 2.336 6.450 874 HA LYS 114 HA LYS 114 88.584 4.637 7.386 875 HB2 LYS 114 HB2 LYS 114 90.264 2.615 8.909 876 HB3 LYS 114 HB3 LYS 114 89.768 4.161 9.639 877 HG2 LYS 114 HG3 LYS 114 87.691 2.446 8.276 878 HG3 LYS 114 HG2 LYS 114 88.245 2.002 9.908 879 HD2 LYS 114 HD2 LYS 114 87.526 4.878 9.397 880 HD3 LYS 114 HD3 LYS 114 86.200 3.699 9.540 881 HE2 LYS 114 HE3 LYS 114 88.451 4.008 11.575 882 HE3 LYS 114 HE2 LYS 114 86.845 4.759 11.735 883 HZ1 LYS 114 HZ1 LYS 114 86.960 2.651 12.886 884 HZ2 LYS 114 HZ2 LYS 114 87.368 1.863 11.495 885 HZ3 LYS 114 HZ3 LYS 114 85.879 2.559 11.643 886 H LYS 115 H LYS 115 89.560 6.480 6.675 887 HA LYS 115 HA LYS 115 92.515 6.582 6.392 888 HB2 LYS 115 HB2 LYS 115 92.126 8.843 5.524 889 HB3 LYS 115 HB3 LYS 115 90.972 7.715 4.772 890 HG2 LYS 115 HG2 LYS 115 89.334 8.376 6.638 891 HG3 LYS 115 HG3 LYS 115 90.461 9.701 7.019 892 HD2 LYS 115 HD3 LYS 115 90.313 10.381 4.562 893 HD3 LYS 115 HD2 LYS 115 88.982 9.210 4.401 894 HE2 LYS 115 HE2 LYS 115 89.078 11.601 6.293 895 HE3 LYS 115 HE3 LYS 115 88.055 11.436 4.845 896 HZ1 LYS 115 HZ1 LYS 115 86.641 10.738 6.461 897 HZ2 LYS 115 HZ2 LYS 115 87.821 10.112 7.428 898 HZ3 LYS 115 HZ3 LYS 115 87.326 9.284 6.090 899 H GLY 116 H GLY 116 93.907 7.390 7.893 900 HA2 GLY 116 HA3 GLY 116 93.865 9.487 9.582 901 HA3 GLY 116 HA2 GLY 116 92.697 8.445 10.428 902 H GLY 117 H GLY 117 93.788 7.680 12.191 903 HA2 GLY 117 HA2 GLY 117 95.699 5.613 12.020 904 HA3 GLY 117 HA3 GLY 117 96.659 7.108 12.125 905 H VAL 118 H VAL 118 94.281 5.069 13.793 906 HA VAL 118 HA VAL 118 93.731 6.538 16.107 907 HB VAL 118 HB VAL 118 94.625 3.622 16.125 908 HG11 VAL 118 HG11 VAL 118 93.018 3.469 18.007 909 HG12 VAL 118 HG12 VAL 118 94.290 4.665 18.349 910 HG13 VAL 118 HG13 VAL 118 92.669 5.207 17.851 911 HG21 VAL 118 HG21 VAL 118 92.245 3.105 15.657 912 HG22 VAL 118 HG22 VAL 118 92.968 4.042 14.329 913 HG23 VAL 118 HG23 VAL 118 91.898 4.844 15.503 914 H ALA 119 H ALA 119 96.825 5.170 15.118 915 HA ALA 119 HA ALA 119 98.068 5.571 17.768 916 HB1 ALA 119 HB1 ALA 119 100.176 5.041 16.575 917 HB2 ALA 119 HB2 ALA 119 98.908 3.854 16.189 918 HB3 ALA 119 HB3 ALA 119 99.318 5.130 15.019 919 H SER 120 H SER 120 97.568 7.457 14.839 920 HA SER 120 HA SER 120 99.647 9.421 15.328 921 HB2 SER 120 HB3 SER 120 96.988 9.632 13.857 922 HB3 SER 120 HB2 SER 120 98.242 10.895 13.843 923 HG SER 120 HG SER 120 98.432 9.433 12.053 924 H GLY 121 H GLY 121 97.306 8.559 17.339 925 HA2 GLY 121 HA2 GLY 121 96.296 11.237 18.115 926 HA3 GLY 121 HA3 GLY 121 95.979 9.703 18.961 927 H PHE 122 H PHE 122 98.257 8.722 19.807 928 HA PHE 122 HA PHE 122 99.265 10.822 21.662 929 HB2 PHE 122 HB2 PHE 122 100.366 8.014 21.551 930 HB3 PHE 122 HB3 PHE 122 100.082 9.060 22.962 931 HD1 PHE 122 HD1 PHE 122 97.601 9.660 23.486 932 HD2 PHE 122 HD2 PHE 122 98.782 6.386 20.971 933 HE1 PHE 122 HE1 PHE 122 95.385 8.601 23.826 934 HE2 PHE 122 HE2 PHE 122 96.564 5.326 21.308 935 HZ PHE 122 HZ PHE 122 94.866 6.434 22.735 936 H LYS 123 H LYS 123 100.204 9.298 18.690 937 HA LYS 123 HA LYS 123 102.994 9.283 18.711 938 HB2 LYS 123 HB2 LYS 123 101.374 8.917 16.729 939 HB3 LYS 123 HB3 LYS 123 101.464 10.678 16.487 940 HG2 LYS 123 HG2 LYS 123 104.047 10.341 16.555 941 HG3 LYS 123 HG3 LYS 123 103.683 8.619 16.289 942 HD2 LYS 123 HD3 LYS 123 102.251 9.360 14.300 943 HD3 LYS 123 HD2 LYS 123 102.968 10.977 14.501 944 HE2 LYS 123 HE2 LYS 123 104.456 10.040 12.970 945 HE3 LYS 123 HE3 LYS 123 105.250 9.602 14.502 946 HZ1 LYS 123 HZ1 LYS 123 105.049 7.710 13.030 947 HZ2 LYS 123 HZ2 LYS 123 104.145 7.469 14.388 948 HZ3 LYS 123 HZ3 LYS 123 103.410 7.876 12.968 949 H HIS 124 H HIS 124 100.966 12.204 18.123 950 HA HIS 124 HA HIS 124 101.541 14.486 18.348 951 HB2 HIS 124 HB2 HIS 124 103.144 13.146 20.545 952 HB3 HIS 124 HB3 HIS 124 103.249 14.903 20.278 953 HD2 HIS 124 HD2 HIS 124 101.780 14.331 23.024 954 HE1 HIS 124 HE1 HIS 124 98.101 14.540 20.961 955 HE2 HIS 124 HE2 HIS 124 99.182 14.612 23.273 956 H VAL 125 H VAL 125 103.410 16.076 18.143 957 HA VAL 125 HA VAL 125 105.509 14.822 16.365 958 HB VAL 125 HB VAL 125 104.638 17.739 16.565 959 HG11 VAL 125 HG11 VAL 125 106.943 17.385 15.724 960 HG12 VAL 125 HG12 VAL 125 105.866 17.943 14.422 961 HG13 VAL 125 HG13 VAL 125 106.326 16.226 14.522 962 HG21 VAL 125 HG21 VAL 125 102.810 16.278 15.739 963 HG22 VAL 125 HG22 VAL 125 103.915 15.580 14.531 964 HG23 VAL 125 HG23 VAL 125 103.455 17.297 14.430 965 H VAL 126 H VAL 126 107.358 14.450 17.493 966 HA VAL 126 HA VAL 126 108.096 16.399 19.670 967 HB VAL 126 HB VAL 126 108.070 13.965 20.222 968 HG11 VAL 126 HG11 VAL 126 109.245 12.377 19.022 969 HG12 VAL 126 HG12 VAL 126 108.943 13.536 17.706 970 HG13 VAL 126 HG13 VAL 126 110.515 13.528 18.541 971 HG21 VAL 126 HG21 VAL 126 110.354 13.874 21.185 972 HG22 VAL 126 HG22 VAL 126 110.856 15.208 20.118 973 HG23 VAL 126 HG23 VAL 126 109.639 15.492 21.386 974 HA PRO 127 HA PRO 127 110.750 18.452 16.649 975 HB2 PRO 127 HB2 PRO 127 112.174 19.140 19.221 976 HB3 PRO 127 HB3 PRO 127 111.700 20.201 17.863 977 HG2 PRO 127 HG2 PRO 127 110.322 20.131 20.173 978 HG3 PRO 127 HG3 PRO 127 109.534 20.399 18.594 979 HD2 PRO 127 HD3 PRO 127 109.469 17.992 20.362 980 HD3 PRO 127 HD2 PRO 127 108.285 18.530 19.133 981 H ASN 128 H ASN 128 112.430 17.553 15.544 982 HA ASN 128 HA ASN 128 113.818 15.216 16.525 983 HB2 ASN 128 HB3 ASN 128 114.443 17.169 14.272 984 HB3 ASN 128 HB2 ASN 128 115.386 15.688 14.569 985 HD21 ASN 128 HD21 ASN 128 111.989 16.809 13.986 986 HD22 ASN 128 HD22 ASN 128 111.492 15.337 13.182 987 H GLU 129 H GLU 129 115.726 14.984 17.644 988 HA GLU 129 HA GLU 129 116.730 17.086 19.269 989 HB2 GLU 129 HB3 GLU 129 118.572 14.922 18.225 990 HB3 GLU 129 HB2 GLU 129 118.472 15.617 19.860 991 HG2 GLU 129 HG2 GLU 129 116.058 14.616 19.891 992 HG3 GLU 129 HG3 GLU 129 116.622 13.621 18.527 993 H VAL 130 H VAL 130 117.174 16.555 15.882 994 HA VAL 130 HA VAL 130 119.724 17.607 15.336 995 HB VAL 130 HB VAL 130 117.086 18.195 13.925 996 HG11 VAL 130 HG11 VAL 130 118.811 19.887 13.363 997 HG12 VAL 130 HG12 VAL 130 118.505 18.804 11.984 998 HG13 VAL 130 HG13 VAL 130 119.963 18.585 12.981 999 HG21 VAL 130 HG21 VAL 130 117.875 16.421 12.383 1000 HG22 VAL 130 HG22 VAL 130 117.731 15.804 14.046 1001 HG23 VAL 130 HG23 VAL 130 119.333 16.202 13.380 1002 H VAL 131 H VAL 131 116.813 19.349 16.406 1003 HA VAL 131 HA VAL 131 117.598 22.018 15.914 1004 HB VAL 131 HB VAL 131 116.195 20.809 18.332 1005 HG11 VAL 131 HG11 VAL 131 117.215 22.989 18.927 1006 HG12 VAL 131 HG12 VAL 131 115.444 23.120 18.821 1007 HG13 VAL 131 HG13 VAL 131 116.462 23.732 17.496 1008 HG21 VAL 131 HG21 VAL 131 114.181 21.706 17.198 1009 HG22 VAL 131 HG22 VAL 131 115.200 22.317 15.872 1010 HG23 VAL 131 HG23 VAL 131 115.051 20.564 16.146 1011 H VAL 132 H VAL 132 118.233 20.228 18.985 1012 HA VAL 132 HA VAL 132 120.215 22.233 19.814 1013 HB VAL 132 HB VAL 132 119.779 19.403 20.864 1014 HG11 VAL 132 HG11 VAL 132 121.899 20.475 21.574 1015 HG12 VAL 132 HG12 VAL 132 120.763 20.339 22.937 1016 HG13 VAL 132 HG13 VAL 132 120.992 21.905 22.123 1017 HG21 VAL 132 HG21 VAL 132 118.303 20.491 22.534 1018 HG22 VAL 132 HG22 VAL 132 117.685 20.729 20.883 1019 HG23 VAL 132 HG23 VAL 132 118.531 22.055 21.715 1020 H GLN 133 H GLN 133 120.279 19.200 18.024 1021 HA GLN 133 HA GLN 133 122.080 18.126 16.934 1022 HB2 GLN 133 HB2 GLN 133 122.378 20.661 16.260 1023 HB3 GLN 133 HB3 GLN 133 123.777 20.591 17.358 1024 HG2 GLN 133 HG3 GLN 133 124.719 19.979 15.288 1025 HG3 GLN 133 HG2 GLN 133 124.382 18.402 16.041 1026 HE21 GLN 133 HE21 GLN 133 122.568 20.860 14.056 1027 HE22 GLN 133 HE22 GLN 133 121.820 19.665 13.020 Start of MODEL 8 1 H1 GLU 1 H1 GLU 1 111.020 -3.543 15.762 2 H2 GLU 1 H2 GLU 1 109.375 -3.644 15.704 3 H3 GLU 1 H3 GLU 1 110.111 -2.931 16.996 4 HA GLU 1 HA GLU 1 110.774 -4.879 17.948 5 HB2 GLU 1 HB3 GLU 1 108.343 -5.771 16.344 6 HB3 GLU 1 HB2 GLU 1 108.851 -6.338 17.953 7 HG2 GLU 1 HG2 GLU 1 107.818 -3.570 17.202 8 HG3 GLU 1 HG3 GLU 1 107.052 -4.755 18.287 9 H HIS 2 H HIS 2 112.562 -6.016 17.337 10 HA HIS 2 HA HIS 2 112.803 -7.118 14.613 11 HB2 HIS 2 HB2 HIS 2 114.582 -6.446 16.668 12 HB3 HIS 2 HB3 HIS 2 114.649 -8.223 16.618 13 HD2 HIS 2 HD2 HIS 2 114.251 -8.423 13.252 14 HE1 HIS 2 HE1 HIS 2 117.868 -6.244 13.198 15 HE2 HIS 2 HE2 HIS 2 116.310 -7.698 11.793 16 HA PRO 3 HA PRO 3 112.253 -11.218 17.287 17 HB2 PRO 3 HB2 PRO 3 110.292 -10.175 19.291 18 HB3 PRO 3 HB3 PRO 3 111.685 -11.270 19.521 19 HG2 PRO 3 HG3 PRO 3 111.712 -8.710 20.351 20 HG3 PRO 3 HG2 PRO 3 113.178 -9.541 19.762 21 HD2 PRO 3 HD3 PRO 3 111.438 -7.503 18.374 22 HD3 PRO 3 HD2 PRO 3 113.213 -7.725 18.287 23 H GLU 4 H GLU 4 109.660 -8.799 16.897 24 HA GLU 4 HA GLU 4 107.442 -10.562 16.597 25 HB2 GLU 4 HB2 GLU 4 107.648 -7.917 16.477 26 HB3 GLU 4 HB3 GLU 4 107.758 -8.215 14.726 27 HG2 GLU 4 HG3 GLU 4 105.501 -8.978 16.619 28 HG3 GLU 4 HG2 GLU 4 105.424 -7.911 15.197 29 H PHE 5 H PHE 5 109.533 -9.255 13.958 30 HA PHE 5 HA PHE 5 108.463 -10.747 11.822 31 HB2 PHE 5 HB2 PHE 5 111.283 -9.865 12.481 32 HB3 PHE 5 HB3 PHE 5 110.962 -10.828 11.020 33 HD1 PHE 5 HD1 PHE 5 111.113 -7.546 12.324 34 HD2 PHE 5 HD2 PHE 5 108.872 -9.989 9.590 35 HE1 PHE 5 HE1 PHE 5 110.313 -5.509 11.156 36 HE2 PHE 5 HE2 PHE 5 108.074 -7.953 8.425 37 HZ PHE 5 HZ PHE 5 108.796 -5.713 9.206 38 H LEU 6 H LEU 6 110.670 -11.823 14.390 39 HA LEU 6 HA LEU 6 111.001 -14.497 13.166 40 HB2 LEU 6 HB2 LEU 6 111.835 -13.162 15.744 41 HB3 LEU 6 HB3 LEU 6 111.895 -14.937 15.622 42 HG LEU 6 HG LEU 6 113.254 -14.695 13.522 43 HD11 LEU 6 HD11 LEU 6 114.344 -12.292 13.393 44 HD12 LEU 6 HD12 LEU 6 112.856 -11.783 14.226 45 HD13 LEU 6 HD13 LEU 6 112.759 -12.581 12.638 46 HD21 LEU 6 HD21 LEU 6 115.336 -13.992 14.674 47 HD22 LEU 6 HD22 LEU 6 114.367 -13.273 15.983 48 HD23 LEU 6 HD23 LEU 6 114.345 -15.034 15.723 49 H LYS 7 H LYS 7 108.773 -12.911 15.350 50 HA LYS 7 HA LYS 7 107.768 -15.285 16.677 51 HB2 LYS 7 HB2 LYS 7 107.299 -12.909 17.377 52 HB3 LYS 7 HB3 LYS 7 106.232 -12.748 15.962 53 HG2 LYS 7 HG3 LYS 7 104.741 -14.449 16.782 54 HG3 LYS 7 HG2 LYS 7 105.893 -14.941 18.046 55 HD2 LYS 7 HD2 LYS 7 105.021 -12.071 18.030 56 HD3 LYS 7 HD3 LYS 7 103.826 -13.281 18.554 57 HE2 LYS 7 HE3 LYS 7 105.056 -12.531 20.516 58 HE3 LYS 7 HE2 LYS 7 105.562 -14.198 20.148 59 HZ1 LYS 7 HZ1 LYS 7 107.352 -12.468 20.589 60 HZ2 LYS 7 HZ2 LYS 7 107.033 -11.898 19.075 61 HZ3 LYS 7 HZ3 LYS 7 107.553 -13.450 19.279 62 H ALA 8 H ALA 8 106.795 -13.586 13.679 63 HA ALA 8 HA ALA 8 104.504 -15.117 13.022 64 HB1 ALA 8 HB1 ALA 8 106.710 -14.109 11.165 65 HB2 ALA 8 HB2 ALA 8 105.104 -14.660 10.632 66 HB3 ALA 8 HB3 ALA 8 105.253 -13.212 11.657 67 H GLY 9 H GLY 9 104.174 -17.126 11.987 68 HA2 GLY 9 HA2 GLY 9 104.828 -19.245 11.085 69 HA3 GLY 9 HA3 GLY 9 106.534 -18.749 11.201 70 H LYS 10 H LYS 10 103.814 -19.198 13.531 71 HA LYS 10 HA LYS 10 105.662 -21.019 15.078 72 HB2 LYS 10 HB2 LYS 10 104.166 -18.570 16.010 73 HB3 LYS 10 HB3 LYS 10 104.385 -19.931 17.136 74 HG2 LYS 10 HG3 LYS 10 106.766 -18.958 15.567 75 HG3 LYS 10 HG2 LYS 10 106.213 -17.999 16.961 76 HD2 LYS 10 HD2 LYS 10 106.378 -19.978 18.417 77 HD3 LYS 10 HD3 LYS 10 106.860 -20.981 17.028 78 HE2 LYS 10 HE3 LYS 10 108.926 -20.425 18.030 79 HE3 LYS 10 HE2 LYS 10 108.776 -19.226 16.723 80 HZ1 LYS 10 HZ1 LYS 10 109.386 -18.198 18.808 81 HZ2 LYS 10 HZ2 LYS 10 107.895 -17.676 18.334 82 HZ3 LYS 10 HZ3 LYS 10 108.034 -18.787 19.546 83 H GLU 11 H GLU 11 102.637 -20.452 13.623 84 HA GLU 11 HA GLU 11 101.646 -23.054 14.629 85 HB2 GLU 11 HB2 GLU 11 100.298 -20.429 15.389 86 HB3 GLU 11 HB3 GLU 11 99.444 -21.990 15.402 87 HG2 GLU 11 HG3 GLU 11 101.433 -22.822 16.869 88 HG3 GLU 11 HG2 GLU 11 101.788 -21.094 17.106 89 HA PRO 12 HA PRO 12 99.840 -22.859 10.592 90 HB2 PRO 12 HB2 PRO 12 97.822 -24.719 10.872 91 HB3 PRO 12 HB3 PRO 12 99.550 -25.154 10.733 92 HG2 PRO 12 HG3 PRO 12 97.810 -24.984 13.164 93 HG3 PRO 12 HG2 PRO 12 99.077 -26.172 12.749 94 HD2 PRO 12 HD3 PRO 12 99.458 -24.063 14.499 95 HD3 PRO 12 HD2 PRO 12 100.783 -24.807 13.553 96 H GLY 13 H GLY 13 97.920 -22.138 9.428 97 HA2 GLY 13 HA3 GLY 13 95.459 -21.515 9.687 98 HA3 GLY 13 HA2 GLY 13 95.903 -20.805 11.258 99 H LEU 14 H LEU 14 95.416 -18.651 10.838 100 HA LEU 14 HA LEU 14 97.076 -17.381 8.649 101 HB2 LEU 14 HB2 LEU 14 94.809 -17.344 7.848 102 HB3 LEU 14 HB3 LEU 14 94.184 -16.846 9.438 103 HG LEU 14 HG LEU 14 96.248 -15.034 8.305 104 HD11 LEU 14 HD11 LEU 14 95.044 -15.671 6.231 105 HD12 LEU 14 HD12 LEU 14 93.494 -15.280 7.013 106 HD13 LEU 14 HD13 LEU 14 94.680 -13.991 6.693 107 HD21 LEU 14 HD21 LEU 14 94.942 -14.554 10.361 108 HD22 LEU 14 HD22 LEU 14 93.434 -14.629 9.419 109 HD23 LEU 14 HD23 LEU 14 94.620 -13.340 9.100 110 H GLN 15 H GLN 15 98.017 -15.392 9.156 111 HA GLN 15 HA GLN 15 97.471 -14.330 11.929 112 HB2 GLN 15 HB2 GLN 15 100.018 -15.432 10.841 113 HB3 GLN 15 HB3 GLN 15 100.162 -13.870 11.683 114 HG2 GLN 15 HG3 GLN 15 98.833 -14.891 13.597 115 HG3 GLN 15 HG2 GLN 15 98.982 -16.461 12.774 116 HE21 GLN 15 HE21 GLN 15 101.539 -16.665 11.917 117 HE22 GLN 15 HE22 GLN 15 102.680 -16.423 13.222 118 H ILE 16 H ILE 16 97.883 -12.054 12.143 119 HA ILE 16 HA ILE 16 98.300 -10.657 9.486 120 HB ILE 16 HB ILE 16 96.523 -9.655 11.745 121 HG12 ILE 16 HG12 ILE 16 94.885 -10.485 9.607 122 HG13 ILE 16 HG13 ILE 16 96.045 -11.817 9.826 123 HG21 ILE 16 HG21 ILE 16 95.581 -8.239 9.935 124 HG22 ILE 16 HG22 ILE 16 97.331 -7.972 10.115 125 HG23 ILE 16 HG23 ILE 16 96.717 -8.969 8.775 126 HD11 ILE 16 HD11 ILE 16 94.050 -12.129 11.265 127 HD12 ILE 16 HD12 ILE 16 94.353 -10.550 12.028 128 HD13 ILE 16 HD13 ILE 16 95.513 -11.882 12.248 129 H TRP 17 H TRP 17 99.538 -8.767 9.528 130 HA TRP 17 HA TRP 17 100.498 -7.766 12.187 131 HB2 TRP 17 HB2 TRP 17 102.470 -8.452 9.973 132 HB3 TRP 17 HB3 TRP 17 102.829 -7.966 11.647 133 HD1 TRP 17 HD1 TRP 17 101.403 -9.783 13.469 134 HE1 TRP 17 HE1 TRP 17 101.618 -12.352 13.471 135 HE3 TRP 17 HE3 TRP 17 103.098 -10.457 8.702 136 HZ2 TRP 17 HZ2 TRP 17 102.430 -14.417 11.626 137 HZ3 TRP 17 HZ3 TRP 17 103.587 -12.730 7.851 138 HH2 TRP 17 HH2 TRP 17 103.252 -14.709 9.304 139 H ARG 18 H ARG 18 99.925 -5.644 12.012 140 HA ARG 18 HA ARG 18 99.878 -4.327 9.356 141 HB2 ARG 18 HB3 ARG 18 98.191 -3.815 11.119 142 HB3 ARG 18 HB2 ARG 18 99.488 -3.167 12.151 143 HG2 ARG 18 HG2 ARG 18 100.018 -1.466 10.445 144 HG3 ARG 18 HG3 ARG 18 98.762 -2.131 9.374 145 HD2 ARG 18 HD2 ARG 18 97.391 -0.601 10.362 146 HD3 ARG 18 HD3 ARG 18 97.366 -1.737 11.732 147 HE ARG 18 HE ARG 18 98.651 -0.176 12.969 148 HH11 ARG 18 HH11 ARG 18 99.890 1.706 13.161 149 HH12 ARG 18 HH12 ARG 18 100.413 2.559 11.726 150 HH21 ARG 18 HH21 ARG 18 98.893 0.321 9.533 151 HH22 ARG 18 HH22 ARG 18 99.851 1.778 9.680 152 H VAL 19 H VAL 19 101.519 -3.150 8.475 153 HA VAL 19 HA VAL 19 104.025 -2.883 10.069 154 HB VAL 19 HB VAL 19 103.779 -1.683 7.336 155 HG11 VAL 19 HG11 VAL 19 105.924 -1.742 8.582 156 HG12 VAL 19 HG12 VAL 19 105.806 -3.514 8.700 157 HG13 VAL 19 HG13 VAL 19 106.010 -2.739 7.110 158 HG21 VAL 19 HG21 VAL 19 104.155 -4.070 6.418 159 HG22 VAL 19 HG22 VAL 19 103.506 -4.642 7.974 160 HG23 VAL 19 HG23 VAL 19 102.495 -3.646 6.900 161 H GLU 20 H GLU 20 104.951 -0.933 10.689 162 HA GLU 20 HA GLU 20 103.616 1.619 9.927 163 HB2 GLU 20 HB2 GLU 20 102.289 0.745 11.880 164 HB3 GLU 20 HB3 GLU 20 103.783 0.753 12.848 165 HG2 GLU 20 HG2 GLU 20 102.940 3.255 11.376 166 HG3 GLU 20 HG3 GLU 20 102.167 2.841 12.925 167 H LYS 21 H LYS 21 105.712 2.066 9.030 168 HA LYS 21 HA LYS 21 107.896 2.958 9.140 169 HB2 LYS 21 HB2 LYS 21 106.515 4.240 11.091 170 HB3 LYS 21 HB3 LYS 21 107.730 3.415 12.095 171 HG2 LYS 21 HG2 LYS 21 108.362 5.138 9.657 172 HG3 LYS 21 HG3 LYS 21 108.483 5.685 11.346 173 HD2 LYS 21 HD2 LYS 21 110.114 3.841 11.794 174 HD3 LYS 21 HD3 LYS 21 110.035 3.383 10.076 175 HE2 LYS 21 HE2 LYS 21 111.979 4.930 10.781 176 HE3 LYS 21 HE3 LYS 21 111.017 5.441 9.373 177 HZ1 LYS 21 HZ1 LYS 21 111.490 7.100 11.267 178 HZ2 LYS 21 HZ2 LYS 21 110.257 6.336 12.051 179 HZ3 LYS 21 HZ3 LYS 21 109.985 7.061 10.595 180 H PHE 22 H PHE 22 107.828 0.230 9.209 181 HA PHE 22 HA PHE 22 109.070 -1.656 9.911 182 HB2 PHE 22 HB3 PHE 22 110.902 0.687 10.451 183 HB3 PHE 22 HB2 PHE 22 111.392 -0.950 10.952 184 HD1 PHE 22 HD1 PHE 22 109.734 0.654 7.972 185 HD2 PHE 22 HD2 PHE 22 112.688 -2.110 9.414 186 HE1 PHE 22 HE1 PHE 22 110.390 0.136 5.636 187 HE2 PHE 22 HE2 PHE 22 113.346 -2.626 7.080 188 HZ PHE 22 HZ PHE 22 112.197 -1.502 5.190 189 H ASP 23 H ASP 23 107.058 -1.002 11.690 190 HA ASP 23 HA ASP 23 108.416 -1.549 14.340 191 HB2 ASP 23 HB3 ASP 23 107.420 0.767 14.202 192 HB3 ASP 23 HB2 ASP 23 105.831 0.016 13.924 193 H LEU 24 H LEU 24 105.842 -2.251 12.058 194 HA LEU 24 HA LEU 24 104.312 -4.046 11.998 195 HB2 LEU 24 HB2 LEU 24 106.668 -5.039 13.490 196 HB3 LEU 24 HB3 LEU 24 105.164 -5.915 13.862 197 HG LEU 24 HG LEU 24 104.776 -6.185 11.388 198 HD11 LEU 24 HD11 LEU 24 106.144 -4.236 10.668 199 HD12 LEU 24 HD12 LEU 24 106.665 -5.734 9.861 200 HD13 LEU 24 HD13 LEU 24 107.614 -5.076 11.215 201 HD21 LEU 24 HD21 LEU 24 105.852 -7.972 12.729 202 HD22 LEU 24 HD22 LEU 24 106.521 -7.919 11.081 203 HD23 LEU 24 HD23 LEU 24 107.444 -7.232 12.438 204 H VAL 25 H VAL 25 102.321 -4.268 12.923 205 HA VAL 25 HA VAL 25 102.089 -4.016 15.904 206 HB VAL 25 HB VAL 25 100.531 -2.269 13.943 207 HG11 VAL 25 HG11 VAL 25 99.238 -2.956 15.945 208 HG12 VAL 25 HG12 VAL 25 100.562 -2.392 16.993 209 HG13 VAL 25 HG13 VAL 25 99.645 -1.224 16.010 210 HG21 VAL 25 HG21 VAL 25 101.775 -0.402 15.012 211 HG22 VAL 25 HG22 VAL 25 102.883 -1.539 14.208 212 HG23 VAL 25 HG23 VAL 25 102.700 -1.577 15.978 213 HA PRO 26 HA PRO 26 99.596 -7.587 14.514 214 HB2 PRO 26 HB2 PRO 26 98.962 -7.451 17.460 215 HB3 PRO 26 HB3 PRO 26 99.414 -8.858 16.455 216 HG2 PRO 26 HG2 PRO 26 101.164 -7.694 18.121 217 HG3 PRO 26 HG3 PRO 26 101.661 -8.377 16.549 218 HD2 PRO 26 HD3 PRO 26 101.372 -5.507 17.371 219 HD3 PRO 26 HD2 PRO 26 102.462 -6.235 16.153 220 H VAL 27 H VAL 27 97.812 -6.850 13.407 221 HA VAL 27 HA VAL 27 96.034 -4.796 14.054 222 HB VAL 27 HB VAL 27 95.585 -7.482 12.716 223 HG11 VAL 27 HG11 VAL 27 93.366 -6.296 11.950 224 HG12 VAL 27 HG12 VAL 27 93.405 -7.125 13.525 225 HG13 VAL 27 HG13 VAL 27 93.561 -5.354 13.448 226 HG21 VAL 27 HG21 VAL 27 95.351 -6.026 10.721 227 HG22 VAL 27 HG22 VAL 27 95.564 -4.588 11.747 228 HG23 VAL 27 HG23 VAL 27 96.904 -5.742 11.543 229 HA PRO 28 HA PRO 28 94.731 -6.215 18.180 230 HB2 PRO 28 HB2 PRO 28 92.766 -3.995 17.622 231 HB3 PRO 28 HB3 PRO 28 93.741 -4.312 19.086 232 HG2 PRO 28 HG2 PRO 28 94.401 -2.390 17.333 233 HG3 PRO 28 HG3 PRO 28 95.630 -3.348 18.204 234 HD2 PRO 28 HD2 PRO 28 94.818 -3.475 15.321 235 HD3 PRO 28 HD3 PRO 28 96.380 -3.891 16.089 236 H THR 29 H THR 29 93.147 -7.672 18.763 237 HA THR 29 HA THR 29 91.398 -8.760 16.741 238 HB THR 29 HB THR 29 90.913 -8.974 19.733 239 HG1 THR 29 HG1 THR 29 92.484 -10.676 19.638 240 HG21 THR 29 HG21 THR 29 90.203 -11.261 19.097 241 HG22 THR 29 HG22 THR 29 89.278 -10.031 18.202 242 HG23 THR 29 HG23 THR 29 90.599 -10.911 17.397 243 H ASN 30 H ASN 30 91.033 -6.095 18.991 244 HA ASN 30 HA ASN 30 88.234 -5.896 19.260 245 HB2 ASN 30 HB2 ASN 30 90.100 -4.288 20.084 246 HB3 ASN 30 HB3 ASN 30 89.925 -3.491 18.502 247 HD21 ASN 30 HD21 ASN 30 86.898 -4.618 18.882 248 HD22 ASN 30 HD22 ASN 30 86.177 -3.308 19.790 249 H LEU 31 H LEU 31 90.245 -4.859 16.474 250 HA LEU 31 HA LEU 31 87.726 -4.303 14.945 251 HB2 LEU 31 HB2 LEU 31 90.436 -4.059 13.683 252 HB3 LEU 31 HB3 LEU 31 89.015 -2.997 13.541 253 HG LEU 31 HG LEU 31 90.822 -3.234 15.989 254 HD11 LEU 31 HD11 LEU 31 91.890 -2.068 14.078 255 HD12 LEU 31 HD12 LEU 31 91.498 -0.926 15.386 256 HD13 LEU 31 HD13 LEU 31 90.470 -1.004 13.935 257 HD21 LEU 31 HD21 LEU 31 89.406 -0.992 16.411 258 HD22 LEU 31 HD22 LEU 31 88.214 -1.856 15.411 259 HD23 LEU 31 HD23 LEU 31 88.801 -2.586 16.924 260 H TYR 32 H TYR 32 90.783 -6.143 14.489 261 HA TYR 32 HA TYR 32 91.179 -7.991 13.047 262 HB2 TYR 32 HB3 TYR 32 89.799 -8.810 15.139 263 HB3 TYR 32 HB2 TYR 32 88.487 -9.025 13.955 264 HD1 TYR 32 HD1 TYR 32 91.872 -10.121 14.968 265 HD2 TYR 32 HD2 TYR 32 88.649 -10.687 12.185 266 HE1 TYR 32 HE1 TYR 32 92.901 -12.245 14.209 267 HE2 TYR 32 HE2 TYR 32 89.680 -12.811 11.426 268 HH TYR 32 HH TYR 32 91.998 -14.454 13.092 269 H GLY 33 H GLY 33 90.930 -6.880 11.014 270 HA2 GLY 33 HA2 GLY 33 89.795 -7.701 8.864 271 HA3 GLY 33 HA3 GLY 33 88.252 -7.419 9.702 272 H ASP 34 H ASP 34 89.258 -4.938 11.019 273 HA ASP 34 HA ASP 34 88.638 -3.126 8.763 274 HB2 ASP 34 HB2 ASP 34 89.574 -2.242 11.507 275 HB3 ASP 34 HB3 ASP 34 88.449 -1.426 10.395 276 H PHE 35 H PHE 35 90.070 -1.820 7.662 277 HA PHE 35 HA PHE 35 92.922 -1.779 8.646 278 HB2 PHE 35 HB3 PHE 35 92.112 -2.272 5.748 279 HB3 PHE 35 HB2 PHE 35 93.762 -2.268 6.417 280 HD1 PHE 35 HD1 PHE 35 94.296 -3.985 8.272 281 HD2 PHE 35 HD2 PHE 35 90.845 -4.256 5.728 282 HE1 PHE 35 HE1 PHE 35 94.078 -6.390 8.826 283 HE2 PHE 35 HE2 PHE 35 90.625 -6.663 6.283 284 HZ PHE 35 HZ PHE 35 92.243 -7.732 7.831 285 H PHE 36 H PHE 36 94.182 0.002 7.653 286 HA PHE 36 HA PHE 36 92.344 2.310 7.010 287 HB2 PHE 36 HB3 PHE 36 95.262 2.666 7.665 288 HB3 PHE 36 HB2 PHE 36 93.880 3.723 8.039 289 HD1 PHE 36 HD1 PHE 36 96.194 2.325 9.831 290 HD2 PHE 36 HD2 PHE 36 92.002 1.657 9.176 291 HE1 PHE 36 HE1 PHE 36 96.010 1.284 12.074 292 HE2 PHE 36 HE2 PHE 36 91.817 0.619 11.420 293 HZ PHE 36 HZ PHE 36 93.821 0.432 12.870 294 H THR 37 H THR 37 92.134 2.416 4.806 295 HA THR 37 HA THR 37 94.087 1.495 2.920 296 HB THR 37 HB THR 37 92.824 2.685 1.251 297 HG1 THR 37 HG1 THR 37 91.593 4.175 3.343 298 HG21 THR 37 HG21 THR 37 90.495 2.087 1.856 299 HG22 THR 37 HG22 THR 37 90.978 1.939 3.563 300 HG23 THR 37 HG23 THR 37 91.633 0.811 2.352 301 H GLY 38 H GLY 38 96.133 2.234 3.680 302 HA2 GLY 38 HA2 GLY 38 97.075 4.651 2.434 303 HA3 GLY 38 HA3 GLY 38 96.797 4.991 4.160 304 H ASP 39 H ASP 39 97.389 2.192 4.941 305 HA ASP 39 HA ASP 39 100.393 2.334 4.600 306 HB2 ASP 39 HB2 ASP 39 98.833 0.933 6.811 307 HB3 ASP 39 HB3 ASP 39 100.579 1.274 6.765 308 H ALA 40 H ALA 40 100.703 -0.355 5.748 309 HA ALA 40 HA ALA 40 99.384 -2.031 3.616 310 HB1 ALA 40 HB1 ALA 40 101.542 -3.169 3.184 311 HB2 ALA 40 HB2 ALA 40 102.354 -2.059 4.314 312 HB3 ALA 40 HB3 ALA 40 101.646 -1.433 2.805 313 H TYR 41 H TYR 41 98.985 -4.175 4.246 314 HA TYR 41 HA TYR 41 99.671 -4.778 7.136 315 HB2 TYR 41 HB2 TYR 41 97.167 -5.513 5.554 316 HB3 TYR 41 HB3 TYR 41 97.526 -6.058 7.210 317 HD1 TYR 41 HD1 TYR 41 97.090 -4.655 9.073 318 HD2 TYR 41 HD2 TYR 41 97.002 -3.012 5.105 319 HE1 TYR 41 HE1 TYR 41 96.156 -2.540 9.969 320 HE2 TYR 41 HE2 TYR 41 96.071 -0.894 6.002 321 HH TYR 41 HH TYR 41 96.074 -0.102 9.280 322 H VAL 42 H VAL 42 100.844 -6.614 7.412 323 HA VAL 42 HA VAL 42 101.230 -8.371 5.014 324 HB VAL 42 HB VAL 42 102.607 -8.440 7.735 325 HG11 VAL 42 HG11 VAL 42 102.742 -10.549 6.442 326 HG12 VAL 42 HG12 VAL 42 104.324 -9.736 6.500 327 HG13 VAL 42 HG13 VAL 42 103.330 -9.645 5.026 328 HG21 VAL 42 HG21 VAL 42 102.957 -6.278 6.571 329 HG22 VAL 42 HG22 VAL 42 103.462 -7.151 5.105 330 HG23 VAL 42 HG23 VAL 42 104.450 -7.248 6.583 331 H ILE 43 H ILE 43 99.555 -9.819 4.856 332 HA ILE 43 HA ILE 43 98.926 -11.406 7.362 333 HB ILE 43 HB ILE 43 96.889 -11.461 5.226 334 HG12 ILE 43 HG13 ILE 43 97.478 -8.843 6.673 335 HG13 ILE 43 HG12 ILE 43 97.711 -9.138 4.933 336 HG21 ILE 43 HG21 ILE 43 96.927 -12.108 7.831 337 HG22 ILE 43 HG22 ILE 43 95.441 -11.546 7.028 338 HG23 ILE 43 HG23 ILE 43 96.412 -10.412 7.998 339 HD11 ILE 43 HD11 ILE 43 95.584 -8.221 4.872 340 HD12 ILE 43 HD12 ILE 43 95.151 -9.930 5.114 341 HD13 ILE 43 HD13 ILE 43 95.168 -8.812 6.498 342 H LEU 44 H LEU 44 98.820 -13.657 7.121 343 HA LEU 44 HA LEU 44 99.131 -14.750 4.353 344 HB2 LEU 44 HB2 LEU 44 101.167 -15.895 4.750 345 HB3 LEU 44 HB3 LEU 44 101.446 -14.257 5.386 346 HG LEU 44 HG LEU 44 100.690 -16.730 7.000 347 HD11 LEU 44 HD11 LEU 44 103.175 -14.983 7.173 348 HD12 LEU 44 HD12 LEU 44 103.090 -16.422 6.129 349 HD13 LEU 44 HD13 LEU 44 102.910 -16.590 7.892 350 HD21 LEU 44 HD21 LEU 44 101.182 -15.040 8.921 351 HD22 LEU 44 HD22 LEU 44 100.909 -13.786 7.688 352 HD23 LEU 44 HD23 LEU 44 99.609 -14.932 8.095 353 H LYS 45 H LYS 45 99.202 -17.288 4.505 354 HA LYS 45 HA LYS 45 97.675 -18.233 6.907 355 HB2 LYS 45 HB2 LYS 45 95.923 -17.502 5.367 356 HB3 LYS 45 HB3 LYS 45 96.654 -18.440 4.043 357 HG2 LYS 45 HG2 LYS 45 96.221 -20.533 5.214 358 HG3 LYS 45 HG3 LYS 45 95.657 -19.657 6.656 359 HD2 LYS 45 HD2 LYS 45 93.691 -20.368 5.445 360 HD3 LYS 45 HD3 LYS 45 93.855 -18.614 5.189 361 HE2 LYS 45 HE3 LYS 45 94.664 -18.892 2.980 362 HE3 LYS 45 HE2 LYS 45 95.081 -20.601 3.252 363 HZ1 LYS 45 HZ1 LYS 45 93.054 -20.372 1.979 364 HZ2 LYS 45 HZ2 LYS 45 92.345 -19.494 3.182 365 HZ3 LYS 45 HZ3 LYS 45 92.731 -21.078 3.435 366 H THR 46 H THR 46 99.244 -19.712 7.492 367 HA THR 46 HA THR 46 100.543 -21.494 5.558 368 HB THR 46 HB THR 46 100.471 -21.141 8.530 369 HG1 THR 46 HG1 THR 46 102.784 -21.998 7.479 370 HG21 THR 46 HG21 THR 46 101.738 -23.373 8.738 371 HG22 THR 46 HG22 THR 46 101.041 -23.793 7.155 372 HG23 THR 46 HG23 THR 46 99.972 -23.481 8.543 373 H VAL 47 H VAL 47 99.544 -23.153 4.563 374 HA VAL 47 HA VAL 47 97.149 -24.380 5.925 375 HB VAL 47 HB VAL 47 97.763 -25.132 3.125 376 HG11 VAL 47 HG11 VAL 47 95.660 -25.725 4.300 377 HG12 VAL 47 HG12 VAL 47 95.303 -23.997 4.530 378 HG13 VAL 47 HG13 VAL 47 95.338 -24.687 2.890 379 HG21 VAL 47 HG21 VAL 47 96.839 -22.897 2.300 380 HG22 VAL 47 HG22 VAL 47 98.506 -22.850 2.922 381 HG23 VAL 47 HG23 VAL 47 97.163 -22.257 3.929 382 H GLN 48 H GLN 48 96.914 -26.766 5.573 383 HA GLN 48 HA GLN 48 99.624 -28.114 5.465 384 HB2 GLN 48 HB2 GLN 48 98.686 -27.931 7.809 385 HB3 GLN 48 HB3 GLN 48 97.298 -28.907 7.270 386 HG2 GLN 48 HG3 GLN 48 98.627 -30.823 6.906 387 HG3 GLN 48 HG2 GLN 48 100.132 -29.877 6.817 388 HE21 GLN 48 HE21 GLN 48 101.248 -30.926 8.560 389 HE22 GLN 48 HE22 GLN 48 100.687 -30.837 10.214 390 H LEU 49 H LEU 49 99.683 -29.542 3.810 391 HA LEU 49 HA LEU 49 97.386 -30.208 2.219 392 HB2 LEU 49 HB2 LEU 49 99.988 -31.764 2.572 393 HB3 LEU 49 HB3 LEU 49 98.832 -31.966 1.234 394 HG LEU 49 HG LEU 49 100.229 -29.341 1.915 395 HD11 LEU 49 HD11 LEU 49 101.842 -31.057 1.137 396 HD12 LEU 49 HD12 LEU 49 101.602 -29.799 -0.099 397 HD13 LEU 49 HD13 LEU 49 100.811 -31.384 -0.277 398 HD21 LEU 49 HD21 LEU 49 98.044 -29.122 0.759 399 HD22 LEU 49 HD22 LEU 49 98.596 -30.255 -0.497 400 HD23 LEU 49 HD23 LEU 49 99.386 -28.670 -0.320 401 H ARG 50 H ARG 50 99.114 -32.998 3.448 402 HA ARG 50 HA ARG 50 96.717 -33.763 5.099 403 HB2 ARG 50 HB2 ARG 50 96.780 -36.050 4.032 404 HB3 ARG 50 HB3 ARG 50 96.266 -34.755 2.924 405 HG2 ARG 50 HG2 ARG 50 98.536 -34.621 1.985 406 HG3 ARG 50 HG3 ARG 50 99.106 -35.851 3.137 407 HD2 ARG 50 HD3 ARG 50 98.634 -36.879 0.941 408 HD3 ARG 50 HD2 ARG 50 97.497 -37.485 2.169 409 HE ARG 50 HE ARG 50 96.436 -35.140 0.755 410 HH11 ARG 50 HH11 ARG 50 94.721 -35.560 -0.656 411 HH12 ARG 50 HH12 ARG 50 94.395 -37.200 -1.173 412 HH21 ARG 50 HH21 ARG 50 97.015 -38.572 0.665 413 HH22 ARG 50 HH22 ARG 50 95.688 -38.898 -0.428 414 H ASN 51 H ASN 51 100.088 -34.316 4.136 415 HA ASN 51 HA ASN 51 100.913 -34.814 6.867 416 HB2 ASN 51 HB2 ASN 51 99.747 -36.959 6.594 417 HB3 ASN 51 HB3 ASN 51 100.624 -37.270 5.077 418 HD21 ASN 51 HD21 ASN 51 101.406 -36.388 8.524 419 HD22 ASN 51 HD22 ASN 51 102.779 -37.467 8.626 420 H GLY 52 H GLY 52 101.659 -33.336 4.418 421 HA2 GLY 52 HA2 GLY 52 104.405 -34.542 3.988 422 HA3 GLY 52 HA3 GLY 52 103.555 -33.568 2.764 423 H ASN 53 H ASN 53 103.217 -31.265 3.230 424 HA ASN 53 HA ASN 53 104.917 -30.191 5.468 425 HB2 ASN 53 HB2 ASN 53 105.139 -28.950 2.720 426 HB3 ASN 53 HB3 ASN 53 106.280 -28.875 4.084 427 HD21 ASN 53 HD21 ASN 53 107.331 -31.074 4.681 428 HD22 ASN 53 HD22 ASN 53 107.700 -32.152 3.354 429 H LEU 54 H LEU 54 104.729 -27.497 4.865 430 HA LEU 54 HA LEU 54 101.740 -27.061 4.652 431 HB2 LEU 54 HB2 LEU 54 103.367 -25.217 6.361 432 HB3 LEU 54 HB3 LEU 54 101.699 -25.797 6.581 433 HG LEU 54 HG LEU 54 102.963 -28.143 6.919 434 HD11 LEU 54 HD11 LEU 54 105.213 -27.188 6.485 435 HD12 LEU 54 HD12 LEU 54 105.085 -27.794 8.153 436 HD13 LEU 54 HD13 LEU 54 104.986 -26.047 7.831 437 HD21 LEU 54 HD21 LEU 54 101.468 -27.019 8.551 438 HD22 LEU 54 HD22 LEU 54 102.804 -25.948 9.035 439 HD23 LEU 54 HD23 LEU 54 102.903 -27.696 9.358 440 H GLN 55 H GLN 55 101.161 -24.854 3.916 441 HA GLN 55 HA GLN 55 103.424 -23.579 2.356 442 HB2 GLN 55 HB2 GLN 55 101.844 -24.878 0.896 443 HB3 GLN 55 HB3 GLN 55 100.518 -23.836 1.465 444 HG2 GLN 55 HG3 GLN 55 101.445 -21.903 0.445 445 HG3 GLN 55 HG2 GLN 55 103.047 -22.659 0.267 446 HE21 GLN 55 HE21 GLN 55 99.961 -22.147 -1.271 447 HE22 GLN 55 HE22 GLN 55 100.254 -23.164 -2.664 448 H TYR 56 H TYR 56 103.798 -21.617 3.242 449 HA TYR 56 HA TYR 56 101.633 -20.182 4.691 450 HB2 TYR 56 HB2 TYR 56 104.556 -20.093 4.520 451 HB3 TYR 56 HB3 TYR 56 103.857 -18.464 4.369 452 HD1 TYR 56 HD1 TYR 56 105.253 -20.475 6.706 453 HD2 TYR 56 HD2 TYR 56 101.540 -18.425 6.032 454 HE1 TYR 56 HE1 TYR 56 104.830 -20.436 9.150 455 HE2 TYR 56 HE2 TYR 56 101.117 -18.384 8.476 456 HH TYR 56 HH TYR 56 103.055 -18.571 10.702 457 H ASP 57 H ASP 57 100.126 -19.168 3.423 458 HA ASP 57 HA ASP 57 100.961 -18.041 0.787 459 HB2 ASP 57 HB3 ASP 57 98.318 -18.264 2.278 460 HB3 ASP 57 HB2 ASP 57 98.477 -17.295 0.793 461 H LEU 58 H LEU 58 102.188 -16.186 1.071 462 HA LEU 58 HA LEU 58 101.292 -14.253 3.187 463 HB2 LEU 58 HB2 LEU 58 103.751 -14.217 1.383 464 HB3 LEU 58 HB3 LEU 58 103.434 -13.115 2.744 465 HG LEU 58 HG LEU 58 103.120 -15.868 3.620 466 HD11 LEU 58 HD11 LEU 58 104.647 -16.630 1.969 467 HD12 LEU 58 HD12 LEU 58 105.664 -16.352 3.402 468 HD13 LEU 58 HD13 LEU 58 105.639 -15.157 2.083 469 HD21 LEU 58 HD21 LEU 58 105.132 -13.669 4.279 470 HD22 LEU 58 HD22 LEU 58 103.571 -13.940 5.088 471 HD23 LEU 58 HD23 LEU 58 104.874 -15.143 5.242 472 H HIS 59 H HIS 59 100.595 -12.179 2.737 473 HA HIS 59 HA HIS 59 100.637 -11.219 -0.078 474 HB2 HIS 59 HB2 HIS 59 98.031 -10.753 0.269 475 HB3 HIS 59 HB3 HIS 59 98.606 -12.293 -0.413 476 HD2 HIS 59 HD2 HIS 59 97.343 -10.932 3.104 477 HE1 HIS 59 HE1 HIS 59 97.024 -15.142 3.070 478 H TYR 60 H TYR 60 100.855 -9.027 -0.084 479 HA TYR 60 HA TYR 60 100.497 -7.663 2.575 480 HB2 TYR 60 HB3 TYR 60 101.576 -5.772 0.851 481 HB3 TYR 60 HB2 TYR 60 102.506 -6.807 1.958 482 HD1 TYR 60 HD1 TYR 60 102.338 -5.729 -1.332 483 HD2 TYR 60 HD2 TYR 60 102.784 -9.349 0.940 484 HE1 TYR 60 HE1 TYR 60 103.448 -6.808 -3.269 485 HE2 TYR 60 HE2 TYR 60 103.886 -10.428 -1.000 486 HH TYR 60 HH TYR 60 105.147 -8.798 -3.568 487 H TRP 61 H TRP 61 98.629 -6.597 2.908 488 HA TRP 61 HA TRP 61 96.878 -5.992 0.581 489 HB2 TRP 61 HB2 TRP 61 96.149 -6.893 2.915 490 HB3 TRP 61 HB3 TRP 61 96.333 -5.208 3.458 491 HD1 TRP 61 HD1 TRP 61 94.406 -7.298 0.845 492 HE1 TRP 61 HE1 TRP 61 92.220 -6.076 0.234 493 HE3 TRP 61 HE3 TRP 61 95.109 -2.993 3.502 494 HZ2 TRP 61 HZ2 TRP 61 90.957 -3.554 0.829 495 HZ3 TRP 61 HZ3 TRP 61 93.401 -1.198 3.460 496 HH2 TRP 61 HH2 TRP 61 91.328 -1.472 2.128 497 H LEU 62 H LEU 62 96.675 -4.046 -0.368 498 HA LEU 62 HA LEU 62 97.718 -1.631 1.122 499 HB2 LEU 62 HB2 LEU 62 98.000 -1.668 -1.854 500 HB3 LEU 62 HB3 LEU 62 99.084 -0.988 -0.617 501 HG LEU 62 HG LEU 62 98.746 -3.965 -1.196 502 HD11 LEU 62 HD11 LEU 62 100.003 -3.391 -3.025 503 HD12 LEU 62 HD12 LEU 62 100.516 -1.842 -2.313 504 HD13 LEU 62 HD13 LEU 62 101.328 -3.353 -1.838 505 HD21 LEU 62 HD21 LEU 62 101.185 -3.300 0.156 506 HD22 LEU 62 HD22 LEU 62 99.817 -4.256 0.773 507 HD23 LEU 62 HD23 LEU 62 99.858 -2.495 1.027 508 H GLY 63 H GLY 63 95.909 -0.414 1.468 509 HA2 GLY 63 HA3 GLY 63 93.481 -0.678 -0.080 510 HA3 GLY 63 HA2 GLY 63 93.860 0.677 1.009 511 H ASN 64 H ASN 64 96.221 0.107 -1.424 512 HA ASN 64 HA ASN 64 96.748 1.297 -3.396 513 HB2 ASN 64 HB2 ASN 64 94.203 0.608 -3.809 514 HB3 ASN 64 HB3 ASN 64 93.936 2.356 -3.613 515 HD21 ASN 64 HD21 ASN 64 96.806 2.823 -4.701 516 HD22 ASN 64 HD22 ASN 64 96.617 2.640 -6.431 517 H GLU 65 H GLU 65 95.820 2.637 -0.524 518 HA GLU 65 HA GLU 65 96.171 5.461 -1.549 519 HB2 GLU 65 HB2 GLU 65 94.711 4.217 0.741 520 HB3 GLU 65 HB3 GLU 65 95.529 5.759 1.088 521 HG2 GLU 65 HG3 GLU 65 94.350 6.870 -0.715 522 HG3 GLU 65 HG2 GLU 65 93.679 5.326 -1.295 523 H CYS 66 H CYS 66 98.102 3.053 -0.707 524 HA CYS 66 HA CYS 66 99.776 4.679 1.209 525 HB2 CYS 66 HB2 CYS 66 99.147 2.256 1.745 526 HB3 CYS 66 HB3 CYS 66 100.185 1.778 0.380 527 HG CYS 66 HG CYS 66 101.630 1.545 2.890 528 H SER 67 H SER 67 101.934 5.188 0.681 529 HA SER 67 HA SER 67 102.467 5.442 -2.196 530 HB2 SER 67 HB2 SER 67 103.277 7.129 -0.595 531 HB3 SER 67 HB3 SER 67 104.259 5.896 0.232 532 HG SER 67 HG SER 67 105.235 7.317 -1.551 533 H GLN 68 H GLN 68 104.582 4.623 -3.147 534 HA GLN 68 HA GLN 68 104.714 1.713 -2.707 535 HB2 GLN 68 HB2 GLN 68 104.996 2.676 -4.961 536 HB3 GLN 68 HB3 GLN 68 106.430 3.575 -4.412 537 HG2 GLN 68 HG3 GLN 68 107.718 1.612 -4.162 538 HG3 GLN 68 HG2 GLN 68 106.280 0.565 -4.094 539 HE21 GLN 68 HE21 GLN 68 106.594 -0.768 -5.923 540 HE22 GLN 68 HE22 GLN 68 106.776 -0.143 -7.547 541 H ASP 69 H ASP 69 106.137 4.388 -1.183 542 HA ASP 69 HA ASP 69 108.783 3.227 -0.676 543 HB2 ASP 69 HB3 ASP 69 107.170 5.498 0.515 544 HB3 ASP 69 HB2 ASP 69 108.694 4.973 1.269 545 H GLU 70 H GLU 70 105.740 3.456 1.232 546 HA GLU 70 HA GLU 70 106.949 1.723 3.337 547 HB2 GLU 70 HB3 GLU 70 105.310 3.677 3.752 548 HB3 GLU 70 HB2 GLU 70 104.042 2.590 3.134 549 HG2 GLU 70 HG2 GLU 70 104.621 0.915 4.853 550 HG3 GLU 70 HG3 GLU 70 105.923 1.968 5.456 551 H SER 71 H SER 71 104.543 1.533 0.731 552 HA SER 71 HA SER 71 103.482 -1.058 1.397 553 HB2 SER 71 HB2 SER 71 102.594 0.565 -0.344 554 HB3 SER 71 HB3 SER 71 103.929 0.051 -1.405 555 HG SER 71 HG SER 71 103.122 -2.112 -1.194 556 H GLY 72 H GLY 72 106.021 -0.238 -1.032 557 HA2 GLY 72 HA2 GLY 72 106.776 -2.931 -1.597 558 HA3 GLY 72 HA3 GLY 72 107.867 -1.532 -1.745 559 H ALA 73 H ALA 73 107.911 -0.721 0.981 560 HA ALA 73 HA ALA 73 110.016 -2.310 2.028 561 HB1 ALA 73 HB1 ALA 73 109.521 -1.238 4.210 562 HB2 ALA 73 HB2 ALA 73 109.432 -0.056 2.882 563 HB3 ALA 73 HB3 ALA 73 107.937 -0.712 3.592 564 H ALA 74 H ALA 74 106.514 -2.463 2.866 565 HA ALA 74 HA ALA 74 106.773 -4.671 4.692 566 HB1 ALA 74 HB1 ALA 74 104.421 -4.079 2.840 567 HB2 ALA 74 HB2 ALA 74 104.375 -4.995 4.365 568 HB3 ALA 74 HB3 ALA 74 104.714 -3.248 4.387 569 H ALA 75 H ALA 75 106.320 -4.558 1.155 570 HA ALA 75 HA ALA 75 106.076 -7.455 0.875 571 HB1 ALA 75 HB1 ALA 75 106.516 -7.021 -1.527 572 HB2 ALA 75 HB2 ALA 75 105.321 -5.871 -0.880 573 HB3 ALA 75 HB3 ALA 75 107.005 -5.354 -1.136 574 H ILE 76 H ILE 76 108.731 -5.277 1.398 575 HA ILE 76 HA ILE 76 110.774 -7.106 0.294 576 HB ILE 76 HB ILE 76 110.930 -4.644 2.083 577 HG12 ILE 76 HG12 ILE 76 110.259 -4.654 -0.492 578 HG13 ILE 76 HG13 ILE 76 111.400 -3.443 0.139 579 HG21 ILE 76 HG21 ILE 76 112.880 -5.867 2.645 580 HG22 ILE 76 HG22 ILE 76 113.066 -6.502 0.993 581 HG23 ILE 76 HG23 ILE 76 113.421 -4.791 1.335 582 HD11 ILE 76 HD11 ILE 76 112.063 -4.733 -2.026 583 HD12 ILE 76 HD12 ILE 76 113.282 -4.586 -0.738 584 HD13 ILE 76 HD13 ILE 76 112.378 -6.106 -0.938 585 H PHE 77 H PHE 77 109.812 -6.059 3.609 586 HA PHE 77 HA PHE 77 111.532 -8.037 4.892 587 HB2 PHE 77 HB2 PHE 77 109.757 -5.920 5.695 588 HB3 PHE 77 HB3 PHE 77 109.274 -7.397 6.561 589 HD1 PHE 77 HD1 PHE 77 111.676 -8.861 7.053 590 HD2 PHE 77 HD2 PHE 77 111.122 -4.602 7.047 591 HE1 PHE 77 HE1 PHE 77 113.620 -8.607 8.570 592 HE2 PHE 77 HE2 PHE 77 113.068 -4.347 8.563 593 HZ PHE 77 HZ PHE 77 114.317 -6.350 9.326 594 H THR 78 H THR 78 108.191 -8.023 3.712 595 HA THR 78 HA THR 78 107.504 -10.579 4.984 596 HB THR 78 HB THR 78 106.269 -8.954 2.725 597 HG1 THR 78 HG1 THR 78 106.016 -8.136 4.837 598 HG21 THR 78 HG21 THR 78 104.349 -10.517 2.861 599 HG22 THR 78 HG22 THR 78 105.828 -11.363 2.347 600 HG23 THR 78 HG23 THR 78 105.250 -11.521 4.023 601 H VAL 79 H VAL 79 108.786 -9.563 1.815 602 HA VAL 79 HA VAL 79 108.570 -12.267 0.675 603 HB VAL 79 HB VAL 79 110.098 -9.764 -0.140 604 HG11 VAL 79 HG11 VAL 79 111.346 -11.779 -0.869 605 HG12 VAL 79 HG12 VAL 79 109.860 -12.435 -1.596 606 HG13 VAL 79 HG13 VAL 79 110.594 -10.955 -2.256 607 HG21 VAL 79 HG21 VAL 79 107.912 -11.141 -1.701 608 HG22 VAL 79 HG22 VAL 79 108.360 -9.419 -1.663 609 HG23 VAL 79 HG23 VAL 79 107.473 -10.138 -0.297 610 H GLN 80 H GLN 80 111.364 -10.268 1.779 611 HA GLN 80 HA GLN 80 113.285 -12.407 1.525 612 HB2 GLN 80 HB2 GLN 80 113.221 -9.951 3.330 613 HB3 GLN 80 HB3 GLN 80 114.632 -11.025 3.171 614 HG2 GLN 80 HG3 GLN 80 114.834 -10.535 0.812 615 HG3 GLN 80 HG2 GLN 80 113.277 -9.672 0.801 616 HE21 GLN 80 HE21 GLN 80 115.064 -8.010 -0.146 617 HE22 GLN 80 HE22 GLN 80 115.725 -6.924 1.056 618 H LEU 81 H LEU 81 111.748 -11.132 4.545 619 HA LEU 81 HA LEU 81 112.703 -13.188 6.258 620 HB2 LEU 81 HB2 LEU 81 111.266 -11.074 6.798 621 HB3 LEU 81 HB3 LEU 81 109.870 -12.129 6.485 622 HG LEU 81 HG LEU 81 110.468 -12.087 8.899 623 HD11 LEU 81 HD11 LEU 81 110.223 -14.397 9.239 624 HD12 LEU 81 HD12 LEU 81 109.637 -14.198 7.570 625 HD13 LEU 81 HD13 LEU 81 111.281 -14.811 7.869 626 HD21 LEU 81 HD21 LEU 81 112.580 -12.602 9.721 627 HD22 LEU 81 HD22 LEU 81 112.992 -13.624 8.324 628 HD23 LEU 81 HD23 LEU 81 113.034 -11.851 8.173 629 H ASP 82 H ASP 82 109.694 -13.150 4.271 630 HA ASP 82 HA ASP 82 108.636 -15.644 5.021 631 HB2 ASP 82 HB2 ASP 82 107.403 -14.453 3.385 632 HB3 ASP 82 HB3 ASP 82 108.819 -14.267 2.323 633 H ASP 83 H ASP 83 111.238 -15.035 2.609 634 HA ASP 83 HA ASP 83 111.705 -17.819 2.037 635 HB2 ASP 83 HB3 ASP 83 112.692 -15.907 0.739 636 HB3 ASP 83 HB2 ASP 83 113.758 -15.559 2.122 637 H TYR 84 H TYR 84 112.658 -15.702 4.692 638 HA TYR 84 HA TYR 84 114.565 -17.639 5.822 639 HB2 TYR 84 HB2 TYR 84 114.837 -15.296 6.388 640 HB3 TYR 84 HB3 TYR 84 113.165 -15.200 6.993 641 HD1 TYR 84 HD1 TYR 84 112.520 -16.398 9.075 642 HD2 TYR 84 HD2 TYR 84 116.591 -16.277 7.714 643 HE1 TYR 84 HE1 TYR 84 113.291 -17.130 11.316 644 HE2 TYR 84 HE2 TYR 84 117.362 -17.009 9.954 645 HH TYR 84 HH TYR 84 116.389 -16.857 12.398 646 H LEU 85 H LEU 85 111.101 -17.135 5.892 647 HA LEU 85 HA LEU 85 110.703 -18.719 8.352 648 HB2 LEU 85 HB3 LEU 85 108.959 -17.459 6.256 649 HB3 LEU 85 HB2 LEU 85 108.272 -18.799 7.204 650 HG LEU 85 HG LEU 85 109.714 -16.505 8.565 651 HD11 LEU 85 HD11 LEU 85 107.935 -15.519 7.145 652 HD12 LEU 85 HD12 LEU 85 107.509 -15.419 8.871 653 HD13 LEU 85 HD13 LEU 85 106.754 -16.657 7.838 654 HD21 LEU 85 HD21 LEU 85 109.225 -18.566 9.857 655 HD22 LEU 85 HD22 LEU 85 107.506 -18.432 9.417 656 HD23 LEU 85 HD23 LEU 85 108.260 -17.193 10.450 657 H ASN 86 H ASN 86 110.112 -19.308 4.843 658 HA ASN 86 HA ASN 86 110.344 -22.260 5.498 659 HB2 ASN 86 HB2 ASN 86 108.607 -20.877 3.406 660 HB3 ASN 86 HB3 ASN 86 108.808 -22.639 3.550 661 HD21 ASN 86 HD21 ASN 86 108.359 -20.026 6.034 662 HD22 ASN 86 HD22 ASN 86 106.976 -20.790 6.785 663 H GLY 87 H GLY 87 110.865 -19.717 3.037 664 HA2 GLY 87 HA3 GLY 87 113.002 -19.609 1.822 665 HA3 GLY 87 HA2 GLY 87 113.190 -21.365 2.049 666 H ARG 88 H ARG 88 110.058 -21.273 1.361 667 HA ARG 88 HA ARG 88 110.286 -20.798 -1.579 668 HB2 ARG 88 HB3 ARG 88 109.209 -23.482 -0.738 669 HB3 ARG 88 HB2 ARG 88 109.965 -22.995 -2.274 670 HG2 ARG 88 HG2 ARG 88 112.167 -22.856 -1.159 671 HG3 ARG 88 HG3 ARG 88 111.420 -23.310 0.392 672 HD2 ARG 88 HD2 ARG 88 111.627 -24.998 -2.135 673 HD3 ARG 88 HD3 ARG 88 112.371 -25.321 -0.551 674 HE ARG 88 HE ARG 88 109.487 -25.129 -0.259 675 HH11 ARG 88 HH11 ARG 88 108.360 -27.070 -0.000 676 HH12 ARG 88 HH12 ARG 88 109.109 -28.584 -0.455 677 HH21 ARG 88 HH21 ARG 88 112.076 -27.094 -1.506 678 HH22 ARG 88 HH22 ARG 88 111.204 -28.598 -1.304 679 H ALA 89 H ALA 89 108.693 -19.991 0.991 680 HA ALA 89 HA ALA 89 105.976 -20.911 0.604 681 HB1 ALA 89 HB1 ALA 89 105.464 -19.464 2.308 682 HB2 ALA 89 HB2 ALA 89 107.233 -19.379 2.484 683 HB3 ALA 89 HB3 ALA 89 106.368 -18.119 1.573 684 H VAL 90 H VAL 90 104.240 -18.989 0.136 685 HA VAL 90 HA VAL 90 105.044 -17.895 -2.572 686 HB VAL 90 HB VAL 90 102.198 -18.417 -1.639 687 HG11 VAL 90 HG11 VAL 90 102.544 -16.966 -3.620 688 HG12 VAL 90 HG12 VAL 90 101.799 -18.514 -4.084 689 HG13 VAL 90 HG13 VAL 90 103.532 -18.237 -4.379 690 HG21 VAL 90 HG21 VAL 90 102.562 -20.537 -3.169 691 HG22 VAL 90 HG22 VAL 90 104.276 -20.316 -2.745 692 HG23 VAL 90 HG23 VAL 90 103.070 -20.591 -1.464 693 H GLN 91 H GLN 91 104.488 -15.733 -3.051 694 HA GLN 91 HA GLN 91 103.227 -14.173 -0.796 695 HB2 GLN 91 HB3 GLN 91 104.992 -12.347 -1.449 696 HB3 GLN 91 HB2 GLN 91 105.502 -13.688 -0.396 697 HG2 GLN 91 HG2 GLN 91 105.737 -14.000 -3.388 698 HG3 GLN 91 HG3 GLN 91 106.952 -13.031 -2.521 699 HE21 GLN 91 HE21 GLN 91 105.614 -15.430 -0.462 700 HE22 GLN 91 HE22 GLN 91 106.887 -16.618 -0.635 701 H HIS 92 H HIS 92 101.613 -12.889 -1.571 702 HA HIS 92 HA HIS 92 101.789 -12.105 -4.486 703 HB2 HIS 92 HB3 HIS 92 99.089 -12.120 -4.026 704 HB3 HIS 92 HB2 HIS 92 99.989 -13.476 -4.741 705 HD2 HIS 92 HD2 HIS 92 101.217 -14.928 -2.092 706 HE1 HIS 92 HE1 HIS 92 97.280 -14.824 -0.565 707 H ARG 93 H ARG 93 100.569 -10.113 -5.017 708 HA ARG 93 HA ARG 93 100.602 -8.236 -2.643 709 HB2 ARG 93 HB2 ARG 93 101.331 -6.517 -4.079 710 HB3 ARG 93 HB3 ARG 93 102.196 -7.940 -4.708 711 HG2 ARG 93 HG2 ARG 93 100.133 -8.240 -6.271 712 HG3 ARG 93 HG3 ARG 93 99.741 -6.559 -5.838 713 HD2 ARG 93 HD2 ARG 93 101.971 -7.634 -7.506 714 HD3 ARG 93 HD3 ARG 93 101.103 -6.084 -7.624 715 HE ARG 93 HE ARG 93 102.525 -5.701 -5.311 716 HH11 ARG 93 HH11 ARG 93 104.687 -5.047 -5.215 717 HH12 ARG 93 HH12 ARG 93 105.767 -5.404 -6.544 718 HH21 ARG 93 HH21 ARG 93 103.333 -7.029 -8.427 719 HH22 ARG 93 HH22 ARG 93 105.005 -6.520 -8.353 720 H GLU 94 H GLU 94 98.773 -7.074 -2.173 721 HA GLU 94 HA GLU 94 96.446 -7.427 -4.085 722 HB2 GLU 94 HB2 GLU 94 95.857 -6.782 -1.240 723 HB3 GLU 94 HB3 GLU 94 95.064 -7.941 -2.333 724 HG2 GLU 94 HG2 GLU 94 97.706 -8.321 -0.858 725 HG3 GLU 94 HG3 GLU 94 96.181 -9.192 -0.566 726 H VAL 95 H VAL 95 96.487 -5.488 -5.187 727 HA VAL 95 HA VAL 95 96.980 -2.963 -3.671 728 HB VAL 95 HB VAL 95 97.896 -3.417 -6.004 729 HG11 VAL 95 HG11 VAL 95 95.864 -4.520 -6.906 730 HG12 VAL 95 HG12 VAL 95 96.320 -3.110 -7.892 731 HG13 VAL 95 HG13 VAL 95 94.965 -2.993 -6.744 732 HG21 VAL 95 HG21 VAL 95 97.718 -1.128 -5.066 733 HG22 VAL 95 HG22 VAL 95 97.402 -1.129 -6.818 734 HG23 VAL 95 HG23 VAL 95 96.047 -1.012 -5.670 735 H GLN 96 H GLN 96 94.620 -4.446 -2.911 736 HA GLN 96 HA GLN 96 92.318 -4.050 -2.546 737 HB2 GLN 96 HB2 GLN 96 93.486 -1.710 -2.079 738 HB3 GLN 96 HB3 GLN 96 92.640 -1.231 -3.570 739 HG2 GLN 96 HG2 GLN 96 90.550 -2.349 -2.442 740 HG3 GLN 96 HG3 GLN 96 91.479 -2.168 -0.935 741 HE21 GLN 96 HE21 GLN 96 89.953 -0.520 -0.143 742 HE22 GLN 96 HE22 GLN 96 89.969 1.094 -0.817 743 H GLY 97 H GLY 97 92.318 -5.462 -4.659 744 HA2 GLY 97 HA2 GLY 97 90.151 -4.812 -6.275 745 HA3 GLY 97 HA3 GLY 97 91.510 -4.021 -7.109 746 H PHE 98 H PHE 98 93.567 -5.646 -7.102 747 HA PHE 98 HA PHE 98 92.524 -8.077 -8.508 748 HB2 PHE 98 HB2 PHE 98 94.572 -6.347 -9.110 749 HB3 PHE 98 HB3 PHE 98 95.462 -7.650 -8.287 750 HD1 PHE 98 HD1 PHE 98 95.399 -9.960 -9.166 751 HD2 PHE 98 HD2 PHE 98 93.462 -6.727 -11.229 752 HE1 PHE 98 HE1 PHE 98 95.223 -11.364 -11.202 753 HE2 PHE 98 HE2 PHE 98 93.290 -8.131 -13.266 754 HZ PHE 98 HZ PHE 98 94.168 -10.450 -13.253 755 H GLU 99 H GLU 99 92.318 -7.876 -5.580 756 HA GLU 99 HA GLU 99 94.460 -9.497 -4.405 757 HB2 GLU 99 HB2 GLU 99 91.685 -9.434 -3.236 758 HB3 GLU 99 HB3 GLU 99 93.262 -9.313 -2.418 759 HG2 GLU 99 HG2 GLU 99 93.492 -7.054 -3.727 760 HG3 GLU 99 HG3 GLU 99 91.728 -7.179 -3.924 761 H SER 100 H SER 100 92.727 -11.367 -2.962 762 HA SER 100 HA SER 100 91.789 -13.148 -5.208 763 HB2 SER 100 HB3 SER 100 93.183 -14.905 -4.649 764 HB3 SER 100 HB2 SER 100 94.244 -13.558 -4.171 765 HG SER 100 HG SER 100 93.232 -15.483 -2.620 766 H ALA 101 H ALA 101 90.298 -14.829 -4.466 767 HA ALA 101 HA ALA 101 88.358 -13.888 -2.595 768 HB1 ALA 101 HB1 ALA 101 87.464 -16.201 -2.636 769 HB2 ALA 101 HB2 ALA 101 88.974 -16.771 -3.385 770 HB3 ALA 101 HB3 ALA 101 87.906 -15.656 -4.272 771 H THR 102 H THR 102 91.412 -15.474 -2.052 772 HA THR 102 HA THR 102 90.853 -16.662 0.518 773 HB THR 102 HB THR 102 93.480 -15.334 -0.258 774 HG1 THR 102 HG1 THR 102 93.752 -17.686 -1.057 775 HG21 THR 102 HG21 THR 102 94.418 -17.212 1.061 776 HG22 THR 102 HG22 THR 102 92.773 -17.819 1.366 777 HG23 THR 102 HG23 THR 102 93.281 -16.250 2.036 778 H PHE 103 H PHE 103 92.470 -13.526 -0.187 779 HA PHE 103 HA PHE 103 92.301 -12.566 2.525 780 HB2 PHE 103 HB3 PHE 103 93.793 -11.495 0.937 781 HB3 PHE 103 HB2 PHE 103 92.433 -11.085 -0.136 782 HD1 PHE 103 HD1 PHE 103 91.317 -9.035 0.121 783 HD2 PHE 103 HD2 PHE 103 93.698 -10.553 3.358 784 HE1 PHE 103 HE1 PHE 103 90.976 -6.917 1.363 785 HE2 PHE 103 HE2 PHE 103 93.355 -8.433 4.603 786 HZ PHE 103 HZ PHE 103 91.991 -6.617 3.605 787 H LEU 104 H LEU 104 90.174 -11.912 -0.314 788 HA LEU 104 HA LEU 104 88.275 -10.375 1.292 789 HB2 LEU 104 HB2 LEU 104 88.023 -11.763 -1.411 790 HB3 LEU 104 HB3 LEU 104 86.757 -10.731 -0.703 791 HG LEU 104 HG LEU 104 89.628 -9.851 -1.248 792 HD11 LEU 104 HD11 LEU 104 88.618 -8.508 -3.071 793 HD12 LEU 104 HD12 LEU 104 88.346 -10.247 -3.332 794 HD13 LEU 104 HD13 LEU 104 87.027 -9.223 -2.716 795 HD21 LEU 104 HD21 LEU 104 88.532 -8.680 0.647 796 HD22 LEU 104 HD22 LEU 104 87.136 -8.306 -0.393 797 HD23 LEU 104 HD23 LEU 104 88.728 -7.593 -0.749 798 H GLY 105 H GLY 105 88.891 -13.752 0.845 799 HA2 GLY 105 HA3 GLY 105 86.190 -14.704 1.428 800 HA3 GLY 105 HA2 GLY 105 87.687 -15.658 1.578 801 H TYR 106 H TYR 106 89.093 -14.020 3.406 802 HA TYR 106 HA TYR 106 87.813 -14.855 5.905 803 HB2 TYR 106 HB2 TYR 106 90.290 -13.283 5.165 804 HB3 TYR 106 HB3 TYR 106 89.733 -13.318 6.855 805 HD1 TYR 106 HD1 TYR 106 90.052 -15.782 4.019 806 HD2 TYR 106 HD2 TYR 106 90.750 -14.935 8.171 807 HE1 TYR 106 HE1 TYR 106 91.068 -18.026 4.307 808 HE2 TYR 106 HE2 TYR 106 91.760 -17.180 8.460 809 HH TYR 106 HH TYR 106 91.550 -19.490 7.220 810 H PHE 107 H PHE 107 88.338 -11.713 4.262 811 HA PHE 107 HA PHE 107 86.476 -10.478 6.298 812 HB2 PHE 107 HB2 PHE 107 88.210 -8.995 4.288 813 HB3 PHE 107 HB3 PHE 107 87.469 -8.367 5.780 814 HD1 PHE 107 HD1 PHE 107 88.172 -9.641 7.996 815 HD2 PHE 107 HD2 PHE 107 90.442 -9.668 4.349 816 HE1 PHE 107 HE1 PHE 107 90.207 -10.262 9.268 817 HE2 PHE 107 HE2 PHE 107 92.478 -10.290 5.621 818 HZ PHE 107 HZ PHE 107 92.361 -10.586 8.082 819 H LYS 108 H LYS 108 85.089 -11.998 4.570 820 HA LYS 108 HA LYS 108 84.382 -10.463 2.136 821 HB2 LYS 108 HB2 LYS 108 84.246 -12.875 2.004 822 HB3 LYS 108 HB3 LYS 108 83.214 -12.951 3.452 823 HG2 LYS 108 HG2 LYS 108 81.346 -12.068 2.325 824 HG3 LYS 108 HG3 LYS 108 82.343 -11.329 1.049 825 HD2 LYS 108 HD3 LYS 108 82.678 -13.376 -0.055 826 HD3 LYS 108 HD2 LYS 108 82.318 -14.333 1.402 827 HE2 LYS 108 HE2 LYS 108 80.292 -12.666 -0.157 828 HE3 LYS 108 HE3 LYS 108 80.458 -14.436 -0.250 829 HZ1 LYS 108 HZ1 LYS 108 78.746 -13.782 1.307 830 HZ2 LYS 108 HZ2 LYS 108 79.823 -12.898 2.188 831 HZ3 LYS 108 HZ3 LYS 108 79.977 -14.538 2.103 832 H SER 109 H SER 109 83.095 -10.958 5.405 833 HA SER 109 HA SER 109 80.487 -9.818 4.961 834 HB2 SER 109 HB2 SER 109 81.191 -11.016 7.042 835 HB3 SER 109 HB3 SER 109 82.219 -9.625 7.465 836 HG SER 109 HG SER 109 80.118 -9.509 8.442 837 H GLY 110 H GLY 110 83.362 -8.391 4.276 838 HA2 GLY 110 HA3 GLY 110 83.485 -6.073 3.529 839 HA3 GLY 110 HA2 GLY 110 82.143 -5.665 4.625 840 H LEU 111 H LEU 111 85.523 -5.612 4.224 841 HA LEU 111 HA LEU 111 86.262 -5.801 7.053 842 HB2 LEU 111 HB3 LEU 111 88.263 -4.296 5.866 843 HB3 LEU 111 HB2 LEU 111 88.216 -6.073 5.921 844 HG LEU 111 HG LEU 111 86.965 -6.071 3.748 845 HD11 LEU 111 HD11 LEU 111 86.880 -3.969 2.442 846 HD12 LEU 111 HD12 LEU 111 87.596 -3.084 3.810 847 HD13 LEU 111 HD13 LEU 111 85.975 -3.801 3.965 848 HD21 LEU 111 HD21 LEU 111 89.434 -6.314 3.803 849 HD22 LEU 111 HD22 LEU 111 89.609 -4.544 3.732 850 HD23 LEU 111 HD23 LEU 111 88.911 -5.426 2.352 851 H LYS 112 H LYS 112 87.407 -2.915 5.490 852 HA LYS 112 HA LYS 112 85.500 -0.962 6.121 853 HB2 LYS 112 HB2 LYS 112 86.586 -2.192 8.553 854 HB3 LYS 112 HB3 LYS 112 86.900 -0.441 8.505 855 HG2 LYS 112 HG2 LYS 112 84.613 0.098 8.429 856 HG3 LYS 112 HG3 LYS 112 84.155 -1.502 7.798 857 HD2 LYS 112 HD2 LYS 112 84.716 -2.536 9.970 858 HD3 LYS 112 HD3 LYS 112 85.223 -0.952 10.605 859 HE2 LYS 112 HE2 LYS 112 82.433 -1.486 9.509 860 HE3 LYS 112 HE3 LYS 112 82.852 -1.671 11.229 861 HZ1 LYS 112 HZ1 LYS 112 81.985 0.522 10.754 862 HZ2 LYS 112 HZ2 LYS 112 83.170 0.798 9.641 863 HZ3 LYS 112 HZ3 LYS 112 83.559 0.628 11.235 864 H TYR 113 H TYR 113 86.327 1.008 5.510 865 HA TYR 113 HA TYR 113 89.339 1.135 5.232 866 HB2 TYR 113 HB2 TYR 113 88.487 3.105 3.587 867 HB3 TYR 113 HB3 TYR 113 88.639 1.415 3.048 868 HD1 TYR 113 HD1 TYR 113 86.294 4.075 4.080 869 HD2 TYR 113 HD2 TYR 113 86.664 0.003 2.767 870 HE1 TYR 113 HE1 TYR 113 83.859 4.003 3.621 871 HE2 TYR 113 HE2 TYR 113 84.229 -0.071 2.308 872 HH TYR 113 HH TYR 113 82.125 1.235 3.214 873 H LYS 114 H LYS 114 90.110 2.271 6.964 874 HA LYS 114 HA LYS 114 88.578 4.765 7.743 875 HB2 LYS 114 HB2 LYS 114 89.022 2.747 9.412 876 HB3 LYS 114 HB3 LYS 114 90.642 3.475 9.528 877 HG2 LYS 114 HG3 LYS 114 89.561 5.679 10.064 878 HG3 LYS 114 HG2 LYS 114 87.979 4.863 10.069 879 HD2 LYS 114 HD2 LYS 114 89.137 3.219 11.773 880 HD3 LYS 114 HD3 LYS 114 90.293 4.555 11.994 881 HE2 LYS 114 HE3 LYS 114 88.642 4.983 13.633 882 HE3 LYS 114 HE2 LYS 114 88.169 6.045 12.285 883 HZ1 LYS 114 HZ1 LYS 114 86.297 4.794 13.131 884 HZ2 LYS 114 HZ2 LYS 114 87.059 3.363 12.825 885 HZ3 LYS 114 HZ3 LYS 114 86.620 4.347 11.577 886 H LYS 115 H LYS 115 89.622 6.696 7.521 887 HA LYS 115 HA LYS 115 92.159 6.809 6.117 888 HB2 LYS 115 HB3 LYS 115 90.394 8.811 7.533 889 HB3 LYS 115 HB2 LYS 115 92.029 9.294 7.019 890 HG2 LYS 115 HG3 LYS 115 91.528 8.615 4.706 891 HG3 LYS 115 HG2 LYS 115 89.914 8.052 5.203 892 HD2 LYS 115 HD2 LYS 115 90.929 10.918 5.468 893 HD3 LYS 115 HD3 LYS 115 89.845 10.332 4.183 894 HE2 LYS 115 HE3 LYS 115 88.427 9.451 6.274 895 HE3 LYS 115 HE2 LYS 115 89.293 10.762 7.112 896 HZ1 LYS 115 HZ1 LYS 115 87.230 11.534 6.144 897 HZ2 LYS 115 HZ2 LYS 115 88.510 12.275 5.414 898 HZ3 LYS 115 HZ3 LYS 115 87.708 11.061 4.638 899 H GLY 116 H GLY 116 94.020 6.095 7.047 900 HA2 GLY 116 HA3 GLY 116 94.602 5.686 9.744 901 HA3 GLY 116 HA2 GLY 116 95.844 6.189 8.573 902 H GLY 117 H GLY 117 95.905 6.980 11.304 903 HA2 GLY 117 HA3 GLY 117 96.328 8.983 12.494 904 HA3 GLY 117 HA2 GLY 117 96.143 9.868 10.960 905 H VAL 118 H VAL 118 94.024 7.955 13.168 906 HA VAL 118 HA VAL 118 91.883 10.014 12.664 907 HB VAL 118 HB VAL 118 91.765 7.261 13.976 908 HG11 VAL 118 HG11 VAL 118 90.079 8.834 14.889 909 HG12 VAL 118 HG12 VAL 118 89.557 9.234 13.235 910 HG13 VAL 118 HG13 VAL 118 89.309 7.592 13.874 911 HG21 VAL 118 HG21 VAL 118 92.174 7.212 11.530 912 HG22 VAL 118 HG22 VAL 118 90.531 6.645 11.915 913 HG23 VAL 118 HG23 VAL 118 90.778 8.288 11.276 914 H ALA 119 H ALA 119 93.990 8.681 15.156 915 HA ALA 119 HA ALA 119 92.566 9.752 17.444 916 HB1 ALA 119 HB1 ALA 119 94.733 9.500 18.624 917 HB2 ALA 119 HB2 ALA 119 94.371 8.063 17.637 918 HB3 ALA 119 HB3 ALA 119 95.554 9.262 17.063 919 H SER 120 H SER 120 94.814 11.160 15.106 920 HA SER 120 HA SER 120 94.879 13.695 16.722 921 HB2 SER 120 HB2 SER 120 96.465 12.633 14.375 922 HB3 SER 120 HB3 SER 120 96.443 14.378 14.731 923 HG SER 120 HG SER 120 98.154 13.266 15.835 924 H GLY 121 H GLY 121 92.798 12.304 14.722 925 HA2 GLY 121 HA2 GLY 121 92.331 14.230 12.630 926 HA3 GLY 121 HA3 GLY 121 91.105 13.129 13.303 927 H PHE 122 H PHE 122 91.562 14.233 16.065 928 HA PHE 122 HA PHE 122 89.499 16.254 16.005 929 HB2 PHE 122 HB3 PHE 122 91.586 15.574 18.124 930 HB3 PHE 122 HB2 PHE 122 90.219 16.684 18.388 931 HD1 PHE 122 HD1 PHE 122 91.176 13.170 17.669 932 HD2 PHE 122 HD2 PHE 122 87.960 15.860 18.610 933 HE1 PHE 122 HE1 PHE 122 89.696 11.237 18.139 934 HE2 PHE 122 HE2 PHE 122 86.481 13.925 19.075 935 HZ PHE 122 HZ PHE 122 87.348 11.614 18.841 936 H LYS 123 H LYS 123 93.037 16.426 15.887 937 HA LYS 123 HA LYS 123 92.978 19.392 16.153 938 HB2 LYS 123 HB2 LYS 123 94.849 17.935 17.064 939 HB3 LYS 123 HB3 LYS 123 95.312 17.590 15.381 940 HG2 LYS 123 HG3 LYS 123 95.821 19.891 14.948 941 HG3 LYS 123 HG2 LYS 123 95.020 20.425 16.445 942 HD2 LYS 123 HD2 LYS 123 96.757 19.622 17.813 943 HD3 LYS 123 HD3 LYS 123 97.346 18.492 16.571 944 HE2 LYS 123 HE2 LYS 123 98.437 20.177 15.366 945 HE3 LYS 123 HE3 LYS 123 97.394 21.462 16.021 946 HZ1 LYS 123 HZ1 LYS 123 99.588 21.509 17.004 947 HZ2 LYS 123 HZ2 LYS 123 99.427 19.960 17.545 948 HZ3 LYS 123 HZ3 LYS 123 98.461 21.150 18.153 949 H HIS 124 H HIS 124 92.344 17.184 13.707 950 HA HIS 124 HA HIS 124 92.969 19.298 11.642 951 HB2 HIS 124 HB2 HIS 124 93.773 16.397 11.688 952 HB3 HIS 124 HB3 HIS 124 93.325 17.124 10.126 953 HD2 HIS 124 HD2 HIS 124 96.457 16.765 12.173 954 HE1 HIS 124 HE1 HIS 124 97.001 20.370 10.043 955 HE2 HIS 124 HE2 HIS 124 98.188 18.599 11.449 956 H VAL 125 H VAL 125 91.056 19.898 10.767 957 HA VAL 125 HA VAL 125 88.960 17.737 10.426 958 HB VAL 125 HB VAL 125 88.518 19.587 12.184 959 HG11 VAL 125 HG11 VAL 125 87.942 21.765 11.420 960 HG12 VAL 125 HG12 VAL 125 89.436 21.370 10.538 961 HG13 VAL 125 HG13 VAL 125 87.859 21.239 9.722 962 HG21 VAL 125 HG21 VAL 125 86.149 19.782 11.477 963 HG22 VAL 125 HG22 VAL 125 86.757 18.127 11.232 964 HG23 VAL 125 HG23 VAL 125 86.591 19.229 9.844 965 H VAL 126 H VAL 126 88.300 17.439 8.351 966 HA VAL 126 HA VAL 126 88.669 19.725 6.420 967 HB VAL 126 HB VAL 126 89.465 16.849 5.797 968 HG11 VAL 126 HG11 VAL 126 88.784 18.254 3.869 969 HG12 VAL 126 HG12 VAL 126 89.942 19.508 4.374 970 HG13 VAL 126 HG13 VAL 126 90.532 17.919 3.829 971 HG21 VAL 126 HG21 VAL 126 91.804 17.659 5.963 972 HG22 VAL 126 HG22 VAL 126 91.215 19.248 6.505 973 HG23 VAL 126 HG23 VAL 126 90.963 17.811 7.524 974 HA PRO 127 HA PRO 127 84.567 17.654 5.954 975 HB2 PRO 127 HB2 PRO 127 83.065 19.950 5.967 976 HB3 PRO 127 HB3 PRO 127 83.596 19.129 7.463 977 HG2 PRO 127 HG3 PRO 127 84.665 21.583 6.147 978 HG3 PRO 127 HG2 PRO 127 84.531 21.181 7.880 979 HD2 PRO 127 HD2 PRO 127 86.885 21.002 6.345 980 HD3 PRO 127 HD3 PRO 127 86.604 20.182 7.910 981 H ASN 128 H ASN 128 83.742 17.183 3.956 982 HA ASN 128 HA ASN 128 84.801 18.041 1.531 983 HB2 ASN 128 HB2 ASN 128 81.914 17.332 2.198 984 HB3 ASN 128 HB3 ASN 128 82.502 17.549 0.532 985 HD21 ASN 128 HD21 ASN 128 81.953 15.173 0.259 986 HD22 ASN 128 HD22 ASN 128 83.108 13.987 0.823 987 H GLU 129 H GLU 129 84.412 19.716 0.038 988 HA GLU 129 HA GLU 129 83.340 22.207 1.289 989 HB2 GLU 129 HB2 GLU 129 84.102 23.172 -0.996 990 HB3 GLU 129 HB3 GLU 129 85.368 22.555 0.092 991 HG2 GLU 129 HG2 GLU 129 84.091 20.689 -1.911 992 HG3 GLU 129 HG3 GLU 129 85.349 21.826 -2.451 993 H VAL 130 H VAL 130 82.276 19.686 -0.822 994 HA VAL 130 HA VAL 130 80.407 21.199 -2.438 995 HB VAL 130 HB VAL 130 80.145 18.321 -1.459 996 HG11 VAL 130 HG11 VAL 130 78.109 19.272 -2.508 997 HG12 VAL 130 HG12 VAL 130 79.071 19.777 -3.918 998 HG13 VAL 130 HG13 VAL 130 78.856 18.047 -3.561 999 HG21 VAL 130 HG21 VAL 130 81.334 17.738 -3.556 1000 HG22 VAL 130 HG22 VAL 130 82.354 18.747 -2.503 1001 HG23 VAL 130 HG23 VAL 130 81.547 19.468 -3.916 1002 H VAL 131 H VAL 131 80.383 20.199 0.907 1003 HA VAL 131 HA VAL 131 77.622 20.023 1.481 1004 HB VAL 131 HB VAL 131 79.779 21.450 3.102 1005 HG11 VAL 131 HG11 VAL 131 78.289 20.980 5.028 1006 HG12 VAL 131 HG12 VAL 131 77.077 20.291 3.921 1007 HG13 VAL 131 HG13 VAL 131 77.479 22.022 3.833 1008 HG21 VAL 131 HG21 VAL 131 79.947 19.268 4.271 1009 HG22 VAL 131 HG22 VAL 131 78.732 18.583 3.165 1010 HG23 VAL 131 HG23 VAL 131 80.317 19.095 2.538 1011 H VAL 132 H VAL 132 79.582 22.907 0.790 1012 HA VAL 132 HA VAL 132 77.658 24.883 1.601 1013 HB VAL 132 HB VAL 132 79.534 25.060 -0.795 1014 HG11 VAL 132 HG11 VAL 132 77.887 26.898 -0.561 1015 HG12 VAL 132 HG12 VAL 132 78.405 27.147 1.123 1016 HG13 VAL 132 HG13 VAL 132 79.536 27.469 -0.212 1017 HG21 VAL 132 HG21 VAL 132 81.200 25.924 0.825 1018 HG22 VAL 132 HG22 VAL 132 80.738 24.250 1.214 1019 HG23 VAL 132 HG23 VAL 132 80.068 25.600 2.161 1020 H GLN 133 H GLN 133 77.846 22.813 -1.251 1021 HA GLN 133 HA GLN 133 75.390 24.216 -2.330 1022 HB2 GLN 133 HB2 GLN 133 77.365 24.141 -3.860 1023 HB3 GLN 133 HB3 GLN 133 77.348 22.364 -3.763 1024 HG2 GLN 133 HG2 GLN 133 75.135 22.270 -4.766 1025 HG3 GLN 133 HG3 GLN 133 74.980 24.042 -4.697 1026 HE21 GLN 133 HE21 GLN 133 76.650 25.308 -6.022 1027 HE22 GLN 133 HE22 GLN 133 77.229 24.575 -7.501 Start of MODEL 9 1 H1 GLU 1 H1 GLU 1 107.699 -6.871 22.466 2 H2 GLU 1 H2 GLU 1 108.708 -7.603 23.547 3 H3 GLU 1 H3 GLU 1 108.483 -5.970 23.604 4 HA GLU 1 HA GLU 1 109.410 -5.888 21.267 5 HB2 GLU 1 HB2 GLU 1 111.769 -6.000 22.168 6 HB3 GLU 1 HB3 GLU 1 110.671 -5.002 23.150 7 HG2 GLU 1 HG3 GLU 1 111.149 -7.945 23.748 8 HG3 GLU 1 HG2 GLU 1 112.179 -6.662 24.427 9 H HIS 2 H HIS 2 108.309 -8.733 21.953 10 HA HIS 2 HA HIS 2 110.505 -10.540 21.235 11 HB2 HIS 2 HB2 HIS 2 108.202 -11.028 22.428 12 HB3 HIS 2 HB3 HIS 2 107.585 -11.178 20.766 13 HD2 HIS 2 HD2 HIS 2 110.754 -12.741 22.665 14 HE1 HIS 2 HE1 HIS 2 109.062 -15.647 20.109 15 HE2 HIS 2 HE2 HIS 2 110.922 -15.216 21.804 16 HA PRO 3 HA PRO 3 110.348 -9.638 16.861 17 HB2 PRO 3 HB3 PRO 3 111.955 -11.694 15.999 18 HB3 PRO 3 HB2 PRO 3 112.595 -10.235 16.809 19 HG2 PRO 3 HG2 PRO 3 112.087 -12.977 17.905 20 HG3 PRO 3 HG3 PRO 3 113.427 -11.844 18.235 21 HD2 PRO 3 HD3 PRO 3 111.260 -12.212 19.926 22 HD3 PRO 3 HD2 PRO 3 112.228 -10.708 19.864 23 H GLU 4 H GLU 4 108.152 -10.131 16.361 24 HA GLU 4 HA GLU 4 107.354 -12.975 16.051 25 HB2 GLU 4 HB3 GLU 4 105.854 -10.473 15.166 26 HB3 GLU 4 HB2 GLU 4 105.177 -12.092 15.461 27 HG2 GLU 4 HG2 GLU 4 106.158 -11.804 17.871 28 HG3 GLU 4 HG3 GLU 4 106.221 -10.072 17.464 29 H PHE 5 H PHE 5 107.736 -10.133 13.867 30 HA PHE 5 HA PHE 5 107.181 -11.347 11.405 31 HB2 PHE 5 HB2 PHE 5 108.701 -9.754 10.379 32 HB3 PHE 5 HB3 PHE 5 107.935 -8.958 11.775 33 HD1 PHE 5 HD1 PHE 5 109.222 -9.190 14.062 34 HD2 PHE 5 HD2 PHE 5 111.031 -9.741 10.205 35 HE1 PHE 5 HE1 PHE 5 111.459 -8.774 15.050 36 HE2 PHE 5 HE2 PHE 5 113.267 -9.325 11.193 37 HZ PHE 5 HZ PHE 5 113.481 -8.845 13.618 38 H LEU 6 H LEU 6 110.050 -11.791 13.445 39 HA LEU 6 HA LEU 6 111.496 -13.340 11.402 40 HB2 LEU 6 HB2 LEU 6 112.588 -12.119 13.329 41 HB3 LEU 6 HB3 LEU 6 111.893 -13.335 14.426 42 HG LEU 6 HG LEU 6 113.355 -14.423 12.064 43 HD11 LEU 6 HD11 LEU 6 114.795 -12.497 12.673 44 HD12 LEU 6 HD12 LEU 6 115.571 -14.039 13.105 45 HD13 LEU 6 HD13 LEU 6 114.807 -13.043 14.367 46 HD21 LEU 6 HD21 LEU 6 112.406 -15.842 13.866 47 HD22 LEU 6 HD22 LEU 6 113.414 -14.994 15.063 48 HD23 LEU 6 HD23 LEU 6 114.179 -15.990 13.802 49 H LYS 7 H LYS 7 109.342 -14.064 14.140 50 HA LYS 7 HA LYS 7 109.548 -16.991 13.425 51 HB2 LYS 7 HB3 LYS 7 109.922 -16.262 15.827 52 HB3 LYS 7 HB2 LYS 7 108.228 -15.715 15.860 53 HG2 LYS 7 HG2 LYS 7 107.382 -17.878 15.770 54 HG3 LYS 7 HG3 LYS 7 108.800 -18.510 14.900 55 HD2 LYS 7 HD2 LYS 7 109.121 -17.480 17.723 56 HD3 LYS 7 HD3 LYS 7 108.451 -19.107 17.454 57 HE2 LYS 7 HE2 LYS 7 110.423 -19.893 16.442 58 HE3 LYS 7 HE3 LYS 7 110.979 -18.254 16.025 59 HZ1 LYS 7 HZ1 LYS 7 112.196 -19.158 17.894 60 HZ2 LYS 7 HZ2 LYS 7 111.320 -17.845 18.371 61 HZ3 LYS 7 HZ3 LYS 7 110.805 -19.363 18.757 62 H ALA 8 H ALA 8 108.007 -14.764 12.009 63 HA ALA 8 HA ALA 8 105.277 -14.691 12.386 64 HB1 ALA 8 HB1 ALA 8 106.955 -14.997 9.905 65 HB2 ALA 8 HB2 ALA 8 105.919 -13.642 10.413 66 HB3 ALA 8 HB3 ALA 8 105.187 -15.122 9.748 67 H GLY 9 H GLY 9 103.510 -16.062 12.240 68 HA2 GLY 9 HA3 GLY 9 102.340 -18.103 11.872 69 HA3 GLY 9 HA2 GLY 9 103.781 -18.754 11.056 70 H LYS 10 H LYS 10 103.201 -17.491 14.384 71 HA LYS 10 HA LYS 10 104.957 -19.432 15.601 72 HB2 LYS 10 HB2 LYS 10 102.545 -18.129 16.929 73 HB3 LYS 10 HB3 LYS 10 104.046 -18.689 17.706 74 HG2 LYS 10 HG3 LYS 10 105.339 -16.980 16.497 75 HG3 LYS 10 HG2 LYS 10 103.873 -16.450 15.640 76 HD2 LYS 10 HD2 LYS 10 102.830 -15.886 17.845 77 HD3 LYS 10 HD3 LYS 10 104.354 -16.329 18.650 78 HE2 LYS 10 HE3 LYS 10 104.459 -14.356 16.378 79 HE3 LYS 10 HE2 LYS 10 103.847 -13.799 17.954 80 HZ1 LYS 10 HZ1 LYS 10 106.231 -13.528 17.779 81 HZ2 LYS 10 HZ2 LYS 10 106.437 -15.140 17.498 82 HZ3 LYS 10 HZ3 LYS 10 105.870 -14.624 18.958 83 H GLU 11 H GLU 11 102.187 -20.016 13.924 84 HA GLU 11 HA GLU 11 101.968 -22.754 14.714 85 HB2 GLU 11 HB2 GLU 11 100.662 -20.908 16.540 86 HB3 GLU 11 HB3 GLU 11 99.441 -21.917 15.728 87 HG2 GLU 11 HG3 GLU 11 100.526 -23.950 16.440 88 HG3 GLU 11 HG2 GLU 11 101.960 -23.058 17.004 89 HA PRO 12 HA PRO 12 99.956 -22.788 10.761 90 HB2 PRO 12 HB2 PRO 12 98.100 -24.735 12.140 91 HB3 PRO 12 HB3 PRO 12 98.932 -24.879 10.565 92 HG2 PRO 12 HG3 PRO 12 99.793 -26.123 12.814 93 HG3 PRO 12 HG2 PRO 12 100.888 -25.587 11.511 94 HD2 PRO 12 HD3 PRO 12 100.572 -24.518 14.256 95 HD3 PRO 12 HD2 PRO 12 101.908 -24.263 13.094 96 H GLY 13 H GLY 13 98.540 -21.262 10.038 97 HA2 GLY 13 HA3 GLY 13 95.842 -21.011 10.409 98 HA3 GLY 13 HA2 GLY 13 96.444 -20.259 11.905 99 H LEU 14 H LEU 14 95.494 -18.235 11.141 100 HA LEU 14 HA LEU 14 97.090 -16.974 8.898 101 HB2 LEU 14 HB2 LEU 14 94.675 -17.062 8.439 102 HB3 LEU 14 HB3 LEU 14 94.328 -16.283 10.001 103 HG LEU 14 HG LEU 14 96.268 -14.814 8.294 104 HD11 LEU 14 HD11 LEU 14 94.721 -15.676 6.555 105 HD12 LEU 14 HD12 LEU 14 93.334 -15.061 7.486 106 HD13 LEU 14 HD13 LEU 14 94.512 -13.924 6.787 107 HD21 LEU 14 HD21 LEU 14 95.328 -13.933 10.417 108 HD22 LEU 14 HD22 LEU 14 94.865 -12.908 9.037 109 HD23 LEU 14 HD23 LEU 14 93.688 -14.045 9.735 110 H GLN 15 H GLN 15 98.336 -15.215 9.383 111 HA GLN 15 HA GLN 15 98.020 -14.072 12.172 112 HB2 GLN 15 HB3 GLN 15 100.577 -14.266 10.518 113 HB3 GLN 15 HB2 GLN 15 100.434 -13.699 12.198 114 HG2 GLN 15 HG2 GLN 15 99.291 -16.396 11.677 115 HG3 GLN 15 HG3 GLN 15 101.058 -16.277 11.496 116 HE21 GLN 15 HE21 GLN 15 102.325 -16.085 13.396 117 HE22 GLN 15 HE22 GLN 15 101.634 -15.978 15.000 118 H ILE 16 H ILE 16 98.581 -11.764 12.359 119 HA ILE 16 HA ILE 16 98.503 -10.310 9.711 120 HB ILE 16 HB ILE 16 96.958 -9.233 12.066 121 HG12 ILE 16 HG12 ILE 16 96.063 -11.441 10.167 122 HG13 ILE 16 HG13 ILE 16 96.089 -11.484 11.946 123 HG21 ILE 16 HG21 ILE 16 97.475 -8.147 9.695 124 HG22 ILE 16 HG22 ILE 16 96.134 -9.189 9.164 125 HG23 ILE 16 HG23 ILE 16 95.865 -7.971 10.434 126 HD11 ILE 16 HD11 ILE 16 94.346 -9.686 10.203 127 HD12 ILE 16 HD12 ILE 16 93.797 -11.081 11.162 128 HD13 ILE 16 HD13 ILE 16 94.414 -9.626 11.981 129 H TRP 17 H TRP 17 99.706 -8.409 9.670 130 HA TRP 17 HA TRP 17 100.802 -7.367 12.251 131 HB2 TRP 17 HB3 TRP 17 102.583 -8.353 9.977 132 HB3 TRP 17 HB2 TRP 17 103.141 -7.490 11.431 133 HD1 TRP 17 HD1 TRP 17 101.996 -8.800 13.796 134 HE1 TRP 17 HE1 TRP 17 102.241 -11.299 14.384 135 HE3 TRP 17 HE3 TRP 17 103.062 -10.626 9.148 136 HZ2 TRP 17 HZ2 TRP 17 102.826 -13.761 12.997 137 HZ3 TRP 17 HZ3 TRP 17 103.458 -13.048 8.810 138 HH2 TRP 17 HH2 TRP 17 103.339 -14.616 10.725 139 H ARG 18 H ARG 18 100.226 -5.257 12.046 140 HA ARG 18 HA ARG 18 100.236 -4.005 9.332 141 HB2 ARG 18 HB2 ARG 18 98.340 -3.367 10.603 142 HB3 ARG 18 HB3 ARG 18 99.295 -3.153 12.089 143 HG2 ARG 18 HG3 ARG 18 100.270 -1.128 11.303 144 HG3 ARG 18 HG2 ARG 18 99.784 -1.450 9.621 145 HD2 ARG 18 HD3 ARG 18 97.701 -0.586 9.940 146 HD3 ARG 18 HD2 ARG 18 97.517 -1.382 11.521 147 HE ARG 18 HE ARG 18 99.430 0.788 11.741 148 HH11 ARG 18 HH11 ARG 18 98.707 2.684 12.736 149 HH12 ARG 18 HH12 ARG 18 96.992 2.997 12.879 150 HH21 ARG 18 HH21 ARG 18 96.059 0.038 11.301 151 HH22 ARG 18 HH22 ARG 18 95.499 1.506 12.070 152 H VAL 19 H VAL 19 101.708 -2.452 8.666 153 HA VAL 19 HA VAL 19 104.067 -2.080 10.501 154 HB VAL 19 HB VAL 19 104.135 -1.074 7.689 155 HG11 VAL 19 HG11 VAL 19 106.104 -1.013 9.196 156 HG12 VAL 19 HG12 VAL 19 106.394 -2.087 7.807 157 HG13 VAL 19 HG13 VAL 19 106.002 -2.778 9.400 158 HG21 VAL 19 HG21 VAL 19 104.655 -3.486 6.948 159 HG22 VAL 19 HG22 VAL 19 103.857 -4.005 8.453 160 HG23 VAL 19 HG23 VAL 19 102.941 -3.095 7.227 161 H GLU 20 H GLU 20 104.774 -0.025 11.086 162 HA GLU 20 HA GLU 20 103.109 2.294 10.108 163 HB2 GLU 20 HB3 GLU 20 102.306 1.420 12.367 164 HB3 GLU 20 HB2 GLU 20 103.895 1.883 13.022 165 HG2 GLU 20 HG2 GLU 20 103.536 4.206 12.472 166 HG3 GLU 20 HG3 GLU 20 102.081 3.818 11.523 167 H LYS 21 H LYS 21 104.593 3.566 9.103 168 HA LYS 21 HA LYS 21 106.639 4.694 8.716 169 HB2 LYS 21 HB3 LYS 21 105.699 5.696 10.946 170 HB3 LYS 21 HB2 LYS 21 106.999 4.762 11.724 171 HG2 LYS 21 HG2 LYS 21 108.664 5.867 10.239 172 HG3 LYS 21 HG3 LYS 21 107.356 6.823 9.501 173 HD2 LYS 21 HD2 LYS 21 106.818 7.508 11.986 174 HD3 LYS 21 HD3 LYS 21 108.488 6.978 12.302 175 HE2 LYS 21 HE2 LYS 21 108.448 9.388 11.795 176 HE3 LYS 21 HE3 LYS 21 109.288 8.506 10.497 177 HZ1 LYS 21 HZ1 LYS 21 107.702 10.085 9.618 178 HZ2 LYS 21 HZ2 LYS 21 106.464 9.366 10.438 179 HZ3 LYS 21 HZ3 LYS 21 107.242 8.548 9.235 180 H PHE 22 H PHE 22 106.870 1.892 8.603 181 HA PHE 22 HA PHE 22 108.671 0.352 8.463 182 HB2 PHE 22 HB2 PHE 22 109.997 2.677 8.392 183 HB3 PHE 22 HB3 PHE 22 110.510 2.158 10.015 184 HD1 PHE 22 HD1 PHE 22 110.045 0.675 6.582 185 HD2 PHE 22 HD2 PHE 22 112.433 0.859 10.146 186 HE1 PHE 22 HE1 PHE 22 111.682 -0.882 5.564 187 HE2 PHE 22 HE2 PHE 22 114.071 -0.701 9.129 188 HZ PHE 22 HZ PHE 22 113.696 -1.572 6.838 189 H ASP 23 H ASP 23 106.804 0.770 10.820 190 HA ASP 23 HA ASP 23 108.491 -0.760 12.815 191 HB2 ASP 23 HB2 ASP 23 106.205 1.133 13.504 192 HB3 ASP 23 HB3 ASP 23 107.321 0.328 14.634 193 H LEU 24 H LEU 24 107.765 -2.827 12.728 194 HA LEU 24 HA LEU 24 105.208 -3.627 11.699 195 HB2 LEU 24 HB2 LEU 24 107.384 -5.015 12.257 196 HB3 LEU 24 HB3 LEU 24 106.614 -5.224 13.848 197 HG LEU 24 HG LEU 24 104.486 -5.839 12.367 198 HD11 LEU 24 HD11 LEU 24 105.595 -5.311 10.212 199 HD12 LEU 24 HD12 LEU 24 105.158 -7.034 10.301 200 HD13 LEU 24 HD13 LEU 24 106.845 -6.530 10.557 201 HD21 LEU 24 HD21 LEU 24 105.628 -7.342 13.980 202 HD22 LEU 24 HD22 LEU 24 105.177 -8.219 12.498 203 HD23 LEU 24 HD23 LEU 24 106.865 -7.715 12.755 204 H VAL 25 H VAL 25 103.220 -4.014 12.677 205 HA VAL 25 HA VAL 25 103.033 -3.487 15.641 206 HB VAL 25 HB VAL 25 101.367 -2.166 13.454 207 HG11 VAL 25 HG11 VAL 25 99.947 -2.914 15.344 208 HG12 VAL 25 HG12 VAL 25 100.104 -1.141 15.324 209 HG13 VAL 25 HG13 VAL 25 101.045 -2.105 16.488 210 HG21 VAL 25 HG21 VAL 25 103.555 -1.099 13.932 211 HG22 VAL 25 HG22 VAL 25 103.150 -1.046 15.664 212 HG23 VAL 25 HG23 VAL 25 102.209 -0.082 14.501 213 HA PRO 26 HA PRO 26 100.568 -7.185 14.914 214 HB2 PRO 26 HB2 PRO 26 100.122 -7.801 17.551 215 HB3 PRO 26 HB3 PRO 26 101.681 -8.104 16.732 216 HG2 PRO 26 HG3 PRO 26 100.898 -5.905 18.600 217 HG3 PRO 26 HG2 PRO 26 102.444 -6.786 18.458 218 HD2 PRO 26 HD2 PRO 26 101.973 -4.243 17.407 219 HD3 PRO 26 HD3 PRO 26 103.229 -5.369 16.811 220 H VAL 27 H VAL 27 98.506 -6.879 14.201 221 HA VAL 27 HA VAL 27 96.662 -5.159 15.837 222 HB VAL 27 HB VAL 27 96.259 -6.456 13.102 223 HG11 VAL 27 HG11 VAL 27 94.421 -4.801 12.904 224 HG12 VAL 27 HG12 VAL 27 94.753 -4.238 14.560 225 HG13 VAL 27 HG13 VAL 27 94.157 -5.893 14.285 226 HG21 VAL 27 HG21 VAL 27 98.132 -4.830 13.114 227 HG22 VAL 27 HG22 VAL 27 97.071 -3.615 13.865 228 HG23 VAL 27 HG23 VAL 27 96.735 -4.191 12.215 229 HA PRO 28 HA PRO 28 94.868 -8.846 17.589 230 HB2 PRO 28 HB2 PRO 28 92.478 -7.723 18.452 231 HB3 PRO 28 HB3 PRO 28 94.033 -7.572 19.319 232 HG2 PRO 28 HG3 PRO 28 92.645 -5.623 17.527 233 HG3 PRO 28 HG2 PRO 28 93.589 -5.335 19.014 234 HD2 PRO 28 HD2 PRO 28 94.589 -4.900 16.478 235 HD3 PRO 28 HD3 PRO 28 95.615 -5.342 17.876 236 H THR 29 H THR 29 94.428 -10.156 15.784 237 HA THR 29 HA THR 29 92.538 -9.659 13.726 238 HB THR 29 HB THR 29 93.317 -12.291 15.059 239 HG1 THR 29 HG1 THR 29 95.071 -11.922 13.950 240 HG21 THR 29 HG21 THR 29 92.482 -13.352 12.980 241 HG22 THR 29 HG22 THR 29 91.923 -11.766 12.396 242 HG23 THR 29 HG23 THR 29 91.173 -12.500 13.834 243 H ASN 30 H ASN 30 92.008 -10.518 17.080 244 HA ASN 30 HA ASN 30 89.242 -11.441 16.659 245 HB2 ASN 30 HB2 ASN 30 89.174 -10.988 19.233 246 HB3 ASN 30 HB3 ASN 30 90.236 -12.282 18.629 247 HD21 ASN 30 HD21 ASN 30 90.254 -8.801 19.608 248 HD22 ASN 30 HD22 ASN 30 91.939 -8.794 20.080 249 H LEU 31 H LEU 31 90.833 -8.365 16.931 250 HA LEU 31 HA LEU 31 88.106 -7.069 17.040 251 HB2 LEU 31 HB2 LEU 31 90.585 -6.452 18.658 252 HB3 LEU 31 HB3 LEU 31 89.433 -5.154 18.263 253 HG LEU 31 HG LEU 31 88.392 -7.761 19.373 254 HD11 LEU 31 HD11 LEU 31 90.247 -7.106 20.884 255 HD12 LEU 31 HD12 LEU 31 88.668 -6.863 21.668 256 HD13 LEU 31 HD13 LEU 31 89.561 -5.469 21.015 257 HD21 LEU 31 HD21 LEU 31 86.835 -6.016 18.541 258 HD22 LEU 31 HD22 LEU 31 87.570 -4.833 19.648 259 HD23 LEU 31 HD23 LEU 31 86.677 -6.226 20.301 260 H TYR 32 H TYR 32 90.459 -7.739 15.009 261 HA TYR 32 HA TYR 32 91.316 -5.096 14.100 262 HB2 TYR 32 HB2 TYR 32 92.144 -6.281 12.116 263 HB3 TYR 32 HB3 TYR 32 92.573 -7.180 13.587 264 HD1 TYR 32 HD1 TYR 32 92.629 -8.526 11.003 265 HD2 TYR 32 HD2 TYR 32 89.313 -7.936 13.674 266 HE1 TYR 32 HE1 TYR 32 91.525 -10.540 10.078 267 HE2 TYR 32 HE2 TYR 32 88.210 -9.952 12.742 268 HH TYR 32 HH TYR 32 89.035 -11.380 9.893 269 H GLY 33 H GLY 33 90.008 -6.969 11.526 270 HA2 GLY 33 HA3 GLY 33 88.155 -6.586 10.107 271 HA3 GLY 33 HA2 GLY 33 87.327 -5.834 11.491 272 H ASP 34 H ASP 34 89.892 -4.041 11.668 273 HA ASP 34 HA ASP 34 88.843 -2.040 9.670 274 HB2 ASP 34 HB2 ASP 34 89.080 -1.589 12.245 275 HB3 ASP 34 HB3 ASP 34 90.816 -1.429 11.887 276 H PHE 35 H PHE 35 90.204 -1.167 8.095 277 HA PHE 35 HA PHE 35 93.052 -2.187 8.126 278 HB2 PHE 35 HB3 PHE 35 90.943 -2.384 5.989 279 HB3 PHE 35 HB2 PHE 35 92.625 -2.097 5.481 280 HD1 PHE 35 HD1 PHE 35 90.343 -4.426 7.247 281 HD2 PHE 35 HD2 PHE 35 94.332 -3.782 5.791 282 HE1 PHE 35 HE1 PHE 35 90.861 -6.826 7.607 283 HE2 PHE 35 HE2 PHE 35 94.852 -6.181 6.151 284 HZ PHE 35 HZ PHE 35 93.118 -7.702 7.062 285 H PHE 36 H PHE 36 94.419 -0.486 8.161 286 HA PHE 36 HA PHE 36 93.465 2.218 7.475 287 HB2 PHE 36 HB2 PHE 36 95.866 0.984 8.678 288 HB3 PHE 36 HB3 PHE 36 96.241 2.366 7.622 289 HD1 PHE 36 HD1 PHE 36 96.519 4.307 8.881 290 HD2 PHE 36 HD2 PHE 36 93.386 1.568 9.947 291 HE1 PHE 36 HE1 PHE 36 95.763 5.865 10.654 292 HE2 PHE 36 HE2 PHE 36 92.628 3.126 11.721 293 HZ PHE 36 HZ PHE 36 93.815 5.276 12.073 294 H THR 37 H THR 37 93.016 2.488 5.319 295 HA THR 37 HA THR 37 94.415 1.164 3.176 296 HB THR 37 HB THR 37 93.341 2.860 1.723 297 HG1 THR 37 HG1 THR 37 92.125 4.526 2.832 298 HG21 THR 37 HG21 THR 37 90.998 2.454 2.434 299 HG22 THR 37 HG22 THR 37 91.981 0.981 2.610 300 HG23 THR 37 HG23 THR 37 91.572 1.955 4.043 301 H GLY 38 H GLY 38 95.085 4.164 4.941 302 HA2 GLY 38 HA2 GLY 38 97.181 4.953 2.993 303 HA3 GLY 38 HA3 GLY 38 96.807 5.774 4.527 304 H ASP 39 H ASP 39 97.273 2.306 4.499 305 HA ASP 39 HA ASP 39 100.121 2.639 5.401 306 HB2 ASP 39 HB3 ASP 39 98.474 2.714 7.392 307 HB3 ASP 39 HB2 ASP 39 98.143 1.003 7.028 308 H ALA 40 H ALA 40 100.269 -0.101 6.373 309 HA ALA 40 HA ALA 40 99.466 -1.689 3.948 310 HB1 ALA 40 HB1 ALA 40 101.757 -2.621 3.746 311 HB2 ALA 40 HB2 ALA 40 102.311 -1.536 5.044 312 HB3 ALA 40 HB3 ALA 40 101.757 -0.859 3.493 313 H TYR 41 H TYR 41 99.024 -3.832 4.421 314 HA TYR 41 HA TYR 41 99.511 -4.659 7.296 315 HB2 TYR 41 HB2 TYR 41 97.112 -5.096 5.478 316 HB3 TYR 41 HB3 TYR 41 97.392 -6.080 6.934 317 HD1 TYR 41 HD1 TYR 41 96.661 -5.301 9.019 318 HD2 TYR 41 HD2 TYR 41 97.177 -2.507 5.797 319 HE1 TYR 41 HE1 TYR 41 95.679 -3.506 10.419 320 HE2 TYR 41 HE2 TYR 41 96.198 -0.710 7.199 321 HH TYR 41 HH TYR 41 94.374 -1.090 9.699 322 H VAL 42 H VAL 42 100.786 -6.426 7.467 323 HA VAL 42 HA VAL 42 101.152 -8.120 5.000 324 HB VAL 42 HB VAL 42 102.775 -8.029 7.584 325 HG11 VAL 42 HG11 VAL 42 102.862 -10.175 6.274 326 HG12 VAL 42 HG12 VAL 42 104.423 -9.321 6.320 327 HG13 VAL 42 HG13 VAL 42 103.410 -9.245 4.859 328 HG21 VAL 42 HG21 VAL 42 102.883 -5.897 6.320 329 HG22 VAL 42 HG22 VAL 42 104.427 -6.777 6.226 330 HG23 VAL 42 HG23 VAL 42 103.306 -6.796 4.843 331 H ILE 43 H ILE 43 99.879 -9.916 4.945 332 HA ILE 43 HA ILE 43 99.251 -11.217 7.609 333 HB ILE 43 HB ILE 43 97.557 -11.885 5.254 334 HG12 ILE 43 HG12 ILE 43 97.397 -9.150 6.591 335 HG13 ILE 43 HG13 ILE 43 97.988 -9.439 4.937 336 HG21 ILE 43 HG21 ILE 43 95.780 -11.572 7.006 337 HG22 ILE 43 HG22 ILE 43 97.051 -11.089 8.155 338 HG23 ILE 43 HG23 ILE 43 97.037 -12.738 7.485 339 HD11 ILE 43 HD11 ILE 43 95.602 -8.764 4.926 340 HD12 ILE 43 HD12 ILE 43 95.798 -10.430 4.329 341 HD13 ILE 43 HD13 ILE 43 95.208 -10.140 5.984 342 H LEU 44 H LEU 44 99.475 -13.438 7.779 343 HA LEU 44 HA LEU 44 100.705 -14.823 5.383 344 HB2 LEU 44 HB2 LEU 44 101.771 -14.400 8.090 345 HB3 LEU 44 HB3 LEU 44 101.688 -16.126 7.669 346 HG LEU 44 HG LEU 44 102.848 -15.580 5.493 347 HD11 LEU 44 HD11 LEU 44 103.984 -13.380 5.324 348 HD12 LEU 44 HD12 LEU 44 102.217 -13.185 5.400 349 HD13 LEU 44 HD13 LEU 44 103.210 -12.865 6.842 350 HD21 LEU 44 HD21 LEU 44 105.088 -15.281 6.524 351 HD22 LEU 44 HD22 LEU 44 104.104 -16.437 7.453 352 HD23 LEU 44 HD23 LEU 44 104.318 -14.773 8.046 353 H LYS 45 H LYS 45 100.164 -17.113 5.213 354 HA LYS 45 HA LYS 45 98.091 -18.033 7.194 355 HB2 LYS 45 HB3 LYS 45 97.268 -16.972 4.827 356 HB3 LYS 45 HB2 LYS 45 97.514 -18.664 4.335 357 HG2 LYS 45 HG2 LYS 45 96.207 -19.176 6.593 358 HG3 LYS 45 HG3 LYS 45 95.598 -17.520 6.365 359 HD2 LYS 45 HD2 LYS 45 95.428 -19.800 4.344 360 HD3 LYS 45 HD3 LYS 45 94.077 -19.129 5.290 361 HE2 LYS 45 HE2 LYS 45 95.651 -17.836 3.044 362 HE3 LYS 45 HE3 LYS 45 93.888 -18.021 3.209 363 HZ1 LYS 45 HZ1 LYS 45 94.249 -15.843 3.791 364 HZ2 LYS 45 HZ2 LYS 45 94.237 -16.568 5.272 365 HZ3 LYS 45 HZ3 LYS 45 95.670 -16.142 4.574 366 H THR 46 H THR 46 99.544 -19.562 7.993 367 HA THR 46 HA THR 46 100.714 -21.559 6.105 368 HB THR 46 HB THR 46 100.838 -21.205 9.133 369 HG1 THR 46 HG1 THR 46 102.036 -19.736 7.754 370 HG21 THR 46 HG21 THR 46 100.963 -23.608 8.455 371 HG22 THR 46 HG22 THR 46 102.500 -23.009 9.123 372 HG23 THR 46 HG23 THR 46 102.310 -23.205 7.364 373 H VAL 47 H VAL 47 99.011 -22.802 5.325 374 HA VAL 47 HA VAL 47 96.993 -23.837 7.269 375 HB VAL 47 HB VAL 47 96.988 -24.862 4.486 376 HG11 VAL 47 HG11 VAL 47 95.120 -25.170 6.089 377 HG12 VAL 47 HG12 VAL 47 94.945 -23.404 6.223 378 HG13 VAL 47 HG13 VAL 47 94.604 -24.218 4.677 379 HG21 VAL 47 HG21 VAL 47 96.087 -22.621 3.652 380 HG22 VAL 47 HG22 VAL 47 96.777 -21.893 5.122 381 HG23 VAL 47 HG23 VAL 47 97.843 -22.681 3.935 382 H GLN 48 H GLN 48 96.478 -26.188 7.202 383 HA GLN 48 HA GLN 48 98.980 -27.838 6.757 384 HB2 GLN 48 HB2 GLN 48 98.486 -27.393 9.197 385 HB3 GLN 48 HB3 GLN 48 96.925 -28.220 8.981 386 HG2 GLN 48 HG2 GLN 48 98.101 -30.273 8.263 387 HG3 GLN 48 HG3 GLN 48 99.668 -29.448 8.443 388 HE21 GLN 48 HE21 GLN 48 99.192 -28.014 10.873 389 HE22 GLN 48 HE22 GLN 48 98.988 -29.178 12.163 390 H LEU 49 H LEU 49 98.641 -29.534 5.399 391 HA LEU 49 HA LEU 49 95.997 -29.979 4.252 392 HB2 LEU 49 HB3 LEU 49 98.465 -31.770 4.154 393 HB3 LEU 49 HB2 LEU 49 97.072 -31.829 3.048 394 HG LEU 49 HG LEU 49 98.634 -29.259 3.421 395 HD11 LEU 49 HD11 LEU 49 100.283 -31.021 2.847 396 HD12 LEU 49 HD12 LEU 49 100.027 -29.915 1.477 397 HD13 LEU 49 HD13 LEU 49 99.267 -31.525 1.476 398 HD21 LEU 49 HD21 LEU 49 96.452 -29.213 2.239 399 HD22 LEU 49 HD22 LEU 49 97.033 -30.470 1.121 400 HD23 LEU 49 HD23 LEU 49 97.792 -28.861 1.121 401 H ARG 50 H ARG 50 97.638 -32.912 5.114 402 HA ARG 50 HA ARG 50 95.709 -33.378 7.375 403 HB2 ARG 50 HB2 ARG 50 95.343 -35.721 6.323 404 HB3 ARG 50 HB3 ARG 50 94.486 -34.347 5.585 405 HG2 ARG 50 HG2 ARG 50 96.193 -34.165 3.842 406 HG3 ARG 50 HG3 ARG 50 97.167 -35.436 4.619 407 HD2 ARG 50 HD3 ARG 50 95.727 -36.203 2.647 408 HD3 ARG 50 HD2 ARG 50 95.502 -37.114 4.160 409 HE ARG 50 HE ARG 50 93.633 -34.842 3.858 410 HH11 ARG 50 HH11 ARG 50 91.469 -35.448 3.617 411 HH12 ARG 50 HH12 ARG 50 91.062 -37.109 3.249 412 HH21 ARG 50 HH21 ARG 50 94.374 -38.180 3.197 413 HH22 ARG 50 HH22 ARG 50 92.699 -38.649 3.012 414 H ASN 51 H ASN 51 98.596 -34.340 5.548 415 HA ASN 51 HA ASN 51 99.968 -35.064 8.036 416 HB2 ASN 51 HB2 ASN 51 98.422 -37.083 7.454 417 HB3 ASN 51 HB3 ASN 51 99.554 -37.374 6.111 418 HD21 ASN 51 HD21 ASN 51 99.064 -37.730 9.551 419 HD22 ASN 51 HD22 ASN 51 100.649 -38.375 9.914 420 H GLY 52 H GLY 52 100.501 -33.252 5.933 421 HA2 GLY 52 HA2 GLY 52 102.949 -34.565 4.729 422 HA3 GLY 52 HA3 GLY 52 101.934 -33.449 3.785 423 H ASN 53 H ASN 53 102.165 -31.230 4.087 424 HA ASN 53 HA ASN 53 104.076 -30.375 6.266 425 HB2 ASN 53 HB2 ASN 53 104.129 -29.285 3.421 426 HB3 ASN 53 HB3 ASN 53 105.289 -28.959 4.731 427 HD21 ASN 53 HD21 ASN 53 106.467 -31.001 5.602 428 HD22 ASN 53 HD22 ASN 53 106.879 -32.227 4.424 429 H LEU 54 H LEU 54 104.049 -27.614 5.328 430 HA LEU 54 HA LEU 54 101.127 -26.954 5.778 431 HB2 LEU 54 HB2 LEU 54 103.293 -25.140 6.815 432 HB3 LEU 54 HB3 LEU 54 101.651 -25.417 7.442 433 HG LEU 54 HG LEU 54 102.616 -27.885 7.845 434 HD11 LEU 54 HD11 LEU 54 104.817 -27.379 6.817 435 HD12 LEU 54 HD12 LEU 54 104.993 -27.774 8.543 436 HD13 LEU 54 HD13 LEU 54 105.073 -26.079 8.006 437 HD21 LEU 54 HD21 LEU 54 101.710 -26.357 9.578 438 HD22 LEU 54 HD22 LEU 54 103.181 -27.178 10.154 439 HD23 LEU 54 HD23 LEU 54 103.260 -25.483 9.617 440 H GLN 55 H GLN 55 100.477 -24.836 4.894 441 HA GLN 55 HA GLN 55 102.306 -24.015 2.622 442 HB2 GLN 55 HB2 GLN 55 100.228 -25.113 1.848 443 HB3 GLN 55 HB3 GLN 55 99.260 -23.937 2.768 444 HG2 GLN 55 HG3 GLN 55 100.033 -22.108 1.402 445 HG3 GLN 55 HG2 GLN 55 101.272 -23.127 0.631 446 HE21 GLN 55 HE21 GLN 55 98.483 -25.005 1.097 447 HE22 GLN 55 HE22 GLN 55 97.775 -24.799 -0.490 448 H TYR 56 H TYR 56 103.333 -22.250 3.567 449 HA TYR 56 HA TYR 56 101.848 -20.231 5.123 450 HB2 TYR 56 HB3 TYR 56 104.638 -20.553 4.019 451 HB3 TYR 56 HB2 TYR 56 104.095 -18.919 4.463 452 HD1 TYR 56 HD1 TYR 56 104.203 -22.427 5.820 453 HD2 TYR 56 HD2 TYR 56 104.275 -18.220 6.673 454 HE1 TYR 56 HE1 TYR 56 104.666 -22.919 8.206 455 HE2 TYR 56 HE2 TYR 56 104.729 -18.708 9.061 456 HH TYR 56 HH TYR 56 104.282 -20.756 10.658 457 H ASP 57 H ASP 57 100.575 -18.655 4.215 458 HA ASP 57 HA ASP 57 100.994 -18.092 1.278 459 HB2 ASP 57 HB2 ASP 57 98.654 -17.267 3.051 460 HB3 ASP 57 HB3 ASP 57 98.732 -17.217 1.273 461 H LEU 58 H LEU 58 101.272 -15.917 0.568 462 HA LEU 58 HA LEU 58 101.846 -13.965 2.814 463 HB2 LEU 58 HB3 LEU 58 103.622 -15.001 0.778 464 HB3 LEU 58 HB2 LEU 58 103.377 -13.260 0.504 465 HG LEU 58 HG LEU 58 103.824 -12.944 3.013 466 HD11 LEU 58 HD11 LEU 58 104.878 -15.788 2.673 467 HD12 LEU 58 HD12 LEU 58 103.452 -15.325 3.633 468 HD13 LEU 58 HD13 LEU 58 105.071 -14.768 4.118 469 HD21 LEU 58 HD21 LEU 58 105.477 -12.506 1.141 470 HD22 LEU 58 HD22 LEU 58 106.232 -12.942 2.692 471 HD23 LEU 58 HD23 LEU 58 106.107 -14.151 1.391 472 H HIS 59 H HIS 59 100.191 -12.515 2.716 473 HA HIS 59 HA HIS 59 99.596 -11.360 -0.013 474 HB2 HIS 59 HB2 HIS 59 97.216 -11.077 1.408 475 HB3 HIS 59 HB3 HIS 59 97.532 -12.299 0.154 476 HD2 HIS 59 HD2 HIS 59 99.007 -14.667 1.544 477 HE1 HIS 59 HE1 HIS 59 96.495 -14.204 4.907 478 H TYR 60 H TYR 60 100.212 -9.272 0.038 479 HA TYR 60 HA TYR 60 100.042 -7.825 2.677 480 HB2 TYR 60 HB3 TYR 60 101.306 -6.072 1.002 481 HB3 TYR 60 HB2 TYR 60 102.157 -7.293 1.977 482 HD1 TYR 60 HD1 TYR 60 101.802 -6.004 -1.263 483 HD2 TYR 60 HD2 TYR 60 102.174 -9.738 0.825 484 HE1 TYR 60 HE1 TYR 60 102.634 -7.078 -3.335 485 HE2 TYR 60 HE2 TYR 60 103.001 -10.816 -1.249 486 HH TYR 60 HH TYR 60 102.624 -10.123 -3.984 487 H TRP 61 H TRP 61 98.496 -6.285 2.966 488 HA TRP 61 HA TRP 61 96.790 -5.651 0.564 489 HB2 TRP 61 HB2 TRP 61 95.827 -6.611 2.764 490 HB3 TRP 61 HB3 TRP 61 96.140 -5.002 3.458 491 HD1 TRP 61 HD1 TRP 61 94.220 -6.634 0.523 492 HE1 TRP 61 HE1 TRP 61 92.189 -5.161 -0.074 493 HE3 TRP 61 HE3 TRP 61 95.076 -2.736 3.710 494 HZ2 TRP 61 HZ2 TRP 61 91.091 -2.622 0.741 495 HZ3 TRP 61 HZ3 TRP 61 93.522 -0.809 3.783 496 HH2 TRP 61 HH2 TRP 61 91.534 -0.745 2.304 497 H LEU 62 H LEU 62 96.881 -3.686 -0.340 498 HA LEU 62 HA LEU 62 97.933 -1.403 1.342 499 HB2 LEU 62 HB3 LEU 62 98.463 -1.294 -1.586 500 HB3 LEU 62 HB2 LEU 62 99.510 -0.833 -0.223 501 HG LEU 62 HG LEU 62 98.912 -3.703 -1.070 502 HD11 LEU 62 HD11 LEU 62 101.255 -3.700 -1.886 503 HD12 LEU 62 HD12 LEU 62 100.274 -2.490 -2.748 504 HD13 LEU 62 HD13 LEU 62 101.397 -1.976 -1.466 505 HD21 LEU 62 HD21 LEU 62 101.294 -3.185 0.566 506 HD22 LEU 62 HD22 LEU 62 99.803 -2.663 1.387 507 HD23 LEU 62 HD23 LEU 62 99.971 -4.346 0.832 508 H GLY 63 H GLY 63 96.134 -0.149 1.622 509 HA2 GLY 63 HA3 GLY 63 93.880 -0.159 -0.202 510 HA3 GLY 63 HA2 GLY 63 94.179 1.059 1.061 511 H ASN 64 H ASN 64 96.711 0.532 -1.242 512 HA ASN 64 HA ASN 64 97.563 1.935 -2.934 513 HB2 ASN 64 HB2 ASN 64 95.148 1.310 -3.804 514 HB3 ASN 64 HB3 ASN 64 94.785 3.012 -3.431 515 HD21 ASN 64 HD21 ASN 64 97.875 1.578 -4.656 516 HD22 ASN 64 HD22 ASN 64 97.891 2.518 -6.131 517 H GLU 65 H GLU 65 96.251 3.071 -0.117 518 HA GLU 65 HA GLU 65 96.682 5.961 -0.868 519 HB2 GLU 65 HB2 GLU 65 95.241 4.533 1.368 520 HB3 GLU 65 HB3 GLU 65 95.839 6.187 1.639 521 HG2 GLU 65 HG2 GLU 65 94.551 7.043 -0.212 522 HG3 GLU 65 HG3 GLU 65 94.142 5.401 -0.765 523 H CYS 66 H CYS 66 98.470 3.392 0.106 524 HA CYS 66 HA CYS 66 100.077 4.957 2.116 525 HB2 CYS 66 HB3 CYS 66 99.393 2.583 2.625 526 HB3 CYS 66 HB2 CYS 66 100.374 2.052 1.238 527 HG CYS 66 HG CYS 66 101.661 1.887 3.976 528 H SER 67 H SER 67 102.181 5.597 1.676 529 HA SER 67 HA SER 67 102.933 5.863 -1.122 530 HB2 SER 67 HB2 SER 67 104.791 6.098 1.277 531 HB3 SER 67 HB3 SER 67 104.929 6.917 -0.298 532 HG SER 67 HG SER 67 104.011 8.281 1.337 533 H GLN 68 H GLN 68 104.795 4.904 -2.187 534 HA GLN 68 HA GLN 68 104.969 2.034 -1.774 535 HB2 GLN 68 HB3 GLN 68 105.381 3.103 -3.969 536 HB3 GLN 68 HB2 GLN 68 106.823 3.911 -3.309 537 HG2 GLN 68 HG2 GLN 68 108.028 1.904 -3.134 538 HG3 GLN 68 HG3 GLN 68 106.555 0.906 -3.105 539 HE21 GLN 68 HE21 GLN 68 109.013 0.899 -4.983 540 HE22 GLN 68 HE22 GLN 68 108.308 1.000 -6.581 541 H ASP 69 H ASP 69 106.365 4.615 -0.075 542 HA ASP 69 HA ASP 69 108.967 3.409 0.503 543 HB2 ASP 69 HB3 ASP 69 108.721 5.778 0.859 544 HB3 ASP 69 HB2 ASP 69 107.295 5.539 1.897 545 H GLU 70 H GLU 70 105.905 3.641 2.398 546 HA GLU 70 HA GLU 70 106.994 1.634 4.321 547 HB2 GLU 70 HB2 GLU 70 104.383 1.969 5.056 548 HB3 GLU 70 HB3 GLU 70 105.696 3.051 5.580 549 HG2 GLU 70 HG3 GLU 70 104.264 3.546 2.958 550 HG3 GLU 70 HG2 GLU 70 103.545 4.095 4.491 551 H SER 71 H SER 71 104.548 1.890 1.757 552 HA SER 71 HA SER 71 103.326 -0.690 2.188 553 HB2 SER 71 HB2 SER 71 102.189 0.804 0.735 554 HB3 SER 71 HB3 SER 71 103.652 1.112 -0.232 555 HG SER 71 HG SER 71 102.198 -0.372 -1.264 556 H GLY 72 H GLY 72 105.778 0.246 -0.293 557 HA2 GLY 72 HA3 GLY 72 106.361 -2.409 -1.150 558 HA3 GLY 72 HA2 GLY 72 107.521 -1.060 -1.216 559 H ALA 73 H ALA 73 108.086 -0.460 1.346 560 HA ALA 73 HA ALA 73 109.956 -2.369 2.198 561 HB1 ALA 73 HB1 ALA 73 109.592 -1.385 4.539 562 HB2 ALA 73 HB2 ALA 73 108.272 -0.425 3.827 563 HB3 ALA 73 HB3 ALA 73 109.942 -0.208 3.250 564 H ALA 74 H ALA 74 106.467 -2.251 2.947 565 HA ALA 74 HA ALA 74 106.549 -4.450 4.858 566 HB1 ALA 74 HB1 ALA 74 104.282 -4.145 4.976 567 HB2 ALA 74 HB2 ALA 74 104.092 -4.148 3.207 568 HB3 ALA 74 HB3 ALA 74 104.624 -2.669 4.042 569 H ALA 75 H ALA 75 106.080 -4.251 1.330 570 HA ALA 75 HA ALA 75 105.500 -7.095 1.016 571 HB1 ALA 75 HB1 ALA 75 105.961 -6.678 -1.384 572 HB2 ALA 75 HB2 ALA 75 106.641 -5.085 -0.977 573 HB3 ALA 75 HB3 ALA 75 104.912 -5.411 -0.706 574 H ILE 76 H ILE 76 108.461 -5.147 1.119 575 HA ILE 76 HA ILE 76 110.156 -7.390 0.212 576 HB ILE 76 HB ILE 76 110.989 -4.850 1.675 577 HG12 ILE 76 HG13 ILE 76 110.235 -5.384 -1.210 578 HG13 ILE 76 HG12 ILE 76 109.792 -4.007 -0.172 579 HG21 ILE 76 HG21 ILE 76 112.567 -6.904 1.277 580 HG22 ILE 76 HG22 ILE 76 112.539 -6.384 -0.425 581 HG23 ILE 76 HG23 ILE 76 113.147 -5.281 0.833 582 HD11 ILE 76 HD11 ILE 76 111.437 -3.084 -1.585 583 HD12 ILE 76 HD12 ILE 76 112.369 -3.523 -0.134 584 HD13 ILE 76 HD13 ILE 76 112.418 -4.569 -1.574 585 H PHE 77 H PHE 77 109.393 -5.820 3.350 586 HA PHE 77 HA PHE 77 111.189 -7.450 4.920 587 HB2 PHE 77 HB2 PHE 77 108.866 -5.663 5.415 588 HB3 PHE 77 HB3 PHE 77 109.103 -6.929 6.643 589 HD1 PHE 77 HD1 PHE 77 110.149 -5.942 8.488 590 HD2 PHE 77 HD2 PHE 77 111.557 -5.013 4.537 591 HE1 PHE 77 HE1 PHE 77 112.027 -4.647 9.462 592 HE2 PHE 77 HE2 PHE 77 113.435 -3.718 5.510 593 HZ PHE 77 HZ PHE 77 113.670 -3.535 7.973 594 H THR 78 H THR 78 107.791 -7.912 3.912 595 HA THR 78 HA THR 78 107.548 -10.434 5.419 596 HB THR 78 HB THR 78 105.686 -8.765 4.599 597 HG1 THR 78 HG1 THR 78 105.529 -11.604 4.473 598 HG21 THR 78 HG21 THR 78 104.687 -9.311 2.456 599 HG22 THR 78 HG22 THR 78 106.410 -8.955 2.183 600 HG23 THR 78 HG23 THR 78 105.842 -10.642 2.203 601 H VAL 79 H VAL 79 108.050 -9.526 1.995 602 HA VAL 79 HA VAL 79 108.047 -12.230 0.977 603 HB VAL 79 HB VAL 79 109.389 -9.678 -0.001 604 HG11 VAL 79 HG11 VAL 79 110.624 -11.662 -0.833 605 HG12 VAL 79 HG12 VAL 79 109.095 -12.375 -1.400 606 HG13 VAL 79 HG13 VAL 79 109.710 -10.881 -2.146 607 HG21 VAL 79 HG21 VAL 79 107.110 -11.140 -1.331 608 HG22 VAL 79 HG22 VAL 79 106.774 -10.150 0.109 609 HG23 VAL 79 HG23 VAL 79 107.495 -9.402 -1.337 610 H GLN 80 H GLN 80 110.752 -10.132 2.103 611 HA GLN 80 HA GLN 80 112.776 -12.140 1.523 612 HB2 GLN 80 HB2 GLN 80 114.290 -10.735 2.753 613 HB3 GLN 80 HB3 GLN 80 113.166 -9.649 1.902 614 HG2 GLN 80 HG2 GLN 80 111.754 -9.711 4.074 615 HG3 GLN 80 HG3 GLN 80 113.202 -10.403 4.844 616 HE21 GLN 80 HE21 GLN 80 114.712 -8.918 5.614 617 HE22 GLN 80 HE22 GLN 80 114.795 -7.244 5.115 618 H LEU 81 H LEU 81 111.165 -11.202 4.630 619 HA LEU 81 HA LEU 81 112.500 -13.272 6.148 620 HB2 LEU 81 HB3 LEU 81 110.757 -11.223 6.765 621 HB3 LEU 81 HB2 LEU 81 109.712 -12.649 6.958 622 HG LEU 81 HG LEU 81 110.922 -11.999 9.068 623 HD11 LEU 81 HD11 LEU 81 110.506 -14.193 9.447 624 HD12 LEU 81 HD12 LEU 81 110.899 -14.631 7.767 625 HD13 LEU 81 HD13 LEU 81 112.197 -14.490 8.977 626 HD21 LEU 81 HD21 LEU 81 113.244 -11.987 9.248 627 HD22 LEU 81 HD22 LEU 81 113.046 -11.394 7.582 628 HD23 LEU 81 HD23 LEU 81 113.463 -13.100 7.876 629 H ASP 82 H ASP 82 109.310 -13.216 4.473 630 HA ASP 82 HA ASP 82 108.422 -15.800 5.124 631 HB2 ASP 82 HB2 ASP 82 106.970 -14.636 3.696 632 HB3 ASP 82 HB3 ASP 82 108.275 -14.181 2.575 633 H ASP 83 H ASP 83 110.791 -14.897 2.562 634 HA ASP 83 HA ASP 83 111.322 -17.620 1.771 635 HB2 ASP 83 HB2 ASP 83 112.135 -15.663 0.477 636 HB3 ASP 83 HB3 ASP 83 113.222 -15.228 1.818 637 H TYR 84 H TYR 84 112.412 -15.583 4.427 638 HA TYR 84 HA TYR 84 114.486 -17.405 5.370 639 HB2 TYR 84 HB2 TYR 84 114.146 -14.929 6.015 640 HB3 TYR 84 HB3 TYR 84 112.847 -15.500 7.089 641 HD1 TYR 84 HD1 TYR 84 113.342 -16.541 9.169 642 HD2 TYR 84 HD2 TYR 84 116.486 -15.841 6.327 643 HE1 TYR 84 HE1 TYR 84 115.026 -17.159 10.882 644 HE2 TYR 84 HE2 TYR 84 118.171 -16.464 8.037 645 HH TYR 84 HH TYR 84 117.487 -18.097 10.813 646 H LEU 85 H LEU 85 111.004 -17.303 5.529 647 HA LEU 85 HA LEU 85 110.865 -19.143 7.847 648 HB2 LEU 85 HB2 LEU 85 108.686 -18.296 5.891 649 HB3 LEU 85 HB3 LEU 85 108.446 -19.091 7.465 650 HG LEU 85 HG LEU 85 109.641 -16.329 6.974 651 HD11 LEU 85 HD11 LEU 85 107.170 -16.466 6.825 652 HD12 LEU 85 HD12 LEU 85 107.120 -17.267 8.414 653 HD13 LEU 85 HD13 LEU 85 107.675 -15.581 8.284 654 HD21 LEU 85 HD21 LEU 85 109.395 -16.405 9.630 655 HD22 LEU 85 HD22 LEU 85 110.861 -17.022 8.831 656 HD23 LEU 85 HD23 LEU 85 109.598 -18.154 9.370 657 H ASN 86 H ASN 86 109.736 -19.439 4.411 658 HA ASN 86 HA ASN 86 110.384 -22.388 4.706 659 HB2 ASN 86 HB2 ASN 86 107.926 -21.886 4.656 660 HB3 ASN 86 HB3 ASN 86 108.143 -21.160 3.045 661 HD21 ASN 86 HD21 ASN 86 106.832 -22.823 1.993 662 HD22 ASN 86 HD22 ASN 86 107.430 -24.457 1.814 663 H GLY 87 H GLY 87 110.090 -19.670 2.378 664 HA2 GLY 87 HA2 GLY 87 111.714 -19.274 0.621 665 HA3 GLY 87 HA3 GLY 87 112.338 -20.927 0.842 666 H ARG 88 H ARG 88 108.961 -20.986 0.848 667 HA ARG 88 HA ARG 88 108.724 -21.149 -2.128 668 HB2 ARG 88 HB2 ARG 88 108.465 -23.508 -0.237 669 HB3 ARG 88 HB3 ARG 88 107.595 -23.469 -1.790 670 HG2 ARG 88 HG2 ARG 88 109.738 -23.122 -2.984 671 HG3 ARG 88 HG3 ARG 88 110.610 -23.152 -1.433 672 HD2 ARG 88 HD2 ARG 88 108.969 -25.426 -2.635 673 HD3 ARG 88 HD3 ARG 88 110.741 -25.365 -2.486 674 HE ARG 88 HE ARG 88 109.614 -24.988 0.135 675 HH11 ARG 88 HH11 ARG 88 109.561 -26.765 1.530 676 HH12 ARG 88 HH12 ARG 88 109.671 -28.388 0.885 677 HH21 ARG 88 HH21 ARG 88 109.909 -27.329 -2.424 678 HH22 ARG 88 HH22 ARG 88 109.868 -28.705 -1.346 679 H ALA 89 H ALA 89 107.567 -19.919 0.604 680 HA ALA 89 HA ALA 89 104.807 -20.651 0.772 681 HB1 ALA 89 HB1 ALA 89 104.462 -18.454 1.798 682 HB2 ALA 89 HB2 ALA 89 105.986 -17.856 1.100 683 HB3 ALA 89 HB3 ALA 89 106.016 -19.119 2.354 684 H VAL 90 H VAL 90 103.015 -18.902 0.139 685 HA VAL 90 HA VAL 90 103.349 -18.494 -2.833 686 HB VAL 90 HB VAL 90 100.767 -18.293 -1.239 687 HG11 VAL 90 HG11 VAL 90 100.785 -17.405 -3.554 688 HG12 VAL 90 HG12 VAL 90 99.781 -18.870 -3.440 689 HG13 VAL 90 HG13 VAL 90 101.413 -18.961 -4.147 690 HG21 VAL 90 HG21 VAL 90 100.516 -20.734 -2.220 691 HG22 VAL 90 HG22 VAL 90 102.296 -20.711 -2.214 692 HG23 VAL 90 HG23 VAL 90 101.398 -20.485 -0.694 693 H GLN 91 H GLN 91 103.357 -16.440 -3.682 694 HA GLN 91 HA GLN 91 103.178 -14.200 -1.685 695 HB2 GLN 91 HB2 GLN 91 103.968 -13.805 -4.566 696 HB3 GLN 91 HB3 GLN 91 104.555 -12.971 -3.107 697 HG2 GLN 91 HG2 GLN 91 106.367 -14.371 -3.676 698 HG3 GLN 91 HG3 GLN 91 105.507 -15.321 -2.441 699 HE21 GLN 91 HE21 GLN 91 106.959 -16.960 -3.950 700 HE22 GLN 91 HE22 GLN 91 106.020 -17.732 -5.208 701 H HIS 92 H HIS 92 101.624 -12.619 -1.797 702 HA HIS 92 HA HIS 92 99.806 -12.613 -4.199 703 HB2 HIS 92 HB3 HIS 92 99.041 -13.076 -1.308 704 HB3 HIS 92 HB2 HIS 92 97.906 -12.260 -2.409 705 HD2 HIS 92 HD2 HIS 92 100.027 -15.653 -2.666 706 HE1 HIS 92 HE1 HIS 92 96.216 -16.232 -4.396 707 H ARG 93 H ARG 93 99.416 -10.549 -4.866 708 HA ARG 93 HA ARG 93 100.127 -8.343 -2.917 709 HB2 ARG 93 HB2 ARG 93 101.616 -8.378 -4.855 710 HB3 ARG 93 HB3 ARG 93 100.226 -8.424 -5.965 711 HG2 ARG 93 HG2 ARG 93 99.547 -6.205 -5.356 712 HG3 ARG 93 HG3 ARG 93 100.648 -6.176 -3.958 713 HD2 ARG 93 HD2 ARG 93 102.560 -5.928 -5.305 714 HD3 ARG 93 HD3 ARG 93 101.747 -6.582 -6.748 715 HE ARG 93 HE ARG 93 101.734 -3.779 -5.879 716 HH11 ARG 93 HH11 ARG 93 100.473 -2.384 -7.133 717 HH12 ARG 93 HH12 ARG 93 99.273 -3.033 -8.228 718 HH21 ARG 93 HH21 ARG 93 99.956 -6.350 -7.415 719 HH22 ARG 93 HH22 ARG 93 98.981 -5.270 -8.386 720 H GLU 94 H GLU 94 98.465 -7.057 -2.281 721 HA GLU 94 HA GLU 94 96.054 -6.925 -4.107 722 HB2 GLU 94 HB2 GLU 94 95.775 -6.704 -1.110 723 HB3 GLU 94 HB3 GLU 94 94.581 -7.234 -2.318 724 HG2 GLU 94 HG3 GLU 94 95.189 -9.275 -1.350 725 HG3 GLU 94 HG2 GLU 94 96.312 -9.196 -2.728 726 H VAL 95 H VAL 95 96.969 -4.923 -4.934 727 HA VAL 95 HA VAL 95 97.430 -2.698 -3.029 728 HB VAL 95 HB VAL 95 98.686 -2.992 -5.211 729 HG11 VAL 95 HG11 VAL 95 96.747 -3.716 -6.577 730 HG12 VAL 95 HG12 VAL 95 97.529 -2.281 -7.284 731 HG13 VAL 95 HG13 VAL 95 96.007 -2.110 -6.376 732 HG21 VAL 95 HG21 VAL 95 98.592 -0.810 -4.033 733 HG22 VAL 95 HG22 VAL 95 97.084 -0.413 -4.891 734 HG23 VAL 95 HG23 VAL 95 98.605 -0.584 -5.798 735 H GLN 96 H GLN 96 94.799 -3.868 -2.864 736 HA GLN 96 HA GLN 96 92.599 -3.031 -2.614 737 HB2 GLN 96 HB2 GLN 96 94.105 -0.790 -2.352 738 HB3 GLN 96 HB3 GLN 96 93.232 -0.382 -3.849 739 HG2 GLN 96 HG2 GLN 96 91.083 -1.038 -2.644 740 HG3 GLN 96 HG3 GLN 96 92.041 -1.130 -1.146 741 HE21 GLN 96 HE21 GLN 96 92.453 1.232 -3.844 742 HE22 GLN 96 HE22 GLN 96 92.078 2.635 -2.868 743 H GLY 97 H GLY 97 93.034 -4.585 -4.784 744 HA2 GLY 97 HA2 GLY 97 90.937 -4.012 -6.561 745 HA3 GLY 97 HA3 GLY 97 92.355 -3.230 -7.299 746 H PHE 98 H PHE 98 94.414 -4.915 -6.869 747 HA PHE 98 HA PHE 98 93.557 -7.327 -8.434 748 HB2 PHE 98 HB2 PHE 98 95.566 -5.770 -9.018 749 HB3 PHE 98 HB3 PHE 98 96.406 -6.603 -7.689 750 HD1 PHE 98 HD1 PHE 98 97.194 -8.845 -7.937 751 HD2 PHE 98 HD2 PHE 98 94.673 -7.109 -10.951 752 HE1 PHE 98 HE1 PHE 98 97.666 -10.764 -9.438 753 HE2 PHE 98 HE2 PHE 98 95.149 -9.024 -12.453 754 HZ PHE 98 HZ PHE 98 96.643 -10.851 -11.695 755 H GLU 99 H GLU 99 92.556 -7.668 -5.982 756 HA GLU 99 HA GLU 99 94.521 -8.901 -4.150 757 HB2 GLU 99 HB3 GLU 99 91.558 -9.407 -3.945 758 HB3 GLU 99 HB2 GLU 99 92.746 -9.098 -2.656 759 HG2 GLU 99 HG2 GLU 99 91.605 -7.059 -2.714 760 HG3 GLU 99 HG3 GLU 99 92.950 -6.730 -3.832 761 H SER 100 H SER 100 93.047 -11.192 -3.322 762 HA SER 100 HA SER 100 92.993 -12.903 -5.804 763 HB2 SER 100 HB2 SER 100 94.406 -13.792 -3.264 764 HB3 SER 100 HB3 SER 100 94.480 -14.525 -4.885 765 HG SER 100 HG SER 100 95.588 -12.664 -5.607 766 H ALA 101 H ALA 101 92.124 -15.173 -5.175 767 HA ALA 101 HA ALA 101 89.595 -14.748 -3.753 768 HB1 ALA 101 HB1 ALA 101 89.227 -17.162 -4.186 769 HB2 ALA 101 HB2 ALA 101 89.796 -16.329 -5.652 770 HB3 ALA 101 HB3 ALA 101 90.923 -17.327 -4.702 771 H THR 102 H THR 102 92.758 -16.093 -2.928 772 HA THR 102 HA THR 102 91.907 -17.450 -0.503 773 HB THR 102 HB THR 102 94.600 -16.205 -1.223 774 HG1 THR 102 HG1 THR 102 95.049 -18.404 -1.802 775 HG21 THR 102 HG21 THR 102 95.493 -17.763 0.487 776 HG22 THR 102 HG22 THR 102 93.837 -18.292 0.870 777 HG23 THR 102 HG23 THR 102 94.337 -16.617 1.209 778 H PHE 103 H PHE 103 93.010 -14.129 -1.204 779 HA PHE 103 HA PHE 103 92.972 -13.331 1.620 780 HB2 PHE 103 HB2 PHE 103 94.347 -12.079 0.052 781 HB3 PHE 103 HB3 PHE 103 92.935 -11.726 -0.973 782 HD1 PHE 103 HD1 PHE 103 94.081 -11.357 2.593 783 HD2 PHE 103 HD2 PHE 103 91.824 -9.698 -0.663 784 HE1 PHE 103 HE1 PHE 103 93.604 -9.338 3.954 785 HE2 PHE 103 HE2 PHE 103 91.347 -7.678 0.698 786 HZ PHE 103 HZ PHE 103 92.233 -7.501 3.007 787 H LEU 104 H LEU 104 90.770 -12.718 -1.167 788 HA LEU 104 HA LEU 104 88.767 -11.404 0.497 789 HB2 LEU 104 HB2 LEU 104 88.594 -12.756 -2.231 790 HB3 LEU 104 HB3 LEU 104 87.257 -11.847 -1.488 791 HG LEU 104 HG LEU 104 90.037 -10.712 -2.026 792 HD11 LEU 104 HD11 LEU 104 88.921 -9.449 -3.846 793 HD12 LEU 104 HD12 LEU 104 87.400 -10.309 -3.508 794 HD13 LEU 104 HD13 LEU 104 88.810 -11.204 -4.124 795 HD21 LEU 104 HD21 LEU 104 88.825 -9.664 -0.129 796 HD22 LEU 104 HD22 LEU 104 87.409 -9.408 -1.176 797 HD23 LEU 104 HD23 LEU 104 88.931 -8.550 -1.514 798 H GLY 105 H GLY 105 89.666 -14.705 0.013 799 HA2 GLY 105 HA3 GLY 105 87.005 -15.801 0.706 800 HA3 GLY 105 HA2 GLY 105 88.520 -16.724 0.561 801 H TYR 106 H TYR 106 90.115 -15.201 2.370 802 HA TYR 106 HA TYR 106 89.042 -16.284 4.914 803 HB2 TYR 106 HB2 TYR 106 91.564 -16.065 3.952 804 HB3 TYR 106 HB3 TYR 106 91.481 -14.544 4.872 805 HD1 TYR 106 HD1 TYR 106 90.500 -14.735 7.303 806 HD2 TYR 106 HD2 TYR 106 92.078 -18.050 5.075 807 HE1 TYR 106 HE1 TYR 106 90.837 -15.993 9.413 808 HE2 TYR 106 HE2 TYR 106 92.412 -19.309 7.185 809 HH TYR 106 HH TYR 106 92.765 -18.646 9.709 810 H PHE 107 H PHE 107 89.504 -13.137 3.353 811 HA PHE 107 HA PHE 107 88.479 -11.792 5.850 812 HB2 PHE 107 HB2 PHE 107 89.882 -10.812 3.343 813 HB3 PHE 107 HB3 PHE 107 89.040 -9.686 4.435 814 HD1 PHE 107 HD1 PHE 107 91.849 -12.069 4.108 815 HD2 PHE 107 HD2 PHE 107 89.871 -9.254 6.678 816 HE1 PHE 107 HE1 PHE 107 93.804 -12.090 5.634 817 HE2 PHE 107 HE2 PHE 107 91.824 -9.273 8.205 818 HZ PHE 107 HZ PHE 107 93.793 -10.688 7.681 819 H LYS 108 H LYS 108 86.253 -12.208 5.761 820 HA LYS 108 HA LYS 108 84.840 -11.509 3.203 821 HB2 LYS 108 HB2 LYS 108 82.845 -12.299 4.858 822 HB3 LYS 108 HB3 LYS 108 83.829 -13.451 3.924 823 HG2 LYS 108 HG2 LYS 108 85.103 -14.077 5.783 824 HG3 LYS 108 HG3 LYS 108 84.790 -12.549 6.641 825 HD2 LYS 108 HD2 LYS 108 82.475 -14.383 6.020 826 HD3 LYS 108 HD3 LYS 108 83.551 -14.779 7.381 827 HE2 LYS 108 HE2 LYS 108 83.193 -12.452 8.269 828 HE3 LYS 108 HE3 LYS 108 82.009 -12.179 6.969 829 HZ1 LYS 108 HZ1 LYS 108 80.947 -12.908 9.000 830 HZ2 LYS 108 HZ2 LYS 108 80.746 -14.040 7.818 831 HZ3 LYS 108 HZ3 LYS 108 81.843 -14.293 9.024 832 H SER 109 H SER 109 84.264 -10.928 6.708 833 HA SER 109 HA SER 109 83.071 -8.273 5.933 834 HB2 SER 109 HB3 SER 109 82.808 -10.133 8.293 835 HB3 SER 109 HB2 SER 109 82.482 -8.397 8.519 836 HG SER 109 HG SER 109 80.594 -9.581 7.873 837 H GLY 110 H GLY 110 86.056 -9.280 6.433 838 HA2 GLY 110 HA2 GLY 110 86.765 -7.161 8.459 839 HA3 GLY 110 HA3 GLY 110 87.828 -8.496 7.952 840 H LEU 111 H LEU 111 86.058 -5.731 6.473 841 HA LEU 111 HA LEU 111 88.610 -4.928 5.144 842 HB2 LEU 111 HB2 LEU 111 86.758 -4.586 3.098 843 HB3 LEU 111 HB3 LEU 111 87.981 -5.875 3.182 844 HG LEU 111 HG LEU 111 85.373 -6.262 4.644 845 HD11 LEU 111 HD11 LEU 111 84.359 -7.188 2.576 846 HD12 LEU 111 HD12 LEU 111 84.713 -5.453 2.395 847 HD13 LEU 111 HD13 LEU 111 85.782 -6.662 1.645 848 HD21 LEU 111 HD21 LEU 111 86.357 -8.493 3.077 849 HD22 LEU 111 HD22 LEU 111 87.700 -7.796 4.013 850 HD23 LEU 111 HD23 LEU 111 86.227 -8.348 4.846 851 H LYS 112 H LYS 112 88.591 -3.064 6.357 852 HA LYS 112 HA LYS 112 86.274 -1.192 5.812 853 HB2 LYS 112 HB2 LYS 112 87.026 -2.137 8.292 854 HB3 LYS 112 HB3 LYS 112 87.977 -0.637 8.181 855 HG2 LYS 112 HG2 LYS 112 85.944 0.123 9.086 856 HG3 LYS 112 HG3 LYS 112 85.722 0.426 7.346 857 HD2 LYS 112 HD2 LYS 112 84.430 -1.609 7.088 858 HD3 LYS 112 HD3 LYS 112 84.805 -2.117 8.752 859 HE2 LYS 112 HE3 LYS 112 83.440 -0.426 9.701 860 HE3 LYS 112 HE2 LYS 112 83.408 0.517 8.192 861 HZ1 LYS 112 HZ1 LYS 112 81.352 -0.684 8.536 862 HZ2 LYS 112 HZ2 LYS 112 82.121 -1.250 7.191 863 HZ3 LYS 112 HZ3 LYS 112 82.152 -2.125 8.589 864 H TYR 113 H TYR 113 86.956 0.326 4.391 865 HA TYR 113 HA TYR 113 89.850 0.892 4.113 866 HB2 TYR 113 HB3 TYR 113 87.689 2.543 2.803 867 HB3 TYR 113 HB2 TYR 113 89.266 2.031 2.157 868 HD1 TYR 113 HD1 TYR 113 89.246 -0.866 2.783 869 HD2 TYR 113 HD2 TYR 113 86.118 1.664 1.277 870 HE1 TYR 113 HE1 TYR 113 88.170 -2.831 1.718 871 HE2 TYR 113 HE2 TYR 113 85.043 -0.300 0.209 872 HH TYR 113 HH TYR 113 85.713 -3.431 0.975 873 H LYS 114 H LYS 114 90.753 2.117 5.710 874 HA LYS 114 HA LYS 114 89.187 4.542 6.619 875 HB2 LYS 114 HB2 LYS 114 91.020 2.619 7.996 876 HB3 LYS 114 HB3 LYS 114 91.167 4.329 8.467 877 HG2 LYS 114 HG2 LYS 114 88.428 3.072 8.257 878 HG3 LYS 114 HG3 LYS 114 89.422 2.775 9.703 879 HD2 LYS 114 HD2 LYS 114 89.379 5.010 10.359 880 HD3 LYS 114 HD3 LYS 114 89.133 5.602 8.699 881 HE2 LYS 114 HE2 LYS 114 87.072 5.866 10.051 882 HE3 LYS 114 HE3 LYS 114 86.819 4.708 8.724 883 HZ1 LYS 114 HZ1 LYS 114 85.967 3.869 10.811 884 HZ2 LYS 114 HZ2 LYS 114 87.450 4.001 11.520 885 HZ3 LYS 114 HZ3 LYS 114 87.217 2.927 10.290 886 H LYS 115 H LYS 115 89.872 6.274 5.438 887 HA LYS 115 HA LYS 115 92.477 6.429 4.177 888 HB2 LYS 115 HB2 LYS 115 91.909 8.823 3.824 889 HB3 LYS 115 HB3 LYS 115 90.538 7.763 3.415 890 HG2 LYS 115 HG3 LYS 115 89.683 8.152 5.790 891 HG3 LYS 115 HG2 LYS 115 90.929 9.414 5.945 892 HD2 LYS 115 HD2 LYS 115 89.986 10.647 4.062 893 HD3 LYS 115 HD3 LYS 115 88.824 9.338 3.739 894 HE2 LYS 115 HE3 LYS 115 87.708 9.722 5.867 895 HE3 LYS 115 HE2 LYS 115 88.956 10.891 6.361 896 HZ1 LYS 115 HZ1 LYS 115 86.996 11.991 5.505 897 HZ2 LYS 115 HZ2 LYS 115 88.286 12.286 4.521 898 HZ3 LYS 115 HZ3 LYS 115 87.129 11.203 4.062 899 H GLY 116 H GLY 116 94.418 7.213 4.916 900 HA2 GLY 116 HA2 GLY 116 95.193 9.082 6.681 901 HA3 GLY 116 HA3 GLY 116 94.516 7.910 7.837 902 H GLY 117 H GLY 117 97.385 8.911 6.873 903 HA2 GLY 117 HA2 GLY 117 98.555 6.136 7.051 904 HA3 GLY 117 HA3 GLY 117 99.126 7.247 5.783 905 H VAL 118 H VAL 118 99.375 6.348 9.117 906 HA VAL 118 HA VAL 118 100.311 8.622 10.438 907 HB VAL 118 HB VAL 118 101.647 5.878 10.457 908 HG11 VAL 118 HG11 VAL 118 103.008 7.659 11.519 909 HG12 VAL 118 HG12 VAL 118 101.609 8.138 12.508 910 HG13 VAL 118 HG13 VAL 118 102.357 6.539 12.739 911 HG21 VAL 118 HG21 VAL 118 100.139 5.448 12.379 912 HG22 VAL 118 HG22 VAL 118 99.209 5.792 10.901 913 HG23 VAL 118 HG23 VAL 118 99.392 7.047 12.150 914 H ALA 119 H ALA 119 101.918 6.841 7.835 915 HA ALA 119 HA ALA 119 104.447 8.341 8.168 916 HB1 ALA 119 HB1 ALA 119 105.095 7.213 6.056 917 HB2 ALA 119 HB2 ALA 119 104.427 6.049 7.224 918 HB3 ALA 119 HB3 ALA 119 103.429 6.616 5.864 919 H SER 120 H SER 120 101.487 8.589 6.242 920 HA SER 120 HA SER 120 102.676 10.981 4.842 921 HB2 SER 120 HB2 SER 120 101.564 9.081 3.517 922 HB3 SER 120 HB3 SER 120 100.023 9.639 4.213 923 HG SER 120 HG SER 120 100.498 10.647 2.178 924 H GLY 121 H GLY 121 101.182 10.363 7.606 925 HA2 GLY 121 HA2 GLY 121 99.002 12.365 7.469 926 HA3 GLY 121 HA3 GLY 121 99.547 11.497 8.923 927 H PHE 122 H PHE 122 102.418 12.328 8.132 928 HA PHE 122 HA PHE 122 102.372 14.827 9.717 929 HB2 PHE 122 HB2 PHE 122 104.504 13.048 8.522 930 HB3 PHE 122 HB3 PHE 122 104.932 14.685 9.076 931 HD1 PHE 122 HD1 PHE 122 104.300 11.289 10.070 932 HD2 PHE 122 HD2 PHE 122 104.211 15.349 11.470 933 HE1 PHE 122 HE1 PHE 122 104.347 10.482 12.417 934 HE2 PHE 122 HE2 PHE 122 104.255 14.543 13.814 935 HZ PHE 122 HZ PHE 122 104.324 12.111 14.288 936 H LYS 123 H LYS 123 102.390 13.942 6.351 937 HA LYS 123 HA LYS 123 103.716 16.172 5.178 938 HB2 LYS 123 HB3 LYS 123 101.334 14.500 4.330 939 HB3 LYS 123 HB2 LYS 123 101.897 15.858 3.327 940 HG2 LYS 123 HG3 LYS 123 104.211 14.843 3.382 941 HG3 LYS 123 HG2 LYS 123 103.515 13.429 4.208 942 HD2 LYS 123 HD2 LYS 123 102.035 12.992 2.311 943 HD3 LYS 123 HD3 LYS 123 102.584 14.478 1.500 944 HE2 LYS 123 HE3 LYS 123 104.355 12.099 2.219 945 HE3 LYS 123 HE2 LYS 123 103.727 12.463 0.593 946 HZ1 LYS 123 HZ1 LYS 123 105.956 13.313 0.898 947 HZ2 LYS 123 HZ2 LYS 123 105.480 14.223 2.188 948 HZ3 LYS 123 HZ3 LYS 123 104.899 14.560 0.682 949 H HIS 124 H HIS 124 100.221 15.887 6.018 950 HA HIS 124 HA HIS 124 100.044 18.883 5.767 951 HB2 HIS 124 HB2 HIS 124 98.031 16.622 5.782 952 HB3 HIS 124 HB3 HIS 124 97.514 18.283 6.158 953 HD2 HIS 124 HD2 HIS 124 99.040 16.287 3.090 954 HE1 HIS 124 HE1 HIS 124 97.643 20.024 1.707 955 HE2 HIS 124 HE2 HIS 124 98.612 17.778 0.974 956 H VAL 125 H VAL 125 98.605 19.949 7.490 957 HA VAL 125 HA VAL 125 99.737 19.250 10.126 958 HB VAL 125 HB VAL 125 97.485 21.225 9.658 959 HG11 VAL 125 HG11 VAL 125 98.256 20.786 11.974 960 HG12 VAL 125 HG12 VAL 125 98.675 22.438 11.463 961 HG13 VAL 125 HG13 VAL 125 99.925 21.171 11.491 962 HG21 VAL 125 HG21 VAL 125 99.513 22.859 9.305 963 HG22 VAL 125 HG22 VAL 125 98.929 21.900 7.925 964 HG23 VAL 125 HG23 VAL 125 100.386 21.389 8.810 965 H VAL 126 H VAL 126 98.580 18.480 11.940 966 HA VAL 126 HA VAL 126 95.773 17.518 11.367 967 HB VAL 126 HB VAL 126 97.847 15.891 12.888 968 HG11 VAL 126 HG11 VAL 126 95.459 15.419 13.361 969 HG12 VAL 126 HG12 VAL 126 96.216 14.069 12.483 970 HG13 VAL 126 HG13 VAL 126 95.156 15.210 11.620 971 HG21 VAL 126 HG21 VAL 126 98.580 16.182 10.536 972 HG22 VAL 126 HG22 VAL 126 98.036 14.514 10.835 973 HG23 VAL 126 HG23 VAL 126 96.977 15.654 9.972 974 HA PRO 127 HA PRO 127 96.228 20.164 15.247 975 HB2 PRO 127 HB3 PRO 127 93.379 20.608 14.386 976 HB3 PRO 127 HB2 PRO 127 94.584 21.790 14.973 977 HG2 PRO 127 HG3 PRO 127 93.916 21.586 12.378 978 HG3 PRO 127 HG2 PRO 127 95.570 22.001 12.902 979 HD2 PRO 127 HD3 PRO 127 94.516 19.440 11.751 980 HD3 PRO 127 HD2 PRO 127 96.161 20.136 11.648 981 H ASN 128 H ASN 128 95.297 19.755 17.314 982 HA ASN 128 HA ASN 128 94.164 17.056 17.607 983 HB2 ASN 128 HB2 ASN 128 94.652 19.334 19.572 984 HB3 ASN 128 HB3 ASN 128 94.012 17.744 20.052 985 HD21 ASN 128 HD21 ASN 128 96.029 17.222 17.402 986 HD22 ASN 128 HD22 ASN 128 97.505 16.850 18.265 987 H GLU 129 H GLU 129 92.041 16.487 18.101 988 HA GLU 129 HA GLU 129 89.983 18.456 17.342 989 HB2 GLU 129 HB2 GLU 129 89.469 15.775 18.670 990 HB3 GLU 129 HB3 GLU 129 88.448 16.651 17.505 991 HG2 GLU 129 HG2 GLU 129 91.149 15.349 16.946 992 HG3 GLU 129 HG3 GLU 129 89.562 14.804 16.353 993 H VAL 130 H VAL 130 91.395 17.263 20.329 994 HA VAL 130 HA VAL 130 89.232 18.047 22.099 995 HB VAL 130 HB VAL 130 92.232 17.957 22.651 996 HG11 VAL 130 HG11 VAL 130 90.913 19.166 24.369 997 HG12 VAL 130 HG12 VAL 130 89.806 17.779 24.495 998 HG13 VAL 130 HG13 VAL 130 91.505 17.609 24.996 999 HG21 VAL 130 HG21 VAL 130 91.358 15.826 21.733 1000 HG22 VAL 130 HG22 VAL 130 90.065 15.830 22.956 1001 HG23 VAL 130 HG23 VAL 130 91.765 15.660 23.457 1002 H VAL 131 H VAL 131 91.702 19.843 20.390 1003 HA VAL 131 HA VAL 131 91.592 22.205 22.128 1004 HB VAL 131 HB VAL 131 92.538 21.746 19.270 1005 HG11 VAL 131 HG11 VAL 131 91.725 24.076 19.513 1006 HG12 VAL 131 HG12 VAL 131 93.500 24.028 19.395 1007 HG13 VAL 131 HG13 VAL 131 92.720 24.271 20.976 1008 HG21 VAL 131 HG21 VAL 131 94.763 22.081 20.317 1009 HG22 VAL 131 HG22 VAL 131 93.887 20.739 21.092 1010 HG23 VAL 131 HG23 VAL 131 93.982 22.322 21.898 1011 H VAL 132 H VAL 132 89.760 21.025 19.342 1012 HA VAL 132 HA VAL 132 88.458 23.578 18.772 1013 HB VAL 132 HB VAL 132 87.688 20.691 18.171 1014 HG11 VAL 132 HG11 VAL 132 85.668 22.125 18.274 1015 HG12 VAL 132 HG12 VAL 132 86.035 21.657 16.597 1016 HG13 VAL 132 HG13 VAL 132 86.441 23.291 17.173 1017 HG21 VAL 132 HG21 VAL 132 88.403 21.322 15.881 1018 HG22 VAL 132 HG22 VAL 132 89.726 21.549 17.049 1019 HG23 VAL 132 HG23 VAL 132 88.810 22.956 16.459 1020 H GLN 133 H GLN 133 87.861 20.925 21.028 1021 HA GLN 133 HA GLN 133 85.296 22.285 21.860 1022 HB2 GLN 133 HB3 GLN 133 85.476 19.732 21.291 1023 HB3 GLN 133 HB2 GLN 133 86.260 19.602 22.884 1024 HG2 GLN 133 HG2 GLN 133 84.261 20.837 23.858 1025 HG3 GLN 133 HG3 GLN 133 83.471 20.668 22.272 1026 HE21 GLN 133 HE21 GLN 133 84.832 18.791 25.027 1027 HE22 GLN 133 HE22 GLN 133 83.931 17.334 24.675 Start of MODEL 10 1 H1 GLU 1 H1 GLU 1 116.360 -11.145 18.617 2 H2 GLU 1 H2 GLU 1 114.858 -11.377 17.976 3 H3 GLU 1 H3 GLU 1 115.030 -10.571 19.405 4 HA GLU 1 HA GLU 1 115.330 -13.440 18.869 5 HB2 GLU 1 HB2 GLU 1 116.513 -11.783 21.129 6 HB3 GLU 1 HB3 GLU 1 116.196 -13.527 21.291 7 HG2 GLU 1 HG2 GLU 1 117.602 -13.938 19.263 8 HG3 GLU 1 HG3 GLU 1 117.969 -12.198 19.193 9 H HIS 2 H HIS 2 113.852 -10.651 20.413 10 HA HIS 2 HA HIS 2 111.968 -12.420 21.929 11 HB2 HIS 2 HB2 HIS 2 113.063 -9.999 22.559 12 HB3 HIS 2 HB3 HIS 2 111.522 -9.472 21.841 13 HD2 HIS 2 HD2 HIS 2 109.298 -11.304 23.044 14 HE1 HIS 2 HE1 HIS 2 111.219 -11.096 26.800 15 HE2 HIS 2 HE2 HIS 2 109.029 -11.692 25.627 16 HA PRO 3 HA PRO 3 109.197 -9.942 18.694 17 HB2 PRO 3 HB2 PRO 3 111.105 -9.967 16.392 18 HB3 PRO 3 HB3 PRO 3 110.024 -8.664 16.962 19 HG2 PRO 3 HG2 PRO 3 112.691 -8.569 17.315 20 HG3 PRO 3 HG3 PRO 3 111.543 -7.890 18.501 21 HD2 PRO 3 HD3 PRO 3 113.115 -10.462 18.622 22 HD3 PRO 3 HD2 PRO 3 112.696 -9.325 19.941 23 H GLU 4 H GLU 4 107.855 -11.657 18.327 24 HA GLU 4 HA GLU 4 108.772 -14.232 17.355 25 HB2 GLU 4 HB3 GLU 4 106.264 -14.582 16.912 26 HB3 GLU 4 HB2 GLU 4 106.718 -14.175 18.585 27 HG2 GLU 4 HG2 GLU 4 106.024 -11.897 18.323 28 HG3 GLU 4 HG3 GLU 4 105.918 -12.055 16.553 29 H PHE 5 H PHE 5 108.237 -11.255 15.754 30 HA PHE 5 HA PHE 5 107.178 -12.008 13.237 31 HB2 PHE 5 HB2 PHE 5 107.658 -9.691 13.646 32 HB3 PHE 5 HB3 PHE 5 109.375 -10.032 13.967 33 HD1 PHE 5 HD1 PHE 5 110.780 -9.317 12.261 34 HD2 PHE 5 HD2 PHE 5 106.923 -10.911 11.243 35 HE1 PHE 5 HE1 PHE 5 111.290 -9.013 9.852 36 HE2 PHE 5 HE2 PHE 5 107.433 -10.607 8.835 37 HZ PHE 5 HZ PHE 5 109.618 -9.659 8.140 38 H LEU 6 H LEU 6 110.235 -12.871 14.689 39 HA LEU 6 HA LEU 6 111.636 -13.530 12.222 40 HB2 LEU 6 HB3 LEU 6 111.934 -14.272 15.135 41 HB3 LEU 6 HB2 LEU 6 112.875 -15.150 13.906 42 HG LEU 6 HG LEU 6 112.810 -12.137 13.801 43 HD11 LEU 6 HD11 LEU 6 113.289 -12.670 16.175 44 HD12 LEU 6 HD12 LEU 6 114.572 -13.793 15.664 45 HD13 LEU 6 HD13 LEU 6 114.741 -12.048 15.355 46 HD21 LEU 6 HD21 LEU 6 113.907 -13.468 12.016 47 HD22 LEU 6 HD22 LEU 6 114.933 -14.258 13.237 48 HD23 LEU 6 HD23 LEU 6 115.102 -12.514 12.928 49 H LYS 7 H LYS 7 109.100 -15.084 14.038 50 HA LYS 7 HA LYS 7 109.568 -17.640 12.497 51 HB2 LYS 7 HB2 LYS 7 108.367 -16.956 15.133 52 HB3 LYS 7 HB3 LYS 7 107.482 -18.184 14.199 53 HG2 LYS 7 HG3 LYS 7 109.130 -19.326 15.577 54 HG3 LYS 7 HG2 LYS 7 109.671 -19.414 13.883 55 HD2 LYS 7 HD2 LYS 7 111.640 -18.725 14.921 56 HD3 LYS 7 HD3 LYS 7 110.923 -17.149 14.511 57 HE2 LYS 7 HE2 LYS 7 111.702 -17.177 16.860 58 HE3 LYS 7 HE3 LYS 7 109.931 -17.014 16.783 59 HZ1 LYS 7 HZ1 LYS 7 110.603 -18.671 18.392 60 HZ2 LYS 7 HZ2 LYS 7 111.404 -19.533 17.236 61 HZ3 LYS 7 HZ3 LYS 7 109.763 -19.383 17.164 62 H ALA 8 H ALA 8 106.839 -15.542 13.548 63 HA ALA 8 HA ALA 8 104.835 -15.016 12.416 64 HB1 ALA 8 HB1 ALA 8 106.836 -15.398 10.197 65 HB2 ALA 8 HB2 ALA 8 105.114 -15.263 9.769 66 HB3 ALA 8 HB3 ALA 8 105.917 -13.945 10.656 67 H GLY 9 H GLY 9 102.971 -16.171 12.061 68 HA2 GLY 9 HA2 GLY 9 101.646 -18.123 11.864 69 HA3 GLY 9 HA3 GLY 9 102.657 -18.472 10.442 70 H LYS 10 H LYS 10 104.087 -18.185 13.646 71 HA LYS 10 HA LYS 10 105.566 -20.548 13.598 72 HB2 LYS 10 HB3 LYS 10 104.877 -20.548 16.229 73 HB3 LYS 10 HB2 LYS 10 106.030 -19.386 15.532 74 HG2 LYS 10 HG2 LYS 10 104.326 -17.699 15.307 75 HG3 LYS 10 HG3 LYS 10 103.033 -18.866 15.673 76 HD2 LYS 10 HD3 LYS 10 103.859 -19.129 17.962 77 HD3 LYS 10 HD2 LYS 10 105.255 -18.081 17.611 78 HE2 LYS 10 HE2 LYS 10 103.425 -16.322 16.913 79 HE3 LYS 10 HE3 LYS 10 102.333 -17.339 17.884 80 HZ1 LYS 10 HZ1 LYS 10 103.349 -15.607 19.209 81 HZ2 LYS 10 HZ2 LYS 10 104.861 -16.146 18.833 82 HZ3 LYS 10 HZ3 LYS 10 103.850 -17.088 19.733 83 H GLU 11 H GLU 11 102.111 -20.244 13.841 84 HA GLU 11 HA GLU 11 101.955 -23.251 14.128 85 HB2 GLU 11 HB3 GLU 11 99.568 -22.420 15.191 86 HB3 GLU 11 HB2 GLU 11 101.008 -22.798 16.167 87 HG2 GLU 11 HG2 GLU 11 101.616 -20.510 16.364 88 HG3 GLU 11 HG3 GLU 11 100.557 -20.024 15.018 89 HA PRO 12 HA PRO 12 99.502 -23.210 10.475 90 HB2 PRO 12 HB3 PRO 12 97.408 -24.922 11.230 91 HB3 PRO 12 HB2 PRO 12 99.004 -25.451 10.628 92 HG2 PRO 12 HG2 PRO 12 97.961 -25.294 13.424 93 HG3 PRO 12 HG3 PRO 12 99.074 -26.476 12.680 94 HD2 PRO 12 HD3 PRO 12 99.934 -24.474 14.341 95 HD3 PRO 12 HD2 PRO 12 100.944 -25.118 13.010 96 H GLY 13 H GLY 13 98.270 -21.497 9.850 97 HA2 GLY 13 HA3 GLY 13 95.590 -21.052 10.264 98 HA3 GLY 13 HA2 GLY 13 96.281 -20.364 11.752 99 H LEU 14 H LEU 14 95.663 -18.218 11.177 100 HA LEU 14 HA LEU 14 97.404 -17.049 8.999 101 HB2 LEU 14 HB2 LEU 14 95.178 -17.144 8.056 102 HB3 LEU 14 HB3 LEU 14 94.456 -16.508 9.553 103 HG LEU 14 HG LEU 14 96.582 -14.792 8.387 104 HD11 LEU 14 HD11 LEU 14 95.510 -15.627 6.311 105 HD12 LEU 14 HD12 LEU 14 93.913 -15.176 6.956 106 HD13 LEU 14 HD13 LEU 14 95.115 -13.914 6.592 107 HD21 LEU 14 HD21 LEU 14 95.151 -14.134 10.306 108 HD22 LEU 14 HD22 LEU 14 94.906 -13.044 8.920 109 HD23 LEU 14 HD23 LEU 14 93.704 -14.306 9.283 110 H GLN 15 H GLN 15 98.258 -14.999 9.477 111 HA GLN 15 HA GLN 15 97.468 -13.822 12.141 112 HB2 GLN 15 HB2 GLN 15 100.316 -14.359 11.184 113 HB3 GLN 15 HB3 GLN 15 99.885 -13.437 12.644 114 HG2 GLN 15 HG2 GLN 15 98.449 -15.634 13.170 115 HG3 GLN 15 HG3 GLN 15 99.658 -16.389 12.104 116 HE21 GLN 15 HE21 GLN 15 101.820 -16.630 12.892 117 HE22 GLN 15 HE22 GLN 15 102.285 -16.164 14.513 118 H ILE 16 H ILE 16 97.743 -11.546 12.265 119 HA ILE 16 HA ILE 16 98.424 -10.251 9.611 120 HB ILE 16 HB ILE 16 96.614 -8.831 11.520 121 HG12 ILE 16 HG13 ILE 16 95.839 -11.360 10.008 122 HG13 ILE 16 HG12 ILE 16 95.655 -11.032 11.748 123 HG21 ILE 16 HG21 ILE 16 97.430 -8.243 9.063 124 HG22 ILE 16 HG22 ILE 16 96.115 -9.344 8.589 125 HG23 ILE 16 HG23 ILE 16 95.757 -7.896 9.559 126 HD11 ILE 16 HD11 ILE 16 93.492 -10.593 10.984 127 HD12 ILE 16 HD12 ILE 16 94.061 -9.964 9.420 128 HD13 ILE 16 HD13 ILE 16 94.219 -8.971 10.889 129 H TRP 17 H TRP 17 99.835 -8.519 9.686 130 HA TRP 17 HA TRP 17 100.517 -7.395 12.392 131 HB2 TRP 17 HB2 TRP 17 102.630 -8.347 10.410 132 HB3 TRP 17 HB3 TRP 17 102.903 -7.692 12.042 133 HD1 TRP 17 HD1 TRP 17 101.036 -9.220 13.843 134 HE1 TRP 17 HE1 TRP 17 101.152 -11.773 14.187 135 HE3 TRP 17 HE3 TRP 17 103.506 -10.509 9.560 136 HZ2 TRP 17 HZ2 TRP 17 102.186 -14.062 12.773 137 HZ3 TRP 17 HZ3 TRP 17 104.043 -12.879 9.087 138 HH2 TRP 17 HH2 TRP 17 103.388 -14.655 10.685 139 H ARG 18 H ARG 18 100.066 -5.261 12.085 140 HA ARG 18 HA ARG 18 100.205 -4.006 9.442 141 HB2 ARG 18 HB3 ARG 18 98.647 -3.102 11.044 142 HB3 ARG 18 HB2 ARG 18 99.926 -2.897 12.265 143 HG2 ARG 18 HG2 ARG 18 100.959 -1.126 11.030 144 HG3 ARG 18 HG3 ARG 18 100.017 -1.496 9.566 145 HD2 ARG 18 HD3 ARG 18 98.244 -0.262 10.276 146 HD3 ARG 18 HD2 ARG 18 98.320 -0.952 11.915 147 HE ARG 18 HE ARG 18 99.643 1.551 10.994 148 HH11 ARG 18 HH11 ARG 18 100.605 2.728 12.668 149 HH12 ARG 18 HH12 ARG 18 100.809 1.999 14.245 150 HH21 ARG 18 HH21 ARG 18 99.366 -1.032 13.313 151 HH22 ARG 18 HH22 ARG 18 100.110 -0.122 14.609 152 H VAL 19 H VAL 19 101.879 -2.868 8.511 153 HA VAL 19 HA VAL 19 104.533 -3.128 9.782 154 HB VAL 19 HB VAL 19 104.150 -1.339 7.416 155 HG11 VAL 19 HG11 VAL 19 106.388 -1.963 8.282 156 HG12 VAL 19 HG12 VAL 19 106.133 -2.604 6.642 157 HG13 VAL 19 HG13 VAL 19 105.997 -3.684 8.051 158 HG21 VAL 19 HG21 VAL 19 104.012 -3.479 5.979 159 HG22 VAL 19 HG22 VAL 19 103.483 -4.305 7.463 160 HG23 VAL 19 HG23 VAL 19 102.516 -2.969 6.796 161 H GLU 20 H GLU 20 105.790 -1.480 10.643 162 HA GLU 20 HA GLU 20 104.836 1.322 10.562 163 HB2 GLU 20 HB2 GLU 20 103.549 -0.019 12.443 164 HB3 GLU 20 HB3 GLU 20 105.088 0.122 13.325 165 HG2 GLU 20 HG3 GLU 20 103.517 2.446 12.125 166 HG3 GLU 20 HG2 GLU 20 103.561 2.012 13.850 167 H LYS 21 H LYS 21 106.944 1.671 9.683 168 HA LYS 21 HA LYS 21 109.235 2.221 9.881 169 HB2 LYS 21 HB2 LYS 21 108.068 2.704 12.460 170 HB3 LYS 21 HB3 LYS 21 109.658 1.947 12.718 171 HG2 LYS 21 HG3 LYS 21 109.223 4.286 10.817 172 HG3 LYS 21 HG2 LYS 21 109.672 4.497 12.526 173 HD2 LYS 21 HD2 LYS 21 111.788 3.556 12.228 174 HD3 LYS 21 HD3 LYS 21 111.280 2.607 10.810 175 HE2 LYS 21 HE2 LYS 21 111.525 5.648 10.859 176 HE3 LYS 21 HE3 LYS 21 112.765 4.546 10.215 177 HZ1 LYS 21 HZ1 LYS 21 111.304 5.350 8.485 178 HZ2 LYS 21 HZ2 LYS 21 111.130 3.719 8.661 179 HZ3 LYS 21 HZ3 LYS 21 109.981 4.740 9.257 180 H PHE 22 H PHE 22 108.246 -0.609 9.729 181 HA PHE 22 HA PHE 22 109.337 -2.710 9.632 182 HB2 PHE 22 HB2 PHE 22 111.813 -1.601 10.943 183 HB3 PHE 22 HB3 PHE 22 111.664 -2.778 9.616 184 HD1 PHE 22 HD1 PHE 22 109.718 -1.296 7.866 185 HD2 PHE 22 HD2 PHE 22 113.212 0.059 9.967 186 HE1 PHE 22 HE1 PHE 22 110.003 0.532 6.216 187 HE2 PHE 22 HE2 PHE 22 113.495 1.887 8.317 188 HZ PHE 22 HZ PHE 22 111.893 2.123 6.439 189 H ASP 23 H ASP 23 108.119 -1.317 12.164 190 HA ASP 23 HA ASP 23 109.392 -3.092 14.237 191 HB2 ASP 23 HB2 ASP 23 107.341 -0.846 14.477 192 HB3 ASP 23 HB3 ASP 23 108.003 -1.775 15.844 193 H LEU 24 H LEU 24 106.709 -2.927 12.105 194 HA LEU 24 HA LEU 24 104.788 -4.284 11.910 195 HB2 LEU 24 HB2 LEU 24 106.550 -6.049 13.656 196 HB3 LEU 24 HB3 LEU 24 104.975 -6.580 13.018 197 HG LEU 24 HG LEU 24 106.986 -5.375 11.118 198 HD11 LEU 24 HD11 LEU 24 108.269 -7.054 12.418 199 HD12 LEU 24 HD12 LEU 24 107.004 -8.265 12.103 200 HD13 LEU 24 HD13 LEU 24 107.974 -7.620 10.757 201 HD21 LEU 24 HD21 LEU 24 104.683 -5.924 10.373 202 HD22 LEU 24 HD22 LEU 24 104.912 -7.606 10.910 203 HD23 LEU 24 HD23 LEU 24 105.882 -6.961 9.564 204 H VAL 25 H VAL 25 102.790 -4.282 12.879 205 HA VAL 25 HA VAL 25 102.688 -4.175 15.884 206 HB VAL 25 HB VAL 25 101.557 -2.093 13.969 207 HG11 VAL 25 HG11 VAL 25 99.808 -2.780 15.587 208 HG12 VAL 25 HG12 VAL 25 100.403 -1.142 15.946 209 HG13 VAL 25 HG13 VAL 25 100.948 -2.522 16.929 210 HG21 VAL 25 HG21 VAL 25 102.780 -0.542 15.470 211 HG22 VAL 25 HG22 VAL 25 103.880 -1.753 14.769 212 HG23 VAL 25 HG23 VAL 25 103.326 -1.923 16.452 213 HA PRO 26 HA PRO 26 99.617 -7.308 14.784 214 HB2 PRO 26 HB2 PRO 26 98.721 -6.575 17.571 215 HB3 PRO 26 HB3 PRO 26 98.989 -8.188 16.848 216 HG2 PRO 26 HG2 PRO 26 100.755 -7.069 18.539 217 HG3 PRO 26 HG3 PRO 26 101.258 -8.112 17.181 218 HD2 PRO 26 HD3 PRO 26 101.522 -5.151 17.500 219 HD3 PRO 26 HD2 PRO 26 102.503 -6.279 16.516 220 H VAL 27 H VAL 27 97.472 -7.218 14.078 221 HA VAL 27 HA VAL 27 96.282 -4.510 13.933 222 HB VAL 27 HB VAL 27 95.529 -7.257 12.879 223 HG11 VAL 27 HG11 VAL 27 93.657 -5.840 11.685 224 HG12 VAL 27 HG12 VAL 27 93.849 -4.749 13.079 225 HG13 VAL 27 HG13 VAL 27 93.371 -6.445 13.335 226 HG21 VAL 27 HG21 VAL 27 97.257 -5.937 11.684 227 HG22 VAL 27 HG22 VAL 27 95.777 -6.090 10.707 228 HG23 VAL 27 HG23 VAL 27 96.125 -4.568 11.562 229 HA PRO 28 HA PRO 28 94.106 -4.763 17.847 230 HB2 PRO 28 HB3 PRO 28 92.095 -3.189 16.237 231 HB3 PRO 28 HB2 PRO 28 92.744 -2.860 17.870 232 HG2 PRO 28 HG2 PRO 28 93.584 -1.530 15.679 233 HG3 PRO 28 HG3 PRO 28 94.665 -1.904 17.049 234 HD2 PRO 28 HD3 PRO 28 94.612 -3.072 14.308 235 HD3 PRO 28 HD2 PRO 28 95.954 -3.013 15.490 236 H THR 29 H THR 29 93.192 -6.742 18.252 237 HA THR 29 HA THR 29 91.488 -8.145 16.379 238 HB THR 29 HB THR 29 91.925 -8.415 19.379 239 HG1 THR 29 HG1 THR 29 93.043 -10.297 18.615 240 HG21 THR 29 HG21 THR 29 90.805 -10.712 18.966 241 HG22 THR 29 HG22 THR 29 90.147 -9.984 17.481 242 HG23 THR 29 HG23 THR 29 89.733 -9.294 19.069 243 H ASN 30 H ASN 30 90.857 -5.677 18.794 244 HA ASN 30 HA ASN 30 88.148 -6.058 19.415 245 HB2 ASN 30 HB2 ASN 30 89.786 -3.591 18.820 246 HB3 ASN 30 HB3 ASN 30 88.034 -3.431 19.090 247 HD21 ASN 30 HD21 ASN 30 87.562 -5.377 21.067 248 HD22 ASN 30 HD22 ASN 30 88.466 -4.966 22.507 249 H LEU 31 H LEU 31 89.522 -4.776 16.371 250 HA LEU 31 HA LEU 31 86.735 -4.818 15.215 251 HB2 LEU 31 HB3 LEU 31 89.296 -3.609 14.080 252 HB3 LEU 31 HB2 LEU 31 87.655 -3.426 13.417 253 HG LEU 31 HG LEU 31 88.570 -2.495 16.176 254 HD11 LEU 31 HD11 LEU 31 89.490 -1.131 14.318 255 HD12 LEU 31 HD12 LEU 31 87.853 -0.945 13.646 256 HD13 LEU 31 HD13 LEU 31 88.253 -0.226 15.224 257 HD21 LEU 31 HD21 LEU 31 86.228 -1.240 15.774 258 HD22 LEU 31 HD22 LEU 31 86.303 -2.864 16.498 259 HD23 LEU 31 HD23 LEU 31 85.918 -2.676 14.770 260 H TYR 32 H TYR 32 90.109 -5.682 14.306 261 HA TYR 32 HA TYR 32 90.877 -7.418 12.903 262 HB2 TYR 32 HB2 TYR 32 89.542 -8.658 14.800 263 HB3 TYR 32 HB3 TYR 32 88.337 -8.942 13.521 264 HD1 TYR 32 HD1 TYR 32 88.710 -10.569 11.828 265 HD2 TYR 32 HD2 TYR 32 91.933 -9.411 14.418 266 HE1 TYR 32 HE1 TYR 32 90.091 -12.422 10.933 267 HE2 TYR 32 HE2 TYR 32 93.318 -11.263 13.524 268 HH TYR 32 HH TYR 32 92.805 -13.587 12.388 269 H GLY 33 H GLY 33 90.701 -6.405 10.887 270 HA2 GLY 33 HA3 GLY 33 89.719 -7.178 8.647 271 HA3 GLY 33 HA2 GLY 33 88.121 -6.967 9.401 272 H ASP 34 H ASP 34 88.974 -4.535 10.880 273 HA ASP 34 HA ASP 34 88.621 -2.642 8.593 274 HB2 ASP 34 HB3 ASP 34 88.789 -1.948 11.549 275 HB3 ASP 34 HB2 ASP 34 88.013 -1.020 10.243 276 H PHE 35 H PHE 35 90.284 -1.455 7.762 277 HA PHE 35 HA PHE 35 92.657 -0.928 9.518 278 HB2 PHE 35 HB2 PHE 35 93.921 -1.600 7.169 279 HB3 PHE 35 HB3 PHE 35 93.747 -2.693 8.562 280 HD1 PHE 35 HD1 PHE 35 93.300 -4.836 7.734 281 HD2 PHE 35 HD2 PHE 35 91.254 -1.466 6.030 282 HE1 PHE 35 HE1 PHE 35 91.917 -6.370 6.361 283 HE2 PHE 35 HE2 PHE 35 89.873 -2.998 4.654 284 HZ PHE 35 HZ PHE 35 90.205 -5.452 4.820 285 H PHE 36 H PHE 36 94.212 0.606 8.358 286 HA PHE 36 HA PHE 36 92.569 2.727 7.073 287 HB2 PHE 36 HB2 PHE 36 95.566 2.887 7.412 288 HB3 PHE 36 HB3 PHE 36 94.345 4.174 7.554 289 HD1 PHE 36 HD1 PHE 36 96.560 2.284 9.419 290 HD2 PHE 36 HD2 PHE 36 92.434 3.475 9.424 291 HE1 PHE 36 HE1 PHE 36 96.457 1.915 11.870 292 HE2 PHE 36 HE2 PHE 36 92.331 3.109 11.875 293 HZ PHE 36 HZ PHE 36 94.343 2.329 13.098 294 H THR 37 H THR 37 93.140 3.678 5.003 295 HA THR 37 HA THR 37 94.208 1.594 3.125 296 HB THR 37 HB THR 37 93.376 3.361 1.401 297 HG1 THR 37 HG1 THR 37 91.796 4.773 2.345 298 HG21 THR 37 HG21 THR 37 91.433 2.009 3.329 299 HG22 THR 37 HG22 THR 37 92.189 1.254 1.906 300 HG23 THR 37 HG23 THR 37 91.028 2.587 1.695 301 H GLY 38 H GLY 38 95.290 4.324 4.831 302 HA2 GLY 38 HA3 GLY 38 97.305 5.013 2.703 303 HA3 GLY 38 HA2 GLY 38 96.979 5.967 4.170 304 H ASP 39 H ASP 39 97.281 2.470 4.333 305 HA ASP 39 HA ASP 39 100.109 2.754 5.322 306 HB2 ASP 39 HB3 ASP 39 97.722 1.726 6.884 307 HB3 ASP 39 HB2 ASP 39 99.369 1.157 7.246 308 H ALA 40 H ALA 40 100.332 0.091 6.279 309 HA ALA 40 HA ALA 40 99.480 -1.588 3.931 310 HB1 ALA 40 HB1 ALA 40 101.778 -2.494 3.706 311 HB2 ALA 40 HB2 ALA 40 102.346 -1.361 4.956 312 HB3 ALA 40 HB3 ALA 40 101.748 -0.741 3.399 313 H TYR 41 H TYR 41 99.091 -3.731 4.487 314 HA TYR 41 HA TYR 41 99.763 -4.490 7.341 315 HB2 TYR 41 HB2 TYR 41 97.181 -5.150 5.855 316 HB3 TYR 41 HB3 TYR 41 97.578 -5.579 7.537 317 HD1 TYR 41 HD1 TYR 41 97.222 -2.628 5.246 318 HD2 TYR 41 HD2 TYR 41 97.060 -4.093 9.281 319 HE1 TYR 41 HE1 TYR 41 96.364 -0.431 6.009 320 HE2 TYR 41 HE2 TYR 41 96.203 -1.895 10.044 321 HH TYR 41 HH TYR 41 96.472 0.718 8.870 322 H VAL 42 H VAL 42 100.986 -6.295 7.385 323 HA VAL 42 HA VAL 42 101.020 -8.027 4.930 324 HB VAL 42 HB VAL 42 102.843 -7.760 7.350 325 HG11 VAL 42 HG11 VAL 42 104.237 -9.527 6.139 326 HG12 VAL 42 HG12 VAL 42 102.792 -9.873 5.158 327 HG13 VAL 42 HG13 VAL 42 102.754 -10.128 6.920 328 HG21 VAL 42 HG21 VAL 42 102.898 -6.195 5.268 329 HG22 VAL 42 HG22 VAL 42 103.542 -7.611 4.402 330 HG23 VAL 42 HG23 VAL 42 104.428 -6.939 5.792 331 H ILE 43 H ILE 43 100.424 -10.197 4.984 332 HA ILE 43 HA ILE 43 99.518 -11.286 7.646 333 HB ILE 43 HB ILE 43 97.840 -11.872 5.223 334 HG12 ILE 43 HG13 ILE 43 97.544 -9.345 6.902 335 HG13 ILE 43 HG12 ILE 43 98.185 -9.380 5.242 336 HG21 ILE 43 HG21 ILE 43 96.094 -12.066 6.906 337 HG22 ILE 43 HG22 ILE 43 97.145 -11.337 8.143 338 HG23 ILE 43 HG23 ILE 43 97.526 -12.948 7.488 339 HD11 ILE 43 HD11 ILE 43 95.769 -8.823 5.251 340 HD12 ILE 43 HD12 ILE 43 96.063 -10.381 4.443 341 HD13 ILE 43 HD13 ILE 43 95.421 -10.347 6.103 342 H LEU 44 H LEU 44 99.701 -13.526 7.822 343 HA LEU 44 HA LEU 44 100.931 -14.919 5.432 344 HB2 LEU 44 HB2 LEU 44 102.072 -14.423 8.092 345 HB3 LEU 44 HB3 LEU 44 102.007 -16.161 7.712 346 HG LEU 44 HG LEU 44 103.071 -15.621 5.474 347 HD11 LEU 44 HD11 LEU 44 104.364 -13.196 6.091 348 HD12 LEU 44 HD12 LEU 44 102.659 -12.921 6.522 349 HD13 LEU 44 HD13 LEU 44 103.087 -13.438 4.874 350 HD21 LEU 44 HD21 LEU 44 105.340 -15.317 6.429 351 HD22 LEU 44 HD22 LEU 44 104.390 -16.473 7.392 352 HD23 LEU 44 HD23 LEU 44 104.620 -14.807 7.975 353 H LYS 45 H LYS 45 99.977 -16.859 4.963 354 HA LYS 45 HA LYS 45 98.095 -17.955 7.070 355 HB2 LYS 45 HB2 LYS 45 97.287 -17.072 4.689 356 HB3 LYS 45 HB3 LYS 45 97.846 -18.675 4.154 357 HG2 LYS 45 HG3 LYS 45 96.460 -19.391 6.387 358 HG3 LYS 45 HG2 LYS 45 95.543 -17.941 5.915 359 HD2 LYS 45 HD2 LYS 45 96.215 -20.226 4.012 360 HD3 LYS 45 HD3 LYS 45 94.673 -20.082 4.889 361 HE2 LYS 45 HE2 LYS 45 94.034 -18.150 3.704 362 HE3 LYS 45 HE3 LYS 45 95.707 -17.769 3.230 363 HZ1 LYS 45 HZ1 LYS 45 95.001 -20.297 2.256 364 HZ2 LYS 45 HZ2 LYS 45 93.838 -19.220 1.800 365 HZ3 LYS 45 HZ3 LYS 45 95.416 -18.948 1.404 366 H THR 46 H THR 46 99.562 -19.367 8.067 367 HA THR 46 HA THR 46 101.209 -21.225 6.476 368 HB THR 46 HB THR 46 100.473 -21.492 9.415 369 HG1 THR 46 HG1 THR 46 101.368 -19.578 9.586 370 HG21 THR 46 HG21 THR 46 101.713 -23.371 8.506 371 HG22 THR 46 HG22 THR 46 102.869 -22.280 7.705 372 HG23 THR 46 HG23 THR 46 102.837 -22.394 9.481 373 H VAL 47 H VAL 47 99.997 -22.612 5.224 374 HA VAL 47 HA VAL 47 97.681 -24.014 6.531 375 HB VAL 47 HB VAL 47 98.347 -24.630 3.709 376 HG11 VAL 47 HG11 VAL 47 96.246 -25.325 4.831 377 HG12 VAL 47 HG12 VAL 47 95.915 -24.236 3.463 378 HG13 VAL 47 HG13 VAL 47 95.843 -23.618 5.131 379 HG21 VAL 47 HG21 VAL 47 97.376 -22.386 2.973 380 HG22 VAL 47 HG22 VAL 47 99.035 -22.326 3.616 381 HG23 VAL 47 HG23 VAL 47 97.667 -21.810 4.632 382 H GLN 48 H GLN 48 97.495 -26.386 6.069 383 HA GLN 48 HA GLN 48 100.232 -27.681 5.965 384 HB2 GLN 48 HB2 GLN 48 99.345 -27.683 8.285 385 HB3 GLN 48 HB3 GLN 48 97.857 -28.474 7.713 386 HG2 GLN 48 HG2 GLN 48 99.174 -30.411 6.927 387 HG3 GLN 48 HG3 GLN 48 100.676 -29.616 7.456 388 HE21 GLN 48 HE21 GLN 48 98.693 -32.040 8.405 389 HE22 GLN 48 HE22 GLN 48 98.790 -31.862 10.142 390 H LEU 49 H LEU 49 100.339 -28.933 4.174 391 HA LEU 49 HA LEU 49 98.127 -29.590 2.504 392 HB2 LEU 49 HB2 LEU 49 100.725 -31.142 2.899 393 HB3 LEU 49 HB3 LEU 49 99.621 -31.312 1.513 394 HG LEU 49 HG LEU 49 101.047 -28.743 2.338 395 HD11 LEU 49 HD11 LEU 49 102.573 -30.448 1.380 396 HD12 LEU 49 HD12 LEU 49 102.338 -29.092 0.251 397 HD13 LEU 49 HD13 LEU 49 101.487 -30.632 -0.018 398 HD21 LEU 49 HD21 LEU 49 100.193 -28.276 -0.166 399 HD22 LEU 49 HD22 LEU 49 98.937 -29.441 0.315 400 HD23 LEU 49 HD23 LEU 49 99.165 -27.942 1.247 401 H ARG 50 H ARG 50 99.840 -32.395 3.766 402 HA ARG 50 HA ARG 50 97.343 -33.262 5.204 403 HB2 ARG 50 HB3 ARG 50 97.412 -35.461 4.082 404 HB3 ARG 50 HB2 ARG 50 97.202 -34.157 2.889 405 HG2 ARG 50 HG3 ARG 50 99.819 -34.199 2.743 406 HG3 ARG 50 HG2 ARG 50 99.668 -35.808 3.490 407 HD2 ARG 50 HD2 ARG 50 98.238 -36.579 1.678 408 HD3 ARG 50 HD3 ARG 50 98.172 -34.944 0.978 409 HE ARG 50 HE ARG 50 100.412 -36.868 0.729 410 HH11 ARG 50 HH11 ARG 50 102.103 -36.147 -0.586 411 HH12 ARG 50 HH12 ARG 50 102.191 -34.464 -1.054 412 HH21 ARG 50 HH21 ARG 50 99.305 -33.567 0.674 413 HH22 ARG 50 HH22 ARG 50 100.614 -33.010 -0.344 414 H ASN 51 H ASN 51 100.782 -33.807 4.452 415 HA ASN 51 HA ASN 51 101.421 -34.298 7.241 416 HB2 ASN 51 HB2 ASN 51 100.183 -36.475 6.373 417 HB3 ASN 51 HB3 ASN 51 101.749 -36.809 5.594 418 HD21 ASN 51 HD21 ASN 51 102.844 -38.277 6.911 419 HD22 ASN 51 HD22 ASN 51 102.984 -38.130 8.649 420 H GLY 52 H GLY 52 102.298 -32.896 4.720 421 HA2 GLY 52 HA2 GLY 52 105.095 -34.047 4.564 422 HA3 GLY 52 HA3 GLY 52 104.328 -33.111 3.259 423 H ASN 53 H ASN 53 103.932 -30.809 3.637 424 HA ASN 53 HA ASN 53 105.374 -29.642 5.996 425 HB2 ASN 53 HB3 ASN 53 107.069 -29.824 4.177 426 HB3 ASN 53 HB2 ASN 53 106.000 -28.887 3.106 427 HD21 ASN 53 HD21 ASN 53 107.785 -28.688 6.243 428 HD22 ASN 53 HD22 ASN 53 107.952 -26.947 6.203 429 H LEU 54 H LEU 54 104.881 -27.307 6.246 430 HA LEU 54 HA LEU 54 102.129 -26.747 5.158 431 HB2 LEU 54 HB2 LEU 54 102.462 -24.785 6.953 432 HB3 LEU 54 HB3 LEU 54 101.991 -26.427 7.454 433 HG LEU 54 HG LEU 54 104.348 -26.986 7.911 434 HD11 LEU 54 HD11 LEU 54 105.876 -24.790 7.920 435 HD12 LEU 54 HD12 LEU 54 105.703 -25.784 6.454 436 HD13 LEU 54 HD13 LEU 54 104.752 -24.290 6.633 437 HD21 LEU 54 HD21 LEU 54 104.184 -26.066 9.981 438 HD22 LEU 54 HD22 LEU 54 104.304 -24.413 9.335 439 HD23 LEU 54 HD23 LEU 54 102.727 -25.238 9.380 440 H GLN 55 H GLN 55 101.704 -24.358 4.645 441 HA GLN 55 HA GLN 55 104.175 -23.037 3.526 442 HB2 GLN 55 HB2 GLN 55 102.704 -24.461 1.832 443 HB3 GLN 55 HB3 GLN 55 101.632 -23.042 1.903 444 HG2 GLN 55 HG3 GLN 55 103.056 -22.432 0.156 445 HG3 GLN 55 HG2 GLN 55 103.899 -21.705 1.545 446 HE21 GLN 55 HE21 GLN 55 103.766 -24.863 -0.255 447 HE22 GLN 55 HE22 GLN 55 105.483 -25.168 -0.115 448 H TYR 56 H TYR 56 104.186 -20.850 3.838 449 HA TYR 56 HA TYR 56 101.790 -19.674 5.207 450 HB2 TYR 56 HB2 TYR 56 104.511 -18.417 4.632 451 HB3 TYR 56 HB3 TYR 56 103.274 -17.818 5.761 452 HD1 TYR 56 HD1 TYR 56 103.339 -18.484 8.004 453 HD2 TYR 56 HD2 TYR 56 105.382 -20.848 5.056 454 HE1 TYR 56 HE1 TYR 56 104.298 -19.897 9.802 455 HE2 TYR 56 HE2 TYR 56 106.340 -22.263 6.856 456 HH TYR 56 HH TYR 56 106.871 -21.912 9.411 457 H ASP 57 H ASP 57 100.381 -18.361 4.130 458 HA ASP 57 HA ASP 57 101.031 -17.708 1.281 459 HB2 ASP 57 HB2 ASP 57 98.765 -18.643 2.107 460 HB3 ASP 57 HB3 ASP 57 98.472 -17.016 2.767 461 H LEU 58 H LEU 58 102.061 -15.826 0.876 462 HA LEU 58 HA LEU 58 102.061 -13.680 2.919 463 HB2 LEU 58 HB3 LEU 58 103.530 -14.327 0.418 464 HB3 LEU 58 HB2 LEU 58 103.277 -12.590 0.710 465 HG LEU 58 HG LEU 58 104.207 -12.874 3.013 466 HD11 LEU 58 HD11 LEU 58 103.576 -15.400 3.003 467 HD12 LEU 58 HD12 LEU 58 105.118 -14.936 3.761 468 HD13 LEU 58 HD13 LEU 58 105.106 -15.635 2.124 469 HD21 LEU 58 HD21 LEU 58 105.589 -12.366 0.867 470 HD22 LEU 58 HD22 LEU 58 106.158 -14.047 1.006 471 HD23 LEU 58 HD23 LEU 58 106.477 -12.887 2.319 472 H HIS 59 H HIS 59 100.659 -12.019 2.981 473 HA HIS 59 HA HIS 59 99.352 -11.154 0.414 474 HB2 HIS 59 HB2 HIS 59 97.958 -12.105 2.939 475 HB3 HIS 59 HB3 HIS 59 97.170 -10.966 1.822 476 HD2 HIS 59 HD2 HIS 59 98.783 -14.616 1.529 477 HE1 HIS 59 HE1 HIS 59 95.751 -14.182 -1.378 478 H TYR 60 H TYR 60 100.094 -9.058 0.339 479 HA TYR 60 HA TYR 60 100.074 -7.528 2.940 480 HB2 TYR 60 HB2 TYR 60 101.257 -5.832 1.141 481 HB3 TYR 60 HB3 TYR 60 102.147 -6.992 2.153 482 HD1 TYR 60 HD1 TYR 60 102.105 -9.510 1.106 483 HD2 TYR 60 HD2 TYR 60 101.743 -5.852 -1.116 484 HE1 TYR 60 HE1 TYR 60 102.895 -10.673 -0.937 485 HE2 TYR 60 HE2 TYR 60 102.530 -7.013 -3.158 486 HH TYR 60 HH TYR 60 102.604 -10.284 -3.528 487 H TRP 61 H TRP 61 98.564 -5.980 3.266 488 HA TRP 61 HA TRP 61 96.683 -5.437 0.987 489 HB2 TRP 61 HB3 TRP 61 95.934 -6.160 3.362 490 HB3 TRP 61 HB2 TRP 61 96.356 -4.504 3.858 491 HD1 TRP 61 HD1 TRP 61 94.390 -6.054 0.880 492 HE1 TRP 61 HE1 TRP 61 92.236 -4.683 0.511 493 HE3 TRP 61 HE3 TRP 61 94.983 -2.590 4.586 494 HZ2 TRP 61 HZ2 TRP 61 90.955 -2.382 1.683 495 HZ3 TRP 61 HZ3 TRP 61 93.282 -0.824 4.939 496 HH2 TRP 61 HH2 TRP 61 91.272 -0.712 3.492 497 H LEU 62 H LEU 62 96.672 -3.530 -0.056 498 HA LEU 62 HA LEU 62 97.957 -1.162 1.309 499 HB2 LEU 62 HB2 LEU 62 98.304 -1.551 -1.663 500 HB3 LEU 62 HB3 LEU 62 99.337 -0.673 -0.511 501 HG LEU 62 HG LEU 62 99.013 -3.697 -0.409 502 HD11 LEU 62 HD11 LEU 62 100.048 -3.669 -2.457 503 HD12 LEU 62 HD12 LEU 62 101.496 -3.304 -1.489 504 HD13 LEU 62 HD13 LEU 62 100.592 -1.985 -2.270 505 HD21 LEU 62 HD21 LEU 62 99.919 -2.549 1.596 506 HD22 LEU 62 HD22 LEU 62 101.173 -3.530 0.801 507 HD23 LEU 62 HD23 LEU 62 101.156 -1.763 0.587 508 H GLY 63 H GLY 63 96.163 0.113 1.600 509 HA2 GLY 63 HA3 GLY 63 93.816 0.046 -0.061 510 HA3 GLY 63 HA2 GLY 63 94.263 1.391 1.016 511 H ASN 64 H ASN 64 96.756 0.693 -1.162 512 HA ASN 64 HA ASN 64 97.483 1.769 -3.138 513 HB2 ASN 64 HB2 ASN 64 94.971 1.168 -3.767 514 HB3 ASN 64 HB3 ASN 64 94.742 2.927 -3.617 515 HD21 ASN 64 HD21 ASN 64 95.708 0.453 -5.771 516 HD22 ASN 64 HD22 ASN 64 96.520 1.464 -6.946 517 H GLU 65 H GLU 65 96.348 3.223 -0.405 518 HA GLU 65 HA GLU 65 97.073 5.979 -1.430 519 HB2 GLU 65 HB3 GLU 65 95.570 5.311 1.135 520 HB3 GLU 65 HB2 GLU 65 95.737 6.901 0.353 521 HG2 GLU 65 HG2 GLU 65 94.597 5.736 -1.702 522 HG3 GLU 65 HG3 GLU 65 94.080 4.517 -0.513 523 H CYS 66 H CYS 66 98.566 3.455 -0.236 524 HA CYS 66 HA CYS 66 99.901 4.846 2.072 525 HB2 CYS 66 HB2 CYS 66 100.676 2.730 2.738 526 HB3 CYS 66 HB3 CYS 66 99.101 2.332 2.010 527 HG CYS 66 HG CYS 66 100.824 0.370 0.998 528 H SER 67 H SER 67 101.956 5.658 1.908 529 HA SER 67 HA SER 67 103.147 6.357 -0.521 530 HB2 SER 67 HB3 SER 67 104.934 5.437 1.735 531 HB3 SER 67 HB2 SER 67 105.087 6.870 0.689 532 HG SER 67 HG SER 67 104.265 7.723 2.513 533 H GLN 68 H GLN 68 104.841 5.448 -1.838 534 HA GLN 68 HA GLN 68 104.571 2.533 -2.164 535 HB2 GLN 68 HB2 GLN 68 106.596 4.384 -3.488 536 HB3 GLN 68 HB3 GLN 68 106.010 2.812 -4.083 537 HG2 GLN 68 HG2 GLN 68 103.724 3.747 -4.304 538 HG3 GLN 68 HG3 GLN 68 104.308 5.318 -3.705 539 HE21 GLN 68 HE21 GLN 68 103.656 6.268 -5.830 540 HE22 GLN 68 HE22 GLN 68 104.686 6.030 -7.224 541 H ASP 69 H ASP 69 106.702 4.670 -0.432 542 HA ASP 69 HA ASP 69 109.020 2.901 -0.360 543 HB2 ASP 69 HB2 ASP 69 108.061 5.094 1.529 544 HB3 ASP 69 HB3 ASP 69 109.631 4.269 1.680 545 H GLU 70 H GLU 70 106.065 3.206 1.597 546 HA GLU 70 HA GLU 70 107.055 1.139 3.507 547 HB2 GLU 70 HB3 GLU 70 104.276 2.372 3.268 548 HB3 GLU 70 HB2 GLU 70 104.944 1.491 4.663 549 HG2 GLU 70 HG2 GLU 70 106.740 3.259 4.830 550 HG3 GLU 70 HG3 GLU 70 105.892 4.170 3.557 551 H SER 71 H SER 71 104.995 1.409 0.663 552 HA SER 71 HA SER 71 103.588 -1.103 0.984 553 HB2 SER 71 HB2 SER 71 103.009 0.716 -0.669 554 HB3 SER 71 HB3 SER 71 104.438 0.241 -1.619 555 HG SER 71 HG SER 71 102.502 -0.820 -2.332 556 H GLY 72 H GLY 72 106.411 -0.335 -1.130 557 HA2 GLY 72 HA3 GLY 72 106.976 -3.116 -1.699 558 HA3 GLY 72 HA2 GLY 72 108.122 -1.770 -1.903 559 H ALA 73 H ALA 73 108.375 -0.836 0.706 560 HA ALA 73 HA ALA 73 110.354 -2.485 1.831 561 HB1 ALA 73 HB1 ALA 73 109.686 -1.383 4.063 562 HB2 ALA 73 HB2 ALA 73 110.086 -0.283 2.723 563 HB3 ALA 73 HB3 ALA 73 108.384 -0.582 3.151 564 H ALA 74 H ALA 74 106.830 -2.557 2.501 565 HA ALA 74 HA ALA 74 107.017 -4.677 4.477 566 HB1 ALA 74 HB1 ALA 74 104.590 -4.975 4.067 567 HB2 ALA 74 HB2 ALA 74 104.710 -3.956 2.613 568 HB3 ALA 74 HB3 ALA 74 105.002 -3.251 4.220 569 H ALA 75 H ALA 75 106.145 -4.743 0.989 570 HA ALA 75 HA ALA 75 105.977 -7.601 0.788 571 HB1 ALA 75 HB1 ALA 75 106.376 -7.253 -1.635 572 HB2 ALA 75 HB2 ALA 75 105.231 -6.047 -1.001 573 HB3 ALA 75 HB3 ALA 75 106.924 -5.592 -1.308 574 H ILE 76 H ILE 76 108.696 -5.483 1.195 575 HA ILE 76 HA ILE 76 110.661 -7.420 0.118 576 HB ILE 76 HB ILE 76 110.959 -4.871 1.762 577 HG12 ILE 76 HG12 ILE 76 110.144 -5.006 -0.782 578 HG13 ILE 76 HG13 ILE 76 111.305 -3.765 -0.253 579 HG21 ILE 76 HG21 ILE 76 112.902 -6.137 2.263 580 HG22 ILE 76 HG22 ILE 76 113.394 -5.110 0.895 581 HG23 ILE 76 HG23 ILE 76 112.984 -6.821 0.622 582 HD11 ILE 76 HD11 ILE 76 111.888 -5.128 -2.388 583 HD12 ILE 76 HD12 ILE 76 113.156 -4.950 -1.151 584 HD13 ILE 76 HD13 ILE 76 112.236 -6.469 -1.271 585 H PHE 77 H PHE 77 110.114 -6.032 3.415 586 HA PHE 77 HA PHE 77 111.706 -8.075 4.713 587 HB2 PHE 77 HB3 PHE 77 109.621 -6.082 5.601 588 HB3 PHE 77 HB2 PHE 77 110.110 -7.372 6.726 589 HD1 PHE 77 HD1 PHE 77 111.638 -6.541 8.279 590 HD2 PHE 77 HD2 PHE 77 111.977 -5.331 4.171 591 HE1 PHE 77 HE1 PHE 77 113.707 -5.288 8.819 592 HE2 PHE 77 HE2 PHE 77 114.045 -4.075 4.713 593 HZ PHE 77 HZ PHE 77 114.911 -4.052 7.037 594 H THR 78 H THR 78 108.411 -7.946 3.551 595 HA THR 78 HA THR 78 107.504 -10.294 5.079 596 HB THR 78 HB THR 78 106.395 -8.848 2.632 597 HG1 THR 78 HG1 THR 78 105.385 -7.681 4.092 598 HG21 THR 78 HG21 THR 78 104.368 -10.319 3.975 599 HG22 THR 78 HG22 THR 78 105.727 -11.444 3.745 600 HG23 THR 78 HG23 THR 78 105.015 -10.610 2.343 601 H VAL 79 H VAL 79 108.407 -9.702 1.634 602 HA VAL 79 HA VAL 79 108.184 -12.515 0.916 603 HB VAL 79 HB VAL 79 109.745 -10.226 -0.360 604 HG11 VAL 79 HG11 VAL 79 110.654 -12.441 -1.009 605 HG12 VAL 79 HG12 VAL 79 109.016 -12.985 -1.444 606 HG13 VAL 79 HG13 VAL 79 109.795 -11.679 -2.369 607 HG21 VAL 79 HG21 VAL 79 107.234 -11.475 -1.464 608 HG22 VAL 79 HG22 VAL 79 107.843 -9.812 -1.639 609 HG23 VAL 79 HG23 VAL 79 107.091 -10.328 -0.111 610 H GLN 80 H GLN 80 110.854 -10.481 2.108 611 HA GLN 80 HA GLN 80 112.931 -12.452 1.627 612 HB2 GLN 80 HB2 GLN 80 112.648 -10.042 3.432 613 HB3 GLN 80 HB3 GLN 80 114.051 -11.124 3.603 614 HG2 GLN 80 HG2 GLN 80 113.262 -10.147 0.858 615 HG3 GLN 80 HG3 GLN 80 114.163 -9.062 1.944 616 HE21 GLN 80 HE21 GLN 80 115.108 -10.413 -0.593 617 HE22 GLN 80 HE22 GLN 80 116.501 -11.352 -0.108 618 H LEU 81 H LEU 81 111.290 -11.564 4.735 619 HA LEU 81 HA LEU 81 112.413 -13.728 6.221 620 HB2 LEU 81 HB2 LEU 81 110.596 -11.693 6.747 621 HB3 LEU 81 HB3 LEU 81 109.597 -13.156 6.908 622 HG LEU 81 HG LEU 81 110.706 -12.473 9.060 623 HD11 LEU 81 HD11 LEU 81 110.412 -14.688 9.430 624 HD12 LEU 81 HD12 LEU 81 112.115 -14.906 8.961 625 HD13 LEU 81 HD13 LEU 81 110.827 -15.088 7.746 626 HD21 LEU 81 HD21 LEU 81 113.020 -12.338 9.310 627 HD22 LEU 81 HD22 LEU 81 113.337 -13.441 7.949 628 HD23 LEU 81 HD23 LEU 81 112.847 -11.759 7.636 629 H ASP 82 H ASP 82 109.344 -13.640 4.312 630 HA ASP 82 HA ASP 82 108.455 -16.254 4.887 631 HB2 ASP 82 HB2 ASP 82 107.063 -15.991 3.097 632 HB3 ASP 82 HB3 ASP 82 107.723 -14.339 3.055 633 H ASP 83 H ASP 83 110.914 -15.265 2.448 634 HA ASP 83 HA ASP 83 111.532 -17.984 1.667 635 HB2 ASP 83 HB3 ASP 83 112.284 -15.903 0.440 636 HB3 ASP 83 HB2 ASP 83 113.444 -15.607 1.758 637 H TYR 84 H TYR 84 112.281 -16.010 4.434 638 HA TYR 84 HA TYR 84 114.499 -17.715 5.373 639 HB2 TYR 84 HB2 TYR 84 114.088 -15.240 5.978 640 HB3 TYR 84 HB3 TYR 84 112.807 -15.835 7.062 641 HD1 TYR 84 HD1 TYR 84 113.337 -17.045 9.085 642 HD2 TYR 84 HD2 TYR 84 116.450 -15.879 6.365 643 HE1 TYR 84 HE1 TYR 84 115.043 -17.602 10.797 644 HE2 TYR 84 HE2 TYR 84 118.155 -16.432 8.077 645 HH TYR 84 HH TYR 84 117.586 -18.290 10.736 646 H LEU 85 H LEU 85 111.002 -17.699 5.538 647 HA LEU 85 HA LEU 85 110.938 -19.555 7.855 648 HB2 LEU 85 HB2 LEU 85 108.713 -18.796 5.909 649 HB3 LEU 85 HB3 LEU 85 108.517 -19.577 7.496 650 HG LEU 85 HG LEU 85 109.575 -16.771 6.943 651 HD11 LEU 85 HD11 LEU 85 107.112 -17.037 6.873 652 HD12 LEU 85 HD12 LEU 85 107.151 -17.815 8.474 653 HD13 LEU 85 HD13 LEU 85 107.615 -16.105 8.304 654 HD21 LEU 85 HD21 LEU 85 109.627 -18.529 9.405 655 HD22 LEU 85 HD22 LEU 85 109.476 -16.764 9.575 656 HD23 LEU 85 HD23 LEU 85 110.896 -17.460 8.760 657 H ASN 86 H ASN 86 110.058 -19.773 4.361 658 HA ASN 86 HA ASN 86 110.612 -22.743 4.613 659 HB2 ASN 86 HB2 ASN 86 108.410 -21.225 3.212 660 HB3 ASN 86 HB3 ASN 86 108.955 -22.784 2.547 661 HD21 ASN 86 HD21 ASN 86 107.074 -24.010 3.156 662 HD22 ASN 86 HD22 ASN 86 106.662 -24.303 4.831 663 H GLY 87 H GLY 87 110.652 -19.897 2.449 664 HA2 GLY 87 HA3 GLY 87 112.899 -19.652 1.228 665 HA3 GLY 87 HA2 GLY 87 112.720 -21.370 0.794 666 H ARG 88 H ARG 88 109.639 -20.419 0.752 667 HA ARG 88 HA ARG 88 109.729 -19.063 -1.924 668 HB2 ARG 88 HB2 ARG 88 108.168 -21.635 -1.418 669 HB3 ARG 88 HB3 ARG 88 108.258 -20.724 -2.945 670 HG2 ARG 88 HG2 ARG 88 110.720 -21.133 -3.017 671 HG3 ARG 88 HG3 ARG 88 110.586 -22.098 -1.527 672 HD2 ARG 88 HD2 ARG 88 108.715 -23.380 -2.923 673 HD3 ARG 88 HD3 ARG 88 109.618 -22.726 -4.310 674 HE ARG 88 HE ARG 88 110.592 -24.776 -2.379 675 HH11 ARG 88 HH11 ARG 88 112.552 -25.718 -2.990 676 HH12 ARG 88 HH12 ARG 88 113.497 -25.013 -4.283 677 HH21 ARG 88 HH21 ARG 88 111.236 -22.431 -4.873 678 HH22 ARG 88 HH22 ARG 88 112.755 -23.160 -5.345 679 H ALA 89 H ALA 89 107.019 -20.821 -0.437 680 HA ALA 89 HA ALA 89 105.025 -19.989 0.532 681 HB1 ALA 89 HB1 ALA 89 105.290 -18.319 2.064 682 HB2 ALA 89 HB2 ALA 89 107.013 -18.409 1.625 683 HB3 ALA 89 HB3 ALA 89 105.961 -17.196 0.858 684 H VAL 90 H VAL 90 103.195 -19.321 -0.519 685 HA VAL 90 HA VAL 90 103.415 -18.180 -3.186 686 HB VAL 90 HB VAL 90 100.916 -18.134 -1.457 687 HG11 VAL 90 HG11 VAL 90 101.383 -18.598 -4.437 688 HG12 VAL 90 HG12 VAL 90 99.805 -18.476 -3.622 689 HG13 VAL 90 HG13 VAL 90 100.872 -17.054 -3.713 690 HG21 VAL 90 HG21 VAL 90 100.620 -20.485 -2.626 691 HG22 VAL 90 HG22 VAL 90 101.578 -20.361 -1.132 692 HG23 VAL 90 HG23 VAL 90 102.397 -20.453 -2.709 693 H GLN 91 H GLN 91 102.820 -16.059 -3.910 694 HA GLN 91 HA GLN 91 102.919 -13.998 -1.692 695 HB2 GLN 91 HB2 GLN 91 103.671 -13.387 -4.552 696 HB3 GLN 91 HB3 GLN 91 104.233 -12.616 -3.050 697 HG2 GLN 91 HG2 GLN 91 106.095 -13.910 -3.604 698 HG3 GLN 91 HG3 GLN 91 105.208 -15.034 -2.546 699 HE21 GLN 91 HE21 GLN 91 104.949 -17.086 -3.421 700 HE22 GLN 91 HE22 GLN 91 104.898 -17.441 -5.133 701 H HIS 92 H HIS 92 101.425 -12.313 -1.743 702 HA HIS 92 HA HIS 92 99.525 -12.227 -4.073 703 HB2 HIS 92 HB2 HIS 92 98.744 -12.608 -1.152 704 HB3 HIS 92 HB3 HIS 92 97.604 -12.092 -2.417 705 HD2 HIS 92 HD2 HIS 92 100.045 -15.236 -1.931 706 HE1 HIS 92 HE1 HIS 92 96.585 -16.442 -4.029 707 H ARG 93 H ARG 93 99.381 -10.142 -4.699 708 HA ARG 93 HA ARG 93 99.945 -8.021 -2.619 709 HB2 ARG 93 HB3 ARG 93 100.701 -6.613 -4.411 710 HB3 ARG 93 HB2 ARG 93 101.423 -8.212 -4.711 711 HG2 ARG 93 HG2 ARG 93 99.259 -8.644 -6.135 712 HG3 ARG 93 HG3 ARG 93 99.108 -6.870 -6.129 713 HD2 ARG 93 HD2 ARG 93 101.666 -6.957 -6.819 714 HD3 ARG 93 HD3 ARG 93 101.254 -8.604 -7.352 715 HE ARG 93 HE ARG 93 99.372 -6.534 -8.318 716 HH11 ARG 93 HH11 ARG 93 99.397 -6.231 -10.559 717 HH12 ARG 93 HH12 ARG 93 100.699 -6.900 -11.516 718 HH21 ARG 93 HH21 ARG 93 102.338 -8.299 -8.781 719 HH22 ARG 93 HH22 ARG 93 102.357 -8.066 -10.514 720 H GLU 94 H GLU 94 98.187 -6.907 -1.931 721 HA GLU 94 HA GLU 94 95.808 -6.809 -3.803 722 HB2 GLU 94 HB2 GLU 94 95.872 -6.498 -0.768 723 HB3 GLU 94 HB3 GLU 94 94.420 -6.552 -1.797 724 HG2 GLU 94 HG3 GLU 94 94.550 -8.773 -1.079 725 HG3 GLU 94 HG2 GLU 94 95.453 -8.852 -2.610 726 H VAL 95 H VAL 95 96.499 -4.911 -4.908 727 HA VAL 95 HA VAL 95 97.191 -2.491 -3.348 728 HB VAL 95 HB VAL 95 96.412 -2.454 -6.267 729 HG11 VAL 95 HG11 VAL 95 98.861 -1.190 -5.064 730 HG12 VAL 95 HG12 VAL 95 97.275 -0.497 -4.649 731 HG13 VAL 95 HG13 VAL 95 97.789 -0.588 -6.351 732 HG21 VAL 95 HG21 VAL 95 98.931 -3.056 -6.622 733 HG22 VAL 95 HG22 VAL 95 98.828 -3.776 -4.998 734 HG23 VAL 95 HG23 VAL 95 97.784 -4.380 -6.307 735 H GLN 96 H GLN 96 94.624 -3.624 -2.674 736 HA GLN 96 HA GLN 96 92.448 -2.805 -2.248 737 HB2 GLN 96 HB2 GLN 96 93.952 -0.572 -2.208 738 HB3 GLN 96 HB3 GLN 96 92.992 -0.213 -3.663 739 HG2 GLN 96 HG3 GLN 96 90.907 -0.700 -2.341 740 HG3 GLN 96 HG2 GLN 96 91.919 -0.895 -0.890 741 HE21 GLN 96 HE21 GLN 96 91.513 0.973 0.333 742 HE22 GLN 96 HE22 GLN 96 91.642 2.599 -0.299 743 H GLY 97 H GLY 97 92.603 -4.451 -4.383 744 HA2 GLY 97 HA2 GLY 97 90.318 -3.984 -5.913 745 HA3 GLY 97 HA3 GLY 97 91.595 -3.156 -6.835 746 H PHE 98 H PHE 98 93.763 -4.754 -6.650 747 HA PHE 98 HA PHE 98 92.951 -7.065 -8.294 748 HB2 PHE 98 HB2 PHE 98 95.566 -5.907 -7.318 749 HB3 PHE 98 HB3 PHE 98 95.530 -7.549 -8.002 750 HD1 PHE 98 HD1 PHE 98 94.567 -4.001 -8.700 751 HD2 PHE 98 HD2 PHE 98 95.409 -7.879 -10.340 752 HE1 PHE 98 HE1 PHE 98 94.510 -3.044 -10.988 753 HE2 PHE 98 HE2 PHE 98 95.351 -6.924 -12.629 754 HZ PHE 98 HZ PHE 98 94.899 -4.507 -12.953 755 H GLU 99 H GLU 99 92.005 -6.990 -5.473 756 HA GLU 99 HA GLU 99 93.533 -8.784 -3.822 757 HB2 GLU 99 HB2 GLU 99 90.495 -8.707 -3.901 758 HB3 GLU 99 HB3 GLU 99 91.556 -9.004 -2.503 759 HG2 GLU 99 HG3 GLU 99 92.486 -6.595 -3.062 760 HG3 GLU 99 HG2 GLU 99 90.935 -6.405 -3.914 761 H SER 100 H SER 100 93.327 -11.069 -3.489 762 HA SER 100 HA SER 100 92.420 -12.496 -5.982 763 HB2 SER 100 HB3 SER 100 94.669 -13.070 -5.422 764 HB3 SER 100 HB2 SER 100 94.278 -13.233 -3.692 765 HG SER 100 HG SER 100 94.437 -15.255 -4.993 766 H ALA 101 H ALA 101 91.298 -14.620 -5.658 767 HA ALA 101 HA ALA 101 88.969 -14.297 -3.988 768 HB1 ALA 101 HB1 ALA 101 88.505 -16.670 -4.540 769 HB2 ALA 101 HB2 ALA 101 90.166 -16.852 -5.153 770 HB3 ALA 101 HB3 ALA 101 89.024 -15.767 -5.983 771 H THR 102 H THR 102 92.125 -15.780 -3.410 772 HA THR 102 HA THR 102 91.388 -17.280 -1.047 773 HB THR 102 HB THR 102 94.057 -15.921 -1.624 774 HG1 THR 102 HG1 THR 102 94.522 -17.942 -2.658 775 HG21 THR 102 HG21 THR 102 94.955 -17.803 -0.284 776 HG22 THR 102 HG22 THR 102 93.794 -16.842 0.661 777 HG23 THR 102 HG23 THR 102 93.301 -18.408 -0.026 778 H PHE 103 H PHE 103 93.133 -14.139 -1.232 779 HA PHE 103 HA PHE 103 92.860 -13.487 1.531 780 HB2 PHE 103 HB2 PHE 103 94.315 -12.169 0.118 781 HB3 PHE 103 HB3 PHE 103 92.959 -11.701 -0.936 782 HD1 PHE 103 HD1 PHE 103 94.309 -11.395 2.534 783 HD2 PHE 103 HD2 PHE 103 91.574 -9.850 -0.395 784 HE1 PHE 103 HE1 PHE 103 93.848 -9.443 3.994 785 HE2 PHE 103 HE2 PHE 103 91.113 -7.899 1.065 786 HZ PHE 103 HZ PHE 103 92.252 -7.693 3.257 787 H LEU 104 H LEU 104 90.592 -13.011 -1.180 788 HA LEU 104 HA LEU 104 88.705 -11.429 0.406 789 HB2 LEU 104 HB2 LEU 104 88.362 -13.055 -2.150 790 HB3 LEU 104 HB3 LEU 104 87.112 -11.990 -1.464 791 HG LEU 104 HG LEU 104 89.925 -11.069 -2.196 792 HD11 LEU 104 HD11 LEU 104 88.664 -11.786 -4.207 793 HD12 LEU 104 HD12 LEU 104 87.296 -10.760 -3.714 794 HD13 LEU 104 HD13 LEU 104 88.849 -10.016 -4.164 795 HD21 LEU 104 HD21 LEU 104 88.768 -9.730 -0.454 796 HD22 LEU 104 HD22 LEU 104 87.356 -9.560 -1.525 797 HD23 LEU 104 HD23 LEU 104 88.909 -8.816 -1.975 798 H GLY 105 H GLY 105 89.403 -14.833 0.075 799 HA2 GLY 105 HA2 GLY 105 86.762 -15.699 1.088 800 HA3 GLY 105 HA3 GLY 105 88.193 -16.732 0.863 801 H TYR 106 H TYR 106 89.924 -14.875 2.429 802 HA TYR 106 HA TYR 106 89.180 -15.956 5.100 803 HB2 TYR 106 HB3 TYR 106 91.594 -15.485 3.819 804 HB3 TYR 106 HB2 TYR 106 91.482 -14.102 4.933 805 HD1 TYR 106 HD1 TYR 106 91.836 -17.741 4.643 806 HD2 TYR 106 HD2 TYR 106 91.272 -14.476 7.377 807 HE1 TYR 106 HE1 TYR 106 92.463 -19.217 6.535 808 HE2 TYR 106 HE2 TYR 106 91.898 -15.954 9.269 809 HH TYR 106 HH TYR 106 91.838 -18.553 9.698 810 H PHE 107 H PHE 107 89.576 -12.770 3.508 811 HA PHE 107 HA PHE 107 88.410 -11.510 5.993 812 HB2 PHE 107 HB2 PHE 107 89.903 -10.323 3.612 813 HB3 PHE 107 HB3 PHE 107 89.185 -9.357 4.923 814 HD1 PHE 107 HD1 PHE 107 90.027 -9.598 7.257 815 HD2 PHE 107 HD2 PHE 107 91.928 -11.573 3.951 816 HE1 PHE 107 HE1 PHE 107 92.040 -9.993 8.650 817 HE2 PHE 107 HE2 PHE 107 93.942 -11.969 5.344 818 HZ PHE 107 HZ PHE 107 93.998 -11.177 7.695 819 H LYS 108 H LYS 108 86.274 -12.444 5.288 820 HA LYS 108 HA LYS 108 85.103 -10.993 2.926 821 HB2 LYS 108 HB3 LYS 108 84.810 -13.483 3.123 822 HB3 LYS 108 HB2 LYS 108 83.900 -13.218 4.629 823 HG2 LYS 108 HG3 LYS 108 82.328 -11.722 3.324 824 HG3 LYS 108 HG2 LYS 108 83.175 -12.221 1.840 825 HD2 LYS 108 HD2 LYS 108 81.553 -13.853 1.825 826 HD3 LYS 108 HD3 LYS 108 82.690 -14.664 2.928 827 HE2 LYS 108 HE2 LYS 108 80.195 -13.074 3.624 828 HE3 LYS 108 HE3 LYS 108 80.586 -14.759 4.047 829 HZ1 LYS 108 HZ1 LYS 108 80.951 -13.356 5.924 830 HZ2 LYS 108 HZ2 LYS 108 81.925 -12.336 5.068 831 HZ3 LYS 108 HZ3 LYS 108 82.421 -13.877 5.387 832 H SER 109 H SER 109 84.894 -11.299 6.443 833 HA SER 109 HA SER 109 82.552 -9.411 6.447 834 HB2 SER 109 HB2 SER 109 83.810 -11.269 8.467 835 HB3 SER 109 HB3 SER 109 82.839 -9.889 9.034 836 HG SER 109 HG SER 109 81.560 -11.792 8.679 837 H GLY 110 H GLY 110 85.742 -9.034 6.099 838 HA2 GLY 110 HA2 GLY 110 85.989 -6.861 8.174 839 HA3 GLY 110 HA3 GLY 110 87.341 -7.571 7.259 840 H LEU 111 H LEU 111 88.061 -6.435 5.531 841 HA LEU 111 HA LEU 111 88.176 -4.598 4.046 842 HB2 LEU 111 HB2 LEU 111 85.330 -5.520 3.499 843 HB3 LEU 111 HB3 LEU 111 86.355 -4.560 2.407 844 HG LEU 111 HG LEU 111 86.920 -7.392 3.390 845 HD11 LEU 111 HD11 LEU 111 85.157 -7.236 1.654 846 HD12 LEU 111 HD12 LEU 111 86.250 -6.274 0.632 847 HD13 LEU 111 HD13 LEU 111 86.639 -7.972 0.997 848 HD21 LEU 111 HD21 LEU 111 88.723 -7.025 1.445 849 HD22 LEU 111 HD22 LEU 111 89.069 -6.544 3.124 850 HD23 LEU 111 HD23 LEU 111 88.553 -5.322 1.936 851 H LYS 112 H LYS 112 88.310 -2.815 5.342 852 HA LYS 112 HA LYS 112 85.867 -1.125 5.443 853 HB2 LYS 112 HB2 LYS 112 86.545 -2.699 7.699 854 HB3 LYS 112 HB3 LYS 112 87.117 -1.057 8.078 855 HG2 LYS 112 HG2 LYS 112 84.848 -0.185 7.377 856 HG3 LYS 112 HG3 LYS 112 84.305 -1.872 7.220 857 HD2 LYS 112 HD3 LYS 112 84.520 -2.285 9.537 858 HD3 LYS 112 HD2 LYS 112 85.595 -0.888 9.779 859 HE2 LYS 112 HE2 LYS 112 83.117 -0.666 10.549 860 HE3 LYS 112 HE3 LYS 112 83.814 0.664 9.594 861 HZ1 LYS 112 HZ1 LYS 112 81.559 -0.322 8.917 862 HZ2 LYS 112 HZ2 LYS 112 82.442 -1.545 8.251 863 HZ3 LYS 112 HZ3 LYS 112 82.664 0.006 7.736 864 H TYR 113 H TYR 113 86.706 0.657 4.485 865 HA TYR 113 HA TYR 113 89.563 1.364 4.901 866 HB2 TYR 113 HB3 TYR 113 87.611 3.193 3.520 867 HB3 TYR 113 HB2 TYR 113 89.295 2.804 3.096 868 HD1 TYR 113 HD1 TYR 113 89.841 0.638 1.998 869 HD2 TYR 113 HD2 TYR 113 85.781 1.827 2.752 870 HE1 TYR 113 HE1 TYR 113 89.039 -1.085 0.405 871 HE2 TYR 113 HE2 TYR 113 84.982 0.103 1.159 872 HH TYR 113 HH TYR 113 86.026 -1.139 -0.917 873 H LYS 114 H LYS 114 90.026 2.277 6.854 874 HA LYS 114 HA LYS 114 88.064 4.298 7.943 875 HB2 LYS 114 HB3 LYS 114 90.299 2.662 9.197 876 HB3 LYS 114 HB2 LYS 114 89.571 4.056 10.030 877 HG2 LYS 114 HG2 LYS 114 87.764 1.950 8.849 878 HG3 LYS 114 HG3 LYS 114 88.589 1.614 10.390 879 HD2 LYS 114 HD2 LYS 114 87.196 4.264 10.050 880 HD3 LYS 114 HD3 LYS 114 86.206 2.815 10.347 881 HE2 LYS 114 HE2 LYS 114 88.635 3.305 12.067 882 HE3 LYS 114 HE3 LYS 114 87.152 4.238 12.382 883 HZ1 LYS 114 HZ1 LYS 114 87.196 2.187 13.636 884 HZ2 LYS 114 HZ2 LYS 114 87.331 1.294 12.256 885 HZ3 LYS 114 HZ3 LYS 114 85.957 2.159 12.547 886 H LYS 115 H LYS 115 88.550 6.308 7.180 887 HA LYS 115 HA LYS 115 91.202 7.084 6.295 888 HB2 LYS 115 HB2 LYS 115 90.270 9.394 6.302 889 HB3 LYS 115 HB3 LYS 115 89.158 8.239 5.529 890 HG2 LYS 115 HG2 LYS 115 88.110 8.005 7.914 891 HG3 LYS 115 HG3 LYS 115 88.960 9.530 8.265 892 HD2 LYS 115 HD2 LYS 115 87.810 10.660 6.444 893 HD3 LYS 115 HD3 LYS 115 87.085 9.130 5.894 894 HE2 LYS 115 HE3 LYS 115 86.629 10.105 8.724 895 HE3 LYS 115 HE2 LYS 115 85.653 10.751 7.383 896 HZ1 LYS 115 HZ1 LYS 115 84.626 8.820 8.381 897 HZ2 LYS 115 HZ2 LYS 115 85.954 7.895 8.063 898 HZ3 LYS 115 HZ3 LYS 115 85.049 8.494 6.821 899 H GLY 116 H GLY 116 92.914 7.925 7.412 900 HA2 GLY 116 HA3 GLY 116 93.355 9.522 9.459 901 HA3 GLY 116 HA2 GLY 116 92.513 8.259 10.387 902 H GLY 117 H GLY 117 94.972 8.690 11.285 903 HA2 GLY 117 HA3 GLY 117 96.409 6.215 10.444 904 HA3 GLY 117 HA2 GLY 117 97.300 7.739 10.222 905 H VAL 118 H VAL 118 96.787 5.221 12.356 906 HA VAL 118 HA VAL 118 96.504 6.274 14.925 907 HB VAL 118 HB VAL 118 98.547 4.229 13.959 908 HG11 VAL 118 HG11 VAL 118 99.189 5.173 16.159 909 HG12 VAL 118 HG12 VAL 118 97.553 4.845 16.777 910 HG13 VAL 118 HG13 VAL 118 98.621 3.494 16.325 911 HG21 VAL 118 HG21 VAL 118 96.858 2.614 14.790 912 HG22 VAL 118 HG22 VAL 118 95.790 3.965 15.242 913 HG23 VAL 118 HG23 VAL 118 96.171 3.666 13.529 914 H ALA 119 H ALA 119 99.739 5.871 13.407 915 HA ALA 119 HA ALA 119 101.187 7.444 15.258 916 HB1 ALA 119 HB1 ALA 119 102.815 7.823 13.426 917 HB2 ALA 119 HB2 ALA 119 102.241 6.139 13.432 918 HB3 ALA 119 HB3 ALA 119 101.601 7.293 12.237 919 H SER 120 H SER 120 98.952 8.468 12.750 920 HA SER 120 HA SER 120 99.867 11.264 12.749 921 HB2 SER 120 HB2 SER 120 98.478 9.966 10.937 922 HB3 SER 120 HB3 SER 120 97.080 10.404 11.949 923 HG SER 120 HG SER 120 97.909 11.941 10.188 924 H GLY 121 H GLY 121 98.666 9.518 15.151 925 HA2 GLY 121 HA2 GLY 121 96.392 10.813 16.208 926 HA3 GLY 121 HA3 GLY 121 97.709 10.165 17.215 927 H PHE 122 H PHE 122 99.805 11.883 16.305 928 HA PHE 122 HA PHE 122 99.201 14.242 17.940 929 HB2 PHE 122 HB3 PHE 122 101.557 13.633 16.097 930 HB3 PHE 122 HB2 PHE 122 101.487 14.970 17.270 931 HD1 PHE 122 HD1 PHE 122 102.228 11.479 16.780 932 HD2 PHE 122 HD2 PHE 122 101.073 14.371 19.739 933 HE1 PHE 122 HE1 PHE 122 102.983 9.944 18.574 934 HE2 PHE 122 HE2 PHE 122 101.827 12.833 21.535 935 HZ PHE 122 HZ PHE 122 102.783 10.621 20.952 936 H LYS 123 H LYS 123 99.090 13.471 14.515 937 HA LYS 123 HA LYS 123 99.106 16.257 13.601 938 HB2 LYS 123 HB2 LYS 123 99.489 13.986 12.282 939 HB3 LYS 123 HB3 LYS 123 97.722 14.044 12.082 940 HG2 LYS 123 HG3 LYS 123 98.399 15.257 10.210 941 HG3 LYS 123 HG2 LYS 123 98.215 16.570 11.397 942 HD2 LYS 123 HD2 LYS 123 100.672 16.306 11.950 943 HD3 LYS 123 HD3 LYS 123 100.797 15.163 10.591 944 HE2 LYS 123 HE3 LYS 123 100.420 18.134 10.569 945 HE3 LYS 123 HE2 LYS 123 101.323 17.092 9.443 946 HZ1 LYS 123 HZ1 LYS 123 99.447 17.806 8.286 947 HZ2 LYS 123 HZ2 LYS 123 98.421 17.554 9.552 948 HZ3 LYS 123 HZ3 LYS 123 99.065 16.269 8.744 949 H HIS 124 H HIS 124 96.621 13.955 14.662 950 HA HIS 124 HA HIS 124 94.689 16.256 14.715 951 HB2 HIS 124 HB2 HIS 124 94.469 14.795 12.564 952 HB3 HIS 124 HB3 HIS 124 93.812 13.553 13.656 953 HD2 HIS 124 HD2 HIS 124 92.987 17.471 13.522 954 HE1 HIS 124 HE1 HIS 124 89.384 15.270 13.463 955 HE2 HIS 124 HE2 HIS 124 90.365 17.628 13.494 956 H VAL 125 H VAL 125 93.977 16.335 16.779 957 HA VAL 125 HA VAL 125 94.263 14.028 18.572 958 HB VAL 125 HB VAL 125 92.599 16.533 19.048 959 HG11 VAL 125 HG11 VAL 125 92.387 14.701 20.707 960 HG12 VAL 125 HG12 VAL 125 94.157 14.662 20.890 961 HG13 VAL 125 HG13 VAL 125 93.240 16.098 21.405 962 HG21 VAL 125 HG21 VAL 125 94.678 17.537 19.956 963 HG22 VAL 125 HG22 VAL 125 95.595 16.101 19.444 964 HG23 VAL 125 HG23 VAL 125 94.853 17.164 18.225 965 H VAL 126 H VAL 126 92.602 12.730 19.460 966 HA VAL 126 HA VAL 126 89.871 13.064 18.221 967 HB VAL 126 HB VAL 126 91.248 10.362 18.466 968 HG11 VAL 126 HG11 VAL 126 88.772 10.394 18.343 969 HG12 VAL 126 HG12 VAL 126 88.859 11.376 16.861 970 HG13 VAL 126 HG13 VAL 126 89.476 9.706 16.860 971 HG21 VAL 126 HG21 VAL 126 91.338 10.704 15.843 972 HG22 VAL 126 HG22 VAL 126 92.633 11.371 16.867 973 HG23 VAL 126 HG23 VAL 126 91.336 12.433 16.267 974 HA PRO 127 HA PRO 127 89.088 12.862 22.688 975 HB2 PRO 127 HB2 PRO 127 86.332 12.381 21.558 976 HB3 PRO 127 HB3 PRO 127 86.853 13.496 22.854 977 HG2 PRO 127 HG2 PRO 127 86.291 14.364 20.375 978 HG3 PRO 127 HG3 PRO 127 87.573 15.100 21.375 979 HD2 PRO 127 HD3 PRO 127 87.817 13.332 18.973 980 HD3 PRO 127 HD2 PRO 127 88.956 14.562 19.599 981 H ASN 128 H ASN 128 89.125 11.097 24.020 982 HA ASN 128 HA ASN 128 89.381 8.454 23.158 983 HB2 ASN 128 HB2 ASN 128 88.173 9.578 25.709 984 HB3 ASN 128 HB3 ASN 128 88.377 7.827 25.461 985 HD21 ASN 128 HD21 ASN 128 90.777 9.612 23.765 986 HD22 ASN 128 HD22 ASN 128 92.061 9.442 24.940 987 H GLU 129 H GLU 129 87.974 6.678 22.820 988 HA GLU 129 HA GLU 129 85.354 7.414 21.710 989 HB2 GLU 129 HB3 GLU 129 86.843 4.810 22.159 990 HB3 GLU 129 HB2 GLU 129 85.147 4.812 21.620 991 HG2 GLU 129 HG2 GLU 129 85.683 6.033 19.625 992 HG3 GLU 129 HG3 GLU 129 87.312 6.430 20.222 993 H VAL 130 H VAL 130 86.543 6.351 24.815 994 HA VAL 130 HA VAL 130 84.248 5.080 25.905 995 HB VAL 130 HB VAL 130 85.955 7.122 27.386 996 HG11 VAL 130 HG11 VAL 130 83.989 6.217 28.598 997 HG12 VAL 130 HG12 VAL 130 85.508 5.611 29.301 998 HG13 VAL 130 HG13 VAL 130 84.535 4.560 28.244 999 HG21 VAL 130 HG21 VAL 130 87.499 5.235 27.842 1000 HG22 VAL 130 HG22 VAL 130 86.526 4.184 26.785 1001 HG23 VAL 130 HG23 VAL 130 87.401 5.573 26.097 1002 H VAL 131 H VAL 131 84.904 8.552 25.409 1003 HA VAL 131 HA VAL 131 82.498 9.426 26.827 1004 HB VAL 131 HB VAL 131 84.128 10.830 24.661 1005 HG11 VAL 131 HG11 VAL 131 81.873 11.804 25.003 1006 HG12 VAL 131 HG12 VAL 131 83.139 12.887 25.629 1007 HG13 VAL 131 HG13 VAL 131 82.179 11.897 26.754 1008 HG21 VAL 131 HG21 VAL 131 85.241 11.935 26.584 1009 HG22 VAL 131 HG22 VAL 131 85.475 10.171 26.638 1010 HG23 VAL 131 HG23 VAL 131 84.281 10.944 27.708 1011 H VAL 132 H VAL 132 83.268 8.586 23.451 1012 HA VAL 132 HA VAL 132 80.681 9.493 22.416 1013 HB VAL 132 HB VAL 132 82.598 7.421 21.260 1014 HG11 VAL 132 HG11 VAL 132 80.338 7.446 20.238 1015 HG12 VAL 132 HG12 VAL 132 81.556 8.091 19.112 1016 HG13 VAL 132 HG13 VAL 132 80.473 9.203 19.983 1017 HG21 VAL 132 HG21 VAL 132 83.732 9.574 21.743 1018 HG22 VAL 132 HG22 VAL 132 82.453 10.444 20.862 1019 HG23 VAL 132 HG23 VAL 132 83.536 9.333 19.990 1020 H GLN 133 H GLN 133 81.882 6.556 23.936 1021 HA GLN 133 HA GLN 133 79.130 5.354 23.531 1022 HB2 GLN 133 HB3 GLN 133 81.832 3.950 23.734 1023 HB3 GLN 133 HB2 GLN 133 80.258 3.122 23.697 1024 HG2 GLN 133 HG2 GLN 133 79.866 4.522 21.505 1025 HG3 GLN 133 HG3 GLN 133 81.637 4.694 21.510 1026 HE21 GLN 133 HE21 GLN 133 78.983 2.260 21.467 1027 HE22 GLN 133 HE22 GLN 133 79.963 0.982 20.785 Start of MODEL 11 1 H1 GLU 1 H1 GLU 1 111.783 -8.246 21.972 2 H2 GLU 1 H2 GLU 1 112.171 -7.484 23.382 3 H3 GLU 1 H3 GLU 1 110.598 -7.851 23.048 4 HA GLU 1 HA GLU 1 112.754 -9.811 23.517 5 HB2 GLU 1 HB2 GLU 1 111.649 -8.350 25.455 6 HB3 GLU 1 HB3 GLU 1 110.304 -9.496 25.244 7 HG2 GLU 1 HG3 GLU 1 113.206 -10.146 25.909 8 HG3 GLU 1 HG2 GLU 1 111.775 -10.413 26.934 9 H HIS 2 H HIS 2 112.230 -11.904 22.961 10 HA HIS 2 HA HIS 2 111.014 -13.601 21.844 11 HB2 HIS 2 HB2 HIS 2 109.009 -12.265 23.656 12 HB3 HIS 2 HB3 HIS 2 108.433 -13.480 22.491 13 HD2 HIS 2 HD2 HIS 2 110.783 -15.725 22.727 14 HE1 HIS 2 HE1 HIS 2 110.138 -15.564 26.897 15 HE2 HIS 2 HE2 HIS 2 111.160 -16.955 25.015 16 HA PRO 3 HA PRO 3 109.476 -10.451 18.712 17 HB2 PRO 3 HB2 PRO 3 111.417 -10.923 16.812 18 HB3 PRO 3 HB3 PRO 3 111.593 -9.717 18.119 19 HG2 PRO 3 HG3 PRO 3 112.727 -12.474 17.896 20 HG3 PRO 3 HG2 PRO 3 113.460 -10.989 18.562 21 HD2 PRO 3 HD2 PRO 3 112.363 -13.015 20.119 22 HD3 PRO 3 HD3 PRO 3 112.501 -11.310 20.646 23 H GLU 4 H GLU 4 107.698 -11.462 17.856 24 HA GLU 4 HA GLU 4 107.901 -14.220 16.800 25 HB2 GLU 4 HB3 GLU 4 105.622 -12.190 16.713 26 HB3 GLU 4 HB2 GLU 4 105.492 -13.907 16.262 27 HG2 GLU 4 HG2 GLU 4 106.390 -14.426 18.624 28 HG3 GLU 4 HG3 GLU 4 106.062 -12.718 19.001 29 H PHE 5 H PHE 5 107.920 -10.928 15.532 30 HA PHE 5 HA PHE 5 107.238 -11.430 12.813 31 HB2 PHE 5 HB3 PHE 5 107.582 -9.161 13.446 32 HB3 PHE 5 HB2 PHE 5 109.194 -9.505 14.116 33 HD1 PHE 5 HD1 PHE 5 110.832 -8.452 12.839 34 HD2 PHE 5 HD2 PHE 5 107.533 -10.343 10.841 35 HE1 PHE 5 HE1 PHE 5 111.861 -7.929 10.644 36 HE2 PHE 5 HE2 PHE 5 108.559 -9.815 8.647 37 HZ PHE 5 HZ PHE 5 110.727 -8.612 8.548 38 H LEU 6 H LEU 6 110.054 -12.414 14.636 39 HA LEU 6 HA LEU 6 111.700 -12.915 12.231 40 HB2 LEU 6 HB2 LEU 6 112.283 -12.591 14.890 41 HB3 LEU 6 HB3 LEU 6 112.323 -14.365 14.760 42 HG LEU 6 HG LEU 6 113.820 -12.469 12.898 43 HD11 LEU 6 HD11 LEU 6 114.698 -12.358 15.215 44 HD12 LEU 6 HD12 LEU 6 114.819 -14.133 15.254 45 HD13 LEU 6 HD13 LEU 6 115.841 -13.195 14.138 46 HD21 LEU 6 HD21 LEU 6 115.080 -14.735 12.524 47 HD22 LEU 6 HD22 LEU 6 113.620 -15.475 13.224 48 HD23 LEU 6 HD23 LEU 6 113.500 -14.501 11.739 49 H LYS 7 H LYS 7 109.031 -14.444 13.650 50 HA LYS 7 HA LYS 7 109.821 -17.044 12.310 51 HB2 LYS 7 HB2 LYS 7 108.502 -16.506 14.972 52 HB3 LYS 7 HB3 LYS 7 108.083 -17.986 14.076 53 HG2 LYS 7 HG3 LYS 7 110.355 -18.749 14.081 54 HG3 LYS 7 HG2 LYS 7 110.963 -17.161 14.606 55 HD2 LYS 7 HD2 LYS 7 108.965 -18.587 16.353 56 HD3 LYS 7 HD3 LYS 7 110.653 -19.151 16.355 57 HE2 LYS 7 HE3 LYS 7 109.994 -16.207 16.663 58 HE3 LYS 7 HE2 LYS 7 109.969 -17.302 18.066 59 HZ1 LYS 7 HZ1 LYS 7 112.128 -16.285 17.770 60 HZ2 LYS 7 HZ2 LYS 7 112.258 -16.902 16.246 61 HZ3 LYS 7 HZ3 LYS 7 112.234 -17.916 17.546 62 H ALA 8 H ALA 8 106.999 -15.150 13.493 63 HA ALA 8 HA ALA 8 104.876 -14.861 12.503 64 HB1 ALA 8 HB1 ALA 8 106.749 -15.157 10.168 65 HB2 ALA 8 HB2 ALA 8 105.001 -15.240 9.845 66 HB3 ALA 8 HB3 ALA 8 105.697 -13.792 10.613 67 H GLY 9 H GLY 9 103.044 -16.110 11.817 68 HA2 GLY 9 HA2 GLY 9 101.875 -18.183 11.898 69 HA3 GLY 9 HA3 GLY 9 102.978 -18.605 10.566 70 H LYS 10 H LYS 10 103.799 -17.959 13.987 71 HA LYS 10 HA LYS 10 105.703 -19.964 14.328 72 HB2 LYS 10 HB2 LYS 10 103.533 -19.299 16.367 73 HB3 LYS 10 HB3 LYS 10 105.142 -19.977 16.713 74 HG2 LYS 10 HG2 LYS 10 106.200 -17.936 15.773 75 HG3 LYS 10 HG3 LYS 10 104.588 -17.258 15.440 76 HD2 LYS 10 HD2 LYS 10 105.660 -18.033 18.191 77 HD3 LYS 10 HD3 LYS 10 105.507 -16.373 17.568 78 HE2 LYS 10 HE3 LYS 10 103.354 -18.309 18.411 79 HE3 LYS 10 HE2 LYS 10 103.512 -16.571 18.759 80 HZ1 LYS 10 HZ1 LYS 10 101.852 -16.698 17.172 81 HZ2 LYS 10 HZ2 LYS 10 103.177 -16.310 16.269 82 HZ3 LYS 10 HZ3 LYS 10 102.613 -17.859 16.280 83 H GLU 11 H GLU 11 102.217 -20.372 14.039 84 HA GLU 11 HA GLU 11 102.677 -23.333 13.903 85 HB2 GLU 11 HB3 GLU 11 100.964 -23.867 15.488 86 HB3 GLU 11 HB2 GLU 11 101.976 -22.637 16.282 87 HG2 GLU 11 HG2 GLU 11 99.270 -22.250 14.941 88 HG3 GLU 11 HG3 GLU 11 99.697 -21.963 16.645 89 HA PRO 12 HA PRO 12 100.095 -23.277 10.331 90 HB2 PRO 12 HB2 PRO 12 98.389 -25.259 11.847 91 HB3 PRO 12 HB3 PRO 12 99.019 -25.345 10.177 92 HG2 PRO 12 HG2 PRO 12 100.135 -26.700 12.238 93 HG3 PRO 12 HG3 PRO 12 101.070 -26.099 10.843 94 HD2 PRO 12 HD3 PRO 12 101.085 -25.158 13.656 95 HD3 PRO 12 HD2 PRO 12 102.287 -24.870 12.363 96 H GLY 13 H GLY 13 98.671 -21.655 9.881 97 HA2 GLY 13 HA2 GLY 13 96.020 -21.422 10.611 98 HA3 GLY 13 HA3 GLY 13 96.840 -20.694 12.012 99 H LEU 14 H LEU 14 95.546 -18.765 11.171 100 HA LEU 14 HA LEU 14 97.162 -17.357 9.028 101 HB2 LEU 14 HB3 LEU 14 94.800 -17.902 8.356 102 HB3 LEU 14 HB2 LEU 14 94.222 -16.935 9.733 103 HG LEU 14 HG LEU 14 96.116 -15.778 7.660 104 HD11 LEU 14 HD11 LEU 14 94.119 -14.848 6.522 105 HD12 LEU 14 HD12 LEU 14 94.116 -16.627 6.475 106 HD13 LEU 14 HD13 LEU 14 93.066 -15.765 7.625 107 HD21 LEU 14 HD21 LEU 14 94.456 -13.778 8.562 108 HD22 LEU 14 HD22 LEU 14 96.040 -14.162 9.279 109 HD23 LEU 14 HD23 LEU 14 94.552 -14.820 10.002 110 H GLN 15 H GLN 15 98.143 -15.498 9.682 111 HA GLN 15 HA GLN 15 97.132 -14.247 12.250 112 HB2 GLN 15 HB2 GLN 15 100.028 -14.380 11.300 113 HB3 GLN 15 HB3 GLN 15 99.439 -13.735 12.851 114 HG2 GLN 15 HG2 GLN 15 98.361 -16.165 13.065 115 HG3 GLN 15 HG3 GLN 15 99.655 -16.594 11.922 116 HE21 GLN 15 HE21 GLN 15 101.845 -16.593 12.683 117 HE22 GLN 15 HE22 GLN 15 102.251 -16.298 14.359 118 H ILE 16 H ILE 16 97.740 -11.888 12.418 119 HA ILE 16 HA ILE 16 98.087 -10.619 9.700 120 HB ILE 16 HB ILE 16 96.151 -9.413 11.670 121 HG12 ILE 16 HG13 ILE 16 95.655 -11.823 9.880 122 HG13 ILE 16 HG12 ILE 16 95.296 -11.649 11.615 123 HG21 ILE 16 HG21 ILE 16 97.035 -8.476 9.359 124 HG22 ILE 16 HG22 ILE 16 95.852 -9.615 8.671 125 HG23 ILE 16 HG23 ILE 16 95.310 -8.327 9.773 126 HD11 ILE 16 HD11 ILE 16 93.183 -11.299 10.665 127 HD12 ILE 16 HD12 ILE 16 93.790 -9.632 10.800 128 HD13 ILE 16 HD13 ILE 16 93.851 -10.477 9.235 129 H TRP 17 H TRP 17 99.407 -8.824 9.730 130 HA TRP 17 HA TRP 17 99.999 -7.571 12.402 131 HB2 TRP 17 HB2 TRP 17 102.202 -8.391 10.466 132 HB3 TRP 17 HB3 TRP 17 102.384 -7.762 12.121 133 HD1 TRP 17 HD1 TRP 17 100.633 -9.438 13.863 134 HE1 TRP 17 HE1 TRP 17 100.867 -11.992 14.134 135 HE3 TRP 17 HE3 TRP 17 103.142 -10.486 9.541 136 HZ2 TRP 17 HZ2 TRP 17 102.004 -14.189 12.651 137 HZ3 TRP 17 HZ3 TRP 17 103.789 -12.813 8.995 138 HH2 TRP 17 HH2 TRP 17 103.221 -14.665 10.543 139 H ARG 18 H ARG 18 100.090 -5.374 12.232 140 HA ARG 18 HA ARG 18 99.952 -4.230 9.459 141 HB2 ARG 18 HB2 ARG 18 98.252 -3.539 11.147 142 HB3 ARG 18 HB3 ARG 18 99.555 -2.904 12.180 143 HG2 ARG 18 HG2 ARG 18 100.241 -1.393 10.283 144 HG3 ARG 18 HG3 ARG 18 98.815 -1.954 9.377 145 HD2 ARG 18 HD3 ARG 18 98.155 0.087 10.458 146 HD3 ARG 18 HD2 ARG 18 97.413 -1.230 11.397 147 HE ARG 18 HE ARG 18 100.042 -0.524 12.469 148 HH11 ARG 18 HH11 ARG 18 100.031 0.598 14.433 149 HH12 ARG 18 HH12 ARG 18 98.566 1.378 14.986 150 HH21 ARG 18 HH21 ARG 18 96.695 0.397 12.218 151 HH22 ARG 18 HH22 ARG 18 96.684 1.265 13.737 152 H VAL 19 H VAL 19 101.456 -2.705 8.694 153 HA VAL 19 HA VAL 19 103.986 -2.561 10.340 154 HB VAL 19 HB VAL 19 103.982 -1.768 7.457 155 HG11 VAL 19 HG11 VAL 19 106.035 -1.770 8.850 156 HG12 VAL 19 HG12 VAL 19 106.148 -2.970 7.540 157 HG13 VAL 19 HG13 VAL 19 105.792 -3.498 9.203 158 HG21 VAL 19 HG21 VAL 19 104.253 -4.272 6.896 159 HG22 VAL 19 HG22 VAL 19 102.598 -3.702 7.216 160 HG23 VAL 19 HG23 VAL 19 103.490 -4.593 8.472 161 H GLU 20 H GLU 20 104.933 -0.568 10.735 162 HA GLU 20 HA GLU 20 103.398 1.846 9.746 163 HB2 GLU 20 HB3 GLU 20 102.964 1.143 12.210 164 HB3 GLU 20 HB2 GLU 20 104.636 1.674 12.514 165 HG2 GLU 20 HG2 GLU 20 103.440 3.644 12.932 166 HG3 GLU 20 HG3 GLU 20 103.870 3.849 11.217 167 H LYS 21 H LYS 21 105.011 2.266 8.169 168 HA LYS 21 HA LYS 21 106.948 3.491 7.526 169 HB2 LYS 21 HB2 LYS 21 106.653 4.382 10.048 170 HB3 LYS 21 HB3 LYS 21 108.129 3.416 10.287 171 HG2 LYS 21 HG3 LYS 21 109.155 4.614 8.319 172 HG3 LYS 21 HG2 LYS 21 107.713 5.656 8.258 173 HD2 LYS 21 HD2 LYS 21 108.205 6.677 10.321 174 HD3 LYS 21 HD3 LYS 21 109.246 5.334 10.848 175 HE2 LYS 21 HE3 LYS 21 110.250 7.663 9.912 176 HE3 LYS 21 HE2 LYS 21 111.071 6.103 9.666 177 HZ1 LYS 21 HZ1 LYS 21 110.691 7.530 7.643 178 HZ2 LYS 21 HZ2 LYS 21 109.093 7.139 7.754 179 HZ3 LYS 21 HZ3 LYS 21 110.217 5.955 7.519 180 H PHE 22 H PHE 22 108.050 1.453 10.295 181 HA PHE 22 HA PHE 22 109.248 -0.496 8.419 182 HB2 PHE 22 HB2 PHE 22 110.811 1.623 8.619 183 HB3 PHE 22 HB3 PHE 22 111.215 0.940 10.212 184 HD1 PHE 22 HD1 PHE 22 110.955 0.005 6.584 185 HD2 PHE 22 HD2 PHE 22 112.815 -0.766 10.380 186 HE1 PHE 22 HE1 PHE 22 112.498 -1.608 5.502 187 HE2 PHE 22 HE2 PHE 22 114.358 -2.378 9.296 188 HZ PHE 22 HZ PHE 22 114.197 -2.799 6.858 189 H ASP 23 H ASP 23 107.551 -0.056 11.036 190 HA ASP 23 HA ASP 23 108.980 -2.248 12.562 191 HB2 ASP 23 HB3 ASP 23 107.919 -1.223 14.636 192 HB3 ASP 23 HB2 ASP 23 109.198 -0.239 13.885 193 H LEU 24 H LEU 24 107.772 -4.067 12.362 194 HA LEU 24 HA LEU 24 105.030 -4.102 11.498 195 HB2 LEU 24 HB2 LEU 24 106.881 -6.081 12.821 196 HB3 LEU 24 HB3 LEU 24 105.146 -6.465 12.728 197 HG LEU 24 HG LEU 24 105.282 -5.914 10.235 198 HD11 LEU 24 HD11 LEU 24 107.799 -6.337 9.464 199 HD12 LEU 24 HD12 LEU 24 108.165 -5.657 11.068 200 HD13 LEU 24 HD13 LEU 24 107.238 -4.701 9.887 201 HD21 LEU 24 HD21 LEU 24 105.160 -8.206 10.588 202 HD22 LEU 24 HD22 LEU 24 106.779 -8.106 9.857 203 HD23 LEU 24 HD23 LEU 24 106.607 -8.230 11.624 204 H VAL 25 H VAL 25 103.074 -4.407 12.678 205 HA VAL 25 HA VAL 25 103.197 -4.288 15.654 206 HB VAL 25 HB VAL 25 102.052 -2.035 13.945 207 HG11 VAL 25 HG11 VAL 25 100.458 -2.674 15.734 208 HG12 VAL 25 HG12 VAL 25 101.765 -2.562 16.938 209 HG13 VAL 25 HG13 VAL 25 101.213 -1.101 16.084 210 HG21 VAL 25 HG21 VAL 25 103.521 -0.699 15.578 211 HG22 VAL 25 HG22 VAL 25 104.387 -1.694 14.383 212 HG23 VAL 25 HG23 VAL 25 104.227 -2.259 16.063 213 HA PRO 26 HA PRO 26 99.818 -7.123 14.703 214 HB2 PRO 26 HB3 PRO 26 99.119 -6.328 17.529 215 HB3 PRO 26 HB2 PRO 26 99.202 -7.957 16.800 216 HG2 PRO 26 HG2 PRO 26 101.142 -6.999 18.402 217 HG3 PRO 26 HG3 PRO 26 101.491 -8.078 17.023 218 HD2 PRO 26 HD3 PRO 26 102.029 -5.156 17.329 219 HD3 PRO 26 HD2 PRO 26 102.850 -6.359 16.290 220 H VAL 27 H VAL 27 97.537 -6.946 14.345 221 HA VAL 27 HA VAL 27 96.572 -4.089 14.404 222 HB VAL 27 HB VAL 27 96.582 -5.336 12.217 223 HG11 VAL 27 HG11 VAL 27 95.323 -7.282 11.881 224 HG12 VAL 27 HG12 VAL 27 95.919 -7.532 13.539 225 HG13 VAL 27 HG13 VAL 27 94.257 -6.953 13.268 226 HG21 VAL 27 HG21 VAL 27 94.251 -4.747 11.611 227 HG22 VAL 27 HG22 VAL 27 94.982 -3.490 12.637 228 HG23 VAL 27 HG23 VAL 27 93.828 -4.650 13.337 229 HA PRO 28 HA PRO 28 93.991 -4.848 17.951 230 HB2 PRO 28 HB2 PRO 28 92.001 -3.283 16.304 231 HB3 PRO 28 HB3 PRO 28 92.492 -3.062 18.008 232 HG2 PRO 28 HG3 PRO 28 93.399 -1.490 16.004 233 HG3 PRO 28 HG2 PRO 28 94.365 -1.869 17.455 234 HD2 PRO 28 HD2 PRO 28 94.739 -2.790 14.652 235 HD3 PRO 28 HD3 PRO 28 95.904 -2.776 16.009 236 H THR 29 H THR 29 92.562 -6.474 18.467 237 HA THR 29 HA THR 29 91.577 -8.214 16.335 238 HB THR 29 HB THR 29 90.556 -8.198 19.196 239 HG1 THR 29 HG1 THR 29 92.435 -9.480 19.648 240 HG21 THR 29 HG21 THR 29 90.491 -10.645 18.807 241 HG22 THR 29 HG22 THR 29 89.537 -9.776 17.580 242 HG23 THR 29 HG23 THR 29 91.153 -10.402 17.172 243 H ASN 30 H ASN 30 90.236 -5.523 18.170 244 HA ASN 30 HA ASN 30 87.443 -6.023 17.668 245 HB2 ASN 30 HB2 ASN 30 89.098 -3.537 18.166 246 HB3 ASN 30 HB3 ASN 30 87.372 -3.395 17.753 247 HD21 ASN 30 HD21 ASN 30 87.631 -2.466 20.182 248 HD22 ASN 30 HD22 ASN 30 87.302 -3.645 21.432 249 H LEU 31 H LEU 31 89.955 -4.385 15.715 250 HA LEU 31 HA LEU 31 88.025 -3.658 13.608 251 HB2 LEU 31 HB3 LEU 31 91.036 -3.592 13.907 252 HB3 LEU 31 HB2 LEU 31 90.294 -3.343 12.309 253 HG LEU 31 HG LEU 31 89.018 -1.452 13.111 254 HD11 LEU 31 HD11 LEU 31 89.337 -0.731 15.552 255 HD12 LEU 31 HD12 LEU 31 90.030 -2.345 15.838 256 HD13 LEU 31 HD13 LEU 31 88.343 -2.185 15.295 257 HD21 LEU 31 HD21 LEU 31 90.834 0.066 13.854 258 HD22 LEU 31 HD22 LEU 31 91.391 -1.008 12.549 259 HD23 LEU 31 HD23 LEU 31 91.854 -1.342 14.235 260 H TYR 32 H TYR 32 90.755 -5.992 13.779 261 HA TYR 32 HA TYR 32 91.194 -7.807 12.280 262 HB2 TYR 32 HB2 TYR 32 89.474 -8.497 14.151 263 HB3 TYR 32 HB3 TYR 32 88.311 -8.557 12.805 264 HD1 TYR 32 HD1 TYR 32 88.088 -10.585 11.692 265 HD2 TYR 32 HD2 TYR 32 91.842 -9.643 13.554 266 HE1 TYR 32 HE1 TYR 32 88.977 -12.802 11.023 267 HE2 TYR 32 HE2 TYR 32 92.731 -11.858 12.885 268 HH TYR 32 HH TYR 32 91.660 -14.200 12.323 269 H GLY 33 H GLY 33 91.232 -6.374 10.331 270 HA2 GLY 33 HA2 GLY 33 90.538 -6.918 7.967 271 HA3 GLY 33 HA3 GLY 33 88.861 -7.007 8.553 272 H ASP 34 H ASP 34 89.187 -4.646 10.329 273 HA ASP 34 HA ASP 34 88.727 -2.601 8.208 274 HB2 ASP 34 HB2 ASP 34 87.157 -2.542 10.020 275 HB3 ASP 34 HB3 ASP 34 88.452 -2.616 11.239 276 H PHE 35 H PHE 35 90.372 -1.354 7.458 277 HA PHE 35 HA PHE 35 92.465 -0.475 9.415 278 HB2 PHE 35 HB2 PHE 35 94.063 -1.062 7.270 279 HB3 PHE 35 HB3 PHE 35 93.835 -2.145 8.664 280 HD1 PHE 35 HD1 PHE 35 91.539 -1.247 5.829 281 HD2 PHE 35 HD2 PHE 35 93.752 -4.335 7.835 282 HE1 PHE 35 HE1 PHE 35 90.514 -2.947 4.342 283 HE2 PHE 35 HE2 PHE 35 92.730 -6.035 6.346 284 HZ PHE 35 HZ PHE 35 91.109 -5.340 4.599 285 H PHE 36 H PHE 36 93.955 1.180 8.344 286 HA PHE 36 HA PHE 36 92.227 3.045 6.790 287 HB2 PHE 36 HB2 PHE 36 95.029 3.283 7.971 288 HB3 PHE 36 HB3 PHE 36 94.226 4.587 7.065 289 HD1 PHE 36 HD1 PHE 36 93.577 2.218 9.915 290 HD2 PHE 36 HD2 PHE 36 92.917 6.117 8.239 291 HE1 PHE 36 HE1 PHE 36 92.360 2.895 11.969 292 HE2 PHE 36 HE2 PHE 36 91.696 6.793 10.290 293 HZ PHE 36 HZ PHE 36 91.419 5.181 12.155 294 H THR 37 H THR 37 92.114 2.574 4.637 295 HA THR 37 HA THR 37 93.936 1.117 3.068 296 HB THR 37 HB THR 37 93.109 2.715 1.158 297 HG1 THR 37 HG1 THR 37 91.516 4.113 1.762 298 HG21 THR 37 HG21 THR 37 92.154 0.495 1.573 299 HG22 THR 37 HG22 THR 37 91.200 1.130 2.934 300 HG23 THR 37 HG23 THR 37 90.838 1.655 1.272 301 H GLY 38 H GLY 38 94.549 4.069 4.649 302 HA2 GLY 38 HA3 GLY 38 96.613 4.928 2.662 303 HA3 GLY 38 HA2 GLY 38 96.165 5.794 4.150 304 H ASP 39 H ASP 39 96.659 2.374 4.441 305 HA ASP 39 HA ASP 39 99.482 2.851 5.406 306 HB2 ASP 39 HB2 ASP 39 97.118 1.746 6.917 307 HB3 ASP 39 HB3 ASP 39 98.732 1.070 7.244 308 H ALA 40 H ALA 40 99.976 0.229 6.292 309 HA ALA 40 HA ALA 40 99.276 -1.482 3.910 310 HB1 ALA 40 HB1 ALA 40 101.646 -2.181 3.700 311 HB2 ALA 40 HB2 ALA 40 101.468 -0.432 3.428 312 HB3 ALA 40 HB3 ALA 40 102.098 -1.031 4.981 313 H TYR 41 H TYR 41 99.052 -3.655 4.416 314 HA TYR 41 HA TYR 41 99.804 -4.453 7.236 315 HB2 TYR 41 HB3 TYR 41 97.192 -5.009 5.761 316 HB3 TYR 41 HB2 TYR 41 97.675 -5.813 7.274 317 HD1 TYR 41 HD1 TYR 41 97.015 -4.855 9.291 318 HD2 TYR 41 HD2 TYR 41 97.373 -2.354 5.815 319 HE1 TYR 41 HE1 TYR 41 96.154 -2.925 10.590 320 HE2 TYR 41 HE2 TYR 41 96.510 -0.426 7.115 321 HH TYR 41 HH TYR 41 96.403 0.262 9.573 322 H VAL 42 H VAL 42 99.907 -6.877 7.468 323 HA VAL 42 HA VAL 42 100.433 -8.259 4.840 324 HB VAL 42 HB VAL 42 102.316 -8.660 7.172 325 HG11 VAL 42 HG11 VAL 42 102.366 -10.210 5.238 326 HG12 VAL 42 HG12 VAL 42 103.861 -9.249 5.327 327 HG13 VAL 42 HG13 VAL 42 102.604 -8.830 4.139 328 HG21 VAL 42 HG21 VAL 42 103.798 -6.950 5.857 329 HG22 VAL 42 HG22 VAL 42 102.253 -6.362 5.196 330 HG23 VAL 42 HG23 VAL 42 102.544 -6.318 6.952 331 H ILE 43 H ILE 43 99.573 -10.295 4.820 332 HA ILE 43 HA ILE 43 98.747 -11.420 7.508 333 HB ILE 43 HB ILE 43 97.416 -12.410 5.024 334 HG12 ILE 43 HG13 ILE 43 96.820 -9.665 6.208 335 HG13 ILE 43 HG12 ILE 43 97.604 -9.948 4.636 336 HG21 ILE 43 HG21 ILE 43 95.435 -12.252 6.562 337 HG22 ILE 43 HG22 ILE 43 96.758 -13.237 7.232 338 HG23 ILE 43 HG23 ILE 43 96.505 -11.573 7.813 339 HD11 ILE 43 HD11 ILE 43 95.175 -9.540 4.358 340 HD12 ILE 43 HD12 ILE 43 94.821 -10.911 5.435 341 HD13 ILE 43 HD13 ILE 43 95.605 -11.194 3.863 342 H LEU 44 H LEU 44 99.118 -13.587 7.901 343 HA LEU 44 HA LEU 44 100.863 -15.002 5.865 344 HB2 LEU 44 HB2 LEU 44 101.309 -14.331 8.682 345 HB3 LEU 44 HB3 LEU 44 101.397 -16.088 8.419 346 HG LEU 44 HG LEU 44 103.603 -14.880 8.130 347 HD11 LEU 44 HD11 LEU 44 104.182 -16.045 6.021 348 HD12 LEU 44 HD12 LEU 44 103.161 -17.066 7.061 349 HD13 LEU 44 HD13 LEU 44 102.451 -16.239 5.654 350 HD21 LEU 44 HD21 LEU 44 102.282 -12.910 6.938 351 HD22 LEU 44 HD22 LEU 44 102.558 -13.888 5.477 352 HD23 LEU 44 HD23 LEU 44 103.942 -13.308 6.434 353 H LYS 45 H LYS 45 100.482 -17.283 5.634 354 HA LYS 45 HA LYS 45 98.276 -18.424 7.320 355 HB2 LYS 45 HB2 LYS 45 97.588 -17.313 4.930 356 HB3 LYS 45 HB3 LYS 45 98.015 -18.955 4.393 357 HG2 LYS 45 HG3 LYS 45 96.544 -19.743 6.408 358 HG3 LYS 45 HG2 LYS 45 95.883 -18.091 6.366 359 HD2 LYS 45 HD2 LYS 45 95.917 -20.094 4.063 360 HD3 LYS 45 HD3 LYS 45 94.489 -19.559 4.981 361 HE2 LYS 45 HE2 LYS 45 94.376 -18.163 3.108 362 HE3 LYS 45 HE3 LYS 45 95.294 -17.146 4.244 363 HZ1 LYS 45 HZ1 LYS 45 97.017 -17.214 2.884 364 HZ2 LYS 45 HZ2 LYS 45 97.018 -18.862 2.829 365 HZ3 LYS 45 HZ3 LYS 45 96.102 -18.002 1.761 366 H THR 46 H THR 46 99.782 -19.885 8.184 367 HA THR 46 HA THR 46 101.328 -21.618 6.311 368 HB THR 46 HB THR 46 101.111 -21.505 9.350 369 HG1 THR 46 HG1 THR 46 102.294 -19.811 8.391 370 HG21 THR 46 HG21 THR 46 101.559 -23.811 8.679 371 HG22 THR 46 HG22 THR 46 103.067 -23.086 9.285 372 HG23 THR 46 HG23 THR 46 102.810 -23.272 7.534 373 H VAL 47 H VAL 47 100.125 -23.184 5.320 374 HA VAL 47 HA VAL 47 97.857 -24.419 6.804 375 HB VAL 47 HB VAL 47 98.756 -25.592 4.217 376 HG11 VAL 47 HG11 VAL 47 96.654 -26.243 5.360 377 HG12 VAL 47 HG12 VAL 47 96.094 -24.555 5.289 378 HG13 VAL 47 HG13 VAL 47 96.320 -25.483 3.786 379 HG21 VAL 47 HG21 VAL 47 97.615 -23.629 3.013 380 HG22 VAL 47 HG22 VAL 47 97.819 -22.715 4.527 381 HG23 VAL 47 HG23 VAL 47 99.247 -23.316 3.652 382 H GLN 48 H GLN 48 97.710 -26.815 6.871 383 HA GLN 48 HA GLN 48 100.035 -27.905 8.232 384 HB2 GLN 48 HB2 GLN 48 98.722 -29.916 8.459 385 HB3 GLN 48 HB3 GLN 48 97.598 -28.544 8.605 386 HG2 GLN 48 HG2 GLN 48 97.122 -28.788 6.122 387 HG3 GLN 48 HG3 GLN 48 98.074 -30.292 6.154 388 HE21 GLN 48 HE21 GLN 48 95.702 -31.034 5.438 389 HE22 GLN 48 HE22 GLN 48 94.669 -31.541 6.756 390 H LEU 49 H LEU 49 101.253 -29.814 7.618 391 HA LEU 49 HA LEU 49 102.248 -29.650 4.881 392 HB2 LEU 49 HB2 LEU 49 102.658 -31.905 6.893 393 HB3 LEU 49 HB3 LEU 49 103.707 -31.485 5.518 394 HG LEU 49 HG LEU 49 103.591 -29.080 6.849 395 HD11 LEU 49 HD11 LEU 49 104.255 -30.498 9.240 396 HD12 LEU 49 HD12 LEU 49 102.912 -29.358 8.984 397 HD13 LEU 49 HD13 LEU 49 102.668 -31.098 8.703 398 HD21 LEU 49 HD21 LEU 49 105.620 -30.240 6.010 399 HD22 LEU 49 HD22 LEU 49 105.855 -29.659 7.676 400 HD23 LEU 49 HD23 LEU 49 105.528 -31.382 7.372 401 H ARG 50 H ARG 50 99.949 -31.763 6.576 402 HA ARG 50 HA ARG 50 99.726 -33.906 4.766 403 HB2 ARG 50 HB3 ARG 50 97.330 -32.419 5.921 404 HB3 ARG 50 HB2 ARG 50 97.425 -34.140 5.479 405 HG2 ARG 50 HG2 ARG 50 99.237 -32.884 7.575 406 HG3 ARG 50 HG3 ARG 50 97.659 -33.603 7.979 407 HD2 ARG 50 HD2 ARG 50 99.180 -35.389 8.301 408 HD3 ARG 50 HD3 ARG 50 98.524 -35.691 6.674 409 HE ARG 50 HE ARG 50 100.660 -35.148 5.734 410 HH11 ARG 50 HH11 ARG 50 102.867 -34.734 5.997 411 HH12 ARG 50 HH12 ARG 50 103.485 -34.248 7.560 412 HH21 ARG 50 HH21 ARG 50 100.371 -34.361 9.112 413 HH22 ARG 50 HH22 ARG 50 102.078 -34.038 9.316 414 H ASN 51 H ASN 51 98.612 -30.563 4.390 415 HA ASN 51 HA ASN 51 97.169 -31.137 1.884 416 HB2 ASN 51 HB3 ASN 51 98.068 -28.601 3.298 417 HB3 ASN 51 HB2 ASN 51 97.308 -28.558 1.689 418 HD21 ASN 51 HD21 ASN 51 95.371 -30.596 1.913 419 HD22 ASN 51 HD22 ASN 51 94.224 -30.160 3.160 420 H GLY 52 H GLY 52 100.466 -30.499 2.819 421 HA2 GLY 52 HA2 GLY 52 101.851 -31.306 0.654 422 HA3 GLY 52 HA3 GLY 52 101.205 -29.783 0.000 423 H ASN 53 H ASN 53 102.853 -30.969 2.987 424 HA ASN 53 HA ASN 53 104.637 -29.990 4.183 425 HB2 ASN 53 HB2 ASN 53 105.435 -29.895 1.612 426 HB3 ASN 53 HB3 ASN 53 105.316 -28.146 1.916 427 HD21 ASN 53 HD21 ASN 53 107.642 -30.372 1.787 428 HD22 ASN 53 HD22 ASN 53 108.642 -29.898 3.142 429 H LEU 54 H LEU 54 104.822 -28.276 5.607 430 HA LEU 54 HA LEU 54 102.735 -26.492 6.065 431 HB2 LEU 54 HB2 LEU 54 104.427 -24.989 7.170 432 HB3 LEU 54 HB3 LEU 54 104.614 -26.700 7.623 433 HG LEU 54 HG LEU 54 106.188 -26.468 5.325 434 HD11 LEU 54 HD11 LEU 54 105.965 -23.999 5.414 435 HD12 LEU 54 HD12 LEU 54 106.569 -24.007 7.088 436 HD13 LEU 54 HD13 LEU 54 107.637 -24.505 5.755 437 HD21 LEU 54 HD21 LEU 54 106.723 -27.709 7.408 438 HD22 LEU 54 HD22 LEU 54 107.011 -26.168 8.250 439 HD23 LEU 54 HD23 LEU 54 108.079 -26.666 6.916 440 H GLN 55 H GLN 55 101.871 -24.753 4.992 441 HA GLN 55 HA GLN 55 103.648 -23.489 2.886 442 HB2 GLN 55 HB2 GLN 55 101.372 -25.002 2.387 443 HB3 GLN 55 HB3 GLN 55 100.750 -23.335 2.356 444 HG2 GLN 55 HG2 GLN 55 102.548 -22.706 0.758 445 HG3 GLN 55 HG3 GLN 55 103.138 -24.385 0.772 446 HE21 GLN 55 HE21 GLN 55 100.114 -25.210 1.064 447 HE22 GLN 55 HE22 GLN 55 99.536 -25.123 -0.585 448 H TYR 56 H TYR 56 104.205 -21.600 3.891 449 HA TYR 56 HA TYR 56 102.202 -20.030 5.423 450 HB2 TYR 56 HB2 TYR 56 105.095 -19.600 4.586 451 HB3 TYR 56 HB3 TYR 56 104.150 -18.313 5.369 452 HD1 TYR 56 HD1 TYR 56 104.548 -22.035 5.869 453 HD2 TYR 56 HD2 TYR 56 104.597 -18.118 7.633 454 HE1 TYR 56 HE1 TYR 56 105.026 -23.036 8.087 455 HE2 TYR 56 HE2 TYR 56 105.069 -19.120 9.849 456 HH TYR 56 HH TYR 56 104.535 -22.075 10.707 457 H ASP 57 H ASP 57 100.630 -19.020 4.210 458 HA ASP 57 HA ASP 57 101.276 -18.067 1.468 459 HB2 ASP 57 HB2 ASP 57 99.005 -19.038 2.346 460 HB3 ASP 57 HB3 ASP 57 98.747 -17.404 3.002 461 H LEU 58 H LEU 58 101.310 -15.832 0.848 462 HA LEU 58 HA LEU 58 101.480 -13.924 3.191 463 HB2 LEU 58 HB2 LEU 58 103.398 -14.298 0.869 464 HB3 LEU 58 HB3 LEU 58 103.317 -12.769 1.777 465 HG LEU 58 HG LEU 58 103.387 -15.051 3.594 466 HD11 LEU 58 HD11 LEU 58 104.614 -16.095 1.674 467 HD12 LEU 58 HD12 LEU 58 105.760 -14.734 1.706 468 HD13 LEU 58 HD13 LEU 58 105.651 -15.839 3.097 469 HD21 LEU 58 HD21 LEU 58 105.453 -12.864 3.127 470 HD22 LEU 58 HD22 LEU 58 103.932 -12.591 4.010 471 HD23 LEU 58 HD23 LEU 58 105.127 -13.752 4.635 472 H HIS 59 H HIS 59 100.158 -12.215 2.949 473 HA HIS 59 HA HIS 59 99.572 -11.287 0.139 474 HB2 HIS 59 HB3 HIS 59 97.257 -11.019 1.925 475 HB3 HIS 59 HB2 HIS 59 97.346 -11.687 0.279 476 HD2 HIS 59 HD2 HIS 59 98.812 -14.450 0.540 477 HE1 HIS 59 HE1 HIS 59 96.556 -15.220 4.024 478 H TYR 60 H TYR 60 100.467 -9.271 0.164 479 HA TYR 60 HA TYR 60 100.300 -7.663 2.673 480 HB2 TYR 60 HB3 TYR 60 101.376 -5.987 0.752 481 HB3 TYR 60 HB2 TYR 60 102.320 -7.049 1.821 482 HD1 TYR 60 HD1 TYR 60 101.839 -6.140 -1.512 483 HD2 TYR 60 HD2 TYR 60 102.348 -9.628 0.943 484 HE1 TYR 60 HE1 TYR 60 102.649 -7.409 -3.482 485 HE2 TYR 60 HE2 TYR 60 103.149 -10.899 -1.029 486 HH TYR 60 HH TYR 60 104.184 -9.521 -3.833 487 H TRP 61 H TRP 61 98.453 -6.563 3.048 488 HA TRP 61 HA TRP 61 96.682 -5.879 0.753 489 HB2 TRP 61 HB2 TRP 61 95.727 -6.767 2.868 490 HB3 TRP 61 HB3 TRP 61 96.363 -5.352 3.740 491 HD1 TRP 61 HD1 TRP 61 93.945 -6.182 0.833 492 HE1 TRP 61 HE1 TRP 61 92.124 -4.358 0.715 493 HE3 TRP 61 HE3 TRP 61 95.684 -3.059 4.478 494 HZ2 TRP 61 HZ2 TRP 61 91.516 -1.873 2.047 495 HZ3 TRP 61 HZ3 TRP 61 94.467 -0.974 5.034 496 HH2 TRP 61 HH2 TRP 61 92.388 -0.377 3.825 497 H LEU 62 H LEU 62 96.946 -4.019 -0.329 498 HA LEU 62 HA LEU 62 97.980 -1.635 1.229 499 HB2 LEU 62 HB2 LEU 62 98.391 -1.778 -1.737 500 HB3 LEU 62 HB3 LEU 62 99.437 -1.082 -0.478 501 HG LEU 62 HG LEU 62 99.010 -4.067 -0.947 502 HD11 LEU 62 HD11 LEU 62 101.337 -4.021 -1.805 503 HD12 LEU 62 HD12 LEU 62 100.271 -2.988 -2.787 504 HD13 LEU 62 HD13 LEU 62 101.377 -2.253 -1.601 505 HD21 LEU 62 HD21 LEU 62 101.375 -3.200 0.565 506 HD22 LEU 62 HD22 LEU 62 99.861 -2.694 1.351 507 HD23 LEU 62 HD23 LEU 62 100.144 -4.414 0.989 508 H GLY 63 H GLY 63 96.142 -0.434 1.551 509 HA2 GLY 63 HA3 GLY 63 93.825 -0.448 -0.130 510 HA3 GLY 63 HA2 GLY 63 94.266 0.883 0.966 511 H ASN 64 H ASN 64 96.865 0.421 -1.023 512 HA ASN 64 HA ASN 64 97.633 1.514 -2.976 513 HB2 ASN 64 HB2 ASN 64 95.252 0.652 -3.781 514 HB3 ASN 64 HB3 ASN 64 94.835 2.380 -3.692 515 HD21 ASN 64 HD21 ASN 64 95.083 0.747 -6.170 516 HD22 ASN 64 HD22 ASN 64 96.361 1.490 -7.104 517 H GLU 65 H GLU 65 96.168 2.914 -0.374 518 HA GLU 65 HA GLU 65 96.638 5.704 -1.452 519 HB2 GLU 65 HB2 GLU 65 94.978 4.736 0.919 520 HB3 GLU 65 HB3 GLU 65 95.242 6.445 0.498 521 HG2 GLU 65 HG2 GLU 65 94.183 4.514 -1.578 522 HG3 GLU 65 HG3 GLU 65 93.080 5.230 -0.378 523 H CYS 66 H CYS 66 98.429 3.459 -0.158 524 HA CYS 66 HA CYS 66 99.500 5.148 2.105 525 HB2 CYS 66 HB2 CYS 66 99.026 2.866 2.778 526 HB3 CYS 66 HB3 CYS 66 99.898 2.217 1.368 527 HG CYS 66 HG CYS 66 101.402 2.057 3.936 528 H SER 67 H SER 67 101.688 5.783 2.104 529 HA SER 67 HA SER 67 102.872 6.398 -0.420 530 HB2 SER 67 HB3 SER 67 103.534 7.502 1.686 531 HB3 SER 67 HB2 SER 67 104.238 5.977 2.276 532 HG SER 67 HG SER 67 105.650 7.641 1.124 533 H GLN 68 H GLN 68 104.804 5.485 -1.446 534 HA GLN 68 HA GLN 68 104.672 2.537 -1.501 535 HB2 GLN 68 HB2 GLN 68 106.418 2.742 -3.245 536 HB3 GLN 68 HB3 GLN 68 105.077 3.869 -3.559 537 HG2 GLN 68 HG3 GLN 68 106.522 5.566 -2.165 538 HG3 GLN 68 HG2 GLN 68 107.863 4.456 -2.534 539 HE21 GLN 68 HE21 GLN 68 108.335 6.802 -3.690 540 HE22 GLN 68 HE22 GLN 68 107.882 6.829 -5.380 541 H ASP 69 H ASP 69 106.675 4.990 0.016 542 HA ASP 69 HA ASP 69 109.038 3.449 0.504 543 HB2 ASP 69 HB2 ASP 69 107.643 5.668 2.024 544 HB3 ASP 69 HB3 ASP 69 109.111 4.902 2.675 545 H GLU 70 H GLU 70 105.944 3.586 2.309 546 HA GLU 70 HA GLU 70 106.974 1.561 4.242 547 HB2 GLU 70 HB3 GLU 70 105.398 3.483 4.859 548 HB3 GLU 70 HB2 GLU 70 104.128 2.607 3.971 549 HG2 GLU 70 HG2 GLU 70 104.792 0.565 5.438 550 HG3 GLU 70 HG3 GLU 70 105.626 1.753 6.469 551 H SER 71 H SER 71 104.564 1.814 1.623 552 HA SER 71 HA SER 71 103.490 -0.833 1.843 553 HB2 SER 71 HB3 SER 71 102.835 1.194 0.299 554 HB3 SER 71 HB2 SER 71 103.996 0.469 -0.841 555 HG SER 71 HG SER 71 101.844 -0.351 -1.120 556 H GLY 72 H GLY 72 106.168 0.338 -0.270 557 HA2 GLY 72 HA3 GLY 72 106.879 -2.231 -1.310 558 HA3 GLY 72 HA2 GLY 72 108.007 -0.865 -1.141 559 H ALA 73 H ALA 73 108.298 -0.491 1.513 560 HA ALA 73 HA ALA 73 110.133 -2.432 2.367 561 HB1 ALA 73 HB1 ALA 73 109.725 -1.625 4.676 562 HB2 ALA 73 HB2 ALA 73 109.773 -0.269 3.523 563 HB3 ALA 73 HB3 ALA 73 108.210 -0.859 4.140 564 H ALA 74 H ALA 74 106.585 -2.451 2.826 565 HA ALA 74 HA ALA 74 106.577 -4.838 4.494 566 HB1 ALA 74 HB1 ALA 74 104.170 -4.965 3.910 567 HB2 ALA 74 HB2 ALA 74 104.416 -3.750 2.633 568 HB3 ALA 74 HB3 ALA 74 104.635 -3.301 4.342 569 H ALA 75 H ALA 75 106.304 -4.285 0.975 570 HA ALA 75 HA ALA 75 105.838 -7.073 0.310 571 HB1 ALA 75 HB1 ALA 75 106.540 -6.408 -1.974 572 HB2 ALA 75 HB2 ALA 75 105.419 -5.214 -1.277 573 HB3 ALA 75 HB3 ALA 75 107.165 -4.869 -1.334 574 H ILE 76 H ILE 76 108.758 -5.160 0.927 575 HA ILE 76 HA ILE 76 110.556 -7.296 -0.032 576 HB ILE 76 HB ILE 76 111.195 -4.931 1.781 577 HG12 ILE 76 HG13 ILE 76 110.778 -5.166 -1.206 578 HG13 ILE 76 HG12 ILE 76 110.242 -3.884 -0.094 579 HG21 ILE 76 HG21 ILE 76 112.827 -6.937 1.381 580 HG22 ILE 76 HG22 ILE 76 113.443 -5.282 1.158 581 HG23 ILE 76 HG23 ILE 76 112.995 -6.264 -0.258 582 HD11 ILE 76 HD11 ILE 76 112.043 -2.874 -1.236 583 HD12 ILE 76 HD12 ILE 76 112.799 -3.455 0.266 584 HD13 ILE 76 HD13 ILE 76 113.002 -4.374 -1.245 585 H PHE 77 H PHE 77 109.615 -6.000 3.197 586 HA PHE 77 HA PHE 77 111.167 -7.932 4.686 587 HB2 PHE 77 HB2 PHE 77 108.972 -6.003 5.239 588 HB3 PHE 77 HB3 PHE 77 109.034 -7.398 6.342 589 HD1 PHE 77 HD1 PHE 77 111.898 -5.780 4.571 590 HD2 PHE 77 HD2 PHE 77 109.904 -6.411 8.323 591 HE1 PHE 77 HE1 PHE 77 113.816 -4.757 5.762 592 HE2 PHE 77 HE2 PHE 77 111.823 -5.385 9.514 593 HZ PHE 77 HZ PHE 77 113.778 -4.556 8.233 594 H THR 78 H THR 78 107.786 -7.968 3.505 595 HA THR 78 HA THR 78 107.167 -10.544 4.722 596 HB THR 78 HB THR 78 105.622 -8.653 3.668 597 HG1 THR 78 HG1 THR 78 104.833 -10.510 4.704 598 HG21 THR 78 HG21 THR 78 104.831 -9.226 1.419 599 HG22 THR 78 HG22 THR 78 105.965 -10.595 1.342 600 HG23 THR 78 HG23 THR 78 106.585 -8.927 1.375 601 H VAL 79 H VAL 79 108.342 -9.546 1.497 602 HA VAL 79 HA VAL 79 108.302 -12.284 0.446 603 HB VAL 79 HB VAL 79 109.679 -9.723 -0.455 604 HG11 VAL 79 HG11 VAL 79 111.013 -11.691 -1.158 605 HG12 VAL 79 HG12 VAL 79 110.196 -10.942 -2.551 606 HG13 VAL 79 HG13 VAL 79 109.549 -12.440 -1.839 607 HG21 VAL 79 HG21 VAL 79 107.524 -11.259 -1.914 608 HG22 VAL 79 HG22 VAL 79 107.907 -9.522 -1.975 609 HG23 VAL 79 HG23 VAL 79 107.082 -10.202 -0.552 610 H GLN 80 H GLN 80 111.073 -10.109 1.251 611 HA GLN 80 HA GLN 80 113.064 -12.158 1.082 612 HB2 GLN 80 HB3 GLN 80 112.923 -9.619 2.756 613 HB3 GLN 80 HB2 GLN 80 114.375 -10.644 2.665 614 HG2 GLN 80 HG2 GLN 80 114.236 -10.416 0.126 615 HG3 GLN 80 HG3 GLN 80 112.990 -9.172 0.387 616 HE21 GLN 80 HE21 GLN 80 114.705 -8.657 3.067 617 HE22 GLN 80 HE22 GLN 80 115.939 -7.568 2.476 618 H LEU 81 H LEU 81 111.578 -10.849 4.114 619 HA LEU 81 HA LEU 81 112.719 -12.778 5.858 620 HB2 LEU 81 HB2 LEU 81 111.212 -10.727 6.399 621 HB3 LEU 81 HB3 LEU 81 109.846 -11.840 6.158 622 HG LEU 81 HG LEU 81 110.552 -11.679 8.556 623 HD11 LEU 81 HD11 LEU 81 110.261 -13.958 8.973 624 HD12 LEU 81 HD12 LEU 81 111.312 -14.445 7.622 625 HD13 LEU 81 HD13 LEU 81 109.672 -13.835 7.298 626 HD21 LEU 81 HD21 LEU 81 112.695 -12.202 9.300 627 HD22 LEU 81 HD22 LEU 81 113.040 -13.249 7.903 628 HD23 LEU 81 HD23 LEU 81 113.081 -11.479 7.720 629 H ASP 82 H ASP 82 109.620 -12.989 4.026 630 HA ASP 82 HA ASP 82 108.762 -15.519 4.914 631 HB2 ASP 82 HB2 ASP 82 107.365 -14.457 3.327 632 HB3 ASP 82 HB3 ASP 82 108.702 -14.218 2.176 633 H ASP 83 H ASP 83 111.158 -14.838 2.310 634 HA ASP 83 HA ASP 83 111.767 -17.591 1.778 635 HB2 ASP 83 HB2 ASP 83 113.343 -15.015 1.558 636 HB3 ASP 83 HB3 ASP 83 114.141 -16.576 1.254 637 H TYR 84 H TYR 84 112.730 -15.385 4.359 638 HA TYR 84 HA TYR 84 114.789 -17.146 5.457 639 HB2 TYR 84 HB2 TYR 84 114.542 -14.670 5.963 640 HB3 TYR 84 HB3 TYR 84 113.119 -15.082 6.950 641 HD1 TYR 84 HD1 TYR 84 113.379 -16.584 8.936 642 HD2 TYR 84 HD2 TYR 84 116.765 -15.097 6.752 643 HE1 TYR 84 HE1 TYR 84 114.860 -17.170 10.836 644 HE2 TYR 84 HE2 TYR 84 118.248 -15.684 8.652 645 HH TYR 84 HH TYR 84 117.909 -15.998 11.247 646 H LEU 85 H LEU 85 111.295 -17.021 5.565 647 HA LEU 85 HA LEU 85 111.092 -18.693 7.991 648 HB2 LEU 85 HB2 LEU 85 109.017 -18.092 5.837 649 HB3 LEU 85 HB3 LEU 85 108.696 -18.783 7.446 650 HG LEU 85 HG LEU 85 109.917 -16.041 6.894 651 HD11 LEU 85 HD11 LEU 85 107.779 -15.196 7.824 652 HD12 LEU 85 HD12 LEU 85 107.498 -16.177 6.365 653 HD13 LEU 85 HD13 LEU 85 107.185 -16.867 7.976 654 HD21 LEU 85 HD21 LEU 85 109.227 -15.961 9.487 655 HD22 LEU 85 HD22 LEU 85 109.505 -17.714 9.358 656 HD23 LEU 85 HD23 LEU 85 110.814 -16.574 8.966 657 H ASN 86 H ASN 86 110.261 -19.277 4.525 658 HA ASN 86 HA ASN 86 110.967 -22.178 5.052 659 HB2 ASN 86 HB3 ASN 86 108.869 -21.107 3.115 660 HB3 ASN 86 HB2 ASN 86 109.221 -22.817 3.464 661 HD21 ASN 86 HD21 ASN 86 106.643 -21.340 3.912 662 HD22 ASN 86 HD22 ASN 86 106.325 -21.479 5.627 663 H GLY 87 H GLY 87 110.818 -19.562 2.620 664 HA2 GLY 87 HA2 GLY 87 113.035 -19.335 1.332 665 HA3 GLY 87 HA3 GLY 87 112.920 -21.091 1.062 666 H ARG 88 H ARG 88 109.871 -20.710 0.873 667 HA ARG 88 HA ARG 88 109.757 -19.339 -1.806 668 HB2 ARG 88 HB3 ARG 88 108.641 -22.118 -1.218 669 HB3 ARG 88 HB2 ARG 88 108.503 -21.232 -2.755 670 HG2 ARG 88 HG2 ARG 88 110.918 -21.284 -3.065 671 HG3 ARG 88 HG3 ARG 88 111.150 -22.000 -1.452 672 HD2 ARG 88 HD2 ARG 88 111.123 -23.549 -3.603 673 HD3 ARG 88 HD3 ARG 88 110.317 -24.083 -2.108 674 HE ARG 88 HE ARG 88 108.194 -23.793 -3.175 675 HH11 ARG 88 HH11 ARG 88 106.973 -23.434 -5.042 676 HH12 ARG 88 HH12 ARG 88 107.720 -22.716 -6.452 677 HH21 ARG 88 HH21 ARG 88 110.854 -22.435 -4.962 678 HH22 ARG 88 HH22 ARG 88 109.909 -22.153 -6.407 679 H ALA 89 H ALA 89 107.323 -21.443 -0.302 680 HA ALA 89 HA ALA 89 105.206 -20.906 0.599 681 HB1 ALA 89 HB1 ALA 89 106.983 -18.741 1.465 682 HB2 ALA 89 HB2 ALA 89 105.650 -19.529 2.343 683 HB3 ALA 89 HB3 ALA 89 105.311 -18.171 1.243 684 H VAL 90 H VAL 90 103.359 -19.132 0.289 685 HA VAL 90 HA VAL 90 103.353 -18.551 -2.665 686 HB VAL 90 HB VAL 90 100.990 -18.367 -0.763 687 HG11 VAL 90 HG11 VAL 90 100.754 -17.383 -3.026 688 HG12 VAL 90 HG12 VAL 90 101.266 -18.927 -3.750 689 HG13 VAL 90 HG13 VAL 90 99.734 -18.831 -2.849 690 HG21 VAL 90 HG21 VAL 90 100.559 -20.759 -1.795 691 HG22 VAL 90 HG22 VAL 90 102.325 -20.775 -2.011 692 HG23 VAL 90 HG23 VAL 90 101.629 -20.592 -0.383 693 H GLN 91 H GLN 91 102.743 -16.459 -3.441 694 HA GLN 91 HA GLN 91 102.902 -14.295 -1.326 695 HB2 GLN 91 HB2 GLN 91 104.121 -12.910 -2.960 696 HB3 GLN 91 HB3 GLN 91 104.986 -14.442 -2.689 697 HG2 GLN 91 HG3 GLN 91 103.666 -15.339 -4.728 698 HG3 GLN 91 HG2 GLN 91 103.272 -13.636 -5.064 699 HE21 GLN 91 HE21 GLN 91 105.654 -12.319 -4.394 700 HE22 GLN 91 HE22 GLN 91 106.946 -12.891 -5.426 701 H HIS 92 H HIS 92 101.420 -12.629 -1.506 702 HA HIS 92 HA HIS 92 99.675 -12.603 -3.967 703 HB2 HIS 92 HB2 HIS 92 98.829 -12.927 -1.078 704 HB3 HIS 92 HB3 HIS 92 97.752 -12.118 -2.241 705 HD2 HIS 92 HD2 HIS 92 99.719 -15.615 -2.248 706 HE1 HIS 92 HE1 HIS 92 95.967 -16.096 -4.125 707 H ARG 93 H ARG 93 99.125 -10.533 -4.611 708 HA ARG 93 HA ARG 93 99.990 -8.307 -2.745 709 HB2 ARG 93 HB3 ARG 93 100.733 -7.042 -4.642 710 HB3 ARG 93 HB2 ARG 93 101.388 -8.680 -4.869 711 HG2 ARG 93 HG3 ARG 93 99.252 -9.161 -6.241 712 HG3 ARG 93 HG2 ARG 93 98.998 -7.399 -6.243 713 HD2 ARG 93 HD2 ARG 93 100.215 -8.053 -8.271 714 HD3 ARG 93 HD3 ARG 93 101.289 -7.107 -7.213 715 HE ARG 93 HE ARG 93 101.432 -10.094 -7.622 716 HH11 ARG 93 HH11 ARG 93 103.478 -10.914 -7.158 717 HH12 ARG 93 HH12 ARG 93 104.700 -9.878 -6.453 718 HH21 ARG 93 HH21 ARG 93 102.651 -7.068 -6.381 719 HH22 ARG 93 HH22 ARG 93 104.234 -7.716 -6.016 720 H GLU 94 H GLU 94 98.343 -6.993 -2.134 721 HA GLU 94 HA GLU 94 95.907 -6.932 -3.937 722 HB2 GLU 94 HB2 GLU 94 95.517 -6.190 -1.094 723 HB3 GLU 94 HB3 GLU 94 94.539 -7.248 -2.139 724 HG2 GLU 94 HG2 GLU 94 96.550 -8.914 -1.924 725 HG3 GLU 94 HG3 GLU 94 97.003 -7.927 -0.513 726 H VAL 95 H VAL 95 96.485 -5.051 -5.068 727 HA VAL 95 HA VAL 95 97.265 -2.632 -3.508 728 HB VAL 95 HB VAL 95 96.601 -2.681 -6.464 729 HG11 VAL 95 HG11 VAL 95 97.113 -0.519 -5.359 730 HG12 VAL 95 HG12 VAL 95 98.649 -1.189 -4.761 731 HG13 VAL 95 HG13 VAL 95 98.395 -0.969 -6.508 732 HG21 VAL 95 HG21 VAL 95 99.172 -3.187 -6.646 733 HG22 VAL 95 HG22 VAL 95 98.047 -4.541 -6.386 734 HG23 VAL 95 HG23 VAL 95 98.977 -3.882 -5.019 735 H GLN 96 H GLN 96 94.663 -3.726 -2.913 736 HA GLN 96 HA GLN 96 92.455 -2.935 -2.633 737 HB2 GLN 96 HB2 GLN 96 94.025 -0.732 -2.391 738 HB3 GLN 96 HB3 GLN 96 93.075 -0.261 -3.820 739 HG2 GLN 96 HG2 GLN 96 91.893 -1.252 -1.187 740 HG3 GLN 96 HG3 GLN 96 91.999 0.456 -1.676 741 HE21 GLN 96 HE21 GLN 96 90.052 1.191 -2.513 742 HE22 GLN 96 HE22 GLN 96 88.949 0.225 -3.467 743 H GLY 97 H GLY 97 91.193 -4.000 -4.107 744 HA2 GLY 97 HA2 GLY 97 89.644 -3.690 -5.997 745 HA3 GLY 97 HA3 GLY 97 90.847 -2.635 -6.776 746 H PHE 98 H PHE 98 93.130 -4.359 -6.266 747 HA PHE 98 HA PHE 98 92.461 -6.524 -8.267 748 HB2 PHE 98 HB2 PHE 98 94.961 -4.933 -7.647 749 HB3 PHE 98 HB3 PHE 98 95.085 -6.520 -8.444 750 HD1 PHE 98 HD1 PHE 98 93.698 -3.086 -8.729 751 HD2 PHE 98 HD2 PHE 98 94.345 -6.838 -10.716 752 HE1 PHE 98 HE1 PHE 98 93.082 -2.045 -10.894 753 HE2 PHE 98 HE2 PHE 98 93.728 -5.799 -12.880 754 HZ PHE 98 HZ PHE 98 93.097 -3.402 -12.971 755 H GLU 99 H GLU 99 91.974 -6.716 -5.355 756 HA GLU 99 HA GLU 99 94.117 -8.317 -4.174 757 HB2 GLU 99 HB2 GLU 99 91.230 -8.620 -3.351 758 HB3 GLU 99 HB3 GLU 99 92.692 -8.556 -2.338 759 HG2 GLU 99 HG2 GLU 99 91.810 -6.430 -1.955 760 HG3 GLU 99 HG3 GLU 99 92.883 -6.097 -3.336 761 H SER 100 H SER 100 93.231 -10.647 -3.287 762 HA SER 100 HA SER 100 92.480 -12.136 -5.812 763 HB2 SER 100 HB3 SER 100 93.962 -13.790 -5.223 764 HB3 SER 100 HB2 SER 100 94.731 -12.466 -4.315 765 HG SER 100 HG SER 100 94.406 -13.875 -2.722 766 H ALA 101 H ALA 101 91.272 -14.251 -5.325 767 HA ALA 101 HA ALA 101 88.883 -13.585 -3.783 768 HB1 ALA 101 HB1 ALA 101 88.184 -15.905 -4.315 769 HB2 ALA 101 HB2 ALA 101 89.829 -16.268 -4.889 770 HB3 ALA 101 HB3 ALA 101 88.825 -15.083 -5.758 771 H THR 102 H THR 102 91.828 -15.453 -3.135 772 HA THR 102 HA THR 102 90.898 -16.800 -0.761 773 HB THR 102 HB THR 102 93.701 -15.717 -1.293 774 HG1 THR 102 HG1 THR 102 93.992 -17.806 -2.258 775 HG21 THR 102 HG21 THR 102 94.381 -17.636 0.122 776 HG22 THR 102 HG22 THR 102 92.671 -18.072 0.352 777 HG23 THR 102 HG23 THR 102 93.295 -16.540 1.010 778 H PHE 103 H PHE 103 92.817 -13.769 -1.033 779 HA PHE 103 HA PHE 103 92.666 -13.036 1.715 780 HB2 PHE 103 HB2 PHE 103 94.100 -11.752 0.298 781 HB3 PHE 103 HB3 PHE 103 92.775 -11.372 -0.828 782 HD1 PHE 103 HD1 PHE 103 93.829 -10.909 2.747 783 HD2 PHE 103 HD2 PHE 103 91.545 -9.393 -0.560 784 HE1 PHE 103 HE1 PHE 103 93.311 -8.860 4.044 785 HE2 PHE 103 HE2 PHE 103 91.028 -7.344 0.737 786 HZ PHE 103 HZ PHE 103 91.911 -7.076 3.039 787 H LEU 104 H LEU 104 90.418 -12.168 -0.964 788 HA LEU 104 HA LEU 104 88.576 -10.769 0.814 789 HB2 LEU 104 HB2 LEU 104 88.128 -12.054 -1.917 790 HB3 LEU 104 HB3 LEU 104 86.983 -10.962 -1.103 791 HG LEU 104 HG LEU 104 89.857 -10.255 -1.855 792 HD11 LEU 104 HD11 LEU 104 88.375 -10.495 -3.829 793 HD12 LEU 104 HD12 LEU 104 87.190 -9.404 -3.071 794 HD13 LEU 104 HD13 LEU 104 88.791 -8.787 -3.545 795 HD21 LEU 104 HD21 LEU 104 89.010 -9.078 0.159 796 HD22 LEU 104 HD22 LEU 104 87.560 -8.577 -0.744 797 HD23 LEU 104 HD23 LEU 104 89.161 -7.960 -1.218 798 H GLY 105 H GLY 105 89.118 -14.127 -0.012 799 HA2 GLY 105 HA2 GLY 105 86.522 -15.179 0.661 800 HA3 GLY 105 HA3 GLY 105 88.053 -16.078 0.789 801 H TYR 106 H TYR 106 89.455 -14.726 2.700 802 HA TYR 106 HA TYR 106 88.080 -15.546 5.141 803 HB2 TYR 106 HB2 TYR 106 90.672 -14.149 4.477 804 HB3 TYR 106 HB3 TYR 106 90.086 -14.127 6.157 805 HD1 TYR 106 HD1 TYR 106 91.252 -16.271 3.375 806 HD2 TYR 106 HD2 TYR 106 89.943 -16.174 7.466 807 HE1 TYR 106 HE1 TYR 106 92.073 -18.589 3.692 808 HE2 TYR 106 HE2 TYR 106 90.767 -18.490 7.784 809 HH TYR 106 HH TYR 106 91.198 -20.546 6.192 810 H PHE 107 H PHE 107 88.841 -12.360 3.672 811 HA PHE 107 HA PHE 107 86.647 -11.218 5.405 812 HB2 PHE 107 HB3 PHE 107 88.962 -9.439 4.774 813 HB3 PHE 107 HB2 PHE 107 87.970 -9.538 6.248 814 HD1 PHE 107 HD1 PHE 107 90.776 -11.103 4.379 815 HD2 PHE 107 HD2 PHE 107 88.581 -10.984 8.068 816 HE1 PHE 107 HE1 PHE 107 92.534 -12.472 5.469 817 HE2 PHE 107 HE2 PHE 107 90.337 -12.356 9.157 818 HZ PHE 107 HZ PHE 107 92.314 -13.099 7.857 819 H LYS 108 H LYS 108 85.292 -11.353 3.508 820 HA LYS 108 HA LYS 108 86.193 -9.827 1.104 821 HB2 LYS 108 HB2 LYS 108 83.641 -10.477 0.510 822 HB3 LYS 108 HB3 LYS 108 84.983 -11.629 0.322 823 HG2 LYS 108 HG2 LYS 108 84.400 -12.832 2.230 824 HG3 LYS 108 HG3 LYS 108 83.604 -11.436 2.995 825 HD2 LYS 108 HD2 LYS 108 81.658 -11.666 1.671 826 HD3 LYS 108 HD3 LYS 108 82.493 -12.658 0.452 827 HE2 LYS 108 HE2 LYS 108 82.741 -14.480 2.139 828 HE3 LYS 108 HE3 LYS 108 81.842 -13.491 3.315 829 HZ1 LYS 108 HZ1 LYS 108 80.404 -15.046 2.175 830 HZ2 LYS 108 HZ2 LYS 108 80.811 -14.415 0.707 831 HZ3 LYS 108 HZ3 LYS 108 79.978 -13.498 1.796 832 H SER 109 H SER 109 83.208 -9.790 3.116 833 HA SER 109 HA SER 109 83.048 -6.831 2.540 834 HB2 SER 109 HB3 SER 109 81.126 -8.591 2.050 835 HB3 SER 109 HB2 SER 109 80.813 -8.425 3.795 836 HG SER 109 HG SER 109 79.637 -6.876 2.528 837 H GLY 110 H GLY 110 84.440 -8.671 4.775 838 HA2 GLY 110 HA3 GLY 110 83.332 -7.101 7.111 839 HA3 GLY 110 HA2 GLY 110 84.200 -8.648 7.251 840 H LEU 111 H LEU 111 84.770 -5.374 5.829 841 HA LEU 111 HA LEU 111 87.412 -5.383 7.283 842 HB2 LEU 111 HB2 LEU 111 88.389 -4.291 5.170 843 HB3 LEU 111 HB3 LEU 111 88.061 -6.037 5.069 844 HG LEU 111 HG LEU 111 85.872 -4.132 4.276 845 HD11 LEU 111 HD11 LEU 111 87.892 -3.230 3.152 846 HD12 LEU 111 HD12 LEU 111 88.263 -4.852 2.520 847 HD13 LEU 111 HD13 LEU 111 86.796 -4.000 1.980 848 HD21 LEU 111 HD21 LEU 111 86.269 -6.275 2.446 849 HD22 LEU 111 HD22 LEU 111 84.995 -6.129 3.681 850 HD23 LEU 111 HD23 LEU 111 86.523 -6.956 4.071 851 H LYS 112 H LYS 112 87.265 -2.922 5.035 852 HA LYS 112 HA LYS 112 85.624 -0.901 5.460 853 HB2 LYS 112 HB3 LYS 112 85.232 -1.321 7.816 854 HB3 LYS 112 HB2 LYS 112 86.975 -1.277 8.166 855 HG2 LYS 112 HG2 LYS 112 86.275 0.874 8.817 856 HG3 LYS 112 HG3 LYS 112 86.857 1.150 7.158 857 HD2 LYS 112 HD3 LYS 112 84.458 0.765 6.375 858 HD3 LYS 112 HD2 LYS 112 83.977 0.811 8.088 859 HE2 LYS 112 HE2 LYS 112 84.908 3.021 6.302 860 HE3 LYS 112 HE3 LYS 112 83.745 3.059 7.649 861 HZ1 LYS 112 HZ1 LYS 112 85.634 4.190 8.387 862 HZ2 LYS 112 HZ2 LYS 112 85.744 2.709 9.105 863 HZ3 LYS 112 HZ3 LYS 112 86.684 3.063 7.796 864 H TYR 113 H TYR 113 86.586 0.625 4.257 865 HA TYR 113 HA TYR 113 89.581 0.897 4.479 866 HB2 TYR 113 HB2 TYR 113 89.095 2.304 2.290 867 HB3 TYR 113 HB3 TYR 113 89.083 0.525 2.220 868 HD1 TYR 113 HD1 TYR 113 87.090 3.572 1.958 869 HD2 TYR 113 HD2 TYR 113 86.899 -0.705 2.305 870 HE1 TYR 113 HE1 TYR 113 84.728 3.617 1.207 871 HE2 TYR 113 HE2 TYR 113 84.536 -0.661 1.558 872 HH TYR 113 HH TYR 113 82.644 2.034 1.528 873 H LYS 114 H LYS 114 90.082 2.454 5.967 874 HA LYS 114 HA LYS 114 88.342 4.916 6.037 875 HB2 LYS 114 HB2 LYS 114 88.818 3.685 8.184 876 HB3 LYS 114 HB3 LYS 114 90.545 4.057 7.963 877 HG2 LYS 114 HG2 LYS 114 90.253 6.325 8.383 878 HG3 LYS 114 HG3 LYS 114 88.571 6.324 7.801 879 HD2 LYS 114 HD2 LYS 114 87.889 5.038 9.820 880 HD3 LYS 114 HD3 LYS 114 89.568 5.091 10.407 881 HE2 LYS 114 HE2 LYS 114 89.498 7.416 10.780 882 HE3 LYS 114 HE3 LYS 114 88.122 7.648 9.674 883 HZ1 LYS 114 HZ1 LYS 114 87.443 7.771 11.978 884 HZ2 LYS 114 HZ2 LYS 114 88.016 6.253 12.274 885 HZ3 LYS 114 HZ3 LYS 114 86.741 6.468 11.250 886 H LYS 115 H LYS 115 89.053 6.656 4.925 887 HA LYS 115 HA LYS 115 91.537 6.784 3.539 888 HB2 LYS 115 HB3 LYS 115 89.685 8.965 4.573 889 HB3 LYS 115 HB2 LYS 115 91.122 9.322 3.585 890 HG2 LYS 115 HG2 LYS 115 90.239 7.706 1.852 891 HG3 LYS 115 HG3 LYS 115 88.745 7.577 2.811 892 HD2 LYS 115 HD2 LYS 115 88.739 10.199 2.685 893 HD3 LYS 115 HD3 LYS 115 89.849 9.964 1.314 894 HE2 LYS 115 HE2 LYS 115 88.105 8.294 0.404 895 HE3 LYS 115 HE3 LYS 115 86.992 8.971 1.617 896 HZ1 LYS 115 HZ1 LYS 115 86.807 10.108 -0.493 897 HZ2 LYS 115 HZ2 LYS 115 87.373 11.142 0.659 898 HZ3 LYS 115 HZ3 LYS 115 88.405 10.515 -0.465 899 H GLY 116 H GLY 116 93.602 7.287 4.133 900 HA2 GLY 116 HA2 GLY 116 94.079 7.770 7.043 901 HA3 GLY 116 HA3 GLY 116 95.319 7.391 5.824 902 H GLY 117 H GLY 117 96.688 9.072 5.544 903 HA2 GLY 117 HA3 GLY 117 97.244 11.310 4.866 904 HA3 GLY 117 HA2 GLY 117 95.538 11.780 5.062 905 H VAL 118 H VAL 118 96.892 9.969 7.675 906 HA VAL 118 HA VAL 118 96.813 12.462 9.347 907 HB VAL 118 HB VAL 118 97.295 9.656 10.387 908 HG11 VAL 118 HG11 VAL 118 97.490 11.587 11.930 909 HG12 VAL 118 HG12 VAL 118 95.853 12.117 11.473 910 HG13 VAL 118 HG13 VAL 118 96.081 10.579 12.341 911 HG21 VAL 118 HG21 VAL 118 94.683 9.710 10.656 912 HG22 VAL 118 HG22 VAL 118 94.740 10.880 9.316 913 HG23 VAL 118 HG23 VAL 118 95.375 9.233 9.087 914 H ALA 119 H ALA 119 98.955 9.613 8.852 915 HA ALA 119 HA ALA 119 101.169 10.624 10.354 916 HB1 ALA 119 HB1 ALA 119 102.553 9.088 8.985 917 HB2 ALA 119 HB2 ALA 119 101.037 8.304 9.488 918 HB3 ALA 119 HB3 ALA 119 101.214 8.915 7.825 919 H SER 120 H SER 120 100.070 11.343 7.067 920 HA SER 120 HA SER 120 102.488 13.103 6.694 921 HB2 SER 120 HB3 SER 120 100.454 11.879 4.825 922 HB3 SER 120 HB2 SER 120 101.357 13.329 4.324 923 HG SER 120 HG SER 120 102.447 11.361 3.758 924 H GLY 121 H GLY 121 99.635 13.333 8.132 925 HA2 GLY 121 HA3 GLY 121 98.478 15.723 6.905 926 HA3 GLY 121 HA2 GLY 121 98.108 15.098 8.530 927 H PHE 122 H PHE 122 101.023 15.118 9.264 928 HA PHE 122 HA PHE 122 101.082 17.793 10.397 929 HB2 PHE 122 HB3 PHE 122 103.252 15.675 10.073 930 HB3 PHE 122 HB2 PHE 122 103.457 17.175 11.009 931 HD1 PHE 122 HD1 PHE 122 101.949 13.846 10.921 932 HD2 PHE 122 HD2 PHE 122 102.025 17.598 13.013 933 HE1 PHE 122 HE1 PHE 122 100.834 12.786 12.866 934 HE2 PHE 122 HE2 PHE 122 100.911 16.537 14.956 935 HZ PHE 122 HZ PHE 122 100.318 14.130 14.886 936 H LYS 123 H LYS 123 102.367 16.371 7.432 937 HA LYS 123 HA LYS 123 104.145 18.652 6.863 938 HB2 LYS 123 HB2 LYS 123 104.586 16.420 5.906 939 HB3 LYS 123 HB3 LYS 123 103.027 16.466 5.049 940 HG2 LYS 123 HG2 LYS 123 104.756 18.834 4.584 941 HG3 LYS 123 HG3 LYS 123 105.425 17.302 3.974 942 HD2 LYS 123 HD2 LYS 123 102.531 18.001 3.437 943 HD3 LYS 123 HD3 LYS 123 103.817 18.716 2.435 944 HE2 LYS 123 HE2 LYS 123 104.690 16.409 1.982 945 HE3 LYS 123 HE3 LYS 123 103.316 15.741 2.896 946 HZ1 LYS 123 HZ1 LYS 123 102.866 15.809 0.534 947 HZ2 LYS 123 HZ2 LYS 123 101.839 16.821 1.335 948 HZ3 LYS 123 HZ3 LYS 123 103.112 17.439 0.489 949 H HIS 124 H HIS 124 100.815 18.348 6.937 950 HA HIS 124 HA HIS 124 100.065 19.734 4.495 951 HB2 HIS 124 HB2 HIS 124 98.562 18.450 6.178 952 HB3 HIS 124 HB3 HIS 124 98.576 19.951 7.134 953 HD2 HIS 124 HD2 HIS 124 98.392 21.973 4.391 954 HE1 HIS 124 HE1 HIS 124 94.678 20.031 3.866 955 HE2 HIS 124 HE2 HIS 124 96.059 22.072 3.192 956 H VAL 125 H VAL 125 101.618 21.466 4.311 957 HA VAL 125 HA VAL 125 101.902 23.479 6.410 958 HB VAL 125 HB VAL 125 102.375 23.901 3.435 959 HG11 VAL 125 HG11 VAL 125 102.583 25.873 4.924 960 HG12 VAL 125 HG12 VAL 125 103.720 24.972 5.956 961 HG13 VAL 125 HG13 VAL 125 104.170 25.385 4.284 962 HG21 VAL 125 HG21 VAL 125 104.786 23.125 4.206 963 HG22 VAL 125 HG22 VAL 125 103.566 21.910 3.757 964 HG23 VAL 125 HG23 VAL 125 103.884 22.259 5.473 965 H VAL 126 H VAL 126 100.930 25.545 6.554 966 HA VAL 126 HA VAL 126 98.847 26.285 4.561 967 HB VAL 126 HB VAL 126 98.165 25.571 7.448 968 HG11 VAL 126 HG11 VAL 126 97.080 27.695 6.767 969 HG12 VAL 126 HG12 VAL 126 96.467 26.909 5.293 970 HG13 VAL 126 HG13 VAL 126 95.887 26.380 6.890 971 HG21 VAL 126 HG21 VAL 126 96.437 24.144 6.205 972 HG22 VAL 126 HG22 VAL 126 98.130 23.621 6.040 973 HG23 VAL 126 HG23 VAL 126 97.340 24.509 4.716 974 HA PRO 127 HA PRO 127 101.308 29.839 6.249 975 HB2 PRO 127 HB2 PRO 127 99.904 31.010 3.852 976 HB3 PRO 127 HB3 PRO 127 101.609 31.170 4.366 977 HG2 PRO 127 HG3 PRO 127 100.880 29.567 2.342 978 HG3 PRO 127 HG2 PRO 127 102.218 29.150 3.447 979 HD2 PRO 127 HD2 PRO 127 99.455 27.987 3.273 980 HD3 PRO 127 HD3 PRO 127 100.980 27.231 3.826 981 H ASN 128 H ASN 128 100.561 32.072 6.880 982 HA ASN 128 HA ASN 128 98.348 32.119 8.551 983 HB2 ASN 128 HB2 ASN 128 99.428 34.352 6.785 984 HB3 ASN 128 HB3 ASN 128 98.200 34.620 8.046 985 HD21 ASN 128 HD21 ASN 128 101.251 35.352 7.760 986 HD22 ASN 128 HD22 ASN 128 101.908 34.844 9.299 987 H GLU 129 H GLU 129 96.332 31.374 8.081 988 HA GLU 129 HA GLU 129 95.124 31.216 5.526 989 HB2 GLU 129 HB2 GLU 129 94.324 30.340 7.869 990 HB3 GLU 129 HB3 GLU 129 93.474 31.901 7.971 991 HG2 GLU 129 HG3 GLU 129 92.376 31.422 5.783 992 HG3 GLU 129 HG2 GLU 129 93.192 29.841 5.737 993 H VAL 130 H VAL 130 95.546 34.008 7.613 994 HA VAL 130 HA VAL 130 93.512 35.741 6.676 995 HB VAL 130 HB VAL 130 96.439 36.361 7.274 996 HG11 VAL 130 HG11 VAL 130 95.382 38.149 5.917 997 HG12 VAL 130 HG12 VAL 130 95.652 38.692 7.590 998 HG13 VAL 130 HG13 VAL 130 94.021 38.213 7.062 999 HG21 VAL 130 HG21 VAL 130 95.160 35.346 9.143 1000 HG22 VAL 130 HG22 VAL 130 93.892 36.578 8.944 1001 HG23 VAL 130 HG23 VAL 130 95.523 37.057 9.472 1002 H VAL 131 H VAL 131 96.309 34.479 4.978 1003 HA VAL 131 HA VAL 131 96.260 36.495 2.842 1004 HB VAL 131 HB VAL 131 97.382 33.656 2.847 1005 HG11 VAL 131 HG11 VAL 131 97.072 34.614 0.582 1006 HG12 VAL 131 HG12 VAL 131 98.799 34.506 1.000 1007 HG13 VAL 131 HG13 VAL 131 97.960 36.075 1.078 1008 HG21 VAL 131 HG21 VAL 131 98.326 35.081 4.646 1009 HG22 VAL 131 HG22 VAL 131 99.530 34.779 3.371 1010 HG23 VAL 131 HG23 VAL 131 98.692 36.347 3.449 1011 H VAL 132 H VAL 132 95.041 33.124 3.148 1012 HA VAL 132 HA VAL 132 93.806 33.161 0.497 1013 HB VAL 132 HB VAL 132 93.183 31.431 2.931 1014 HG11 VAL 132 HG11 VAL 132 91.395 31.420 1.211 1015 HG12 VAL 132 HG12 VAL 132 92.260 29.865 1.244 1016 HG13 VAL 132 HG13 VAL 132 92.603 31.048 -0.042 1017 HG21 VAL 132 HG21 VAL 132 95.553 31.302 2.213 1018 HG22 VAL 132 HG22 VAL 132 94.686 29.796 1.828 1019 HG23 VAL 132 HG23 VAL 132 95.029 30.979 0.543 1020 H GLN 133 H GLN 133 92.778 34.103 3.747 1021 HA GLN 133 HA GLN 133 89.986 34.557 2.733 1022 HB2 GLN 133 HB2 GLN 133 90.665 33.529 5.064 1023 HB3 GLN 133 HB3 GLN 133 90.938 35.227 5.525 1024 HG2 GLN 133 HG3 GLN 133 88.627 35.788 4.815 1025 HG3 GLN 133 HG2 GLN 133 88.355 34.088 4.362 1026 HE21 GLN 133 HE21 GLN 133 87.063 33.146 5.948 1027 HE22 GLN 133 HE22 GLN 133 87.294 33.360 7.669 Start of MODEL 12 1 H1 GLU 1 H1 GLU 1 113.832 -4.024 18.692 2 H2 GLU 1 H2 GLU 1 114.510 -3.012 19.802 3 H3 GLU 1 H3 GLU 1 113.084 -2.607 19.080 4 HA GLU 1 HA GLU 1 113.491 -4.888 20.911 5 HB2 GLU 1 HB2 GLU 1 113.480 -2.451 21.827 6 HB3 GLU 1 HB3 GLU 1 111.759 -2.439 21.375 7 HG2 GLU 1 HG2 GLU 1 111.491 -4.580 22.719 8 HG3 GLU 1 HG3 GLU 1 113.154 -4.339 23.307 9 H HIS 2 H HIS 2 112.447 -5.130 18.240 10 HA HIS 2 HA HIS 2 109.633 -5.908 18.968 11 HB2 HIS 2 HB3 HIS 2 110.490 -4.102 16.687 12 HB3 HIS 2 HB2 HIS 2 109.016 -5.092 16.564 13 HD2 HIS 2 HD2 HIS 2 108.473 -1.895 16.799 14 HE1 HIS 2 HE1 HIS 2 107.648 -2.604 20.881 15 HE2 HIS 2 HE2 HIS 2 107.358 -0.932 18.973 16 HA PRO 3 HA PRO 3 112.101 -9.050 16.509 17 HB2 PRO 3 HB2 PRO 3 112.033 -11.059 18.390 18 HB3 PRO 3 HB3 PRO 3 113.302 -9.801 18.348 19 HG2 PRO 3 HG2 PRO 3 110.896 -10.030 20.109 20 HG3 PRO 3 HG3 PRO 3 112.542 -9.451 20.487 21 HD2 PRO 3 HD2 PRO 3 110.369 -7.776 20.009 22 HD3 PRO 3 HD3 PRO 3 112.079 -7.301 19.784 23 H GLU 4 H GLU 4 109.601 -8.538 15.744 24 HA GLU 4 HA GLU 4 107.773 -10.767 16.461 25 HB2 GLU 4 HB2 GLU 4 107.108 -8.338 15.834 26 HB3 GLU 4 HB3 GLU 4 107.421 -8.828 14.152 27 HG2 GLU 4 HG3 GLU 4 105.120 -9.284 14.420 28 HG3 GLU 4 HG2 GLU 4 105.879 -10.868 14.708 29 H PHE 5 H PHE 5 110.021 -9.906 13.869 30 HA PHE 5 HA PHE 5 109.186 -11.623 11.794 31 HB2 PHE 5 HB2 PHE 5 112.102 -11.664 12.518 32 HB3 PHE 5 HB3 PHE 5 111.327 -11.386 10.940 33 HD1 PHE 5 HD1 PHE 5 112.408 -9.848 14.104 34 HD2 PHE 5 HD2 PHE 5 110.403 -9.178 10.364 35 HE1 PHE 5 HE1 PHE 5 112.592 -7.400 14.445 36 HE2 PHE 5 HE2 PHE 5 110.588 -6.728 10.705 37 HZ PHE 5 HZ PHE 5 111.687 -5.839 12.744 38 H LEU 6 H LEU 6 110.695 -12.453 14.886 39 HA LEU 6 HA LEU 6 111.081 -15.282 14.082 40 HB2 LEU 6 HB2 LEU 6 111.401 -13.730 16.673 41 HB3 LEU 6 HB3 LEU 6 111.539 -15.504 16.624 42 HG LEU 6 HG LEU 6 113.748 -14.305 16.378 43 HD11 LEU 6 HD11 LEU 6 113.410 -16.590 15.472 44 HD12 LEU 6 HD12 LEU 6 112.809 -15.895 13.947 45 HD13 LEU 6 HD13 LEU 6 114.503 -15.644 14.433 46 HD21 LEU 6 HD21 LEU 6 114.218 -12.984 14.457 47 HD22 LEU 6 HD22 LEU 6 112.754 -13.541 13.613 48 HD23 LEU 6 HD23 LEU 6 112.615 -12.427 14.994 49 H LYS 7 H LYS 7 108.664 -13.315 15.740 50 HA LYS 7 HA LYS 7 107.225 -15.504 16.980 51 HB2 LYS 7 HB2 LYS 7 106.476 -12.701 16.101 52 HB3 LYS 7 HB3 LYS 7 105.245 -13.814 16.744 53 HG2 LYS 7 HG2 LYS 7 107.854 -13.161 18.179 54 HG3 LYS 7 HG3 LYS 7 106.318 -12.318 18.490 55 HD2 LYS 7 HD3 LYS 7 105.462 -14.885 18.702 56 HD3 LYS 7 HD2 LYS 7 107.155 -15.102 19.207 57 HE2 LYS 7 HE2 LYS 7 105.208 -13.067 20.382 58 HE3 LYS 7 HE3 LYS 7 105.679 -14.604 21.146 59 HZ1 LYS 7 HZ1 LYS 7 106.996 -12.764 21.961 60 HZ2 LYS 7 HZ2 LYS 7 107.955 -13.830 21.147 61 HZ3 LYS 7 HZ3 LYS 7 107.519 -12.406 20.439 62 H ALA 8 H ALA 8 107.252 -14.158 13.708 63 HA ALA 8 HA ALA 8 104.823 -15.577 12.859 64 HB1 ALA 8 HB1 ALA 8 107.147 -14.443 11.235 65 HB2 ALA 8 HB2 ALA 8 105.648 -13.580 11.658 66 HB3 ALA 8 HB3 ALA 8 105.589 -14.986 10.567 67 H GLY 9 H GLY 9 104.855 -17.360 11.234 68 HA2 GLY 9 HA2 GLY 9 105.556 -19.524 10.593 69 HA3 GLY 9 HA3 GLY 9 107.226 -18.919 10.718 70 H LYS 10 H LYS 10 104.580 -19.464 13.107 71 HA LYS 10 HA LYS 10 106.398 -21.405 14.506 72 HB2 LYS 10 HB2 LYS 10 105.230 -18.856 15.675 73 HB3 LYS 10 HB3 LYS 10 105.680 -20.237 16.703 74 HG2 LYS 10 HG3 LYS 10 107.975 -20.165 15.550 75 HG3 LYS 10 HG2 LYS 10 107.479 -18.592 14.881 76 HD2 LYS 10 HD2 LYS 10 108.520 -17.899 16.847 77 HD3 LYS 10 HD3 LYS 10 106.847 -18.090 17.424 78 HE2 LYS 10 HE3 LYS 10 108.489 -19.180 18.952 79 HE3 LYS 10 HE2 LYS 10 107.365 -20.359 18.234 80 HZ1 LYS 10 HZ1 LYS 10 109.932 -20.743 18.206 81 HZ2 LYS 10 HZ2 LYS 10 108.994 -21.214 16.934 82 HZ3 LYS 10 HZ3 LYS 10 109.863 -19.815 16.844 83 H GLU 11 H GLU 11 103.338 -20.481 13.377 84 HA GLU 11 HA GLU 11 102.139 -22.904 14.599 85 HB2 GLU 11 HB2 GLU 11 101.158 -20.102 15.293 86 HB3 GLU 11 HB3 GLU 11 100.181 -21.571 15.528 87 HG2 GLU 11 HG3 GLU 11 102.191 -22.491 16.863 88 HG3 GLU 11 HG2 GLU 11 102.808 -20.821 16.862 89 HA PRO 12 HA PRO 12 99.993 -22.624 10.728 90 HB2 PRO 12 HB2 PRO 12 97.906 -24.341 11.212 91 HB3 PRO 12 HB3 PRO 12 99.590 -24.900 10.996 92 HG2 PRO 12 HG2 PRO 12 98.016 -24.509 13.516 93 HG3 PRO 12 HG3 PRO 12 99.158 -25.807 13.072 94 HD2 PRO 12 HD3 PRO 12 99.815 -23.658 14.698 95 HD3 PRO 12 HD2 PRO 12 101.010 -24.569 13.727 96 H GLY 13 H GLY 13 97.733 -22.176 9.806 97 HA2 GLY 13 HA3 GLY 13 95.467 -21.261 10.255 98 HA3 GLY 13 HA2 GLY 13 96.106 -20.518 11.741 99 H LEU 14 H LEU 14 95.817 -18.345 11.350 100 HA LEU 14 HA LEU 14 97.381 -17.239 9.027 101 HB2 LEU 14 HB2 LEU 14 95.156 -17.235 8.139 102 HB3 LEU 14 HB3 LEU 14 94.461 -16.691 9.685 103 HG LEU 14 HG LEU 14 96.550 -14.908 8.525 104 HD11 LEU 14 HD11 LEU 14 95.333 -15.606 6.477 105 HD12 LEU 14 HD12 LEU 14 93.787 -15.189 7.255 106 HD13 LEU 14 HD13 LEU 14 94.973 -13.912 6.890 107 HD21 LEU 14 HD21 LEU 14 95.257 -14.364 10.573 108 HD22 LEU 14 HD22 LEU 14 94.930 -13.189 9.278 109 HD23 LEU 14 HD23 LEU 14 93.743 -14.464 9.643 110 H GLN 15 H GLN 15 98.371 -15.267 9.486 111 HA GLN 15 HA GLN 15 97.780 -14.117 12.226 112 HB2 GLN 15 HB2 GLN 15 100.519 -14.370 10.907 113 HB3 GLN 15 HB3 GLN 15 100.179 -13.698 12.519 114 HG2 GLN 15 HG2 GLN 15 100.741 -15.868 13.117 115 HG3 GLN 15 HG3 GLN 15 98.993 -16.078 12.855 116 HE21 GLN 15 HE21 GLN 15 102.133 -17.135 11.856 117 HE22 GLN 15 HE22 GLN 15 101.619 -18.062 10.464 118 H ILE 16 H ILE 16 97.924 -11.840 12.376 119 HA ILE 16 HA ILE 16 98.184 -10.455 9.692 120 HB ILE 16 HB ILE 16 96.558 -9.479 12.075 121 HG12 ILE 16 HG12 ILE 16 95.541 -10.980 9.623 122 HG13 ILE 16 HG13 ILE 16 95.774 -11.732 11.219 123 HG21 ILE 16 HG21 ILE 16 96.528 -8.821 9.094 124 HG22 ILE 16 HG22 ILE 16 97.216 -7.797 10.377 125 HG23 ILE 16 HG23 ILE 16 95.463 -8.103 10.327 126 HD11 ILE 16 HD11 ILE 16 93.962 -9.354 10.602 127 HD12 ILE 16 HD12 ILE 16 93.427 -11.018 10.938 128 HD13 ILE 16 HD13 ILE 16 94.217 -10.063 12.215 129 H TRP 17 H TRP 17 99.614 -8.766 9.568 130 HA TRP 17 HA TRP 17 100.643 -7.607 12.147 131 HB2 TRP 17 HB3 TRP 17 102.444 -8.639 9.910 132 HB3 TRP 17 HB2 TRP 17 102.973 -7.859 11.420 133 HD1 TRP 17 HD1 TRP 17 101.448 -9.247 13.618 134 HE1 TRP 17 HE1 TRP 17 101.663 -11.765 14.130 135 HE3 TRP 17 HE3 TRP 17 103.190 -10.852 9.093 136 HZ2 TRP 17 HZ2 TRP 17 102.484 -14.153 12.740 137 HZ3 TRP 17 HZ3 TRP 17 103.677 -13.251 8.713 138 HH2 TRP 17 HH2 TRP 17 103.329 -14.902 10.529 139 H ARG 18 H ARG 18 100.138 -5.491 11.887 140 HA ARG 18 HA ARG 18 100.099 -4.283 9.175 141 HB2 ARG 18 HB2 ARG 18 98.385 -3.531 10.678 142 HB3 ARG 18 HB3 ARG 18 99.561 -3.229 11.979 143 HG2 ARG 18 HG3 ARG 18 100.522 -1.365 10.788 144 HG3 ARG 18 HG2 ARG 18 99.621 -1.769 9.307 145 HD2 ARG 18 HD2 ARG 18 98.792 0.082 11.159 146 HD3 ARG 18 HD3 ARG 18 97.697 -0.792 10.061 147 HE ARG 18 HE ARG 18 98.061 -2.463 12.344 148 HH11 ARG 18 HH11 ARG 18 96.525 -2.416 14.001 149 HH12 ARG 18 HH12 ARG 18 95.485 -1.023 14.189 150 HH21 ARG 18 HH21 ARG 18 96.864 0.692 11.492 151 HH22 ARG 18 HH22 ARG 18 95.675 0.729 12.775 152 H VAL 19 H VAL 19 101.747 -3.122 8.272 153 HA VAL 19 HA VAL 19 104.240 -2.827 9.902 154 HB VAL 19 HB VAL 19 104.135 -1.843 7.087 155 HG11 VAL 19 HG11 VAL 19 106.233 -1.976 8.405 156 HG12 VAL 19 HG12 VAL 19 105.980 -3.723 8.631 157 HG13 VAL 19 HG13 VAL 19 106.287 -3.071 7.003 158 HG21 VAL 19 HG21 VAL 19 104.346 -4.289 6.317 159 HG22 VAL 19 HG22 VAL 19 102.712 -3.741 6.759 160 HG23 VAL 19 HG23 VAL 19 103.654 -4.736 7.895 161 H GLU 20 H GLU 20 105.166 -0.840 10.398 162 HA GLU 20 HA GLU 20 103.885 1.649 9.371 163 HB2 GLU 20 HB3 GLU 20 103.545 0.603 12.167 164 HB3 GLU 20 HB2 GLU 20 103.827 2.349 11.969 165 HG2 GLU 20 HG3 GLU 20 101.948 2.411 10.298 166 HG3 GLU 20 HG2 GLU 20 101.625 0.697 10.653 167 H LYS 21 H LYS 21 105.690 2.725 8.727 168 HA LYS 21 HA LYS 21 107.936 3.494 8.766 169 HB2 LYS 21 HB2 LYS 21 106.793 4.878 10.548 170 HB3 LYS 21 HB3 LYS 21 107.374 3.707 11.756 171 HG2 LYS 21 HG3 LYS 21 109.588 4.363 11.529 172 HG3 LYS 21 HG2 LYS 21 109.377 4.863 9.834 173 HD2 LYS 21 HD2 LYS 21 108.153 6.337 12.205 174 HD3 LYS 21 HD3 LYS 21 109.699 6.788 11.450 175 HE2 LYS 21 HE2 LYS 21 108.106 6.614 9.237 176 HE3 LYS 21 HE3 LYS 21 106.911 7.134 10.450 177 HZ1 LYS 21 HZ1 LYS 21 108.007 9.010 9.418 178 HZ2 LYS 21 HZ2 LYS 21 108.381 8.948 11.023 179 HZ3 LYS 21 HZ3 LYS 21 109.488 8.466 9.899 180 H PHE 22 H PHE 22 107.521 0.580 9.106 181 HA PHE 22 HA PHE 22 108.948 -1.265 9.502 182 HB2 PHE 22 HB2 PHE 22 111.091 0.540 10.621 183 HB3 PHE 22 HB3 PHE 22 111.253 -0.904 9.593 184 HD1 PHE 22 HD1 PHE 22 109.422 -0.394 7.388 185 HD2 PHE 22 HD2 PHE 22 112.020 2.340 9.441 186 HE1 PHE 22 HE1 PHE 22 109.499 1.048 5.371 187 HE2 PHE 22 HE2 PHE 22 112.095 3.783 7.426 188 HZ PHE 22 HZ PHE 22 110.834 3.138 5.392 189 H ASP 23 H ASP 23 107.071 -0.786 11.413 190 HA ASP 23 HA ASP 23 108.617 -1.299 13.966 191 HB2 ASP 23 HB2 ASP 23 106.059 0.303 13.550 192 HB3 ASP 23 HB3 ASP 23 106.618 -0.250 15.147 193 H LEU 24 H LEU 24 105.991 -2.138 11.808 194 HA LEU 24 HA LEU 24 104.551 -4.007 11.806 195 HB2 LEU 24 HB2 LEU 24 106.950 -4.936 13.369 196 HB3 LEU 24 HB3 LEU 24 105.499 -5.966 13.357 197 HG LEU 24 HG LEU 24 106.519 -4.832 10.752 198 HD11 LEU 24 HD11 LEU 24 108.512 -5.810 11.856 199 HD12 LEU 24 HD12 LEU 24 107.607 -7.313 12.157 200 HD13 LEU 24 HD13 LEU 24 107.980 -6.818 10.489 201 HD21 LEU 24 HD21 LEU 24 104.358 -6.048 10.858 202 HD22 LEU 24 HD22 LEU 24 105.184 -7.452 11.575 203 HD23 LEU 24 HD23 LEU 24 105.556 -6.957 9.906 204 H VAL 25 H VAL 25 102.627 -4.322 12.825 205 HA VAL 25 HA VAL 25 102.539 -4.266 15.817 206 HB VAL 25 HB VAL 25 100.888 -2.359 14.095 207 HG11 VAL 25 HG11 VAL 25 100.147 -1.466 16.286 208 HG12 VAL 25 HG12 VAL 25 101.111 -2.709 17.119 209 HG13 VAL 25 HG13 VAL 25 99.717 -3.186 16.120 210 HG21 VAL 25 HG21 VAL 25 102.216 -0.586 15.219 211 HG22 VAL 25 HG22 VAL 25 103.189 -1.836 16.032 212 HG23 VAL 25 HG23 VAL 25 103.259 -1.665 14.261 213 HA PRO 26 HA PRO 26 99.570 -7.407 14.695 214 HB2 PRO 26 HB2 PRO 26 98.485 -7.813 17.208 215 HB3 PRO 26 HB3 PRO 26 100.067 -8.463 16.692 216 HG2 PRO 26 HG2 PRO 26 99.441 -6.070 18.374 217 HG3 PRO 26 HG3 PRO 26 100.765 -7.259 18.521 218 HD2 PRO 26 HD3 PRO 26 101.078 -4.740 17.426 219 HD3 PRO 26 HD2 PRO 26 102.106 -6.140 16.994 220 H VAL 27 H VAL 27 97.633 -7.075 13.716 221 HA VAL 27 HA VAL 27 96.042 -4.712 14.126 222 HB VAL 27 HB VAL 27 95.503 -7.418 12.860 223 HG11 VAL 27 HG11 VAL 27 93.394 -6.125 11.954 224 HG12 VAL 27 HG12 VAL 27 93.583 -5.149 13.431 225 HG13 VAL 27 HG13 VAL 27 93.315 -6.904 13.552 226 HG21 VAL 27 HG21 VAL 27 95.881 -4.559 11.880 227 HG22 VAL 27 HG22 VAL 27 96.924 -5.966 11.566 228 HG23 VAL 27 HG23 VAL 27 95.306 -5.876 10.830 229 HA PRO 28 HA PRO 28 94.397 -5.789 18.202 230 HB2 PRO 28 HB2 PRO 28 92.355 -3.774 17.269 231 HB3 PRO 28 HB3 PRO 28 93.229 -3.873 18.824 232 HG2 PRO 28 HG2 PRO 28 93.904 -2.104 16.915 233 HG3 PRO 28 HG3 PRO 28 95.111 -2.862 17.989 234 HD2 PRO 28 HD3 PRO 28 94.576 -3.352 15.088 235 HD3 PRO 28 HD2 PRO 28 96.085 -3.588 16.020 236 H THR 29 H THR 29 93.147 -7.566 18.546 237 HA THR 29 HA THR 29 91.416 -8.692 16.544 238 HB THR 29 HB THR 29 90.959 -9.152 19.499 239 HG1 THR 29 HG1 THR 29 93.159 -9.214 19.409 240 HG21 THR 29 HG21 THR 29 90.688 -11.486 18.707 241 HG22 THR 29 HG22 THR 29 91.093 -10.970 17.052 242 HG23 THR 29 HG23 THR 29 89.604 -10.381 17.828 243 H ASN 30 H ASN 30 90.891 -6.182 18.923 244 HA ASN 30 HA ASN 30 88.094 -6.278 19.306 245 HB2 ASN 30 HB3 ASN 30 89.988 -3.936 18.896 246 HB3 ASN 30 HB2 ASN 30 88.260 -3.695 19.249 247 HD21 ASN 30 HD21 ASN 30 90.448 -2.927 21.052 248 HD22 ASN 30 HD22 ASN 30 90.267 -3.894 22.498 249 H LEU 31 H LEU 31 89.881 -4.834 16.542 250 HA LEU 31 HA LEU 31 87.278 -4.469 15.111 251 HB2 LEU 31 HB3 LEU 31 90.146 -3.631 14.612 252 HB3 LEU 31 HB2 LEU 31 88.953 -3.592 13.291 253 HG LEU 31 HG LEU 31 87.535 -2.066 14.507 254 HD11 LEU 31 HD11 LEU 31 88.285 -1.290 16.830 255 HD12 LEU 31 HD12 LEU 31 87.652 -2.951 16.739 256 HD13 LEU 31 HD13 LEU 31 89.407 -2.671 16.829 257 HD21 LEU 31 HD21 LEU 31 89.506 -1.047 13.397 258 HD22 LEU 31 HD22 LEU 31 89.063 -0.146 14.866 259 HD23 LEU 31 HD23 LEU 31 90.454 -1.256 14.889 260 H TYR 32 H TYR 32 90.458 -6.030 14.481 261 HA TYR 32 HA TYR 32 90.957 -7.796 12.977 262 HB2 TYR 32 HB3 TYR 32 89.584 -8.791 15.010 263 HB3 TYR 32 HB2 TYR 32 88.322 -9.036 13.779 264 HD1 TYR 32 HD1 TYR 32 88.436 -10.873 12.316 265 HD2 TYR 32 HD2 TYR 32 91.954 -9.673 14.467 266 HE1 TYR 32 HE1 TYR 32 89.625 -12.889 11.494 267 HE2 TYR 32 HE2 TYR 32 93.143 -11.689 13.648 268 HH TYR 32 HH TYR 32 92.151 -13.525 11.100 269 H GLY 33 H GLY 33 90.701 -6.671 10.986 270 HA2 GLY 33 HA2 GLY 33 89.586 -7.419 8.800 271 HA3 GLY 33 HA3 GLY 33 88.035 -7.174 9.638 272 H ASP 34 H ASP 34 90.162 -4.849 10.762 273 HA ASP 34 HA ASP 34 88.913 -2.824 8.924 274 HB2 ASP 34 HB3 ASP 34 90.254 -2.720 11.637 275 HB3 ASP 34 HB2 ASP 34 90.108 -1.243 10.656 276 H PHE 35 H PHE 35 90.167 -1.450 7.618 277 HA PHE 35 HA PHE 35 93.148 -1.871 7.716 278 HB2 PHE 35 HB2 PHE 35 91.466 -2.050 5.178 279 HB3 PHE 35 HB3 PHE 35 93.238 -2.180 5.277 280 HD1 PHE 35 HD1 PHE 35 94.301 -4.199 6.025 281 HD2 PHE 35 HD2 PHE 35 90.026 -3.806 6.214 282 HE1 PHE 35 HE1 PHE 35 94.098 -6.626 6.499 283 HE2 PHE 35 HE2 PHE 35 89.825 -6.231 6.691 284 HZ PHE 35 HZ PHE 35 91.860 -7.641 6.834 285 H PHE 36 H PHE 36 94.110 0.086 7.761 286 HA PHE 36 HA PHE 36 92.529 2.495 7.028 287 HB2 PHE 36 HB2 PHE 36 95.210 1.948 8.303 288 HB3 PHE 36 HB3 PHE 36 94.907 3.552 7.593 289 HD1 PHE 36 HD1 PHE 36 94.819 4.810 9.647 290 HD2 PHE 36 HD2 PHE 36 92.289 1.382 9.096 291 HE1 PHE 36 HE1 PHE 36 93.513 5.451 11.655 292 HE2 PHE 36 HE2 PHE 36 90.984 2.023 11.105 293 HZ PHE 36 HZ PHE 36 91.593 4.060 12.382 294 H THR 37 H THR 37 92.301 2.704 4.820 295 HA THR 37 HA THR 37 94.204 1.807 2.878 296 HB THR 37 HB THR 37 93.012 3.172 1.278 297 HG1 THR 37 HG1 THR 37 91.723 4.888 1.953 298 HG21 THR 37 HG21 THR 37 90.657 2.605 1.813 299 HG22 THR 37 HG22 THR 37 91.113 2.310 3.508 300 HG23 THR 37 HG23 THR 37 91.747 1.258 2.220 301 H GLY 38 H GLY 38 96.283 2.401 3.656 302 HA2 GLY 38 HA2 GLY 38 97.362 4.796 2.510 303 HA3 GLY 38 HA3 GLY 38 97.072 5.115 4.238 304 H ASP 39 H ASP 39 97.502 2.248 4.934 305 HA ASP 39 HA ASP 39 100.516 2.251 4.661 306 HB2 ASP 39 HB3 ASP 39 98.946 0.756 6.786 307 HB3 ASP 39 HB2 ASP 39 100.653 1.261 6.812 308 H ALA 40 H ALA 40 100.699 -0.473 5.713 309 HA ALA 40 HA ALA 40 99.249 -2.056 3.606 310 HB1 ALA 40 HB1 ALA 40 102.270 -2.050 4.025 311 HB2 ALA 40 HB2 ALA 40 101.400 -1.494 2.576 312 HB3 ALA 40 HB3 ALA 40 101.387 -3.219 3.014 313 H TYR 41 H TYR 41 98.792 -4.164 4.256 314 HA TYR 41 HA TYR 41 99.720 -4.842 7.059 315 HB2 TYR 41 HB2 TYR 41 97.135 -5.573 5.614 316 HB3 TYR 41 HB3 TYR 41 97.601 -6.168 7.225 317 HD1 TYR 41 HD1 TYR 41 97.208 -2.957 5.306 318 HD2 TYR 41 HD2 TYR 41 96.980 -4.936 9.113 319 HE1 TYR 41 HE1 TYR 41 96.308 -0.885 6.330 320 HE2 TYR 41 HE2 TYR 41 96.081 -2.863 10.135 321 HH TYR 41 HH TYR 41 94.717 -0.719 9.099 322 H VAL 42 H VAL 42 101.011 -6.592 7.192 323 HA VAL 42 HA VAL 42 101.201 -8.394 4.801 324 HB VAL 42 HB VAL 42 102.856 -8.230 7.363 325 HG11 VAL 42 HG11 VAL 42 102.850 -10.498 6.364 326 HG12 VAL 42 HG12 VAL 42 103.290 -9.804 4.786 327 HG13 VAL 42 HG13 VAL 42 104.431 -9.709 6.148 328 HG21 VAL 42 HG21 VAL 42 103.080 -6.254 5.879 329 HG22 VAL 42 HG22 VAL 42 104.566 -7.234 5.869 330 HG23 VAL 42 HG23 VAL 42 103.428 -7.328 4.503 331 H ILE 43 H ILE 43 99.953 -10.208 4.782 332 HA ILE 43 HA ILE 43 99.255 -11.405 7.476 333 HB ILE 43 HB ILE 43 97.482 -12.196 5.279 334 HG12 ILE 43 HG12 ILE 43 97.628 -9.240 6.012 335 HG13 ILE 43 HG13 ILE 43 98.082 -9.936 4.438 336 HG21 ILE 43 HG21 ILE 43 97.314 -12.136 7.961 337 HG22 ILE 43 HG22 ILE 43 96.607 -10.538 7.624 338 HG23 ILE 43 HG23 ILE 43 95.870 -12.001 6.929 339 HD11 ILE 43 HD11 ILE 43 95.888 -9.361 3.968 340 HD12 ILE 43 HD12 ILE 43 95.618 -10.991 4.629 341 HD13 ILE 43 HD13 ILE 43 95.362 -9.560 5.657 342 H LEU 44 H LEU 44 99.407 -13.620 7.700 343 HA LEU 44 HA LEU 44 100.653 -15.098 5.367 344 HB2 LEU 44 HB2 LEU 44 101.668 -14.615 8.021 345 HB3 LEU 44 HB3 LEU 44 101.302 -16.351 7.872 346 HG LEU 44 HG LEU 44 102.584 -16.378 5.708 347 HD11 LEU 44 HD11 LEU 44 102.625 -13.485 6.307 348 HD12 LEU 44 HD12 LEU 44 102.874 -14.330 4.761 349 HD13 LEU 44 HD13 LEU 44 104.227 -14.147 5.903 350 HD21 LEU 44 HD21 LEU 44 104.816 -16.236 6.779 351 HD22 LEU 44 HD22 LEU 44 104.103 -15.348 8.147 352 HD23 LEU 44 HD23 LEU 44 103.643 -17.042 7.848 353 H LYS 45 H LYS 45 100.001 -17.348 5.161 354 HA LYS 45 HA LYS 45 97.792 -18.207 7.010 355 HB2 LYS 45 HB2 LYS 45 96.914 -16.980 4.883 356 HB3 LYS 45 HB3 LYS 45 97.423 -18.444 4.011 357 HG2 LYS 45 HG2 LYS 45 95.837 -18.906 6.497 358 HG3 LYS 45 HG3 LYS 45 94.956 -18.147 5.150 359 HD2 LYS 45 HD2 LYS 45 96.699 -20.580 4.673 360 HD3 LYS 45 HD3 LYS 45 95.037 -20.764 5.284 361 HE2 LYS 45 HE3 LYS 45 95.512 -18.968 2.911 362 HE3 LYS 45 HE2 LYS 45 95.531 -20.731 2.664 363 HZ1 LYS 45 HZ1 LYS 45 93.322 -19.819 2.399 364 HZ2 LYS 45 HZ2 LYS 45 93.363 -20.833 3.698 365 HZ3 LYS 45 HZ3 LYS 45 93.346 -19.200 3.928 366 H THR 46 H THR 46 99.102 -19.879 7.786 367 HA THR 46 HA THR 46 100.336 -21.778 5.844 368 HB THR 46 HB THR 46 100.351 -21.399 8.840 369 HG1 THR 46 HG1 THR 46 102.538 -22.116 7.226 370 HG21 THR 46 HG21 THR 46 101.729 -23.612 8.848 371 HG22 THR 46 HG22 THR 46 100.878 -23.974 7.327 372 HG23 THR 46 HG23 THR 46 99.954 -23.733 8.829 373 H VAL 47 H VAL 47 99.036 -23.296 4.925 374 HA VAL 47 HA VAL 47 96.600 -24.166 6.429 375 HB VAL 47 HB VAL 47 97.302 -25.395 3.794 376 HG11 VAL 47 HG11 VAL 47 95.200 -25.910 5.010 377 HG12 VAL 47 HG12 VAL 47 94.768 -24.183 4.988 378 HG13 VAL 47 HG13 VAL 47 94.867 -25.095 3.463 379 HG21 VAL 47 HG21 VAL 47 96.244 -23.315 2.687 380 HG22 VAL 47 HG22 VAL 47 97.934 -23.162 3.222 381 HG23 VAL 47 HG23 VAL 47 96.625 -22.457 4.200 382 H GLN 48 H GLN 48 96.123 -26.520 6.467 383 HA GLN 48 HA GLN 48 98.168 -27.949 7.872 384 HB2 GLN 48 HB2 GLN 48 96.688 -29.885 7.699 385 HB3 GLN 48 HB3 GLN 48 95.705 -28.427 7.974 386 HG2 GLN 48 HG2 GLN 48 95.572 -28.310 5.365 387 HG3 GLN 48 HG3 GLN 48 96.083 -30.014 5.422 388 HE21 GLN 48 HE21 GLN 48 94.171 -31.173 5.017 389 HE22 GLN 48 HE22 GLN 48 92.686 -30.945 5.914 390 H LEU 49 H LEU 49 99.301 -29.914 7.257 391 HA LEU 49 HA LEU 49 100.601 -29.645 4.649 392 HB2 LEU 49 HB2 LEU 49 100.673 -31.942 6.659 393 HB3 LEU 49 HB3 LEU 49 101.803 -31.708 5.305 394 HG LEU 49 HG LEU 49 102.030 -29.276 6.482 395 HD11 LEU 49 HD11 LEU 49 102.262 -30.353 9.048 396 HD12 LEU 49 HD12 LEU 49 100.727 -31.030 8.454 397 HD13 LEU 49 HD13 LEU 49 100.968 -29.267 8.488 398 HD21 LEU 49 HD21 LEU 49 103.440 -31.906 6.996 399 HD22 LEU 49 HD22 LEU 49 104.001 -30.492 6.071 400 HD23 LEU 49 HD23 LEU 49 103.958 -30.433 7.850 401 H ARG 50 H ARG 50 98.119 -31.801 6.028 402 HA ARG 50 HA ARG 50 97.921 -33.791 4.078 403 HB2 ARG 50 HB2 ARG 50 95.551 -32.224 5.188 404 HB3 ARG 50 HB3 ARG 50 95.521 -33.885 4.549 405 HG2 ARG 50 HG2 ARG 50 97.082 -34.600 6.339 406 HG3 ARG 50 HG3 ARG 50 97.109 -32.939 6.978 407 HD2 ARG 50 HD2 ARG 50 94.839 -33.038 7.656 408 HD3 ARG 50 HD3 ARG 50 94.496 -34.439 6.612 409 HE ARG 50 HE ARG 50 95.317 -35.868 8.329 410 HH11 ARG 50 HH11 ARG 50 96.212 -36.217 10.374 411 HH12 ARG 50 HH12 ARG 50 96.936 -34.888 11.251 412 HH21 ARG 50 HH21 ARG 50 96.281 -32.548 8.756 413 HH22 ARG 50 HH22 ARG 50 96.975 -32.820 10.339 414 H ASN 51 H ASN 51 97.018 -30.377 3.772 415 HA ASN 51 HA ASN 51 95.740 -30.764 1.144 416 HB2 ASN 51 HB3 ASN 51 96.730 -28.306 2.648 417 HB3 ASN 51 HB2 ASN 51 95.939 -28.225 1.056 418 HD21 ASN 51 HD21 ASN 51 94.894 -30.800 3.195 419 HD22 ASN 51 HD22 ASN 51 93.378 -30.062 3.662 420 H GLY 52 H GLY 52 98.984 -30.163 2.360 421 HA2 GLY 52 HA3 GLY 52 100.473 -31.035 0.234 422 HA3 GLY 52 HA2 GLY 52 99.988 -29.424 -0.347 423 H ASN 53 H ASN 53 101.219 -30.888 2.717 424 HA ASN 53 HA ASN 53 102.921 -30.103 4.158 425 HB2 ASN 53 HB2 ASN 53 104.153 -30.215 1.867 426 HB3 ASN 53 HB3 ASN 53 103.966 -28.446 1.840 427 HD21 ASN 53 HD21 ASN 53 105.311 -31.153 3.816 428 HD22 ASN 53 HD22 ASN 53 106.512 -30.164 4.616 429 H LEU 54 H LEU 54 103.384 -28.278 5.501 430 HA LEU 54 HA LEU 54 101.407 -26.383 5.942 431 HB2 LEU 54 HB2 LEU 54 103.444 -24.805 6.603 432 HB3 LEU 54 HB3 LEU 54 103.117 -26.289 7.530 433 HG LEU 54 HG LEU 54 104.867 -26.565 5.115 434 HD11 LEU 54 HD11 LEU 54 105.702 -24.467 6.144 435 HD12 LEU 54 HD12 LEU 54 106.857 -25.800 6.381 436 HD13 LEU 54 HD13 LEU 54 105.807 -25.284 7.722 437 HD21 LEU 54 HD21 LEU 54 105.846 -27.659 7.624 438 HD22 LEU 54 HD22 LEU 54 104.129 -28.076 7.407 439 HD23 LEU 54 HD23 LEU 54 105.317 -28.520 6.158 440 H GLN 55 H GLN 55 100.414 -25.042 4.522 441 HA GLN 55 HA GLN 55 102.107 -23.883 2.305 442 HB2 GLN 55 HB2 GLN 55 100.135 -25.145 1.563 443 HB3 GLN 55 HB3 GLN 55 99.082 -24.143 2.591 444 HG2 GLN 55 HG2 GLN 55 99.701 -22.135 1.303 445 HG3 GLN 55 HG3 GLN 55 100.812 -23.101 0.303 446 HE21 GLN 55 HE21 GLN 55 98.116 -21.591 -0.269 447 HE22 GLN 55 HE22 GLN 55 97.180 -22.792 -1.130 448 H TYR 56 H TYR 56 103.035 -22.122 3.414 449 HA TYR 56 HA TYR 56 101.322 -20.241 4.927 450 HB2 TYR 56 HB2 TYR 56 104.188 -20.637 4.384 451 HB3 TYR 56 HB3 TYR 56 103.720 -18.923 4.301 452 HD1 TYR 56 HD1 TYR 56 101.733 -18.479 6.268 453 HD2 TYR 56 HD2 TYR 56 105.061 -21.192 6.463 454 HE1 TYR 56 HE1 TYR 56 101.669 -18.383 8.746 455 HE2 TYR 56 HE2 TYR 56 104.993 -21.095 8.939 456 HH TYR 56 HH TYR 56 103.564 -18.807 10.674 457 H ASP 57 H ASP 57 99.971 -18.857 3.886 458 HA ASP 57 HA ASP 57 100.715 -18.004 1.091 459 HB2 ASP 57 HB2 ASP 57 98.327 -18.913 2.017 460 HB3 ASP 57 HB3 ASP 57 98.117 -17.173 2.329 461 H LEU 58 H LEU 58 101.716 -16.062 0.902 462 HA LEU 58 HA LEU 58 101.295 -14.095 3.160 463 HB2 LEU 58 HB2 LEU 58 103.628 -14.901 2.856 464 HB3 LEU 58 HB3 LEU 58 103.602 -14.319 1.175 465 HG LEU 58 HG LEU 58 102.793 -12.316 3.231 466 HD11 LEU 58 HD11 LEU 58 105.159 -13.873 3.671 467 HD12 LEU 58 HD12 LEU 58 104.642 -12.401 4.528 468 HD13 LEU 58 HD13 LEU 58 105.678 -12.274 3.086 469 HD21 LEU 58 HD21 LEU 58 103.336 -12.206 0.590 470 HD22 LEU 58 HD22 LEU 58 104.978 -11.914 1.213 471 HD23 LEU 58 HD23 LEU 58 103.645 -10.830 1.676 472 H HIS 59 H HIS 59 100.428 -12.131 2.706 473 HA HIS 59 HA HIS 59 100.501 -11.114 -0.096 474 HB2 HIS 59 HB2 HIS 59 97.860 -10.692 0.331 475 HB3 HIS 59 HB3 HIS 59 98.477 -12.132 -0.513 476 HD2 HIS 59 HD2 HIS 59 98.787 -11.907 3.409 477 HE1 HIS 59 HE1 HIS 59 95.909 -14.855 2.480 478 H TYR 60 H TYR 60 100.628 -8.902 -0.081 479 HA TYR 60 HA TYR 60 100.234 -7.606 2.611 480 HB2 TYR 60 HB3 TYR 60 101.325 -5.650 1.005 481 HB3 TYR 60 HB2 TYR 60 102.265 -6.753 2.035 482 HD1 TYR 60 HD1 TYR 60 102.065 -5.461 -1.175 483 HD2 TYR 60 HD2 TYR 60 102.556 -9.215 0.852 484 HE1 TYR 60 HE1 TYR 60 103.164 -6.403 -3.188 485 HE2 TYR 60 HE2 TYR 60 103.651 -10.161 -1.162 486 HH TYR 60 HH TYR 60 105.035 -8.709 -3.378 487 H TRP 61 H TRP 61 98.480 -6.349 2.941 488 HA TRP 61 HA TRP 61 96.724 -5.803 0.579 489 HB2 TRP 61 HB3 TRP 61 95.754 -6.776 2.663 490 HB3 TRP 61 HB2 TRP 61 96.247 -5.314 3.552 491 HD1 TRP 61 HD1 TRP 61 93.666 -6.623 1.113 492 HE1 TRP 61 HE1 TRP 61 91.854 -4.835 0.695 493 HE3 TRP 61 HE3 TRP 61 95.877 -2.667 3.461 494 HZ2 TRP 61 HZ2 TRP 61 91.439 -2.049 1.315 495 HZ3 TRP 61 HZ3 TRP 61 94.754 -0.461 3.537 496 HH2 TRP 61 HH2 TRP 61 92.538 -0.146 2.468 497 H LEU 62 H LEU 62 96.410 -3.792 -0.268 498 HA LEU 62 HA LEU 62 97.474 -1.439 1.290 499 HB2 LEU 62 HB3 LEU 62 97.924 -1.501 -1.681 500 HB3 LEU 62 HB2 LEU 62 98.881 -0.715 -0.404 501 HG LEU 62 HG LEU 62 98.733 -3.733 -0.816 502 HD11 LEU 62 HD11 LEU 62 100.027 -3.255 -2.641 503 HD12 LEU 62 HD12 LEU 62 101.303 -2.991 -1.428 504 HD13 LEU 62 HD13 LEU 62 100.389 -1.607 -2.074 505 HD21 LEU 62 HD21 LEU 62 101.082 -2.699 0.548 506 HD22 LEU 62 HD22 LEU 62 99.873 -3.867 1.132 507 HD23 LEU 62 HD23 LEU 62 99.606 -2.122 1.360 508 H GLY 63 H GLY 63 95.806 -0.029 1.482 509 HA2 GLY 63 HA2 GLY 63 93.406 -0.260 -0.168 510 HA3 GLY 63 HA3 GLY 63 93.757 1.054 0.980 511 H ASN 64 H ASN 64 96.063 0.268 -1.524 512 HA ASN 64 HA ASN 64 96.802 1.535 -3.370 513 HB2 ASN 64 HB2 ASN 64 94.458 0.940 -4.141 514 HB3 ASN 64 HB3 ASN 64 93.926 2.523 -3.523 515 HD21 ASN 64 HD21 ASN 64 93.660 3.848 -5.336 516 HD22 ASN 64 HD22 ASN 64 94.843 4.014 -6.614 517 H GLU 65 H GLU 65 96.006 2.856 -0.498 518 HA GLU 65 HA GLU 65 96.477 5.681 -1.478 519 HB2 GLU 65 HB2 GLU 65 94.967 4.493 0.824 520 HB3 GLU 65 HB3 GLU 65 95.801 6.039 1.113 521 HG2 GLU 65 HG2 GLU 65 94.663 7.028 -0.848 522 HG3 GLU 65 HG3 GLU 65 93.844 5.479 -1.162 523 H CYS 66 H CYS 66 98.269 3.166 -0.654 524 HA CYS 66 HA CYS 66 99.999 4.670 1.313 525 HB2 CYS 66 HB2 CYS 66 99.244 2.278 1.806 526 HB3 CYS 66 HB3 CYS 66 100.260 1.764 0.438 527 HG CYS 66 HG CYS 66 101.678 1.414 2.952 528 H SER 67 H SER 67 102.186 5.073 0.826 529 HA SER 67 HA SER 67 102.779 5.136 -2.092 530 HB2 SER 67 HB2 SER 67 103.408 7.112 -0.887 531 HB3 SER 67 HB3 SER 67 104.216 6.165 0.385 532 HG SER 67 HG SER 67 105.571 7.155 -1.377 533 H GLN 68 H GLN 68 105.110 4.470 -2.731 534 HA GLN 68 HA GLN 68 105.401 1.630 -2.122 535 HB2 GLN 68 HB2 GLN 68 107.444 3.502 -3.398 536 HB3 GLN 68 HB3 GLN 68 107.370 1.731 -3.556 537 HG2 GLN 68 HG3 GLN 68 104.868 3.170 -4.285 538 HG3 GLN 68 HG2 GLN 68 106.256 3.481 -5.354 539 HE21 GLN 68 HE21 GLN 68 104.977 0.552 -3.604 540 HE22 GLN 68 HE22 GLN 68 105.040 -0.480 -5.015 541 H ASP 69 H ASP 69 106.472 4.511 -0.560 542 HA ASP 69 HA ASP 69 108.958 3.583 0.568 543 HB2 ASP 69 HB2 ASP 69 108.403 5.910 0.776 544 HB3 ASP 69 HB3 ASP 69 106.852 5.540 1.566 545 H GLU 70 H GLU 70 105.683 3.640 2.092 546 HA GLU 70 HA GLU 70 106.664 1.686 4.123 547 HB2 GLU 70 HB2 GLU 70 103.901 2.916 3.714 548 HB3 GLU 70 HB3 GLU 70 104.428 1.975 5.130 549 HG2 GLU 70 HG2 GLU 70 106.230 3.677 5.532 550 HG3 GLU 70 HG3 GLU 70 105.574 4.641 4.187 551 H SER 71 H SER 71 104.492 1.831 1.322 552 HA SER 71 HA SER 71 103.388 -0.846 1.715 553 HB2 SER 71 HB3 SER 71 102.438 1.050 0.267 554 HB3 SER 71 HB2 SER 71 103.683 0.624 -0.932 555 HG SER 71 HG SER 71 101.687 -0.503 -1.283 556 H GLY 72 H GLY 72 105.743 0.378 -0.734 557 HA2 GLY 72 HA3 GLY 72 106.535 -2.173 -1.707 558 HA3 GLY 72 HA2 GLY 72 107.595 -0.743 -1.690 559 H ALA 73 H ALA 73 107.808 -0.324 1.089 560 HA ALA 73 HA ALA 73 109.940 -2.082 1.786 561 HB1 ALA 73 HB1 ALA 73 109.383 -1.313 4.196 562 HB2 ALA 73 HB2 ALA 73 109.760 -0.044 3.007 563 HB3 ALA 73 HB3 ALA 73 108.069 -0.368 3.457 564 H ALA 74 H ALA 74 106.516 -2.182 2.930 565 HA ALA 74 HA ALA 74 106.738 -4.523 4.519 566 HB1 ALA 74 HB1 ALA 74 104.399 -3.861 2.675 567 HB2 ALA 74 HB2 ALA 74 104.349 -4.832 4.165 568 HB3 ALA 74 HB3 ALA 74 104.675 -3.085 4.253 569 H ALA 75 H ALA 75 106.065 -4.277 1.004 570 HA ALA 75 HA ALA 75 105.920 -7.123 0.555 571 HB1 ALA 75 HB1 ALA 75 106.381 -6.553 -1.816 572 HB2 ALA 75 HB2 ALA 75 106.879 -4.916 -1.326 573 HB3 ALA 75 HB3 ALA 75 105.189 -5.434 -1.112 574 H ILE 76 H ILE 76 108.604 -4.968 1.140 575 HA ILE 76 HA ILE 76 110.601 -6.855 0.012 576 HB ILE 76 HB ILE 76 110.898 -4.342 1.715 577 HG12 ILE 76 HG12 ILE 76 109.947 -4.362 -0.771 578 HG13 ILE 76 HG13 ILE 76 111.151 -3.151 -0.273 579 HG21 ILE 76 HG21 ILE 76 112.889 -5.579 2.063 580 HG22 ILE 76 HG22 ILE 76 113.290 -4.508 0.699 581 HG23 ILE 76 HG23 ILE 76 112.889 -6.217 0.401 582 HD11 ILE 76 HD11 ILE 76 111.572 -4.446 -2.493 583 HD12 ILE 76 HD12 ILE 76 111.997 -5.819 -1.443 584 HD13 ILE 76 HD13 ILE 76 112.925 -4.303 -1.344 585 H PHE 77 H PHE 77 109.882 -5.572 3.314 586 HA PHE 77 HA PHE 77 111.629 -7.437 4.653 587 HB2 PHE 77 HB2 PHE 77 109.155 -5.907 5.539 588 HB3 PHE 77 HB3 PHE 77 110.062 -6.962 6.650 589 HD1 PHE 77 HD1 PHE 77 112.635 -6.566 6.789 590 HD2 PHE 77 HD2 PHE 77 109.865 -3.699 5.189 591 HE1 PHE 77 HE1 PHE 77 114.297 -4.760 7.148 592 HE2 PHE 77 HE2 PHE 77 111.529 -1.894 5.543 593 HZ PHE 77 HZ PHE 77 113.743 -2.426 6.523 594 H THR 78 H THR 78 108.259 -7.667 3.572 595 HA THR 78 HA THR 78 107.786 -10.214 4.958 596 HB THR 78 HB THR 78 106.109 -8.382 3.992 597 HG1 THR 78 HG1 THR 78 105.931 -11.083 4.482 598 HG21 THR 78 HG21 THR 78 105.148 -9.044 1.834 599 HG22 THR 78 HG22 THR 78 106.314 -10.382 1.699 600 HG23 THR 78 HG23 THR 78 106.883 -8.697 1.635 601 H VAL 79 H VAL 79 108.610 -9.256 1.603 602 HA VAL 79 HA VAL 79 108.541 -11.944 0.535 603 HB VAL 79 HB VAL 79 109.994 -9.406 -0.290 604 HG11 VAL 79 HG11 VAL 79 111.366 -11.353 -0.982 605 HG12 VAL 79 HG12 VAL 79 110.593 -10.583 -2.388 606 HG13 VAL 79 HG13 VAL 79 109.932 -12.098 -1.728 607 HG21 VAL 79 HG21 VAL 79 107.891 -10.938 -1.834 608 HG22 VAL 79 HG22 VAL 79 107.410 -9.877 -0.488 609 HG23 VAL 79 HG23 VAL 79 108.281 -9.202 -1.886 610 H GLN 80 H GLN 80 111.369 -9.950 1.566 611 HA GLN 80 HA GLN 80 113.269 -12.101 1.285 612 HB2 GLN 80 HB3 GLN 80 113.359 -9.762 3.240 613 HB3 GLN 80 HB2 GLN 80 114.745 -10.731 2.686 614 HG2 GLN 80 HG2 GLN 80 112.928 -9.126 0.834 615 HG3 GLN 80 HG3 GLN 80 114.488 -8.538 1.460 616 HE21 GLN 80 HE21 GLN 80 113.625 -9.261 -1.393 617 HE22 GLN 80 HE22 GLN 80 114.816 -10.431 -1.913 618 H LEU 81 H LEU 81 111.817 -10.811 4.343 619 HA LEU 81 HA LEU 81 112.818 -12.884 6.016 620 HB2 LEU 81 HB2 LEU 81 111.437 -10.743 6.615 621 HB3 LEU 81 HB3 LEU 81 110.017 -11.787 6.379 622 HG LEU 81 HG LEU 81 110.730 -11.758 8.757 623 HD11 LEU 81 HD11 LEU 81 110.534 -14.077 9.108 624 HD12 LEU 81 HD12 LEU 81 109.843 -13.873 7.481 625 HD13 LEU 81 HD13 LEU 81 111.507 -14.475 7.672 626 HD21 LEU 81 HD21 LEU 81 112.881 -12.253 9.477 627 HD22 LEU 81 HD22 LEU 81 113.258 -11.509 7.904 628 HD23 LEU 81 HD23 LEU 81 113.231 -13.281 8.067 629 H ASP 82 H ASP 82 109.711 -12.777 4.194 630 HA ASP 82 HA ASP 82 108.637 -15.248 4.979 631 HB2 ASP 82 HB2 ASP 82 107.408 -13.927 3.400 632 HB3 ASP 82 HB3 ASP 82 108.745 -13.959 2.226 633 H ASP 83 H ASP 83 111.191 -14.687 2.506 634 HA ASP 83 HA ASP 83 111.511 -17.502 1.891 635 HB2 ASP 83 HB2 ASP 83 113.651 -15.323 1.849 636 HB3 ASP 83 HB3 ASP 83 113.683 -16.861 0.954 637 H TYR 84 H TYR 84 112.670 -15.397 4.462 638 HA TYR 84 HA TYR 84 114.546 -17.415 5.523 639 HB2 TYR 84 HB3 TYR 84 115.011 -15.070 5.957 640 HB3 TYR 84 HB2 TYR 84 113.402 -14.840 6.683 641 HD1 TYR 84 HD1 TYR 84 116.820 -15.930 7.236 642 HD2 TYR 84 HD2 TYR 84 112.825 -16.095 8.806 643 HE1 TYR 84 HE1 TYR 84 117.715 -16.622 9.444 644 HE2 TYR 84 HE2 TYR 84 113.720 -16.789 11.011 645 HH TYR 84 HH TYR 84 116.758 -17.960 11.502 646 H LEU 85 H LEU 85 111.144 -16.666 5.787 647 HA LEU 85 HA LEU 85 110.836 -18.165 8.331 648 HB2 LEU 85 HB3 LEU 85 109.387 -16.169 7.336 649 HB3 LEU 85 HB2 LEU 85 108.528 -17.491 6.510 650 HG LEU 85 HG LEU 85 108.560 -18.592 8.931 651 HD11 LEU 85 HD11 LEU 85 109.966 -16.814 9.936 652 HD12 LEU 85 HD12 LEU 85 108.736 -15.601 9.510 653 HD13 LEU 85 HD13 LEU 85 108.361 -16.868 10.702 654 HD21 LEU 85 HD21 LEU 85 106.751 -16.728 7.535 655 HD22 LEU 85 HD22 LEU 85 106.494 -16.761 9.296 656 HD23 LEU 85 HD23 LEU 85 106.387 -18.266 8.353 657 H ASN 86 H ASN 86 109.938 -18.644 4.880 658 HA ASN 86 HA ASN 86 109.686 -21.591 5.547 659 HB2 ASN 86 HB2 ASN 86 107.546 -20.245 4.890 660 HB3 ASN 86 HB3 ASN 86 108.233 -20.250 3.248 661 HD21 ASN 86 HD21 ASN 86 108.240 -22.787 5.849 662 HD22 ASN 86 HD22 ASN 86 107.497 -24.012 4.846 663 H GLY 87 H GLY 87 110.548 -19.176 3.057 664 HA2 GLY 87 HA2 GLY 87 112.632 -19.464 1.765 665 HA3 GLY 87 HA3 GLY 87 112.468 -21.227 1.951 666 H ARG 88 H ARG 88 109.455 -20.821 1.429 667 HA ARG 88 HA ARG 88 109.610 -20.245 -1.526 668 HB2 ARG 88 HB2 ARG 88 107.832 -22.314 -1.483 669 HB3 ARG 88 HB3 ARG 88 109.569 -22.522 -1.806 670 HG2 ARG 88 HG2 ARG 88 110.000 -23.064 0.523 671 HG3 ARG 88 HG3 ARG 88 108.328 -22.658 0.975 672 HD2 ARG 88 HD2 ARG 88 107.447 -24.576 -0.038 673 HD3 ARG 88 HD3 ARG 88 108.829 -24.751 -1.145 674 HE ARG 88 HE ARG 88 109.886 -25.100 1.466 675 HH11 ARG 88 HH11 ARG 88 110.108 -27.183 2.318 676 HH12 ARG 88 HH12 ARG 88 109.129 -28.492 1.695 677 HH21 ARG 88 HH21 ARG 88 107.472 -26.491 -0.623 678 HH22 ARG 88 HH22 ARG 88 107.643 -28.102 0.038 679 H ALA 89 H ALA 89 106.983 -21.640 0.449 680 HA ALA 89 HA ALA 89 104.745 -20.836 0.618 681 HB1 ALA 89 HB1 ALA 89 106.171 -19.571 2.372 682 HB2 ALA 89 HB2 ALA 89 104.596 -18.862 1.946 683 HB3 ALA 89 HB3 ALA 89 106.091 -18.187 1.256 684 H VAL 90 H VAL 90 103.851 -18.091 0.241 685 HA VAL 90 HA VAL 90 104.489 -17.542 -2.636 686 HB VAL 90 HB VAL 90 101.633 -17.967 -1.656 687 HG11 VAL 90 HG11 VAL 90 101.904 -16.343 -3.513 688 HG12 VAL 90 HG12 VAL 90 101.113 -17.834 -4.078 689 HG13 VAL 90 HG13 VAL 90 102.834 -17.550 -4.433 690 HG21 VAL 90 HG21 VAL 90 101.673 -20.042 -2.975 691 HG22 VAL 90 HG22 VAL 90 103.366 -19.743 -3.435 692 HG23 VAL 90 HG23 VAL 90 102.953 -20.094 -1.740 693 H GLN 91 H GLN 91 104.491 -15.365 -3.022 694 HA GLN 91 HA GLN 91 103.233 -13.625 -0.883 695 HB2 GLN 91 HB3 GLN 91 105.007 -11.954 -1.457 696 HB3 GLN 91 HB2 GLN 91 105.684 -13.475 -0.828 697 HG2 GLN 91 HG2 GLN 91 107.016 -13.321 -2.692 698 HG3 GLN 91 HG3 GLN 91 105.607 -14.058 -3.490 699 HE21 GLN 91 HE21 GLN 91 105.236 -12.991 -5.435 700 HE22 GLN 91 HE22 GLN 91 105.324 -11.257 -5.648 701 H HIS 92 H HIS 92 101.449 -12.629 -1.689 702 HA HIS 92 HA HIS 92 101.571 -11.787 -4.591 703 HB2 HIS 92 HB3 HIS 92 98.873 -11.887 -4.016 704 HB3 HIS 92 HB2 HIS 92 99.789 -13.171 -4.835 705 HD2 HIS 92 HD2 HIS 92 101.220 -14.650 -2.289 706 HE1 HIS 92 HE1 HIS 92 97.349 -14.829 -0.611 707 H ARG 93 H ARG 93 100.304 -9.832 -5.099 708 HA ARG 93 HA ARG 93 100.322 -7.947 -2.732 709 HB2 ARG 93 HB2 ARG 93 101.902 -7.478 -4.661 710 HB3 ARG 93 HB3 ARG 93 100.473 -7.252 -5.697 711 HG2 ARG 93 HG3 ARG 93 99.687 -5.413 -4.312 712 HG3 ARG 93 HG2 ARG 93 100.969 -5.710 -3.115 713 HD2 ARG 93 HD2 ARG 93 102.599 -5.356 -5.141 714 HD3 ARG 93 HD3 ARG 93 101.199 -4.568 -5.909 715 HE ARG 93 HE ARG 93 101.774 -3.595 -3.170 716 HH11 ARG 93 HH11 ARG 93 102.429 -1.434 -3.079 717 HH12 ARG 93 HH12 ARG 93 102.905 -0.603 -4.542 718 HH21 ARG 93 HH21 ARG 93 102.360 -3.362 -6.595 719 HH22 ARG 93 HH22 ARG 93 102.866 -1.689 -6.524 720 H GLU 94 H GLU 94 98.414 -7.053 -2.124 721 HA GLU 94 HA GLU 94 96.090 -7.360 -4.044 722 HB2 GLU 94 HB2 GLU 94 95.797 -6.996 -1.050 723 HB3 GLU 94 HB3 GLU 94 94.650 -7.713 -2.207 724 HG2 GLU 94 HG2 GLU 94 97.342 -8.918 -1.422 725 HG3 GLU 94 HG3 GLU 94 95.760 -9.448 -0.801 726 H VAL 95 H VAL 95 96.580 -5.299 -5.031 727 HA VAL 95 HA VAL 95 96.848 -2.865 -3.450 728 HB VAL 95 HB VAL 95 95.728 -2.882 -6.256 729 HG11 VAL 95 HG11 VAL 95 96.139 -0.739 -5.080 730 HG12 VAL 95 HG12 VAL 95 97.246 -0.934 -6.460 731 HG13 VAL 95 HG13 VAL 95 97.831 -1.217 -4.803 732 HG21 VAL 95 HG21 VAL 95 98.253 -3.019 -6.924 733 HG22 VAL 95 HG22 VAL 95 98.469 -3.793 -5.336 734 HG23 VAL 95 HG23 VAL 95 97.395 -4.533 -6.548 735 H GLN 96 H GLN 96 94.610 -4.456 -2.555 736 HA GLN 96 HA GLN 96 92.301 -4.237 -2.081 737 HB2 GLN 96 HB3 GLN 96 92.938 -2.304 -0.848 738 HB3 GLN 96 HB2 GLN 96 93.265 -1.368 -2.326 739 HG2 GLN 96 HG2 GLN 96 90.488 -2.438 -2.005 740 HG3 GLN 96 HG3 GLN 96 90.965 -1.118 -0.911 741 HE21 GLN 96 HE21 GLN 96 88.991 -0.463 -2.710 742 HE22 GLN 96 HE22 GLN 96 89.637 0.524 -4.002 743 H GLY 97 H GLY 97 91.106 -5.120 -3.726 744 HA2 GLY 97 HA3 GLY 97 89.271 -4.055 -5.291 745 HA3 GLY 97 HA2 GLY 97 90.674 -3.416 -6.181 746 H PHE 98 H PHE 98 92.446 -5.456 -6.260 747 HA PHE 98 HA PHE 98 90.881 -7.609 -7.699 748 HB2 PHE 98 HB2 PHE 98 92.448 -6.358 -9.135 749 HB3 PHE 98 HB3 PHE 98 93.782 -6.712 -8.011 750 HD1 PHE 98 HD1 PHE 98 91.050 -8.574 -9.821 751 HD2 PHE 98 HD2 PHE 98 95.157 -8.503 -8.561 752 HE1 PHE 98 HE1 PHE 98 91.437 -10.742 -10.961 753 HE2 PHE 98 HE2 PHE 98 95.542 -10.673 -9.700 754 HZ PHE 98 HZ PHE 98 93.684 -11.790 -10.902 755 H GLU 99 H GLU 99 91.383 -7.495 -4.774 756 HA GLU 99 HA GLU 99 93.559 -9.129 -3.941 757 HB2 GLU 99 HB2 GLU 99 90.853 -9.593 -2.706 758 HB3 GLU 99 HB3 GLU 99 92.429 -9.339 -1.920 759 HG2 GLU 99 HG2 GLU 99 92.345 -6.938 -2.771 760 HG3 GLU 99 HG3 GLU 99 90.663 -7.249 -3.261 761 H SER 100 H SER 100 92.652 -11.459 -2.801 762 HA SER 100 HA SER 100 91.793 -13.048 -5.232 763 HB2 SER 100 HB3 SER 100 94.135 -13.480 -4.479 764 HB3 SER 100 HB2 SER 100 93.513 -13.942 -2.876 765 HG SER 100 HG SER 100 93.857 -15.614 -4.726 766 H ALA 101 H ALA 101 90.759 -15.221 -4.537 767 HA ALA 101 HA ALA 101 88.440 -14.597 -2.888 768 HB1 ALA 101 HB1 ALA 101 87.875 -16.992 -3.192 769 HB2 ALA 101 HB2 ALA 101 89.505 -17.295 -3.839 770 HB3 ALA 101 HB3 ALA 101 88.372 -16.252 -4.732 771 H THR 102 H THR 102 91.611 -15.916 -2.221 772 HA THR 102 HA THR 102 90.909 -17.265 0.266 773 HB THR 102 HB THR 102 93.512 -16.108 -0.808 774 HG1 THR 102 HG1 THR 102 93.942 -18.376 -1.016 775 HG21 THR 102 HG21 THR 102 94.626 -17.319 1.046 776 HG22 THR 102 HG22 THR 102 93.036 -17.764 1.711 777 HG23 THR 102 HG23 THR 102 93.537 -16.057 1.670 778 H PHE 103 H PHE 103 92.423 -14.066 -0.379 779 HA PHE 103 HA PHE 103 92.356 -13.210 2.377 780 HB2 PHE 103 HB2 PHE 103 93.733 -11.997 0.817 781 HB3 PHE 103 HB3 PHE 103 92.347 -11.670 -0.250 782 HD1 PHE 103 HD1 PHE 103 90.514 -10.143 0.533 783 HD2 PHE 103 HD2 PHE 103 94.169 -10.633 2.733 784 HE1 PHE 103 HE1 PHE 103 90.036 -8.060 1.790 785 HE2 PHE 103 HE2 PHE 103 93.693 -8.548 3.989 786 HZ PHE 103 HZ PHE 103 91.625 -7.261 3.517 787 H LEU 104 H LEU 104 89.980 -12.925 -0.278 788 HA LEU 104 HA LEU 104 88.137 -11.277 1.297 789 HB2 LEU 104 HB2 LEU 104 87.738 -13.008 -1.181 790 HB3 LEU 104 HB3 LEU 104 86.484 -11.948 -0.494 791 HG LEU 104 HG LEU 104 89.251 -10.974 -1.320 792 HD11 LEU 104 HD11 LEU 104 88.003 -11.831 -3.284 793 HD12 LEU 104 HD12 LEU 104 86.601 -10.833 -2.827 794 HD13 LEU 104 HD13 LEU 104 88.122 -10.055 -3.326 795 HD21 LEU 104 HD21 LEU 104 86.719 -9.728 -0.257 796 HD22 LEU 104 HD22 LEU 104 88.415 -9.356 0.135 797 HD23 LEU 104 HD23 LEU 104 87.713 -8.795 -1.401 798 H GLY 105 H GLY 105 88.552 -14.769 0.723 799 HA2 GLY 105 HA2 GLY 105 86.066 -15.597 1.943 800 HA3 GLY 105 HA3 GLY 105 87.526 -16.604 1.804 801 H TYR 106 H TYR 106 89.277 -14.846 3.299 802 HA TYR 106 HA TYR 106 88.484 -15.709 6.008 803 HB2 TYR 106 HB2 TYR 106 90.899 -15.155 4.718 804 HB3 TYR 106 HB3 TYR 106 90.711 -13.788 5.842 805 HD1 TYR 106 HD1 TYR 106 89.955 -14.427 8.285 806 HD2 TYR 106 HD2 TYR 106 91.756 -17.175 5.518 807 HE1 TYR 106 HE1 TYR 106 90.619 -15.892 10.173 808 HE2 TYR 106 HE2 TYR 106 92.424 -18.638 7.407 809 HH TYR 106 HH TYR 106 92.507 -17.690 10.557 810 H PHE 107 H PHE 107 89.055 -12.523 4.420 811 HA PHE 107 HA PHE 107 87.579 -11.261 6.731 812 HB2 PHE 107 HB2 PHE 107 89.180 -9.914 4.513 813 HB3 PHE 107 HB3 PHE 107 88.573 -9.161 6.007 814 HD1 PHE 107 HD1 PHE 107 89.338 -10.325 8.249 815 HD2 PHE 107 HD2 PHE 107 91.351 -10.774 4.482 816 HE1 PHE 107 HE1 PHE 107 91.404 -11.017 9.436 817 HE2 PHE 107 HE2 PHE 107 93.417 -11.466 5.667 818 HZ PHE 107 HZ PHE 107 93.443 -11.587 8.145 819 H LYS 108 H LYS 108 85.712 -12.486 5.407 820 HA LYS 108 HA LYS 108 84.795 -10.914 3.055 821 HB2 LYS 108 HB2 LYS 108 84.370 -13.309 3.043 822 HB3 LYS 108 HB3 LYS 108 83.556 -13.217 4.623 823 HG2 LYS 108 HG2 LYS 108 81.744 -11.910 3.695 824 HG3 LYS 108 HG3 LYS 108 82.606 -11.710 2.151 825 HD2 LYS 108 HD3 LYS 108 82.447 -14.108 1.700 826 HD3 LYS 108 HD2 LYS 108 81.722 -14.394 3.300 827 HE2 LYS 108 HE2 LYS 108 79.828 -14.314 1.915 828 HE3 LYS 108 HE3 LYS 108 79.929 -12.635 2.497 829 HZ1 LYS 108 HZ1 LYS 108 79.644 -12.733 0.111 830 HZ2 LYS 108 HZ2 LYS 108 81.110 -12.075 0.479 831 HZ3 LYS 108 HZ3 LYS 108 81.017 -13.631 -0.061 832 H SER 109 H SER 109 84.168 -11.133 6.520 833 HA SER 109 HA SER 109 81.852 -9.237 6.204 834 HB2 SER 109 HB2 SER 109 82.902 -10.865 8.555 835 HB3 SER 109 HB3 SER 109 81.594 -9.666 8.702 836 HG SER 109 HG SER 109 80.797 -11.807 8.299 837 H GLY 110 H GLY 110 85.137 -9.025 6.420 838 HA2 GLY 110 HA2 GLY 110 85.127 -6.756 8.386 839 HA3 GLY 110 HA3 GLY 110 86.572 -7.508 7.668 840 H LEU 111 H LEU 111 87.510 -6.467 5.974 841 HA LEU 111 HA LEU 111 87.838 -4.788 4.359 842 HB2 LEU 111 HB2 LEU 111 84.931 -5.523 3.887 843 HB3 LEU 111 HB3 LEU 111 85.839 -4.410 2.836 844 HG LEU 111 HG LEU 111 87.033 -7.100 3.503 845 HD11 LEU 111 HD11 LEU 111 84.703 -7.585 2.802 846 HD12 LEU 111 HD12 LEU 111 84.930 -6.575 1.354 847 HD13 LEU 111 HD13 LEU 111 85.865 -8.077 1.546 848 HD21 LEU 111 HD21 LEU 111 88.339 -5.391 2.264 849 HD22 LEU 111 HD22 LEU 111 87.050 -5.296 1.039 850 HD23 LEU 111 HD23 LEU 111 87.985 -6.798 1.231 851 H LYS 112 H LYS 112 88.246 -2.956 5.495 852 HA LYS 112 HA LYS 112 85.932 -1.067 5.796 853 HB2 LYS 112 HB2 LYS 112 86.793 -2.432 8.004 854 HB3 LYS 112 HB3 LYS 112 87.900 -1.038 8.040 855 HG2 LYS 112 HG2 LYS 112 85.779 0.411 7.673 856 HG3 LYS 112 HG3 LYS 112 84.864 -1.046 8.126 857 HD2 LYS 112 HD2 LYS 112 85.935 -1.141 10.290 858 HD3 LYS 112 HD3 LYS 112 87.103 0.122 9.831 859 HE2 LYS 112 HE3 LYS 112 85.500 1.301 11.107 860 HE3 LYS 112 HE2 LYS 112 84.994 1.610 9.429 861 HZ1 LYS 112 HZ1 LYS 112 83.142 0.936 10.807 862 HZ2 LYS 112 HZ2 LYS 112 83.890 -0.482 11.195 863 HZ3 LYS 112 HZ3 LYS 112 83.421 -0.196 9.640 864 H TYR 113 H TYR 113 86.690 0.338 4.236 865 HA TYR 113 HA TYR 113 89.572 1.027 4.135 866 HB2 TYR 113 HB2 TYR 113 88.287 2.874 2.533 867 HB3 TYR 113 HB3 TYR 113 88.843 1.274 1.988 868 HD1 TYR 113 HD1 TYR 113 85.916 3.164 3.312 869 HD2 TYR 113 HD2 TYR 113 87.285 -0.467 1.470 870 HE1 TYR 113 HE1 TYR 113 83.566 2.498 2.876 871 HE2 TYR 113 HE2 TYR 113 84.936 -1.133 1.035 872 HH TYR 113 HH TYR 113 82.322 0.204 2.522 873 H LYS 114 H LYS 114 90.327 2.284 5.774 874 HA LYS 114 HA LYS 114 88.651 4.701 6.508 875 HB2 LYS 114 HB2 LYS 114 88.989 2.911 8.313 876 HB3 LYS 114 HB3 LYS 114 90.715 3.344 8.287 877 HG2 LYS 114 HG2 LYS 114 89.959 4.781 9.954 878 HG3 LYS 114 HG3 LYS 114 89.742 5.819 8.525 879 HD2 LYS 114 HD2 LYS 114 87.380 5.179 8.374 880 HD3 LYS 114 HD3 LYS 114 87.576 4.035 9.723 881 HE2 LYS 114 HE2 LYS 114 87.786 5.739 11.314 882 HE3 LYS 114 HE3 LYS 114 88.334 6.933 10.112 883 HZ1 LYS 114 HZ1 LYS 114 86.063 7.334 10.795 884 HZ2 LYS 114 HZ2 LYS 114 86.111 6.932 9.196 885 HZ3 LYS 114 HZ3 LYS 114 85.604 5.826 10.309 886 H LYS 115 H LYS 115 89.696 6.693 6.506 887 HA LYS 115 HA LYS 115 91.984 7.061 4.849 888 HB2 LYS 115 HB2 LYS 115 92.154 9.320 5.938 889 HB3 LYS 115 HB3 LYS 115 90.496 8.918 5.427 890 HG2 LYS 115 HG2 LYS 115 89.886 8.290 7.696 891 HG3 LYS 115 HG3 LYS 115 91.570 8.463 8.245 892 HD2 LYS 115 HD3 LYS 115 90.132 10.445 8.824 893 HD3 LYS 115 HD2 LYS 115 91.519 10.865 7.791 894 HE2 LYS 115 HE2 LYS 115 88.884 10.132 6.510 895 HE3 LYS 115 HE3 LYS 115 89.102 11.763 7.187 896 HZ1 LYS 115 HZ1 LYS 115 90.126 12.227 5.297 897 HZ2 LYS 115 HZ2 LYS 115 91.377 11.265 5.778 898 HZ3 LYS 115 HZ3 LYS 115 90.186 10.651 4.816 899 H GLY 116 H GLY 116 94.204 7.315 5.275 900 HA2 GLY 116 HA3 GLY 116 95.147 5.870 7.691 901 HA3 GLY 116 HA2 GLY 116 96.165 6.490 6.370 902 H GLY 117 H GLY 117 94.190 9.016 7.109 903 HA2 GLY 117 HA2 GLY 117 96.327 10.233 8.830 904 HA3 GLY 117 HA3 GLY 117 95.048 11.121 7.969 905 H VAL 118 H VAL 118 96.040 10.529 10.985 906 HA VAL 118 HA VAL 118 93.201 10.351 12.027 907 HB VAL 118 HB VAL 118 95.599 9.492 13.661 908 HG11 VAL 118 HG11 VAL 118 93.384 9.766 14.741 909 HG12 VAL 118 HG12 VAL 118 92.668 8.648 13.556 910 HG13 VAL 118 HG13 VAL 118 93.877 8.056 14.720 911 HG21 VAL 118 HG21 VAL 118 94.905 7.113 12.816 912 HG22 VAL 118 HG22 VAL 118 94.211 7.984 11.428 913 HG23 VAL 118 HG23 VAL 118 95.952 8.111 11.777 914 H ALA 119 H ALA 119 96.223 12.052 11.937 915 HA ALA 119 HA ALA 119 96.200 13.464 14.402 916 HB1 ALA 119 HB1 ALA 119 97.366 15.280 13.180 917 HB2 ALA 119 HB2 ALA 119 96.869 14.556 11.632 918 HB3 ALA 119 HB3 ALA 119 97.992 13.683 12.703 919 H SER 120 H SER 120 93.995 13.673 11.697 920 HA SER 120 HA SER 120 92.950 16.325 12.450 921 HB2 SER 120 HB2 SER 120 92.829 15.121 10.132 922 HB3 SER 120 HB3 SER 120 91.421 14.280 10.825 923 HG SER 120 HG SER 120 90.840 16.252 9.753 924 H GLY 121 H GLY 121 92.949 13.579 14.095 925 HA2 GLY 121 HA2 GLY 121 90.129 13.243 14.795 926 HA3 GLY 121 HA3 GLY 121 91.517 12.602 15.707 927 H PHE 122 H PHE 122 92.897 14.914 16.373 928 HA PHE 122 HA PHE 122 91.554 15.826 18.696 929 HB2 PHE 122 HB2 PHE 122 93.721 17.043 16.961 930 HB3 PHE 122 HB3 PHE 122 93.093 17.921 18.376 931 HD1 PHE 122 HD1 PHE 122 93.002 16.600 20.620 932 HD2 PHE 122 HD2 PHE 122 95.381 15.412 17.246 933 HE1 PHE 122 HE1 PHE 122 94.422 15.216 22.110 934 HE2 PHE 122 HE2 PHE 122 96.804 14.030 18.736 935 HZ PHE 122 HZ PHE 122 96.323 13.931 21.168 936 H LYS 123 H LYS 123 91.172 16.842 15.355 937 HA LYS 123 HA LYS 123 89.814 19.364 15.999 938 HB2 LYS 123 HB2 LYS 123 90.145 17.647 13.534 939 HB3 LYS 123 HB3 LYS 123 88.937 18.955 13.538 940 HG2 LYS 123 HG3 LYS 123 90.649 20.602 14.096 941 HG3 LYS 123 HG2 LYS 123 91.872 19.322 14.279 942 HD2 LYS 123 HD2 LYS 123 91.987 18.917 11.977 943 HD3 LYS 123 HD3 LYS 123 90.356 19.565 11.679 944 HE2 LYS 123 HE2 LYS 123 92.603 20.960 11.103 945 HE3 LYS 123 HE3 LYS 123 91.090 21.751 11.608 946 HZ1 LYS 123 HZ1 LYS 123 93.175 22.371 12.850 947 HZ2 LYS 123 HZ2 LYS 123 91.879 21.945 13.778 948 HZ3 LYS 123 HZ3 LYS 123 93.118 20.880 13.552 949 H HIS 124 H HIS 124 88.780 16.011 15.343 950 HA HIS 124 HA HIS 124 85.931 16.873 15.797 951 HB2 HIS 124 HB3 HIS 124 87.021 14.148 14.961 952 HB3 HIS 124 HB2 HIS 124 85.320 14.672 14.934 953 HD2 HIS 124 HD2 HIS 124 85.565 17.516 13.368 954 HE1 HIS 124 HE1 HIS 124 87.724 15.395 10.422 955 HE2 HIS 124 HE2 HIS 124 86.434 17.550 10.891 956 H VAL 125 H VAL 125 86.068 17.203 18.087 957 HA VAL 125 HA VAL 125 86.931 14.872 19.748 958 HB VAL 125 HB VAL 125 85.667 17.433 20.777 959 HG11 VAL 125 HG11 VAL 125 86.088 15.575 22.364 960 HG12 VAL 125 HG12 VAL 125 87.155 16.958 22.702 961 HG13 VAL 125 HG13 VAL 125 87.793 15.528 21.857 962 HG21 VAL 125 HG21 VAL 125 88.200 18.131 20.950 963 HG22 VAL 125 HG22 VAL 125 88.426 16.971 19.620 964 HG23 VAL 125 HG23 VAL 125 87.340 18.365 19.409 965 H VAL 126 H VAL 126 85.508 13.326 20.352 966 HA VAL 126 HA VAL 126 82.707 14.084 21.005 967 HB VAL 126 HB VAL 126 83.390 12.204 18.701 968 HG11 VAL 126 HG11 VAL 126 81.603 11.262 20.141 969 HG12 VAL 126 HG12 VAL 126 80.945 11.809 18.580 970 HG13 VAL 126 HG13 VAL 126 80.712 12.800 20.040 971 HG21 VAL 126 HG21 VAL 126 81.776 13.798 17.514 972 HG22 VAL 126 HG22 VAL 126 83.349 14.497 17.966 973 HG23 VAL 126 HG23 VAL 126 81.903 14.852 18.943 974 HA PRO 127 HA PRO 127 84.447 10.569 23.449 975 HB2 PRO 127 HB2 PRO 127 83.865 11.605 25.921 976 HB3 PRO 127 HB3 PRO 127 85.341 12.036 25.011 977 HG2 PRO 127 HG3 PRO 127 82.812 13.574 25.392 978 HG3 PRO 127 HG2 PRO 127 84.495 14.154 25.270 979 HD2 PRO 127 HD2 PRO 127 82.603 14.212 23.188 980 HD3 PRO 127 HD3 PRO 127 84.376 14.324 22.977 981 H ASN 128 H ASN 128 83.217 8.804 23.963 982 HA ASN 128 HA ASN 128 80.333 8.905 23.736 983 HB2 ASN 128 HB2 ASN 128 81.691 6.706 25.282 984 HB3 ASN 128 HB3 ASN 128 80.401 6.601 24.061 985 HD21 ASN 128 HD21 ASN 128 82.117 8.607 22.362 986 HD22 ASN 128 HD22 ASN 128 83.310 7.563 21.623 987 H GLU 129 H GLU 129 78.717 8.690 25.372 988 HA GLU 129 HA GLU 129 79.524 9.975 27.943 989 HB2 GLU 129 HB3 GLU 129 77.172 10.279 28.324 990 HB3 GLU 129 HB2 GLU 129 77.435 10.601 26.593 991 HG2 GLU 129 HG2 GLU 129 75.598 9.161 26.508 992 HG3 GLU 129 HG3 GLU 129 76.944 8.007 26.350 993 H VAL 130 H VAL 130 78.775 6.810 26.682 994 HA VAL 130 HA VAL 130 77.751 5.437 28.912 995 HB VAL 130 HB VAL 130 78.178 4.253 26.843 996 HG11 VAL 130 HG11 VAL 130 80.159 5.567 26.134 997 HG12 VAL 130 HG12 VAL 130 80.490 3.820 26.056 998 HG13 VAL 130 HG13 VAL 130 81.131 4.788 27.405 999 HG21 VAL 130 HG21 VAL 130 79.038 2.235 27.719 1000 HG22 VAL 130 HG22 VAL 130 80.220 3.077 28.750 1001 HG23 VAL 130 HG23 VAL 130 78.492 3.100 29.176 1002 H VAL 131 H VAL 131 80.759 7.118 28.675 1003 HA VAL 131 HA VAL 131 82.237 5.584 30.664 1004 HB VAL 131 HB VAL 131 82.443 8.477 29.732 1005 HG11 VAL 131 HG11 VAL 131 83.330 8.236 32.035 1006 HG12 VAL 131 HG12 VAL 131 84.324 6.857 31.508 1007 HG13 VAL 131 HG13 VAL 131 84.649 8.485 30.866 1008 HG21 VAL 131 HG21 VAL 131 84.436 7.608 28.536 1009 HG22 VAL 131 HG22 VAL 131 84.110 5.980 29.178 1010 HG23 VAL 131 HG23 VAL 131 82.964 6.736 28.044 1011 H VAL 132 H VAL 132 80.059 8.417 30.834 1012 HA VAL 132 HA VAL 132 80.454 8.756 33.724 1013 HB VAL 132 HB VAL 132 78.332 9.748 31.777 1014 HG11 VAL 132 HG11 VAL 132 77.364 9.525 34.051 1015 HG12 VAL 132 HG12 VAL 132 78.736 10.438 34.723 1016 HG13 VAL 132 HG13 VAL 132 77.592 11.236 33.619 1017 HG21 VAL 132 HG21 VAL 132 80.615 10.682 31.520 1018 HG22 VAL 132 HG22 VAL 132 80.632 11.113 33.247 1019 HG23 VAL 132 HG23 VAL 132 79.488 11.912 32.142 1020 H GLN 133 H GLN 133 78.302 6.857 31.670 1021 HA GLN 133 HA GLN 133 76.648 6.104 34.057 1022 HB2 GLN 133 HB3 GLN 133 75.787 6.571 31.605 1023 HB3 GLN 133 HB2 GLN 133 76.332 4.904 31.300 1024 HG2 GLN 133 HG2 GLN 133 74.989 4.263 33.415 1025 HG3 GLN 133 HG3 GLN 133 74.238 5.871 33.278 1026 HE21 GLN 133 HE21 GLN 133 72.415 5.979 31.956 1027 HE22 GLN 133 HE22 GLN 133 72.019 4.806 30.720 Start of MODEL 13 1 H1 GLU 1 H1 GLU 1 114.108 -8.880 19.241 2 H2 GLU 1 H2 GLU 1 115.093 -7.604 18.893 3 H3 GLU 1 H3 GLU 1 114.300 -8.390 17.678 4 HA GLU 1 HA GLU 1 112.976 -6.875 19.837 5 HB2 GLU 1 HB2 GLU 1 112.940 -6.034 16.950 6 HB3 GLU 1 HB3 GLU 1 112.837 -5.040 18.423 7 HG2 GLU 1 HG3 GLU 1 115.006 -4.580 17.588 8 HG3 GLU 1 HG2 GLU 1 115.292 -5.800 18.852 9 H HIS 2 H HIS 2 110.966 -7.691 20.123 10 HA HIS 2 HA HIS 2 108.956 -8.843 19.636 11 HB2 HIS 2 HB2 HIS 2 109.550 -7.337 17.069 12 HB3 HIS 2 HB3 HIS 2 108.107 -8.369 17.217 13 HD2 HIS 2 HD2 HIS 2 106.426 -7.561 19.558 14 HE1 HIS 2 HE1 HIS 2 107.819 -3.577 19.419 15 HE2 HIS 2 HE2 HIS 2 106.018 -5.104 20.390 16 HA PRO 3 HA PRO 3 111.169 -12.328 17.568 17 HB2 PRO 3 HB3 PRO 3 110.730 -14.168 19.557 18 HB3 PRO 3 HB2 PRO 3 112.094 -13.015 19.589 19 HG2 PRO 3 HG2 PRO 3 109.509 -12.975 21.081 20 HG3 PRO 3 HG3 PRO 3 111.129 -12.420 21.583 21 HD2 PRO 3 HD3 PRO 3 109.044 -10.760 20.684 22 HD3 PRO 3 HD2 PRO 3 110.772 -10.301 20.747 23 H GLU 4 H GLU 4 107.957 -11.858 18.811 24 HA GLU 4 HA GLU 4 106.794 -14.390 18.022 25 HB2 GLU 4 HB3 GLU 4 105.794 -12.399 19.421 26 HB3 GLU 4 HB2 GLU 4 105.294 -11.768 17.833 27 HG2 GLU 4 HG2 GLU 4 104.135 -13.910 17.351 28 HG3 GLU 4 HG3 GLU 4 104.625 -14.530 18.947 29 H PHE 5 H PHE 5 107.362 -11.329 16.269 30 HA PHE 5 HA PHE 5 105.986 -12.250 13.847 31 HB2 PHE 5 HB3 PHE 5 106.239 -9.869 14.187 32 HB3 PHE 5 HB2 PHE 5 108.002 -10.027 14.376 33 HD1 PHE 5 HD1 PHE 5 109.218 -9.302 12.538 34 HD2 PHE 5 HD2 PHE 5 105.417 -11.196 11.893 35 HE1 PHE 5 HE1 PHE 5 109.505 -9.044 10.088 36 HE2 PHE 5 HE2 PHE 5 105.704 -10.938 9.444 37 HZ PHE 5 HZ PHE 5 107.751 -9.867 8.540 38 H LEU 6 H LEU 6 109.300 -12.408 15.098 39 HA LEU 6 HA LEU 6 110.662 -13.116 12.692 40 HB2 LEU 6 HB2 LEU 6 111.512 -12.787 15.183 41 HB3 LEU 6 HB3 LEU 6 111.284 -14.550 15.277 42 HG LEU 6 HG LEU 6 112.646 -14.675 13.086 43 HD11 LEU 6 HD11 LEU 6 112.477 -12.265 12.513 44 HD12 LEU 6 HD12 LEU 6 113.375 -11.852 13.993 45 HD13 LEU 6 HD13 LEU 6 114.176 -12.764 12.692 46 HD21 LEU 6 HD21 LEU 6 114.792 -14.546 14.325 47 HD22 LEU 6 HD22 LEU 6 113.532 -15.335 15.304 48 HD23 LEU 6 HD23 LEU 6 113.984 -13.644 15.629 49 H LYS 7 H LYS 7 108.306 -14.879 14.558 50 HA LYS 7 HA LYS 7 109.020 -17.431 13.136 51 HB2 LYS 7 HB3 LYS 7 106.801 -17.014 15.173 52 HB3 LYS 7 HB2 LYS 7 107.594 -18.538 14.707 53 HG2 LYS 7 HG2 LYS 7 109.785 -17.412 15.556 54 HG3 LYS 7 HG3 LYS 7 108.704 -16.251 16.365 55 HD2 LYS 7 HD3 LYS 7 107.497 -18.263 17.377 56 HD3 LYS 7 HD2 LYS 7 108.829 -19.269 16.758 57 HE2 LYS 7 HE2 LYS 7 110.359 -17.492 17.970 58 HE3 LYS 7 HE3 LYS 7 108.882 -17.131 18.895 59 HZ1 LYS 7 HZ1 LYS 7 110.198 -18.843 19.953 60 HZ2 LYS 7 HZ2 LYS 7 108.749 -19.463 19.467 61 HZ3 LYS 7 HZ3 LYS 7 110.118 -19.797 18.610 62 H ALA 8 H ALA 8 106.095 -15.449 13.814 63 HA ALA 8 HA ALA 8 104.168 -15.122 12.491 64 HB1 ALA 8 HB1 ALA 8 106.374 -15.490 10.461 65 HB2 ALA 8 HB2 ALA 8 104.686 -15.412 9.903 66 HB3 ALA 8 HB3 ALA 8 105.387 -14.049 10.808 67 H GLY 9 H GLY 9 102.426 -16.414 12.036 68 HA2 GLY 9 HA2 GLY 9 101.230 -18.423 11.690 69 HA3 GLY 9 HA3 GLY 9 102.493 -18.832 10.504 70 H LYS 10 H LYS 10 102.430 -18.465 14.092 71 HA LYS 10 HA LYS 10 104.364 -20.579 14.504 72 HB2 LYS 10 HB2 LYS 10 102.206 -19.786 16.494 73 HB3 LYS 10 HB3 LYS 10 103.855 -20.365 16.828 74 HG2 LYS 10 HG3 LYS 10 104.759 -18.295 15.743 75 HG3 LYS 10 HG2 LYS 10 103.091 -17.709 15.535 76 HD2 LYS 10 HD3 LYS 10 103.994 -18.588 18.275 77 HD3 LYS 10 HD2 LYS 10 104.517 -17.000 17.667 78 HE2 LYS 10 HE2 LYS 10 102.304 -16.196 17.499 79 HE3 LYS 10 HE3 LYS 10 101.609 -17.835 17.505 80 HZ1 LYS 10 HZ1 LYS 10 101.324 -16.739 19.626 81 HZ2 LYS 10 HZ2 LYS 10 102.952 -16.533 19.789 82 HZ3 LYS 10 HZ3 LYS 10 102.309 -18.052 19.795 83 H GLU 11 H GLU 11 101.332 -20.822 13.210 84 HA GLU 11 HA GLU 11 101.264 -23.709 13.437 85 HB2 GLU 11 HB3 GLU 11 99.129 -23.840 14.819 86 HB3 GLU 11 HB2 GLU 11 100.583 -23.387 15.740 87 HG2 GLU 11 HG2 GLU 11 99.952 -20.972 15.460 88 HG3 GLU 11 HG3 GLU 11 98.447 -21.492 14.664 89 HA PRO 12 HA PRO 12 98.773 -23.369 9.816 90 HB2 PRO 12 HB3 PRO 12 96.809 -25.106 11.318 91 HB3 PRO 12 HB2 PRO 12 97.435 -25.288 9.654 92 HG2 PRO 12 HG2 PRO 12 98.347 -26.755 11.739 93 HG3 PRO 12 HG3 PRO 12 99.378 -26.282 10.361 94 HD2 PRO 12 HD3 PRO 12 99.452 -25.334 13.171 95 HD3 PRO 12 HD2 PRO 12 100.707 -25.205 11.902 96 H GLY 13 H GLY 13 97.499 -21.644 9.275 97 HA2 GLY 13 HA3 GLY 13 94.921 -21.040 9.931 98 HA3 GLY 13 HA2 GLY 13 95.756 -20.463 11.392 99 H LEU 14 H LEU 14 94.995 -18.297 10.790 100 HA LEU 14 HA LEU 14 96.728 -17.099 8.613 101 HB2 LEU 14 HB2 LEU 14 94.466 -17.036 7.798 102 HB3 LEU 14 HB3 LEU 14 93.842 -16.497 9.375 103 HG LEU 14 HG LEU 14 95.946 -14.744 8.226 104 HD11 LEU 14 HD11 LEU 14 94.755 -15.403 6.150 105 HD12 LEU 14 HD12 LEU 14 93.203 -14.969 6.905 106 HD13 LEU 14 HD13 LEU 14 94.414 -13.708 6.574 107 HD21 LEU 14 HD21 LEU 14 94.625 -14.199 10.255 108 HD22 LEU 14 HD22 LEU 14 93.127 -14.268 9.296 109 HD23 LEU 14 HD23 LEU 14 94.338 -13.007 8.965 110 H GLN 15 H GLN 15 97.781 -15.178 9.139 111 HA GLN 15 HA GLN 15 97.262 -14.110 11.925 112 HB2 GLN 15 HB2 GLN 15 99.971 -14.403 10.551 113 HB3 GLN 15 HB3 GLN 15 99.682 -13.750 12.180 114 HG2 GLN 15 HG3 GLN 15 98.455 -16.400 11.780 115 HG3 GLN 15 HG2 GLN 15 100.222 -16.419 11.565 116 HE21 GLN 15 HE21 GLN 15 101.579 -15.814 13.406 117 HE22 GLN 15 HE22 GLN 15 100.914 -15.744 15.022 118 H ILE 16 H ILE 16 97.808 -11.814 12.178 119 HA ILE 16 HA ILE 16 98.014 -10.361 9.532 120 HB ILE 16 HB ILE 16 96.320 -9.323 11.820 121 HG12 ILE 16 HG12 ILE 16 94.445 -10.306 10.127 122 HG13 ILE 16 HG13 ILE 16 95.715 -11.529 9.885 123 HG21 ILE 16 HG21 ILE 16 95.215 -8.114 9.957 124 HG22 ILE 16 HG22 ILE 16 96.964 -7.788 9.985 125 HG23 ILE 16 HG23 ILE 16 96.290 -8.926 8.794 126 HD11 ILE 16 HD11 ILE 16 94.189 -12.184 11.728 127 HD12 ILE 16 HD12 ILE 16 94.565 -10.666 12.578 128 HD13 ILE 16 HD13 ILE 16 95.835 -11.889 12.337 129 H TRP 17 H TRP 17 99.418 -8.638 9.539 130 HA TRP 17 HA TRP 17 100.308 -7.544 12.188 131 HB2 TRP 17 HB2 TRP 17 102.250 -8.583 10.076 132 HB3 TRP 17 HB3 TRP 17 102.682 -7.810 11.621 133 HD1 TRP 17 HD1 TRP 17 101.107 -9.166 13.746 134 HE1 TRP 17 HE1 TRP 17 101.209 -11.692 14.254 135 HE3 TRP 17 HE3 TRP 17 102.882 -10.831 9.256 136 HZ2 TRP 17 HZ2 TRP 17 101.969 -14.108 12.876 137 HZ3 TRP 17 HZ3 TRP 17 103.284 -13.246 8.882 138 HH2 TRP 17 HH2 TRP 17 102.829 -14.885 10.684 139 H ARG 18 H ARG 18 99.927 -5.396 11.937 140 HA ARG 18 HA ARG 18 99.979 -4.181 9.235 141 HB2 ARG 18 HB3 ARG 18 98.342 -3.502 11.025 142 HB3 ARG 18 HB2 ARG 18 99.703 -2.831 11.956 143 HG2 ARG 18 HG2 ARG 18 100.264 -1.452 9.859 144 HG3 ARG 18 HG3 ARG 18 98.670 -1.940 9.237 145 HD2 ARG 18 HD2 ARG 18 97.529 -0.871 11.061 146 HD3 ARG 18 HD3 ARG 18 99.046 -0.646 11.966 147 HE ARG 18 HE ARG 18 98.923 0.699 9.307 148 HH11 ARG 18 HH11 ARG 18 99.118 2.945 9.431 149 HH12 ARG 18 HH12 ARG 18 99.001 3.749 10.981 150 HH21 ARG 18 HH21 ARG 18 98.509 0.798 12.762 151 HH22 ARG 18 HH22 ARG 18 98.658 2.538 12.859 152 H VAL 19 H VAL 19 101.572 -2.826 8.406 153 HA VAL 19 HA VAL 19 104.169 -2.908 9.884 154 HB VAL 19 HB VAL 19 103.920 -1.455 7.281 155 HG11 VAL 19 HG11 VAL 19 106.096 -1.835 8.411 156 HG12 VAL 19 HG12 VAL 19 105.807 -3.591 8.375 157 HG13 VAL 19 HG13 VAL 19 106.025 -2.694 6.853 158 HG21 VAL 19 HG21 VAL 19 104.014 -3.758 6.127 159 HG22 VAL 19 HG22 VAL 19 102.428 -3.242 6.746 160 HG23 VAL 19 HG23 VAL 19 103.396 -4.425 7.657 161 H GLU 20 H GLU 20 105.245 -1.095 10.629 162 HA GLU 20 HA GLU 20 103.961 1.581 10.212 163 HB2 GLU 20 HB2 GLU 20 104.163 0.100 12.834 164 HB3 GLU 20 HB3 GLU 20 104.348 1.870 12.824 165 HG2 GLU 20 HG2 GLU 20 102.008 0.395 11.540 166 HG3 GLU 20 HG3 GLU 20 101.968 1.085 13.180 167 H LYS 21 H LYS 21 105.663 2.733 9.444 168 HA LYS 21 HA LYS 21 107.861 3.588 9.281 169 HB2 LYS 21 HB2 LYS 21 107.325 4.240 11.661 170 HB3 LYS 21 HB3 LYS 21 108.082 2.722 12.198 171 HG2 LYS 21 HG2 LYS 21 110.218 3.437 11.666 172 HG3 LYS 21 HG3 LYS 21 109.656 4.468 10.329 173 HD2 LYS 21 HD3 LYS 21 110.403 5.944 12.089 174 HD3 LYS 21 HD2 LYS 21 108.624 6.000 12.086 175 HE2 LYS 21 HE2 LYS 21 109.156 5.736 14.375 176 HE3 LYS 21 HE3 LYS 21 108.785 4.077 13.847 177 HZ1 LYS 21 HZ1 LYS 21 110.833 4.175 15.102 178 HZ2 LYS 21 HZ2 LYS 21 111.143 3.716 13.549 179 HZ3 LYS 21 HZ3 LYS 21 111.486 5.253 14.038 180 H PHE 22 H PHE 22 108.507 1.023 11.706 181 HA PHE 22 HA PHE 22 109.499 -0.909 9.788 182 HB2 PHE 22 HB2 PHE 22 111.408 1.190 10.767 183 HB3 PHE 22 HB3 PHE 22 112.001 -0.487 10.707 184 HD1 PHE 22 HD1 PHE 22 111.787 2.456 8.861 185 HD2 PHE 22 HD2 PHE 22 111.145 -1.770 8.446 186 HE1 PHE 22 HE1 PHE 22 112.087 2.653 6.407 187 HE2 PHE 22 HE2 PHE 22 111.442 -1.575 5.992 188 HZ PHE 22 HZ PHE 22 111.913 0.636 4.971 189 H ASP 23 H ASP 23 107.951 -0.729 12.284 190 HA ASP 23 HA ASP 23 109.682 -2.561 13.962 191 HB2 ASP 23 HB3 ASP 23 109.149 -0.168 14.890 192 HB3 ASP 23 HB2 ASP 23 107.511 -0.814 15.150 193 H LEU 24 H LEU 24 106.991 -2.332 12.004 194 HA LEU 24 HA LEU 24 105.124 -3.755 11.722 195 HB2 LEU 24 HB3 LEU 24 107.106 -5.434 12.141 196 HB3 LEU 24 HB2 LEU 24 106.335 -5.668 13.728 197 HG LEU 24 HG LEU 24 104.131 -5.915 12.255 198 HD11 LEU 24 HD11 LEU 24 105.262 -5.350 10.122 199 HD12 LEU 24 HD12 LEU 24 104.625 -7.011 10.087 200 HD13 LEU 24 HD13 LEU 24 106.364 -6.730 10.341 201 HD21 LEU 24 HD21 LEU 24 105.111 -7.662 13.719 202 HD22 LEU 24 HD22 LEU 24 106.277 -8.079 12.440 203 HD23 LEU 24 HD23 LEU 24 104.538 -8.361 12.186 204 H VAL 25 H VAL 25 103.102 -4.167 12.724 205 HA VAL 25 HA VAL 25 102.927 -3.950 15.690 206 HB VAL 25 HB VAL 25 101.839 -1.834 13.790 207 HG11 VAL 25 HG11 VAL 25 100.029 -2.574 15.314 208 HG12 VAL 25 HG12 VAL 25 100.596 -0.942 15.741 209 HG13 VAL 25 HG13 VAL 25 101.110 -2.344 16.709 210 HG21 VAL 25 HG21 VAL 25 102.904 -0.390 15.667 211 HG22 VAL 25 HG22 VAL 25 103.695 -1.895 16.193 212 HG23 VAL 25 HG23 VAL 25 104.010 -1.246 14.566 213 HA PRO 26 HA PRO 26 99.935 -7.094 14.354 214 HB2 PRO 26 HB3 PRO 26 99.121 -6.637 17.223 215 HB3 PRO 26 HB2 PRO 26 99.386 -8.175 16.353 216 HG2 PRO 26 HG3 PRO 26 101.186 -7.181 18.078 217 HG3 PRO 26 HG2 PRO 26 101.677 -8.067 16.608 218 HD2 PRO 26 HD2 PRO 26 101.860 -5.137 17.214 219 HD3 PRO 26 HD3 PRO 26 102.846 -6.138 16.107 220 H VAL 27 H VAL 27 97.713 -7.048 13.825 221 HA VAL 27 HA VAL 27 96.500 -4.359 13.803 222 HB VAL 27 HB VAL 27 96.272 -6.181 11.996 223 HG11 VAL 27 HG11 VAL 27 94.720 -7.949 12.320 224 HG12 VAL 27 HG12 VAL 27 94.042 -7.199 13.785 225 HG13 VAL 27 HG13 VAL 27 95.667 -7.924 13.827 226 HG21 VAL 27 HG21 VAL 27 94.882 -4.128 12.057 227 HG22 VAL 27 HG22 VAL 27 93.741 -4.934 13.159 228 HG23 VAL 27 HG23 VAL 27 93.936 -5.525 11.491 229 HA PRO 28 HA PRO 28 94.552 -4.376 17.806 230 HB2 PRO 28 HB2 PRO 28 92.226 -3.307 16.201 231 HB3 PRO 28 HB3 PRO 28 92.943 -2.688 17.717 232 HG2 PRO 28 HG3 PRO 28 93.432 -1.577 15.301 233 HG3 PRO 28 HG2 PRO 28 94.623 -1.580 16.629 234 HD2 PRO 28 HD3 PRO 28 94.644 -3.092 14.072 235 HD3 PRO 28 HD2 PRO 28 95.999 -2.734 15.183 236 H THR 29 H THR 29 94.357 -6.717 17.951 237 HA THR 29 HA THR 29 92.445 -8.329 16.614 238 HB THR 29 HB THR 29 93.180 -8.581 19.562 239 HG1 THR 29 HG1 THR 29 94.961 -9.804 18.719 240 HG21 THR 29 HG21 THR 29 92.896 -10.999 19.098 241 HG22 THR 29 HG22 THR 29 92.464 -10.624 17.412 242 HG23 THR 29 HG23 THR 29 91.402 -10.100 18.741 243 H ASN 30 H ASN 30 91.980 -5.950 19.159 244 HA ASN 30 HA ASN 30 89.491 -6.764 20.242 245 HB2 ASN 30 HB2 ASN 30 90.492 -3.976 19.517 246 HB3 ASN 30 HB3 ASN 30 89.026 -4.279 20.480 247 HD21 ASN 30 HD21 ASN 30 92.046 -6.228 20.615 248 HD22 ASN 30 HD22 ASN 30 92.427 -5.805 22.269 249 H LEU 31 H LEU 31 90.135 -4.989 17.193 250 HA LEU 31 HA LEU 31 87.214 -5.152 16.541 251 HB2 LEU 31 HB3 LEU 31 89.467 -3.966 14.869 252 HB3 LEU 31 HB2 LEU 31 87.720 -3.665 14.707 253 HG LEU 31 HG LEU 31 89.530 -2.850 17.020 254 HD11 LEU 31 HD11 LEU 31 89.571 -1.382 15.021 255 HD12 LEU 31 HD12 LEU 31 87.796 -1.268 15.069 256 HD13 LEU 31 HD13 LEU 31 88.768 -0.576 16.389 257 HD21 LEU 31 HD21 LEU 31 87.212 -1.727 17.698 258 HD22 LEU 31 HD22 LEU 31 86.534 -3.082 16.765 259 HD23 LEU 31 HD23 LEU 31 87.578 -3.403 18.171 260 H TYR 32 H TYR 32 90.352 -6.021 15.004 261 HA TYR 32 HA TYR 32 90.854 -7.838 13.582 262 HB2 TYR 32 HB2 TYR 32 89.443 -9.018 15.479 263 HB3 TYR 32 HB3 TYR 32 88.185 -9.103 14.223 264 HD1 TYR 32 HD1 TYR 32 88.293 -10.747 12.530 265 HD2 TYR 32 HD2 TYR 32 91.776 -9.924 14.905 266 HE1 TYR 32 HE1 TYR 32 89.450 -12.686 11.504 267 HE2 TYR 32 HE2 TYR 32 92.933 -11.862 13.877 268 HH TYR 32 HH TYR 32 91.968 -13.351 11.108 269 H GLY 33 H GLY 33 90.744 -6.856 11.581 270 HA2 GLY 33 HA3 GLY 33 89.492 -7.376 9.402 271 HA3 GLY 33 HA2 GLY 33 88.018 -6.868 10.260 272 H ASP 34 H ASP 34 89.558 -4.697 11.691 273 HA ASP 34 HA ASP 34 89.041 -2.585 9.764 274 HB2 ASP 34 HB2 ASP 34 88.930 -2.113 12.148 275 HB3 ASP 34 HB3 ASP 34 90.623 -2.615 12.372 276 H PHE 35 H PHE 35 90.440 -1.482 8.384 277 HA PHE 35 HA PHE 35 93.353 -2.213 8.512 278 HB2 PHE 35 HB3 PHE 35 91.573 -2.537 6.057 279 HB3 PHE 35 HB2 PHE 35 93.351 -2.612 6.028 280 HD1 PHE 35 HD1 PHE 35 94.436 -4.271 7.771 281 HD2 PHE 35 HD2 PHE 35 90.371 -4.508 6.406 282 HE1 PHE 35 HE1 PHE 35 94.349 -6.657 8.445 283 HE2 PHE 35 HE2 PHE 35 90.283 -6.892 7.080 284 HZ PHE 35 HZ PHE 35 92.271 -7.968 8.100 285 H PHE 36 H PHE 36 94.705 -0.571 7.771 286 HA PHE 36 HA PHE 36 93.300 2.021 7.173 287 HB2 PHE 36 HB2 PHE 36 96.034 1.249 8.204 288 HB3 PHE 36 HB3 PHE 36 95.802 2.837 7.434 289 HD1 PHE 36 HD1 PHE 36 95.487 4.537 8.987 290 HD2 PHE 36 HD2 PHE 36 93.761 0.678 9.755 291 HE1 PHE 36 HE1 PHE 36 94.481 5.404 11.082 292 HE2 PHE 36 HE2 PHE 36 92.754 1.546 11.848 293 HZ PHE 36 HZ PHE 36 93.112 3.908 12.511 294 H THR 37 H THR 37 92.876 2.101 4.992 295 HA THR 37 HA THR 37 94.394 0.845 2.930 296 HB THR 37 HB THR 37 93.405 2.709 1.458 297 HG1 THR 37 HG1 THR 37 91.846 4.002 2.586 298 HG21 THR 37 HG21 THR 37 91.097 1.857 1.759 299 HG22 THR 37 HG22 THR 37 91.555 1.178 3.339 300 HG23 THR 37 HG23 THR 37 92.284 0.534 1.848 301 H GLY 38 H GLY 38 94.713 4.158 4.282 302 HA2 GLY 38 HA2 GLY 38 96.859 4.939 2.501 303 HA3 GLY 38 HA3 GLY 38 96.508 5.683 4.079 304 H ASP 39 H ASP 39 96.908 2.315 4.356 305 HA ASP 39 HA ASP 39 99.857 2.640 4.928 306 HB2 ASP 39 HB2 ASP 39 97.743 1.385 6.732 307 HB3 ASP 39 HB3 ASP 39 99.497 1.205 6.978 308 H ALA 40 H ALA 40 100.060 -0.074 5.971 309 HA ALA 40 HA ALA 40 99.056 -1.761 3.708 310 HB1 ALA 40 HB1 ALA 40 101.327 -2.635 3.231 311 HB2 ALA 40 HB2 ALA 40 102.015 -1.481 4.399 312 HB3 ALA 40 HB3 ALA 40 101.234 -0.885 2.915 313 H TYR 41 H TYR 41 98.764 -3.899 4.311 314 HA TYR 41 HA TYR 41 99.697 -4.601 7.108 315 HB2 TYR 41 HB2 TYR 41 97.059 -5.249 5.724 316 HB3 TYR 41 HB3 TYR 41 97.590 -5.996 7.249 317 HD1 TYR 41 HD1 TYR 41 97.243 -2.582 5.693 318 HD2 TYR 41 HD2 TYR 41 96.939 -4.985 9.241 319 HE1 TYR 41 HE1 TYR 41 96.395 -0.619 6.951 320 HE2 TYR 41 HE2 TYR 41 96.088 -3.023 10.497 321 HH TYR 41 HH TYR 41 94.776 -0.708 9.666 322 H VAL 42 H VAL 42 100.417 -6.740 7.410 323 HA VAL 42 HA VAL 42 100.778 -8.290 4.831 324 HB VAL 42 HB VAL 42 102.504 -8.691 7.283 325 HG11 VAL 42 HG11 VAL 42 102.666 -10.256 5.365 326 HG12 VAL 42 HG12 VAL 42 104.160 -9.304 5.542 327 HG13 VAL 42 HG13 VAL 42 102.983 -8.885 4.274 328 HG21 VAL 42 HG21 VAL 42 104.080 -7.003 6.053 329 HG22 VAL 42 HG22 VAL 42 102.764 -6.354 7.062 330 HG23 VAL 42 HG23 VAL 42 102.585 -6.408 5.291 331 H ILE 43 H ILE 43 99.454 -10.032 4.775 332 HA ILE 43 HA ILE 43 98.790 -11.344 7.421 333 HB ILE 43 HB ILE 43 97.132 -12.085 5.091 334 HG12 ILE 43 HG13 ILE 43 97.052 -9.220 6.128 335 HG13 ILE 43 HG12 ILE 43 97.677 -9.706 4.534 336 HG21 ILE 43 HG21 ILE 43 95.332 -11.415 6.779 337 HG22 ILE 43 HG22 ILE 43 96.440 -12.701 7.315 338 HG23 ILE 43 HG23 ILE 43 96.653 -11.038 7.911 339 HD11 ILE 43 HD11 ILE 43 95.324 -8.941 4.373 340 HD12 ILE 43 HD12 ILE 43 95.465 -10.667 3.960 341 HD13 ILE 43 HD13 ILE 43 94.839 -10.181 5.554 342 H LEU 44 H LEU 44 99.092 -13.555 7.620 343 HA LEU 44 HA LEU 44 100.415 -14.899 5.249 344 HB2 LEU 44 HB2 LEU 44 101.364 -14.475 7.967 345 HB3 LEU 44 HB3 LEU 44 101.219 -16.217 7.631 346 HG LEU 44 HG LEU 44 102.452 -15.750 5.428 347 HD11 LEU 44 HD11 LEU 44 102.362 -13.053 6.655 348 HD12 LEU 44 HD12 LEU 44 102.588 -13.525 4.954 349 HD13 LEU 44 HD13 LEU 44 103.972 -13.539 6.073 350 HD21 LEU 44 HD21 LEU 44 104.141 -15.010 7.833 351 HD22 LEU 44 HD22 LEU 44 104.552 -16.063 6.459 352 HD23 LEU 44 HD23 LEU 44 103.411 -16.629 7.703 353 H LYS 45 H LYS 45 99.817 -17.059 4.844 354 HA LYS 45 HA LYS 45 97.619 -18.115 6.641 355 HB2 LYS 45 HB3 LYS 45 97.101 -17.223 4.158 356 HB3 LYS 45 HB2 LYS 45 97.661 -18.858 3.734 357 HG2 LYS 45 HG2 LYS 45 96.034 -19.812 5.374 358 HG3 LYS 45 HG3 LYS 45 95.441 -18.167 5.711 359 HD2 LYS 45 HD2 LYS 45 93.922 -18.829 4.074 360 HD3 LYS 45 HD3 LYS 45 95.178 -18.083 3.058 361 HE2 LYS 45 HE2 LYS 45 94.631 -20.233 2.081 362 HE3 LYS 45 HE3 LYS 45 96.236 -20.381 2.837 363 HZ1 LYS 45 HZ1 LYS 45 94.808 -22.228 3.410 364 HZ2 LYS 45 HZ2 LYS 45 93.681 -21.213 4.058 365 HZ3 LYS 45 HZ3 LYS 45 95.167 -21.350 4.760 366 H THR 46 H THR 46 99.012 -19.493 7.776 367 HA THR 46 HA THR 46 100.888 -21.286 6.404 368 HB THR 46 HB THR 46 99.709 -21.431 9.216 369 HG1 THR 46 HG1 THR 46 100.969 -19.771 9.530 370 HG21 THR 46 HG21 THR 46 101.729 -22.784 9.699 371 HG22 THR 46 HG22 THR 46 100.731 -23.551 8.440 372 HG23 THR 46 HG23 THR 46 102.212 -22.673 7.989 373 H VAL 47 H VAL 47 100.033 -22.779 5.020 374 HA VAL 47 HA VAL 47 97.582 -24.283 5.940 375 HB VAL 47 HB VAL 47 98.583 -24.707 3.183 376 HG11 VAL 47 HG11 VAL 47 96.406 -25.550 4.024 377 HG12 VAL 47 HG12 VAL 47 95.892 -23.880 4.363 378 HG13 VAL 47 HG13 VAL 47 96.177 -24.401 2.685 379 HG21 VAL 47 HG21 VAL 47 97.596 -22.468 2.455 380 HG22 VAL 47 HG22 VAL 47 97.671 -21.973 4.163 381 HG23 VAL 47 HG23 VAL 47 99.167 -22.374 3.286 382 H GLN 48 H GLN 48 97.583 -26.636 5.343 383 HA GLN 48 HA GLN 48 100.385 -27.769 5.562 384 HB2 GLN 48 HB2 GLN 48 99.001 -27.994 7.661 385 HB3 GLN 48 HB3 GLN 48 97.824 -28.949 6.727 386 HG2 GLN 48 HG3 GLN 48 99.358 -30.718 6.375 387 HG3 GLN 48 HG2 GLN 48 100.764 -29.695 6.756 388 HE21 GLN 48 HE21 GLN 48 100.758 -32.004 8.174 389 HE22 GLN 48 HE22 GLN 48 100.203 -31.751 9.814 390 H LEU 49 H LEU 49 100.896 -29.393 4.126 391 HA LEU 49 HA LEU 49 99.097 -29.805 1.850 392 HB2 LEU 49 HB3 LEU 49 101.673 -31.203 2.696 393 HB3 LEU 49 HB2 LEU 49 100.846 -31.473 1.143 394 HG LEU 49 HG LEU 49 101.497 -28.650 1.985 395 HD11 LEU 49 HD11 LEU 49 103.600 -29.924 2.321 396 HD12 LEU 49 HD12 LEU 49 103.716 -28.860 0.898 397 HD13 LEU 49 HD13 LEU 49 103.447 -30.607 0.684 398 HD21 LEU 49 HD21 LEU 49 100.119 -29.099 -0.029 399 HD22 LEU 49 HD22 LEU 49 101.416 -30.126 -0.686 400 HD23 LEU 49 HD23 LEU 49 101.686 -28.379 -0.473 401 H ARG 50 H ARG 50 100.630 -32.700 2.978 402 HA ARG 50 HA ARG 50 98.020 -33.712 4.086 403 HB2 ARG 50 HB2 ARG 50 99.621 -35.304 2.051 404 HB3 ARG 50 HB3 ARG 50 97.973 -35.616 2.645 405 HG2 ARG 50 HG2 ARG 50 97.149 -33.593 1.539 406 HG3 ARG 50 HG3 ARG 50 98.800 -33.163 1.032 407 HD2 ARG 50 HD3 ARG 50 97.103 -34.498 -0.586 408 HD3 ARG 50 HD2 ARG 50 98.860 -34.776 -0.620 409 HE ARG 50 HE ARG 50 97.310 -36.485 1.274 410 HH11 ARG 50 HH11 ARG 50 97.495 -38.693 0.831 411 HH12 ARG 50 HH12 ARG 50 98.210 -39.227 -0.674 412 HH21 ARG 50 HH21 ARG 50 98.812 -36.001 -1.833 413 HH22 ARG 50 HH22 ARG 50 98.951 -37.711 -2.173 414 H ASN 51 H ASN 51 101.518 -34.083 3.624 415 HA ASN 51 HA ASN 51 101.842 -35.077 6.346 416 HB2 ASN 51 HB3 ASN 51 100.898 -37.126 5.187 417 HB3 ASN 51 HB2 ASN 51 102.335 -37.119 4.136 418 HD21 ASN 51 HD21 ASN 51 103.629 -35.895 6.861 419 HD22 ASN 51 HD22 ASN 51 104.072 -37.366 7.696 420 H GLY 52 H GLY 52 102.939 -33.025 4.605 421 HA2 GLY 52 HA2 GLY 52 105.818 -33.967 4.587 422 HA3 GLY 52 HA3 GLY 52 105.165 -32.940 3.288 423 H ASN 53 H ASN 53 104.346 -30.772 3.931 424 HA ASN 53 HA ASN 53 105.258 -29.792 6.597 425 HB2 ASN 53 HB2 ASN 53 107.192 -29.704 4.809 426 HB3 ASN 53 HB3 ASN 53 106.277 -28.325 4.157 427 HD21 ASN 53 HD21 ASN 53 106.619 -26.324 5.155 428 HD22 ASN 53 HD22 ASN 53 107.394 -26.123 6.710 429 H LEU 54 H LEU 54 105.100 -27.052 6.068 430 HA LEU 54 HA LEU 54 102.323 -26.754 4.902 431 HB2 LEU 54 HB3 LEU 54 102.227 -24.885 6.827 432 HB3 LEU 54 HB2 LEU 54 101.763 -26.573 7.147 433 HG LEU 54 HG LEU 54 104.662 -25.830 7.441 434 HD11 LEU 54 HD11 LEU 54 104.119 -25.214 9.868 435 HD12 LEU 54 HD12 LEU 54 103.685 -23.996 8.645 436 HD13 LEU 54 HD13 LEU 54 102.426 -25.039 9.348 437 HD21 LEU 54 HD21 LEU 54 103.867 -28.162 7.728 438 HD22 LEU 54 HD22 LEU 54 104.496 -27.506 9.259 439 HD23 LEU 54 HD23 LEU 54 102.739 -27.621 8.995 440 H GLN 55 H GLN 55 101.846 -24.409 4.367 441 HA GLN 55 HA GLN 55 104.386 -22.883 3.787 442 HB2 GLN 55 HB2 GLN 55 103.796 -22.516 1.529 443 HB3 GLN 55 HB3 GLN 55 103.385 -24.228 1.782 444 HG2 GLN 55 HG3 GLN 55 101.025 -23.280 2.470 445 HG3 GLN 55 HG2 GLN 55 101.549 -21.833 1.575 446 HE21 GLN 55 HE21 GLN 55 103.238 -23.524 -0.309 447 HE22 GLN 55 HE22 GLN 55 102.077 -24.272 -1.383 448 H TYR 56 H TYR 56 104.166 -20.634 3.895 449 HA TYR 56 HA TYR 56 101.564 -19.704 5.107 450 HB2 TYR 56 HB3 TYR 56 104.151 -18.118 4.912 451 HB3 TYR 56 HB2 TYR 56 102.799 -17.891 6.046 452 HD1 TYR 56 HD1 TYR 56 102.944 -18.811 8.180 453 HD2 TYR 56 HD2 TYR 56 105.342 -20.472 5.029 454 HE1 TYR 56 HE1 TYR 56 104.055 -20.305 9.816 455 HE2 TYR 56 HE2 TYR 56 106.454 -21.970 6.665 456 HH TYR 56 HH TYR 56 106.887 -21.888 9.264 457 H ASP 57 H ASP 57 100.170 -18.717 3.715 458 HA ASP 57 HA ASP 57 101.137 -17.785 1.080 459 HB2 ASP 57 HB2 ASP 57 98.424 -17.260 2.365 460 HB3 ASP 57 HB3 ASP 57 98.826 -17.236 0.631 461 H LEU 58 H LEU 58 102.070 -15.820 0.780 462 HA LEU 58 HA LEU 58 101.677 -13.779 2.947 463 HB2 LEU 58 HB3 LEU 58 103.723 -14.197 0.760 464 HB3 LEU 58 HB2 LEU 58 103.544 -12.604 1.533 465 HG LEU 58 HG LEU 58 103.555 -14.672 3.568 466 HD11 LEU 58 HD11 LEU 58 104.842 -15.908 1.761 467 HD12 LEU 58 HD12 LEU 58 105.764 -15.609 3.254 468 HD13 LEU 58 HD13 LEU 58 106.046 -14.598 1.816 469 HD21 LEU 58 HD21 LEU 58 105.545 -13.324 4.332 470 HD22 LEU 58 HD22 LEU 58 105.442 -12.397 2.817 471 HD23 LEU 58 HD23 LEU 58 104.106 -12.335 3.991 472 H HIS 59 H HIS 59 100.273 -12.177 2.665 473 HA HIS 59 HA HIS 59 99.822 -11.156 -0.133 474 HB2 HIS 59 HB3 HIS 59 97.321 -10.935 1.134 475 HB3 HIS 59 HB2 HIS 59 97.753 -12.077 -0.160 476 HD2 HIS 59 HD2 HIS 59 99.107 -14.532 1.144 477 HE1 HIS 59 HE1 HIS 59 96.468 -14.252 4.427 478 H TYR 60 H TYR 60 100.531 -9.070 0.031 479 HA TYR 60 HA TYR 60 100.178 -7.657 2.639 480 HB2 TYR 60 HB3 TYR 60 101.153 -5.876 0.615 481 HB3 TYR 60 HB2 TYR 60 102.047 -6.582 1.981 482 HD1 TYR 60 HD1 TYR 60 102.326 -9.360 1.456 483 HD2 TYR 60 HD2 TYR 60 102.320 -6.123 -1.367 484 HE1 TYR 60 HE1 TYR 60 103.655 -10.734 -0.124 485 HE2 TYR 60 HE2 TYR 60 103.646 -7.498 -2.947 486 HH TYR 60 HH TYR 60 103.922 -10.664 -2.880 487 H TRP 61 H TRP 61 98.544 -6.248 3.042 488 HA TRP 61 HA TRP 61 96.598 -5.780 0.815 489 HB2 TRP 61 HB3 TRP 61 95.993 -6.505 3.247 490 HB3 TRP 61 HB2 TRP 61 96.288 -4.799 3.665 491 HD1 TRP 61 HD1 TRP 61 94.263 -6.792 1.017 492 HE1 TRP 61 HE1 TRP 61 92.040 -5.559 0.574 493 HE3 TRP 61 HE3 TRP 61 94.952 -2.752 4.063 494 HZ2 TRP 61 HZ2 TRP 61 90.749 -3.132 1.439 495 HZ3 TRP 61 HZ3 TRP 61 93.214 -0.995 4.234 496 HH2 TRP 61 HH2 TRP 61 91.115 -1.179 2.926 497 H LEU 62 H LEU 62 97.030 -4.056 -0.448 498 HA LEU 62 HA LEU 62 98.049 -1.559 0.927 499 HB2 LEU 62 HB3 LEU 62 98.300 -1.880 -2.044 500 HB3 LEU 62 HB2 LEU 62 99.415 -1.121 -0.884 501 HG LEU 62 HG LEU 62 98.949 -4.129 -1.101 502 HD11 LEU 62 HD11 LEU 62 100.208 -3.934 -2.988 503 HD12 LEU 62 HD12 LEU 62 100.674 -2.259 -2.609 504 HD13 LEU 62 HD13 LEU 62 101.559 -3.617 -1.873 505 HD21 LEU 62 HD21 LEU 62 99.703 -3.326 1.125 506 HD22 LEU 62 HD22 LEU 62 101.057 -2.466 0.355 507 HD23 LEU 62 HD23 LEU 62 100.989 -4.244 0.306 508 H GLY 63 H GLY 63 96.227 -0.338 1.277 509 HA2 GLY 63 HA2 GLY 63 93.875 -0.458 -0.429 510 HA3 GLY 63 HA3 GLY 63 94.216 0.809 0.774 511 H ASN 64 H ASN 64 96.737 0.319 -1.487 512 HA ASN 64 HA ASN 64 97.500 1.646 -3.284 513 HB2 ASN 64 HB2 ASN 64 95.144 0.891 -4.134 514 HB3 ASN 64 HB3 ASN 64 94.653 2.560 -3.756 515 HD21 ASN 64 HD21 ASN 64 94.359 2.540 -6.268 516 HD22 ASN 64 HD22 ASN 64 95.766 2.977 -7.211 517 H GLU 65 H GLU 65 96.183 2.844 -0.501 518 HA GLU 65 HA GLU 65 96.511 5.717 -1.366 519 HB2 GLU 65 HB2 GLU 65 95.198 4.380 1.025 520 HB3 GLU 65 HB3 GLU 65 95.584 6.118 1.023 521 HG2 GLU 65 HG2 GLU 65 94.280 6.368 -1.102 522 HG3 GLU 65 HG3 GLU 65 93.831 4.649 -0.999 523 H CYS 66 H CYS 66 98.409 3.272 -0.323 524 HA CYS 66 HA CYS 66 99.931 4.981 1.643 525 HB2 CYS 66 HB3 CYS 66 99.314 2.617 2.279 526 HB3 CYS 66 HB2 CYS 66 100.330 2.042 0.936 527 HG CYS 66 HG CYS 66 101.794 1.864 3.429 528 H SER 67 H SER 67 101.662 6.075 0.871 529 HA SER 67 HA SER 67 102.575 6.134 -1.766 530 HB2 SER 67 HB3 SER 67 104.291 6.335 0.749 531 HB3 SER 67 HB2 SER 67 104.769 6.902 -0.869 532 HG SER 67 HG SER 67 103.842 8.588 0.427 533 H GLN 68 H GLN 68 103.508 4.678 -3.111 534 HA GLN 68 HA GLN 68 103.976 1.971 -2.457 535 HB2 GLN 68 HB2 GLN 68 103.924 2.824 -4.776 536 HB3 GLN 68 HB3 GLN 68 105.468 3.668 -4.507 537 HG2 GLN 68 HG3 GLN 68 106.688 1.657 -4.371 538 HG3 GLN 68 HG2 GLN 68 105.239 0.692 -4.000 539 HE21 GLN 68 HE21 GLN 68 107.362 1.632 -6.524 540 HE22 GLN 68 HE22 GLN 68 106.355 1.142 -7.868 541 H ASP 69 H ASP 69 105.702 4.660 -1.324 542 HA ASP 69 HA ASP 69 108.375 3.505 -1.202 543 HB2 ASP 69 HB2 ASP 69 107.533 5.976 -0.804 544 HB3 ASP 69 HB3 ASP 69 107.331 5.432 0.878 545 H GLU 70 H GLU 70 105.615 3.572 1.089 546 HA GLU 70 HA GLU 70 107.156 1.875 2.999 547 HB2 GLU 70 HB3 GLU 70 104.203 2.514 3.211 548 HB3 GLU 70 HB2 GLU 70 105.385 2.243 4.514 549 HG2 GLU 70 HG2 GLU 70 105.268 4.642 2.633 550 HG3 GLU 70 HG3 GLU 70 104.881 4.635 4.371 551 H SER 71 H SER 71 104.545 1.589 0.620 552 HA SER 71 HA SER 71 103.589 -1.014 1.345 553 HB2 SER 71 HB2 SER 71 102.734 0.651 -0.466 554 HB3 SER 71 HB3 SER 71 103.934 -0.118 -1.533 555 HG SER 71 HG SER 71 101.523 -1.073 -0.657 556 H GLY 72 H GLY 72 106.072 -0.165 -1.130 557 HA2 GLY 72 HA2 GLY 72 106.876 -2.843 -1.697 558 HA3 GLY 72 HA3 GLY 72 107.939 -1.424 -1.851 559 H ALA 73 H ALA 73 108.022 -0.593 0.846 560 HA ALA 73 HA ALA 73 110.141 -2.138 1.907 561 HB1 ALA 73 HB1 ALA 73 109.617 -1.079 4.089 562 HB2 ALA 73 HB2 ALA 73 108.020 -0.595 3.471 563 HB3 ALA 73 HB3 ALA 73 109.497 0.102 2.763 564 H ALA 74 H ALA 74 106.636 -2.397 2.678 565 HA ALA 74 HA ALA 74 106.929 -4.590 4.527 566 HB1 ALA 74 HB1 ALA 74 104.530 -5.022 4.072 567 HB2 ALA 74 HB2 ALA 74 104.606 -3.953 2.651 568 HB3 ALA 74 HB3 ALA 74 104.835 -3.281 4.283 569 H ALA 75 H ALA 75 106.487 -4.494 0.985 570 HA ALA 75 HA ALA 75 106.254 -7.357 0.638 571 HB1 ALA 75 HB1 ALA 75 106.906 -6.904 -1.712 572 HB2 ALA 75 HB2 ALA 75 107.423 -5.264 -1.252 573 HB3 ALA 75 HB3 ALA 75 105.706 -5.718 -1.143 574 H ILE 76 H ILE 76 108.942 -5.297 1.412 575 HA ILE 76 HA ILE 76 110.978 -7.229 0.450 576 HB ILE 76 HB ILE 76 111.215 -4.770 2.239 577 HG12 ILE 76 HG12 ILE 76 110.393 -4.658 -0.283 578 HG13 ILE 76 HG13 ILE 76 111.614 -3.512 0.316 579 HG21 ILE 76 HG21 ILE 76 113.155 -6.063 2.643 580 HG22 ILE 76 HG22 ILE 76 113.225 -6.645 0.962 581 HG23 ILE 76 HG23 ILE 76 113.651 -4.958 1.338 582 HD11 ILE 76 HD11 ILE 76 112.088 -4.743 -1.934 583 HD12 ILE 76 HD12 ILE 76 113.393 -4.680 -0.725 584 HD13 ILE 76 HD13 ILE 76 112.426 -6.163 -0.916 585 H PHE 77 H PHE 77 110.048 -5.954 3.704 586 HA PHE 77 HA PHE 77 111.596 -7.919 5.142 587 HB2 PHE 77 HB3 PHE 77 109.320 -6.068 5.785 588 HB3 PHE 77 HB2 PHE 77 109.646 -7.397 6.923 589 HD1 PHE 77 HD1 PHE 77 110.810 -6.521 8.753 590 HD2 PHE 77 HD2 PHE 77 111.928 -5.310 4.788 591 HE1 PHE 77 HE1 PHE 77 112.731 -5.257 9.682 592 HE2 PHE 77 HE2 PHE 77 113.850 -4.045 5.715 593 HZ PHE 77 HZ PHE 77 114.251 -4.019 8.163 594 H THR 78 H THR 78 108.337 -7.990 3.756 595 HA THR 78 HA THR 78 107.603 -10.500 5.092 596 HB THR 78 HB THR 78 106.128 -8.602 3.930 597 HG1 THR 78 HG1 THR 78 104.804 -10.808 3.357 598 HG21 THR 78 HG21 THR 78 105.362 -9.274 1.696 599 HG22 THR 78 HG22 THR 78 107.119 -8.992 1.674 600 HG23 THR 78 HG23 THR 78 106.485 -10.655 1.704 601 H VAL 79 H VAL 79 108.821 -9.610 1.841 602 HA VAL 79 HA VAL 79 108.790 -12.364 0.868 603 HB VAL 79 HB VAL 79 110.244 -9.847 -0.031 604 HG11 VAL 79 HG11 VAL 79 111.594 -11.839 -0.628 605 HG12 VAL 79 HG12 VAL 79 110.157 -12.594 -1.358 606 HG13 VAL 79 HG13 VAL 79 110.847 -11.117 -2.073 607 HG21 VAL 79 HG21 VAL 79 108.133 -11.413 -1.532 608 HG22 VAL 79 HG22 VAL 79 108.552 -9.688 -1.657 609 HG23 VAL 79 HG23 VAL 79 107.655 -10.286 -0.241 610 H GLN 80 H GLN 80 111.468 -10.231 2.010 611 HA GLN 80 HA GLN 80 113.491 -12.277 1.847 612 HB2 GLN 80 HB3 GLN 80 113.187 -9.736 3.471 613 HB3 GLN 80 HB2 GLN 80 114.581 -10.813 3.726 614 HG2 GLN 80 HG2 GLN 80 113.774 -9.828 0.964 615 HG3 GLN 80 HG3 GLN 80 114.895 -8.920 2.006 616 HE21 GLN 80 HE21 GLN 80 117.041 -9.743 2.303 617 HE22 GLN 80 HE22 GLN 80 117.629 -11.147 1.441 618 H LEU 81 H LEU 81 111.775 -11.086 4.806 619 HA LEU 81 HA LEU 81 112.759 -13.125 6.536 620 HB2 LEU 81 HB2 LEU 81 111.244 -11.061 7.060 621 HB3 LEU 81 HB3 LEU 81 109.889 -12.151 6.686 622 HG LEU 81 HG LEU 81 110.397 -12.140 9.116 623 HD11 LEU 81 HD11 LEU 81 110.248 -14.467 9.412 624 HD12 LEU 81 HD12 LEU 81 111.359 -14.808 8.065 625 HD13 LEU 81 HD13 LEU 81 109.699 -14.259 7.732 626 HD21 LEU 81 HD21 LEU 81 112.496 -12.577 10.007 627 HD22 LEU 81 HD22 LEU 81 112.977 -11.790 8.485 628 HD23 LEU 81 HD23 LEU 81 112.999 -13.565 8.615 629 H ASP 82 H ASP 82 109.782 -13.130 4.511 630 HA ASP 82 HA ASP 82 108.762 -15.652 5.175 631 HB2 ASP 82 HB2 ASP 82 107.588 -14.392 3.524 632 HB3 ASP 82 HB3 ASP 82 109.023 -14.277 2.477 633 H ASP 83 H ASP 83 111.455 -14.955 2.894 634 HA ASP 83 HA ASP 83 111.951 -17.739 2.277 635 HB2 ASP 83 HB3 ASP 83 113.705 -15.256 2.271 636 HB3 ASP 83 HB2 ASP 83 114.352 -16.857 1.842 637 H TYR 84 H TYR 84 112.847 -15.622 4.950 638 HA TYR 84 HA TYR 84 114.711 -17.576 6.133 639 HB2 TYR 84 HB3 TYR 84 115.033 -15.243 6.681 640 HB3 TYR 84 HB2 TYR 84 113.343 -15.080 7.216 641 HD1 TYR 84 HD1 TYR 84 112.567 -16.422 9.231 642 HD2 TYR 84 HD2 TYR 84 116.710 -16.028 8.165 643 HE1 TYR 84 HE1 TYR 84 113.222 -17.123 11.518 644 HE2 TYR 84 HE2 TYR 84 117.365 -16.729 10.453 645 HH TYR 84 HH TYR 84 116.234 -18.157 12.356 646 H LEU 85 H LEU 85 111.265 -17.005 6.120 647 HA LEU 85 HA LEU 85 110.812 -18.586 8.587 648 HB2 LEU 85 HB2 LEU 85 109.347 -16.669 7.305 649 HB3 LEU 85 HB3 LEU 85 108.569 -18.140 6.674 650 HG LEU 85 HG LEU 85 108.464 -18.951 9.112 651 HD11 LEU 85 HD11 LEU 85 110.064 -16.701 9.541 652 HD12 LEU 85 HD12 LEU 85 109.215 -17.629 10.801 653 HD13 LEU 85 HD13 LEU 85 108.458 -16.177 10.104 654 HD21 LEU 85 HD21 LEU 85 106.434 -17.599 9.578 655 HD22 LEU 85 HD22 LEU 85 106.496 -18.094 7.870 656 HD23 LEU 85 HD23 LEU 85 106.928 -16.429 8.331 657 H ASN 86 H ASN 86 110.150 -19.033 5.071 658 HA ASN 86 HA ASN 86 110.142 -22.009 5.649 659 HB2 ASN 86 HB3 ASN 86 107.918 -20.805 4.933 660 HB3 ASN 86 HB2 ASN 86 108.662 -20.776 3.316 661 HD21 ASN 86 HD21 ASN 86 106.977 -22.335 2.584 662 HD22 ASN 86 HD22 ASN 86 107.128 -24.025 3.010 663 H GLY 87 H GLY 87 110.855 -19.454 3.256 664 HA2 GLY 87 HA2 GLY 87 113.122 -19.623 2.154 665 HA3 GLY 87 HA3 GLY 87 112.846 -21.378 2.024 666 H ARG 88 H ARG 88 109.872 -20.517 1.488 667 HA ARG 88 HA ARG 88 110.209 -19.480 -1.308 668 HB2 ARG 88 HB2 ARG 88 109.004 -22.167 -0.541 669 HB3 ARG 88 HB3 ARG 88 108.629 -21.355 -2.080 670 HG2 ARG 88 HG2 ARG 88 110.957 -21.387 -2.747 671 HG3 ARG 88 HG3 ARG 88 111.466 -21.950 -1.138 672 HD2 ARG 88 HD2 ARG 88 111.439 -23.858 -2.658 673 HD3 ARG 88 HD3 ARG 88 110.098 -24.034 -1.501 674 HE ARG 88 HE ARG 88 109.844 -23.407 -4.416 675 HH11 ARG 88 HH11 ARG 88 107.728 -23.621 -5.174 676 HH12 ARG 88 HH12 ARG 88 106.408 -23.816 -4.043 677 HH21 ARG 88 HH21 ARG 88 108.459 -23.705 -1.233 678 HH22 ARG 88 HH22 ARG 88 106.820 -23.863 -1.823 679 H ALA 89 H ALA 89 107.416 -21.192 0.071 680 HA ALA 89 HA ALA 89 105.243 -20.384 0.533 681 HB1 ALA 89 HB1 ALA 89 105.329 -18.948 2.281 682 HB2 ALA 89 HB2 ALA 89 105.955 -17.643 1.245 683 HB3 ALA 89 HB3 ALA 89 107.080 -18.806 1.989 684 H VAL 90 H VAL 90 103.561 -18.938 -0.292 685 HA VAL 90 HA VAL 90 104.325 -17.858 -2.981 686 HB VAL 90 HB VAL 90 101.563 -18.014 -1.700 687 HG11 VAL 90 HG11 VAL 90 101.782 -16.534 -3.677 688 HG12 VAL 90 HG12 VAL 90 100.822 -17.982 -4.065 689 HG13 VAL 90 HG13 VAL 90 102.517 -17.870 -4.595 690 HG21 VAL 90 HG21 VAL 90 101.318 -20.152 -2.935 691 HG22 VAL 90 HG22 VAL 90 102.632 -20.252 -1.738 692 HG23 VAL 90 HG23 VAL 90 103.014 -20.040 -3.464 693 H GLN 91 H GLN 91 103.868 -15.660 -3.600 694 HA GLN 91 HA GLN 91 103.229 -13.829 -1.284 695 HB2 GLN 91 HB3 GLN 91 105.000 -12.270 -2.501 696 HB3 GLN 91 HB2 GLN 91 105.536 -13.505 -1.337 697 HG2 GLN 91 HG2 GLN 91 105.233 -14.314 -4.218 698 HG3 GLN 91 HG3 GLN 91 106.638 -13.316 -3.772 699 HE21 GLN 91 HE21 GLN 91 105.463 -15.272 -1.161 700 HE22 GLN 91 HE22 GLN 91 106.663 -16.539 -1.286 701 H HIS 92 H HIS 92 101.564 -12.534 -1.812 702 HA HIS 92 HA HIS 92 101.355 -11.616 -4.674 703 HB2 HIS 92 HB3 HIS 92 98.727 -11.841 -4.085 704 HB3 HIS 92 HB2 HIS 92 99.653 -13.152 -4.851 705 HD2 HIS 92 HD2 HIS 92 101.015 -14.675 -2.382 706 HE1 HIS 92 HE1 HIS 92 97.248 -14.551 -0.478 707 H ARG 93 H ARG 93 99.997 -9.643 -4.884 708 HA ARG 93 HA ARG 93 99.975 -8.087 -2.283 709 HB2 ARG 93 HB2 ARG 93 100.711 -6.144 -3.448 710 HB3 ARG 93 HB3 ARG 93 101.735 -7.459 -4.073 711 HG2 ARG 93 HG3 ARG 93 99.756 -7.679 -5.856 712 HG3 ARG 93 HG2 ARG 93 99.485 -5.975 -5.417 713 HD2 ARG 93 HD2 ARG 93 101.023 -5.973 -7.276 714 HD3 ARG 93 HD3 ARG 93 101.980 -5.596 -5.822 715 HE ARG 93 HE ARG 93 102.137 -8.396 -6.055 716 HH11 ARG 93 HH11 ARG 93 103.816 -9.379 -7.209 717 HH12 ARG 93 HH12 ARG 93 104.650 -8.490 -8.464 718 HH21 ARG 93 HH21 ARG 93 102.755 -5.600 -8.038 719 HH22 ARG 93 HH22 ARG 93 104.053 -6.362 -8.931 720 H GLU 94 H GLU 94 98.183 -6.765 -1.897 721 HA GLU 94 HA GLU 94 95.919 -7.106 -3.881 722 HB2 GLU 94 HB3 GLU 94 95.416 -6.362 -1.011 723 HB3 GLU 94 HB2 GLU 94 94.424 -7.338 -2.121 724 HG2 GLU 94 HG2 GLU 94 96.969 -8.166 -0.668 725 HG3 GLU 94 HG3 GLU 94 95.344 -8.878 -0.518 726 H VAL 95 H VAL 95 96.612 -5.189 -5.038 727 HA VAL 95 HA VAL 95 96.910 -2.630 -3.643 728 HB VAL 95 HB VAL 95 96.142 -2.894 -6.560 729 HG11 VAL 95 HG11 VAL 95 96.455 -0.645 -5.566 730 HG12 VAL 95 HG12 VAL 95 97.729 -1.001 -6.756 731 HG13 VAL 95 HG13 VAL 95 98.081 -1.115 -5.015 732 HG21 VAL 95 HG21 VAL 95 98.739 -3.129 -6.849 733 HG22 VAL 95 HG22 VAL 95 98.699 -3.759 -5.184 734 HG23 VAL 95 HG23 VAL 95 97.786 -4.584 -6.471 735 H GLN 96 H GLN 96 94.480 -3.987 -2.883 736 HA GLN 96 HA GLN 96 92.192 -3.477 -2.583 737 HB2 GLN 96 HB3 GLN 96 93.584 -1.055 -2.554 738 HB3 GLN 96 HB2 GLN 96 92.288 -0.769 -3.739 739 HG2 GLN 96 HG2 GLN 96 90.663 -1.738 -2.023 740 HG3 GLN 96 HG3 GLN 96 91.999 -1.682 -0.847 741 HE21 GLN 96 HE21 GLN 96 89.342 0.070 -1.863 742 HE22 GLN 96 HE22 GLN 96 89.899 1.679 -1.458 743 H GLY 97 H GLY 97 90.706 -4.385 -3.908 744 HA2 GLY 97 HA2 GLY 97 89.172 -4.133 -5.817 745 HA3 GLY 97 HA3 GLY 97 90.447 -3.251 -6.691 746 H PHE 98 H PHE 98 92.589 -5.105 -6.024 747 HA PHE 98 HA PHE 98 91.696 -7.434 -7.742 748 HB2 PHE 98 HB2 PHE 98 94.270 -5.857 -7.567 749 HB3 PHE 98 HB3 PHE 98 94.305 -7.546 -8.126 750 HD1 PHE 98 HD1 PHE 98 94.121 -7.871 -10.419 751 HD2 PHE 98 HD2 PHE 98 92.198 -4.464 -8.645 752 HE1 PHE 98 HE1 PHE 98 93.341 -7.145 -12.658 753 HE2 PHE 98 HE2 PHE 98 91.419 -3.738 -10.886 754 HZ PHE 98 HZ PHE 98 91.989 -5.079 -12.890 755 H GLU 99 H GLU 99 91.226 -7.561 -4.983 756 HA GLU 99 HA GLU 99 93.472 -8.798 -3.576 757 HB2 GLU 99 HB2 GLU 99 90.567 -9.323 -2.907 758 HB3 GLU 99 HB3 GLU 99 91.954 -9.137 -1.808 759 HG2 GLU 99 HG2 GLU 99 92.117 -6.719 -2.604 760 HG3 GLU 99 HG3 GLU 99 90.557 -6.966 -3.424 761 H SER 100 H SER 100 92.937 -11.149 -2.593 762 HA SER 100 HA SER 100 92.566 -12.887 -5.027 763 HB2 SER 100 HB2 SER 100 93.902 -13.316 -2.329 764 HB3 SER 100 HB3 SER 100 93.579 -14.655 -3.456 765 HG SER 100 HG SER 100 95.678 -13.719 -3.765 766 H ALA 101 H ALA 101 91.342 -14.929 -4.735 767 HA ALA 101 HA ALA 101 88.773 -14.425 -3.467 768 HB1 ALA 101 HB1 ALA 101 88.279 -16.782 -4.065 769 HB2 ALA 101 HB2 ALA 101 90.000 -17.048 -4.432 770 HB3 ALA 101 HB3 ALA 101 89.042 -15.924 -5.425 771 H THR 102 H THR 102 91.784 -15.782 -2.343 772 HA THR 102 HA THR 102 90.634 -17.321 -0.132 773 HB THR 102 HB THR 102 93.414 -16.092 -0.200 774 HG1 THR 102 HG1 THR 102 93.978 -18.004 -1.382 775 HG21 THR 102 HG21 THR 102 93.980 -18.169 1.028 776 HG22 THR 102 HG22 THR 102 92.284 -18.698 0.914 777 HG23 THR 102 HG23 THR 102 92.704 -17.255 1.869 778 H PHE 103 H PHE 103 92.285 -14.132 -0.295 779 HA PHE 103 HA PHE 103 91.811 -13.455 2.467 780 HB2 PHE 103 HB2 PHE 103 93.411 -12.164 1.222 781 HB3 PHE 103 HB3 PHE 103 92.209 -11.755 -0.026 782 HD1 PHE 103 HD1 PHE 103 90.669 -9.949 0.280 783 HD2 PHE 103 HD2 PHE 103 93.168 -11.222 3.533 784 HE1 PHE 103 HE1 PHE 103 90.017 -7.933 1.571 785 HE2 PHE 103 HE2 PHE 103 92.515 -9.206 4.824 786 HZ PHE 103 HZ PHE 103 90.938 -7.564 3.843 787 H LEU 104 H LEU 104 89.838 -13.006 -0.472 788 HA LEU 104 HA LEU 104 87.806 -11.398 0.897 789 HB2 LEU 104 HB3 LEU 104 88.008 -12.860 -1.738 790 HB3 LEU 104 HB2 LEU 104 86.414 -12.302 -1.174 791 HG LEU 104 HG LEU 104 88.754 -10.398 -1.087 792 HD11 LEU 104 HD11 LEU 104 88.796 -11.371 -3.368 793 HD12 LEU 104 HD12 LEU 104 87.060 -11.020 -3.549 794 HD13 LEU 104 HD13 LEU 104 88.228 -9.685 -3.403 795 HD21 LEU 104 HD21 LEU 104 86.574 -9.790 -0.071 796 HD22 LEU 104 HD22 LEU 104 86.932 -8.762 -1.479 797 HD23 LEU 104 HD23 LEU 104 85.764 -10.098 -1.626 798 H GLY 105 H GLY 105 88.426 -14.844 0.500 799 HA2 GLY 105 HA2 GLY 105 85.702 -15.561 1.460 800 HA3 GLY 105 HA3 GLY 105 87.017 -16.698 1.080 801 H TYR 106 H TYR 106 88.910 -15.015 2.771 802 HA TYR 106 HA TYR 106 88.155 -16.332 5.349 803 HB2 TYR 106 HB2 TYR 106 90.508 -16.387 4.221 804 HB3 TYR 106 HB3 TYR 106 90.679 -14.728 4.845 805 HD1 TYR 106 HD1 TYR 106 90.487 -14.305 7.310 806 HD2 TYR 106 HD2 TYR 106 90.617 -18.279 5.682 807 HE1 TYR 106 HE1 TYR 106 91.041 -15.206 9.554 808 HE2 TYR 106 HE2 TYR 106 91.170 -19.179 7.925 809 HH TYR 106 HH TYR 106 92.298 -18.201 10.096 810 H PHE 107 H PHE 107 87.965 -13.248 3.842 811 HA PHE 107 HA PHE 107 87.338 -12.048 6.543 812 HB2 PHE 107 HB3 PHE 107 89.188 -11.003 4.390 813 HB3 PHE 107 HB2 PHE 107 88.313 -9.864 5.442 814 HD1 PHE 107 HD1 PHE 107 88.343 -10.618 8.045 815 HD2 PHE 107 HD2 PHE 107 91.294 -11.669 5.105 816 HE1 PHE 107 HE1 PHE 107 89.999 -11.015 9.848 817 HE2 PHE 107 HE2 PHE 107 92.949 -12.064 6.909 818 HZ PHE 107 HZ PHE 107 92.300 -11.740 9.280 819 H LYS 108 H LYS 108 85.095 -12.190 6.140 820 HA LYS 108 HA LYS 108 83.980 -11.168 3.603 821 HB2 LYS 108 HB3 LYS 108 82.907 -12.971 5.024 822 HB3 LYS 108 HB2 LYS 108 82.540 -11.719 6.234 823 HG2 LYS 108 HG2 LYS 108 81.416 -10.428 4.291 824 HG3 LYS 108 HG3 LYS 108 81.497 -11.962 3.391 825 HD2 LYS 108 HD2 LYS 108 80.388 -13.014 5.501 826 HD3 LYS 108 HD3 LYS 108 79.984 -11.339 5.947 827 HE2 LYS 108 HE2 LYS 108 78.953 -11.078 3.637 828 HE3 LYS 108 HE3 LYS 108 79.173 -12.831 3.417 829 HZ1 LYS 108 HZ1 LYS 108 76.986 -12.309 4.272 830 HZ2 LYS 108 HZ2 LYS 108 77.836 -13.179 5.386 831 HZ3 LYS 108 HZ3 LYS 108 77.632 -11.555 5.589 832 H SER 109 H SER 109 83.517 -10.125 7.015 833 HA SER 109 HA SER 109 82.907 -7.375 6.001 834 HB2 SER 109 HB3 SER 109 81.696 -8.763 7.939 835 HB3 SER 109 HB2 SER 109 83.002 -8.068 8.929 836 HG SER 109 HG SER 109 81.137 -6.691 8.821 837 H GLY 110 H GLY 110 85.666 -8.958 6.406 838 HA2 GLY 110 HA2 GLY 110 87.091 -7.096 8.213 839 HA3 GLY 110 HA3 GLY 110 87.829 -8.387 7.236 840 H LEU 111 H LEU 111 85.924 -5.410 6.546 841 HA LEU 111 HA LEU 111 88.221 -4.444 4.878 842 HB2 LEU 111 HB2 LEU 111 85.370 -4.718 3.843 843 HB3 LEU 111 HB3 LEU 111 86.709 -3.914 2.990 844 HG LEU 111 HG LEU 111 87.915 -6.269 3.453 845 HD11 LEU 111 HD11 LEU 111 85.988 -7.201 4.709 846 HD12 LEU 111 HD12 LEU 111 84.942 -6.947 3.291 847 HD13 LEU 111 HD13 LEU 111 86.280 -8.119 3.212 848 HD21 LEU 111 HD21 LEU 111 87.174 -6.961 1.188 849 HD22 LEU 111 HD22 LEU 111 85.838 -5.787 1.267 850 HD23 LEU 111 HD23 LEU 111 87.524 -5.217 1.241 851 H LYS 112 H LYS 112 88.482 -2.818 6.395 852 HA LYS 112 HA LYS 112 86.289 -0.736 6.367 853 HB2 LYS 112 HB2 LYS 112 86.913 -2.193 8.604 854 HB3 LYS 112 HB3 LYS 112 88.054 -0.837 8.766 855 HG2 LYS 112 HG2 LYS 112 86.112 0.741 8.380 856 HG3 LYS 112 HG3 LYS 112 85.026 -0.668 8.451 857 HD2 LYS 112 HD3 LYS 112 85.653 -1.143 10.728 858 HD3 LYS 112 HD2 LYS 112 86.998 0.021 10.667 859 HE2 LYS 112 HE2 LYS 112 85.239 1.826 10.205 860 HE3 LYS 112 HE3 LYS 112 84.012 0.610 10.634 861 HZ1 LYS 112 HZ1 LYS 112 84.656 1.933 12.535 862 HZ2 LYS 112 HZ2 LYS 112 85.099 0.361 12.764 863 HZ3 LYS 112 HZ3 LYS 112 86.236 1.488 12.366 864 H TYR 113 H TYR 113 87.146 0.838 5.099 865 HA TYR 113 HA TYR 113 90.078 1.265 5.034 866 HB2 TYR 113 HB3 TYR 113 88.099 3.177 3.804 867 HB3 TYR 113 HB2 TYR 113 89.671 2.619 3.183 868 HD1 TYR 113 HD1 TYR 113 86.804 2.636 1.834 869 HD2 TYR 113 HD2 TYR 113 89.171 -0.378 3.775 870 HE1 TYR 113 HE1 TYR 113 85.654 0.881 0.512 871 HE2 TYR 113 HE2 TYR 113 88.023 -2.131 2.450 872 HH TYR 113 HH TYR 113 86.773 -2.192 0.133 873 H LYS 114 H LYS 114 90.949 2.251 6.794 874 HA LYS 114 HA LYS 114 89.452 4.621 7.931 875 HB2 LYS 114 HB2 LYS 114 91.231 2.513 9.079 876 HB3 LYS 114 HB3 LYS 114 91.459 4.157 9.721 877 HG2 LYS 114 HG3 LYS 114 88.979 4.281 10.131 878 HG3 LYS 114 HG2 LYS 114 88.849 2.580 9.620 879 HD2 LYS 114 HD2 LYS 114 90.288 1.858 11.439 880 HD3 LYS 114 HD3 LYS 114 90.660 3.543 11.877 881 HE2 LYS 114 HE2 LYS 114 88.033 3.750 12.115 882 HE3 LYS 114 HE3 LYS 114 88.107 1.980 12.282 883 HZ1 LYS 114 HZ1 LYS 114 88.294 3.082 14.411 884 HZ2 LYS 114 HZ2 LYS 114 89.623 3.921 13.911 885 HZ3 LYS 114 HZ3 LYS 114 89.692 2.280 14.066 886 H LYS 115 H LYS 115 90.167 6.452 6.920 887 HA LYS 115 HA LYS 115 92.722 6.708 5.624 888 HB2 LYS 115 HB3 LYS 115 90.658 8.662 6.655 889 HB3 LYS 115 HB2 LYS 115 92.222 9.264 6.057 890 HG2 LYS 115 HG2 LYS 115 91.837 8.485 3.876 891 HG3 LYS 115 HG3 LYS 115 90.647 7.275 4.411 892 HD2 LYS 115 HD2 LYS 115 89.548 9.188 3.266 893 HD3 LYS 115 HD3 LYS 115 89.051 9.078 4.971 894 HE2 LYS 115 HE3 LYS 115 91.436 10.779 4.243 895 HE3 LYS 115 HE2 LYS 115 89.798 11.409 3.944 896 HZ1 LYS 115 HZ1 LYS 115 89.821 11.957 6.078 897 HZ2 LYS 115 HZ2 LYS 115 91.170 11.067 6.410 898 HZ3 LYS 115 HZ3 LYS 115 89.683 10.354 6.441 899 H GLY 116 H GLY 116 94.630 6.440 6.687 900 HA2 GLY 116 HA3 GLY 116 94.912 7.035 9.544 901 HA3 GLY 116 HA2 GLY 116 96.232 6.608 8.428 902 H GLY 117 H GLY 117 93.915 9.341 8.870 903 HA2 GLY 117 HA3 GLY 117 96.159 11.197 8.112 904 HA3 GLY 117 HA2 GLY 117 94.432 11.623 8.167 905 H VAL 118 H VAL 118 96.144 9.830 10.711 906 HA VAL 118 HA VAL 118 95.390 12.036 12.600 907 HB VAL 118 HB VAL 118 96.367 10.219 14.266 908 HG11 VAL 118 HG11 VAL 118 93.987 10.895 14.093 909 HG12 VAL 118 HG12 VAL 118 94.137 9.134 14.307 910 HG13 VAL 118 HG13 VAL 118 93.780 9.807 12.699 911 HG21 VAL 118 HG21 VAL 118 96.456 8.002 13.456 912 HG22 VAL 118 HG22 VAL 118 97.225 8.934 12.149 913 HG23 VAL 118 HG23 VAL 118 95.533 8.403 11.987 914 H ALA 119 H ALA 119 98.217 10.347 11.276 915 HA ALA 119 HA ALA 119 100.073 11.832 13.053 916 HB1 ALA 119 HB1 ALA 119 101.837 10.715 11.711 917 HB2 ALA 119 HB2 ALA 119 100.598 10.116 10.582 918 HB3 ALA 119 HB3 ALA 119 100.619 9.542 12.267 919 H SER 120 H SER 120 98.628 12.199 9.879 920 HA SER 120 HA SER 120 100.606 14.111 8.877 921 HB2 SER 120 HB2 SER 120 97.716 13.545 8.101 922 HB3 SER 120 HB3 SER 120 98.757 14.706 7.242 923 HG SER 120 HG SER 120 98.826 12.585 6.305 924 H GLY 121 H GLY 121 98.795 14.321 11.512 925 HA2 GLY 121 HA2 GLY 121 97.404 16.834 11.306 926 HA3 GLY 121 HA3 GLY 121 98.034 16.136 12.817 927 H PHE 122 H PHE 122 100.816 16.048 11.662 928 HA PHE 122 HA PHE 122 101.524 18.833 12.423 929 HB2 PHE 122 HB2 PHE 122 103.091 16.316 11.774 930 HB3 PHE 122 HB3 PHE 122 103.902 17.891 11.942 931 HD1 PHE 122 HD1 PHE 122 102.407 15.093 13.684 932 HD2 PHE 122 HD2 PHE 122 103.568 19.207 14.100 933 HE1 PHE 122 HE1 PHE 122 102.340 14.862 16.151 934 HE2 PHE 122 HE2 PHE 122 103.504 18.976 16.567 935 HZ PHE 122 HZ PHE 122 102.891 16.803 17.595 936 H LYS 123 H LYS 123 101.240 16.881 9.508 937 HA LYS 123 HA LYS 123 102.899 18.426 7.753 938 HB2 LYS 123 HB3 LYS 123 100.404 16.759 7.373 939 HB3 LYS 123 HB2 LYS 123 101.070 17.687 6.008 940 HG2 LYS 123 HG2 LYS 123 103.184 16.544 6.151 941 HG3 LYS 123 HG3 LYS 123 102.753 15.808 7.713 942 HD2 LYS 123 HD2 LYS 123 102.511 14.183 5.848 943 HD3 LYS 123 HD3 LYS 123 100.943 14.525 6.618 944 HE2 LYS 123 HE3 LYS 123 100.212 15.867 4.820 945 HE3 LYS 123 HE2 LYS 123 101.867 16.134 4.223 946 HZ1 LYS 123 HZ1 LYS 123 100.681 14.540 2.870 947 HZ2 LYS 123 HZ2 LYS 123 100.421 13.562 4.171 948 HZ3 LYS 123 HZ3 LYS 123 101.955 13.809 3.619 949 H HIS 124 H HIS 124 99.685 19.061 9.082 950 HA HIS 124 HA HIS 124 99.328 21.401 7.257 951 HB2 HIS 124 HB2 HIS 124 97.656 20.002 9.343 952 HB3 HIS 124 HB3 HIS 124 97.263 21.681 8.901 953 HD2 HIS 124 HD2 HIS 124 96.242 18.290 7.712 954 HE1 HIS 124 HE1 HIS 124 96.174 20.653 4.213 955 HE2 HIS 124 HE2 HIS 124 95.437 18.424 5.217 956 H VAL 125 H VAL 125 100.961 22.862 7.858 957 HA VAL 125 HA VAL 125 101.205 23.589 10.747 958 HB VAL 125 HB VAL 125 102.622 24.698 8.282 959 HG11 VAL 125 HG11 VAL 125 102.609 26.242 10.221 960 HG12 VAL 125 HG12 VAL 125 103.226 24.938 11.263 961 HG13 VAL 125 HG13 VAL 125 104.237 25.576 9.945 962 HG21 VAL 125 HG21 VAL 125 103.067 22.286 8.656 963 HG22 VAL 125 HG22 VAL 125 103.493 22.629 10.350 964 HG23 VAL 125 HG23 VAL 125 104.504 23.267 9.032 965 H VAL 126 H VAL 126 100.427 25.484 11.632 966 HA VAL 126 HA VAL 126 98.230 26.832 10.386 967 HB VAL 126 HB VAL 126 100.024 28.249 12.366 968 HG11 VAL 126 HG11 VAL 126 97.932 29.324 11.576 969 HG12 VAL 126 HG12 VAL 126 97.824 28.907 13.303 970 HG13 VAL 126 HG13 VAL 126 97.005 27.895 12.090 971 HG21 VAL 126 HG21 VAL 126 98.448 26.780 14.014 972 HG22 VAL 126 HG22 VAL 126 100.077 26.257 13.526 973 HG23 VAL 126 HG23 VAL 126 98.646 25.610 12.688 974 HA PRO 127 HA PRO 127 100.570 29.001 7.166 975 HB2 PRO 127 HB2 PRO 127 98.025 30.618 7.220 976 HB3 PRO 127 HB3 PRO 127 98.900 29.916 5.829 977 HG2 PRO 127 HG3 PRO 127 96.653 28.815 6.816 978 HG3 PRO 127 HG2 PRO 127 97.973 27.835 6.122 979 HD2 PRO 127 HD2 PRO 127 97.145 28.159 8.981 980 HD3 PRO 127 HD3 PRO 127 98.000 26.803 8.186 981 H ASN 128 H ASN 128 101.549 31.099 6.965 982 HA ASN 128 HA ASN 128 100.856 33.258 8.835 983 HB2 ASN 128 HB2 ASN 128 103.176 31.404 9.416 984 HB3 ASN 128 HB3 ASN 128 103.287 33.126 9.854 985 HD21 ASN 128 HD21 ASN 128 102.089 30.058 10.872 986 HD22 ASN 128 HD22 ASN 128 101.064 30.637 12.166 987 H GLU 129 H GLU 129 100.966 34.742 7.174 988 HA GLU 129 HA GLU 129 103.113 34.655 5.168 989 HB2 GLU 129 HB3 GLU 129 100.857 35.626 4.715 990 HB3 GLU 129 HB2 GLU 129 101.195 36.917 5.892 991 HG2 GLU 129 HG3 GLU 129 103.032 37.754 4.559 992 HG3 GLU 129 HG2 GLU 129 102.956 36.346 3.473 993 H VAL 130 H VAL 130 102.674 36.134 8.322 994 HA VAL 130 HA VAL 130 104.693 38.207 8.030 995 HB VAL 130 HB VAL 130 102.961 38.048 9.877 996 HG11 VAL 130 HG11 VAL 130 103.281 36.536 11.699 997 HG12 VAL 130 HG12 VAL 130 104.909 36.085 11.138 998 HG13 VAL 130 HG13 VAL 130 103.475 35.545 10.233 999 HG21 VAL 130 HG21 VAL 130 104.499 38.890 11.632 1000 HG22 VAL 130 HG22 VAL 130 105.885 38.224 10.736 1001 HG23 VAL 130 HG23 VAL 130 104.928 39.552 10.036 1002 H VAL 131 H VAL 131 104.858 34.755 8.404 1003 HA VAL 131 HA VAL 131 107.306 34.369 9.757 1004 HB VAL 131 HB VAL 131 105.799 32.576 8.771 1005 HG11 VAL 131 HG11 VAL 131 107.410 32.853 6.234 1006 HG12 VAL 131 HG12 VAL 131 105.954 33.853 6.450 1007 HG13 VAL 131 HG13 VAL 131 105.828 32.078 6.487 1008 HG21 VAL 131 HG21 VAL 131 107.676 31.031 8.276 1009 HG22 VAL 131 HG22 VAL 131 108.770 32.422 8.088 1010 HG23 VAL 131 HG23 VAL 131 108.051 32.064 9.676 1011 H VAL 132 H VAL 132 106.736 35.872 6.652 1012 HA VAL 132 HA VAL 132 109.245 35.532 5.373 1013 HB VAL 132 HB VAL 132 107.442 37.984 5.530 1014 HG11 VAL 132 HG11 VAL 132 109.752 38.633 4.908 1015 HG12 VAL 132 HG12 VAL 132 109.764 37.379 3.645 1016 HG13 VAL 132 HG13 VAL 132 108.654 38.764 3.513 1017 HG21 VAL 132 HG21 VAL 132 106.723 37.196 3.291 1018 HG22 VAL 132 HG22 VAL 132 107.834 35.812 3.422 1019 HG23 VAL 132 HG23 VAL 132 106.445 35.946 4.527 1020 H GLN 133 H GLN 133 108.381 37.551 8.151 1021 HA GLN 133 HA GLN 133 111.239 38.536 8.222 1022 HB2 GLN 133 HB2 GLN 133 108.710 39.573 9.575 1023 HB3 GLN 133 HB3 GLN 133 110.339 40.235 9.848 1024 HG2 GLN 133 HG3 GLN 133 110.436 40.464 7.248 1025 HG3 GLN 133 HG2 GLN 133 108.667 40.282 7.320 1026 HE21 GLN 133 HE21 GLN 133 111.295 42.168 8.987 1027 HE22 GLN 133 HE22 GLN 133 110.354 43.639 9.096 Start of MODEL 14 1 H1 GLU 1 H1 GLU 1 109.770 -4.466 21.559 2 H2 GLU 1 H2 GLU 1 110.981 -4.065 22.603 3 H3 GLU 1 H3 GLU 1 109.741 -5.027 23.110 4 HA GLU 1 HA GLU 1 111.744 -5.746 21.064 5 HB2 GLU 1 HB2 GLU 1 112.312 -5.638 23.652 6 HB3 GLU 1 HB3 GLU 1 111.363 -7.143 23.715 7 HG2 GLU 1 HG3 GLU 1 112.838 -7.906 21.707 8 HG3 GLU 1 HG2 GLU 1 113.918 -6.572 22.182 9 H HIS 2 H HIS 2 110.261 -6.573 19.556 10 HA HIS 2 HA HIS 2 108.837 -9.054 20.494 11 HB2 HIS 2 HB2 HIS 2 107.496 -7.074 18.620 12 HB3 HIS 2 HB3 HIS 2 106.763 -8.437 19.499 13 HD2 HIS 2 HD2 HIS 2 107.710 -4.692 20.115 14 HE1 HIS 2 HE1 HIS 2 106.101 -6.206 23.713 15 HE2 HIS 2 HE2 HIS 2 106.865 -4.080 22.523 16 HA PRO 3 HA PRO 3 111.148 -9.470 16.458 17 HB2 PRO 3 HB3 PRO 3 112.735 -11.578 17.231 18 HB3 PRO 3 HB2 PRO 3 113.186 -9.870 17.501 19 HG2 PRO 3 HG3 PRO 3 112.066 -11.888 19.403 20 HG3 PRO 3 HG2 PRO 3 113.272 -10.603 19.685 21 HD2 PRO 3 HD3 PRO 3 110.579 -10.439 20.399 22 HD3 PRO 3 HD2 PRO 3 111.640 -9.022 20.138 23 H GLU 4 H GLU 4 108.811 -11.084 18.125 24 HA GLU 4 HA GLU 4 108.815 -13.760 17.171 25 HB2 GLU 4 HB3 GLU 4 106.486 -11.822 17.524 26 HB3 GLU 4 HB2 GLU 4 106.297 -13.571 17.255 27 HG2 GLU 4 HG2 GLU 4 107.917 -12.354 19.534 28 HG3 GLU 4 HG3 GLU 4 106.233 -12.908 19.690 29 H PHE 5 H PHE 5 108.638 -10.828 15.376 30 HA PHE 5 HA PHE 5 107.066 -11.727 13.120 31 HB2 PHE 5 HB2 PHE 5 107.602 -9.376 13.347 32 HB3 PHE 5 HB3 PHE 5 109.348 -9.719 13.345 33 HD1 PHE 5 HD1 PHE 5 110.485 -9.416 11.340 34 HD2 PHE 5 HD2 PHE 5 106.312 -10.428 11.229 35 HE1 PHE 5 HE1 PHE 5 110.514 -9.258 8.865 36 HE2 PHE 5 HE2 PHE 5 106.339 -10.269 8.754 37 HZ PHE 5 HZ PHE 5 108.441 -9.685 7.572 38 H LEU 6 H LEU 6 110.404 -12.307 14.104 39 HA LEU 6 HA LEU 6 111.410 -13.209 11.550 40 HB2 LEU 6 HB2 LEU 6 112.141 -13.703 14.439 41 HB3 LEU 6 HB3 LEU 6 112.905 -14.685 13.167 42 HG LEU 6 HG LEU 6 112.783 -11.687 12.842 43 HD11 LEU 6 HD11 LEU 6 113.661 -12.058 15.131 44 HD12 LEU 6 HD12 LEU 6 114.849 -13.217 14.487 45 HD13 LEU 6 HD13 LEU 6 114.948 -11.498 14.036 46 HD21 LEU 6 HD21 LEU 6 113.575 -13.140 10.991 47 HD22 LEU 6 HD22 LEU 6 114.799 -13.848 12.072 48 HD23 LEU 6 HD23 LEU 6 114.898 -12.129 11.620 49 H LYS 7 H LYS 7 109.230 -14.651 13.869 50 HA LYS 7 HA LYS 7 109.562 -17.348 12.596 51 HB2 LYS 7 HB2 LYS 7 108.206 -16.278 15.068 52 HB3 LYS 7 HB3 LYS 7 107.616 -17.800 14.358 53 HG2 LYS 7 HG3 LYS 7 109.364 -18.220 16.072 54 HG3 LYS 7 HG2 LYS 7 109.901 -18.742 14.457 55 HD2 LYS 7 HD3 LYS 7 111.163 -16.645 14.175 56 HD3 LYS 7 HD2 LYS 7 110.585 -16.067 15.756 57 HE2 LYS 7 HE2 LYS 7 112.864 -17.010 15.946 58 HE3 LYS 7 HE3 LYS 7 111.696 -17.993 16.861 59 HZ1 LYS 7 HZ1 LYS 7 113.149 -19.361 15.516 60 HZ2 LYS 7 HZ2 LYS 7 111.593 -19.497 14.987 61 HZ3 LYS 7 HZ3 LYS 7 112.676 -18.587 14.139 62 H ALA 8 H ALA 8 106.803 -15.198 13.456 63 HA ALA 8 HA ALA 8 104.775 -14.839 12.299 64 HB1 ALA 8 HB1 ALA 8 106.789 -15.323 10.112 65 HB2 ALA 8 HB2 ALA 8 105.064 -15.291 9.676 66 HB3 ALA 8 HB3 ALA 8 105.812 -13.875 10.452 67 H GLY 9 H GLY 9 102.930 -16.048 11.811 68 HA2 GLY 9 HA3 GLY 9 101.693 -18.085 11.901 69 HA3 GLY 9 HA2 GLY 9 102.683 -18.485 10.477 70 H LYS 10 H LYS 10 103.687 -18.047 13.892 71 HA LYS 10 HA LYS 10 105.557 -20.137 13.983 72 HB2 LYS 10 HB2 LYS 10 104.666 -20.379 16.477 73 HB3 LYS 10 HB3 LYS 10 105.482 -18.887 15.952 74 HG2 LYS 10 HG2 LYS 10 103.477 -17.680 15.818 75 HG3 LYS 10 HG3 LYS 10 102.490 -19.147 15.616 76 HD2 LYS 10 HD3 LYS 10 102.776 -19.753 17.938 77 HD3 LYS 10 HD2 LYS 10 104.006 -18.489 18.176 78 HE2 LYS 10 HE2 LYS 10 101.227 -17.753 17.227 79 HE3 LYS 10 HE3 LYS 10 101.541 -18.025 18.958 80 HZ1 LYS 10 HZ1 LYS 10 101.856 -15.720 18.348 81 HZ2 LYS 10 HZ2 LYS 10 103.288 -16.378 18.833 82 HZ3 LYS 10 HZ3 LYS 10 102.997 -16.126 17.229 83 H GLU 11 H GLU 11 102.075 -20.382 13.798 84 HA GLU 11 HA GLU 11 102.379 -23.363 13.654 85 HB2 GLU 11 HB2 GLU 11 100.385 -23.657 15.157 86 HB3 GLU 11 HB3 GLU 11 101.797 -22.978 16.003 87 HG2 GLU 11 HG3 GLU 11 100.772 -20.658 15.417 88 HG3 GLU 11 HG2 GLU 11 99.275 -21.561 15.083 89 HA PRO 12 HA PRO 12 99.718 -23.192 10.145 90 HB2 PRO 12 HB2 PRO 12 97.933 -25.054 11.719 91 HB3 PRO 12 HB3 PRO 12 98.519 -25.193 10.036 92 HG2 PRO 12 HG3 PRO 12 99.596 -26.587 12.095 93 HG3 PRO 12 HG2 PRO 12 100.535 -26.070 10.668 94 HD2 PRO 12 HD2 PRO 12 100.692 -25.099 13.466 95 HD3 PRO 12 HD3 PRO 12 101.855 -24.886 12.124 96 H GLY 13 H GLY 13 98.370 -21.503 9.699 97 HA2 GLY 13 HA2 GLY 13 95.767 -21.084 10.432 98 HA3 GLY 13 HA3 GLY 13 96.612 -20.465 11.871 99 H LEU 14 H LEU 14 95.469 -18.422 11.096 100 HA LEU 14 HA LEU 14 97.133 -17.073 8.953 101 HB2 LEU 14 HB3 LEU 14 94.671 -17.320 8.460 102 HB3 LEU 14 HB2 LEU 14 94.328 -16.341 9.906 103 HG LEU 14 HG LEU 14 96.317 -15.178 8.010 104 HD11 LEU 14 HD11 LEU 14 94.668 -16.158 6.435 105 HD12 LEU 14 HD12 LEU 14 94.556 -14.382 6.458 106 HD13 LEU 14 HD13 LEU 14 93.348 -15.361 7.324 107 HD21 LEU 14 HD21 LEU 14 95.500 -14.000 10.036 108 HD22 LEU 14 HD22 LEU 14 95.041 -13.125 8.556 109 HD23 LEU 14 HD23 LEU 14 93.833 -14.104 9.422 110 H GLN 15 H GLN 15 97.943 -14.990 9.400 111 HA GLN 15 HA GLN 15 97.418 -13.895 12.153 112 HB2 GLN 15 HB2 GLN 15 100.179 -14.484 10.993 113 HB3 GLN 15 HB3 GLN 15 99.881 -13.533 12.468 114 HG2 GLN 15 HG2 GLN 15 98.411 -15.735 13.062 115 HG3 GLN 15 HG3 GLN 15 99.635 -16.483 12.008 116 HE21 GLN 15 HE21 GLN 15 101.825 -16.607 12.775 117 HE22 GLN 15 HE22 GLN 15 102.272 -16.122 14.395 118 H ILE 16 H ILE 16 97.847 -11.607 12.298 119 HA ILE 16 HA ILE 16 98.383 -10.310 9.615 120 HB ILE 16 HB ILE 16 96.551 -8.944 11.552 121 HG12 ILE 16 HG12 ILE 16 95.848 -11.452 9.978 122 HG13 ILE 16 HG13 ILE 16 95.596 -11.139 11.712 123 HG21 ILE 16 HG21 ILE 16 97.382 -8.255 9.132 124 HG22 ILE 16 HG22 ILE 16 95.691 -7.968 9.608 125 HG23 ILE 16 HG23 ILE 16 96.105 -9.373 8.596 126 HD11 ILE 16 HD11 ILE 16 93.454 -10.739 10.860 127 HD12 ILE 16 HD12 ILE 16 94.153 -9.103 10.828 128 HD13 ILE 16 HD13 ILE 16 94.076 -10.067 9.334 129 H TRP 17 H TRP 17 99.825 -8.625 9.675 130 HA TRP 17 HA TRP 17 100.455 -7.409 12.355 131 HB2 TRP 17 HB2 TRP 17 102.645 -8.344 10.458 132 HB3 TRP 17 HB3 TRP 17 102.818 -7.765 12.132 133 HD1 TRP 17 HD1 TRP 17 100.958 -9.381 13.804 134 HE1 TRP 17 HE1 TRP 17 101.044 -11.950 14.010 135 HE3 TRP 17 HE3 TRP 17 103.452 -10.462 9.478 136 HZ2 TRP 17 HZ2 TRP 17 102.073 -14.169 12.484 137 HZ3 TRP 17 HZ3 TRP 17 103.975 -12.808 8.883 138 HH2 TRP 17 HH2 TRP 17 103.283 -14.662 10.376 139 H ARG 18 H ARG 18 99.999 -5.292 11.958 140 HA ARG 18 HA ARG 18 100.348 -4.161 9.245 141 HB2 ARG 18 HB3 ARG 18 98.500 -3.402 10.702 142 HB3 ARG 18 HB2 ARG 18 99.677 -2.828 11.908 143 HG2 ARG 18 HG3 ARG 18 100.591 -1.215 10.306 144 HG3 ARG 18 HG2 ARG 18 99.530 -1.845 9.023 145 HD2 ARG 18 HD2 ARG 18 98.151 -0.141 9.691 146 HD3 ARG 18 HD3 ARG 18 97.685 -1.292 10.967 147 HE ARG 18 HE ARG 18 100.038 0.323 11.700 148 HH11 ARG 18 HH11 ARG 18 99.681 1.815 13.361 149 HH12 ARG 18 HH12 ARG 18 98.047 2.237 13.821 150 HH21 ARG 18 HH21 ARG 18 96.570 0.132 11.473 151 HH22 ARG 18 HH22 ARG 18 96.293 1.288 12.756 152 H VAL 19 H VAL 19 102.016 -2.835 8.545 153 HA VAL 19 HA VAL 19 104.467 -2.880 10.218 154 HB VAL 19 HB VAL 19 104.365 -1.249 7.719 155 HG11 VAL 19 HG11 VAL 19 106.469 -1.711 8.951 156 HG12 VAL 19 HG12 VAL 19 106.501 -2.444 7.330 157 HG13 VAL 19 HG13 VAL 19 106.196 -3.459 8.760 158 HG21 VAL 19 HG21 VAL 19 104.546 -3.451 6.395 159 HG22 VAL 19 HG22 VAL 19 103.847 -4.243 7.827 160 HG23 VAL 19 HG23 VAL 19 102.920 -2.997 6.958 161 H GLU 20 H GLU 20 105.438 -1.103 11.177 162 HA GLU 20 HA GLU 20 104.344 1.615 10.753 163 HB2 GLU 20 HB3 GLU 20 102.789 0.352 12.430 164 HB3 GLU 20 HB2 GLU 20 104.147 0.509 13.570 165 HG2 GLU 20 HG3 GLU 20 102.888 2.840 12.058 166 HG3 GLU 20 HG2 GLU 20 102.489 2.395 13.735 167 H LYS 21 H LYS 21 106.464 2.282 10.322 168 HA LYS 21 HA LYS 21 108.630 3.030 10.908 169 HB2 LYS 21 HB3 LYS 21 107.206 3.755 13.005 170 HB3 LYS 21 HB2 LYS 21 108.045 2.407 13.810 171 HG2 LYS 21 HG2 LYS 21 110.235 3.393 13.049 172 HG3 LYS 21 HG3 LYS 21 109.337 4.793 12.416 173 HD2 LYS 21 HD3 LYS 21 108.905 3.928 15.277 174 HD3 LYS 21 HD2 LYS 21 110.357 4.869 14.860 175 HE2 LYS 21 HE2 LYS 21 107.492 5.684 14.196 176 HE3 LYS 21 HE3 LYS 21 108.449 6.330 15.551 177 HZ1 LYS 21 HZ1 LYS 21 108.577 7.748 13.614 178 HZ2 LYS 21 HZ2 LYS 21 110.061 7.114 13.951 179 HZ3 LYS 21 HZ3 LYS 21 109.174 6.515 12.696 180 H PHE 22 H PHE 22 107.909 0.109 10.512 181 HA PHE 22 HA PHE 22 109.186 -1.883 10.478 182 HB2 PHE 22 HB2 PHE 22 111.408 -0.586 12.048 183 HB3 PHE 22 HB3 PHE 22 111.502 -1.750 10.705 184 HD1 PHE 22 HD1 PHE 22 112.508 1.367 11.370 185 HD2 PHE 22 HD2 PHE 22 109.833 -0.587 8.635 186 HE1 PHE 22 HE1 PHE 22 112.779 3.238 9.768 187 HE2 PHE 22 HE2 PHE 22 110.106 1.285 7.032 188 HZ PHE 22 HZ PHE 22 111.580 3.199 7.599 189 H ASP 23 H ASP 23 107.651 -0.646 12.949 190 HA ASP 23 HA ASP 23 108.865 -2.404 15.069 191 HB2 ASP 23 HB3 ASP 23 108.085 0.066 15.432 192 HB3 ASP 23 HB2 ASP 23 106.441 -0.617 15.424 193 H LEU 24 H LEU 24 106.357 -2.353 12.716 194 HA LEU 24 HA LEU 24 104.608 -3.880 12.293 195 HB2 LEU 24 HB3 LEU 24 106.709 -5.381 13.664 196 HB3 LEU 24 HB2 LEU 24 105.099 -6.037 14.047 197 HG LEU 24 HG LEU 24 104.586 -6.054 11.578 198 HD11 LEU 24 HD11 LEU 24 106.219 -4.310 10.915 199 HD12 LEU 24 HD12 LEU 24 107.558 -5.392 11.368 200 HD13 LEU 24 HD13 LEU 24 106.491 -5.817 10.009 201 HD21 LEU 24 HD21 LEU 24 105.395 -8.089 12.745 202 HD22 LEU 24 HD22 LEU 24 107.077 -7.597 12.436 203 HD23 LEU 24 HD23 LEU 24 106.010 -8.023 11.076 204 H VAL 25 H VAL 25 102.527 -4.070 13.048 205 HA VAL 25 HA VAL 25 102.103 -3.941 16.030 206 HB VAL 25 HB VAL 25 101.069 -2.009 13.929 207 HG11 VAL 25 HG11 VAL 25 99.575 -1.223 15.950 208 HG12 VAL 25 HG12 VAL 25 99.764 -2.902 16.510 209 HG13 VAL 25 HG13 VAL 25 99.015 -2.570 14.930 210 HG21 VAL 25 HG21 VAL 25 103.099 -1.421 15.226 211 HG22 VAL 25 HG22 VAL 25 102.203 -1.679 16.742 212 HG23 VAL 25 HG23 VAL 25 101.738 -0.355 15.647 213 HA PRO 26 HA PRO 26 99.306 -7.161 14.649 214 HB2 PRO 26 HB2 PRO 26 98.148 -7.676 17.110 215 HB3 PRO 26 HB3 PRO 26 99.752 -8.288 16.616 216 HG2 PRO 26 HG3 PRO 26 99.045 -5.979 18.375 217 HG3 PRO 26 HG2 PRO 26 100.388 -7.146 18.508 218 HD2 PRO 26 HD2 PRO 26 100.678 -4.570 17.528 219 HD3 PRO 26 HD3 PRO 26 101.742 -5.934 17.072 220 H VAL 27 H VAL 27 97.380 -6.867 13.646 221 HA VAL 27 HA VAL 27 95.744 -4.540 14.003 222 HB VAL 27 HB VAL 27 94.911 -7.294 12.981 223 HG11 VAL 27 HG11 VAL 27 93.218 -6.024 11.704 224 HG12 VAL 27 HG12 VAL 27 93.785 -4.509 12.445 225 HG13 VAL 27 HG13 VAL 27 93.014 -5.758 13.452 226 HG21 VAL 27 HG21 VAL 27 96.922 -6.402 11.836 227 HG22 VAL 27 HG22 VAL 27 96.065 -4.874 11.524 228 HG23 VAL 27 HG23 VAL 27 95.507 -6.380 10.757 229 HA PRO 28 HA PRO 28 93.700 -5.642 17.817 230 HB2 PRO 28 HB2 PRO 28 91.705 -3.734 17.741 231 HB3 PRO 28 HB3 PRO 28 93.400 -3.374 18.179 232 HG2 PRO 28 HG2 PRO 28 91.958 -2.930 15.594 233 HG3 PRO 28 HG3 PRO 28 93.172 -1.913 16.418 234 HD2 PRO 28 HD3 PRO 28 93.748 -3.569 14.274 235 HD3 PRO 28 HD2 PRO 28 94.955 -3.084 15.502 236 H THR 29 H THR 29 92.212 -7.218 18.228 237 HA THR 29 HA THR 29 90.545 -8.314 16.156 238 HB THR 29 HB THR 29 90.047 -8.526 19.155 239 HG1 THR 29 HG1 THR 29 91.523 -10.307 18.996 240 HG21 THR 29 HG21 THR 29 89.196 -10.767 18.523 241 HG22 THR 29 HG22 THR 29 89.556 -10.422 16.815 242 HG23 THR 29 HG23 THR 29 88.309 -9.482 17.669 243 H ASN 30 H ASN 30 90.036 -5.684 18.429 244 HA ASN 30 HA ASN 30 87.251 -5.503 18.618 245 HB2 ASN 30 HB2 ASN 30 89.113 -3.830 19.375 246 HB3 ASN 30 HB3 ASN 30 88.866 -3.076 17.782 247 HD21 ASN 30 HD21 ASN 30 87.904 -1.134 18.739 248 HD22 ASN 30 HD22 ASN 30 86.301 -1.183 19.438 249 H LEU 31 H LEU 31 89.280 -4.744 15.781 250 HA LEU 31 HA LEU 31 86.730 -4.332 14.212 251 HB2 LEU 31 HB2 LEU 31 89.577 -3.612 13.393 252 HB3 LEU 31 HB3 LEU 31 88.064 -3.103 12.605 253 HG LEU 31 HG LEU 31 88.944 -2.372 15.434 254 HD11 LEU 31 HD11 LEU 31 90.200 -1.191 13.650 255 HD12 LEU 31 HD12 LEU 31 89.099 -0.080 14.498 256 HD13 LEU 31 HD13 LEU 31 88.665 -0.707 12.890 257 HD21 LEU 31 HD21 LEU 31 86.896 -0.715 14.931 258 HD22 LEU 31 HD22 LEU 31 86.390 -2.058 13.878 259 HD23 LEU 31 HD23 LEU 31 86.631 -2.335 15.619 260 H TYR 32 H TYR 32 90.027 -5.734 13.852 261 HA TYR 32 HA TYR 32 90.720 -7.546 12.491 262 HB2 TYR 32 HB2 TYR 32 89.138 -8.520 14.395 263 HB3 TYR 32 HB3 TYR 32 88.060 -8.865 13.020 264 HD1 TYR 32 HD1 TYR 32 91.721 -9.124 13.879 265 HD2 TYR 32 HD2 TYR 32 88.318 -10.925 11.975 266 HE1 TYR 32 HE1 TYR 32 93.093 -11.110 13.306 267 HE2 TYR 32 HE2 TYR 32 89.691 -12.908 11.395 268 HH TYR 32 HH TYR 32 92.579 -13.644 12.795 269 H GLY 33 H GLY 33 90.683 -6.560 10.438 270 HA2 GLY 33 HA2 GLY 33 89.779 -7.392 8.183 271 HA3 GLY 33 HA3 GLY 33 88.157 -7.086 8.847 272 H ASP 34 H ASP 34 89.047 -4.617 10.260 273 HA ASP 34 HA ASP 34 88.731 -2.797 7.942 274 HB2 ASP 34 HB3 ASP 34 89.192 -2.150 10.889 275 HB3 ASP 34 HB2 ASP 34 88.608 -1.028 9.637 276 H PHE 35 H PHE 35 90.286 -1.266 7.228 277 HA PHE 35 HA PHE 35 92.991 -1.398 8.520 278 HB2 PHE 35 HB2 PHE 35 92.643 -1.827 5.526 279 HB3 PHE 35 HB3 PHE 35 94.138 -1.970 6.481 280 HD1 PHE 35 HD1 PHE 35 91.542 -3.801 4.987 281 HD2 PHE 35 HD2 PHE 35 93.896 -3.650 8.577 282 HE1 PHE 35 HE1 PHE 35 91.035 -6.190 5.419 283 HE2 PHE 35 HE2 PHE 35 93.390 -6.039 9.008 284 HZ PHE 35 HZ PHE 35 91.962 -7.310 7.430 285 H PHE 36 H PHE 36 94.329 0.417 7.985 286 HA PHE 36 HA PHE 36 92.716 2.773 7.097 287 HB2 PHE 36 HB2 PHE 36 93.966 3.312 9.012 288 HB3 PHE 36 HB3 PHE 36 95.376 2.367 8.481 289 HD1 PHE 36 HD1 PHE 36 97.060 4.061 8.578 290 HD2 PHE 36 HD2 PHE 36 93.435 4.764 6.384 291 HE1 PHE 36 HE1 PHE 36 98.055 6.104 7.589 292 HE2 PHE 36 HE2 PHE 36 94.432 6.806 5.392 293 HZ PHE 36 HZ PHE 36 96.743 7.475 5.992 294 H THR 37 H THR 37 92.582 2.870 4.887 295 HA THR 37 HA THR 37 94.571 1.865 3.075 296 HB THR 37 HB THR 37 93.413 3.131 1.356 297 HG1 THR 37 HG1 THR 37 92.998 5.118 2.017 298 HG21 THR 37 HG21 THR 37 91.067 2.475 1.823 299 HG22 THR 37 HG22 THR 37 91.467 2.269 3.545 300 HG23 THR 37 HG23 THR 37 92.200 1.198 2.326 301 H GLY 38 H GLY 38 96.606 2.560 3.897 302 HA2 GLY 38 HA2 GLY 38 97.657 4.938 2.666 303 HA3 GLY 38 HA3 GLY 38 97.329 5.300 4.379 304 H ASP 39 H ASP 39 97.806 2.502 5.210 305 HA ASP 39 HA ASP 39 100.823 2.566 5.023 306 HB2 ASP 39 HB2 ASP 39 99.497 2.701 7.293 307 HB3 ASP 39 HB3 ASP 39 99.249 0.956 7.049 308 H ALA 40 H ALA 40 100.981 -0.187 6.081 309 HA ALA 40 HA ALA 40 99.779 -1.729 3.785 310 HB1 ALA 40 HB1 ALA 40 101.940 -2.897 3.438 311 HB2 ALA 40 HB2 ALA 40 102.697 -1.859 4.670 312 HB3 ALA 40 HB3 ALA 40 102.103 -1.148 3.151 313 H TYR 41 H TYR 41 99.148 -3.805 4.334 314 HA TYR 41 HA TYR 41 99.708 -4.604 7.203 315 HB2 TYR 41 HB3 TYR 41 97.235 -4.930 5.467 316 HB3 TYR 41 HB2 TYR 41 97.498 -5.911 6.928 317 HD1 TYR 41 HD1 TYR 41 96.670 -5.091 8.943 318 HD2 TYR 41 HD2 TYR 41 97.688 -2.314 5.827 319 HE1 TYR 41 HE1 TYR 41 95.850 -3.217 10.345 320 HE2 TYR 41 HE2 TYR 41 96.870 -0.440 7.229 321 HH TYR 41 HH TYR 41 94.923 -0.508 9.473 322 H VAL 42 H VAL 42 100.859 -6.452 7.408 323 HA VAL 42 HA VAL 42 101.086 -8.213 4.968 324 HB VAL 42 HB VAL 42 102.786 -8.584 7.427 325 HG11 VAL 42 HG11 VAL 42 103.008 -10.073 5.456 326 HG12 VAL 42 HG12 VAL 42 103.315 -8.657 4.422 327 HG13 VAL 42 HG13 VAL 42 104.480 -9.100 5.692 328 HG21 VAL 42 HG21 VAL 42 104.350 -6.821 6.328 329 HG22 VAL 42 HG22 VAL 42 102.886 -6.241 5.497 330 HG23 VAL 42 HG23 VAL 42 102.969 -6.219 7.275 331 H ILE 43 H ILE 43 100.183 -10.224 4.983 332 HA ILE 43 HA ILE 43 99.285 -11.292 7.670 333 HB ILE 43 HB ILE 43 97.823 -12.088 5.173 334 HG12 ILE 43 HG12 ILE 43 97.269 -9.471 6.633 335 HG13 ILE 43 HG13 ILE 43 98.116 -9.569 5.071 336 HG21 ILE 43 HG21 ILE 43 95.934 -12.134 6.753 337 HG22 ILE 43 HG22 ILE 43 97.312 -13.042 7.420 338 HG23 ILE 43 HG23 ILE 43 96.954 -11.404 8.017 339 HD11 ILE 43 HD11 ILE 43 95.696 -9.128 4.745 340 HD12 ILE 43 HD12 ILE 43 95.305 -10.615 5.641 341 HD13 ILE 43 HD13 ILE 43 96.151 -10.714 4.078 342 H LEU 44 H LEU 44 99.527 -13.498 7.994 343 HA LEU 44 HA LEU 44 101.060 -14.968 5.831 344 HB2 LEU 44 HB2 LEU 44 101.692 -14.451 8.684 345 HB3 LEU 44 HB3 LEU 44 101.839 -16.158 8.207 346 HG LEU 44 HG LEU 44 103.968 -14.878 7.888 347 HD11 LEU 44 HD11 LEU 44 103.140 -16.841 6.396 348 HD12 LEU 44 HD12 LEU 44 102.818 -15.590 5.171 349 HD13 LEU 44 HD13 LEU 44 104.473 -15.837 5.777 350 HD21 LEU 44 HD21 LEU 44 104.049 -12.894 6.775 351 HD22 LEU 44 HD22 LEU 44 102.283 -12.861 6.993 352 HD23 LEU 44 HD23 LEU 44 102.981 -13.481 5.478 353 H LYS 45 H LYS 45 100.216 -16.971 5.317 354 HA LYS 45 HA LYS 45 98.199 -18.107 7.265 355 HB2 LYS 45 HB2 LYS 45 97.444 -16.948 4.918 356 HB3 LYS 45 HB3 LYS 45 97.751 -18.610 4.357 357 HG2 LYS 45 HG2 LYS 45 96.269 -19.479 6.154 358 HG3 LYS 45 HG3 LYS 45 95.950 -17.812 6.690 359 HD2 LYS 45 HD2 LYS 45 94.114 -18.495 5.256 360 HD3 LYS 45 HD3 LYS 45 95.096 -17.314 4.357 361 HE2 LYS 45 HE2 LYS 45 95.974 -18.932 2.923 362 HE3 LYS 45 HE3 LYS 45 95.743 -20.249 4.099 363 HZ1 LYS 45 HZ1 LYS 45 93.608 -20.504 3.485 364 HZ2 LYS 45 HZ2 LYS 45 93.358 -18.908 3.153 365 HZ3 LYS 45 HZ3 LYS 45 94.135 -19.866 2.058 366 H THR 46 H THR 46 99.652 -19.661 8.042 367 HA THR 46 HA THR 46 101.061 -21.431 6.112 368 HB THR 46 HB THR 46 100.812 -21.501 9.152 369 HG1 THR 46 HG1 THR 46 102.089 -19.827 7.755 370 HG21 THR 46 HG21 THR 46 101.260 -23.745 8.321 371 HG22 THR 46 HG22 THR 46 102.778 -23.075 8.965 372 HG23 THR 46 HG23 THR 46 102.504 -23.128 7.207 373 H VAL 47 H VAL 47 99.735 -22.839 5.038 374 HA VAL 47 HA VAL 47 97.384 -23.984 6.450 375 HB VAL 47 HB VAL 47 98.227 -25.077 3.804 376 HG11 VAL 47 HG11 VAL 47 96.084 -25.671 4.903 377 HG12 VAL 47 HG12 VAL 47 95.624 -23.952 4.930 378 HG13 VAL 47 HG13 VAL 47 95.803 -24.801 3.376 379 HG21 VAL 47 HG21 VAL 47 97.202 -22.979 2.720 380 HG22 VAL 47 HG22 VAL 47 97.463 -22.172 4.284 381 HG23 VAL 47 HG23 VAL 47 98.851 -22.806 3.367 382 H GLN 48 H GLN 48 97.040 -26.354 6.379 383 HA GLN 48 HA GLN 48 99.141 -27.728 7.780 384 HB2 GLN 48 HB3 GLN 48 97.714 -29.649 7.686 385 HB3 GLN 48 HB2 GLN 48 96.625 -28.243 7.748 386 HG2 GLN 48 HG3 GLN 48 96.582 -28.322 5.190 387 HG3 GLN 48 HG2 GLN 48 97.399 -29.899 5.313 388 HE21 GLN 48 HE21 GLN 48 94.931 -30.021 4.137 389 HE22 GLN 48 HE22 GLN 48 93.740 -30.658 5.249 390 H LEU 49 H LEU 49 100.347 -29.628 7.114 391 HA LEU 49 HA LEU 49 101.681 -29.252 4.556 392 HB2 LEU 49 HB2 LEU 49 101.693 -31.762 6.287 393 HB3 LEU 49 HB3 LEU 49 102.950 -31.226 5.148 394 HG LEU 49 HG LEU 49 102.768 -29.024 6.768 395 HD11 LEU 49 HD11 LEU 49 102.937 -30.790 9.017 396 HD12 LEU 49 HD12 LEU 49 101.749 -29.497 8.726 397 HD13 LEU 49 HD13 LEU 49 101.416 -31.153 8.167 398 HD21 LEU 49 HD21 LEU 49 104.834 -30.235 6.108 399 HD22 LEU 49 HD22 LEU 49 104.450 -31.522 7.275 400 HD23 LEU 49 HD23 LEU 49 104.828 -29.881 7.852 401 H ARG 50 H ARG 50 99.073 -31.378 5.705 402 HA ARG 50 HA ARG 50 98.921 -33.309 3.698 403 HB2 ARG 50 HB2 ARG 50 96.432 -31.736 4.410 404 HB3 ARG 50 HB3 ARG 50 96.615 -33.489 4.160 405 HG2 ARG 50 HG3 ARG 50 98.172 -33.442 6.225 406 HG3 ARG 50 HG2 ARG 50 97.514 -31.816 6.532 407 HD2 ARG 50 HD2 ARG 50 96.208 -33.469 7.785 408 HD3 ARG 50 HD3 ARG 50 95.202 -32.790 6.484 409 HE ARG 50 HE ARG 50 96.609 -35.235 5.650 410 HH11 ARG 50 HH11 ARG 50 95.278 -37.036 5.329 411 HH12 ARG 50 HH12 ARG 50 93.648 -37.042 5.962 412 HH21 ARG 50 HH21 ARG 50 93.898 -33.857 7.346 413 HH22 ARG 50 HH22 ARG 50 92.870 -35.251 7.098 414 H ASN 51 H ASN 51 98.181 -29.851 3.413 415 HA ASN 51 HA ASN 51 97.130 -30.144 0.669 416 HB2 ASN 51 HB3 ASN 51 96.502 -28.272 2.260 417 HB3 ASN 51 HB2 ASN 51 98.150 -27.630 2.061 418 HD21 ASN 51 HD21 ASN 51 96.307 -25.854 1.231 419 HD22 ASN 51 HD22 ASN 51 96.134 -25.853 -0.510 420 H GLY 52 H GLY 52 100.252 -29.598 2.203 421 HA2 GLY 52 HA3 GLY 52 101.936 -30.447 0.226 422 HA3 GLY 52 HA2 GLY 52 101.505 -28.835 -0.394 423 H ASN 53 H ASN 53 102.585 -30.388 2.679 424 HA ASN 53 HA ASN 53 104.147 -29.602 4.270 425 HB2 ASN 53 HB2 ASN 53 105.485 -29.508 2.007 426 HB3 ASN 53 HB3 ASN 53 105.276 -27.747 2.161 427 HD21 ASN 53 HD21 ASN 53 107.391 -30.243 2.937 428 HD22 ASN 53 HD22 ASN 53 108.175 -29.508 4.318 429 H LEU 54 H LEU 54 104.465 -27.819 5.719 430 HA LEU 54 HA LEU 54 102.376 -26.034 6.132 431 HB2 LEU 54 HB2 LEU 54 105.325 -25.327 6.490 432 HB3 LEU 54 HB3 LEU 54 103.952 -24.573 7.334 433 HG LEU 54 HG LEU 54 104.353 -27.569 7.466 434 HD11 LEU 54 HD11 LEU 54 106.523 -26.554 8.100 435 HD12 LEU 54 HD12 LEU 54 105.699 -27.239 9.521 436 HD13 LEU 54 HD13 LEU 54 105.686 -25.480 9.247 437 HD21 LEU 54 HD21 LEU 54 103.204 -27.238 9.640 438 HD22 LEU 54 HD22 LEU 54 102.250 -26.554 8.302 439 HD23 LEU 54 HD23 LEU 54 103.191 -25.480 9.365 440 H GLN 55 H GLN 55 101.406 -24.678 4.690 441 HA GLN 55 HA GLN 55 103.196 -23.347 2.654 442 HB2 GLN 55 HB3 GLN 55 101.497 -24.527 1.511 443 HB3 GLN 55 HB2 GLN 55 100.254 -24.070 2.700 444 HG2 GLN 55 HG3 GLN 55 100.018 -21.915 1.828 445 HG3 GLN 55 HG2 GLN 55 101.664 -21.898 1.151 446 HE21 GLN 55 HE21 GLN 55 101.697 -24.307 -0.327 447 HE22 GLN 55 HE22 GLN 55 100.498 -24.211 -1.597 448 H TYR 56 H TYR 56 103.920 -21.535 3.777 449 HA TYR 56 HA TYR 56 102.064 -19.818 5.301 450 HB2 TYR 56 HB2 TYR 56 104.930 -19.528 4.315 451 HB3 TYR 56 HB3 TYR 56 104.083 -18.203 5.147 452 HD1 TYR 56 HD1 TYR 56 104.833 -21.870 5.527 453 HD2 TYR 56 HD2 TYR 56 104.155 -18.102 7.476 454 HE1 TYR 56 HE1 TYR 56 105.372 -22.904 7.716 455 HE2 TYR 56 HE2 TYR 56 104.694 -19.137 9.664 456 HH TYR 56 HH TYR 56 104.588 -22.098 10.398 457 H ASP 57 H ASP 57 100.488 -18.736 4.154 458 HA ASP 57 HA ASP 57 101.041 -17.895 1.357 459 HB2 ASP 57 HB3 ASP 57 98.775 -18.727 2.376 460 HB3 ASP 57 HB2 ASP 57 98.622 -17.057 2.974 461 H LEU 58 H LEU 58 101.847 -15.942 0.789 462 HA LEU 58 HA LEU 58 102.108 -13.873 2.958 463 HB2 LEU 58 HB3 LEU 58 103.618 -14.622 0.523 464 HB3 LEU 58 HB2 LEU 58 103.389 -12.867 0.711 465 HG LEU 58 HG LEU 58 104.214 -13.100 3.096 466 HD11 LEU 58 HD11 LEU 58 103.751 -15.490 3.405 467 HD12 LEU 58 HD12 LEU 58 104.881 -15.904 2.093 468 HD13 LEU 58 HD13 LEU 58 105.495 -15.193 3.605 469 HD21 LEU 58 HD21 LEU 58 105.625 -12.547 0.955 470 HD22 LEU 58 HD22 LEU 58 106.484 -12.968 2.456 471 HD23 LEU 58 HD23 LEU 58 106.290 -14.184 1.170 472 H HIS 59 H HIS 59 100.597 -12.286 3.030 473 HA HIS 59 HA HIS 59 99.438 -11.371 0.393 474 HB2 HIS 59 HB2 HIS 59 97.971 -12.148 2.938 475 HB3 HIS 59 HB3 HIS 59 97.244 -11.057 1.735 476 HD2 HIS 59 HD2 HIS 59 98.976 -14.667 1.456 477 HE1 HIS 59 HE1 HIS 59 95.641 -14.493 -1.126 478 H TYR 60 H TYR 60 100.253 -9.323 0.237 479 HA TYR 60 HA TYR 60 100.239 -7.652 2.752 480 HB2 TYR 60 HB2 TYR 60 101.517 -6.064 0.989 481 HB3 TYR 60 HB3 TYR 60 102.365 -7.328 1.910 482 HD1 TYR 60 HD1 TYR 60 101.853 -6.019 -1.302 483 HD2 TYR 60 HD2 TYR 60 102.198 -9.765 0.769 484 HE1 TYR 60 HE1 TYR 60 102.499 -7.130 -3.422 485 HE2 TYR 60 HE2 TYR 60 102.839 -10.878 -1.351 486 HH TYR 60 HH TYR 60 102.325 -10.192 -4.044 487 H TRP 61 H TRP 61 98.534 -6.305 2.983 488 HA TRP 61 HA TRP 61 96.916 -5.695 0.531 489 HB2 TRP 61 HB2 TRP 61 95.655 -6.554 2.424 490 HB3 TRP 61 HB3 TRP 61 96.357 -5.324 3.503 491 HD1 TRP 61 HD1 TRP 61 93.997 -5.654 0.476 492 HE1 TRP 61 HE1 TRP 61 92.435 -3.605 0.392 493 HE3 TRP 61 HE3 TRP 61 96.045 -2.916 4.268 494 HZ2 TRP 61 HZ2 TRP 61 92.129 -1.107 1.802 495 HZ3 TRP 61 HZ3 TRP 61 95.100 -0.708 4.877 496 HH2 TRP 61 HH2 TRP 61 93.148 0.201 3.648 497 H LEU 62 H LEU 62 97.035 -3.776 -0.443 498 HA LEU 62 HA LEU 62 98.160 -1.455 1.144 499 HB2 LEU 62 HB2 LEU 62 98.398 -1.550 -1.856 500 HB3 LEU 62 HB3 LEU 62 99.484 -0.809 -0.658 501 HG LEU 62 HG LEU 62 99.139 -3.820 -0.983 502 HD11 LEU 62 HD11 LEU 62 100.082 -2.821 -3.049 503 HD12 LEU 62 HD12 LEU 62 101.307 -1.970 -2.078 504 HD13 LEU 62 HD13 LEU 62 101.318 -3.748 -2.166 505 HD21 LEU 62 HD21 LEU 62 99.961 -3.034 1.223 506 HD22 LEU 62 HD22 LEU 62 101.237 -2.094 0.413 507 HD23 LEU 62 HD23 LEU 62 101.248 -3.872 0.324 508 H GLY 63 H GLY 63 96.407 -0.164 1.565 509 HA2 GLY 63 HA2 GLY 63 93.965 -0.187 0.045 510 HA3 GLY 63 HA3 GLY 63 94.471 1.126 1.135 511 H ASN 64 H ASN 64 96.819 0.494 -1.235 512 HA ASN 64 HA ASN 64 97.425 1.653 -3.205 513 HB2 ASN 64 HB3 ASN 64 94.903 1.013 -3.716 514 HB3 ASN 64 HB2 ASN 64 94.627 2.755 -3.474 515 HD21 ASN 64 HD21 ASN 64 94.069 2.615 -5.909 516 HD22 ASN 64 HD22 ASN 64 95.401 2.760 -7.034 517 H GLU 65 H GLU 65 96.446 3.020 -0.364 518 HA GLU 65 HA GLU 65 96.924 5.830 -1.376 519 HB2 GLU 65 HB2 GLU 65 95.346 4.644 0.878 520 HB3 GLU 65 HB3 GLU 65 96.159 6.194 1.201 521 HG2 GLU 65 HG2 GLU 65 94.492 5.762 -1.301 522 HG3 GLU 65 HG3 GLU 65 93.756 6.291 0.231 523 H CYS 66 H CYS 66 98.734 3.367 -0.461 524 HA CYS 66 HA CYS 66 100.366 4.919 1.549 525 HB2 CYS 66 HB3 CYS 66 99.647 2.509 2.022 526 HB3 CYS 66 HB2 CYS 66 100.725 2.019 0.692 527 HG CYS 66 HG CYS 66 102.044 1.717 3.274 528 H SER 67 H SER 67 102.560 5.372 1.120 529 HA SER 67 HA SER 67 103.213 5.603 -1.747 530 HB2 SER 67 HB3 SER 67 104.636 6.299 0.840 531 HB3 SER 67 HB2 SER 67 105.468 6.413 -0.729 532 HG SER 67 HG SER 67 104.414 8.391 -0.135 533 H GLN 68 H GLN 68 105.355 4.784 -2.592 534 HA GLN 68 HA GLN 68 105.520 1.903 -2.165 535 HB2 GLN 68 HB2 GLN 68 107.684 3.600 -3.452 536 HB3 GLN 68 HB3 GLN 68 107.210 1.928 -3.837 537 HG2 GLN 68 HG2 GLN 68 104.950 2.825 -4.555 538 HG3 GLN 68 HG3 GLN 68 105.606 4.467 -4.357 539 HE21 GLN 68 HE21 GLN 68 104.842 2.556 -6.811 540 HE22 GLN 68 HE22 GLN 68 106.200 2.807 -7.885 541 H ASP 69 H ASP 69 106.701 4.525 -0.375 542 HA ASP 69 HA ASP 69 109.282 3.434 0.434 543 HB2 ASP 69 HB2 ASP 69 108.754 5.801 0.769 544 HB3 ASP 69 HB3 ASP 69 107.387 5.376 1.827 545 H GLU 70 H GLU 70 106.103 3.527 2.150 546 HA GLU 70 HA GLU 70 107.127 1.463 4.044 547 HB2 GLU 70 HB2 GLU 70 104.259 2.412 3.934 548 HB3 GLU 70 HB3 GLU 70 105.232 1.936 5.345 549 HG2 GLU 70 HG3 GLU 70 106.651 3.969 5.014 550 HG3 GLU 70 HG2 GLU 70 105.598 4.457 3.664 551 H SER 71 H SER 71 104.746 1.776 1.415 552 HA SER 71 HA SER 71 103.536 -0.812 1.691 553 HB2 SER 71 HB2 SER 71 102.735 1.011 0.168 554 HB3 SER 71 HB3 SER 71 104.134 0.702 -0.889 555 HG SER 71 HG SER 71 102.982 -0.851 -1.732 556 H GLY 72 H GLY 72 106.242 0.176 -0.481 557 HA2 GLY 72 HA2 GLY 72 106.847 -2.488 -1.370 558 HA3 GLY 72 HA3 GLY 72 108.006 -1.138 -1.349 559 H ALA 73 H ALA 73 108.385 -0.567 1.267 560 HA ALA 73 HA ALA 73 110.221 -2.465 2.206 561 HB1 ALA 73 HB1 ALA 73 109.655 -1.543 4.544 562 HB2 ALA 73 HB2 ALA 73 108.405 -0.565 3.738 563 HB3 ALA 73 HB3 ALA 73 110.119 -0.345 3.312 564 H ALA 74 H ALA 74 106.685 -2.451 2.679 565 HA ALA 74 HA ALA 74 106.721 -4.705 4.548 566 HB1 ALA 74 HB1 ALA 74 104.397 -4.023 2.720 567 HB2 ALA 74 HB2 ALA 74 104.821 -2.975 4.095 568 HB3 ALA 74 HB3 ALA 74 104.360 -4.671 4.378 569 H ALA 75 H ALA 75 106.288 -4.370 1.018 570 HA ALA 75 HA ALA 75 105.782 -7.209 0.584 571 HB1 ALA 75 HB1 ALA 75 106.284 -6.693 -1.790 572 HB2 ALA 75 HB2 ALA 75 105.201 -5.468 -1.086 573 HB3 ALA 75 HB3 ALA 75 106.930 -5.105 -1.308 574 H ILE 76 H ILE 76 108.708 -5.212 0.796 575 HA ILE 76 HA ILE 76 110.453 -7.409 -0.134 576 HB ILE 76 HB ILE 76 111.196 -4.861 1.367 577 HG12 ILE 76 HG12 ILE 76 110.519 -5.424 -1.522 578 HG13 ILE 76 HG13 ILE 76 110.096 -4.016 -0.519 579 HG21 ILE 76 HG21 ILE 76 112.839 -6.866 1.069 580 HG22 ILE 76 HG22 ILE 76 113.396 -5.245 0.592 581 HG23 ILE 76 HG23 ILE 76 112.855 -6.401 -0.649 582 HD11 ILE 76 HD11 ILE 76 111.777 -3.177 -1.954 583 HD12 ILE 76 HD12 ILE 76 112.669 -3.567 -0.464 584 HD13 ILE 76 HD13 ILE 76 112.736 -4.673 -1.856 585 H PHE 77 H PHE 77 109.665 -5.887 3.030 586 HA PHE 77 HA PHE 77 111.453 -7.553 4.572 587 HB2 PHE 77 HB3 PHE 77 109.008 -5.897 5.151 588 HB3 PHE 77 HB2 PHE 77 109.550 -7.054 6.389 589 HD1 PHE 77 HD1 PHE 77 111.658 -5.182 3.935 590 HD2 PHE 77 HD2 PHE 77 110.477 -5.622 8.042 591 HE1 PHE 77 HE1 PHE 77 113.451 -3.612 4.619 592 HE2 PHE 77 HE2 PHE 77 112.269 -4.050 8.727 593 HZ PHE 77 HZ PHE 77 113.756 -3.044 7.014 594 H THR 78 H THR 78 108.061 -7.977 3.542 595 HA THR 78 HA THR 78 107.780 -10.515 5.010 596 HB THR 78 HB THR 78 105.941 -8.827 4.188 597 HG1 THR 78 HG1 THR 78 105.353 -10.714 5.210 598 HG21 THR 78 HG21 THR 78 104.983 -9.315 2.017 599 HG22 THR 78 HG22 THR 78 106.715 -8.983 1.780 600 HG23 THR 78 HG23 THR 78 106.120 -10.661 1.762 601 H VAL 79 H VAL 79 108.323 -9.582 1.594 602 HA VAL 79 HA VAL 79 108.322 -12.272 0.554 603 HB VAL 79 HB VAL 79 109.696 -9.719 -0.375 604 HG11 VAL 79 HG11 VAL 79 110.959 -11.693 -1.186 605 HG12 VAL 79 HG12 VAL 79 109.449 -12.408 -1.799 606 HG13 VAL 79 HG13 VAL 79 110.079 -10.907 -2.518 607 HG21 VAL 79 HG21 VAL 79 107.456 -11.179 -1.774 608 HG22 VAL 79 HG22 VAL 79 107.080 -10.198 -0.338 609 HG23 VAL 79 HG23 VAL 79 107.836 -9.441 -1.760 610 H GLN 80 H GLN 80 111.123 -10.180 1.474 611 HA GLN 80 HA GLN 80 113.070 -12.270 1.045 612 HB2 GLN 80 HB2 GLN 80 114.631 -10.835 2.113 613 HB3 GLN 80 HB3 GLN 80 113.455 -9.735 1.356 614 HG2 GLN 80 HG3 GLN 80 112.212 -9.748 3.603 615 HG3 GLN 80 HG2 GLN 80 113.652 -10.544 4.282 616 HE21 GLN 80 HE21 GLN 80 113.443 -8.275 5.541 617 HE22 GLN 80 HE22 GLN 80 114.391 -6.980 4.844 618 H LEU 81 H LEU 81 111.496 -11.157 4.108 619 HA LEU 81 HA LEU 81 112.788 -13.143 5.745 620 HB2 LEU 81 HB2 LEU 81 111.303 -11.110 6.445 621 HB3 LEU 81 HB3 LEU 81 109.936 -12.227 6.223 622 HG LEU 81 HG LEU 81 110.723 -12.224 8.579 623 HD11 LEU 81 HD11 LEU 81 110.664 -14.558 8.859 624 HD12 LEU 81 HD12 LEU 81 111.622 -14.857 7.389 625 HD13 LEU 81 HD13 LEU 81 109.922 -14.347 7.254 626 HD21 LEU 81 HD21 LEU 81 112.924 -12.611 9.214 627 HD22 LEU 81 HD22 LEU 81 113.282 -13.583 7.766 628 HD23 LEU 81 HD23 LEU 81 113.206 -11.809 7.650 629 H ASP 82 H ASP 82 109.564 -13.208 4.129 630 HA ASP 82 HA ASP 82 108.729 -15.776 4.861 631 HB2 ASP 82 HB2 ASP 82 107.259 -14.654 3.406 632 HB3 ASP 82 HB3 ASP 82 108.549 -14.271 2.241 633 H ASP 83 H ASP 83 111.137 -14.925 2.334 634 HA ASP 83 HA ASP 83 111.646 -17.655 1.541 635 HB2 ASP 83 HB3 ASP 83 112.495 -15.498 0.418 636 HB3 ASP 83 HB2 ASP 83 113.751 -15.461 1.678 637 H TYR 84 H TYR 84 112.858 -15.607 4.176 638 HA TYR 84 HA TYR 84 114.787 -17.606 5.121 639 HB2 TYR 84 HB2 TYR 84 115.202 -15.353 5.801 640 HB3 TYR 84 HB3 TYR 84 113.527 -15.132 6.360 641 HD1 TYR 84 HD1 TYR 84 116.863 -16.189 7.266 642 HD2 TYR 84 HD2 TYR 84 112.718 -16.545 8.342 643 HE1 TYR 84 HE1 TYR 84 117.515 -16.970 9.526 644 HE2 TYR 84 HE2 TYR 84 113.372 -17.326 10.602 645 HH TYR 84 HH TYR 84 116.368 -18.438 11.391 646 H LEU 85 H LEU 85 111.348 -17.073 5.455 647 HA LEU 85 HA LEU 85 111.131 -18.745 7.890 648 HB2 LEU 85 HB3 LEU 85 109.538 -16.818 6.868 649 HB3 LEU 85 HB2 LEU 85 108.757 -18.239 6.133 650 HG LEU 85 HG LEU 85 109.335 -17.854 9.105 651 HD11 LEU 85 HD11 LEU 85 106.919 -17.483 7.341 652 HD12 LEU 85 HD12 LEU 85 106.683 -18.087 8.998 653 HD13 LEU 85 HD13 LEU 85 107.467 -16.512 8.729 654 HD21 LEU 85 HD21 LEU 85 107.789 -19.939 9.187 655 HD22 LEU 85 HD22 LEU 85 108.176 -20.129 7.461 656 HD23 LEU 85 HD23 LEU 85 109.476 -20.189 8.676 657 H ASN 86 H ASN 86 110.158 -19.112 4.437 658 HA ASN 86 HA ASN 86 110.275 -22.101 4.922 659 HB2 ASN 86 HB2 ASN 86 108.589 -22.109 2.916 660 HB3 ASN 86 HB3 ASN 86 107.988 -21.689 4.538 661 HD21 ASN 86 HD21 ASN 86 106.964 -19.682 4.758 662 HD22 ASN 86 HD22 ASN 86 107.026 -18.413 3.556 663 H GLY 87 H GLY 87 110.699 -19.467 2.542 664 HA2 GLY 87 HA2 GLY 87 112.814 -19.511 1.196 665 HA3 GLY 87 HA3 GLY 87 112.665 -21.284 1.124 666 H ARG 88 H ARG 88 109.574 -20.494 0.876 667 HA ARG 88 HA ARG 88 109.586 -19.565 -1.963 668 HB2 ARG 88 HB2 ARG 88 108.795 -22.348 -1.058 669 HB3 ARG 88 HB3 ARG 88 108.035 -21.605 -2.485 670 HG2 ARG 88 HG3 ARG 88 110.351 -21.169 -3.400 671 HG3 ARG 88 HG2 ARG 88 111.009 -22.106 -2.037 672 HD2 ARG 88 HD2 ARG 88 110.105 -24.122 -2.814 673 HD3 ARG 88 HD3 ARG 88 108.834 -23.307 -3.756 674 HE ARG 88 HE ARG 88 111.550 -23.933 -4.691 675 HH11 ARG 88 HH11 ARG 88 112.028 -23.230 -6.783 676 HH12 ARG 88 HH12 ARG 88 111.014 -22.033 -7.557 677 HH21 ARG 88 HH21 ARG 88 108.851 -21.738 -4.846 678 HH22 ARG 88 HH22 ARG 88 109.223 -21.192 -6.465 679 H ALA 89 H ALA 89 107.125 -21.448 -0.192 680 HA ALA 89 HA ALA 89 104.947 -20.813 0.472 681 HB1 ALA 89 HB1 ALA 89 106.760 -18.639 1.291 682 HB2 ALA 89 HB2 ALA 89 105.430 -19.409 2.190 683 HB3 ALA 89 HB3 ALA 89 105.084 -18.090 1.046 684 H VAL 90 H VAL 90 103.120 -19.182 -0.048 685 HA VAL 90 HA VAL 90 103.341 -18.553 -2.983 686 HB VAL 90 HB VAL 90 100.840 -18.446 -1.253 687 HG11 VAL 90 HG11 VAL 90 100.740 -17.396 -3.497 688 HG12 VAL 90 HG12 VAL 90 101.332 -18.906 -4.230 689 HG13 VAL 90 HG13 VAL 90 99.739 -18.867 -3.436 690 HG21 VAL 90 HG21 VAL 90 100.533 -20.813 -2.397 691 HG22 VAL 90 HG22 VAL 90 101.483 -20.672 -0.898 692 HG23 VAL 90 HG23 VAL 90 102.311 -20.789 -2.469 693 H GLN 91 H GLN 91 102.752 -16.458 -3.786 694 HA GLN 91 HA GLN 91 102.900 -14.315 -1.649 695 HB2 GLN 91 HB2 GLN 91 103.890 -12.872 -3.387 696 HB3 GLN 91 HB3 GLN 91 104.836 -14.370 -3.213 697 HG2 GLN 91 HG3 GLN 91 103.450 -15.331 -5.128 698 HG3 GLN 91 HG2 GLN 91 102.805 -13.691 -5.378 699 HE21 GLN 91 HE21 GLN 91 105.907 -15.543 -5.246 700 HE22 GLN 91 HE22 GLN 91 106.768 -14.456 -6.312 701 H HIS 92 H HIS 92 101.485 -12.531 -1.814 702 HA HIS 92 HA HIS 92 99.462 -12.575 -4.028 703 HB2 HIS 92 HB2 HIS 92 98.860 -12.933 -1.073 704 HB3 HIS 92 HB3 HIS 92 97.657 -12.249 -2.191 705 HD2 HIS 92 HD2 HIS 92 99.812 -15.620 -2.045 706 HE1 HIS 92 HE1 HIS 92 96.132 -16.386 -3.971 707 H ARG 93 H ARG 93 99.287 -10.513 -4.741 708 HA ARG 93 HA ARG 93 99.964 -8.310 -2.778 709 HB2 ARG 93 HB3 ARG 93 100.642 -6.979 -4.696 710 HB3 ARG 93 HB2 ARG 93 101.442 -8.564 -4.815 711 HG2 ARG 93 HG3 ARG 93 99.281 -9.211 -6.208 712 HG3 ARG 93 HG2 ARG 93 99.152 -7.450 -6.437 713 HD2 ARG 93 HD2 ARG 93 101.543 -7.441 -7.232 714 HD3 ARG 93 HD3 ARG 93 101.534 -9.219 -7.142 715 HE ARG 93 HE ARG 93 100.226 -9.277 -9.132 716 HH11 ARG 93 HH11 ARG 93 99.179 -8.252 -10.852 717 HH12 ARG 93 HH12 ARG 93 98.849 -6.536 -10.777 718 HH21 ARG 93 HH21 ARG 93 100.285 -6.137 -7.631 719 HH22 ARG 93 HH22 ARG 93 99.473 -5.344 -8.962 720 H GLU 94 H GLU 94 98.213 -7.200 -2.081 721 HA GLU 94 HA GLU 94 95.857 -7.011 -3.977 722 HB2 GLU 94 HB2 GLU 94 95.604 -6.520 -1.014 723 HB3 GLU 94 HB3 GLU 94 94.398 -7.146 -2.163 724 HG2 GLU 94 HG2 GLU 94 95.021 -9.061 -0.917 725 HG3 GLU 94 HG3 GLU 94 96.002 -9.191 -2.396 726 H VAL 95 H VAL 95 96.264 -5.064 -4.999 727 HA VAL 95 HA VAL 95 97.175 -2.728 -3.384 728 HB VAL 95 HB VAL 95 96.281 -2.597 -6.273 729 HG11 VAL 95 HG11 VAL 95 96.960 -0.526 -5.087 730 HG12 VAL 95 HG12 VAL 95 98.516 -1.280 -4.664 731 HG13 VAL 95 HG13 VAL 95 98.126 -0.940 -6.367 732 HG21 VAL 95 HG21 VAL 95 98.798 -3.173 -6.717 733 HG22 VAL 95 HG22 VAL 95 97.658 -4.508 -6.420 734 HG23 VAL 95 HG23 VAL 95 98.733 -3.949 -5.116 735 H GLN 96 H GLN 96 94.612 -3.823 -2.641 736 HA GLN 96 HA GLN 96 92.513 -2.904 -2.033 737 HB2 GLN 96 HB2 GLN 96 93.992 -0.697 -2.165 738 HB3 GLN 96 HB3 GLN 96 93.037 -0.407 -3.639 739 HG2 GLN 96 HG2 GLN 96 90.948 -0.827 -2.256 740 HG3 GLN 96 HG3 GLN 96 91.986 -0.849 -0.811 741 HE21 GLN 96 HE21 GLN 96 90.655 1.125 -0.161 742 HE22 GLN 96 HE22 GLN 96 91.135 2.679 -0.806 743 H GLY 97 H GLY 97 91.016 -4.092 -3.135 744 HA2 GLY 97 HA2 GLY 97 89.254 -4.168 -4.800 745 HA3 GLY 97 HA3 GLY 97 90.180 -3.037 -5.815 746 H PHE 98 H PHE 98 92.699 -4.596 -5.441 747 HA PHE 98 HA PHE 98 92.051 -6.706 -7.483 748 HB2 PHE 98 HB2 PHE 98 93.984 -4.838 -7.556 749 HB3 PHE 98 HB3 PHE 98 94.869 -6.083 -6.644 750 HD1 PHE 98 HD1 PHE 98 93.213 -5.266 -9.846 751 HD2 PHE 98 HD2 PHE 98 95.422 -8.230 -7.658 752 HE1 PHE 98 HE1 PHE 98 93.613 -6.519 -11.949 753 HE2 PHE 98 HE2 PHE 98 95.823 -9.483 -9.761 754 HZ PHE 98 HZ PHE 98 94.919 -8.627 -11.907 755 H GLU 99 H GLU 99 91.312 -7.176 -4.729 756 HA GLU 99 HA GLU 99 93.311 -8.731 -3.331 757 HB2 GLU 99 HB3 GLU 99 90.266 -8.911 -3.298 758 HB3 GLU 99 HB2 GLU 99 91.339 -9.731 -2.139 759 HG2 GLU 99 HG3 GLU 99 90.523 -7.601 -1.196 760 HG3 GLU 99 HG2 GLU 99 92.279 -7.524 -1.473 761 H SER 100 H SER 100 92.140 -11.229 -2.864 762 HA SER 100 HA SER 100 92.124 -12.492 -5.612 763 HB2 SER 100 HB3 SER 100 93.824 -13.166 -3.198 764 HB3 SER 100 HB2 SER 100 93.401 -14.422 -4.386 765 HG SER 100 HG SER 100 95.375 -13.326 -4.915 766 H ALA 101 H ALA 101 91.734 -15.112 -4.913 767 HA ALA 101 HA ALA 101 88.944 -15.030 -3.969 768 HB1 ALA 101 HB1 ALA 101 89.016 -17.483 -4.323 769 HB2 ALA 101 HB2 ALA 101 89.682 -16.614 -5.726 770 HB3 ALA 101 HB3 ALA 101 90.777 -17.397 -4.562 771 H THR 102 H THR 102 91.821 -16.854 -2.796 772 HA THR 102 HA THR 102 90.667 -17.629 -0.302 773 HB THR 102 HB THR 102 93.577 -16.953 -0.923 774 HG1 THR 102 HG1 THR 102 93.659 -19.244 -1.267 775 HG21 THR 102 HG21 THR 102 92.744 -17.170 1.553 776 HG22 THR 102 HG22 THR 102 94.171 -18.105 1.046 777 HG23 THR 102 HG23 THR 102 92.584 -18.901 1.172 778 H PHE 103 H PHE 103 92.320 -14.622 -1.252 779 HA PHE 103 HA PHE 103 92.428 -13.520 1.440 780 HB2 PHE 103 HB2 PHE 103 93.779 -12.658 -0.477 781 HB3 PHE 103 HB3 PHE 103 92.284 -12.060 -1.238 782 HD1 PHE 103 HD1 PHE 103 90.872 -10.361 0.024 783 HD2 PHE 103 HD2 PHE 103 94.859 -11.411 1.229 784 HE1 PHE 103 HE1 PHE 103 91.007 -8.291 1.383 785 HE2 PHE 103 HE2 PHE 103 94.994 -9.342 2.590 786 HZ PHE 103 HZ PHE 103 93.066 -7.782 2.668 787 H LEU 104 H LEU 104 90.080 -13.149 -1.257 788 HA LEU 104 HA LEU 104 88.325 -11.422 0.350 789 HB2 LEU 104 HB3 LEU 104 87.884 -12.983 -2.230 790 HB3 LEU 104 HB2 LEU 104 86.677 -11.889 -1.513 791 HG LEU 104 HG LEU 104 89.521 -11.056 -2.239 792 HD11 LEU 104 HD11 LEU 104 88.471 -9.912 -4.172 793 HD12 LEU 104 HD12 LEU 104 86.896 -10.611 -3.729 794 HD13 LEU 104 HD13 LEU 104 88.223 -11.673 -4.257 795 HD21 LEU 104 HD21 LEU 104 88.429 -9.721 -0.454 796 HD22 LEU 104 HD22 LEU 104 87.017 -9.468 -1.507 797 HD23 LEU 104 HD23 LEU 104 88.594 -8.772 -1.951 798 H GLY 105 H GLY 105 88.986 -14.760 0.355 799 HA2 GLY 105 HA2 GLY 105 86.230 -15.566 1.142 800 HA3 GLY 105 HA3 GLY 105 87.658 -16.626 1.073 801 H TYR 106 H TYR 106 89.407 -15.008 2.679 802 HA TYR 106 HA TYR 106 88.366 -15.789 5.337 803 HB2 TYR 106 HB3 TYR 106 90.863 -15.750 4.329 804 HB3 TYR 106 HB2 TYR 106 90.844 -14.119 5.042 805 HD1 TYR 106 HD1 TYR 106 90.517 -17.745 5.755 806 HD2 TYR 106 HD2 TYR 106 90.753 -13.799 7.436 807 HE1 TYR 106 HE1 TYR 106 90.870 -18.723 8.004 808 HE2 TYR 106 HE2 TYR 106 91.104 -14.779 9.686 809 HH TYR 106 HH TYR 106 92.051 -17.066 10.591 810 H PHE 107 H PHE 107 88.883 -12.793 3.498 811 HA PHE 107 HA PHE 107 87.881 -11.237 5.882 812 HB2 PHE 107 HB2 PHE 107 89.218 -10.349 3.289 813 HB3 PHE 107 HB3 PHE 107 88.630 -9.239 4.551 814 HD1 PHE 107 HD1 PHE 107 89.542 -9.560 6.939 815 HD2 PHE 107 HD2 PHE 107 91.346 -11.343 3.473 816 HE1 PHE 107 HE1 PHE 107 91.651 -9.881 8.203 817 HE2 PHE 107 HE2 PHE 107 93.457 -11.665 4.737 818 HZ PHE 107 HZ PHE 107 93.609 -10.933 7.102 819 H LYS 108 H LYS 108 85.674 -11.213 5.866 820 HA LYS 108 HA LYS 108 84.291 -10.939 3.209 821 HB2 LYS 108 HB2 LYS 108 83.530 -12.732 4.770 822 HB3 LYS 108 HB3 LYS 108 83.144 -11.487 5.983 823 HG2 LYS 108 HG3 LYS 108 81.317 -10.690 4.784 824 HG3 LYS 108 HG2 LYS 108 82.001 -11.178 3.215 825 HD2 LYS 108 HD2 LYS 108 80.128 -12.647 3.722 826 HD3 LYS 108 HD3 LYS 108 81.632 -13.585 3.881 827 HE2 LYS 108 HE3 LYS 108 80.201 -14.072 5.799 828 HE3 LYS 108 HE2 LYS 108 81.593 -13.113 6.357 829 HZ1 LYS 108 HZ1 LYS 108 79.520 -12.272 7.241 830 HZ2 LYS 108 HZ2 LYS 108 80.205 -11.153 6.241 831 HZ3 LYS 108 HZ3 LYS 108 78.915 -12.041 5.724 832 H SER 109 H SER 109 85.334 -9.069 5.879 833 HA SER 109 HA SER 109 83.237 -7.174 6.205 834 HB2 SER 109 HB3 SER 109 86.186 -6.440 6.058 835 HB3 SER 109 HB2 SER 109 84.911 -5.661 7.025 836 HG SER 109 HG SER 109 86.203 -7.129 8.273 837 H GLY 110 H GLY 110 85.670 -7.466 3.625 838 HA2 GLY 110 HA2 GLY 110 85.264 -6.670 1.370 839 HA3 GLY 110 HA3 GLY 110 83.981 -5.604 1.990 840 H LEU 111 H LEU 111 87.262 -5.894 3.346 841 HA LEU 111 HA LEU 111 88.886 -4.220 3.661 842 HB2 LEU 111 HB3 LEU 111 87.865 -3.547 0.879 843 HB3 LEU 111 HB2 LEU 111 89.260 -2.737 1.630 844 HG LEU 111 HG LEU 111 89.950 -4.642 0.172 845 HD11 LEU 111 HD11 LEU 111 90.445 -5.460 3.047 846 HD12 LEU 111 HD12 LEU 111 91.568 -5.489 1.666 847 HD13 LEU 111 HD13 LEU 111 91.111 -3.937 2.410 848 HD21 LEU 111 HD21 LEU 111 89.251 -6.855 0.547 849 HD22 LEU 111 HD22 LEU 111 87.761 -5.932 0.852 850 HD23 LEU 111 HD23 LEU 111 88.742 -6.515 2.218 851 H LYS 112 H LYS 112 88.238 -2.954 5.301 852 HA LYS 112 HA LYS 112 86.124 -0.885 4.797 853 HB2 LYS 112 HB3 LYS 112 86.605 -2.503 6.969 854 HB3 LYS 112 HB2 LYS 112 87.449 -1.014 7.457 855 HG2 LYS 112 HG2 LYS 112 85.272 -0.601 8.224 856 HG3 LYS 112 HG3 LYS 112 85.243 0.174 6.622 857 HD2 LYS 112 HD3 LYS 112 84.453 -2.191 5.784 858 HD3 LYS 112 HD2 LYS 112 84.027 -2.456 7.491 859 HE2 LYS 112 HE2 LYS 112 82.810 -0.171 7.347 860 HE3 LYS 112 HE3 LYS 112 82.962 -0.348 5.583 861 HZ1 LYS 112 HZ1 LYS 112 80.890 -1.262 6.394 862 HZ2 LYS 112 HZ2 LYS 112 81.829 -2.462 5.763 863 HZ3 LYS 112 HZ3 LYS 112 81.689 -2.298 7.399 864 H TYR 113 H TYR 113 86.763 1.094 4.139 865 HA TYR 113 HA TYR 113 89.616 1.866 4.374 866 HB2 TYR 113 HB3 TYR 113 87.391 3.717 3.487 867 HB3 TYR 113 HB2 TYR 113 89.079 3.643 2.927 868 HD1 TYR 113 HD1 TYR 113 85.993 3.203 1.684 869 HD2 TYR 113 HD2 TYR 113 89.536 0.855 2.318 870 HE1 TYR 113 HE1 TYR 113 85.317 1.684 -0.156 871 HE2 TYR 113 HE2 TYR 113 88.857 -0.663 0.479 872 HH TYR 113 HH TYR 113 85.818 -0.828 -0.774 873 H LYS 114 H LYS 114 90.277 2.490 6.385 874 HA LYS 114 HA LYS 114 88.463 4.411 7.868 875 HB2 LYS 114 HB2 LYS 114 89.123 2.064 8.872 876 HB3 LYS 114 HB3 LYS 114 90.692 2.843 9.185 877 HG2 LYS 114 HG2 LYS 114 89.403 4.732 10.313 878 HG3 LYS 114 HG3 LYS 114 87.951 3.709 10.193 879 HD2 LYS 114 HD2 LYS 114 89.260 1.889 11.397 880 HD3 LYS 114 HD3 LYS 114 90.535 3.096 11.688 881 HE2 LYS 114 HE3 LYS 114 88.607 4.568 12.657 882 HE3 LYS 114 HE2 LYS 114 87.690 3.044 12.736 883 HZ1 LYS 114 HZ1 LYS 114 88.886 3.470 14.777 884 HZ2 LYS 114 HZ2 LYS 114 90.326 3.525 13.974 885 HZ3 LYS 114 HZ3 LYS 114 89.476 2.114 14.048 886 H LYS 115 H LYS 115 89.224 6.439 7.450 887 HA LYS 115 HA LYS 115 91.936 7.031 6.675 888 HB2 LYS 115 HB2 LYS 115 89.630 8.655 7.760 889 HB3 LYS 115 HB3 LYS 115 91.234 9.407 7.585 890 HG2 LYS 115 HG3 LYS 115 91.268 9.062 5.238 891 HG3 LYS 115 HG2 LYS 115 89.972 7.845 5.310 892 HD2 LYS 115 HD3 LYS 115 88.294 9.457 5.603 893 HD3 LYS 115 HD2 LYS 115 89.430 10.668 6.246 894 HE2 LYS 115 HE2 LYS 115 88.534 10.946 3.794 895 HE3 LYS 115 HE3 LYS 115 90.267 11.202 4.110 896 HZ1 LYS 115 HZ1 LYS 115 89.571 9.665 2.206 897 HZ2 LYS 115 HZ2 LYS 115 89.266 8.546 3.379 898 HZ3 LYS 115 HZ3 LYS 115 90.785 9.165 3.205 899 H GLY 116 H GLY 116 93.687 6.629 7.929 900 HA2 GLY 116 HA2 GLY 116 93.488 7.434 10.842 901 HA3 GLY 116 HA3 GLY 116 94.301 5.930 10.348 902 H GLY 117 H GLY 117 95.320 8.478 11.681 903 HA2 GLY 117 HA3 GLY 117 97.626 9.241 11.575 904 HA3 GLY 117 HA2 GLY 117 97.688 8.770 9.859 905 H VAL 118 H VAL 118 95.022 10.078 9.358 906 HA VAL 118 HA VAL 118 95.953 12.606 8.420 907 HB VAL 118 HB VAL 118 93.362 13.176 8.652 908 HG11 VAL 118 HG11 VAL 118 94.552 12.643 6.541 909 HG12 VAL 118 HG12 VAL 118 94.429 10.907 6.911 910 HG13 VAL 118 HG13 VAL 118 92.957 11.856 6.592 911 HG21 VAL 118 HG21 VAL 118 91.941 11.313 9.023 912 HG22 VAL 118 HG22 VAL 118 93.272 10.148 8.834 913 HG23 VAL 118 HG23 VAL 118 93.178 11.162 10.293 914 H ALA 119 H ALA 119 94.624 11.667 11.570 915 HA ALA 119 HA ALA 119 94.082 14.256 12.634 916 HB1 ALA 119 HB1 ALA 119 94.515 13.240 14.853 917 HB2 ALA 119 HB2 ALA 119 95.302 11.852 14.063 918 HB3 ALA 119 HB3 ALA 119 93.563 12.145 13.823 919 H SER 120 H SER 120 97.164 12.542 12.204 920 HA SER 120 HA SER 120 98.555 14.999 13.287 921 HB2 SER 120 HB3 SER 120 99.347 12.076 13.162 922 HB3 SER 120 HB2 SER 120 100.576 13.353 13.330 923 HG SER 120 HG SER 120 99.808 12.583 15.378 924 H GLY 121 H GLY 121 97.491 13.829 10.502 925 HA2 GLY 121 HA2 GLY 121 99.917 13.959 8.845 926 HA3 GLY 121 HA3 GLY 121 98.239 13.916 8.252 927 H PHE 122 H PHE 122 97.542 16.247 10.056 928 HA PHE 122 HA PHE 122 98.292 18.339 8.099 929 HB2 PHE 122 HB2 PHE 122 96.817 18.660 10.747 930 HB3 PHE 122 HB3 PHE 122 96.791 19.767 9.353 931 HD1 PHE 122 HD1 PHE 122 95.892 18.848 7.119 932 HD2 PHE 122 HD2 PHE 122 95.267 16.892 10.893 933 HE1 PHE 122 HE1 PHE 122 93.995 17.580 6.149 934 HE2 PHE 122 HE2 PHE 122 93.370 15.624 9.921 935 HZ PHE 122 HZ PHE 122 92.733 15.970 7.549 936 H LYS 123 H LYS 123 99.421 17.190 11.197 937 HA LYS 123 HA LYS 123 100.782 19.703 11.919 938 HB2 LYS 123 HB2 LYS 123 100.045 17.748 13.479 939 HB3 LYS 123 HB3 LYS 123 101.536 16.945 12.933 940 HG2 LYS 123 HG3 LYS 123 102.894 18.807 13.727 941 HG3 LYS 123 HG2 LYS 123 101.439 19.751 14.123 942 HD2 LYS 123 HD2 LYS 123 100.820 17.690 15.628 943 HD3 LYS 123 HD3 LYS 123 102.550 17.295 15.500 944 HE2 LYS 123 HE2 LYS 123 102.062 18.691 17.507 945 HE3 LYS 123 HE3 LYS 123 103.143 19.526 16.366 946 HZ1 LYS 123 HZ1 LYS 123 101.032 20.688 17.330 947 HZ2 LYS 123 HZ2 LYS 123 100.274 19.918 16.084 948 HZ3 LYS 123 HZ3 LYS 123 101.511 20.964 15.776 949 H HIS 124 H HIS 124 101.571 16.782 10.087 950 HA HIS 124 HA HIS 124 104.412 16.955 10.070 951 HB2 HIS 124 HB3 HIS 124 102.331 15.971 8.139 952 HB3 HIS 124 HB2 HIS 124 103.991 16.172 7.531 953 HD2 HIS 124 HD2 HIS 124 101.978 13.778 9.860 954 HE1 HIS 124 HE1 HIS 124 106.023 12.574 10.014 955 HE2 HIS 124 HE2 HIS 124 103.646 11.927 10.686 956 H VAL 125 H VAL 125 105.366 17.487 7.562 957 HA VAL 125 HA VAL 125 104.991 20.468 7.441 958 HB VAL 125 HB VAL 125 107.093 18.577 6.307 959 HG11 VAL 125 HG11 VAL 125 108.221 20.801 5.657 960 HG12 VAL 125 HG12 VAL 125 106.620 21.549 5.869 961 HG13 VAL 125 HG13 VAL 125 106.854 20.280 4.643 962 HG21 VAL 125 HG21 VAL 125 107.246 19.105 8.727 963 HG22 VAL 125 HG22 VAL 125 107.193 20.844 8.350 964 HG23 VAL 125 HG23 VAL 125 108.580 19.861 7.822 965 H VAL 126 H VAL 126 104.418 21.531 5.508 966 HA VAL 126 HA VAL 126 102.937 19.779 3.579 967 HB VAL 126 HB VAL 126 103.123 22.821 3.614 968 HG11 VAL 126 HG11 VAL 126 102.219 21.770 1.556 969 HG12 VAL 126 HG12 VAL 126 101.048 20.858 2.537 970 HG13 VAL 126 HG13 VAL 126 100.942 22.632 2.447 971 HG21 VAL 126 HG21 VAL 126 101.028 22.764 4.941 972 HG22 VAL 126 HG22 VAL 126 101.133 20.990 5.030 973 HG23 VAL 126 HG23 VAL 126 102.367 21.995 5.827 974 HA PRO 127 HA PRO 127 106.635 19.679 0.976 975 HB2 PRO 127 HB3 PRO 127 104.464 19.127 -1.046 976 HB3 PRO 127 HB2 PRO 127 106.012 18.272 -0.786 977 HG2 PRO 127 HG2 PRO 127 103.665 17.275 0.065 978 HG3 PRO 127 HG3 PRO 127 105.182 17.045 0.977 979 HD2 PRO 127 HD2 PRO 127 102.832 18.781 1.619 980 HD3 PRO 127 HD3 PRO 127 104.058 18.068 2.710 981 H ASN 128 H ASN 128 107.591 21.168 -0.421 982 HA ASN 128 HA ASN 128 106.670 23.803 -0.610 983 HB2 ASN 128 HB3 ASN 128 108.360 22.155 -2.522 984 HB3 ASN 128 HB2 ASN 128 108.034 23.880 -2.816 985 HD21 ASN 128 HD21 ASN 128 110.455 24.154 -2.483 986 HD22 ASN 128 HD22 ASN 128 111.053 24.257 -0.842 987 H GLU 129 H GLU 129 105.949 24.978 -2.691 988 HA GLU 129 HA GLU 129 103.428 23.696 -3.568 989 HB2 GLU 129 HB2 GLU 129 104.753 26.329 -4.358 990 HB3 GLU 129 HB3 GLU 129 103.114 25.827 -4.836 991 HG2 GLU 129 HG2 GLU 129 102.616 25.552 -2.336 992 HG3 GLU 129 HG3 GLU 129 104.154 26.395 -2.034 993 H VAL 130 H VAL 130 106.690 24.011 -4.761 994 HA VAL 130 HA VAL 130 106.383 23.902 -7.556 995 HB VAL 130 HB VAL 130 108.260 22.122 -5.940 996 HG11 VAL 130 HG11 VAL 130 109.715 22.373 -7.933 997 HG12 VAL 130 HG12 VAL 130 108.460 23.354 -8.726 998 HG13 VAL 130 HG13 VAL 130 108.155 21.637 -8.370 999 HG21 VAL 130 HG21 VAL 130 109.834 24.034 -6.069 1000 HG22 VAL 130 HG22 VAL 130 108.578 25.014 -6.864 1001 HG23 VAL 130 HG23 VAL 130 108.358 24.480 -5.180 1002 H VAL 131 H VAL 131 105.748 21.346 -5.173 1003 HA VAL 131 HA VAL 131 105.427 19.209 -7.122 1004 HB VAL 131 HB VAL 131 103.957 19.421 -4.469 1005 HG11 VAL 131 HG11 VAL 131 103.420 17.503 -5.948 1006 HG12 VAL 131 HG12 VAL 131 105.149 17.095 -6.046 1007 HG13 VAL 131 HG13 VAL 131 104.290 16.963 -4.492 1008 HG21 VAL 131 HG21 VAL 131 106.145 18.156 -3.694 1009 HG22 VAL 131 HG22 VAL 131 106.132 19.934 -3.761 1010 HG23 VAL 131 HG23 VAL 131 106.888 18.999 -5.074 1011 H VAL 132 H VAL 132 103.124 21.493 -5.587 1012 HA VAL 132 HA VAL 132 100.791 20.379 -6.933 1013 HB VAL 132 HB VAL 132 101.267 23.195 -5.858 1014 HG11 VAL 132 HG11 VAL 132 99.330 23.024 -7.397 1015 HG12 VAL 132 HG12 VAL 132 98.794 23.269 -5.718 1016 HG13 VAL 132 HG13 VAL 132 98.703 21.650 -6.454 1017 HG21 VAL 132 HG21 VAL 132 101.623 21.422 -4.159 1018 HG22 VAL 132 HG22 VAL 132 100.131 22.334 -3.829 1019 HG23 VAL 132 HG23 VAL 132 100.041 20.716 -4.565 1020 H GLN 133 H GLN 133 103.299 22.670 -7.859 1021 HA GLN 133 HA GLN 133 102.041 22.763 -10.592 1022 HB2 GLN 133 HB2 GLN 133 101.435 24.844 -9.218 1023 HB3 GLN 133 HB3 GLN 133 103.168 25.249 -9.247 1024 HG2 GLN 133 HG2 GLN 133 103.079 25.072 -11.773 1025 HG3 GLN 133 HG3 GLN 133 101.312 24.905 -11.640 1026 HE21 GLN 133 HE21 GLN 133 103.834 27.063 -10.138 1027 HE22 GLN 133 HE22 GLN 133 102.939 28.536 -10.436 Start of MODEL 15 1 H1 GLU 1 H1 GLU 1 116.175 -3.381 18.586 2 H2 GLU 1 H2 GLU 1 115.134 -3.783 19.800 3 H3 GLU 1 H3 GLU 1 115.523 -4.895 18.646 4 HA GLU 1 HA GLU 1 113.802 -2.529 18.404 5 HB2 GLU 1 HB2 GLU 1 115.119 -4.125 16.160 6 HB3 GLU 1 HB3 GLU 1 113.829 -2.919 15.938 7 HG2 GLU 1 HG2 GLU 1 115.307 -1.204 17.020 8 HG3 GLU 1 HG3 GLU 1 116.606 -2.419 17.098 9 H HIS 2 H HIS 2 113.827 -5.344 19.684 10 HA HIS 2 HA HIS 2 112.390 -7.237 19.722 11 HB2 HIS 2 HB2 HIS 2 110.935 -5.112 20.241 12 HB3 HIS 2 HB3 HIS 2 110.255 -5.394 18.621 13 HD2 HIS 2 HD2 HIS 2 110.933 -7.891 21.688 14 HE1 HIS 2 HE1 HIS 2 107.121 -8.670 20.046 15 HE2 HIS 2 HE2 HIS 2 108.780 -9.385 21.851 16 HA PRO 3 HA PRO 3 113.013 -7.627 15.020 17 HB2 PRO 3 HB3 PRO 3 113.907 -10.276 16.146 18 HB3 PRO 3 HB2 PRO 3 114.626 -9.305 14.830 19 HG2 PRO 3 HG2 PRO 3 115.704 -9.399 17.291 20 HG3 PRO 3 HG3 PRO 3 115.743 -7.919 16.293 21 HD2 PRO 3 HD3 PRO 3 114.096 -8.535 18.717 22 HD3 PRO 3 HD2 PRO 3 114.662 -6.953 18.101 23 H GLU 4 H GLU 4 110.547 -7.580 15.280 24 HA GLU 4 HA GLU 4 109.076 -9.964 15.971 25 HB2 GLU 4 HB2 GLU 4 108.497 -7.532 14.263 26 HB3 GLU 4 HB3 GLU 4 107.340 -8.883 14.321 27 HG2 GLU 4 HG2 GLU 4 107.250 -8.706 16.789 28 HG3 GLU 4 HG3 GLU 4 108.421 -7.367 16.740 29 H PHE 5 H PHE 5 110.768 -8.976 13.032 30 HA PHE 5 HA PHE 5 109.592 -10.634 11.087 31 HB2 PHE 5 HB2 PHE 5 112.583 -10.706 11.247 32 HB3 PHE 5 HB3 PHE 5 111.525 -10.315 9.870 33 HD1 PHE 5 HD1 PHE 5 113.882 -8.917 11.955 34 HD2 PHE 5 HD2 PHE 5 109.898 -8.155 10.538 35 HE1 PHE 5 HE1 PHE 5 114.182 -6.499 12.413 36 HE2 PHE 5 HE2 PHE 5 110.199 -5.736 10.998 37 HZ PHE 5 HZ PHE 5 112.339 -4.908 11.936 38 H LEU 6 H LEU 6 111.722 -11.559 13.775 39 HA LEU 6 HA LEU 6 111.834 -14.376 12.830 40 HB2 LEU 6 HB3 LEU 6 112.876 -12.880 15.256 41 HB3 LEU 6 HB2 LEU 6 112.923 -14.657 15.177 42 HG LEU 6 HG LEU 6 115.034 -13.502 14.357 43 HD11 LEU 6 HD11 LEU 6 114.437 -15.806 13.656 44 HD12 LEU 6 HD12 LEU 6 115.240 -14.923 12.336 45 HD13 LEU 6 HD13 LEU 6 113.474 -15.147 12.312 46 HD21 LEU 6 HD21 LEU 6 115.006 -12.288 12.294 47 HD22 LEU 6 HD22 LEU 6 113.658 -11.627 13.249 48 HD23 LEU 6 HD23 LEU 6 113.335 -12.786 11.938 49 H LYS 7 H LYS 7 109.834 -12.382 14.877 50 HA LYS 7 HA LYS 7 108.782 -14.533 16.546 51 HB2 LYS 7 HB2 LYS 7 108.610 -11.985 16.924 52 HB3 LYS 7 HB3 LYS 7 107.279 -12.016 15.743 53 HG2 LYS 7 HG2 LYS 7 106.360 -13.983 17.233 54 HG3 LYS 7 HG3 LYS 7 107.437 -13.302 18.477 55 HD2 LYS 7 HD3 LYS 7 106.342 -11.020 17.902 56 HD3 LYS 7 HD2 LYS 7 105.091 -11.977 17.073 57 HE2 LYS 7 HE2 LYS 7 105.705 -11.752 20.000 58 HE3 LYS 7 HE3 LYS 7 104.136 -11.916 19.176 59 HZ1 LYS 7 HZ1 LYS 7 104.521 -13.953 20.205 60 HZ2 LYS 7 HZ2 LYS 7 104.923 -14.233 18.630 61 HZ3 LYS 7 HZ3 LYS 7 106.108 -14.018 19.758 62 H ALA 8 H ALA 8 107.968 -13.241 13.347 63 HA ALA 8 HA ALA 8 105.385 -14.480 13.074 64 HB1 ALA 8 HB1 ALA 8 107.549 -13.754 11.065 65 HB2 ALA 8 HB2 ALA 8 106.033 -12.889 11.412 66 HB3 ALA 8 HB3 ALA 8 105.991 -14.456 10.569 67 H GLY 9 H GLY 9 104.750 -16.534 12.391 68 HA2 GLY 9 HA2 GLY 9 105.134 -18.771 11.558 69 HA3 GLY 9 HA3 GLY 9 106.889 -18.501 11.674 70 H LYS 10 H LYS 10 104.324 -18.030 14.136 71 HA LYS 10 HA LYS 10 105.908 -19.895 15.907 72 HB2 LYS 10 HB2 LYS 10 104.424 -18.740 17.718 73 HB3 LYS 10 HB3 LYS 10 105.755 -17.802 16.999 74 HG2 LYS 10 HG2 LYS 10 104.190 -16.741 15.425 75 HG3 LYS 10 HG3 LYS 10 102.851 -17.723 16.064 76 HD2 LYS 10 HD3 LYS 10 103.383 -16.709 18.358 77 HD3 LYS 10 HD2 LYS 10 104.437 -15.559 17.500 78 HE2 LYS 10 HE3 LYS 10 102.384 -14.403 17.600 79 HE3 LYS 10 HE2 LYS 10 102.334 -15.148 15.984 80 HZ1 LYS 10 HZ1 LYS 10 100.291 -15.515 17.197 81 HZ2 LYS 10 HZ2 LYS 10 101.101 -16.262 18.424 82 HZ3 LYS 10 HZ3 LYS 10 101.055 -16.952 16.927 83 H GLU 11 H GLU 11 102.841 -19.372 14.319 84 HA GLU 11 HA GLU 11 101.967 -22.067 15.259 85 HB2 GLU 11 HB3 GLU 11 100.499 -19.484 15.898 86 HB3 GLU 11 HB2 GLU 11 99.652 -21.047 15.811 87 HG2 GLU 11 HG2 GLU 11 101.298 -21.964 17.483 88 HG3 GLU 11 HG3 GLU 11 101.985 -20.330 17.640 89 HA PRO 12 HA PRO 12 100.415 -22.046 11.114 90 HB2 PRO 12 HB3 PRO 12 98.542 -24.050 11.282 91 HB3 PRO 12 HB2 PRO 12 100.302 -24.362 11.303 92 HG2 PRO 12 HG3 PRO 12 98.338 -24.260 13.564 93 HG3 PRO 12 HG2 PRO 12 99.717 -25.364 13.306 94 HD2 PRO 12 HD2 PRO 12 99.790 -23.179 15.017 95 HD3 PRO 12 HD3 PRO 12 101.237 -23.869 14.222 96 H GLY 13 H GLY 13 98.248 -21.980 9.846 97 HA2 GLY 13 HA2 GLY 13 95.846 -21.384 9.919 98 HA3 GLY 13 HA3 GLY 13 96.126 -20.585 11.484 99 H LEU 14 H LEU 14 95.923 -18.415 11.260 100 HA LEU 14 HA LEU 14 97.346 -17.139 8.927 101 HB2 LEU 14 HB3 LEU 14 95.016 -17.218 8.247 102 HB3 LEU 14 HB2 LEU 14 94.483 -16.615 9.833 103 HG LEU 14 HG LEU 14 96.478 -14.884 8.476 104 HD11 LEU 14 HD11 LEU 14 95.174 -15.659 6.511 105 HD12 LEU 14 HD12 LEU 14 93.663 -15.213 7.340 106 HD13 LEU 14 HD13 LEU 14 94.830 -13.951 6.876 107 HD21 LEU 14 HD21 LEU 14 95.274 -14.264 10.556 108 HD22 LEU 14 HD22 LEU 14 93.721 -14.401 9.696 109 HD23 LEU 14 HD23 LEU 14 94.888 -13.139 9.231 110 H GLN 15 H GLN 15 98.189 -15.065 9.381 111 HA GLN 15 HA GLN 15 97.741 -14.042 12.183 112 HB2 GLN 15 HB2 GLN 15 100.408 -14.625 10.835 113 HB3 GLN 15 HB3 GLN 15 100.253 -13.549 12.244 114 HG2 GLN 15 HG2 GLN 15 99.718 -15.284 13.685 115 HG3 GLN 15 HG3 GLN 15 98.955 -16.255 12.403 116 HE21 GLN 15 HE21 GLN 15 102.099 -15.314 13.835 117 HE22 GLN 15 HE22 GLN 15 103.011 -16.598 13.073 118 H ILE 16 H ILE 16 97.692 -11.800 12.305 119 HA ILE 16 HA ILE 16 98.088 -10.374 9.664 120 HB ILE 16 HB ILE 16 96.438 -9.441 12.046 121 HG12 ILE 16 HG12 ILE 16 95.665 -11.087 9.603 122 HG13 ILE 16 HG13 ILE 16 95.444 -11.516 11.316 123 HG21 ILE 16 HG21 ILE 16 97.342 -7.915 10.067 124 HG22 ILE 16 HG22 ILE 16 96.020 -8.682 9.156 125 HG23 ILE 16 HG23 ILE 16 95.662 -7.752 10.631 126 HD11 ILE 16 HD11 ILE 16 93.308 -10.741 10.780 127 HD12 ILE 16 HD12 ILE 16 94.066 -9.246 11.379 128 HD13 ILE 16 HD13 ILE 16 93.923 -9.532 9.628 129 H TRP 17 H TRP 17 99.299 -8.456 9.627 130 HA TRP 17 HA TRP 17 100.437 -7.463 12.213 131 HB2 TRP 17 HB3 TRP 17 102.152 -8.471 9.896 132 HB3 TRP 17 HB2 TRP 17 102.765 -7.575 11.306 133 HD1 TRP 17 HD1 TRP 17 101.435 -8.880 13.693 134 HE1 TRP 17 HE1 TRP 17 101.808 -11.347 14.344 135 HE3 TRP 17 HE3 TRP 17 102.984 -10.684 9.176 136 HZ2 TRP 17 HZ2 TRP 17 102.674 -13.778 13.053 137 HZ3 TRP 17 HZ3 TRP 17 103.575 -13.076 8.912 138 HH2 TRP 17 HH2 TRP 17 103.420 -14.624 10.841 139 H ARG 18 H ARG 18 99.880 -5.335 12.045 140 HA ARG 18 HA ARG 18 99.850 -4.035 9.363 141 HB2 ARG 18 HB3 ARG 18 98.081 -3.525 11.037 142 HB3 ARG 18 HB2 ARG 18 99.322 -2.895 12.146 143 HG2 ARG 18 HG2 ARG 18 99.590 -1.688 9.501 144 HG3 ARG 18 HG3 ARG 18 97.946 -1.450 10.139 145 HD2 ARG 18 HD2 ARG 18 100.456 -0.899 11.774 146 HD3 ARG 18 HD3 ARG 18 99.646 0.345 10.791 147 HE ARG 18 HE ARG 18 98.699 -0.728 13.365 148 HH11 ARG 18 HH11 ARG 18 96.742 0.142 14.093 149 HH12 ARG 18 HH12 ARG 18 95.720 1.038 12.991 150 HH21 ARG 18 HH21 ARG 18 97.867 0.649 10.279 151 HH22 ARG 18 HH22 ARG 18 96.354 1.324 10.842 152 H VAL 19 H VAL 19 101.490 -2.775 8.566 153 HA VAL 19 HA VAL 19 103.846 -2.376 10.402 154 HB VAL 19 HB VAL 19 104.026 -1.752 7.481 155 HG11 VAL 19 HG11 VAL 19 105.969 -1.572 9.014 156 HG12 VAL 19 HG12 VAL 19 105.773 -3.284 9.461 157 HG13 VAL 19 HG13 VAL 19 106.229 -2.845 7.798 158 HG21 VAL 19 HG21 VAL 19 104.446 -4.272 7.113 159 HG22 VAL 19 HG22 VAL 19 103.574 -4.524 8.644 160 HG23 VAL 19 HG23 VAL 19 102.749 -3.758 7.265 161 H GLU 20 H GLU 20 104.714 -0.359 10.753 162 HA GLU 20 HA GLU 20 103.457 1.995 9.380 163 HB2 GLU 20 HB2 GLU 20 102.226 1.425 11.583 164 HB3 GLU 20 HB3 GLU 20 103.728 1.910 12.407 165 HG2 GLU 20 HG2 GLU 20 103.616 4.118 11.222 166 HG3 GLU 20 HG3 GLU 20 102.056 3.628 10.518 167 H LYS 21 H LYS 21 105.092 3.339 8.773 168 HA LYS 21 HA LYS 21 107.241 4.324 8.738 169 HB2 LYS 21 HB2 LYS 21 106.472 4.918 11.131 170 HB3 LYS 21 HB3 LYS 21 107.475 3.550 11.670 171 HG2 LYS 21 HG2 LYS 21 109.474 4.551 10.769 172 HG3 LYS 21 HG3 LYS 21 108.537 5.796 9.908 173 HD2 LYS 21 HD3 LYS 21 108.061 6.983 11.867 174 HD3 LYS 21 HD2 LYS 21 108.266 5.552 12.905 175 HE2 LYS 21 HE2 LYS 21 110.139 7.420 12.854 176 HE3 LYS 21 HE3 LYS 21 110.603 5.702 12.879 177 HZ1 LYS 21 HZ1 LYS 21 111.648 7.216 11.136 178 HZ2 LYS 21 HZ2 LYS 21 111.083 5.750 10.636 179 HZ3 LYS 21 HZ3 LYS 21 110.207 7.115 10.340 180 H PHE 22 H PHE 22 107.780 1.814 11.256 181 HA PHE 22 HA PHE 22 109.073 -0.017 9.374 182 HB2 PHE 22 HB2 PHE 22 110.728 2.000 10.867 183 HB3 PHE 22 HB3 PHE 22 111.360 0.341 10.732 184 HD1 PHE 22 HD1 PHE 22 111.181 -0.725 8.310 185 HD2 PHE 22 HD2 PHE 22 111.132 3.494 9.120 186 HE1 PHE 22 HE1 PHE 22 111.879 -0.270 5.975 187 HE2 PHE 22 HE2 PHE 22 111.833 3.950 6.785 188 HZ PHE 22 HZ PHE 22 112.205 2.067 5.213 189 H ASP 23 H ASP 23 107.230 0.290 11.864 190 HA ASP 23 HA ASP 23 108.537 -1.973 13.393 191 HB2 ASP 23 HB3 ASP 23 106.668 0.004 14.717 192 HB3 ASP 23 HB2 ASP 23 107.899 -1.047 15.457 193 H LEU 24 H LEU 24 107.344 -3.758 12.890 194 HA LEU 24 HA LEU 24 104.737 -3.821 11.807 195 HB2 LEU 24 HB2 LEU 24 106.383 -5.736 13.436 196 HB3 LEU 24 HB3 LEU 24 104.657 -6.109 13.218 197 HG LEU 24 HG LEU 24 104.982 -5.780 10.728 198 HD11 LEU 24 HD11 LEU 24 107.531 -6.110 10.114 199 HD12 LEU 24 HD12 LEU 24 106.913 -4.479 10.469 200 HD13 LEU 24 HD13 LEU 24 107.810 -5.381 11.714 201 HD21 LEU 24 HD21 LEU 24 106.121 -7.961 10.402 202 HD22 LEU 24 HD22 LEU 24 104.982 -8.032 11.768 203 HD23 LEU 24 HD23 LEU 24 106.730 -7.892 12.073 204 H VAL 25 H VAL 25 102.646 -4.391 12.841 205 HA VAL 25 HA VAL 25 102.423 -3.796 15.755 206 HB VAL 25 HB VAL 25 101.235 -2.012 13.591 207 HG11 VAL 25 HG11 VAL 25 99.480 -2.628 15.230 208 HG12 VAL 25 HG12 VAL 25 99.962 -0.925 15.418 209 HG13 VAL 25 HG13 VAL 25 100.558 -2.151 16.563 210 HG21 VAL 25 HG21 VAL 25 102.242 -0.262 15.208 211 HG22 VAL 25 HG22 VAL 25 103.392 -1.231 14.256 212 HG23 VAL 25 HG23 VAL 25 103.095 -1.628 15.966 213 HA PRO 26 HA PRO 26 99.636 -7.192 14.306 214 HB2 PRO 26 HB2 PRO 26 99.522 -7.462 17.302 215 HB3 PRO 26 HB3 PRO 26 99.763 -8.717 16.052 216 HG2 PRO 26 HG2 PRO 26 101.789 -7.813 17.566 217 HG3 PRO 26 HG3 PRO 26 102.012 -8.290 15.861 218 HD2 PRO 26 HD3 PRO 26 101.935 -5.546 17.078 219 HD3 PRO 26 HD2 PRO 26 102.833 -6.127 15.643 220 H VAL 27 H VAL 27 97.507 -6.815 13.897 221 HA VAL 27 HA VAL 27 96.064 -4.899 15.740 222 HB VAL 27 HB VAL 27 96.269 -4.323 13.279 223 HG11 VAL 27 HG11 VAL 27 95.257 -5.650 11.622 224 HG12 VAL 27 HG12 VAL 27 94.225 -6.500 12.796 225 HG13 VAL 27 HG13 VAL 27 95.963 -6.874 12.705 226 HG21 VAL 27 HG21 VAL 27 93.902 -3.699 13.035 227 HG22 VAL 27 HG22 VAL 27 94.409 -3.480 14.727 228 HG23 VAL 27 HG23 VAL 27 93.438 -4.898 14.266 229 HA PRO 28 HA PRO 28 93.729 -8.230 17.551 230 HB2 PRO 28 HB2 PRO 28 91.450 -6.300 17.091 231 HB3 PRO 28 HB3 PRO 28 91.886 -7.215 18.563 232 HG2 PRO 28 HG2 PRO 28 92.455 -4.591 18.255 233 HG3 PRO 28 HG3 PRO 28 93.485 -5.705 19.193 234 HD2 PRO 28 HD3 PRO 28 94.013 -4.414 16.570 235 HD3 PRO 28 HD2 PRO 28 95.168 -5.140 17.727 236 H THR 29 H THR 29 93.809 -9.737 15.794 237 HA THR 29 HA THR 29 92.120 -9.414 13.425 238 HB THR 29 HB THR 29 93.520 -11.832 14.647 239 HG1 THR 29 HG1 THR 29 95.090 -10.667 13.774 240 HG21 THR 29 HG21 THR 29 93.156 -12.662 12.172 241 HG22 THR 29 HG22 THR 29 91.808 -11.500 12.175 242 HG23 THR 29 HG23 THR 29 91.835 -12.835 13.351 243 H ASN 30 H ASN 30 91.464 -10.264 16.669 244 HA ASN 30 HA ASN 30 89.251 -12.126 16.092 245 HB2 ASN 30 HB2 ASN 30 90.632 -11.906 18.282 246 HB3 ASN 30 HB3 ASN 30 89.595 -10.504 18.636 247 HD21 ASN 30 HD21 ASN 30 87.549 -10.927 19.525 248 HD22 ASN 30 HD22 ASN 30 86.837 -12.523 19.617 249 H LEU 31 H LEU 31 89.673 -8.656 16.259 250 HA LEU 31 HA LEU 31 86.718 -8.386 15.717 251 HB2 LEU 31 HB3 LEU 31 87.566 -7.777 18.159 252 HB3 LEU 31 HB2 LEU 31 88.142 -6.294 17.360 253 HG LEU 31 HG LEU 31 85.810 -6.016 16.395 254 HD11 LEU 31 HD11 LEU 31 85.092 -8.380 16.642 255 HD12 LEU 31 HD12 LEU 31 83.981 -7.281 17.495 256 HD13 LEU 31 HD13 LEU 31 85.182 -8.221 18.413 257 HD21 LEU 31 HD21 LEU 31 84.848 -5.176 18.522 258 HD22 LEU 31 HD22 LEU 31 86.056 -6.111 19.435 259 HD23 LEU 31 HD23 LEU 31 86.575 -4.766 18.393 260 H TYR 32 H TYR 32 89.571 -8.173 14.331 261 HA TYR 32 HA TYR 32 89.921 -5.462 13.501 262 HB2 TYR 32 HB2 TYR 32 91.076 -6.402 11.528 263 HB3 TYR 32 HB3 TYR 32 91.558 -7.239 13.018 264 HD1 TYR 32 HD1 TYR 32 92.063 -8.504 10.451 265 HD2 TYR 32 HD2 TYR 32 88.484 -8.579 12.832 266 HE1 TYR 32 HE1 TYR 32 91.423 -10.667 9.426 267 HE2 TYR 32 HE2 TYR 32 87.849 -10.740 11.802 268 HH TYR 32 HH TYR 32 89.150 -11.937 9.028 269 H GLY 33 H GLY 33 89.020 -7.557 10.842 270 HA2 GLY 33 HA2 GLY 33 87.279 -7.340 9.255 271 HA3 GLY 33 HA3 GLY 33 86.276 -6.660 10.559 272 H ASP 34 H ASP 34 89.238 -5.011 10.216 273 HA ASP 34 HA ASP 34 88.364 -3.167 8.081 274 HB2 ASP 34 HB2 ASP 34 86.938 -2.165 9.676 275 HB3 ASP 34 HB3 ASP 34 88.075 -2.456 11.014 276 H PHE 35 H PHE 35 90.094 -1.794 7.438 277 HA PHE 35 HA PHE 35 92.564 -1.873 9.136 278 HB2 PHE 35 HB2 PHE 35 93.737 -2.373 6.754 279 HB3 PHE 35 HB3 PHE 35 93.255 -3.672 7.870 280 HD1 PHE 35 HD1 PHE 35 92.048 -5.420 6.934 281 HD2 PHE 35 HD2 PHE 35 91.638 -1.485 5.259 282 HE1 PHE 35 HE1 PHE 35 90.490 -6.311 5.222 283 HE2 PHE 35 HE2 PHE 35 90.080 -2.376 3.548 284 HZ PHE 35 HZ PHE 35 89.504 -4.788 3.531 285 H PHE 36 H PHE 36 94.217 -0.325 8.355 286 HA PHE 36 HA PHE 36 92.910 2.142 7.398 287 HB2 PHE 36 HB2 PHE 36 95.661 1.346 8.334 288 HB3 PHE 36 HB3 PHE 36 95.487 2.844 7.389 289 HD1 PHE 36 HD1 PHE 36 92.907 1.410 9.658 290 HD2 PHE 36 HD2 PHE 36 95.905 4.441 9.129 291 HE1 PHE 36 HE1 PHE 36 92.073 2.585 11.675 292 HE2 PHE 36 HE2 PHE 36 95.071 5.616 11.149 293 HZ PHE 36 HZ PHE 36 93.155 4.688 12.421 294 H THR 37 H THR 37 93.669 3.339 5.473 295 HA THR 37 HA THR 37 94.423 1.393 3.286 296 HB THR 37 HB THR 37 93.512 3.316 1.805 297 HG1 THR 37 HG1 THR 37 92.058 4.689 2.980 298 HG21 THR 37 HG21 THR 37 91.170 2.587 2.178 299 HG22 THR 37 HG22 THR 37 91.637 1.887 3.747 300 HG23 THR 37 HG23 THR 37 92.286 1.201 2.238 301 H GLY 38 H GLY 38 95.284 4.438 4.867 302 HA2 GLY 38 HA2 GLY 38 97.332 5.075 2.827 303 HA3 GLY 38 HA3 GLY 38 97.085 5.924 4.371 304 H ASP 39 H ASP 39 97.297 2.460 4.475 305 HA ASP 39 HA ASP 39 100.223 2.617 5.179 306 HB2 ASP 39 HB2 ASP 39 98.054 1.357 6.919 307 HB3 ASP 39 HB3 ASP 39 99.805 1.265 7.223 308 H ALA 40 H ALA 40 100.283 -0.108 6.159 309 HA ALA 40 HA ALA 40 99.235 -1.683 3.820 310 HB1 ALA 40 HB1 ALA 40 102.155 -1.547 4.693 311 HB2 ALA 40 HB2 ALA 40 101.499 -2.781 3.591 312 HB3 ALA 40 HB3 ALA 40 101.484 -1.065 3.116 313 H TYR 41 H TYR 41 98.718 -3.798 4.365 314 HA TYR 41 HA TYR 41 99.330 -4.572 7.231 315 HB2 TYR 41 HB2 TYR 41 96.850 -5.040 5.527 316 HB3 TYR 41 HB3 TYR 41 97.167 -5.931 7.035 317 HD1 TYR 41 HD1 TYR 41 96.513 -5.001 9.083 318 HD2 TYR 41 HD2 TYR 41 97.004 -2.432 5.675 319 HE1 TYR 41 HE1 TYR 41 95.628 -3.090 10.393 320 HE2 TYR 41 HE2 TYR 41 96.121 -0.522 6.985 321 HH TYR 41 HH TYR 41 94.404 -0.774 9.714 322 H VAL 42 H VAL 42 100.628 -6.325 7.368 323 HA VAL 42 HA VAL 42 100.870 -8.084 4.939 324 HB VAL 42 HB VAL 42 102.530 -8.067 7.498 325 HG11 VAL 42 HG11 VAL 42 102.625 -10.163 6.176 326 HG12 VAL 42 HG12 VAL 42 103.026 -9.224 4.718 327 HG13 VAL 42 HG13 VAL 42 104.166 -9.278 6.083 328 HG21 VAL 42 HG21 VAL 42 102.652 -5.887 6.322 329 HG22 VAL 42 HG22 VAL 42 104.182 -6.784 6.169 330 HG23 VAL 42 HG23 VAL 42 103.042 -6.730 4.803 331 H ILE 43 H ILE 43 100.019 -10.126 4.926 332 HA ILE 43 HA ILE 43 99.194 -11.274 7.602 333 HB ILE 43 HB ILE 43 97.433 -12.244 5.553 334 HG12 ILE 43 HG13 ILE 43 97.739 -9.214 5.664 335 HG13 ILE 43 HG12 ILE 43 97.978 -10.258 4.243 336 HG21 ILE 43 HG21 ILE 43 97.234 -11.705 8.162 337 HG22 ILE 43 HG22 ILE 43 95.800 -11.675 7.108 338 HG23 ILE 43 HG23 ILE 43 96.608 -10.153 7.557 339 HD11 ILE 43 HD11 ILE 43 95.792 -9.560 3.869 340 HD12 ILE 43 HD12 ILE 43 95.424 -9.432 5.606 341 HD13 ILE 43 HD13 ILE 43 95.489 -11.031 4.825 342 H LEU 44 H LEU 44 99.596 -13.423 7.865 343 HA LEU 44 HA LEU 44 100.897 -14.833 5.521 344 HB2 LEU 44 HB3 LEU 44 101.833 -14.328 8.187 345 HB3 LEU 44 HB2 LEU 44 101.517 -16.074 8.052 346 HG LEU 44 HG LEU 44 102.845 -16.095 5.918 347 HD11 LEU 44 HD11 LEU 44 104.269 -14.123 5.419 348 HD12 LEU 44 HD12 LEU 44 102.542 -13.701 5.337 349 HD13 LEU 44 HD13 LEU 44 103.506 -13.234 6.758 350 HD21 LEU 44 HD21 LEU 44 104.808 -14.913 7.771 351 HD22 LEU 44 HD22 LEU 44 103.722 -16.079 8.564 352 HD23 LEU 44 HD23 LEU 44 104.688 -16.578 7.155 353 H LYS 45 H LYS 45 100.234 -17.001 5.116 354 HA LYS 45 HA LYS 45 97.976 -17.964 6.885 355 HB2 LYS 45 HB2 LYS 45 97.495 -16.941 4.419 356 HB3 LYS 45 HB3 LYS 45 97.857 -18.625 3.970 357 HG2 LYS 45 HG3 LYS 45 96.232 -19.164 6.016 358 HG3 LYS 45 HG2 LYS 45 95.616 -17.532 5.665 359 HD2 LYS 45 HD2 LYS 45 95.951 -19.667 3.520 360 HD3 LYS 45 HD3 LYS 45 94.441 -19.450 4.436 361 HE2 LYS 45 HE2 LYS 45 95.487 -16.907 3.395 362 HE3 LYS 45 HE3 LYS 45 95.159 -18.084 2.100 363 HZ1 LYS 45 HZ1 LYS 45 93.021 -17.677 2.371 364 HZ2 LYS 45 HZ2 LYS 45 93.077 -18.195 3.936 365 HZ3 LYS 45 HZ3 LYS 45 93.325 -16.602 3.585 366 H THR 46 H THR 46 99.298 -19.488 7.918 367 HA THR 46 HA THR 46 100.941 -21.376 6.351 368 HB THR 46 HB THR 46 100.272 -22.339 9.008 369 HG1 THR 46 HG1 THR 46 99.911 -20.435 9.880 370 HG21 THR 46 HG21 THR 46 102.374 -22.893 8.012 371 HG22 THR 46 HG22 THR 46 102.740 -21.187 7.660 372 HG23 THR 46 HG23 THR 46 102.755 -21.772 9.341 373 H VAL 47 H VAL 47 99.805 -22.732 5.020 374 HA VAL 47 HA VAL 47 97.251 -23.925 6.056 375 HB VAL 47 HB VAL 47 98.252 -24.689 3.365 376 HG11 VAL 47 HG11 VAL 47 95.988 -25.252 4.213 377 HG12 VAL 47 HG12 VAL 47 95.894 -24.189 2.789 378 HG13 VAL 47 HG13 VAL 47 95.636 -23.519 4.418 379 HG21 VAL 47 HG21 VAL 47 97.483 -22.419 2.459 380 HG22 VAL 47 HG22 VAL 47 99.056 -22.425 3.293 381 HG23 VAL 47 HG23 VAL 47 97.608 -21.813 4.128 382 H GLN 48 H GLN 48 96.944 -26.293 5.642 383 HA GLN 48 HA GLN 48 99.556 -27.768 6.067 384 HB2 GLN 48 HB2 GLN 48 98.007 -27.627 8.084 385 HB3 GLN 48 HB3 GLN 48 96.822 -28.569 7.148 386 HG2 GLN 48 HG2 GLN 48 98.414 -30.413 6.914 387 HG3 GLN 48 HG3 GLN 48 99.682 -29.461 7.722 388 HE21 GLN 48 HE21 GLN 48 99.312 -28.901 10.058 389 HE22 GLN 48 HE22 GLN 48 98.281 -29.936 11.021 390 H LEU 49 H LEU 49 99.910 -28.581 4.015 391 HA LEU 49 HA LEU 49 98.070 -29.291 2.039 392 HB2 LEU 49 HB2 LEU 49 100.525 -30.923 2.828 393 HB3 LEU 49 HB3 LEU 49 99.716 -30.947 1.243 394 HG LEU 49 HG LEU 49 100.678 -28.325 2.405 395 HD11 LEU 49 HD11 LEU 49 102.609 -29.877 2.531 396 HD12 LEU 49 HD12 LEU 49 102.844 -28.667 1.247 397 HD13 LEU 49 HD13 LEU 49 102.358 -30.327 0.827 398 HD21 LEU 49 HD21 LEU 49 99.236 -28.347 0.386 399 HD22 LEU 49 HD22 LEU 49 100.389 -29.434 -0.424 400 HD23 LEU 49 HD23 LEU 49 100.875 -27.774 -0.005 401 H ARG 50 H ARG 50 99.531 -32.070 3.690 402 HA ARG 50 HA ARG 50 96.776 -33.021 4.440 403 HB2 ARG 50 HB3 ARG 50 98.759 -34.816 2.994 404 HB3 ARG 50 HB2 ARG 50 97.038 -35.121 3.327 405 HG2 ARG 50 HG2 ARG 50 96.393 -33.294 1.812 406 HG3 ARG 50 HG3 ARG 50 98.106 -32.905 1.522 407 HD2 ARG 50 HD2 ARG 50 97.200 -35.732 1.041 408 HD3 ARG 50 HD3 ARG 50 96.730 -34.491 -0.146 409 HE ARG 50 HE ARG 50 99.458 -35.531 0.306 410 HH11 ARG 50 HH11 ARG 50 101.032 -34.648 -1.055 411 HH12 ARG 50 HH12 ARG 50 100.684 -33.198 -1.969 412 HH21 ARG 50 HH21 ARG 50 97.441 -32.892 -0.738 413 HH22 ARG 50 HH22 ARG 50 98.659 -32.207 -1.790 414 H ASN 51 H ASN 51 100.303 -33.602 4.548 415 HA ASN 51 HA ASN 51 100.292 -33.882 7.434 416 HB2 ASN 51 HB3 ASN 51 99.195 -36.096 6.479 417 HB3 ASN 51 HB2 ASN 51 100.879 -36.522 6.092 418 HD21 ASN 51 HD21 ASN 51 98.842 -37.471 8.288 419 HD22 ASN 51 HD22 ASN 51 99.788 -37.373 9.755 420 H GLY 52 H GLY 52 101.745 -32.713 5.060 421 HA2 GLY 52 HA3 GLY 52 104.463 -33.941 5.570 422 HA3 GLY 52 HA2 GLY 52 104.027 -33.031 4.104 423 H ASN 53 H ASN 53 104.068 -30.767 4.149 424 HA ASN 53 HA ASN 53 105.129 -29.585 6.730 425 HB2 ASN 53 HB2 ASN 53 105.689 -28.716 3.858 426 HB3 ASN 53 HB3 ASN 53 106.353 -27.960 5.327 427 HD21 ASN 53 HD21 ASN 53 108.571 -28.527 4.678 428 HD22 ASN 53 HD22 ASN 53 109.129 -30.181 4.789 429 H LEU 54 H LEU 54 104.936 -26.884 5.951 430 HA LEU 54 HA LEU 54 101.951 -26.589 5.529 431 HB2 LEU 54 HB3 LEU 54 103.514 -24.630 7.208 432 HB3 LEU 54 HB2 LEU 54 101.792 -25.070 7.294 433 HG LEU 54 HG LEU 54 102.829 -27.473 7.905 434 HD11 LEU 54 HD11 LEU 54 105.175 -26.711 7.644 435 HD12 LEU 54 HD12 LEU 54 104.908 -25.466 8.888 436 HD13 LEU 54 HD13 LEU 54 104.841 -27.190 9.325 437 HD21 LEU 54 HD21 LEU 54 101.271 -26.140 9.300 438 HD22 LEU 54 HD22 LEU 54 102.563 -26.858 10.291 439 HD23 LEU 54 HD23 LEU 54 102.630 -25.134 9.854 440 H GLN 55 H GLN 55 101.404 -24.259 4.837 441 HA GLN 55 HA GLN 55 103.655 -23.133 3.160 442 HB2 GLN 55 HB2 GLN 55 102.203 -24.425 1.670 443 HB3 GLN 55 HB3 GLN 55 100.761 -23.604 2.315 444 HG2 GLN 55 HG3 GLN 55 101.120 -21.731 1.059 445 HG3 GLN 55 HG2 GLN 55 102.877 -21.765 1.345 446 HE21 GLN 55 HE21 GLN 55 104.096 -23.564 0.086 447 HE22 GLN 55 HE22 GLN 55 103.519 -23.919 -1.527 448 H TYR 56 H TYR 56 104.034 -21.135 3.956 449 HA TYR 56 HA TYR 56 101.837 -19.617 5.292 450 HB2 TYR 56 HB2 TYR 56 104.791 -19.543 5.175 451 HB3 TYR 56 HB3 TYR 56 104.052 -17.927 5.092 452 HD1 TYR 56 HD1 TYR 56 101.775 -17.932 6.767 453 HD2 TYR 56 HD2 TYR 56 105.450 -20.083 7.326 454 HE1 TYR 56 HE1 TYR 56 101.363 -18.002 9.212 455 HE2 TYR 56 HE2 TYR 56 105.038 -20.153 9.770 456 HH TYR 56 HH TYR 56 103.160 -18.265 11.393 457 H ASP 57 H ASP 57 100.426 -18.590 3.902 458 HA ASP 57 HA ASP 57 101.471 -17.569 1.295 459 HB2 ASP 57 HB2 ASP 57 98.668 -17.233 2.435 460 HB3 ASP 57 HB3 ASP 57 99.173 -17.150 0.730 461 H LEU 58 H LEU 58 102.346 -15.560 1.183 462 HA LEU 58 HA LEU 58 101.684 -13.632 3.390 463 HB2 LEU 58 HB2 LEU 58 103.627 -12.351 2.545 464 HB3 LEU 58 HB3 LEU 58 104.077 -14.042 2.869 465 HG LEU 58 HG LEU 58 103.269 -14.235 0.262 466 HD11 LEU 58 HD11 LEU 58 102.890 -11.789 0.092 467 HD12 LEU 58 HD12 LEU 58 104.576 -11.495 0.580 468 HD13 LEU 58 HD13 LEU 58 104.225 -12.307 -0.965 469 HD21 LEU 58 HD21 LEU 58 105.393 -15.064 1.244 470 HD22 LEU 58 HD22 LEU 58 106.035 -13.405 1.251 471 HD23 LEU 58 HD23 LEU 58 105.684 -14.216 -0.294 472 H HIS 59 H HIS 59 100.426 -11.869 3.052 473 HA HIS 59 HA HIS 59 99.930 -11.041 0.193 474 HB2 HIS 59 HB2 HIS 59 97.545 -10.641 1.783 475 HB3 HIS 59 HB3 HIS 59 97.743 -11.602 0.298 476 HD2 HIS 59 HD2 HIS 59 99.111 -14.269 1.084 477 HE1 HIS 59 HE1 HIS 59 96.873 -14.353 4.664 478 H TYR 60 H TYR 60 100.212 -8.867 -0.055 479 HA TYR 60 HA TYR 60 100.242 -7.237 2.488 480 HB2 TYR 60 HB2 TYR 60 101.310 -5.549 0.653 481 HB3 TYR 60 HB3 TYR 60 102.284 -6.710 1.583 482 HD1 TYR 60 HD1 TYR 60 102.273 -9.191 0.497 483 HD2 TYR 60 HD2 TYR 60 101.621 -5.524 -1.640 484 HE1 TYR 60 HE1 TYR 60 102.972 -10.295 -1.609 485 HE2 TYR 60 HE2 TYR 60 102.318 -6.627 -3.748 486 HH TYR 60 HH TYR 60 102.418 -9.790 -4.248 487 H TRP 61 H TRP 61 98.394 -6.154 2.840 488 HA TRP 61 HA TRP 61 96.656 -5.465 0.500 489 HB2 TRP 61 HB3 TRP 61 95.815 -6.524 2.709 490 HB3 TRP 61 HB2 TRP 61 96.061 -4.914 3.427 491 HD1 TRP 61 HD1 TRP 61 94.016 -6.708 0.712 492 HE1 TRP 61 HE1 TRP 61 91.933 -5.300 0.142 493 HE3 TRP 61 HE3 TRP 61 95.049 -2.563 3.509 494 HZ2 TRP 61 HZ2 TRP 61 90.866 -2.710 0.829 495 HZ3 TRP 61 HZ3 TRP 61 93.481 -0.644 3.537 496 HH2 TRP 61 HH2 TRP 61 91.393 -0.712 2.204 497 H LEU 62 H LEU 62 96.939 -3.530 -0.448 498 HA LEU 62 HA LEU 62 97.882 -1.242 1.300 499 HB2 LEU 62 HB2 LEU 62 98.207 -1.165 -1.688 500 HB3 LEU 62 HB3 LEU 62 99.246 -0.481 -0.418 501 HG LEU 62 HG LEU 62 98.962 -3.470 -0.952 502 HD11 LEU 62 HD11 LEU 62 100.121 -2.892 -2.858 503 HD12 LEU 62 HD12 LEU 62 100.691 -1.352 -2.170 504 HD13 LEU 62 HD13 LEU 62 101.492 -2.877 -1.723 505 HD21 LEU 62 HD21 LEU 62 99.882 -3.454 1.146 506 HD22 LEU 62 HD22 LEU 62 100.405 -1.758 1.012 507 HD23 LEU 62 HD23 LEU 62 101.379 -3.051 0.272 508 H GLY 63 H GLY 63 96.269 0.214 1.633 509 HA2 GLY 63 HA3 GLY 63 93.796 0.149 0.090 510 HA3 GLY 63 HA2 GLY 63 94.260 1.414 1.253 511 H ASN 64 H ASN 64 96.479 0.662 -1.297 512 HA ASN 64 HA ASN 64 97.227 1.972 -3.109 513 HB2 ASN 64 HB2 ASN 64 95.033 1.329 -4.051 514 HB3 ASN 64 HB3 ASN 64 94.272 2.721 -3.242 515 HD21 ASN 64 HD21 ASN 64 94.602 4.841 -4.143 516 HD22 ASN 64 HD22 ASN 64 95.423 5.082 -5.669 517 H GLU 65 H GLU 65 96.187 3.283 -0.262 518 HA GLU 65 HA GLU 65 96.791 6.097 -1.202 519 HB2 GLU 65 HB3 GLU 65 95.157 4.984 1.099 520 HB3 GLU 65 HB2 GLU 65 95.804 6.641 1.160 521 HG2 GLU 65 HG3 GLU 65 94.284 5.675 -1.276 522 HG3 GLU 65 HG2 GLU 65 93.410 6.260 0.160 523 H CYS 66 H CYS 66 98.401 3.535 -0.172 524 HA CYS 66 HA CYS 66 99.897 4.923 2.039 525 HB2 CYS 66 HB2 CYS 66 100.868 2.776 2.515 526 HB3 CYS 66 HB3 CYS 66 99.140 2.483 2.209 527 HG CYS 66 HG CYS 66 100.899 0.492 0.921 528 H SER 67 H SER 67 102.113 5.401 1.855 529 HA SER 67 HA SER 67 103.038 6.052 -0.828 530 HB2 SER 67 HB2 SER 67 103.711 7.103 1.461 531 HB3 SER 67 HB3 SER 67 104.858 5.746 1.580 532 HG SER 67 HG SER 67 105.782 7.603 0.544 533 H GLN 68 H GLN 68 104.879 5.124 -1.955 534 HA GLN 68 HA GLN 68 104.869 2.183 -1.818 535 HB2 GLN 68 HB3 GLN 68 106.891 3.827 -3.362 536 HB3 GLN 68 HB2 GLN 68 106.165 2.258 -3.787 537 HG2 GLN 68 HG2 GLN 68 103.962 3.365 -4.089 538 HG3 GLN 68 HG3 GLN 68 104.698 4.934 -3.680 539 HE21 GLN 68 HE21 GLN 68 104.611 6.003 -5.701 540 HE22 GLN 68 HE22 GLN 68 105.369 5.378 -7.149 541 H ASP 69 H ASP 69 106.520 4.604 -0.106 542 HA ASP 69 HA ASP 69 109.105 3.229 0.142 543 HB2 ASP 69 HB2 ASP 69 107.724 5.453 1.685 544 HB3 ASP 69 HB3 ASP 69 109.298 4.795 2.192 545 H GLU 70 H GLU 70 106.166 3.475 2.197 546 HA GLU 70 HA GLU 70 107.334 1.482 4.085 547 HB2 GLU 70 HB2 GLU 70 106.029 3.231 5.106 548 HB3 GLU 70 HB3 GLU 70 104.681 2.973 3.972 549 HG2 GLU 70 HG3 GLU 70 104.377 1.958 6.304 550 HG3 GLU 70 HG2 GLU 70 104.158 0.834 4.941 551 H SER 71 H SER 71 104.854 1.691 1.556 552 HA SER 71 HA SER 71 103.600 -0.850 2.011 553 HB2 SER 71 HB2 SER 71 103.063 1.099 0.312 554 HB3 SER 71 HB3 SER 71 104.123 0.179 -0.782 555 HG SER 71 HG SER 71 102.492 -1.124 -1.076 556 H GLY 72 H GLY 72 106.311 -0.024 -0.219 557 HA2 GLY 72 HA2 GLY 72 106.827 -2.711 -1.066 558 HA3 GLY 72 HA3 GLY 72 108.044 -1.412 -1.028 559 H ALA 73 H ALA 73 108.422 -0.847 1.580 560 HA ALA 73 HA ALA 73 110.142 -2.834 2.559 561 HB1 ALA 73 HB1 ALA 73 109.845 -1.816 4.800 562 HB2 ALA 73 HB2 ALA 73 108.374 -0.993 4.231 563 HB3 ALA 73 HB3 ALA 73 109.957 -0.565 3.539 564 H ALA 74 H ALA 74 106.614 -2.575 3.070 565 HA ALA 74 HA ALA 74 106.484 -4.791 4.953 566 HB1 ALA 74 HB1 ALA 74 104.624 -3.039 3.537 567 HB2 ALA 74 HB2 ALA 74 104.409 -3.899 5.080 568 HB3 ALA 74 HB3 ALA 74 104.040 -4.720 3.545 569 H ALA 75 H ALA 75 106.136 -4.553 1.403 570 HA ALA 75 HA ALA 75 105.499 -7.374 1.050 571 HB1 ALA 75 HB1 ALA 75 106.079 -6.966 -1.327 572 HB2 ALA 75 HB2 ALA 75 106.795 -5.398 -0.882 573 HB3 ALA 75 HB3 ALA 75 105.045 -5.664 -0.688 574 H ILE 76 H ILE 76 108.546 -5.500 0.980 575 HA ILE 76 HA ILE 76 110.187 -7.814 0.272 576 HB ILE 76 HB ILE 76 111.019 -5.262 1.721 577 HG12 ILE 76 HG13 ILE 76 110.477 -5.890 -1.197 578 HG13 ILE 76 HG12 ILE 76 109.936 -4.492 -0.238 579 HG21 ILE 76 HG21 ILE 76 112.563 -7.378 1.481 580 HG22 ILE 76 HG22 ILE 76 113.214 -5.778 1.052 581 HG23 ILE 76 HG23 ILE 76 112.667 -6.889 -0.227 582 HD11 ILE 76 HD11 ILE 76 111.687 -3.575 -1.513 583 HD12 ILE 76 HD12 ILE 76 112.508 -3.997 0.009 584 HD13 ILE 76 HD13 ILE 76 112.667 -5.057 -1.412 585 H PHE 77 H PHE 77 109.248 -6.256 3.355 586 HA PHE 77 HA PHE 77 110.989 -7.837 5.032 587 HB2 PHE 77 HB2 PHE 77 108.463 -6.252 5.418 588 HB3 PHE 77 HB3 PHE 77 108.933 -7.389 6.705 589 HD1 PHE 77 HD1 PHE 77 109.901 -6.158 8.442 590 HD2 PHE 77 HD2 PHE 77 110.975 -5.248 4.383 591 HE1 PHE 77 HE1 PHE 77 111.596 -4.540 9.253 592 HE2 PHE 77 HE2 PHE 77 112.673 -3.633 5.196 593 HZ PHE 77 HZ PHE 77 112.983 -3.278 7.630 594 H THR 78 H THR 78 107.585 -8.341 4.002 595 HA THR 78 HA THR 78 107.439 -10.941 5.373 596 HB THR 78 HB THR 78 105.543 -9.234 4.581 597 HG1 THR 78 HG1 THR 78 105.015 -11.029 5.762 598 HG21 THR 78 HG21 THR 78 104.441 -9.991 2.516 599 HG22 THR 78 HG22 THR 78 106.107 -9.474 2.163 600 HG23 THR 78 HG23 THR 78 105.715 -11.208 2.262 601 H VAL 79 H VAL 79 107.934 -9.855 2.000 602 HA VAL 79 HA VAL 79 107.941 -12.498 0.837 603 HB VAL 79 HB VAL 79 109.319 -9.911 0.011 604 HG11 VAL 79 HG11 VAL 79 110.531 -11.867 -0.913 605 HG12 VAL 79 HG12 VAL 79 109.644 -11.001 -2.191 606 HG13 VAL 79 HG13 VAL 79 108.997 -12.523 -1.534 607 HG21 VAL 79 HG21 VAL 79 107.068 -11.217 -1.484 608 HG22 VAL 79 HG22 VAL 79 107.425 -9.489 -1.246 609 HG23 VAL 79 HG23 VAL 79 106.677 -10.432 0.065 610 H GLN 80 H GLN 80 110.661 -10.445 2.006 611 HA GLN 80 HA GLN 80 112.683 -12.440 1.421 612 HB2 GLN 80 HB2 GLN 80 112.587 -10.094 3.352 613 HB3 GLN 80 HB3 GLN 80 114.030 -11.117 3.155 614 HG2 GLN 80 HG2 GLN 80 112.618 -9.690 0.860 615 HG3 GLN 80 HG3 GLN 80 114.047 -9.050 1.706 616 HE21 GLN 80 HE21 GLN 80 114.156 -9.657 -1.090 617 HE22 GLN 80 HE22 GLN 80 115.205 -11.039 -1.308 618 H LEU 81 H LEU 81 111.296 -11.493 4.632 619 HA LEU 81 HA LEU 81 112.473 -13.688 6.041 620 HB2 LEU 81 HB3 LEU 81 110.773 -11.582 6.696 621 HB3 LEU 81 HB2 LEU 81 109.744 -13.010 6.948 622 HG LEU 81 HG LEU 81 111.046 -12.342 8.996 623 HD11 LEU 81 HD11 LEU 81 110.697 -14.535 9.429 624 HD12 LEU 81 HD12 LEU 81 112.337 -14.839 8.809 625 HD13 LEU 81 HD13 LEU 81 110.935 -14.971 7.720 626 HD21 LEU 81 HD21 LEU 81 113.377 -12.312 9.065 627 HD22 LEU 81 HD22 LEU 81 113.097 -11.735 7.404 628 HD23 LEU 81 HD23 LEU 81 113.537 -13.435 7.693 629 H ASP 82 H ASP 82 109.324 -13.460 4.318 630 HA ASP 82 HA ASP 82 108.283 -16.000 4.958 631 HB2 ASP 82 HB3 ASP 82 106.993 -14.587 3.510 632 HB3 ASP 82 HB2 ASP 82 108.309 -14.489 2.315 633 H ASP 83 H ASP 83 110.721 -15.202 2.429 634 HA ASP 83 HA ASP 83 111.138 -17.957 1.648 635 HB2 ASP 83 HB3 ASP 83 113.125 -15.634 1.658 636 HB3 ASP 83 HB2 ASP 83 113.311 -17.157 0.755 637 H TYR 84 H TYR 84 112.227 -15.974 4.332 638 HA TYR 84 HA TYR 84 114.288 -17.872 5.225 639 HB2 TYR 84 HB2 TYR 84 114.242 -15.422 5.843 640 HB3 TYR 84 HB3 TYR 84 112.813 -15.754 6.851 641 HD1 TYR 84 HD1 TYR 84 116.444 -16.108 6.535 642 HD2 TYR 84 HD2 TYR 84 112.993 -17.265 8.817 643 HE1 TYR 84 HE1 TYR 84 117.918 -16.866 8.381 644 HE2 TYR 84 HE2 TYR 84 114.467 -18.023 10.662 645 HH TYR 84 HH TYR 84 116.903 -17.419 11.463 646 H LEU 85 H LEU 85 110.812 -17.540 5.547 647 HA LEU 85 HA LEU 85 110.634 -19.307 7.903 648 HB2 LEU 85 HB2 LEU 85 108.517 -18.488 5.861 649 HB3 LEU 85 HB3 LEU 85 108.202 -19.295 7.415 650 HG LEU 85 HG LEU 85 109.536 -16.572 7.071 651 HD11 LEU 85 HD11 LEU 85 107.442 -15.709 8.077 652 HD12 LEU 85 HD12 LEU 85 107.115 -16.553 6.545 653 HD13 LEU 85 HD13 LEU 85 106.771 -17.357 8.095 654 HD21 LEU 85 HD21 LEU 85 108.849 -16.675 9.667 655 HD22 LEU 85 HD22 LEU 85 109.053 -18.421 9.391 656 HD23 LEU 85 HD23 LEU 85 110.409 -17.309 9.090 657 H ASN 86 H ASN 86 109.784 -19.686 4.421 658 HA ASN 86 HA ASN 86 110.232 -22.655 4.826 659 HB2 ASN 86 HB2 ASN 86 107.850 -22.187 4.454 660 HB3 ASN 86 HB3 ASN 86 108.240 -21.241 2.998 661 HD21 ASN 86 HD21 ASN 86 106.783 -24.000 3.559 662 HD22 ASN 86 HD22 ASN 86 107.511 -25.049 2.363 663 H GLY 87 H GLY 87 110.389 -19.918 2.534 664 HA2 GLY 87 HA3 GLY 87 112.529 -19.689 1.236 665 HA3 GLY 87 HA2 GLY 87 112.550 -21.463 1.077 666 H ARG 88 H ARG 88 109.371 -20.519 0.874 667 HA ARG 88 HA ARG 88 109.410 -19.718 -1.989 668 HB2 ARG 88 HB2 ARG 88 108.376 -22.432 -1.060 669 HB3 ARG 88 HB3 ARG 88 107.949 -21.698 -2.625 670 HG2 ARG 88 HG3 ARG 88 110.477 -21.475 -3.040 671 HG3 ARG 88 HG2 ARG 88 110.697 -22.549 -1.638 672 HD2 ARG 88 HD2 ARG 88 109.536 -23.145 -4.347 673 HD3 ARG 88 HD3 ARG 88 110.603 -24.138 -3.326 674 HE ARG 88 HE ARG 88 107.668 -24.157 -3.291 675 HH11 ARG 88 HH11 ARG 88 106.730 -25.508 -1.739 676 HH12 ARG 88 HH12 ARG 88 107.692 -26.108 -0.407 677 HH21 ARG 88 HH21 ARG 88 110.596 -24.489 -1.437 678 HH22 ARG 88 HH22 ARG 88 109.871 -25.534 -0.237 679 H ALA 89 H ALA 89 106.953 -21.509 -0.104 680 HA ALA 89 HA ALA 89 104.778 -20.830 0.536 681 HB1 ALA 89 HB1 ALA 89 106.620 -18.632 1.240 682 HB2 ALA 89 HB2 ALA 89 105.311 -19.368 2.195 683 HB3 ALA 89 HB3 ALA 89 104.939 -18.094 1.009 684 H VAL 90 H VAL 90 103.050 -18.964 0.024 685 HA VAL 90 HA VAL 90 103.202 -18.602 -2.967 686 HB VAL 90 HB VAL 90 100.757 -18.256 -1.189 687 HG11 VAL 90 HG11 VAL 90 101.154 -18.904 -4.145 688 HG12 VAL 90 HG12 VAL 90 100.625 -17.340 -3.478 689 HG13 VAL 90 HG13 VAL 90 99.582 -18.774 -3.320 690 HG21 VAL 90 HG21 VAL 90 100.297 -20.669 -2.174 691 HG22 VAL 90 HG22 VAL 90 102.072 -20.745 -2.288 692 HG23 VAL 90 HG23 VAL 90 101.292 -20.487 -0.709 693 H GLN 91 H GLN 91 102.818 -16.549 -3.902 694 HA GLN 91 HA GLN 91 103.166 -14.272 -1.951 695 HB2 GLN 91 HB2 GLN 91 103.679 -13.031 -4.204 696 HB3 GLN 91 HB3 GLN 91 104.899 -14.144 -3.542 697 HG2 GLN 91 HG2 GLN 91 102.797 -15.246 -5.398 698 HG3 GLN 91 HG3 GLN 91 104.140 -14.309 -6.094 699 HE21 GLN 91 HE21 GLN 91 106.410 -15.065 -5.465 700 HE22 GLN 91 HE22 GLN 91 106.644 -16.774 -5.176 701 H HIS 92 H HIS 92 101.665 -12.600 -1.872 702 HA HIS 92 HA HIS 92 99.407 -12.715 -3.865 703 HB2 HIS 92 HB3 HIS 92 99.199 -12.835 -0.838 704 HB3 HIS 92 HB2 HIS 92 97.854 -12.257 -1.849 705 HD2 HIS 92 HD2 HIS 92 99.927 -15.617 -1.360 706 HE1 HIS 92 HE1 HIS 92 96.306 -16.515 -3.340 707 H ARG 93 H ARG 93 99.239 -10.734 -4.749 708 HA ARG 93 HA ARG 93 100.145 -8.375 -3.098 709 HB2 ARG 93 HB2 ARG 93 101.300 -8.512 -5.215 710 HB3 ARG 93 HB3 ARG 93 99.778 -8.788 -6.095 711 HG2 ARG 93 HG2 ARG 93 99.064 -6.558 -5.811 712 HG3 ARG 93 HG3 ARG 93 100.166 -6.280 -4.440 713 HD2 ARG 93 HD3 ARG 93 102.108 -6.519 -6.024 714 HD3 ARG 93 HD2 ARG 93 100.947 -6.634 -7.369 715 HE ARG 93 HE ARG 93 100.621 -4.229 -5.654 716 HH11 ARG 93 HH11 ARG 93 100.993 -2.283 -6.743 717 HH12 ARG 93 HH12 ARG 93 101.754 -2.293 -8.318 718 HH21 ARG 93 HH21 ARG 93 102.076 -5.758 -8.424 719 HH22 ARG 93 HH22 ARG 93 102.365 -4.251 -9.265 720 H GLU 94 H GLU 94 98.610 -7.007 -2.312 721 HA GLU 94 HA GLU 94 95.909 -7.060 -3.680 722 HB2 GLU 94 HB3 GLU 94 96.643 -7.304 -0.766 723 HB3 GLU 94 HB2 GLU 94 95.127 -6.481 -1.206 724 HG2 GLU 94 HG2 GLU 94 94.690 -8.871 -0.849 725 HG3 GLU 94 HG3 GLU 94 94.482 -8.479 -2.573 726 H VAL 95 H VAL 95 96.830 -5.148 -4.831 727 HA VAL 95 HA VAL 95 97.415 -2.738 -3.223 728 HB VAL 95 HB VAL 95 96.697 -2.673 -6.160 729 HG11 VAL 95 HG11 VAL 95 97.278 -0.583 -4.959 730 HG12 VAL 95 HG12 VAL 95 98.516 -0.990 -6.171 731 HG13 VAL 95 HG13 VAL 95 98.821 -1.307 -4.446 732 HG21 VAL 95 HG21 VAL 95 99.236 -3.217 -6.471 733 HG22 VAL 95 HG22 VAL 95 98.110 -4.568 -6.201 734 HG23 VAL 95 HG23 VAL 95 99.113 -3.964 -4.860 735 H GLN 96 H GLN 96 94.868 -3.942 -2.624 736 HA GLN 96 HA GLN 96 92.547 -3.426 -2.585 737 HB2 GLN 96 HB2 GLN 96 93.575 -1.653 -1.162 738 HB3 GLN 96 HB3 GLN 96 93.721 -0.611 -2.597 739 HG2 GLN 96 HG2 GLN 96 91.032 -1.808 -1.954 740 HG3 GLN 96 HG3 GLN 96 91.603 -0.430 -0.983 741 HE21 GLN 96 HE21 GLN 96 92.384 1.537 -2.319 742 HE22 GLN 96 HE22 GLN 96 91.527 1.870 -3.807 743 H GLY 97 H GLY 97 91.997 -4.179 -4.703 744 HA2 GLY 97 HA2 GLY 97 90.501 -2.570 -6.362 745 HA3 GLY 97 HA3 GLY 97 92.147 -2.263 -6.969 746 H PHE 98 H PHE 98 93.158 -4.932 -6.396 747 HA PHE 98 HA PHE 98 91.449 -6.620 -8.224 748 HB2 PHE 98 HB2 PHE 98 94.448 -6.683 -8.514 749 HB3 PHE 98 HB3 PHE 98 93.186 -7.047 -9.716 750 HD1 PHE 98 HD1 PHE 98 91.518 -4.898 -10.081 751 HD2 PHE 98 HD2 PHE 98 95.645 -4.732 -8.896 752 HE1 PHE 98 HE1 PHE 98 91.673 -2.578 -10.944 753 HE2 PHE 98 HE2 PHE 98 95.799 -2.410 -9.759 754 HZ PHE 98 HZ PHE 98 93.813 -1.335 -10.784 755 H GLU 99 H GLU 99 91.287 -7.053 -5.586 756 HA GLU 99 HA GLU 99 93.408 -8.777 -4.535 757 HB2 GLU 99 HB2 GLU 99 90.486 -8.687 -3.677 758 HB3 GLU 99 HB3 GLU 99 91.882 -9.212 -2.707 759 HG2 GLU 99 HG2 GLU 99 92.773 -6.979 -2.622 760 HG3 GLU 99 HG3 GLU 99 91.625 -6.405 -3.855 761 H SER 100 H SER 100 92.800 -11.110 -3.826 762 HA SER 100 HA SER 100 91.535 -12.457 -6.223 763 HB2 SER 100 HB2 SER 100 94.031 -12.852 -5.597 764 HB3 SER 100 HB3 SER 100 93.390 -13.793 -4.228 765 HG SER 100 HG SER 100 93.760 -14.725 -6.594 766 H ALA 101 H ALA 101 90.785 -14.828 -5.452 767 HA ALA 101 HA ALA 101 88.565 -14.356 -3.627 768 HB1 ALA 101 HB1 ALA 101 88.167 -16.793 -3.853 769 HB2 ALA 101 HB2 ALA 101 89.760 -16.980 -4.626 770 HB3 ALA 101 HB3 ALA 101 88.481 -16.046 -5.438 771 H THR 102 H THR 102 91.864 -15.498 -3.214 772 HA THR 102 HA THR 102 91.496 -16.836 -0.674 773 HB THR 102 HB THR 102 93.863 -15.392 -1.932 774 HG1 THR 102 HG1 THR 102 94.556 -17.596 -2.125 775 HG21 THR 102 HG21 THR 102 95.243 -16.404 -0.138 776 HG22 THR 102 HG22 THR 102 93.770 -17.022 0.647 777 HG23 THR 102 HG23 THR 102 94.051 -15.268 0.537 778 H PHE 103 H PHE 103 92.852 -13.558 -1.279 779 HA PHE 103 HA PHE 103 92.719 -12.680 1.430 780 HB2 PHE 103 HB2 PHE 103 93.892 -11.390 -0.286 781 HB3 PHE 103 HB3 PHE 103 92.364 -11.086 -1.147 782 HD1 PHE 103 HD1 PHE 103 90.607 -9.659 -0.104 783 HD2 PHE 103 HD2 PHE 103 94.483 -10.142 1.685 784 HE1 PHE 103 HE1 PHE 103 90.200 -7.667 1.317 785 HE2 PHE 103 HE2 PHE 103 94.074 -8.151 3.107 786 HZ PHE 103 HZ PHE 103 91.931 -6.916 2.924 787 H LEU 104 H LEU 104 90.233 -12.542 -1.150 788 HA LEU 104 HA LEU 104 88.301 -11.153 0.566 789 HB2 LEU 104 HB3 LEU 104 88.094 -12.695 -2.045 790 HB3 LEU 104 HB2 LEU 104 86.660 -12.025 -1.232 791 HG LEU 104 HG LEU 104 89.055 -10.245 -1.675 792 HD11 LEU 104 HD11 LEU 104 88.650 -11.332 -3.869 793 HD12 LEU 104 HD12 LEU 104 88.156 -9.622 -3.901 794 HD13 LEU 104 HD13 LEU 104 86.926 -10.902 -3.763 795 HD21 LEU 104 HD21 LEU 104 87.117 -9.475 -0.331 796 HD22 LEU 104 HD22 LEU 104 86.032 -9.819 -1.699 797 HD23 LEU 104 HD23 LEU 104 87.261 -8.539 -1.838 798 H GLY 105 H GLY 105 89.246 -14.496 0.047 799 HA2 GLY 105 HA2 GLY 105 86.841 -15.741 1.076 800 HA3 GLY 105 HA3 GLY 105 88.462 -16.477 1.075 801 H TYR 106 H TYR 106 89.860 -14.645 2.678 802 HA TYR 106 HA TYR 106 88.882 -15.471 5.333 803 HB2 TYR 106 HB2 TYR 106 91.340 -14.512 4.181 804 HB3 TYR 106 HB3 TYR 106 90.910 -13.442 5.536 805 HD1 TYR 106 HD1 TYR 106 90.890 -14.249 7.810 806 HD2 TYR 106 HD2 TYR 106 91.612 -16.953 4.552 807 HE1 TYR 106 HE1 TYR 106 91.628 -15.988 9.417 808 HE2 TYR 106 HE2 TYR 106 92.350 -18.691 6.158 809 HH TYR 106 HH TYR 106 91.729 -18.620 9.390 810 H PHE 107 H PHE 107 89.352 -12.296 3.692 811 HA PHE 107 HA PHE 107 87.875 -10.935 5.877 812 HB2 PHE 107 HB2 PHE 107 88.941 -9.960 3.192 813 HB3 PHE 107 HB3 PHE 107 88.175 -8.913 4.410 814 HD1 PHE 107 HD1 PHE 107 89.175 -9.029 6.823 815 HD2 PHE 107 HD2 PHE 107 91.245 -10.373 3.308 816 HE1 PHE 107 HE1 PHE 107 91.336 -8.840 8.025 817 HE2 PHE 107 HE2 PHE 107 93.405 -10.188 4.511 818 HZ PHE 107 HZ PHE 107 93.453 -9.423 6.868 819 H LYS 108 H LYS 108 85.946 -12.442 5.462 820 HA LYS 108 HA LYS 108 84.376 -11.730 3.025 821 HB2 LYS 108 HB2 LYS 108 84.515 -14.081 4.096 822 HB3 LYS 108 HB3 LYS 108 83.445 -13.434 5.363 823 HG2 LYS 108 HG2 LYS 108 81.939 -12.637 3.395 824 HG3 LYS 108 HG3 LYS 108 82.887 -13.766 2.398 825 HD2 LYS 108 HD2 LYS 108 82.364 -15.474 4.343 826 HD3 LYS 108 HD3 LYS 108 81.033 -14.352 4.711 827 HE2 LYS 108 HE3 LYS 108 80.011 -15.813 3.189 828 HE3 LYS 108 HE2 LYS 108 80.567 -14.508 2.114 829 HZ1 LYS 108 HZ1 LYS 108 81.186 -16.675 1.275 830 HZ2 LYS 108 HZ2 LYS 108 82.536 -15.810 1.659 831 HZ3 LYS 108 HZ3 LYS 108 82.022 -17.019 2.655 832 H SER 109 H SER 109 84.236 -11.303 6.569 833 HA SER 109 HA SER 109 81.899 -9.442 6.150 834 HB2 SER 109 HB3 SER 109 81.935 -11.447 7.865 835 HB3 SER 109 HB2 SER 109 82.905 -10.331 8.856 836 HG SER 109 HG SER 109 80.629 -10.121 9.247 837 H GLY 110 H GLY 110 85.125 -9.203 6.079 838 HA2 GLY 110 HA2 GLY 110 85.385 -6.930 8.004 839 HA3 GLY 110 HA3 GLY 110 86.692 -7.623 7.015 840 H LEU 111 H LEU 111 87.256 -6.554 5.174 841 HA LEU 111 HA LEU 111 87.234 -4.834 3.564 842 HB2 LEU 111 HB3 LEU 111 84.347 -5.729 3.661 843 HB3 LEU 111 HB2 LEU 111 84.873 -4.420 2.576 844 HG LEU 111 HG LEU 111 84.884 -6.761 1.555 845 HD11 LEU 111 HD11 LEU 111 86.208 -4.885 0.612 846 HD12 LEU 111 HD12 LEU 111 87.546 -5.274 1.719 847 HD13 LEU 111 HD13 LEU 111 87.078 -6.429 0.448 848 HD21 LEU 111 HD21 LEU 111 86.601 -8.311 2.209 849 HD22 LEU 111 HD22 LEU 111 85.799 -7.796 3.712 850 HD23 LEU 111 HD23 LEU 111 87.378 -7.107 3.265 851 H LYS 112 H LYS 112 87.838 -3.016 4.620 852 HA LYS 112 HA LYS 112 85.768 -0.999 5.131 853 HB2 LYS 112 HB2 LYS 112 86.288 -2.695 7.289 854 HB3 LYS 112 HB3 LYS 112 87.335 -1.292 7.609 855 HG2 LYS 112 HG3 LYS 112 85.277 -0.684 8.611 856 HG3 LYS 112 HG2 LYS 112 85.228 0.137 7.033 857 HD2 LYS 112 HD2 LYS 112 83.792 -1.553 6.099 858 HD3 LYS 112 HD3 LYS 112 84.043 -2.630 7.494 859 HE2 LYS 112 HE2 LYS 112 82.881 -1.049 8.967 860 HE3 LYS 112 HE3 LYS 112 82.711 0.112 7.629 861 HZ1 LYS 112 HZ1 LYS 112 80.715 -1.193 7.933 862 HZ2 LYS 112 HZ2 LYS 112 81.546 -2.599 7.704 863 HZ3 LYS 112 HZ3 LYS 112 81.388 -1.524 6.464 864 H TYR 113 H TYR 113 86.964 0.296 3.734 865 HA TYR 113 HA TYR 113 89.871 0.671 4.186 866 HB2 TYR 113 HB2 TYR 113 88.927 2.697 2.458 867 HB3 TYR 113 HB3 TYR 113 89.684 1.158 1.980 868 HD1 TYR 113 HD1 TYR 113 86.768 3.147 1.705 869 HD2 TYR 113 HD2 TYR 113 88.048 -0.941 2.036 870 HE1 TYR 113 HE1 TYR 113 84.618 2.394 0.725 871 HE2 TYR 113 HE2 TYR 113 85.896 -1.693 1.060 872 HH TYR 113 HH TYR 113 83.822 0.255 -0.594 873 H LYS 114 H LYS 114 90.417 1.817 5.997 874 HA LYS 114 HA LYS 114 88.794 4.310 6.563 875 HB2 LYS 114 HB3 LYS 114 90.164 2.284 8.303 876 HB3 LYS 114 HB2 LYS 114 90.185 3.977 8.850 877 HG2 LYS 114 HG2 LYS 114 87.604 2.727 7.881 878 HG3 LYS 114 HG3 LYS 114 88.169 2.432 9.543 879 HD2 LYS 114 HD3 LYS 114 87.855 4.632 10.188 880 HD3 LYS 114 HD2 LYS 114 88.207 5.269 8.563 881 HE2 LYS 114 HE3 LYS 114 85.799 5.528 9.186 882 HE3 LYS 114 HE2 LYS 114 86.021 4.497 7.753 883 HZ1 LYS 114 HZ1 LYS 114 84.536 3.744 9.739 884 HZ2 LYS 114 HZ2 LYS 114 85.970 3.232 10.373 885 HZ3 LYS 114 HZ3 LYS 114 85.458 2.651 8.917 886 H LYS 115 H LYS 115 89.809 6.143 5.943 887 HA LYS 115 HA LYS 115 92.618 6.183 5.182 888 HB2 LYS 115 HB3 LYS 115 92.303 8.555 4.845 889 HB3 LYS 115 HB2 LYS 115 90.794 7.752 4.349 890 HG2 LYS 115 HG2 LYS 115 89.992 8.166 6.777 891 HG3 LYS 115 HG3 LYS 115 91.362 9.295 6.903 892 HD2 LYS 115 HD3 LYS 115 89.783 10.784 6.116 893 HD3 LYS 115 HD2 LYS 115 90.327 10.141 4.548 894 HE2 LYS 115 HE2 LYS 115 87.978 9.040 6.154 895 HE3 LYS 115 HE3 LYS 115 87.829 10.160 4.778 896 HZ1 LYS 115 HZ1 LYS 115 87.609 8.089 3.827 897 HZ2 LYS 115 HZ2 LYS 115 88.749 7.378 4.783 898 HZ3 LYS 115 HZ3 LYS 115 89.209 8.399 3.573 899 H GLY 116 H GLY 116 94.427 6.725 6.360 900 HA2 GLY 116 HA3 GLY 116 94.005 7.041 9.314 901 HA3 GLY 116 HA2 GLY 116 95.547 6.651 8.513 902 H GLY 117 H GLY 117 94.170 9.065 6.701 903 HA2 GLY 117 HA2 GLY 117 94.599 11.384 6.546 904 HA3 GLY 117 HA3 GLY 117 94.633 11.415 8.325 905 H VAL 118 H VAL 118 96.821 9.094 7.490 906 HA VAL 118 HA VAL 118 99.101 10.722 8.230 907 HB VAL 118 HB VAL 118 98.989 8.044 6.771 908 HG11 VAL 118 HG11 VAL 118 101.321 7.946 8.055 909 HG12 VAL 118 HG12 VAL 118 101.215 9.718 7.923 910 HG13 VAL 118 HG13 VAL 118 101.199 8.714 6.454 911 HG21 VAL 118 HG21 VAL 118 99.370 7.110 9.037 912 HG22 VAL 118 HG22 VAL 118 97.858 8.047 8.977 913 HG23 VAL 118 HG23 VAL 118 99.312 8.752 9.722 914 H ALA 119 H ALA 119 97.385 10.417 5.275 915 HA ALA 119 HA ALA 119 99.405 10.662 3.301 916 HB1 ALA 119 HB1 ALA 119 97.725 11.905 1.968 917 HB2 ALA 119 HB2 ALA 119 96.985 10.510 2.789 918 HB3 ALA 119 HB3 ALA 119 96.746 12.152 3.434 919 H SER 120 H SER 120 98.336 12.989 5.715 920 HA SER 120 HA SER 120 99.485 15.338 4.441 921 HB2 SER 120 HB2 SER 120 97.832 15.270 6.406 922 HB3 SER 120 HB3 SER 120 99.236 14.901 7.438 923 HG SER 120 HG SER 120 98.814 17.177 7.288 924 H GLY 121 H GLY 121 100.984 12.608 5.183 925 HA2 GLY 121 HA3 GLY 121 103.239 13.271 6.797 926 HA3 GLY 121 HA2 GLY 121 103.263 12.071 5.483 927 H PHE 122 H PHE 122 102.412 14.271 3.541 928 HA PHE 122 HA PHE 122 105.116 15.013 2.733 929 HB2 PHE 122 HB2 PHE 122 104.091 16.055 0.869 930 HB3 PHE 122 HB3 PHE 122 102.977 14.728 1.273 931 HD1 PHE 122 HD1 PHE 122 103.470 18.364 1.222 932 HD2 PHE 122 HD2 PHE 122 100.855 15.191 2.465 933 HE1 PHE 122 HE1 PHE 122 101.641 20.005 1.561 934 HE2 PHE 122 HE2 PHE 122 99.026 16.833 2.802 935 HZ PHE 122 HZ PHE 122 99.419 19.238 2.352 936 H LYS 123 H LYS 123 102.580 16.571 4.631 937 HA LYS 123 HA LYS 123 103.557 19.272 4.501 938 HB2 LYS 123 HB3 LYS 123 101.380 18.493 5.546 939 HB3 LYS 123 HB2 LYS 123 102.327 17.912 6.936 940 HG2 LYS 123 HG2 LYS 123 103.018 20.103 7.528 941 HG3 LYS 123 HG3 LYS 123 102.587 20.765 5.933 942 HD2 LYS 123 HD2 LYS 123 100.285 20.749 6.404 943 HD3 LYS 123 HD3 LYS 123 100.453 19.516 7.676 944 HE2 LYS 123 HE2 LYS 123 101.340 21.072 9.231 945 HE3 LYS 123 HE3 LYS 123 101.739 22.251 7.958 946 HZ1 LYS 123 HZ1 LYS 123 99.755 22.879 9.162 947 HZ2 LYS 123 HZ2 LYS 123 99.383 22.551 7.590 948 HZ3 LYS 123 HZ3 LYS 123 99.013 21.459 8.769 949 H HIS 124 H HIS 124 104.610 16.465 6.402 950 HA HIS 124 HA HIS 124 106.338 17.972 8.199 951 HB2 HIS 124 HB2 HIS 124 106.213 15.077 7.300 952 HB3 HIS 124 HB3 HIS 124 107.515 15.655 8.367 953 HD2 HIS 124 HD2 HIS 124 106.570 16.627 10.941 954 HE1 HIS 124 HE1 HIS 124 102.741 14.885 10.576 955 HE2 HIS 124 HE2 HIS 124 104.354 16.009 12.205 956 H VAL 125 H VAL 125 108.773 17.794 8.145 957 HA VAL 125 HA VAL 125 109.688 18.293 5.321 958 HB VAL 125 HB VAL 125 111.142 18.837 7.946 959 HG11 VAL 125 HG11 VAL 125 112.581 18.682 5.931 960 HG12 VAL 125 HG12 VAL 125 112.490 20.358 6.525 961 HG13 VAL 125 HG13 VAL 125 111.543 19.865 5.100 962 HG21 VAL 125 HG21 VAL 125 109.008 20.096 7.816 963 HG22 VAL 125 HG22 VAL 125 109.458 20.690 6.199 964 HG23 VAL 125 HG23 VAL 125 110.405 21.183 7.624 965 H VAL 126 H VAL 126 111.474 17.178 4.445 966 HA VAL 126 HA VAL 126 112.314 14.738 6.039 967 HB VAL 126 HB VAL 126 112.141 14.986 3.003 968 HG11 VAL 126 HG11 VAL 126 113.745 13.306 3.873 969 HG12 VAL 126 HG12 VAL 126 112.461 12.605 4.886 970 HG13 VAL 126 HG13 VAL 126 112.344 12.516 3.112 971 HG21 VAL 126 HG21 VAL 126 109.892 15.159 4.035 972 HG22 VAL 126 HG22 VAL 126 110.096 13.597 3.206 973 HG23 VAL 126 HG23 VAL 126 110.212 13.685 4.980 974 HA PRO 127 HA PRO 127 116.023 17.514 5.521 975 HB2 PRO 127 HB3 PRO 127 116.894 15.472 7.558 976 HB3 PRO 127 HB2 PRO 127 117.136 17.242 7.553 977 HG2 PRO 127 HG2 PRO 127 115.292 16.064 9.111 978 HG3 PRO 127 HG3 PRO 127 115.016 17.660 8.362 979 HD2 PRO 127 HD3 PRO 127 113.839 14.995 7.652 980 HD3 PRO 127 HD2 PRO 127 113.145 16.633 7.452 981 H ASN 128 H ASN 128 118.031 17.076 4.499 982 HA ASN 128 HA ASN 128 118.187 15.057 2.581 983 HB2 ASN 128 HB2 ASN 128 120.481 16.232 4.215 984 HB3 ASN 128 HB3 ASN 128 120.686 15.306 2.709 985 HD21 ASN 128 HD21 ASN 128 118.316 16.374 1.343 986 HD22 ASN 128 HD22 ASN 128 118.662 18.049 0.976 987 H GLU 129 H GLU 129 119.688 13.103 2.533 988 HA GLU 129 HA GLU 129 119.042 11.426 4.914 989 HB2 GLU 129 HB2 GLU 129 120.148 9.618 3.453 990 HB3 GLU 129 HB3 GLU 129 118.656 10.346 2.811 991 HG2 GLU 129 HG3 GLU 129 119.857 11.712 1.269 992 HG3 GLU 129 HG2 GLU 129 121.403 11.441 2.109 993 H VAL 130 H VAL 130 121.806 13.010 3.402 994 HA VAL 130 HA VAL 130 123.973 11.582 4.507 995 HB VAL 130 HB VAL 130 124.067 13.668 3.045 996 HG11 VAL 130 HG11 VAL 130 123.921 15.829 4.048 997 HG12 VAL 130 HG12 VAL 130 123.957 15.153 5.694 998 HG13 VAL 130 HG13 VAL 130 122.513 14.938 4.675 999 HG21 VAL 130 HG21 VAL 130 126.086 12.680 4.095 1000 HG22 VAL 130 HG22 VAL 130 126.196 14.455 4.044 1001 HG23 VAL 130 HG23 VAL 130 125.785 13.633 5.568 1002 H VAL 131 H VAL 131 121.683 13.744 6.133 1003 HA VAL 131 HA VAL 131 123.047 14.235 8.562 1004 HB VAL 131 HB VAL 131 120.117 13.421 8.366 1005 HG11 VAL 131 HG11 VAL 131 121.029 13.723 10.652 1006 HG12 VAL 131 HG12 VAL 131 119.884 15.023 10.244 1007 HG13 VAL 131 HG13 VAL 131 121.637 15.332 10.197 1008 HG21 VAL 131 HG21 VAL 131 120.681 15.081 6.610 1009 HG22 VAL 131 HG22 VAL 131 121.434 16.125 7.839 1010 HG23 VAL 131 HG23 VAL 131 119.682 15.816 7.886 1011 H VAL 132 H VAL 132 120.808 11.465 7.978 1012 HA VAL 132 HA VAL 132 121.783 10.085 10.382 1013 HB VAL 132 HB VAL 132 120.254 8.903 8.025 1014 HG11 VAL 132 HG11 VAL 132 119.399 7.362 9.770 1015 HG12 VAL 132 HG12 VAL 132 121.174 7.286 9.664 1016 HG13 VAL 132 HG13 VAL 132 120.400 8.188 10.989 1017 HG21 VAL 132 HG21 VAL 132 118.210 9.509 9.293 1018 HG22 VAL 132 HG22 VAL 132 119.140 10.960 8.846 1019 HG23 VAL 132 HG23 VAL 132 119.212 10.334 10.511 1020 H GLN 133 H GLN 133 122.649 10.136 6.969 1021 HA GLN 133 HA GLN 133 124.257 8.844 5.785 1022 HB2 GLN 133 HB2 GLN 133 125.572 10.329 7.443 1023 HB3 GLN 133 HB3 GLN 133 125.765 8.856 8.423 1024 HG2 GLN 133 HG2 GLN 133 127.703 8.914 7.039 1025 HG3 GLN 133 HG3 GLN 133 126.623 7.742 6.247 1026 HE21 GLN 133 HE21 GLN 133 128.395 8.722 4.491 1027 HE22 GLN 133 HE22 GLN 133 127.711 9.989 3.498 Start of MODEL 16 1 H1 GLU 1 H1 GLU 1 108.036 -9.760 26.852 2 H2 GLU 1 H2 GLU 1 109.261 -8.687 26.596 3 H3 GLU 1 H3 GLU 1 109.523 -10.302 26.387 4 HA GLU 1 HA GLU 1 107.510 -8.881 24.790 5 HB2 GLU 1 HB3 GLU 1 109.519 -9.011 23.039 6 HB3 GLU 1 HB2 GLU 1 109.358 -7.621 24.140 7 HG2 GLU 1 HG2 GLU 1 111.685 -8.539 24.097 8 HG3 GLU 1 HG3 GLU 1 110.944 -8.642 25.712 9 H HIS 2 H HIS 2 107.486 -10.071 22.571 10 HA HIS 2 HA HIS 2 108.223 -12.967 22.867 11 HB2 HIS 2 HB3 HIS 2 105.431 -12.233 21.954 12 HB3 HIS 2 HB2 HIS 2 106.036 -13.789 22.572 13 HD2 HIS 2 HD2 HIS 2 104.251 -10.667 23.915 14 HE1 HIS 2 HE1 HIS 2 105.787 -12.680 27.294 15 HE2 HIS 2 HE2 HIS 2 104.218 -10.814 26.535 16 HA PRO 3 HA PRO 3 109.217 -10.942 18.738 17 HB2 PRO 3 HB2 PRO 3 111.137 -13.259 18.936 18 HB3 PRO 3 HB3 PRO 3 111.424 -11.586 18.379 19 HG2 PRO 3 HG3 PRO 3 112.221 -12.444 20.797 20 HG3 PRO 3 HG2 PRO 3 111.668 -10.771 20.514 21 HD2 PRO 3 HD3 PRO 3 110.292 -13.024 21.929 22 HD3 PRO 3 HD2 PRO 3 110.120 -11.259 22.170 23 H GLU 4 H GLU 4 106.984 -11.946 18.304 24 HA GLU 4 HA GLU 4 106.982 -14.753 17.374 25 HB2 GLU 4 HB2 GLU 4 104.935 -13.840 18.327 26 HB3 GLU 4 HB3 GLU 4 104.939 -12.500 17.156 27 HG2 GLU 4 HG3 GLU 4 104.517 -13.989 15.315 28 HG3 GLU 4 HG2 GLU 4 104.841 -15.425 16.316 29 H PHE 5 H PHE 5 106.826 -11.508 15.841 30 HA PHE 5 HA PHE 5 106.530 -12.243 13.148 31 HB2 PHE 5 HB2 PHE 5 106.711 -9.911 13.705 32 HB3 PHE 5 HB3 PHE 5 108.329 -10.137 14.411 33 HD1 PHE 5 HD1 PHE 5 110.169 -9.594 13.097 34 HD2 PHE 5 HD2 PHE 5 106.511 -10.760 11.171 35 HE1 PHE 5 HE1 PHE 5 111.200 -9.170 10.881 36 HE2 PHE 5 HE2 PHE 5 107.541 -10.336 8.956 37 HZ PHE 5 HZ PHE 5 109.885 -9.536 8.810 38 H LEU 6 H LEU 6 109.225 -12.914 15.275 39 HA LEU 6 HA LEU 6 111.222 -13.376 13.215 40 HB2 LEU 6 HB2 LEU 6 111.247 -13.336 15.955 41 HB3 LEU 6 HB3 LEU 6 111.306 -15.088 15.654 42 HG LEU 6 HG LEU 6 113.588 -14.226 15.752 43 HD11 LEU 6 HD11 LEU 6 114.406 -15.120 13.703 44 HD12 LEU 6 HD12 LEU 6 112.847 -15.939 13.959 45 HD13 LEU 6 HD13 LEU 6 112.965 -14.592 12.802 46 HD21 LEU 6 HD21 LEU 6 113.064 -11.862 15.203 47 HD22 LEU 6 HD22 LEU 6 114.364 -12.490 14.162 48 HD23 LEU 6 HD23 LEU 6 112.710 -12.332 13.523 49 H LYS 7 H LYS 7 108.668 -15.380 14.659 50 HA LYS 7 HA LYS 7 109.529 -17.648 12.862 51 HB2 LYS 7 HB2 LYS 7 107.484 -17.642 15.126 52 HB3 LYS 7 HB3 LYS 7 108.110 -19.065 14.261 53 HG2 LYS 7 HG2 LYS 7 110.461 -18.165 15.030 54 HG3 LYS 7 HG3 LYS 7 109.517 -17.262 16.240 55 HD2 LYS 7 HD2 LYS 7 108.510 -19.344 17.059 56 HD3 LYS 7 HD3 LYS 7 109.338 -20.276 15.788 57 HE2 LYS 7 HE3 LYS 7 111.504 -19.115 16.833 58 HE3 LYS 7 HE2 LYS 7 110.465 -19.001 18.273 59 HZ1 LYS 7 HZ1 LYS 7 111.697 -21.065 18.227 60 HZ2 LYS 7 HZ2 LYS 7 111.045 -21.474 16.769 61 HZ3 LYS 7 HZ3 LYS 7 110.081 -21.368 18.103 62 H ALA 8 H ALA 8 106.670 -15.718 13.836 63 HA ALA 8 HA ALA 8 104.678 -15.282 12.647 64 HB1 ALA 8 HB1 ALA 8 106.731 -15.701 10.482 65 HB2 ALA 8 HB2 ALA 8 105.016 -15.584 10.022 66 HB3 ALA 8 HB3 ALA 8 105.798 -14.241 10.891 67 H GLY 9 H GLY 9 102.847 -16.474 12.271 68 HA2 GLY 9 HA2 GLY 9 101.557 -18.452 12.096 69 HA3 GLY 9 HA3 GLY 9 102.615 -18.829 10.716 70 H LYS 10 H LYS 10 103.118 -18.653 14.284 71 HA LYS 10 HA LYS 10 105.037 -20.785 14.343 72 HB2 LYS 10 HB2 LYS 10 103.047 -19.955 16.504 73 HB3 LYS 10 HB3 LYS 10 104.518 -20.923 16.763 74 HG2 LYS 10 HG3 LYS 10 105.926 -19.070 16.022 75 HG3 LYS 10 HG2 LYS 10 104.494 -18.110 15.582 76 HD2 LYS 10 HD2 LYS 10 105.357 -17.389 17.774 77 HD3 LYS 10 HD3 LYS 10 103.760 -18.152 17.965 78 HE2 LYS 10 HE2 LYS 10 104.659 -20.100 18.914 79 HE3 LYS 10 HE3 LYS 10 106.263 -19.832 18.191 80 HZ1 LYS 10 HZ1 LYS 10 106.253 -19.337 20.544 81 HZ2 LYS 10 HZ2 LYS 10 106.548 -17.965 19.678 82 HZ3 LYS 10 HZ3 LYS 10 105.062 -18.213 20.348 83 H GLU 11 H GLU 11 101.886 -20.974 13.335 84 HA GLU 11 HA GLU 11 101.900 -23.897 13.404 85 HB2 GLU 11 HB2 GLU 11 100.097 -24.313 14.937 86 HB3 GLU 11 HB3 GLU 11 101.239 -23.255 15.801 87 HG2 GLU 11 HG2 GLU 11 99.824 -21.283 14.949 88 HG3 GLU 11 HG3 GLU 11 98.606 -22.494 14.480 89 HA PRO 12 HA PRO 12 99.389 -23.443 9.809 90 HB2 PRO 12 HB3 PRO 12 97.472 -25.287 11.242 91 HB3 PRO 12 HB2 PRO 12 98.094 -25.381 9.569 92 HG2 PRO 12 HG2 PRO 12 99.049 -26.917 11.586 93 HG3 PRO 12 HG3 PRO 12 100.059 -26.367 10.221 94 HD2 PRO 12 HD3 PRO 12 100.142 -25.538 13.067 95 HD3 PRO 12 HD2 PRO 12 101.378 -25.324 11.792 96 H GLY 13 H GLY 13 98.172 -21.645 9.422 97 HA2 GLY 13 HA3 GLY 13 95.536 -21.175 10.128 98 HA3 GLY 13 HA2 GLY 13 96.413 -20.580 11.558 99 H LEU 14 H LEU 14 95.633 -18.419 11.034 100 HA LEU 14 HA LEU 14 97.316 -17.154 8.866 101 HB2 LEU 14 HB3 LEU 14 95.092 -17.290 7.924 102 HB3 LEU 14 HB2 LEU 14 94.355 -16.717 9.438 103 HG LEU 14 HG LEU 14 96.422 -14.902 8.318 104 HD11 LEU 14 HD11 LEU 14 95.377 -15.717 6.220 105 HD12 LEU 14 HD12 LEU 14 94.925 -14.027 6.546 106 HD13 LEU 14 HD13 LEU 14 93.767 -15.337 6.876 107 HD21 LEU 14 HD21 LEU 14 94.969 -14.342 10.252 108 HD22 LEU 14 HD22 LEU 14 93.529 -14.537 9.224 109 HD23 LEU 14 HD23 LEU 14 94.687 -13.226 8.894 110 H GLN 15 H GLN 15 98.115 -15.086 9.393 111 HA GLN 15 HA GLN 15 97.274 -13.988 12.074 112 HB2 GLN 15 HB3 GLN 15 100.147 -14.485 11.176 113 HB3 GLN 15 HB2 GLN 15 99.673 -13.597 12.644 114 HG2 GLN 15 HG2 GLN 15 98.238 -15.817 13.080 115 HG3 GLN 15 HG3 GLN 15 99.488 -16.537 12.038 116 HE21 GLN 15 HE21 GLN 15 101.589 -16.845 12.916 117 HE22 GLN 15 HE22 GLN 15 102.016 -16.379 14.547 118 H ILE 16 H ILE 16 97.599 -11.710 12.285 119 HA ILE 16 HA ILE 16 98.237 -10.349 9.652 120 HB ILE 16 HB ILE 16 96.327 -9.423 11.847 121 HG12 ILE 16 HG12 ILE 16 95.403 -10.156 9.090 122 HG13 ILE 16 HG13 ILE 16 95.827 -11.496 10.182 123 HG21 ILE 16 HG21 ILE 16 97.077 -8.341 9.100 124 HG22 ILE 16 HG22 ILE 16 97.253 -7.528 10.674 125 HG23 ILE 16 HG23 ILE 16 95.632 -7.813 9.996 126 HD11 ILE 16 HD11 ILE 16 93.427 -10.906 10.388 127 HD12 ILE 16 HD12 ILE 16 94.298 -10.575 11.904 128 HD13 ILE 16 HD13 ILE 16 93.874 -9.236 10.811 129 H TRP 17 H TRP 17 99.712 -8.689 9.710 130 HA TRP 17 HA TRP 17 100.530 -7.623 12.401 131 HB2 TRP 17 HB2 TRP 17 102.506 -8.678 10.328 132 HB3 TRP 17 HB3 TRP 17 102.907 -7.962 11.908 133 HD1 TRP 17 HD1 TRP 17 101.022 -9.359 13.850 134 HE1 TRP 17 HE1 TRP 17 101.119 -11.895 14.315 135 HE3 TRP 17 HE3 TRP 17 103.379 -10.881 9.582 136 HZ2 TRP 17 HZ2 TRP 17 102.099 -14.262 12.991 137 HZ3 TRP 17 HZ3 TRP 17 103.885 -13.276 9.211 138 HH2 TRP 17 HH2 TRP 17 103.244 -14.968 10.907 139 H ARG 18 H ARG 18 100.139 -5.472 12.129 140 HA ARG 18 HA ARG 18 100.349 -4.233 9.453 141 HB2 ARG 18 HB2 ARG 18 98.651 -3.504 11.126 142 HB3 ARG 18 HB3 ARG 18 99.962 -2.954 12.197 143 HG2 ARG 18 HG2 ARG 18 100.740 -1.388 10.436 144 HG3 ARG 18 HG3 ARG 18 99.421 -1.933 9.372 145 HD2 ARG 18 HD3 ARG 18 98.858 0.188 10.571 146 HD3 ARG 18 HD2 ARG 18 97.750 -1.140 10.993 147 HE ARG 18 HE ARG 18 99.775 -1.281 12.940 148 HH11 ARG 18 HH11 ARG 18 99.593 -0.164 14.898 149 HH12 ARG 18 HH12 ARG 18 98.572 1.252 15.007 150 HH21 ARG 18 HH21 ARG 18 97.573 1.101 11.675 151 HH22 ARG 18 HH22 ARG 18 97.433 1.965 13.190 152 H VAL 19 H VAL 19 102.028 -2.985 8.673 153 HA VAL 19 HA VAL 19 104.582 -3.148 10.173 154 HB VAL 19 HB VAL 19 104.368 -1.460 7.716 155 HG11 VAL 19 HG11 VAL 19 106.534 -2.015 8.792 156 HG12 VAL 19 HG12 VAL 19 106.431 -2.716 7.159 157 HG13 VAL 19 HG13 VAL 19 106.189 -3.749 8.589 158 HG21 VAL 19 HG21 VAL 19 104.384 -3.641 6.343 159 HG22 VAL 19 HG22 VAL 19 103.757 -4.438 7.805 160 HG23 VAL 19 HG23 VAL 19 102.816 -3.145 7.024 161 H GLU 20 H GLU 20 105.691 -1.416 11.079 162 HA GLU 20 HA GLU 20 104.585 1.332 10.813 163 HB2 GLU 20 HB2 GLU 20 103.197 0.205 12.617 164 HB3 GLU 20 HB3 GLU 20 104.695 0.010 13.558 165 HG2 GLU 20 HG3 GLU 20 105.000 2.579 13.165 166 HG3 GLU 20 HG2 GLU 20 103.265 2.561 12.765 167 H LYS 21 H LYS 21 106.708 1.753 9.984 168 HA LYS 21 HA LYS 21 108.938 2.490 10.253 169 HB2 LYS 21 HB2 LYS 21 107.796 3.452 12.426 170 HB3 LYS 21 HB3 LYS 21 108.695 2.154 13.249 171 HG2 LYS 21 HG3 LYS 21 110.810 2.984 12.319 172 HG3 LYS 21 HG2 LYS 21 109.941 4.227 11.387 173 HD2 LYS 21 HD2 LYS 21 108.977 4.894 13.769 174 HD3 LYS 21 HD3 LYS 21 110.435 4.059 14.359 175 HE2 LYS 21 HE2 LYS 21 110.418 6.296 12.284 176 HE3 LYS 21 HE3 LYS 21 110.820 6.504 14.005 177 HZ1 LYS 21 HZ1 LYS 21 112.792 6.197 12.662 178 HZ2 LYS 21 HZ2 LYS 21 112.245 4.741 12.113 179 HZ3 LYS 21 HZ3 LYS 21 112.617 4.934 13.708 180 H PHE 22 H PHE 22 108.261 -0.354 9.988 181 HA PHE 22 HA PHE 22 109.469 -2.389 10.026 182 HB2 PHE 22 HB3 PHE 22 111.790 -1.025 11.396 183 HB3 PHE 22 HB2 PHE 22 111.805 -2.288 10.141 184 HD1 PHE 22 HD1 PHE 22 112.940 0.807 10.475 185 HD2 PHE 22 HD2 PHE 22 109.965 -1.210 8.124 186 HE1 PHE 22 HE1 PHE 22 113.144 2.550 8.723 187 HE2 PHE 22 HE2 PHE 22 110.170 0.533 6.370 188 HZ PHE 22 HZ PHE 22 111.756 2.414 6.670 189 H ASP 23 H ASP 23 108.048 -1.063 12.484 190 HA ASP 23 HA ASP 23 109.365 -2.742 14.618 191 HB2 ASP 23 HB2 ASP 23 107.194 -0.605 14.828 192 HB3 ASP 23 HB3 ASP 23 107.963 -1.445 16.196 193 H LEU 24 H LEU 24 106.712 -2.675 12.437 194 HA LEU 24 HA LEU 24 104.844 -4.101 12.215 195 HB2 LEU 24 HB2 LEU 24 106.492 -5.844 14.100 196 HB3 LEU 24 HB3 LEU 24 105.084 -6.390 13.157 197 HG LEU 24 HG LEU 24 107.395 -5.032 11.757 198 HD11 LEU 24 HD11 LEU 24 108.403 -6.821 13.146 199 HD12 LEU 24 HD12 LEU 24 108.436 -7.255 11.420 200 HD13 LEU 24 HD13 LEU 24 107.224 -7.987 12.498 201 HD21 LEU 24 HD21 LEU 24 105.282 -5.492 10.539 202 HD22 LEU 24 HD22 LEU 24 106.617 -6.480 9.900 203 HD23 LEU 24 HD23 LEU 24 105.405 -7.213 10.978 204 H VAL 25 H VAL 25 102.840 -4.452 13.212 205 HA VAL 25 HA VAL 25 102.662 -4.279 16.182 206 HB VAL 25 HB VAL 25 101.509 -2.147 14.329 207 HG11 VAL 25 HG11 VAL 25 100.443 -1.237 16.375 208 HG12 VAL 25 HG12 VAL 25 101.038 -2.633 17.305 209 HG13 VAL 25 HG13 VAL 25 99.838 -2.871 16.012 210 HG21 VAL 25 HG21 VAL 25 102.752 -0.665 16.009 211 HG22 VAL 25 HG22 VAL 25 103.783 -1.640 14.934 212 HG23 VAL 25 HG23 VAL 25 103.518 -2.152 16.618 213 HA PRO 26 HA PRO 26 99.652 -7.367 14.747 214 HB2 PRO 26 HB2 PRO 26 98.851 -7.025 17.635 215 HB3 PRO 26 HB3 PRO 26 99.125 -8.522 16.698 216 HG2 PRO 26 HG3 PRO 26 100.926 -7.590 18.460 217 HG3 PRO 26 HG2 PRO 26 101.408 -8.431 16.961 218 HD2 PRO 26 HD2 PRO 26 101.604 -5.524 17.662 219 HD3 PRO 26 HD3 PRO 26 102.579 -6.491 16.514 220 H VAL 27 H VAL 27 98.003 -6.513 13.543 221 HA VAL 27 HA VAL 27 96.591 -4.118 13.991 222 HB VAL 27 HB VAL 27 96.403 -5.585 11.955 223 HG11 VAL 27 HG11 VAL 27 94.691 -7.223 13.870 224 HG12 VAL 27 HG12 VAL 27 94.623 -7.399 12.100 225 HG13 VAL 27 HG13 VAL 27 96.132 -7.760 12.973 226 HG21 VAL 27 HG21 VAL 27 94.011 -5.112 11.552 227 HG22 VAL 27 HG22 VAL 27 93.754 -4.880 13.298 228 HG23 VAL 27 HG23 VAL 27 94.784 -3.746 12.392 229 HA PRO 28 HA PRO 28 94.439 -4.528 17.865 230 HB2 PRO 28 HB3 PRO 28 92.203 -3.303 16.246 231 HB3 PRO 28 HB2 PRO 28 92.816 -2.838 17.858 232 HG2 PRO 28 HG3 PRO 28 93.442 -1.490 15.597 233 HG3 PRO 28 HG2 PRO 28 94.559 -1.626 16.982 234 HD2 PRO 28 HD2 PRO 28 94.744 -2.866 14.289 235 HD3 PRO 28 HD3 PRO 28 96.016 -2.641 15.527 236 H THR 29 H THR 29 94.027 -6.739 18.120 237 HA THR 29 HA THR 29 92.341 -8.317 16.411 238 HB THR 29 HB THR 29 92.647 -8.741 19.408 239 HG1 THR 29 HG1 THR 29 94.608 -9.821 18.807 240 HG21 THR 29 HG21 THR 29 92.575 -11.123 18.728 241 HG22 THR 29 HG22 THR 29 92.421 -10.632 17.024 242 HG23 THR 29 HG23 THR 29 91.120 -10.257 18.179 243 H ASN 30 H ASN 30 91.578 -6.021 18.956 244 HA ASN 30 HA ASN 30 88.989 -6.862 19.734 245 HB2 ASN 30 HB2 ASN 30 90.142 -4.857 20.646 246 HB3 ASN 30 HB3 ASN 30 89.883 -4.013 19.100 247 HD21 ASN 30 HD21 ASN 30 88.756 -2.709 21.194 248 HD22 ASN 30 HD22 ASN 30 87.029 -2.979 21.264 249 H LEU 31 H LEU 31 89.907 -4.925 16.849 250 HA LEU 31 HA LEU 31 87.101 -5.114 15.850 251 HB2 LEU 31 HB2 LEU 31 89.636 -3.752 14.895 252 HB3 LEU 31 HB3 LEU 31 88.223 -3.907 13.825 253 HG LEU 31 HG LEU 31 88.292 -1.745 15.144 254 HD11 LEU 31 HD11 LEU 31 86.160 -2.676 14.277 255 HD12 LEU 31 HD12 LEU 31 85.978 -3.639 15.762 256 HD13 LEU 31 HD13 LEU 31 85.915 -1.862 15.841 257 HD21 LEU 31 HD21 LEU 31 87.977 -1.760 17.511 258 HD22 LEU 31 HD22 LEU 31 89.253 -2.963 17.207 259 HD23 LEU 31 HD23 LEU 31 87.585 -3.496 17.526 260 H TYR 32 H TYR 32 90.370 -6.028 14.655 261 HA TYR 32 HA TYR 32 90.985 -7.757 13.167 262 HB2 TYR 32 HB2 TYR 32 89.978 -9.091 15.083 263 HB3 TYR 32 HB3 TYR 32 88.453 -9.126 14.167 264 HD1 TYR 32 HD1 TYR 32 88.303 -10.332 12.023 265 HD2 TYR 32 HD2 TYR 32 91.913 -10.362 14.352 266 HE1 TYR 32 HE1 TYR 32 89.146 -12.245 10.691 267 HE2 TYR 32 HE2 TYR 32 92.757 -12.274 13.018 268 HH TYR 32 HH TYR 32 91.535 -13.190 10.100 269 H GLY 33 H GLY 33 90.646 -6.661 11.199 270 HA2 GLY 33 HA3 GLY 33 89.489 -7.382 9.026 271 HA3 GLY 33 HA2 GLY 33 87.956 -7.206 9.914 272 H ASP 34 H ASP 34 90.410 -4.918 10.736 273 HA ASP 34 HA ASP 34 88.992 -2.867 9.015 274 HB2 ASP 34 HB2 ASP 34 89.366 -1.241 10.763 275 HB3 ASP 34 HB3 ASP 34 88.668 -2.685 11.537 276 H PHE 35 H PHE 35 90.297 -1.368 7.897 277 HA PHE 35 HA PHE 35 93.262 -1.575 8.308 278 HB2 PHE 35 HB3 PHE 35 92.212 -1.739 5.483 279 HB3 PHE 35 HB2 PHE 35 93.773 -2.285 6.142 280 HD1 PHE 35 HD1 PHE 35 94.065 -4.521 6.824 281 HD2 PHE 35 HD2 PHE 35 90.094 -2.990 6.245 282 HE1 PHE 35 HE1 PHE 35 93.142 -6.802 7.126 283 HE2 PHE 35 HE2 PHE 35 89.170 -5.272 6.548 284 HZ PHE 35 HZ PHE 35 90.694 -7.178 6.991 285 H PHE 36 H PHE 36 94.234 0.392 8.051 286 HA PHE 36 HA PHE 36 92.467 2.654 7.193 287 HB2 PHE 36 HB3 PHE 36 95.231 2.531 8.472 288 HB3 PHE 36 HB2 PHE 36 94.436 4.049 7.989 289 HD1 PHE 36 HD1 PHE 36 93.769 0.917 9.963 290 HD2 PHE 36 HD2 PHE 36 93.037 5.126 9.518 291 HE1 PHE 36 HE1 PHE 36 92.475 0.916 12.080 292 HE2 PHE 36 HE2 PHE 36 91.746 5.125 11.633 293 HZ PHE 36 HZ PHE 36 91.467 3.021 12.917 294 H THR 37 H THR 37 92.396 2.752 4.970 295 HA THR 37 HA THR 37 94.437 1.936 3.175 296 HB THR 37 HB THR 37 93.305 3.197 1.495 297 HG1 THR 37 HG1 THR 37 93.137 5.237 2.152 298 HG21 THR 37 HG21 THR 37 91.096 2.460 1.772 299 HG22 THR 37 HG22 THR 37 91.070 2.872 3.503 300 HG23 THR 37 HG23 THR 37 91.967 1.441 2.943 301 H GLY 38 H GLY 38 96.453 2.554 4.103 302 HA2 GLY 38 HA2 GLY 38 97.593 4.950 3.022 303 HA3 GLY 38 HA3 GLY 38 97.176 5.276 4.723 304 H ASP 39 H ASP 39 97.576 2.424 5.473 305 HA ASP 39 HA ASP 39 100.599 2.479 5.475 306 HB2 ASP 39 HB2 ASP 39 100.451 1.148 7.533 307 HB3 ASP 39 HB3 ASP 39 99.456 2.613 7.704 308 H ALA 40 H ALA 40 100.728 -0.296 6.423 309 HA ALA 40 HA ALA 40 99.580 -1.790 4.076 310 HB1 ALA 40 HB1 ALA 40 102.521 -1.691 4.866 311 HB2 ALA 40 HB2 ALA 40 101.830 -2.922 3.783 312 HB3 ALA 40 HB3 ALA 40 101.803 -1.206 3.311 313 H TYR 41 H TYR 41 99.053 -3.915 4.563 314 HA TYR 41 HA TYR 41 99.655 -4.756 7.411 315 HB2 TYR 41 HB3 TYR 41 97.232 -5.285 5.640 316 HB3 TYR 41 HB2 TYR 41 97.524 -6.121 7.184 317 HD1 TYR 41 HD1 TYR 41 97.307 -4.962 9.300 318 HD2 TYR 41 HD2 TYR 41 96.805 -2.853 5.592 319 HE1 TYR 41 HE1 TYR 41 96.342 -3.036 10.527 320 HE2 TYR 41 HE2 TYR 41 95.841 -0.925 6.818 321 HH TYR 41 HH TYR 41 94.536 -0.836 9.413 322 H VAL 42 H VAL 42 100.981 -6.483 7.543 323 HA VAL 42 HA VAL 42 101.300 -8.202 5.092 324 HB VAL 42 HB VAL 42 102.930 -8.094 7.671 325 HG11 VAL 42 HG11 VAL 42 103.087 -10.270 6.550 326 HG12 VAL 42 HG12 VAL 42 104.596 -9.361 6.295 327 HG13 VAL 42 HG13 VAL 42 103.392 -9.471 4.989 328 HG21 VAL 42 HG21 VAL 42 103.062 -5.998 6.352 329 HG22 VAL 42 HG22 VAL 42 104.594 -6.900 6.275 330 HG23 VAL 42 HG23 VAL 42 103.468 -6.940 4.897 331 H ILE 43 H ILE 43 99.997 -9.970 5.033 332 HA ILE 43 HA ILE 43 99.377 -11.298 7.682 333 HB ILE 43 HB ILE 43 97.740 -11.856 5.227 334 HG12 ILE 43 HG12 ILE 43 97.402 -9.357 6.939 335 HG13 ILE 43 HG13 ILE 43 98.052 -9.364 5.282 336 HG21 ILE 43 HG21 ILE 43 95.966 -12.081 6.885 337 HG22 ILE 43 HG22 ILE 43 97.392 -12.981 7.455 338 HG23 ILE 43 HG23 ILE 43 97.009 -11.387 8.150 339 HD11 ILE 43 HD11 ILE 43 95.631 -8.829 5.287 340 HD12 ILE 43 HD12 ILE 43 95.293 -10.366 6.118 341 HD13 ILE 43 HD13 ILE 43 95.942 -10.375 4.460 342 H LEU 44 H LEU 44 99.593 -13.526 7.824 343 HA LEU 44 HA LEU 44 100.951 -14.837 5.457 344 HB2 LEU 44 HB2 LEU 44 101.889 -14.445 8.171 345 HB3 LEU 44 HB3 LEU 44 101.684 -16.186 7.862 346 HG LEU 44 HG LEU 44 102.973 -15.880 5.709 347 HD11 LEU 44 HD11 LEU 44 102.957 -13.067 6.750 348 HD12 LEU 44 HD12 LEU 44 102.934 -13.659 5.072 349 HD13 LEU 44 HD13 LEU 44 104.460 -13.639 5.988 350 HD21 LEU 44 HD21 LEU 44 105.182 -15.702 6.826 351 HD22 LEU 44 HD22 LEU 44 104.063 -16.711 7.774 352 HD23 LEU 44 HD23 LEU 44 104.393 -15.036 8.276 353 H LYS 45 H LYS 45 100.299 -16.951 4.972 354 HA LYS 45 HA LYS 45 98.081 -18.042 6.725 355 HB2 LYS 45 HB2 LYS 45 97.573 -16.995 4.294 356 HB3 LYS 45 HB3 LYS 45 98.072 -18.624 3.780 357 HG2 LYS 45 HG3 LYS 45 96.445 -19.440 5.679 358 HG3 LYS 45 HG2 LYS 45 95.750 -17.807 5.544 359 HD2 LYS 45 HD2 LYS 45 96.071 -19.826 3.279 360 HD3 LYS 45 HD3 LYS 45 94.543 -19.358 4.063 361 HE2 LYS 45 HE2 LYS 45 96.393 -17.568 2.427 362 HE3 LYS 45 HE3 LYS 45 94.752 -18.101 1.988 363 HZ1 LYS 45 HZ1 LYS 45 94.340 -16.069 2.893 364 HZ2 LYS 45 HZ2 LYS 45 94.194 -16.990 4.253 365 HZ3 LYS 45 HZ3 LYS 45 95.579 -16.138 3.978 366 H THR 46 H THR 46 99.436 -19.541 7.756 367 HA THR 46 HA THR 46 101.176 -21.324 6.151 368 HB THR 46 HB THR 46 100.331 -21.537 9.076 369 HG1 THR 46 HG1 THR 46 101.459 -19.728 9.136 370 HG21 THR 46 HG21 THR 46 102.424 -22.851 9.279 371 HG22 THR 46 HG22 THR 46 102.708 -22.666 7.532 372 HG23 THR 46 HG23 THR 46 101.308 -23.600 8.112 373 H VAL 47 H VAL 47 100.205 -22.869 4.916 374 HA VAL 47 HA VAL 47 97.656 -24.082 5.923 375 HB VAL 47 HB VAL 47 98.886 -25.018 3.366 376 HG11 VAL 47 HG11 VAL 47 96.667 -25.786 4.166 377 HG12 VAL 47 HG12 VAL 47 96.098 -24.100 4.198 378 HG13 VAL 47 HG13 VAL 47 96.520 -24.867 2.649 379 HG21 VAL 47 HG21 VAL 47 97.859 -22.936 2.243 380 HG22 VAL 47 HG22 VAL 47 99.409 -22.700 3.084 381 HG23 VAL 47 HG23 VAL 47 97.891 -22.185 3.856 382 H GLN 48 H GLN 48 97.430 -26.453 5.714 383 HA GLN 48 HA GLN 48 99.280 -27.835 7.370 384 HB2 GLN 48 HB3 GLN 48 98.070 -29.823 6.816 385 HB3 GLN 48 HB2 GLN 48 96.887 -28.497 6.715 386 HG2 GLN 48 HG2 GLN 48 97.431 -28.367 4.219 387 HG3 GLN 48 HG3 GLN 48 98.328 -29.891 4.422 388 HE21 GLN 48 HE21 GLN 48 95.935 -30.113 6.702 389 HE22 GLN 48 HE22 GLN 48 94.697 -30.901 5.750 390 H LEU 49 H LEU 49 100.741 -29.602 6.878 391 HA LEU 49 HA LEU 49 102.612 -28.931 4.753 392 HB2 LEU 49 HB3 LEU 49 102.339 -31.511 6.365 393 HB3 LEU 49 HB2 LEU 49 103.764 -31.016 5.422 394 HG LEU 49 HG LEU 49 103.446 -28.797 6.960 395 HD11 LEU 49 HD11 LEU 49 103.130 -30.333 9.292 396 HD12 LEU 49 HD12 LEU 49 101.952 -29.180 8.621 397 HD13 LEU 49 HD13 LEU 49 101.839 -30.908 8.209 398 HD21 LEU 49 HD21 LEU 49 105.511 -30.153 6.699 399 HD22 LEU 49 HD22 LEU 49 104.847 -31.374 7.811 400 HD23 LEU 49 HD23 LEU 49 105.227 -29.740 8.406 401 H ARG 50 H ARG 50 99.939 -31.252 5.047 402 HA ARG 50 HA ARG 50 100.435 -33.000 2.915 403 HB2 ARG 50 HB2 ARG 50 97.727 -31.662 3.155 404 HB3 ARG 50 HB3 ARG 50 98.106 -33.362 2.788 405 HG2 ARG 50 HG2 ARG 50 99.205 -33.343 5.188 406 HG3 ARG 50 HG3 ARG 50 98.167 -31.920 5.446 407 HD2 ARG 50 HD3 ARG 50 97.421 -34.794 5.086 408 HD3 ARG 50 HD2 ARG 50 96.645 -33.529 6.069 409 HE ARG 50 HE ARG 50 96.064 -32.659 3.524 410 HH11 ARG 50 HH11 ARG 50 94.328 -33.408 2.288 411 HH12 ARG 50 HH12 ARG 50 93.688 -35.013 2.558 412 HH21 ARG 50 HH21 ARG 50 95.944 -35.758 5.105 413 HH22 ARG 50 HH22 ARG 50 94.599 -36.339 4.148 414 H ASN 51 H ASN 51 99.342 -29.612 2.730 415 HA ASN 51 HA ASN 51 99.003 -29.664 -0.180 416 HB2 ASN 51 HB2 ASN 51 98.058 -27.965 1.557 417 HB3 ASN 51 HB3 ASN 51 99.655 -27.187 1.447 418 HD21 ASN 51 HD21 ASN 51 97.621 -28.784 -1.101 419 HD22 ASN 51 HD22 ASN 51 97.565 -27.373 -2.135 420 H GLY 52 H GLY 52 101.715 -29.334 1.993 421 HA2 GLY 52 HA2 GLY 52 103.820 -29.877 0.403 422 HA3 GLY 52 HA3 GLY 52 103.443 -28.247 -0.205 423 H ASN 53 H ASN 53 103.851 -29.931 2.962 424 HA ASN 53 HA ASN 53 104.954 -29.178 4.914 425 HB2 ASN 53 HB2 ASN 53 106.773 -28.948 2.976 426 HB3 ASN 53 HB3 ASN 53 106.551 -27.209 3.283 427 HD21 ASN 53 HD21 ASN 53 106.290 -26.937 5.975 428 HD22 ASN 53 HD22 ASN 53 107.649 -27.639 6.823 429 H LEU 54 H LEU 54 104.983 -27.376 6.424 430 HA LEU 54 HA LEU 54 102.807 -25.682 6.496 431 HB2 LEU 54 HB2 LEU 54 105.644 -24.846 7.257 432 HB3 LEU 54 HB3 LEU 54 104.142 -24.105 7.860 433 HG LEU 54 HG LEU 54 104.523 -27.085 8.142 434 HD11 LEU 54 HD11 LEU 54 106.632 -26.086 8.984 435 HD12 LEU 54 HD12 LEU 54 105.643 -26.715 10.323 436 HD13 LEU 54 HD13 LEU 54 105.695 -24.965 10.001 437 HD21 LEU 54 HD21 LEU 54 102.362 -26.010 8.716 438 HD22 LEU 54 HD22 LEU 54 103.152 -26.671 10.167 439 HD23 LEU 54 HD23 LEU 54 103.203 -24.921 9.844 440 H GLN 55 H GLN 55 102.001 -24.572 4.751 441 HA GLN 55 HA GLN 55 103.982 -23.062 3.055 442 HB2 GLN 55 HB2 GLN 55 102.021 -24.701 2.231 443 HB3 GLN 55 HB3 GLN 55 101.065 -23.205 2.355 444 HG2 GLN 55 HG2 GLN 55 102.638 -22.034 0.884 445 HG3 GLN 55 HG3 GLN 55 103.695 -23.466 0.829 446 HE21 GLN 55 HE21 GLN 55 100.981 -25.107 0.875 447 HE22 GLN 55 HE22 GLN 55 100.505 -25.076 -0.809 448 H TYR 56 H TYR 56 104.365 -21.154 4.167 449 HA TYR 56 HA TYR 56 102.112 -19.618 5.334 450 HB2 TYR 56 HB2 TYR 56 104.990 -18.750 4.796 451 HB3 TYR 56 HB3 TYR 56 103.827 -17.954 5.881 452 HD1 TYR 56 HD1 TYR 56 103.629 -18.636 8.124 453 HD2 TYR 56 HD2 TYR 56 105.626 -21.195 5.309 454 HE1 TYR 56 HE1 TYR 56 104.349 -20.115 9.979 455 HE2 TYR 56 HE2 TYR 56 106.340 -22.676 7.166 456 HH TYR 56 HH TYR 56 105.438 -23.196 9.585 457 H ASP 57 H ASP 57 100.710 -18.674 3.894 458 HA ASP 57 HA ASP 57 101.635 -17.840 1.220 459 HB2 ASP 57 HB2 ASP 57 99.263 -18.627 1.864 460 HB3 ASP 57 HB3 ASP 57 99.040 -17.008 2.570 461 H LEU 58 H LEU 58 102.113 -15.746 0.531 462 HA LEU 58 HA LEU 58 102.396 -13.737 2.774 463 HB2 LEU 58 HB3 LEU 58 103.893 -14.224 0.183 464 HB3 LEU 58 HB2 LEU 58 103.939 -12.626 0.962 465 HG LEU 58 HG LEU 58 105.801 -14.343 1.572 466 HD11 LEU 58 HD11 LEU 58 105.761 -12.395 2.878 467 HD12 LEU 58 HD12 LEU 58 104.119 -12.715 3.486 468 HD13 LEU 58 HD13 LEU 58 105.495 -13.662 4.100 469 HD21 LEU 58 HD21 LEU 58 105.226 -15.930 3.345 470 HD22 LEU 58 HD22 LEU 58 103.534 -15.379 3.330 471 HD23 LEU 58 HD23 LEU 58 104.200 -16.243 1.924 472 H HIS 59 H HIS 59 100.491 -12.560 2.758 473 HA HIS 59 HA HIS 59 99.742 -11.358 0.079 474 HB2 HIS 59 HB2 HIS 59 97.457 -11.189 1.688 475 HB3 HIS 59 HB3 HIS 59 97.728 -12.355 0.372 476 HD2 HIS 59 HD2 HIS 59 99.589 -14.582 1.690 477 HE1 HIS 59 HE1 HIS 59 97.012 -14.527 5.036 478 H TYR 60 H TYR 60 100.376 -9.266 0.109 479 HA TYR 60 HA TYR 60 100.214 -7.800 2.739 480 HB2 TYR 60 HB2 TYR 60 101.436 -6.018 1.132 481 HB3 TYR 60 HB3 TYR 60 102.331 -7.317 1.955 482 HD1 TYR 60 HD1 TYR 60 102.337 -9.642 0.628 483 HD2 TYR 60 HD2 TYR 60 101.729 -5.784 -1.160 484 HE1 TYR 60 HE1 TYR 60 103.042 -10.547 -1.570 485 HE2 TYR 60 HE2 TYR 60 102.431 -6.691 -3.358 486 HH TYR 60 HH TYR 60 102.577 -9.887 -4.090 487 H TRP 61 H TRP 61 98.577 -6.382 3.060 488 HA TRP 61 HA TRP 61 96.868 -5.713 0.675 489 HB2 TRP 61 HB3 TRP 61 95.920 -6.701 2.864 490 HB3 TRP 61 HB2 TRP 61 96.245 -5.106 3.586 491 HD1 TRP 61 HD1 TRP 61 94.139 -6.798 0.857 492 HE1 TRP 61 HE1 TRP 61 92.162 -5.267 0.229 493 HE3 TRP 61 HE3 TRP 61 95.403 -2.676 3.591 494 HZ2 TRP 61 HZ2 TRP 61 91.260 -2.599 0.850 495 HZ3 TRP 61 HZ3 TRP 61 93.970 -0.654 3.555 496 HH2 TRP 61 HH2 TRP 61 91.902 -0.612 2.187 497 H LEU 62 H LEU 62 96.775 -3.687 -0.136 498 HA LEU 62 HA LEU 62 97.895 -1.443 1.544 499 HB2 LEU 62 HB3 LEU 62 98.408 -1.466 -1.425 500 HB3 LEU 62 HB2 LEU 62 99.353 -0.713 -0.119 501 HG LEU 62 HG LEU 62 99.123 -3.732 -0.425 502 HD11 LEU 62 HD11 LEU 62 100.306 -3.448 -2.358 503 HD12 LEU 62 HD12 LEU 62 101.665 -3.078 -1.270 504 HD13 LEU 62 HD13 LEU 62 100.704 -1.756 -1.974 505 HD21 LEU 62 HD21 LEU 62 101.578 -2.578 0.684 506 HD22 LEU 62 HD22 LEU 62 100.139 -2.049 1.587 507 HD23 LEU 62 HD23 LEU 62 100.478 -3.785 1.392 508 H GLY 63 H GLY 63 96.230 -0.027 1.782 509 HA2 GLY 63 HA2 GLY 63 93.879 -0.083 0.073 510 HA3 GLY 63 HA3 GLY 63 94.268 1.191 1.252 511 H ASN 64 H ASN 64 96.717 0.507 -1.079 512 HA ASN 64 HA ASN 64 97.501 1.763 -2.917 513 HB2 ASN 64 HB3 ASN 64 95.063 1.199 -3.668 514 HB3 ASN 64 HB2 ASN 64 94.712 2.896 -3.259 515 HD21 ASN 64 HD21 ASN 64 94.915 4.262 -5.026 516 HD22 ASN 64 HD22 ASN 64 96.043 4.029 -6.342 517 H GLU 65 H GLU 65 96.413 3.070 -0.083 518 HA GLU 65 HA GLU 65 96.980 5.900 -0.984 519 HB2 GLU 65 HB2 GLU 65 95.319 4.662 1.168 520 HB3 GLU 65 HB3 GLU 65 96.181 6.155 1.611 521 HG2 GLU 65 HG3 GLU 65 94.478 5.878 -0.902 522 HG3 GLU 65 HG2 GLU 65 93.859 6.518 0.639 523 H CYS 66 H CYS 66 98.736 3.373 -0.089 524 HA CYS 66 HA CYS 66 100.328 4.827 2.016 525 HB2 CYS 66 HB2 CYS 66 99.748 2.482 2.510 526 HB3 CYS 66 HB3 CYS 66 100.492 1.960 0.979 527 HG CYS 66 HG CYS 66 102.469 1.327 2.813 528 H SER 67 H SER 67 102.276 5.731 1.514 529 HA SER 67 HA SER 67 103.100 6.223 -1.144 530 HB2 SER 67 HB3 SER 67 103.986 7.229 1.075 531 HB3 SER 67 HB2 SER 67 105.097 5.839 1.112 532 HG SER 67 HG SER 67 105.799 7.879 -0.022 533 H GLN 68 H GLN 68 104.893 5.326 -2.412 534 HA GLN 68 HA GLN 68 104.823 2.383 -2.401 535 HB2 GLN 68 HB3 GLN 68 106.736 4.145 -3.977 536 HB3 GLN 68 HB2 GLN 68 106.130 2.526 -4.400 537 HG2 GLN 68 HG2 GLN 68 103.796 3.519 -4.483 538 HG3 GLN 68 HG3 GLN 68 104.540 5.125 -4.296 539 HE21 GLN 68 HE21 GLN 68 106.889 4.740 -5.909 540 HE22 GLN 68 HE22 GLN 68 106.374 4.528 -7.567 541 H ASP 69 H ASP 69 106.662 4.736 -0.745 542 HA ASP 69 HA ASP 69 109.160 3.161 -0.622 543 HB2 ASP 69 HB2 ASP 69 109.794 4.830 1.129 544 HB3 ASP 69 HB3 ASP 69 109.227 5.606 -0.369 545 H GLU 70 H GLU 70 106.315 3.714 1.477 546 HA GLU 70 HA GLU 70 107.439 1.856 3.522 547 HB2 GLU 70 HB2 GLU 70 106.181 3.768 4.342 548 HB3 GLU 70 HB3 GLU 70 104.794 3.356 3.306 549 HG2 GLU 70 HG2 GLU 70 104.392 1.309 4.549 550 HG3 GLU 70 HG3 GLU 70 105.895 1.521 5.477 551 H SER 71 H SER 71 104.998 1.910 0.958 552 HA SER 71 HA SER 71 103.754 -0.621 1.685 553 HB2 SER 71 HB2 SER 71 102.644 0.970 0.181 554 HB3 SER 71 HB3 SER 71 103.970 0.820 -0.997 555 HG SER 71 HG SER 71 102.169 -0.550 -1.505 556 H GLY 72 H GLY 72 106.030 0.148 -1.010 557 HA2 GLY 72 HA3 GLY 72 106.573 -2.510 -1.797 558 HA3 GLY 72 HA2 GLY 72 107.768 -1.194 -1.897 559 H ALA 73 H ALA 73 107.973 -0.657 0.917 560 HA ALA 73 HA ALA 73 109.990 -2.557 1.662 561 HB1 ALA 73 HB1 ALA 73 109.821 -1.553 3.924 562 HB2 ALA 73 HB2 ALA 73 109.797 -0.297 2.664 563 HB3 ALA 73 HB3 ALA 73 108.284 -0.782 3.466 564 H ALA 74 H ALA 74 106.654 -2.214 3.005 565 HA ALA 74 HA ALA 74 106.649 -4.497 4.651 566 HB1 ALA 74 HB1 ALA 74 104.344 -3.697 2.823 567 HB2 ALA 74 HB2 ALA 74 104.236 -4.564 4.373 568 HB3 ALA 74 HB3 ALA 74 104.744 -2.858 4.341 569 H ALA 75 H ALA 75 106.154 -4.322 1.121 570 HA ALA 75 HA ALA 75 105.650 -7.188 0.843 571 HB1 ALA 75 HB1 ALA 75 106.041 -6.777 -1.571 572 HB2 ALA 75 HB2 ALA 75 106.677 -5.158 -1.193 573 HB3 ALA 75 HB3 ALA 75 104.966 -5.538 -0.880 574 H ILE 76 H ILE 76 108.491 -5.224 1.253 575 HA ILE 76 HA ILE 76 110.313 -7.284 0.127 576 HB ILE 76 HB ILE 76 110.783 -4.695 1.666 577 HG12 ILE 76 HG12 ILE 76 109.925 -4.883 -0.847 578 HG13 ILE 76 HG13 ILE 76 111.188 -3.709 -0.405 579 HG21 ILE 76 HG21 ILE 76 112.668 -6.025 2.208 580 HG22 ILE 76 HG22 ILE 76 112.686 -6.807 0.609 581 HG23 ILE 76 HG23 ILE 76 113.193 -5.108 0.775 582 HD11 ILE 76 HD11 ILE 76 111.606 -5.221 -2.482 583 HD12 ILE 76 HD12 ILE 76 112.920 -5.062 -1.292 584 HD13 ILE 76 HD13 ILE 76 111.899 -6.519 -1.300 585 H PHE 77 H PHE 77 109.595 -5.913 3.384 586 HA PHE 77 HA PHE 77 111.330 -7.732 4.803 587 HB2 PHE 77 HB3 PHE 77 108.908 -6.080 5.541 588 HB3 PHE 77 HB2 PHE 77 109.570 -7.247 6.711 589 HD1 PHE 77 HD1 PHE 77 109.798 -3.928 5.516 590 HD2 PHE 77 HD2 PHE 77 112.224 -7.166 6.958 591 HE1 PHE 77 HE1 PHE 77 111.596 -2.322 6.097 592 HE2 PHE 77 HE2 PHE 77 114.020 -5.560 7.544 593 HZ PHE 77 HZ PHE 77 113.706 -3.137 7.113 594 H THR 78 H THR 78 107.956 -7.993 3.705 595 HA THR 78 HA THR 78 107.524 -10.549 5.105 596 HB THR 78 HB THR 78 105.784 -8.769 4.250 597 HG1 THR 78 HG1 THR 78 104.573 -11.010 3.581 598 HG21 THR 78 HG21 THR 78 104.875 -9.200 2.043 599 HG22 THR 78 HG22 THR 78 105.974 -10.580 1.807 600 HG23 THR 78 HG23 THR 78 106.625 -8.924 1.867 601 H VAL 79 H VAL 79 108.195 -9.570 1.721 602 HA VAL 79 HA VAL 79 108.184 -12.270 0.672 603 HB VAL 79 HB VAL 79 109.560 -9.716 -0.257 604 HG11 VAL 79 HG11 VAL 79 110.792 -11.703 -1.085 605 HG12 VAL 79 HG12 VAL 79 109.268 -12.397 -1.687 606 HG13 VAL 79 HG13 VAL 79 109.910 -10.901 -2.407 607 HG21 VAL 79 HG21 VAL 79 107.267 -11.170 -1.593 608 HG22 VAL 79 HG22 VAL 79 107.705 -9.447 -1.675 609 HG23 VAL 79 HG23 VAL 79 106.953 -10.105 -0.202 610 H GLN 80 H GLN 80 110.928 -10.143 1.655 611 HA GLN 80 HA GLN 80 112.948 -12.163 1.235 612 HB2 GLN 80 HB2 GLN 80 112.787 -9.675 2.962 613 HB3 GLN 80 HB3 GLN 80 114.215 -10.736 3.013 614 HG2 GLN 80 HG2 GLN 80 114.407 -10.516 0.518 615 HG3 GLN 80 HG3 GLN 80 113.060 -9.354 0.551 616 HE21 GLN 80 HE21 GLN 80 116.328 -9.368 0.287 617 HE22 GLN 80 HE22 GLN 80 116.715 -7.900 1.155 618 H LEU 81 H LEU 81 111.513 -11.059 4.370 619 HA LEU 81 HA LEU 81 112.673 -13.115 5.955 620 HB2 LEU 81 HB2 LEU 81 111.192 -11.086 6.663 621 HB3 LEU 81 HB3 LEU 81 109.818 -12.183 6.390 622 HG LEU 81 HG LEU 81 110.550 -12.220 8.764 623 HD11 LEU 81 HD11 LEU 81 110.443 -14.553 9.016 624 HD12 LEU 81 HD12 LEU 81 109.748 -14.314 7.395 625 HD13 LEU 81 HD13 LEU 81 111.435 -14.853 7.568 626 HD21 LEU 81 HD21 LEU 81 112.728 -12.653 9.446 627 HD22 LEU 81 HD22 LEU 81 113.057 -11.828 7.903 628 HD23 LEU 81 HD23 LEU 81 113.107 -13.605 7.990 629 H ASP 82 H ASP 82 109.520 -13.140 4.212 630 HA ASP 82 HA ASP 82 108.616 -15.698 4.919 631 HB2 ASP 82 HB2 ASP 82 107.293 -14.394 3.395 632 HB3 ASP 82 HB3 ASP 82 108.615 -14.320 2.205 633 H ASP 83 H ASP 83 111.071 -14.898 2.417 634 HA ASP 83 HA ASP 83 111.585 -17.641 1.682 635 HB2 ASP 83 HB3 ASP 83 112.445 -15.483 0.546 636 HB3 ASP 83 HB2 ASP 83 113.708 -15.467 1.800 637 H TYR 84 H TYR 84 112.696 -15.579 4.336 638 HA TYR 84 HA TYR 84 114.661 -17.538 5.308 639 HB2 TYR 84 HB2 TYR 84 115.007 -15.253 5.961 640 HB3 TYR 84 HB3 TYR 84 113.336 -15.097 6.551 641 HD1 TYR 84 HD1 TYR 84 112.617 -16.533 8.543 642 HD2 TYR 84 HD2 TYR 84 116.724 -16.043 7.383 643 HE1 TYR 84 HE1 TYR 84 113.341 -17.296 10.788 644 HE2 TYR 84 HE2 TYR 84 117.448 -16.807 9.629 645 HH TYR 84 HH TYR 84 116.356 -16.827 12.027 646 H LEU 85 H LEU 85 111.211 -17.057 5.581 647 HA LEU 85 HA LEU 85 110.963 -18.725 8.013 648 HB2 LEU 85 HB2 LEU 85 109.327 -16.892 6.704 649 HB3 LEU 85 HB3 LEU 85 108.565 -18.452 6.314 650 HG LEU 85 HG LEU 85 109.346 -17.573 9.129 651 HD11 LEU 85 HD11 LEU 85 106.911 -17.241 9.462 652 HD12 LEU 85 HD12 LEU 85 106.626 -17.623 7.747 653 HD13 LEU 85 HD13 LEU 85 107.537 -16.160 8.193 654 HD21 LEU 85 HD21 LEU 85 109.280 -20.025 8.763 655 HD22 LEU 85 HD22 LEU 85 107.930 -19.496 9.795 656 HD23 LEU 85 HD23 LEU 85 107.642 -19.878 8.081 657 H ASN 86 H ASN 86 110.094 -19.139 4.537 658 HA ASN 86 HA ASN 86 110.318 -22.120 5.029 659 HB2 ASN 86 HB2 ASN 86 107.969 -21.234 4.578 660 HB3 ASN 86 HB3 ASN 86 108.538 -20.778 2.955 661 HD21 ASN 86 HD21 ASN 86 109.659 -23.687 4.731 662 HD22 ASN 86 HD22 ASN 86 108.927 -24.833 3.632 663 H GLY 87 H GLY 87 110.700 -19.468 2.665 664 HA2 GLY 87 HA2 GLY 87 112.869 -19.448 1.387 665 HA3 GLY 87 HA3 GLY 87 112.738 -21.220 1.266 666 H ARG 88 H ARG 88 109.668 -20.599 0.947 667 HA ARG 88 HA ARG 88 109.716 -19.540 -1.858 668 HB2 ARG 88 HB2 ARG 88 108.899 -22.344 -1.030 669 HB3 ARG 88 HB3 ARG 88 108.222 -21.572 -2.484 670 HG2 ARG 88 HG2 ARG 88 110.433 -21.289 -3.444 671 HG3 ARG 88 HG3 ARG 88 111.210 -21.827 -1.935 672 HD2 ARG 88 HD3 ARG 88 110.108 -24.057 -2.202 673 HD3 ARG 88 HD2 ARG 88 109.426 -23.510 -3.752 674 HE ARG 88 HE ARG 88 112.096 -23.048 -4.177 675 HH11 ARG 88 HH11 ARG 88 113.594 -24.613 -4.819 676 HH12 ARG 88 HH12 ARG 88 113.324 -26.297 -4.429 677 HH21 ARG 88 HH21 ARG 88 110.317 -25.695 -2.778 678 HH22 ARG 88 HH22 ARG 88 111.475 -26.908 -3.277 679 H ALA 89 H ALA 89 107.352 -21.418 0.084 680 HA ALA 89 HA ALA 89 105.163 -20.820 0.750 681 HB1 ALA 89 HB1 ALA 89 106.901 -18.497 1.298 682 HB2 ALA 89 HB2 ALA 89 105.652 -19.248 2.320 683 HB3 ALA 89 HB3 ALA 89 105.190 -18.057 1.080 684 H VAL 90 H VAL 90 103.479 -18.751 0.240 685 HA VAL 90 HA VAL 90 103.437 -18.704 -2.785 686 HB VAL 90 HB VAL 90 101.037 -18.078 -1.063 687 HG11 VAL 90 HG11 VAL 90 100.942 -17.795 -3.525 688 HG12 VAL 90 HG12 VAL 90 101.442 -19.490 -3.739 689 HG13 VAL 90 HG13 VAL 90 99.872 -19.113 -2.991 690 HG21 VAL 90 HG21 VAL 90 100.557 -20.632 -1.317 691 HG22 VAL 90 HG22 VAL 90 102.316 -20.787 -1.538 692 HG23 VAL 90 HG23 VAL 90 101.665 -20.110 -0.026 693 H GLN 91 H GLN 91 102.901 -16.718 -3.842 694 HA GLN 91 HA GLN 91 103.398 -14.306 -2.087 695 HB2 GLN 91 HB2 GLN 91 103.825 -13.269 -4.481 696 HB3 GLN 91 HB3 GLN 91 105.079 -14.275 -3.718 697 HG2 GLN 91 HG2 GLN 91 102.966 -15.561 -5.458 698 HG3 GLN 91 HG3 GLN 91 104.369 -14.764 -6.209 699 HE21 GLN 91 HE21 GLN 91 106.533 -15.649 -5.744 700 HE22 GLN 91 HE22 GLN 91 106.705 -17.271 -5.110 701 H HIS 92 H HIS 92 101.824 -12.767 -1.919 702 HA HIS 92 HA HIS 92 99.608 -12.795 -3.959 703 HB2 HIS 92 HB2 HIS 92 99.362 -13.187 -0.967 704 HB3 HIS 92 HB3 HIS 92 98.050 -12.400 -1.877 705 HD2 HIS 92 HD2 HIS 92 100.088 -15.823 -2.314 706 HE1 HIS 92 HE1 HIS 92 96.077 -16.406 -3.501 707 H ARG 93 H ARG 93 99.287 -10.754 -4.674 708 HA ARG 93 HA ARG 93 100.232 -8.504 -2.884 709 HB2 ARG 93 HB2 ARG 93 100.592 -7.212 -4.902 710 HB3 ARG 93 HB3 ARG 93 101.349 -8.805 -5.144 711 HG2 ARG 93 HG2 ARG 93 98.953 -9.428 -6.126 712 HG3 ARG 93 HG3 ARG 93 98.840 -7.669 -6.373 713 HD2 ARG 93 HD3 ARG 93 101.045 -9.509 -7.407 714 HD3 ARG 93 HD2 ARG 93 99.783 -8.718 -8.381 715 HE ARG 93 HE ARG 93 101.301 -6.743 -6.858 716 HH11 ARG 93 HH11 ARG 93 102.750 -5.479 -8.046 717 HH12 ARG 93 HH12 ARG 93 103.254 -5.991 -9.641 718 HH21 ARG 93 HH21 ARG 93 101.335 -8.896 -9.594 719 HH22 ARG 93 HH22 ARG 93 102.456 -7.918 -10.514 720 H GLU 94 H GLU 94 98.752 -7.025 -2.195 721 HA GLU 94 HA GLU 94 96.064 -7.016 -3.582 722 HB2 GLU 94 HB2 GLU 94 96.749 -7.464 -0.700 723 HB3 GLU 94 HB3 GLU 94 95.347 -6.421 -1.038 724 HG2 GLU 94 HG2 GLU 94 94.116 -8.144 -1.965 725 HG3 GLU 94 HG3 GLU 94 95.557 -8.977 -2.594 726 H VAL 95 H VAL 95 96.602 -5.081 -4.687 727 HA VAL 95 HA VAL 95 97.349 -2.724 -2.973 728 HB VAL 95 HB VAL 95 96.998 -2.580 -5.965 729 HG11 VAL 95 HG11 VAL 95 97.576 -0.561 -4.646 730 HG12 VAL 95 HG12 VAL 95 98.915 -1.028 -5.722 731 HG13 VAL 95 HG13 VAL 95 98.998 -1.402 -3.983 732 HG21 VAL 95 HG21 VAL 95 99.504 -3.299 -6.020 733 HG22 VAL 95 HG22 VAL 95 99.171 -4.050 -4.441 734 HG23 VAL 95 HG23 VAL 95 98.273 -4.577 -5.884 735 H GLN 96 H GLN 96 94.699 -3.835 -2.706 736 HA GLN 96 HA GLN 96 92.451 -3.109 -2.729 737 HB2 GLN 96 HB3 GLN 96 93.936 -0.954 -2.012 738 HB3 GLN 96 HB2 GLN 96 93.217 -0.324 -3.513 739 HG2 GLN 96 HG2 GLN 96 90.983 -1.337 -2.497 740 HG3 GLN 96 HG3 GLN 96 91.865 -1.189 -0.958 741 HE21 GLN 96 HE21 GLN 96 92.319 0.947 -0.140 742 HE22 GLN 96 HE22 GLN 96 91.651 2.382 -0.884 743 H GLY 97 H GLY 97 91.837 -4.258 -4.624 744 HA2 GLY 97 HA2 GLY 97 90.423 -3.297 -6.637 745 HA3 GLY 97 HA3 GLY 97 91.998 -2.684 -7.195 746 H PHE 98 H PHE 98 93.477 -5.032 -6.171 747 HA PHE 98 HA PHE 98 92.435 -7.108 -8.113 748 HB2 PHE 98 HB2 PHE 98 95.384 -6.795 -7.561 749 HB3 PHE 98 HB3 PHE 98 94.567 -7.424 -9.011 750 HD1 PHE 98 HD1 PHE 98 93.641 -5.905 -10.691 751 HD2 PHE 98 HD2 PHE 98 95.620 -4.391 -7.192 752 HE1 PHE 98 HE1 PHE 98 93.776 -3.661 -11.738 753 HE2 PHE 98 HE2 PHE 98 95.754 -2.146 -8.240 754 HZ PHE 98 HZ PHE 98 94.835 -1.783 -10.513 755 H GLU 99 H GLU 99 91.551 -7.444 -5.635 756 HA GLU 99 HA GLU 99 93.540 -8.951 -4.009 757 HB2 GLU 99 HB2 GLU 99 90.594 -9.002 -3.411 758 HB3 GLU 99 HB3 GLU 99 91.976 -8.854 -2.298 759 HG2 GLU 99 HG3 GLU 99 90.879 -6.701 -4.159 760 HG3 GLU 99 HG2 GLU 99 90.826 -6.708 -2.379 761 H SER 100 H SER 100 92.872 -11.193 -3.211 762 HA SER 100 HA SER 100 91.946 -12.765 -5.609 763 HB2 SER 100 HB2 SER 100 94.168 -13.297 -4.530 764 HB3 SER 100 HB3 SER 100 93.285 -13.756 -3.053 765 HG SER 100 HG SER 100 93.690 -15.565 -4.447 766 H ALA 101 H ALA 101 90.503 -14.645 -5.185 767 HA ALA 101 HA ALA 101 88.202 -13.823 -3.603 768 HB1 ALA 101 HB1 ALA 101 87.310 -16.071 -4.156 769 HB2 ALA 101 HB2 ALA 101 88.012 -15.289 -5.593 770 HB3 ALA 101 HB3 ALA 101 88.917 -16.564 -4.741 771 H THR 102 H THR 102 90.954 -15.986 -3.007 772 HA THR 102 HA THR 102 89.908 -17.226 -0.616 773 HB THR 102 HB THR 102 92.831 -16.518 -1.077 774 HG1 THR 102 HG1 THR 102 92.866 -18.482 -2.310 775 HG21 THR 102 HG21 THR 102 93.174 -18.684 0.080 776 HG22 THR 102 HG22 THR 102 91.412 -18.894 0.210 777 HG23 THR 102 HG23 THR 102 92.217 -17.568 1.083 778 H PHE 103 H PHE 103 92.273 -14.526 -0.880 779 HA PHE 103 HA PHE 103 92.246 -13.795 1.866 780 HB2 PHE 103 HB2 PHE 103 93.849 -12.755 0.411 781 HB3 PHE 103 HB3 PHE 103 92.572 -12.117 -0.653 782 HD1 PHE 103 HD1 PHE 103 93.811 -11.963 2.888 783 HD2 PHE 103 HD2 PHE 103 91.707 -9.967 -0.282 784 HE1 PHE 103 HE1 PHE 103 93.691 -9.903 4.265 785 HE2 PHE 103 HE2 PHE 103 91.591 -7.906 1.093 786 HZ PHE 103 HZ PHE 103 92.581 -7.875 3.367 787 H LEU 104 H LEU 104 89.989 -12.885 -0.750 788 HA LEU 104 HA LEU 104 88.494 -10.990 0.893 789 HB2 LEU 104 HB2 LEU 104 87.786 -12.562 -1.619 790 HB3 LEU 104 HB3 LEU 104 86.698 -11.365 -0.877 791 HG LEU 104 HG LEU 104 89.562 -10.779 -1.749 792 HD11 LEU 104 HD11 LEU 104 88.510 -9.567 -3.639 793 HD12 LEU 104 HD12 LEU 104 88.108 -11.300 -3.686 794 HD13 LEU 104 HD13 LEU 104 86.907 -10.124 -3.102 795 HD21 LEU 104 HD21 LEU 104 88.688 -9.338 0.073 796 HD22 LEU 104 HD22 LEU 104 87.247 -8.975 -0.907 797 HD23 LEU 104 HD23 LEU 104 88.851 -8.422 -1.445 798 H GLY 105 H GLY 105 88.477 -14.485 0.533 799 HA2 GLY 105 HA2 GLY 105 85.815 -14.850 1.726 800 HA3 GLY 105 HA3 GLY 105 87.046 -16.117 1.499 801 H TYR 106 H TYR 106 89.149 -14.642 2.929 802 HA TYR 106 HA TYR 106 88.455 -15.531 5.638 803 HB2 TYR 106 HB3 TYR 106 90.814 -15.119 4.250 804 HB3 TYR 106 HB2 TYR 106 90.782 -13.718 5.347 805 HD1 TYR 106 HD1 TYR 106 92.119 -16.837 5.121 806 HD2 TYR 106 HD2 TYR 106 89.613 -14.581 7.782 807 HE1 TYR 106 HE1 TYR 106 92.809 -18.293 7.005 808 HE2 TYR 106 HE2 TYR 106 90.302 -16.039 9.666 809 HH TYR 106 HH TYR 106 91.210 -18.504 9.876 810 H PHE 107 H PHE 107 88.905 -12.345 4.052 811 HA PHE 107 HA PHE 107 87.790 -11.076 6.558 812 HB2 PHE 107 HB2 PHE 107 89.255 -9.827 4.190 813 HB3 PHE 107 HB3 PHE 107 88.706 -8.962 5.645 814 HD1 PHE 107 HD1 PHE 107 89.795 -9.328 7.810 815 HD2 PHE 107 HD2 PHE 107 91.135 -11.379 4.283 816 HE1 PHE 107 HE1 PHE 107 91.884 -9.976 8.981 817 HE2 PHE 107 HE2 PHE 107 93.223 -12.029 5.453 818 HZ PHE 107 HZ PHE 107 93.598 -11.327 7.802 819 H LYS 108 H LYS 108 85.620 -11.896 5.838 820 HA LYS 108 HA LYS 108 84.529 -10.364 3.485 821 HB2 LYS 108 HB2 LYS 108 82.483 -11.884 3.978 822 HB3 LYS 108 HB3 LYS 108 83.944 -12.661 3.321 823 HG2 LYS 108 HG2 LYS 108 84.583 -13.506 5.464 824 HG3 LYS 108 HG3 LYS 108 83.435 -12.441 6.311 825 HD2 LYS 108 HD3 LYS 108 81.541 -13.655 5.256 826 HD3 LYS 108 HD2 LYS 108 82.697 -14.729 4.430 827 HE2 LYS 108 HE2 LYS 108 82.075 -14.518 7.389 828 HE3 LYS 108 HE3 LYS 108 82.099 -15.965 6.353 829 HZ1 LYS 108 HZ1 LYS 108 84.077 -16.090 7.492 830 HZ2 LYS 108 HZ2 LYS 108 84.358 -14.465 7.459 831 HZ3 LYS 108 HZ3 LYS 108 84.560 -15.364 6.092 832 H SER 109 H SER 109 84.142 -10.847 6.987 833 HA SER 109 HA SER 109 81.899 -8.869 7.026 834 HB2 SER 109 HB3 SER 109 83.279 -10.272 9.354 835 HB3 SER 109 HB2 SER 109 81.712 -9.427 9.386 836 HG SER 109 HG SER 109 81.481 -11.723 9.151 837 H GLY 110 H GLY 110 85.240 -8.742 6.939 838 HA2 GLY 110 HA2 GLY 110 85.466 -6.464 8.866 839 HA3 GLY 110 HA3 GLY 110 86.805 -7.209 7.961 840 H LEU 111 H LEU 111 87.507 -6.183 6.144 841 HA LEU 111 HA LEU 111 87.634 -4.487 4.517 842 HB2 LEU 111 HB2 LEU 111 84.630 -4.960 4.448 843 HB3 LEU 111 HB3 LEU 111 85.586 -4.142 3.189 844 HG LEU 111 HG LEU 111 86.044 -7.010 4.124 845 HD11 LEU 111 HD11 LEU 111 85.042 -7.640 1.944 846 HD12 LEU 111 HD12 LEU 111 84.700 -5.926 1.607 847 HD13 LEU 111 HD13 LEU 111 83.875 -6.750 2.951 848 HD21 LEU 111 HD21 LEU 111 88.051 -5.860 3.226 849 HD22 LEU 111 HD22 LEU 111 87.481 -7.119 2.105 850 HD23 LEU 111 HD23 LEU 111 87.138 -5.406 1.767 851 H LYS 112 H LYS 112 88.248 -2.684 5.610 852 HA LYS 112 HA LYS 112 86.094 -0.691 6.151 853 HB2 LYS 112 HB2 LYS 112 86.854 -2.194 8.284 854 HB3 LYS 112 HB3 LYS 112 88.113 -0.937 8.344 855 HG2 LYS 112 HG2 LYS 112 86.409 0.042 9.621 856 HG3 LYS 112 HG3 LYS 112 86.076 0.714 8.007 857 HD2 LYS 112 HD2 LYS 112 84.552 -1.379 7.690 858 HD3 LYS 112 HD3 LYS 112 84.649 -1.533 9.460 859 HE2 LYS 112 HE3 LYS 112 83.347 0.600 7.789 860 HE3 LYS 112 HE2 LYS 112 82.789 -0.157 9.300 861 HZ1 LYS 112 HZ1 LYS 112 83.463 1.969 9.896 862 HZ2 LYS 112 HZ2 LYS 112 84.749 1.033 10.334 863 HZ3 LYS 112 HZ3 LYS 112 84.819 1.939 8.957 864 H TYR 113 H TYR 113 87.038 0.475 4.419 865 HA TYR 113 HA TYR 113 89.930 1.123 4.521 866 HB2 TYR 113 HB3 TYR 113 88.877 2.839 2.662 867 HB3 TYR 113 HB2 TYR 113 89.345 1.159 2.306 868 HD1 TYR 113 HD1 TYR 113 86.525 3.450 2.975 869 HD2 TYR 113 HD2 TYR 113 87.662 -0.597 2.086 870 HE1 TYR 113 HE1 TYR 113 84.167 2.906 2.431 871 HE2 TYR 113 HE2 TYR 113 85.304 -1.139 1.543 872 HH TYR 113 HH TYR 113 82.961 -0.151 2.234 873 H LYS 114 H LYS 114 90.549 2.495 6.133 874 HA LYS 114 HA LYS 114 88.794 4.915 6.613 875 HB2 LYS 114 HB2 LYS 114 90.692 3.362 8.406 876 HB3 LYS 114 HB3 LYS 114 90.171 5.016 8.806 877 HG2 LYS 114 HG2 LYS 114 87.775 4.233 8.558 878 HG3 LYS 114 HG3 LYS 114 88.396 2.573 8.389 879 HD2 LYS 114 HD2 LYS 114 89.583 2.891 10.610 880 HD3 LYS 114 HD3 LYS 114 88.708 4.430 10.785 881 HE2 LYS 114 HE2 LYS 114 87.703 1.625 10.986 882 HE3 LYS 114 HE3 LYS 114 87.163 3.094 11.834 883 HZ1 LYS 114 HZ1 LYS 114 86.485 3.635 9.323 884 HZ2 LYS 114 HZ2 LYS 114 85.464 2.933 10.411 885 HZ3 LYS 114 HZ3 LYS 114 86.278 1.999 9.323 886 H LYS 115 H LYS 115 89.610 6.581 5.423 887 HA LYS 115 HA LYS 115 92.368 6.754 4.565 888 HB2 LYS 115 HB2 LYS 115 91.810 8.982 3.816 889 HB3 LYS 115 HB3 LYS 115 90.371 7.967 3.555 890 HG2 LYS 115 HG2 LYS 115 89.639 8.759 5.924 891 HG3 LYS 115 HG3 LYS 115 90.869 10.030 5.725 892 HD2 LYS 115 HD3 LYS 115 88.989 11.093 4.839 893 HD3 LYS 115 HD2 LYS 115 89.687 10.366 3.372 894 HE2 LYS 115 HE2 LYS 115 87.473 9.659 3.189 895 HE3 LYS 115 HE3 LYS 115 88.182 8.289 4.079 896 HZ1 LYS 115 HZ1 LYS 115 86.158 9.073 5.115 897 HZ2 LYS 115 HZ2 LYS 115 87.441 9.318 6.121 898 HZ3 LYS 115 HZ3 LYS 115 86.785 10.587 5.297 899 H GLY 116 H GLY 116 94.155 7.371 5.674 900 HA2 GLY 116 HA2 GLY 116 93.796 9.205 8.030 901 HA3 GLY 116 HA3 GLY 116 94.622 7.651 8.290 902 H GLY 117 H GLY 117 96.210 7.343 6.108 903 HA2 GLY 117 HA2 GLY 117 98.322 8.034 5.302 904 HA3 GLY 117 HA3 GLY 117 97.571 9.635 5.098 905 H VAL 118 H VAL 118 99.112 7.512 7.546 906 HA VAL 118 HA VAL 118 99.590 9.865 9.308 907 HB VAL 118 HB VAL 118 100.824 7.121 9.669 908 HG11 VAL 118 HG11 VAL 118 101.442 8.957 11.217 909 HG12 VAL 118 HG12 VAL 118 99.721 9.234 11.575 910 HG13 VAL 118 HG13 VAL 118 100.496 7.705 12.056 911 HG21 VAL 118 HG21 VAL 118 98.616 6.721 11.035 912 HG22 VAL 118 HG22 VAL 118 97.930 7.966 9.964 913 HG23 VAL 118 HG23 VAL 118 98.593 6.465 9.274 914 H ALA 119 H ALA 119 101.111 8.377 6.635 915 HA ALA 119 HA ALA 119 103.886 8.618 7.294 916 HB1 ALA 119 HB1 ALA 119 104.250 8.846 4.851 917 HB2 ALA 119 HB2 ALA 119 103.053 7.577 5.203 918 HB3 ALA 119 HB3 ALA 119 102.515 9.171 4.623 919 H SER 120 H SER 120 101.465 11.069 6.636 920 HA SER 120 HA SER 120 103.558 13.166 6.263 921 HB2 SER 120 HB2 SER 120 101.358 13.176 4.998 922 HB3 SER 120 HB3 SER 120 100.548 13.529 6.544 923 HG SER 120 HG SER 120 101.092 15.452 5.364 924 H GLY 121 H GLY 121 102.567 11.493 8.809 925 HA2 GLY 121 HA2 GLY 121 101.798 13.486 10.757 926 HA3 GLY 121 HA3 GLY 121 102.540 11.912 11.131 927 H PHE 122 H PHE 122 104.905 12.553 9.385 928 HA PHE 122 HA PHE 122 106.673 13.545 11.382 929 HB2 PHE 122 HB3 PHE 122 106.805 13.478 8.354 930 HB3 PHE 122 HB2 PHE 122 108.126 14.191 9.310 931 HD1 PHE 122 HD1 PHE 122 106.859 11.189 7.922 932 HD2 PHE 122 HD2 PHE 122 108.934 12.710 11.361 933 HE1 PHE 122 HE1 PHE 122 107.743 8.919 8.392 934 HE2 PHE 122 HE2 PHE 122 109.817 10.440 11.831 935 HZ PHE 122 HZ PHE 122 109.220 8.545 10.348 936 H LYS 123 H LYS 123 104.539 15.278 9.191 937 HA LYS 123 HA LYS 123 105.803 17.851 9.241 938 HB2 LYS 123 HB2 LYS 123 103.733 17.109 7.908 939 HB3 LYS 123 HB3 LYS 123 102.797 17.407 9.392 940 HG2 LYS 123 HG3 LYS 123 103.409 19.734 9.416 941 HG3 LYS 123 HG2 LYS 123 104.640 19.490 8.154 942 HD2 LYS 123 HD2 LYS 123 102.746 18.741 6.615 943 HD3 LYS 123 HD3 LYS 123 101.615 19.319 7.862 944 HE2 LYS 123 HE3 LYS 123 101.998 21.074 6.171 945 HE3 LYS 123 HE2 LYS 123 102.662 21.574 7.745 946 HZ1 LYS 123 HZ1 LYS 123 104.216 21.977 5.955 947 HZ2 LYS 123 HZ2 LYS 123 104.210 20.383 5.531 948 HZ3 LYS 123 HZ3 LYS 123 104.826 20.847 6.989 949 H HIS 124 H HIS 124 104.128 16.071 11.743 950 HA HIS 124 HA HIS 124 103.479 18.387 13.406 951 HB2 HIS 124 HB2 HIS 124 102.605 15.914 13.531 952 HB3 HIS 124 HB3 HIS 124 104.064 15.630 14.510 953 HD2 HIS 124 HD2 HIS 124 100.885 18.041 14.672 954 HE1 HIS 124 HE1 HIS 124 102.448 17.541 18.565 955 HE2 HIS 124 HE2 HIS 124 100.547 18.589 17.219 956 H VAL 125 H VAL 125 105.684 19.431 12.985 957 HA VAL 125 HA VAL 125 108.039 18.271 14.271 958 HB VAL 125 HB VAL 125 107.493 21.209 13.675 959 HG11 VAL 125 HG11 VAL 125 109.488 20.726 15.066 960 HG12 VAL 125 HG12 VAL 125 109.959 21.290 13.445 961 HG13 VAL 125 HG13 VAL 125 110.055 19.559 13.847 962 HG21 VAL 125 HG21 VAL 125 108.531 20.751 11.469 963 HG22 VAL 125 HG22 VAL 125 107.038 19.806 11.682 964 HG23 VAL 125 HG23 VAL 125 108.623 19.020 11.872 965 H VAL 126 H VAL 126 108.427 18.138 16.417 966 HA VAL 126 HA VAL 126 106.877 20.010 18.221 967 HB VAL 126 HB VAL 126 108.050 17.236 18.692 968 HG11 VAL 126 HG11 VAL 126 108.403 18.682 20.676 969 HG12 VAL 126 HG12 VAL 126 107.153 17.455 20.993 970 HG13 VAL 126 HG13 VAL 126 106.682 19.137 20.650 971 HG21 VAL 126 HG21 VAL 126 105.876 17.326 17.500 972 HG22 VAL 126 HG22 VAL 126 105.208 18.346 18.797 973 HG23 VAL 126 HG23 VAL 126 105.678 16.664 19.140 974 HA PRO 127 HA PRO 127 111.200 21.396 18.752 975 HB2 PRO 127 HB2 PRO 127 110.592 24.009 19.327 976 HB3 PRO 127 HB3 PRO 127 110.654 23.370 17.659 977 HG2 PRO 127 HG2 PRO 127 108.298 23.992 19.379 978 HG3 PRO 127 HG3 PRO 127 108.497 24.133 17.612 979 HD2 PRO 127 HD3 PRO 127 107.175 22.037 18.952 980 HD3 PRO 127 HD2 PRO 127 107.750 21.985 17.259 981 H ASN 128 H ASN 128 112.366 22.314 20.643 982 HA ASN 128 HA ASN 128 111.467 21.180 23.126 983 HB2 ASN 128 HB3 ASN 128 113.218 22.843 24.109 984 HB3 ASN 128 HB2 ASN 128 113.790 21.607 22.963 985 HD21 ASN 128 HD21 ASN 128 115.600 23.007 22.301 986 HD22 ASN 128 HD22 ASN 128 115.311 24.394 21.274 987 H GLU 129 H GLU 129 109.186 22.032 23.066 988 HA GLU 129 HA GLU 129 108.908 24.927 23.742 989 HB2 GLU 129 HB2 GLU 129 107.270 23.632 22.266 990 HB3 GLU 129 HB3 GLU 129 106.746 22.782 23.740 991 HG2 GLU 129 HG2 GLU 129 106.169 24.945 24.792 992 HG3 GLU 129 HG3 GLU 129 106.715 25.808 23.334 993 H VAL 130 H VAL 130 109.306 21.899 25.358 994 HA VAL 130 HA VAL 130 107.837 22.356 27.774 995 HB VAL 130 HB VAL 130 109.072 20.239 27.134 996 HG11 VAL 130 HG11 VAL 130 111.418 20.076 27.362 997 HG12 VAL 130 HG12 VAL 130 111.520 21.571 28.323 998 HG13 VAL 130 HG13 VAL 130 111.197 21.657 26.575 999 HG21 VAL 130 HG21 VAL 130 109.745 19.710 29.464 1000 HG22 VAL 130 HG22 VAL 130 108.216 20.621 29.432 1001 HG23 VAL 130 HG23 VAL 130 109.735 21.445 29.860 1002 H VAL 131 H VAL 131 111.129 23.419 26.826 1003 HA VAL 131 HA VAL 131 112.007 24.543 29.250 1004 HB VAL 131 HB VAL 131 113.273 24.560 27.078 1005 HG11 VAL 131 HG11 VAL 131 112.777 26.113 25.360 1006 HG12 VAL 131 HG12 VAL 131 111.735 27.090 26.421 1007 HG13 VAL 131 HG13 VAL 131 111.177 25.502 25.843 1008 HG21 VAL 131 HG21 VAL 131 114.345 26.765 27.459 1009 HG22 VAL 131 HG22 VAL 131 112.951 27.273 28.442 1010 HG23 VAL 131 HG23 VAL 131 114.000 25.948 29.002 1011 H VAL 132 H VAL 132 109.461 25.701 27.089 1012 HA VAL 132 HA VAL 132 109.241 28.340 28.340 1013 HB VAL 132 HB VAL 132 107.056 26.792 26.887 1014 HG11 VAL 132 HG11 VAL 132 106.371 28.884 28.030 1015 HG12 VAL 132 HG12 VAL 132 107.668 29.767 27.189 1016 HG13 VAL 132 HG13 VAL 132 106.316 29.074 26.261 1017 HG21 VAL 132 HG21 VAL 132 109.152 26.769 25.558 1018 HG22 VAL 132 HG22 VAL 132 107.938 27.840 24.819 1019 HG23 VAL 132 HG23 VAL 132 109.290 28.533 25.746 1020 H GLN 133 H GLN 133 108.002 25.122 29.054 1021 HA GLN 133 HA GLN 133 106.828 26.257 31.578 1022 HB2 GLN 133 HB2 GLN 133 105.358 24.502 29.565 1023 HB3 GLN 133 HB3 GLN 133 104.816 24.733 31.245 1024 HG2 GLN 133 HG2 GLN 133 105.299 26.995 29.256 1025 HG3 GLN 133 HG3 GLN 133 103.702 26.301 29.625 1026 HE21 GLN 133 HE21 GLN 133 105.850 28.784 30.503 1027 HE22 GLN 133 HE22 GLN 133 105.195 29.129 32.089 Start of MODEL 17 1 H1 GLU 1 H1 GLU 1 108.412 -6.802 24.278 2 H2 GLU 1 H2 GLU 1 109.643 -7.793 23.809 3 H3 GLU 1 H3 GLU 1 108.432 -8.378 24.765 4 HA GLU 1 HA GLU 1 106.878 -8.439 23.085 5 HB2 GLU 1 HB2 GLU 1 107.465 -6.054 22.401 6 HB3 GLU 1 HB3 GLU 1 108.773 -6.741 21.409 7 HG2 GLU 1 HG2 GLU 1 106.935 -6.535 19.911 8 HG3 GLU 1 HG3 GLU 1 106.941 -8.253 20.373 9 H HIS 2 H HIS 2 110.396 -8.495 22.465 10 HA HIS 2 HA HIS 2 111.707 -10.183 21.458 11 HB2 HIS 2 HB3 HIS 2 109.456 -12.160 21.493 12 HB3 HIS 2 HB2 HIS 2 111.150 -12.356 22.001 13 HD2 HIS 2 HD2 HIS 2 111.021 -9.750 24.205 14 HE1 HIS 2 HE1 HIS 2 108.138 -12.187 26.097 15 HE2 HIS 2 HE2 HIS 2 109.699 -10.195 26.429 16 HA PRO 3 HA PRO 3 110.564 -9.941 17.194 17 HB2 PRO 3 HB2 PRO 3 112.193 -11.931 16.157 18 HB3 PRO 3 HB3 PRO 3 112.778 -10.314 16.644 19 HG2 PRO 3 HG2 PRO 3 112.931 -12.921 18.106 20 HG3 PRO 3 HG3 PRO 3 114.124 -11.599 17.994 21 HD2 PRO 3 HD3 PRO 3 112.495 -11.988 20.183 22 HD3 PRO 3 HD2 PRO 3 113.125 -10.382 19.707 23 H GLU 4 H GLU 4 108.361 -10.861 17.815 24 HA GLU 4 HA GLU 4 107.894 -13.730 17.565 25 HB2 GLU 4 HB3 GLU 4 106.348 -12.062 18.693 26 HB3 GLU 4 HB2 GLU 4 105.905 -11.472 17.073 27 HG2 GLU 4 HG2 GLU 4 104.896 -13.526 16.469 28 HG3 GLU 4 HG3 GLU 4 105.732 -14.420 17.762 29 H PHE 5 H PHE 5 108.195 -11.080 15.283 30 HA PHE 5 HA PHE 5 106.822 -12.312 13.054 31 HB2 PHE 5 HB3 PHE 5 108.132 -10.758 11.660 32 HB3 PHE 5 HB2 PHE 5 107.532 -9.923 13.113 33 HD1 PHE 5 HD1 PHE 5 110.516 -11.545 11.579 34 HD2 PHE 5 HD2 PHE 5 109.038 -9.073 14.768 35 HE1 PHE 5 HE1 PHE 5 112.844 -10.975 12.216 36 HE2 PHE 5 HE2 PHE 5 111.366 -8.503 15.404 37 HZ PHE 5 HZ PHE 5 113.268 -9.452 14.127 38 H LEU 6 H LEU 6 110.055 -12.724 14.426 39 HA LEU 6 HA LEU 6 111.403 -13.990 12.287 40 HB2 LEU 6 HB3 LEU 6 112.384 -13.531 14.545 41 HB3 LEU 6 HB2 LEU 6 111.427 -14.878 15.207 42 HG LEU 6 HG LEU 6 112.535 -16.414 13.559 43 HD11 LEU 6 HD11 LEU 6 113.998 -13.836 12.890 44 HD12 LEU 6 HD12 LEU 6 113.188 -14.970 11.782 45 HD13 LEU 6 HD13 LEU 6 114.719 -15.431 12.565 46 HD21 LEU 6 HD21 LEU 6 114.731 -16.452 14.713 47 HD22 LEU 6 HD22 LEU 6 113.407 -16.172 15.868 48 HD23 LEU 6 HD23 LEU 6 114.429 -14.814 15.340 49 H LYS 7 H LYS 7 108.750 -15.196 14.279 50 HA LYS 7 HA LYS 7 109.003 -17.877 12.920 51 HB2 LYS 7 HB2 LYS 7 107.621 -16.882 15.419 52 HB3 LYS 7 HB3 LYS 7 107.046 -18.366 14.622 53 HG2 LYS 7 HG2 LYS 7 109.043 -19.516 15.024 54 HG3 LYS 7 HG3 LYS 7 109.999 -18.020 15.147 55 HD2 LYS 7 HD2 LYS 7 109.054 -17.509 17.316 56 HD3 LYS 7 HD3 LYS 7 107.869 -18.828 17.170 57 HE2 LYS 7 HE3 LYS 7 110.853 -19.366 17.044 58 HE3 LYS 7 HE2 LYS 7 109.995 -19.267 18.601 59 HZ1 LYS 7 HZ1 LYS 7 110.069 -21.521 17.767 60 HZ2 LYS 7 HZ2 LYS 7 108.509 -20.987 17.817 61 HZ3 LYS 7 HZ3 LYS 7 109.304 -21.079 16.374 62 H ALA 8 H ALA 8 106.366 -15.624 13.887 63 HA ALA 8 HA ALA 8 104.373 -15.080 12.747 64 HB1 ALA 8 HB1 ALA 8 106.395 -15.483 10.550 65 HB2 ALA 8 HB2 ALA 8 105.494 -14.018 11.005 66 HB3 ALA 8 HB3 ALA 8 104.681 -15.317 10.099 67 H GLY 9 H GLY 9 102.484 -16.178 12.284 68 HA2 GLY 9 HA2 GLY 9 101.135 -18.124 12.115 69 HA3 GLY 9 HA3 GLY 9 102.139 -18.470 10.686 70 H LYS 10 H LYS 10 103.227 -18.306 14.084 71 HA LYS 10 HA LYS 10 104.910 -20.528 14.040 72 HB2 LYS 10 HB3 LYS 10 103.863 -20.844 16.538 73 HB3 LYS 10 HB2 LYS 10 105.026 -19.565 16.117 74 HG2 LYS 10 HG2 LYS 10 103.061 -18.648 17.331 75 HG3 LYS 10 HG3 LYS 10 103.168 -18.000 15.677 76 HD2 LYS 10 HD2 LYS 10 101.319 -19.197 14.941 77 HD3 LYS 10 HD3 LYS 10 101.567 -20.509 16.117 78 HE2 LYS 10 HE3 LYS 10 100.830 -19.016 17.948 79 HE3 LYS 10 HE2 LYS 10 100.599 -17.692 16.781 80 HZ1 LYS 10 HZ1 LYS 10 98.540 -18.846 17.236 81 HZ2 LYS 10 HZ2 LYS 10 98.968 -19.053 15.657 82 HZ3 LYS 10 HZ3 LYS 10 99.182 -20.281 16.738 83 H GLU 11 H GLU 11 101.418 -20.544 13.867 84 HA GLU 11 HA GLU 11 101.556 -23.535 13.600 85 HB2 GLU 11 HB2 GLU 11 99.928 -21.981 15.619 86 HB3 GLU 11 HB3 GLU 11 99.285 -23.500 14.951 87 HG2 GLU 11 HG2 GLU 11 102.085 -23.282 16.124 88 HG3 GLU 11 HG3 GLU 11 100.665 -23.713 17.108 89 HA PRO 12 HA PRO 12 98.982 -23.158 10.051 90 HB2 PRO 12 HB2 PRO 12 96.993 -24.866 11.550 91 HB3 PRO 12 HB3 PRO 12 97.634 -25.056 9.893 92 HG2 PRO 12 HG2 PRO 12 98.508 -26.543 11.976 93 HG3 PRO 12 HG3 PRO 12 99.552 -26.081 10.606 94 HD2 PRO 12 HD3 PRO 12 99.609 -25.128 13.420 95 HD3 PRO 12 HD2 PRO 12 100.890 -25.051 12.173 96 H GLY 13 H GLY 13 97.809 -21.352 9.584 97 HA2 GLY 13 HA3 GLY 13 95.205 -20.752 10.275 98 HA3 GLY 13 HA2 GLY 13 96.100 -20.139 11.686 99 H LEU 14 H LEU 14 95.123 -18.045 10.840 100 HA LEU 14 HA LEU 14 96.980 -16.879 8.748 101 HB2 LEU 14 HB2 LEU 14 94.681 -17.102 7.865 102 HB3 LEU 14 HB3 LEU 14 94.046 -16.215 9.271 103 HG LEU 14 HG LEU 14 96.180 -15.011 7.479 104 HD11 LEU 14 HD11 LEU 14 94.353 -13.885 6.235 105 HD12 LEU 14 HD12 LEU 14 93.152 -14.825 7.151 106 HD13 LEU 14 HD13 LEU 14 94.269 -15.652 6.039 107 HD21 LEU 14 HD21 LEU 14 94.369 -14.127 9.691 108 HD22 LEU 14 HD22 LEU 14 96.008 -13.575 9.271 109 HD23 LEU 14 HD23 LEU 14 94.605 -12.972 8.357 110 H GLN 15 H GLN 15 98.229 -15.272 9.568 111 HA GLN 15 HA GLN 15 97.216 -13.895 12.069 112 HB2 GLN 15 HB2 GLN 15 100.088 -14.343 11.139 113 HB3 GLN 15 HB3 GLN 15 99.596 -13.513 12.635 114 HG2 GLN 15 HG2 GLN 15 98.205 -15.841 12.908 115 HG3 GLN 15 HG3 GLN 15 99.604 -16.427 11.978 116 HE21 GLN 15 HE21 GLN 15 101.564 -16.716 13.097 117 HE22 GLN 15 HE22 GLN 15 101.820 -16.203 14.750 118 H ILE 16 H ILE 16 97.528 -11.611 12.219 119 HA ILE 16 HA ILE 16 98.204 -10.303 9.570 120 HB ILE 16 HB ILE 16 96.343 -8.915 11.457 121 HG12 ILE 16 HG12 ILE 16 95.591 -11.400 9.860 122 HG13 ILE 16 HG13 ILE 16 95.441 -11.165 11.618 123 HG21 ILE 16 HG21 ILE 16 97.215 -8.310 9.012 124 HG22 ILE 16 HG22 ILE 16 95.540 -7.948 9.495 125 HG23 ILE 16 HG23 ILE 16 95.891 -9.392 8.515 126 HD11 ILE 16 HD11 ILE 16 93.263 -10.687 10.941 127 HD12 ILE 16 HD12 ILE 16 93.984 -9.061 10.875 128 HD13 ILE 16 HD13 ILE 16 93.785 -10.008 9.381 129 H TRP 17 H TRP 17 99.539 -8.511 9.667 130 HA TRP 17 HA TRP 17 100.178 -7.368 12.369 131 HB2 TRP 17 HB2 TRP 17 102.326 -8.376 10.448 132 HB3 TRP 17 HB3 TRP 17 102.588 -7.628 12.042 133 HD1 TRP 17 HD1 TRP 17 100.819 -9.050 13.966 134 HE1 TRP 17 HE1 TRP 17 100.913 -11.582 14.439 135 HE3 TRP 17 HE3 TRP 17 103.084 -10.599 9.658 136 HZ2 TRP 17 HZ2 TRP 17 101.855 -13.959 13.106 137 HZ3 TRP 17 HZ3 TRP 17 103.568 -12.999 9.289 138 HH2 TRP 17 HH2 TRP 17 102.955 -14.679 11.003 139 H ARG 18 H ARG 18 99.745 -5.237 12.026 140 HA ARG 18 HA ARG 18 100.024 -4.085 9.314 141 HB2 ARG 18 HB2 ARG 18 98.831 -2.284 10.132 142 HB3 ARG 18 HB3 ARG 18 98.341 -3.507 11.326 143 HG2 ARG 18 HG2 ARG 18 100.448 -2.706 12.659 144 HG3 ARG 18 HG3 ARG 18 100.361 -1.268 11.614 145 HD2 ARG 18 HD2 ARG 18 98.060 -2.336 13.308 146 HD3 ARG 18 HD3 ARG 18 99.107 -0.968 13.759 147 HE ARG 18 HE ARG 18 96.998 -0.956 11.647 148 HH11 ARG 18 HH11 ARG 18 96.570 1.103 10.826 149 HH12 ARG 18 HH12 ARG 18 97.639 2.436 11.204 150 HH21 ARG 18 HH21 ARG 18 99.780 0.503 13.153 151 HH22 ARG 18 HH22 ARG 18 99.447 2.098 12.516 152 H VAL 19 H VAL 19 101.551 -2.522 8.656 153 HA VAL 19 HA VAL 19 104.038 -2.520 10.349 154 HB VAL 19 HB VAL 19 104.019 -1.264 7.637 155 HG11 VAL 19 HG11 VAL 19 106.078 -1.507 9.001 156 HG12 VAL 19 HG12 VAL 19 105.830 -3.269 9.059 157 HG13 VAL 19 HG13 VAL 19 106.181 -2.470 7.508 158 HG21 VAL 19 HG21 VAL 19 104.276 -3.635 6.660 159 HG22 VAL 19 HG22 VAL 19 102.625 -3.126 7.087 160 HG23 VAL 19 HG23 VAL 19 103.527 -4.218 8.166 161 H GLU 20 H GLU 20 104.980 -0.614 11.061 162 HA GLU 20 HA GLU 20 103.613 1.964 10.340 163 HB2 GLU 20 HB3 GLU 20 102.643 0.894 12.501 164 HB3 GLU 20 HB2 GLU 20 104.217 1.282 13.236 165 HG2 GLU 20 HG2 GLU 20 102.975 3.213 13.717 166 HG3 GLU 20 HG3 GLU 20 103.794 3.674 12.205 167 H LYS 21 H LYS 21 105.492 2.656 9.274 168 HA LYS 21 HA LYS 21 107.590 3.757 9.226 169 HB2 LYS 21 HB3 LYS 21 106.720 4.398 11.680 170 HB3 LYS 21 HB2 LYS 21 108.039 3.307 12.167 171 HG2 LYS 21 HG2 LYS 21 109.182 5.339 12.023 172 HG3 LYS 21 HG3 LYS 21 109.425 4.703 10.379 173 HD2 LYS 21 HD2 LYS 21 107.301 5.965 9.712 174 HD3 LYS 21 HD3 LYS 21 107.384 6.766 11.300 175 HE2 LYS 21 HE2 LYS 21 108.574 8.273 9.960 176 HE3 LYS 21 HE3 LYS 21 109.888 7.253 10.594 177 HZ1 LYS 21 HZ1 LYS 21 110.046 7.528 8.210 178 HZ2 LYS 21 HZ2 LYS 21 108.540 6.893 7.992 179 HZ3 LYS 21 HZ3 LYS 21 109.757 5.947 8.579 180 H PHE 22 H PHE 22 107.333 0.954 8.747 181 HA PHE 22 HA PHE 22 108.849 -0.827 8.359 182 HB2 PHE 22 HB3 PHE 22 111.005 0.516 9.981 183 HB3 PHE 22 HB2 PHE 22 111.141 -0.430 8.479 184 HD1 PHE 22 HD1 PHE 22 111.386 2.797 9.766 185 HD2 PHE 22 HD2 PHE 22 109.640 0.665 6.471 186 HE1 PHE 22 HE1 PHE 22 111.325 4.893 8.439 187 HE2 PHE 22 HE2 PHE 22 109.581 2.759 5.145 188 HZ PHE 22 HZ PHE 22 110.422 4.874 6.130 189 H ASP 23 H ASP 23 107.228 -0.285 10.929 190 HA ASP 23 HA ASP 23 108.668 -2.379 12.578 191 HB2 ASP 23 HB3 ASP 23 106.866 -0.274 13.803 192 HB3 ASP 23 HB2 ASP 23 108.120 -1.266 14.585 193 H LEU 24 H LEU 24 107.481 -4.214 12.348 194 HA LEU 24 HA LEU 24 104.681 -4.220 11.587 195 HB2 LEU 24 HB2 LEU 24 106.237 -6.426 13.009 196 HB3 LEU 24 HB3 LEU 24 104.766 -6.619 12.025 197 HG LEU 24 HG LEU 24 107.208 -5.312 10.816 198 HD11 LEU 24 HD11 LEU 24 108.020 -7.417 11.849 199 HD12 LEU 24 HD12 LEU 24 106.709 -8.315 11.047 200 HD13 LEU 24 HD13 LEU 24 107.986 -7.547 10.074 201 HD21 LEU 24 HD21 LEU 24 105.044 -5.316 9.599 202 HD22 LEU 24 HD22 LEU 24 104.973 -7.090 9.734 203 HD23 LEU 24 HD23 LEU 24 106.250 -6.322 8.761 204 H VAL 25 H VAL 25 102.827 -4.262 12.821 205 HA VAL 25 HA VAL 25 103.115 -4.587 15.795 206 HB VAL 25 HB VAL 25 101.735 -2.213 14.456 207 HG11 VAL 25 HG11 VAL 25 100.594 -3.013 16.509 208 HG12 VAL 25 HG12 VAL 25 102.137 -2.943 17.394 209 HG13 VAL 25 HG13 VAL 25 101.388 -1.446 16.790 210 HG21 VAL 25 HG21 VAL 25 104.211 -2.042 14.439 211 HG22 VAL 25 HG22 VAL 25 104.245 -2.377 16.186 212 HG23 VAL 25 HG23 VAL 25 103.497 -0.879 15.582 213 HA PRO 26 HA PRO 26 99.671 -7.314 14.832 214 HB2 PRO 26 HB3 PRO 26 99.028 -6.631 17.701 215 HB3 PRO 26 HB2 PRO 26 99.080 -8.229 16.903 216 HG2 PRO 26 HG2 PRO 26 101.059 -7.348 18.506 217 HG3 PRO 26 HG3 PRO 26 101.366 -8.387 17.089 218 HD2 PRO 26 HD3 PRO 26 101.973 -5.494 17.482 219 HD3 PRO 26 HD2 PRO 26 102.731 -6.671 16.368 220 H VAL 27 H VAL 27 97.449 -7.074 14.395 221 HA VAL 27 HA VAL 27 96.480 -4.241 14.525 222 HB VAL 27 HB VAL 27 96.336 -5.598 12.400 223 HG11 VAL 27 HG11 VAL 27 94.985 -7.511 12.239 224 HG12 VAL 27 HG12 VAL 27 94.049 -7.093 13.694 225 HG13 VAL 27 HG13 VAL 27 95.711 -7.709 13.852 226 HG21 VAL 27 HG21 VAL 27 94.014 -4.950 11.886 227 HG22 VAL 27 HG22 VAL 27 94.801 -3.685 12.859 228 HG23 VAL 27 HG23 VAL 27 93.653 -4.810 13.623 229 HA PRO 28 HA PRO 28 94.123 -4.740 18.264 230 HB2 PRO 28 HB2 PRO 28 91.992 -3.414 16.576 231 HB3 PRO 28 HB3 PRO 28 92.527 -3.032 18.238 232 HG2 PRO 28 HG2 PRO 28 93.313 -1.597 16.084 233 HG3 PRO 28 HG3 PRO 28 94.338 -1.829 17.525 234 HD2 PRO 28 HD3 PRO 28 94.658 -2.944 14.795 235 HD3 PRO 28 HD2 PRO 28 95.865 -2.809 16.109 236 H THR 29 H THR 29 93.521 -6.858 18.595 237 HA THR 29 HA THR 29 92.017 -8.448 16.718 238 HB THR 29 HB THR 29 91.929 -8.835 19.730 239 HG1 THR 29 HG1 THR 29 93.972 -9.893 19.439 240 HG21 THR 29 HG21 THR 29 91.987 -11.221 19.062 241 HG22 THR 29 HG22 THR 29 90.621 -10.375 18.296 242 HG23 THR 29 HG23 THR 29 92.085 -10.740 17.352 243 H ASN 30 H ASN 30 91.031 -6.153 19.212 244 HA ASN 30 HA ASN 30 88.356 -6.884 19.681 245 HB2 ASN 30 HB3 ASN 30 88.980 -4.012 18.981 246 HB3 ASN 30 HB2 ASN 30 87.976 -4.657 20.302 247 HD21 ASN 30 HD21 ASN 30 90.654 -2.909 20.047 248 HD22 ASN 30 HD22 ASN 30 91.657 -3.626 21.288 249 H LEU 31 H LEU 31 89.691 -5.204 16.813 250 HA LEU 31 HA LEU 31 86.981 -5.260 15.548 251 HB2 LEU 31 HB2 LEU 31 89.675 -4.086 14.787 252 HB3 LEU 31 HB3 LEU 31 88.351 -4.204 13.603 253 HG LEU 31 HG LEU 31 87.783 -3.023 16.321 254 HD11 LEU 31 HD11 LEU 31 89.837 -1.874 15.541 255 HD12 LEU 31 HD12 LEU 31 89.055 -1.538 13.978 256 HD13 LEU 31 HD13 LEU 31 88.429 -0.788 15.466 257 HD21 LEU 31 HD21 LEU 31 85.952 -3.459 14.705 258 HD22 LEU 31 HD22 LEU 31 86.161 -1.713 14.978 259 HD23 LEU 31 HD23 LEU 31 86.787 -2.463 13.490 260 H TYR 32 H TYR 32 90.299 -6.438 14.797 261 HA TYR 32 HA TYR 32 90.957 -8.219 13.384 262 HB2 TYR 32 HB3 TYR 32 89.654 -9.330 15.363 263 HB3 TYR 32 HB2 TYR 32 88.365 -9.584 14.162 264 HD1 TYR 32 HD1 TYR 32 88.419 -11.556 12.924 265 HD2 TYR 32 HD2 TYR 32 92.100 -9.967 14.466 266 HE1 TYR 32 HE1 TYR 32 89.643 -13.517 12.025 267 HE2 TYR 32 HE2 TYR 32 93.323 -11.927 13.568 268 HH TYR 32 HH TYR 32 92.129 -13.980 11.287 269 H GLY 33 H GLY 33 90.718 -7.161 11.365 270 HA2 GLY 33 HA2 GLY 33 89.703 -7.977 9.155 271 HA3 GLY 33 HA3 GLY 33 88.117 -7.795 9.943 272 H ASP 34 H ASP 34 90.471 -5.446 10.849 273 HA ASP 34 HA ASP 34 89.310 -3.506 8.837 274 HB2 ASP 34 HB2 ASP 34 89.826 -3.031 11.808 275 HB3 ASP 34 HB3 ASP 34 89.322 -1.784 10.644 276 H PHE 35 H PHE 35 90.834 -2.193 7.860 277 HA PHE 35 HA PHE 35 93.527 -1.977 9.164 278 HB2 PHE 35 HB2 PHE 35 93.468 -2.676 6.235 279 HB3 PHE 35 HB3 PHE 35 94.732 -2.988 7.450 280 HD1 PHE 35 HD1 PHE 35 92.041 -4.415 5.609 281 HD2 PHE 35 HD2 PHE 35 94.051 -4.625 9.399 282 HE1 PHE 35 HE1 PHE 35 91.138 -6.699 5.962 283 HE2 PHE 35 HE2 PHE 35 93.148 -6.905 9.753 284 HZ PHE 35 HZ PHE 35 91.693 -7.943 8.035 285 H PHE 36 H PHE 36 94.883 -0.311 8.102 286 HA PHE 36 HA PHE 36 93.161 1.938 7.189 287 HB2 PHE 36 HB2 PHE 36 96.131 1.673 7.812 288 HB3 PHE 36 HB3 PHE 36 95.398 3.176 7.202 289 HD1 PHE 36 HD1 PHE 36 94.991 0.598 9.903 290 HD2 PHE 36 HD2 PHE 36 94.438 4.687 8.713 291 HE1 PHE 36 HE1 PHE 36 94.246 1.166 12.200 292 HE2 PHE 36 HE2 PHE 36 93.696 5.256 11.010 293 HZ PHE 36 HZ PHE 36 93.597 3.494 12.752 294 H THR 37 H THR 37 93.299 2.921 5.138 295 HA THR 37 HA THR 37 94.356 1.093 3.022 296 HB THR 37 HB THR 37 93.259 2.884 1.511 297 HG1 THR 37 HG1 THR 37 93.101 4.581 2.951 298 HG21 THR 37 HG21 THR 37 90.992 2.003 1.997 299 HG22 THR 37 HG22 THR 37 92.209 0.707 2.068 300 HG23 THR 37 HG23 THR 37 91.563 1.404 3.573 301 H GLY 38 H GLY 38 95.189 4.071 4.642 302 HA2 GLY 38 HA3 GLY 38 97.017 4.939 2.464 303 HA3 GLY 38 HA2 GLY 38 96.826 5.719 4.052 304 H ASP 39 H ASP 39 97.107 2.781 5.148 305 HA ASP 39 HA ASP 39 100.123 2.915 5.209 306 HB2 ASP 39 HB2 ASP 39 98.673 2.978 7.357 307 HB3 ASP 39 HB3 ASP 39 98.353 1.257 7.038 308 H ALA 40 H ALA 40 100.547 0.245 6.093 309 HA ALA 40 HA ALA 40 99.488 -1.381 3.777 310 HB1 ALA 40 HB1 ALA 40 101.752 -2.339 3.451 311 HB2 ALA 40 HB2 ALA 40 102.391 -1.256 4.711 312 HB3 ALA 40 HB3 ALA 40 101.759 -0.578 3.191 313 H TYR 41 H TYR 41 99.058 -3.523 4.291 314 HA TYR 41 HA TYR 41 99.673 -4.304 7.153 315 HB2 TYR 41 HB3 TYR 41 97.175 -4.530 5.489 316 HB3 TYR 41 HB2 TYR 41 97.522 -5.818 6.668 317 HD1 TYR 41 HD1 TYR 41 97.533 -2.062 6.423 318 HD2 TYR 41 HD2 TYR 41 96.805 -5.521 8.863 319 HE1 TYR 41 HE1 TYR 41 96.731 -0.597 8.259 320 HE2 TYR 41 HE2 TYR 41 96.004 -4.057 10.699 321 HH TYR 41 HH TYR 41 94.925 -1.275 10.522 322 H VAL 42 H VAL 42 100.256 -6.485 7.518 323 HA VAL 42 HA VAL 42 100.873 -8.043 4.994 324 HB VAL 42 HB VAL 42 102.484 -8.297 7.546 325 HG11 VAL 42 HG11 VAL 42 102.764 -9.969 5.735 326 HG12 VAL 42 HG12 VAL 42 103.111 -8.659 4.580 327 HG13 VAL 42 HG13 VAL 42 104.232 -8.980 5.925 328 HG21 VAL 42 HG21 VAL 42 104.089 -6.654 6.277 329 HG22 VAL 42 HG22 VAL 42 102.613 -6.127 5.435 330 HG23 VAL 42 HG23 VAL 42 102.730 -5.975 7.205 331 H ILE 43 H ILE 43 100.257 -10.190 5.006 332 HA ILE 43 HA ILE 43 99.291 -11.317 7.633 333 HB ILE 43 HB ILE 43 97.717 -11.966 5.164 334 HG12 ILE 43 HG12 ILE 43 97.347 -9.390 6.749 335 HG13 ILE 43 HG13 ILE 43 98.014 -9.479 5.102 336 HG21 ILE 43 HG21 ILE 43 95.901 -12.095 6.800 337 HG22 ILE 43 HG22 ILE 43 96.940 -11.376 8.054 338 HG23 ILE 43 HG23 ILE 43 97.306 -12.997 7.416 339 HD11 ILE 43 HD11 ILE 43 95.594 -8.943 5.054 340 HD12 ILE 43 HD12 ILE 43 95.912 -10.527 4.308 341 HD13 ILE 43 HD13 ILE 43 95.245 -10.438 5.955 342 H LEU 44 H LEU 44 99.523 -13.552 7.816 343 HA LEU 44 HA LEU 44 100.913 -14.891 5.483 344 HB2 LEU 44 HB2 LEU 44 101.801 -14.516 8.284 345 HB3 LEU 44 HB3 LEU 44 101.892 -16.201 7.720 346 HG LEU 44 HG LEU 44 103.083 -15.337 5.644 347 HD11 LEU 44 HD11 LEU 44 102.711 -12.788 7.197 348 HD12 LEU 44 HD12 LEU 44 104.228 -13.001 6.290 349 HD13 LEU 44 HD13 LEU 44 102.665 -13.064 5.439 350 HD21 LEU 44 HD21 LEU 44 105.253 -15.036 6.813 351 HD22 LEU 44 HD22 LEU 44 104.307 -16.352 7.548 352 HD23 LEU 44 HD23 LEU 44 104.389 -14.763 8.345 353 H LYS 45 H LYS 45 99.833 -16.678 4.820 354 HA LYS 45 HA LYS 45 97.867 -17.884 6.772 355 HB2 LYS 45 HB3 LYS 45 97.299 -17.004 4.315 356 HB3 LYS 45 HB2 LYS 45 97.913 -18.609 3.850 357 HG2 LYS 45 HG2 LYS 45 96.330 -19.666 5.452 358 HG3 LYS 45 HG3 LYS 45 95.701 -18.057 5.880 359 HD2 LYS 45 HD2 LYS 45 94.166 -18.701 4.244 360 HD3 LYS 45 HD3 LYS 45 95.367 -17.844 3.249 361 HE2 LYS 45 HE3 LYS 45 95.148 -19.838 2.054 362 HE3 LYS 45 HE2 LYS 45 96.508 -20.240 3.129 363 HZ1 LYS 45 HZ1 LYS 45 94.820 -21.953 3.151 364 HZ2 LYS 45 HZ2 LYS 45 94.931 -21.249 4.638 365 HZ3 LYS 45 HZ3 LYS 45 93.671 -20.877 3.642 366 H THR 46 H THR 46 99.242 -19.267 7.907 367 HA THR 46 HA THR 46 101.076 -21.096 6.484 368 HB THR 46 HB THR 46 100.128 -21.343 9.362 369 HG1 THR 46 HG1 THR 46 100.871 -19.354 9.515 370 HG21 THR 46 HG21 THR 46 101.532 -23.163 8.574 371 HG22 THR 46 HG22 THR 46 102.517 -22.122 9.630 372 HG23 THR 46 HG23 THR 46 102.694 -22.018 7.862 373 H VAL 47 H VAL 47 100.187 -22.714 5.286 374 HA VAL 47 HA VAL 47 97.740 -24.088 6.391 375 HB VAL 47 HB VAL 47 98.745 -24.820 3.692 376 HG11 VAL 47 HG11 VAL 47 96.586 -25.607 4.626 377 HG12 VAL 47 HG12 VAL 47 96.333 -24.610 3.174 378 HG13 VAL 47 HG13 VAL 47 96.043 -23.920 4.788 379 HG21 VAL 47 HG21 VAL 47 97.701 -22.682 2.743 380 HG22 VAL 47 HG22 VAL 47 99.286 -22.484 3.527 381 HG23 VAL 47 HG23 VAL 47 97.802 -22.011 4.388 382 H GLN 48 H GLN 48 97.700 -26.495 6.055 383 HA GLN 48 HA GLN 48 100.385 -27.600 6.836 384 HB2 GLN 48 HB2 GLN 48 98.423 -28.092 8.289 385 HB3 GLN 48 HB3 GLN 48 97.612 -28.875 6.911 386 HG2 GLN 48 HG2 GLN 48 99.098 -30.683 6.893 387 HG3 GLN 48 HG3 GLN 48 100.390 -29.761 7.698 388 HE21 GLN 48 HE21 GLN 48 97.319 -29.209 9.161 389 HE22 GLN 48 HE22 GLN 48 97.505 -30.319 10.500 390 H LEU 49 H LEU 49 101.562 -28.170 5.051 391 HA LEU 49 HA LEU 49 100.475 -28.869 2.497 392 HB2 LEU 49 HB2 LEU 49 103.101 -29.370 3.896 393 HB3 LEU 49 HB3 LEU 49 102.772 -30.198 2.355 394 HG LEU 49 HG LEU 49 102.238 -27.236 2.569 395 HD11 LEU 49 HD11 LEU 49 104.517 -27.544 3.496 396 HD12 LEU 49 HD12 LEU 49 104.965 -28.512 2.072 397 HD13 LEU 49 HD13 LEU 49 104.578 -26.785 1.887 398 HD21 LEU 49 HD21 LEU 49 101.570 -28.519 0.551 399 HD22 LEU 49 HD22 LEU 49 102.860 -27.353 0.170 400 HD23 LEU 49 HD23 LEU 49 103.247 -29.081 0.354 401 H ARG 50 H ARG 50 102.392 -31.409 4.006 402 HA ARG 50 HA ARG 50 100.093 -33.282 3.466 403 HB2 ARG 50 HB2 ARG 50 103.094 -33.708 3.754 404 HB3 ARG 50 HB3 ARG 50 101.927 -35.050 3.681 405 HG2 ARG 50 HG2 ARG 50 101.253 -34.494 1.472 406 HG3 ARG 50 HG3 ARG 50 101.963 -32.865 1.574 407 HD2 ARG 50 HD2 ARG 50 104.148 -33.652 1.288 408 HD3 ARG 50 HD3 ARG 50 103.749 -35.279 1.890 409 HE ARG 50 HE ARG 50 103.245 -35.888 -0.340 410 HH11 ARG 50 HH11 ARG 50 102.752 -35.431 -2.497 411 HH12 ARG 50 HH12 ARG 50 102.458 -33.780 -2.996 412 HH21 ARG 50 HH21 ARG 50 102.948 -32.460 0.187 413 HH22 ARG 50 HH22 ARG 50 102.568 -32.106 -1.483 414 H ASN 51 H ASN 51 102.806 -33.075 5.812 415 HA ASN 51 HA ASN 51 101.027 -33.057 8.117 416 HB2 ASN 51 HB2 ASN 51 100.819 -35.468 7.140 417 HB3 ASN 51 HB3 ASN 51 102.476 -35.698 7.748 418 HD21 ASN 51 HD21 ASN 51 99.112 -34.937 8.753 419 HD22 ASN 51 HD22 ASN 51 99.354 -35.359 10.433 420 H GLY 52 H GLY 52 103.587 -31.944 6.901 421 HA2 GLY 52 HA3 GLY 52 105.155 -32.122 9.445 422 HA3 GLY 52 HA2 GLY 52 105.993 -32.612 7.954 423 H ASN 53 H ASN 53 105.610 -30.893 6.080 424 HA ASN 53 HA ASN 53 106.572 -28.318 7.236 425 HB2 ASN 53 HB2 ASN 53 107.453 -29.615 5.101 426 HB3 ASN 53 HB3 ASN 53 106.111 -28.774 4.288 427 HD21 ASN 53 HD21 ASN 53 106.236 -26.453 4.050 428 HD22 ASN 53 HD22 ASN 53 107.695 -25.567 4.435 429 H LEU 54 H LEU 54 105.605 -26.260 6.669 430 HA LEU 54 HA LEU 54 102.660 -26.522 6.005 431 HB2 LEU 54 HB2 LEU 54 103.598 -24.112 7.492 432 HB3 LEU 54 HB3 LEU 54 102.126 -25.086 7.716 433 HG LEU 54 HG LEU 54 104.924 -25.983 8.537 434 HD11 LEU 54 HD11 LEU 54 104.154 -24.036 9.868 435 HD12 LEU 54 HD12 LEU 54 102.623 -24.875 10.209 436 HD13 LEU 54 HD13 LEU 54 104.153 -25.522 10.849 437 HD21 LEU 54 HD21 LEU 54 103.323 -27.816 8.038 438 HD22 LEU 54 HD22 LEU 54 102.138 -27.079 9.143 439 HD23 LEU 54 HD23 LEU 54 103.668 -27.725 9.782 440 H GLN 55 H GLN 55 101.830 -24.195 5.250 441 HA GLN 55 HA GLN 55 103.940 -23.003 3.444 442 HB2 GLN 55 HB2 GLN 55 102.535 -24.584 2.134 443 HB3 GLN 55 HB3 GLN 55 101.078 -23.699 2.646 444 HG2 GLN 55 HG3 GLN 55 101.606 -21.818 1.360 445 HG3 GLN 55 HG2 GLN 55 103.347 -22.187 1.348 446 HE21 GLN 55 HE21 GLN 55 104.012 -22.807 -0.705 447 HE22 GLN 55 HE22 GLN 55 103.063 -23.775 -1.810 448 H TYR 56 H TYR 56 104.136 -20.933 4.126 449 HA TYR 56 HA TYR 56 101.749 -19.530 5.268 450 HB2 TYR 56 HB2 TYR 56 104.596 -18.508 4.860 451 HB3 TYR 56 HB3 TYR 56 103.336 -17.782 5.886 452 HD1 TYR 56 HD1 TYR 56 105.293 -20.947 5.402 453 HD2 TYR 56 HD2 TYR 56 103.127 -18.436 8.132 454 HE1 TYR 56 HE1 TYR 56 106.002 -22.391 7.290 455 HE2 TYR 56 HE2 TYR 56 103.832 -19.883 10.021 456 HH TYR 56 HH TYR 56 106.045 -21.592 10.329 457 H ASP 57 H ASP 57 100.529 -18.124 4.073 458 HA ASP 57 HA ASP 57 101.469 -17.563 1.276 459 HB2 ASP 57 HB3 ASP 57 98.787 -16.955 2.599 460 HB3 ASP 57 HB2 ASP 57 99.163 -16.843 0.862 461 H LEU 58 H LEU 58 102.325 -15.609 0.755 462 HA LEU 58 HA LEU 58 102.367 -13.504 2.866 463 HB2 LEU 58 HB2 LEU 58 103.719 -13.891 0.180 464 HB3 LEU 58 HB3 LEU 58 103.755 -12.312 0.999 465 HG LEU 58 HG LEU 58 105.740 -13.784 1.527 466 HD11 LEU 58 HD11 LEU 58 104.994 -12.006 3.090 467 HD12 LEU 58 HD12 LEU 58 103.871 -13.153 3.859 468 HD13 LEU 58 HD13 LEU 58 105.628 -13.412 3.978 469 HD21 LEU 58 HD21 LEU 58 105.466 -15.792 2.787 470 HD22 LEU 58 HD22 LEU 58 103.760 -15.430 3.142 471 HD23 LEU 58 HD23 LEU 58 104.246 -15.895 1.494 472 H HIS 59 H HIS 59 100.412 -12.445 2.977 473 HA HIS 59 HA HIS 59 99.356 -11.333 0.362 474 HB2 HIS 59 HB3 HIS 59 97.938 -12.157 2.929 475 HB3 HIS 59 HB2 HIS 59 97.161 -11.154 1.682 476 HD2 HIS 59 HD2 HIS 59 99.064 -14.682 1.579 477 HE1 HIS 59 HE1 HIS 59 95.761 -14.774 -1.052 478 H TYR 60 H TYR 60 100.085 -9.239 0.249 479 HA TYR 60 HA TYR 60 100.006 -7.641 2.810 480 HB2 TYR 60 HB3 TYR 60 101.257 -5.991 1.029 481 HB3 TYR 60 HB2 TYR 60 102.114 -7.154 2.066 482 HD1 TYR 60 HD1 TYR 60 102.076 -9.676 1.034 483 HD2 TYR 60 HD2 TYR 60 101.799 -6.027 -1.219 484 HE1 TYR 60 HE1 TYR 60 102.909 -10.855 -0.981 485 HE2 TYR 60 HE2 TYR 60 102.633 -7.209 -3.232 486 HH TYR 60 HH TYR 60 102.690 -10.481 -3.580 487 H TRP 61 H TRP 61 98.369 -6.221 3.050 488 HA TRP 61 HA TRP 61 96.664 -5.669 0.644 489 HB2 TRP 61 HB2 TRP 61 95.772 -6.469 2.948 490 HB3 TRP 61 HB3 TRP 61 96.078 -4.801 3.490 491 HD1 TRP 61 HD1 TRP 61 94.362 -6.480 0.430 492 HE1 TRP 61 HE1 TRP 61 92.210 -5.176 -0.132 493 HE3 TRP 61 HE3 TRP 61 94.650 -2.853 4.013 494 HZ2 TRP 61 HZ2 TRP 61 90.811 -2.858 0.857 495 HZ3 TRP 61 HZ3 TRP 61 92.894 -1.112 4.184 496 HH2 TRP 61 HH2 TRP 61 90.978 -1.109 2.608 497 H LEU 62 H LEU 62 96.696 -3.753 -0.370 498 HA LEU 62 HA LEU 62 97.843 -1.386 1.123 499 HB2 LEU 62 HB2 LEU 62 98.237 -1.530 -1.839 500 HB3 LEU 62 HB3 LEU 62 99.311 -0.879 -0.578 501 HG LEU 62 HG LEU 62 98.799 -3.846 -1.077 502 HD11 LEU 62 HD11 LEU 62 100.261 -3.580 -2.787 503 HD12 LEU 62 HD12 LEU 62 101.496 -3.251 -1.547 504 HD13 LEU 62 HD13 LEU 62 100.620 -1.903 -2.311 505 HD21 LEU 62 HD21 LEU 62 101.213 -3.295 0.370 506 HD22 LEU 62 HD22 LEU 62 99.901 -2.381 1.152 507 HD23 LEU 62 HD23 LEU 62 99.759 -4.144 0.947 508 H GLY 63 H GLY 63 96.027 -0.167 1.438 509 HA2 GLY 63 HA3 GLY 63 93.699 -0.227 -0.257 510 HA3 GLY 63 HA2 GLY 63 94.094 1.075 0.889 511 H ASN 64 H ASN 64 96.523 0.394 -1.455 512 HA ASN 64 HA ASN 64 97.280 1.651 -3.303 513 HB2 ASN 64 HB2 ASN 64 94.851 0.954 -4.030 514 HB3 ASN 64 HB3 ASN 64 94.462 2.665 -3.730 515 HD21 ASN 64 HD21 ASN 64 94.440 3.693 -5.738 516 HD22 ASN 64 HD22 ASN 64 95.680 3.500 -6.957 517 H GLU 65 H GLU 65 96.084 2.972 -0.522 518 HA GLU 65 HA GLU 65 96.515 5.804 -1.480 519 HB2 GLU 65 HB2 GLU 65 95.168 4.607 0.968 520 HB3 GLU 65 HB3 GLU 65 95.612 6.328 0.886 521 HG2 GLU 65 HG3 GLU 65 94.278 6.574 -1.190 522 HG3 GLU 65 HG2 GLU 65 93.834 4.852 -1.108 523 H CYS 66 H CYS 66 98.332 3.327 -0.417 524 HA CYS 66 HA CYS 66 99.912 4.983 1.545 525 HB2 CYS 66 HB2 CYS 66 99.284 2.635 2.172 526 HB3 CYS 66 HB3 CYS 66 100.220 2.046 0.777 527 HG CYS 66 HG CYS 66 101.815 1.763 3.156 528 H SER 67 H SER 67 101.797 5.914 0.915 529 HA SER 67 HA SER 67 102.634 6.058 -1.789 530 HB2 SER 67 HB2 SER 67 103.427 7.349 0.386 531 HB3 SER 67 HB3 SER 67 104.703 6.106 0.408 532 HG SER 67 HG SER 67 105.544 7.623 -0.908 533 H GLN 68 H GLN 68 104.117 4.908 -3.061 534 HA GLN 68 HA GLN 68 104.349 2.070 -2.513 535 HB2 GLN 68 HB2 GLN 68 106.252 3.517 -4.363 536 HB3 GLN 68 HB3 GLN 68 105.465 1.934 -4.572 537 HG2 GLN 68 HG2 GLN 68 103.238 3.332 -4.568 538 HG3 GLN 68 HG3 GLN 68 104.305 4.706 -4.943 539 HE21 GLN 68 HE21 GLN 68 106.105 2.414 -6.286 540 HE22 GLN 68 HE22 GLN 68 105.372 2.281 -7.869 541 H ASP 69 H ASP 69 106.016 4.716 -1.205 542 HA ASP 69 HA ASP 69 108.663 3.468 -0.969 543 HB2 ASP 69 HB2 ASP 69 107.496 5.599 0.861 544 HB3 ASP 69 HB3 ASP 69 109.205 5.317 0.454 545 H GLU 70 H GLU 70 105.826 3.800 1.213 546 HA GLU 70 HA GLU 70 107.192 2.091 3.239 547 HB2 GLU 70 HB2 GLU 70 104.273 2.860 3.357 548 HB3 GLU 70 HB3 GLU 70 105.443 2.669 4.685 549 HG2 GLU 70 HG3 GLU 70 106.680 4.690 3.669 550 HG3 GLU 70 HG2 GLU 70 105.220 4.950 2.686 551 H SER 71 H SER 71 104.538 1.900 0.880 552 HA SER 71 HA SER 71 103.530 -0.677 1.663 553 HB2 SER 71 HB3 SER 71 102.550 0.984 -0.038 554 HB3 SER 71 HB2 SER 71 103.722 0.322 -1.203 555 HG SER 71 HG SER 71 102.808 -1.764 -0.775 556 H GLY 72 H GLY 72 105.979 0.179 -0.838 557 HA2 GLY 72 HA3 GLY 72 106.628 -2.488 -1.610 558 HA3 GLY 72 HA2 GLY 72 107.771 -1.125 -1.664 559 H ALA 73 H ALA 73 107.846 -0.533 1.130 560 HA ALA 73 HA ALA 73 109.882 -2.345 2.005 561 HB1 ALA 73 HB1 ALA 73 109.569 -1.319 4.240 562 HB2 ALA 73 HB2 ALA 73 109.556 -0.081 2.960 563 HB3 ALA 73 HB3 ALA 73 108.026 -0.613 3.700 564 H ALA 74 H ALA 74 106.457 -2.134 3.131 565 HA ALA 74 HA ALA 74 106.481 -4.390 4.836 566 HB1 ALA 74 HB1 ALA 74 104.223 -3.694 2.908 567 HB2 ALA 74 HB2 ALA 74 104.531 -2.824 4.430 568 HB3 ALA 74 HB3 ALA 74 104.084 -4.547 4.464 569 H ALA 75 H ALA 75 106.091 -4.278 1.287 570 HA ALA 75 HA ALA 75 105.714 -7.165 1.032 571 HB1 ALA 75 HB1 ALA 75 106.173 -6.767 -1.373 572 HB2 ALA 75 HB2 ALA 75 106.734 -5.121 -0.994 573 HB3 ALA 75 HB3 ALA 75 105.029 -5.562 -0.735 574 H ILE 76 H ILE 76 108.465 -5.108 1.545 575 HA ILE 76 HA ILE 76 110.399 -7.096 0.480 576 HB ILE 76 HB ILE 76 110.723 -4.504 2.050 577 HG12 ILE 76 HG12 ILE 76 109.970 -4.702 -0.497 578 HG13 ILE 76 HG13 ILE 76 111.171 -3.488 0.003 579 HG21 ILE 76 HG21 ILE 76 112.628 -5.775 2.657 580 HG22 ILE 76 HG22 ILE 76 112.736 -6.542 1.054 581 HG23 ILE 76 HG23 ILE 76 113.177 -4.829 1.252 582 HD11 ILE 76 HD11 ILE 76 111.726 -4.966 -2.066 583 HD12 ILE 76 HD12 ILE 76 112.016 -6.264 -0.883 584 HD13 ILE 76 HD13 ILE 76 112.985 -4.772 -0.823 585 H PHE 77 H PHE 77 109.496 -5.790 3.718 586 HA PHE 77 HA PHE 77 111.258 -7.597 5.155 587 HB2 PHE 77 HB2 PHE 77 108.912 -5.848 5.839 588 HB3 PHE 77 HB3 PHE 77 109.374 -7.108 7.009 589 HD1 PHE 77 HD1 PHE 77 110.390 -5.840 8.744 590 HD2 PHE 77 HD2 PHE 77 111.600 -5.229 4.669 591 HE1 PHE 77 HE1 PHE 77 112.279 -4.430 9.516 592 HE2 PHE 77 HE2 PHE 77 113.488 -3.820 5.440 593 HZ PHE 77 HZ PHE 77 113.827 -3.418 7.864 594 H THR 78 H THR 78 107.937 -7.876 3.939 595 HA THR 78 HA THR 78 107.456 -10.413 5.366 596 HB THR 78 HB THR 78 105.757 -8.617 4.391 597 HG1 THR 78 HG1 THR 78 105.049 -10.433 5.485 598 HG21 THR 78 HG21 THR 78 104.856 -9.244 2.203 599 HG22 THR 78 HG22 THR 78 106.592 -8.889 2.041 600 HG23 THR 78 HG23 THR 78 106.027 -10.577 2.070 601 H VAL 79 H VAL 79 108.305 -9.448 2.022 602 HA VAL 79 HA VAL 79 108.326 -12.178 1.008 603 HB VAL 79 HB VAL 79 109.669 -9.615 0.052 604 HG11 VAL 79 HG11 VAL 79 110.943 -11.598 -0.716 605 HG12 VAL 79 HG12 VAL 79 110.069 -10.838 -2.067 606 HG13 VAL 79 HG13 VAL 79 109.439 -12.328 -1.326 607 HG21 VAL 79 HG21 VAL 79 107.414 -11.134 -1.280 608 HG22 VAL 79 HG22 VAL 79 107.070 -10.036 0.078 609 HG23 VAL 79 HG23 VAL 79 107.832 -9.408 -1.403 610 H GLN 80 H GLN 80 110.898 -10.005 2.261 611 HA GLN 80 HA GLN 80 113.038 -11.914 1.798 612 HB2 GLN 80 HB2 GLN 80 112.697 -9.487 3.576 613 HB3 GLN 80 HB3 GLN 80 114.149 -10.507 3.711 614 HG2 GLN 80 HG2 GLN 80 114.671 -10.167 1.354 615 HG3 GLN 80 HG3 GLN 80 113.142 -9.291 1.102 616 HE21 GLN 80 HE21 GLN 80 115.222 -7.774 0.361 617 HE22 GLN 80 HE22 GLN 80 115.666 -6.609 1.588 618 H LEU 81 H LEU 81 111.424 -10.992 4.907 619 HA LEU 81 HA LEU 81 112.594 -13.099 6.439 620 HB2 LEU 81 HB2 LEU 81 111.043 -11.125 7.184 621 HB3 LEU 81 HB3 LEU 81 109.710 -12.252 6.842 622 HG LEU 81 HG LEU 81 110.398 -12.350 9.229 623 HD11 LEU 81 HD11 LEU 81 110.087 -14.616 9.330 624 HD12 LEU 81 HD12 LEU 81 111.443 -14.952 8.227 625 HD13 LEU 81 HD13 LEU 81 109.863 -14.460 7.571 626 HD21 LEU 81 HD21 LEU 81 112.573 -12.756 9.938 627 HD22 LEU 81 HD22 LEU 81 112.910 -11.864 8.435 628 HD23 LEU 81 HD23 LEU 81 113.004 -13.642 8.455 629 H ASP 82 H ASP 82 109.567 -13.077 4.507 630 HA ASP 82 HA ASP 82 108.633 -15.668 5.087 631 HB2 ASP 82 HB3 ASP 82 107.297 -14.455 3.575 632 HB3 ASP 82 HB2 ASP 82 108.681 -14.039 2.536 633 H ASP 83 H ASP 83 111.156 -14.760 2.678 634 HA ASP 83 HA ASP 83 111.724 -17.484 1.912 635 HB2 ASP 83 HB2 ASP 83 113.233 -14.877 1.823 636 HB3 ASP 83 HB3 ASP 83 114.134 -16.387 1.546 637 H TYR 84 H TYR 84 112.658 -15.492 4.660 638 HA TYR 84 HA TYR 84 114.671 -17.426 5.619 639 HB2 TYR 84 HB2 TYR 84 114.915 -15.092 6.257 640 HB3 TYR 84 HB3 TYR 84 113.276 -15.065 6.950 641 HD1 TYR 84 HD1 TYR 84 116.765 -15.885 7.518 642 HD2 TYR 84 HD2 TYR 84 112.768 -16.553 8.942 643 HE1 TYR 84 HE1 TYR 84 117.671 -16.675 9.687 644 HE2 TYR 84 HE2 TYR 84 113.674 -17.348 11.111 645 HH TYR 84 HH TYR 84 115.906 -16.946 12.452 646 H LEU 85 H LEU 85 111.210 -16.992 5.834 647 HA LEU 85 HA LEU 85 110.976 -18.732 8.229 648 HB2 LEU 85 HB2 LEU 85 109.380 -16.779 7.291 649 HB3 LEU 85 HB3 LEU 85 108.627 -18.157 6.452 650 HG LEU 85 HG LEU 85 108.708 -19.323 8.796 651 HD11 LEU 85 HD11 LEU 85 110.105 -17.129 9.543 652 HD12 LEU 85 HD12 LEU 85 108.461 -16.554 9.911 653 HD13 LEU 85 HD13 LEU 85 109.077 -18.039 10.676 654 HD21 LEU 85 HD21 LEU 85 106.527 -18.301 9.388 655 HD22 LEU 85 HD22 LEU 85 106.639 -18.607 7.638 656 HD23 LEU 85 HD23 LEU 85 106.855 -16.956 8.269 657 H ASN 86 H ASN 86 110.129 -18.975 4.732 658 HA ASN 86 HA ASN 86 110.203 -21.981 5.125 659 HB2 ASN 86 HB3 ASN 86 107.905 -21.001 4.661 660 HB3 ASN 86 HB2 ASN 86 108.525 -20.471 3.079 661 HD21 ASN 86 HD21 ASN 86 108.640 -23.512 5.084 662 HD22 ASN 86 HD22 ASN 86 108.269 -24.568 3.739 663 H GLY 87 H GLY 87 110.757 -19.278 2.847 664 HA2 GLY 87 HA2 GLY 87 112.937 -19.308 1.606 665 HA3 GLY 87 HA3 GLY 87 112.763 -21.074 1.461 666 H ARG 88 H ARG 88 109.745 -20.533 1.028 667 HA ARG 88 HA ARG 88 109.885 -19.380 -1.746 668 HB2 ARG 88 HB2 ARG 88 108.755 -22.121 -1.028 669 HB3 ARG 88 HB3 ARG 88 108.551 -21.319 -2.603 670 HG2 ARG 88 HG2 ARG 88 110.977 -21.293 -2.946 671 HG3 ARG 88 HG3 ARG 88 111.241 -21.979 -1.325 672 HD2 ARG 88 HD2 ARG 88 111.392 -23.784 -2.953 673 HD3 ARG 88 HD3 ARG 88 109.883 -23.988 -2.031 674 HE ARG 88 HE ARG 88 109.145 -22.448 -4.274 675 HH11 ARG 88 HH11 ARG 88 108.395 -23.436 -6.161 676 HH12 ARG 88 HH12 ARG 88 108.822 -25.096 -6.509 677 HH21 ARG 88 HH21 ARG 88 110.709 -25.489 -3.609 678 HH22 ARG 88 HH22 ARG 88 110.126 -26.253 -5.071 679 H ALA 89 H ALA 89 107.482 -21.188 0.223 680 HA ALA 89 HA ALA 89 105.283 -20.569 0.828 681 HB1 ALA 89 HB1 ALA 89 107.011 -18.218 1.308 682 HB2 ALA 89 HB2 ALA 89 105.783 -18.963 2.359 683 HB3 ALA 89 HB3 ALA 89 105.291 -17.812 1.093 684 H VAL 90 H VAL 90 103.657 -18.435 0.258 685 HA VAL 90 HA VAL 90 103.643 -18.444 -2.770 686 HB VAL 90 HB VAL 90 101.203 -18.011 -1.019 687 HG11 VAL 90 HG11 VAL 90 101.072 -17.460 -3.432 688 HG12 VAL 90 HG12 VAL 90 100.058 -18.870 -3.043 689 HG13 VAL 90 HG13 VAL 90 101.634 -19.099 -3.837 690 HG21 VAL 90 HG21 VAL 90 100.837 -20.553 -1.594 691 HG22 VAL 90 HG22 VAL 90 102.609 -20.587 -1.761 692 HG23 VAL 90 HG23 VAL 90 101.870 -20.119 -0.211 693 H GLN 91 H GLN 91 103.036 -16.469 -3.820 694 HA GLN 91 HA GLN 91 103.396 -14.060 -2.029 695 HB2 GLN 91 HB2 GLN 91 104.924 -14.672 -4.128 696 HB3 GLN 91 HB3 GLN 91 103.591 -13.915 -5.032 697 HG2 GLN 91 HG2 GLN 91 103.811 -11.990 -3.267 698 HG3 GLN 91 HG3 GLN 91 105.415 -12.691 -2.946 699 HE21 GLN 91 HE21 GLN 91 103.383 -11.812 -5.837 700 HE22 GLN 91 HE22 GLN 91 104.720 -11.128 -6.734 701 H HIS 92 H HIS 92 101.706 -12.684 -1.781 702 HA HIS 92 HA HIS 92 99.537 -12.735 -3.880 703 HB2 HIS 92 HB3 HIS 92 99.263 -13.141 -0.890 704 HB3 HIS 92 HB2 HIS 92 97.930 -12.440 -1.838 705 HD2 HIS 92 HD2 HIS 92 100.085 -15.803 -1.947 706 HE1 HIS 92 HE1 HIS 92 96.286 -16.518 -3.649 707 H ARG 93 H ARG 93 99.512 -10.703 -4.670 708 HA ARG 93 HA ARG 93 100.089 -8.438 -2.752 709 HB2 ARG 93 HB2 ARG 93 101.604 -8.551 -4.680 710 HB3 ARG 93 HB3 ARG 93 100.219 -8.595 -5.797 711 HG2 ARG 93 HG2 ARG 93 99.574 -6.352 -5.231 712 HG3 ARG 93 HG3 ARG 93 100.676 -6.315 -3.833 713 HD2 ARG 93 HD2 ARG 93 101.723 -5.075 -5.642 714 HD3 ARG 93 HD3 ARG 93 102.605 -6.609 -5.448 715 HE ARG 93 HE ARG 93 100.853 -5.858 -7.745 716 HH11 ARG 93 HH11 ARG 93 100.958 -7.319 -9.464 717 HH12 ARG 93 HH12 ARG 93 101.795 -8.842 -9.270 718 HH21 ARG 93 HH21 ARG 93 102.664 -8.237 -5.955 719 HH22 ARG 93 HH22 ARG 93 102.757 -9.360 -7.293 720 H GLU 94 H GLU 94 98.393 -7.166 -2.169 721 HA GLU 94 HA GLU 94 95.987 -7.174 -4.011 722 HB2 GLU 94 HB2 GLU 94 96.051 -6.994 -0.965 723 HB3 GLU 94 HB3 GLU 94 94.589 -6.900 -1.977 724 HG2 GLU 94 HG3 GLU 94 94.675 -9.158 -2.551 725 HG3 GLU 94 HG2 GLU 94 96.436 -9.259 -2.311 726 H VAL 95 H VAL 95 96.723 -5.254 -5.067 727 HA VAL 95 HA VAL 95 97.257 -2.845 -3.399 728 HB VAL 95 HB VAL 95 96.854 -2.754 -6.387 729 HG11 VAL 95 HG11 VAL 95 97.402 -0.702 -5.108 730 HG12 VAL 95 HG12 VAL 95 98.855 -1.497 -4.457 731 HG13 VAL 95 HG13 VAL 95 98.735 -1.151 -6.199 732 HG21 VAL 95 HG21 VAL 95 99.375 -3.413 -6.473 733 HG22 VAL 95 HG22 VAL 95 99.086 -4.148 -4.878 734 HG23 VAL 95 HG23 VAL 95 98.178 -4.718 -6.299 735 H GLN 96 H GLN 96 94.635 -4.009 -3.072 736 HA GLN 96 HA GLN 96 92.365 -3.346 -3.097 737 HB2 GLN 96 HB2 GLN 96 93.746 -1.224 -2.251 738 HB3 GLN 96 HB3 GLN 96 93.191 -0.535 -3.795 739 HG2 GLN 96 HG2 GLN 96 90.836 -1.393 -3.096 740 HG3 GLN 96 HG3 GLN 96 91.531 -1.547 -1.464 741 HE21 GLN 96 HE21 GLN 96 92.006 0.394 -0.277 742 HE22 GLN 96 HE22 GLN 96 91.564 1.979 -0.871 743 H GLY 97 H GLY 97 91.655 -4.401 -4.987 744 HA2 GLY 97 HA2 GLY 97 90.407 -3.002 -7.017 745 HA3 GLY 97 HA3 GLY 97 92.078 -3.105 -7.623 746 H PHE 98 H PHE 98 93.027 -5.458 -7.339 747 HA PHE 98 HA PHE 98 90.858 -7.405 -8.171 748 HB2 PHE 98 HB2 PHE 98 93.722 -7.174 -9.203 749 HB3 PHE 98 HB3 PHE 98 92.567 -8.449 -9.659 750 HD1 PHE 98 HD1 PHE 98 91.178 -8.111 -11.509 751 HD2 PHE 98 HD2 PHE 98 92.866 -4.702 -9.514 752 HE1 PHE 98 HE1 PHE 98 90.219 -6.620 -13.244 753 HE2 PHE 98 HE2 PHE 98 91.906 -3.212 -11.248 754 HZ PHE 98 HZ PHE 98 90.584 -4.170 -13.113 755 H GLU 99 H GLU 99 91.474 -7.213 -5.505 756 HA GLU 99 HA GLU 99 93.684 -8.688 -4.515 757 HB2 GLU 99 HB2 GLU 99 90.861 -8.943 -3.407 758 HB3 GLU 99 HB3 GLU 99 92.400 -9.031 -2.517 759 HG2 GLU 99 HG2 GLU 99 91.747 -6.836 -2.057 760 HG3 GLU 99 HG3 GLU 99 92.752 -6.593 -3.505 761 H SER 100 H SER 100 93.489 -10.973 -3.497 762 HA SER 100 HA SER 100 92.664 -12.799 -5.703 763 HB2 SER 100 HB3 SER 100 94.856 -12.968 -4.353 764 HB3 SER 100 HB2 SER 100 93.853 -13.589 -3.020 765 HG SER 100 HG SER 100 94.672 -15.281 -4.379 766 H ALA 101 H ALA 101 91.447 -14.843 -5.096 767 HA ALA 101 HA ALA 101 88.992 -14.058 -3.672 768 HB1 ALA 101 HB1 ALA 101 88.239 -16.357 -4.221 769 HB2 ALA 101 HB2 ALA 101 89.885 -16.766 -4.760 770 HB3 ALA 101 HB3 ALA 101 88.933 -15.553 -5.649 771 H THR 102 H THR 102 91.905 -15.911 -2.921 772 HA THR 102 HA THR 102 90.841 -17.247 -0.571 773 HB THR 102 HB THR 102 93.699 -16.355 -1.171 774 HG1 THR 102 HG1 THR 102 93.852 -18.539 -1.932 775 HG21 THR 102 HG21 THR 102 94.312 -18.162 0.410 776 HG22 THR 102 HG22 THR 102 93.311 -16.926 1.209 777 HG23 THR 102 HG23 THR 102 92.587 -18.477 0.719 778 H PHE 103 H PHE 103 92.732 -14.221 -0.968 779 HA PHE 103 HA PHE 103 92.640 -13.504 1.833 780 HB2 PHE 103 HB2 PHE 103 94.226 -12.353 0.475 781 HB3 PHE 103 HB3 PHE 103 92.992 -11.903 -0.726 782 HD1 PHE 103 HD1 PHE 103 94.029 -11.376 2.833 783 HD2 PHE 103 HD2 PHE 103 91.772 -9.890 -0.506 784 HE1 PHE 103 HE1 PHE 103 93.599 -9.267 4.062 785 HE2 PHE 103 HE2 PHE 103 91.346 -7.777 0.722 786 HZ PHE 103 HZ PHE 103 92.260 -7.466 3.006 787 H LEU 104 H LEU 104 90.565 -12.504 -0.941 788 HA LEU 104 HA LEU 104 88.805 -10.871 0.678 789 HB2 LEU 104 HB2 LEU 104 88.529 -12.268 -1.997 790 HB3 LEU 104 HB3 LEU 104 87.145 -11.422 -1.264 791 HG LEU 104 HG LEU 104 89.881 -10.161 -1.748 792 HD11 LEU 104 HD11 LEU 104 88.749 -8.947 -3.591 793 HD12 LEU 104 HD12 LEU 104 87.263 -9.879 -3.291 794 HD13 LEU 104 HD13 LEU 104 88.728 -10.704 -3.874 795 HD21 LEU 104 HD21 LEU 104 88.580 -9.171 0.122 796 HD22 LEU 104 HD22 LEU 104 87.178 -8.978 -0.957 797 HD23 LEU 104 HD23 LEU 104 88.668 -8.052 -1.259 798 H GLY 105 H GLY 105 88.784 -14.332 -0.192 799 HA2 GLY 105 HA2 GLY 105 86.189 -14.962 0.862 800 HA3 GLY 105 HA3 GLY 105 87.551 -16.104 0.773 801 H TYR 106 H TYR 106 89.360 -14.613 2.454 802 HA TYR 106 HA TYR 106 88.416 -15.542 5.057 803 HB2 TYR 106 HB2 TYR 106 90.876 -15.032 4.015 804 HB3 TYR 106 HB3 TYR 106 90.621 -13.524 4.925 805 HD1 TYR 106 HD1 TYR 106 89.835 -13.751 7.384 806 HD2 TYR 106 HD2 TYR 106 91.545 -16.985 5.136 807 HE1 TYR 106 HE1 TYR 106 90.368 -14.936 9.496 808 HE2 TYR 106 HE2 TYR 106 92.079 -18.170 7.246 809 HH TYR 106 HH TYR 106 90.745 -17.455 10.170 810 H PHE 107 H PHE 107 88.625 -12.361 3.455 811 HA PHE 107 HA PHE 107 86.980 -11.266 5.754 812 HB2 PHE 107 HB2 PHE 107 88.973 -9.714 4.043 813 HB3 PHE 107 HB3 PHE 107 88.093 -9.119 5.471 814 HD1 PHE 107 HD1 PHE 107 91.080 -10.705 4.304 815 HD2 PHE 107 HD2 PHE 107 88.454 -10.435 7.691 816 HE1 PHE 107 HE1 PHE 107 92.887 -11.561 5.773 817 HE2 PHE 107 HE2 PHE 107 90.259 -11.289 9.161 818 HZ PHE 107 HZ PHE 107 92.476 -11.856 8.202 819 H LYS 108 H LYS 108 85.631 -12.442 3.696 820 HA LYS 108 HA LYS 108 85.078 -10.495 1.544 821 HB2 LYS 108 HB2 LYS 108 84.844 -13.013 1.319 822 HB3 LYS 108 HB3 LYS 108 83.422 -12.913 2.385 823 HG2 LYS 108 HG2 LYS 108 82.393 -12.742 0.305 824 HG3 LYS 108 HG3 LYS 108 82.683 -11.022 0.656 825 HD2 LYS 108 HD2 LYS 108 84.980 -11.405 -0.534 826 HD3 LYS 108 HD3 LYS 108 84.215 -12.870 -1.194 827 HE2 LYS 108 HE3 LYS 108 83.632 -9.988 -1.753 828 HE3 LYS 108 HE2 LYS 108 83.557 -11.397 -2.838 829 HZ1 LYS 108 HZ1 LYS 108 81.359 -10.772 -2.449 830 HZ2 LYS 108 HZ2 LYS 108 81.582 -10.551 -0.830 831 HZ3 LYS 108 HZ3 LYS 108 81.580 -12.075 -1.462 832 H SER 109 H SER 109 83.756 -11.284 4.718 833 HA SER 109 HA SER 109 81.180 -10.042 4.426 834 HB2 SER 109 HB3 SER 109 83.047 -10.489 6.770 835 HB3 SER 109 HB2 SER 109 81.525 -9.589 6.980 836 HG SER 109 HG SER 109 81.267 -11.867 7.328 837 H GLY 110 H GLY 110 84.123 -8.631 3.875 838 HA2 GLY 110 HA3 GLY 110 84.305 -6.271 3.296 839 HA3 GLY 110 HA2 GLY 110 82.940 -5.915 4.383 840 H LEU 111 H LEU 111 86.323 -5.871 4.072 841 HA LEU 111 HA LEU 111 86.979 -6.275 6.907 842 HB2 LEU 111 HB2 LEU 111 89.102 -4.879 5.993 843 HB3 LEU 111 HB3 LEU 111 88.876 -6.606 5.624 844 HG LEU 111 HG LEU 111 87.590 -4.561 3.822 845 HD11 LEU 111 HD11 LEU 111 89.922 -3.765 4.104 846 HD12 LEU 111 HD12 LEU 111 89.669 -4.443 2.478 847 HD13 LEU 111 HD13 LEU 111 90.524 -5.395 3.716 848 HD21 LEU 111 HD21 LEU 111 89.041 -6.915 2.755 849 HD22 LEU 111 HD22 LEU 111 87.387 -6.349 2.421 850 HD23 LEU 111 HD23 LEU 111 87.718 -7.321 3.875 851 H LYS 112 H LYS 112 88.330 -3.379 5.624 852 HA LYS 112 HA LYS 112 86.361 -1.446 6.422 853 HB2 LYS 112 HB2 LYS 112 87.190 -2.742 8.674 854 HB3 LYS 112 HB3 LYS 112 88.429 -1.467 8.580 855 HG2 LYS 112 HG2 LYS 112 86.732 -0.402 9.804 856 HG3 LYS 112 HG3 LYS 112 86.367 0.120 8.143 857 HD2 LYS 112 HD2 LYS 112 84.651 -1.582 7.913 858 HD3 LYS 112 HD3 LYS 112 85.110 -2.323 9.465 859 HE2 LYS 112 HE2 LYS 112 83.085 -0.892 9.690 860 HE3 LYS 112 HE3 LYS 112 84.441 -0.272 10.662 861 HZ1 LYS 112 HZ1 LYS 112 83.095 1.273 9.069 862 HZ2 LYS 112 HZ2 LYS 112 84.145 0.698 7.935 863 HZ3 LYS 112 HZ3 LYS 112 84.719 1.478 9.271 864 H TYR 113 H TYR 113 87.061 0.109 5.056 865 HA TYR 113 HA TYR 113 90.000 0.446 4.625 866 HB2 TYR 113 HB3 TYR 113 88.767 2.413 3.133 867 HB3 TYR 113 HB2 TYR 113 89.104 0.766 2.548 868 HD1 TYR 113 HD1 TYR 113 86.514 2.898 4.196 869 HD2 TYR 113 HD2 TYR 113 87.339 -0.760 2.100 870 HE1 TYR 113 HE1 TYR 113 84.081 2.472 3.981 871 HE2 TYR 113 HE2 TYR 113 84.906 -1.185 1.885 872 HH TYR 113 HH TYR 113 82.589 0.322 3.676 873 H LYS 114 H LYS 114 90.992 1.616 6.213 874 HA LYS 114 HA LYS 114 89.550 4.091 7.192 875 HB2 LYS 114 HB2 LYS 114 91.327 2.074 8.485 876 HB3 LYS 114 HB3 LYS 114 91.619 3.767 8.948 877 HG2 LYS 114 HG3 LYS 114 89.172 4.009 9.442 878 HG3 LYS 114 HG2 LYS 114 88.958 2.279 9.082 879 HD2 LYS 114 HD2 LYS 114 90.554 1.699 10.881 880 HD3 LYS 114 HD3 LYS 114 90.796 3.427 11.232 881 HE2 LYS 114 HE2 LYS 114 89.164 2.878 12.813 882 HE3 LYS 114 HE3 LYS 114 88.149 3.429 11.459 883 HZ1 LYS 114 HZ1 LYS 114 87.400 1.317 12.332 884 HZ2 LYS 114 HZ2 LYS 114 87.925 1.133 10.779 885 HZ3 LYS 114 HZ3 LYS 114 88.866 0.623 12.034 886 H LYS 115 H LYS 115 90.400 6.032 6.611 887 HA LYS 115 HA LYS 115 92.834 6.075 4.945 888 HB2 LYS 115 HB3 LYS 115 92.365 8.414 4.653 889 HB3 LYS 115 HB2 LYS 115 90.786 7.592 4.678 890 HG2 LYS 115 HG2 LYS 115 90.706 8.091 7.187 891 HG3 LYS 115 HG3 LYS 115 92.116 9.148 6.933 892 HD2 LYS 115 HD3 LYS 115 90.792 10.377 5.170 893 HD3 LYS 115 HD2 LYS 115 89.375 9.399 5.621 894 HE2 LYS 115 HE3 LYS 115 89.178 10.405 7.721 895 HE3 LYS 115 HE2 LYS 115 90.896 10.870 7.773 896 HZ1 LYS 115 HZ1 LYS 115 89.473 12.764 7.356 897 HZ2 LYS 115 HZ2 LYS 115 88.851 12.055 6.003 898 HZ3 LYS 115 HZ3 LYS 115 90.442 12.486 6.051 899 H GLY 116 H GLY 116 94.761 7.333 5.454 900 HA2 GLY 116 HA2 GLY 116 95.526 7.000 8.301 901 HA3 GLY 116 HA3 GLY 116 96.588 7.547 6.982 902 H GLY 117 H GLY 117 95.000 8.535 9.764 903 HA2 GLY 117 HA2 GLY 117 95.820 11.275 9.508 904 HA3 GLY 117 HA3 GLY 117 94.101 11.184 9.055 905 H VAL 118 H VAL 118 93.380 9.031 10.827 906 HA VAL 118 HA VAL 118 92.703 10.495 13.187 907 HB VAL 118 HB VAL 118 93.097 7.476 12.997 908 HG11 VAL 118 HG11 VAL 118 92.698 8.373 15.275 909 HG12 VAL 118 HG12 VAL 118 91.290 7.451 14.695 910 HG13 VAL 118 HG13 VAL 118 91.254 9.230 14.684 911 HG21 VAL 118 HG21 VAL 118 91.734 8.326 11.107 912 HG22 VAL 118 HG22 VAL 118 90.728 7.423 12.265 913 HG23 VAL 118 HG23 VAL 118 90.692 9.203 12.253 914 H ALA 119 H ALA 119 95.591 8.619 12.379 915 HA ALA 119 HA ALA 119 96.595 8.714 15.169 916 HB1 ALA 119 HB1 ALA 119 98.644 7.714 14.192 917 HB2 ALA 119 HB2 ALA 119 97.992 7.976 12.557 918 HB3 ALA 119 HB3 ALA 119 97.189 6.835 13.662 919 H SER 120 H SER 120 96.879 10.597 12.199 920 HA SER 120 HA SER 120 99.200 12.134 13.186 921 HB2 SER 120 HB2 SER 120 97.257 12.649 10.895 922 HB3 SER 120 HB3 SER 120 98.725 13.603 11.218 923 HG SER 120 HG SER 120 99.089 11.898 9.686 924 H GLY 121 H GLY 121 96.213 11.932 14.320 925 HA2 GLY 121 HA2 GLY 121 95.323 14.695 14.458 926 HA3 GLY 121 HA3 GLY 121 94.811 13.383 15.546 927 H PHE 122 H PHE 122 97.833 12.921 16.075 928 HA PHE 122 HA PHE 122 97.918 14.655 18.455 929 HB2 PHE 122 HB3 PHE 122 99.691 12.526 17.250 930 HB3 PHE 122 HB2 PHE 122 100.341 13.588 18.521 931 HD1 PHE 122 HD1 PHE 122 97.190 11.650 17.796 932 HD2 PHE 122 HD2 PHE 122 100.099 12.864 20.715 933 HE1 PHE 122 HE1 PHE 122 96.020 10.307 19.523 934 HE2 PHE 122 HE2 PHE 122 98.929 11.521 22.440 935 HZ PHE 122 HZ PHE 122 96.891 10.241 21.843 936 H LYS 123 H LYS 123 99.319 14.666 15.215 937 HA LYS 123 HA LYS 123 101.343 16.704 15.839 938 HB2 LYS 123 HB2 LYS 123 100.107 15.791 13.204 939 HB3 LYS 123 HB3 LYS 123 101.483 16.912 13.336 940 HG2 LYS 123 HG3 LYS 123 102.503 14.995 14.859 941 HG3 LYS 123 HG2 LYS 123 101.344 13.967 13.985 942 HD2 LYS 123 HD2 LYS 123 102.286 14.653 11.835 943 HD3 LYS 123 HD3 LYS 123 103.365 15.816 12.641 944 HE2 LYS 123 HE3 LYS 123 104.779 13.965 12.328 945 HE3 LYS 123 HE2 LYS 123 104.190 13.710 13.988 946 HZ1 LYS 123 HZ1 LYS 123 104.006 11.712 12.662 947 HZ2 LYS 123 HZ2 LYS 123 103.052 12.480 11.558 948 HZ3 LYS 123 HZ3 LYS 123 102.506 12.244 13.096 949 H HIS 124 H HIS 124 98.010 16.836 15.785 950 HA HIS 124 HA HIS 124 96.488 18.637 15.590 951 HB2 HIS 124 HB2 HIS 124 98.324 19.499 17.251 952 HB3 HIS 124 HB3 HIS 124 98.844 20.516 15.885 953 HD2 HIS 124 HD2 HIS 124 97.487 22.174 18.318 954 HE1 HIS 124 HE1 HIS 124 93.947 22.176 16.013 955 HE2 HIS 124 HE2 HIS 124 95.138 23.296 17.975 956 H VAL 125 H VAL 125 95.793 18.632 13.466 957 HA VAL 125 HA VAL 125 97.577 19.909 11.413 958 HB VAL 125 HB VAL 125 94.854 18.789 10.775 959 HG11 VAL 125 HG11 VAL 125 96.282 19.797 9.015 960 HG12 VAL 125 HG12 VAL 125 96.066 18.052 8.743 961 HG13 VAL 125 HG13 VAL 125 97.590 18.663 9.429 962 HG21 VAL 125 HG21 VAL 125 96.105 16.519 10.551 963 HG22 VAL 125 HG22 VAL 125 97.293 17.222 11.675 964 HG23 VAL 125 HG23 VAL 125 95.597 17.026 12.180 965 H VAL 126 H VAL 126 97.353 22.075 11.170 966 HA VAL 126 HA VAL 126 94.555 23.179 11.111 967 HB VAL 126 HB VAL 126 96.822 24.487 12.672 968 HG11 VAL 126 HG11 VAL 126 95.104 26.019 11.748 969 HG12 VAL 126 HG12 VAL 126 94.982 25.917 13.521 970 HG13 VAL 126 HG13 VAL 126 93.824 25.035 12.498 971 HG21 VAL 126 HG21 VAL 126 95.285 23.847 14.656 972 HG22 VAL 126 HG22 VAL 126 94.528 22.689 13.536 973 HG23 VAL 126 HG23 VAL 126 96.257 22.542 13.935 974 HA PRO 127 HA PRO 127 97.375 24.349 7.517 975 HB2 PRO 127 HB3 PRO 127 94.596 24.483 6.367 976 HB3 PRO 127 HB2 PRO 127 96.088 23.811 5.650 977 HG2 PRO 127 HG2 PRO 127 94.150 22.241 6.655 978 HG3 PRO 127 HG3 PRO 127 95.878 21.812 6.775 979 HD2 PRO 127 HD2 PRO 127 94.008 22.780 8.912 980 HD3 PRO 127 HD3 PRO 127 95.464 21.747 9.046 981 H ASN 128 H ASN 128 97.279 26.392 6.207 982 HA ASN 128 HA ASN 128 95.504 28.494 7.425 983 HB2 ASN 128 HB2 ASN 128 97.602 30.015 7.393 984 HB3 ASN 128 HB3 ASN 128 97.487 28.817 8.704 985 HD21 ASN 128 HD21 ASN 128 99.780 28.517 8.978 986 HD22 ASN 128 HD22 ASN 128 100.774 27.791 7.735 987 H GLU 129 H GLU 129 95.409 27.127 4.857 988 HA GLU 129 HA GLU 129 96.650 28.785 2.806 989 HB2 GLU 129 HB3 GLU 129 94.147 27.048 2.628 990 HB3 GLU 129 HB2 GLU 129 95.122 27.635 1.259 991 HG2 GLU 129 HG3 GLU 129 96.277 25.935 3.506 992 HG3 GLU 129 HG2 GLU 129 95.610 25.239 2.009 993 H VAL 130 H VAL 130 93.722 29.052 4.729 994 HA VAL 130 HA VAL 130 92.214 30.820 3.048 995 HB VAL 130 HB VAL 130 91.477 29.766 5.251 996 HG11 VAL 130 HG11 VAL 130 92.088 30.783 7.317 997 HG12 VAL 130 HG12 VAL 130 93.619 30.625 6.423 998 HG13 VAL 130 HG13 VAL 130 92.794 32.200 6.504 999 HG21 VAL 130 HG21 VAL 130 90.159 31.524 4.098 1000 HG22 VAL 130 HG22 VAL 130 91.110 32.779 4.928 1001 HG23 VAL 130 HG23 VAL 130 90.051 31.700 5.866 1002 H VAL 131 H VAL 131 94.953 31.438 5.238 1003 HA VAL 131 HA VAL 131 94.768 34.335 5.124 1004 HB VAL 131 HB VAL 131 97.370 32.796 5.389 1005 HG11 VAL 131 HG11 VAL 131 97.434 35.274 5.385 1006 HG12 VAL 131 HG12 VAL 131 96.239 35.306 6.704 1007 HG13 VAL 131 HG13 VAL 131 97.859 34.626 6.988 1008 HG21 VAL 131 HG21 VAL 131 96.655 32.837 7.923 1009 HG22 VAL 131 HG22 VAL 131 96.039 31.542 6.869 1010 HG23 VAL 131 HG23 VAL 131 95.002 32.932 7.269 1011 H VAL 132 H VAL 132 96.443 31.905 3.106 1012 HA VAL 132 HA VAL 132 97.958 33.727 1.498 1013 HB VAL 132 HB VAL 132 96.595 31.133 0.643 1014 HG11 VAL 132 HG11 VAL 132 97.380 32.525 -1.256 1015 HG12 VAL 132 HG12 VAL 132 98.392 31.073 -1.068 1016 HG13 VAL 132 HG13 VAL 132 98.986 32.651 -0.499 1017 HG21 VAL 132 HG21 VAL 132 98.053 30.870 2.633 1018 HG22 VAL 132 HG22 VAL 132 99.378 31.687 1.769 1019 HG23 VAL 132 HG23 VAL 132 98.785 30.108 1.200 1020 H GLN 133 H GLN 133 94.523 32.898 1.464 1021 HA GLN 133 HA GLN 133 94.022 34.139 -1.155 1022 HB2 GLN 133 HB2 GLN 133 92.145 33.474 1.157 1023 HB3 GLN 133 HB3 GLN 133 91.624 33.979 -0.468 1024 HG2 GLN 133 HG2 GLN 133 93.140 31.995 -1.290 1025 HG3 GLN 133 HG3 GLN 133 92.990 31.415 0.386 1026 HE21 GLN 133 HE21 GLN 133 91.587 31.081 -2.625 1027 HE22 GLN 133 HE22 GLN 133 89.958 30.679 -2.130 Start of MODEL 18 1 H1 GLU 1 H1 GLU 1 112.295 -3.675 18.346 2 H2 GLU 1 H2 GLU 1 111.593 -2.532 19.306 3 H3 GLU 1 H3 GLU 1 113.229 -2.740 19.332 4 HA GLU 1 HA GLU 1 113.000 -4.946 20.264 5 HB2 GLU 1 HB2 GLU 1 111.461 -2.772 21.754 6 HB3 GLU 1 HB3 GLU 1 112.150 -4.240 22.486 7 HG2 GLU 1 HG3 GLU 1 114.368 -3.523 22.145 8 HG3 GLU 1 HG2 GLU 1 113.900 -2.372 20.871 9 H HIS 2 H HIS 2 111.222 -5.389 18.276 10 HA HIS 2 HA HIS 2 108.763 -6.287 19.795 11 HB2 HIS 2 HB3 HIS 2 109.003 -4.791 17.190 12 HB3 HIS 2 HB2 HIS 2 107.707 -6.000 17.351 13 HD2 HIS 2 HD2 HIS 2 108.919 -3.289 20.040 14 HE1 HIS 2 HE1 HIS 2 104.743 -2.964 19.501 15 HE2 HIS 2 HE2 HIS 2 106.735 -2.055 20.816 16 HA PRO 3 HA PRO 3 110.998 -9.999 18.160 17 HB2 PRO 3 HB2 PRO 3 108.823 -11.183 19.875 18 HB3 PRO 3 HB3 PRO 3 110.559 -11.599 19.787 19 HG2 PRO 3 HG2 PRO 3 109.548 -10.169 21.820 20 HG3 PRO 3 HG3 PRO 3 111.183 -9.872 21.168 21 HD2 PRO 3 HD3 PRO 3 108.680 -8.249 20.845 22 HD3 PRO 3 HD2 PRO 3 110.387 -7.713 20.855 23 H GLU 4 H GLU 4 107.983 -8.632 17.587 24 HA GLU 4 HA GLU 4 106.312 -10.604 16.527 25 HB2 GLU 4 HB2 GLU 4 107.058 -7.943 15.234 26 HB3 GLU 4 HB3 GLU 4 105.645 -8.929 14.788 27 HG2 GLU 4 HG3 GLU 4 106.189 -7.850 17.590 28 HG3 GLU 4 HG2 GLU 4 105.088 -7.094 16.412 29 H PHE 5 H PHE 5 109.201 -9.192 14.927 30 HA PHE 5 HA PHE 5 109.044 -10.505 12.436 31 HB2 PHE 5 HB3 PHE 5 111.379 -9.798 14.229 32 HB3 PHE 5 HB2 PHE 5 111.651 -10.659 12.695 33 HD1 PHE 5 HD1 PHE 5 111.476 -9.530 10.601 34 HD2 PHE 5 HD2 PHE 5 110.191 -7.576 14.204 35 HE1 PHE 5 HE1 PHE 5 111.260 -7.391 9.363 36 HE2 PHE 5 HE2 PHE 5 109.976 -5.437 12.967 37 HZ PHE 5 HZ PHE 5 110.510 -5.344 10.547 38 H LEU 6 H LEU 6 110.176 -11.816 15.558 39 HA LEU 6 HA LEU 6 110.808 -14.440 14.358 40 HB2 LEU 6 HB2 LEU 6 110.629 -13.383 17.202 41 HB3 LEU 6 HB3 LEU 6 110.919 -15.104 16.855 42 HG LEU 6 HG LEU 6 113.034 -13.767 17.184 43 HD11 LEU 6 HD11 LEU 6 113.020 -15.846 15.828 44 HD12 LEU 6 HD12 LEU 6 112.589 -14.900 14.383 45 HD13 LEU 6 HD13 LEU 6 114.170 -14.660 15.166 46 HD21 LEU 6 HD21 LEU 6 113.665 -12.067 15.646 47 HD22 LEU 6 HD22 LEU 6 111.957 -11.718 16.003 48 HD23 LEU 6 HD23 LEU 6 112.400 -12.532 14.483 49 H LYS 7 H LYS 7 108.013 -12.866 15.774 50 HA LYS 7 HA LYS 7 106.553 -15.265 16.498 51 HB2 LYS 7 HB2 LYS 7 106.018 -12.799 17.080 52 HB3 LYS 7 HB3 LYS 7 105.283 -12.706 15.462 53 HG2 LYS 7 HG2 LYS 7 103.708 -14.462 15.991 54 HG3 LYS 7 HG3 LYS 7 104.552 -14.840 17.512 55 HD2 LYS 7 HD2 LYS 7 103.975 -12.618 18.408 56 HD3 LYS 7 HD3 LYS 7 103.184 -12.187 16.874 57 HE2 LYS 7 HE2 LYS 7 101.564 -12.949 18.639 58 HE3 LYS 7 HE3 LYS 7 101.530 -13.962 17.176 59 HZ1 LYS 7 HZ1 LYS 7 101.719 -15.017 19.532 60 HZ2 LYS 7 HZ2 LYS 7 103.327 -14.705 19.346 61 HZ3 LYS 7 HZ3 LYS 7 102.542 -15.666 18.259 62 H ALA 8 H ALA 8 107.050 -13.540 13.449 63 HA ALA 8 HA ALA 8 104.946 -15.010 12.015 64 HB1 ALA 8 HB1 ALA 8 107.396 -13.500 11.000 65 HB2 ALA 8 HB2 ALA 8 105.758 -12.833 11.198 66 HB3 ALA 8 HB3 ALA 8 106.064 -14.094 9.980 67 H GLY 9 H GLY 9 105.087 -17.177 11.711 68 HA2 GLY 9 HA3 GLY 9 106.140 -19.039 10.523 69 HA3 GLY 9 HA2 GLY 9 107.721 -18.247 10.724 70 H LYS 10 H LYS 10 105.110 -19.036 13.073 71 HA LYS 10 HA LYS 10 107.060 -20.868 14.452 72 HB2 LYS 10 HB3 LYS 10 105.700 -18.422 15.623 73 HB3 LYS 10 HB2 LYS 10 106.172 -19.792 16.657 74 HG2 LYS 10 HG3 LYS 10 108.180 -18.651 14.714 75 HG3 LYS 10 HG2 LYS 10 107.865 -17.794 16.241 76 HD2 LYS 10 HD2 LYS 10 108.337 -20.769 16.321 77 HD3 LYS 10 HD3 LYS 10 109.734 -19.687 16.107 78 HE2 LYS 10 HE2 LYS 10 109.038 -18.421 18.139 79 HE3 LYS 10 HE3 LYS 10 107.683 -19.554 18.363 80 HZ1 LYS 10 HZ1 LYS 10 109.594 -20.180 19.683 81 HZ2 LYS 10 HZ2 LYS 10 110.543 -20.285 18.338 82 HZ3 LYS 10 HZ3 LYS 10 109.288 -21.335 18.546 83 H GLU 11 H GLU 11 103.888 -20.054 13.423 84 HA GLU 11 HA GLU 11 102.902 -22.653 14.488 85 HB2 GLU 11 HB2 GLU 11 100.833 -21.480 15.451 86 HB3 GLU 11 HB3 GLU 11 102.334 -21.298 16.389 87 HG2 GLU 11 HG3 GLU 11 102.661 -19.072 15.664 88 HG3 GLU 11 HG2 GLU 11 101.568 -19.268 14.273 89 HA PRO 12 HA PRO 12 100.773 -22.374 10.612 90 HB2 PRO 12 HB2 PRO 12 98.793 -24.244 11.027 91 HB3 PRO 12 HB3 PRO 12 100.506 -24.674 10.749 92 HG2 PRO 12 HG2 PRO 12 98.961 -24.540 13.311 93 HG3 PRO 12 HG3 PRO 12 100.193 -25.717 12.778 94 HD2 PRO 12 HD3 PRO 12 100.713 -23.629 14.520 95 HD3 PRO 12 HD2 PRO 12 101.956 -24.371 13.468 96 H GLY 13 H GLY 13 98.485 -22.061 9.686 97 HA2 GLY 13 HA2 GLY 13 96.156 -21.320 10.170 98 HA3 GLY 13 HA3 GLY 13 96.756 -20.555 11.661 99 H LEU 14 H LEU 14 95.641 -18.606 10.750 100 HA LEU 14 HA LEU 14 97.310 -17.298 8.591 101 HB2 LEU 14 HB2 LEU 14 94.942 -17.504 7.986 102 HB3 LEU 14 HB3 LEU 14 94.456 -16.743 9.519 103 HG LEU 14 HG LEU 14 96.416 -15.136 8.008 104 HD11 LEU 14 HD11 LEU 14 95.206 -16.138 6.087 105 HD12 LEU 14 HD12 LEU 14 93.656 -15.647 6.810 106 HD13 LEU 14 HD13 LEU 14 94.814 -14.411 6.263 107 HD21 LEU 14 HD21 LEU 14 93.589 -14.547 8.996 108 HD22 LEU 14 HD22 LEU 14 94.836 -13.352 8.568 109 HD23 LEU 14 HD23 LEU 14 95.057 -14.398 9.991 110 H GLN 15 H GLN 15 98.749 -15.860 9.390 111 HA GLN 15 HA GLN 15 98.178 -14.609 12.063 112 HB2 GLN 15 HB3 GLN 15 100.699 -14.445 10.356 113 HB3 GLN 15 HB2 GLN 15 100.530 -13.991 12.069 114 HG2 GLN 15 HG2 GLN 15 99.739 -16.464 12.401 115 HG3 GLN 15 HG3 GLN 15 100.503 -16.751 10.819 116 HE21 GLN 15 HE21 GLN 15 102.845 -16.493 10.648 117 HE22 GLN 15 HE22 GLN 15 103.846 -16.408 12.080 118 H ILE 16 H ILE 16 98.471 -12.261 12.319 119 HA ILE 16 HA ILE 16 98.303 -10.703 9.752 120 HB ILE 16 HB ILE 16 96.334 -10.105 11.966 121 HG12 ILE 16 HG12 ILE 16 96.103 -12.237 9.808 122 HG13 ILE 16 HG13 ILE 16 95.874 -12.427 11.562 123 HG21 ILE 16 HG21 ILE 16 96.915 -8.687 9.800 124 HG22 ILE 16 HG22 ILE 16 95.872 -9.880 8.990 125 HG23 ILE 16 HG23 ILE 16 95.221 -8.881 10.312 126 HD11 ILE 16 HD11 ILE 16 93.657 -12.289 10.828 127 HD12 ILE 16 HD12 ILE 16 94.001 -10.585 11.209 128 HD13 ILE 16 HD13 ILE 16 94.054 -11.148 9.521 129 H TRP 17 H TRP 17 99.945 -9.260 9.985 130 HA TRP 17 HA TRP 17 99.986 -7.663 12.531 131 HB2 TRP 17 HB2 TRP 17 102.484 -7.792 12.585 132 HB3 TRP 17 HB3 TRP 17 101.705 -9.362 12.883 133 HD1 TRP 17 HD1 TRP 17 103.247 -7.394 9.917 134 HE1 TRP 17 HE1 TRP 17 104.358 -9.068 8.298 135 HE3 TRP 17 HE3 TRP 17 101.966 -11.753 12.247 136 HZ2 TRP 17 HZ2 TRP 17 104.650 -11.930 8.070 137 HZ3 TRP 17 HZ3 TRP 17 102.674 -13.936 11.312 138 HH2 TRP 17 HH2 TRP 17 104.012 -14.029 9.230 139 H ARG 18 H ARG 18 100.393 -5.506 12.175 140 HA ARG 18 HA ARG 18 100.582 -4.689 9.306 141 HB2 ARG 18 HB2 ARG 18 98.915 -3.605 10.790 142 HB3 ARG 18 HB3 ARG 18 100.229 -3.035 11.846 143 HG2 ARG 18 HG3 ARG 18 101.205 -1.790 9.911 144 HG3 ARG 18 HG2 ARG 18 99.831 -2.312 8.908 145 HD2 ARG 18 HD2 ARG 18 99.666 0.027 10.003 146 HD3 ARG 18 HD3 ARG 18 98.270 -1.060 10.201 147 HE ARG 18 HE ARG 18 100.187 -1.357 12.400 148 HH11 ARG 18 HH11 ARG 18 99.510 -0.534 14.393 149 HH12 ARG 18 HH12 ARG 18 98.174 0.592 14.466 150 HH21 ARG 18 HH21 ARG 18 97.643 0.582 11.024 151 HH22 ARG 18 HH22 ARG 18 97.120 1.222 12.566 152 H VAL 19 H VAL 19 102.265 -3.403 8.465 153 HA VAL 19 HA VAL 19 104.843 -3.697 9.921 154 HB VAL 19 HB VAL 19 104.695 -2.098 7.405 155 HG11 VAL 19 HG11 VAL 19 106.835 -2.770 8.462 156 HG12 VAL 19 HG12 VAL 19 106.361 -4.481 8.329 157 HG13 VAL 19 HG13 VAL 19 106.648 -3.520 6.859 158 HG21 VAL 19 HG21 VAL 19 104.520 -4.315 6.111 159 HG22 VAL 19 HG22 VAL 19 103.875 -5.018 7.614 160 HG23 VAL 19 HG23 VAL 19 103.008 -3.687 6.810 161 H GLU 20 H GLU 20 106.071 -1.993 10.735 162 HA GLU 20 HA GLU 20 105.035 0.790 10.410 163 HB2 GLU 20 HB3 GLU 20 103.748 0.075 12.335 164 HB3 GLU 20 HB2 GLU 20 105.184 -0.659 13.088 165 HG2 GLU 20 HG2 GLU 20 106.175 1.456 13.527 166 HG3 GLU 20 HG3 GLU 20 105.101 2.293 12.381 167 H LYS 21 H LYS 21 106.939 1.586 9.598 168 HA LYS 21 HA LYS 21 109.271 2.027 9.483 169 HB2 LYS 21 HB2 LYS 21 108.346 2.514 12.287 170 HB3 LYS 21 HB3 LYS 21 110.106 2.480 12.025 171 HG2 LYS 21 HG2 LYS 21 109.321 4.771 11.734 172 HG3 LYS 21 HG3 LYS 21 109.796 4.129 10.143 173 HD2 LYS 21 HD2 LYS 21 107.337 3.474 9.826 174 HD3 LYS 21 HD3 LYS 21 106.987 4.461 11.265 175 HE2 LYS 21 HE3 LYS 21 107.763 5.305 8.512 176 HE3 LYS 21 HE2 LYS 21 106.766 6.145 9.724 177 HZ1 LYS 21 HZ1 LYS 21 108.751 7.348 9.536 178 HZ2 LYS 21 HZ2 LYS 21 108.904 6.506 10.946 179 HZ3 LYS 21 HZ3 LYS 21 109.703 6.002 9.594 180 H PHE 22 H PHE 22 108.587 -0.803 9.612 181 HA PHE 22 HA PHE 22 109.812 -2.819 9.811 182 HB2 PHE 22 HB3 PHE 22 112.159 -1.418 11.066 183 HB3 PHE 22 HB2 PHE 22 112.130 -2.701 9.832 184 HD1 PHE 22 HD1 PHE 22 113.054 0.563 10.244 185 HD2 PHE 22 HD2 PHE 22 110.554 -1.807 7.679 186 HE1 PHE 22 HE1 PHE 22 113.267 2.270 8.458 187 HE2 PHE 22 HE2 PHE 22 110.764 -0.099 5.893 188 HZ PHE 22 HZ PHE 22 112.120 1.942 6.284 189 H ASP 23 H ASP 23 108.225 -1.531 12.037 190 HA ASP 23 HA ASP 23 109.620 -2.852 14.375 191 HB2 ASP 23 HB2 ASP 23 108.979 -0.390 14.543 192 HB3 ASP 23 HB3 ASP 23 107.278 -0.905 14.462 193 H LEU 24 H LEU 24 106.894 -2.986 12.224 194 HA LEU 24 HA LEU 24 105.102 -4.519 12.117 195 HB2 LEU 24 HB3 LEU 24 107.328 -5.934 13.412 196 HB3 LEU 24 HB2 LEU 24 105.746 -6.557 13.937 197 HG LEU 24 HG LEU 24 105.082 -6.687 11.492 198 HD11 LEU 24 HD11 LEU 24 106.747 -5.056 10.642 199 HD12 LEU 24 HD12 LEU 24 108.063 -6.160 11.106 200 HD13 LEU 24 HD13 LEU 24 106.918 -6.629 9.826 201 HD21 LEU 24 HD21 LEU 24 105.867 -8.672 12.754 202 HD22 LEU 24 HD22 LEU 24 107.551 -8.270 12.338 203 HD23 LEU 24 HD23 LEU 24 106.405 -8.739 11.058 204 H VAL 25 H VAL 25 103.120 -4.689 13.128 205 HA VAL 25 HA VAL 25 102.993 -4.446 16.107 206 HB VAL 25 HB VAL 25 102.105 -2.319 14.152 207 HG11 VAL 25 HG11 VAL 25 100.686 -1.461 16.172 208 HG12 VAL 25 HG12 VAL 25 100.712 -3.156 16.712 209 HG13 VAL 25 HG13 VAL 25 99.995 -2.735 15.138 210 HG21 VAL 25 HG21 VAL 25 104.185 -2.044 15.477 211 HG22 VAL 25 HG22 VAL 25 102.955 -0.850 15.956 212 HG23 VAL 25 HG23 VAL 25 103.257 -2.276 16.978 213 HA PRO 26 HA PRO 26 99.696 -7.258 14.967 214 HB2 PRO 26 HB2 PRO 26 98.714 -7.685 17.514 215 HB3 PRO 26 HB3 PRO 26 100.195 -8.459 16.882 216 HG2 PRO 26 HG3 PRO 26 99.894 -6.110 18.704 217 HG3 PRO 26 HG2 PRO 26 101.101 -7.424 18.727 218 HD2 PRO 26 HD2 PRO 26 101.604 -4.884 17.729 219 HD3 PRO 26 HD3 PRO 26 102.468 -6.356 17.189 220 H VAL 27 H VAL 27 97.745 -6.683 14.138 221 HA VAL 27 HA VAL 27 96.449 -4.182 14.941 222 HB VAL 27 HB VAL 27 96.342 -5.209 12.633 223 HG11 VAL 27 HG11 VAL 27 95.106 -7.158 12.204 224 HG12 VAL 27 HG12 VAL 27 95.884 -7.553 13.755 225 HG13 VAL 27 HG13 VAL 27 94.184 -7.026 13.720 226 HG21 VAL 27 HG21 VAL 27 94.716 -3.486 13.368 227 HG22 VAL 27 HG22 VAL 27 93.947 -4.668 12.283 228 HG23 VAL 27 HG23 VAL 27 93.669 -4.760 14.038 229 HA PRO 28 HA PRO 28 94.259 -5.493 18.590 230 HB2 PRO 28 HB2 PRO 28 92.030 -3.913 17.304 231 HB3 PRO 28 HB3 PRO 28 92.664 -3.836 18.973 232 HG2 PRO 28 HG3 PRO 28 93.279 -2.004 17.080 233 HG3 PRO 28 HG2 PRO 28 94.394 -2.457 18.397 234 HD2 PRO 28 HD2 PRO 28 94.576 -3.049 15.490 235 HD3 PRO 28 HD3 PRO 28 95.852 -3.097 16.743 236 H THR 29 H THR 29 93.242 -7.423 18.905 237 HA THR 29 HA THR 29 92.020 -8.870 16.702 238 HB THR 29 HB THR 29 91.997 -9.260 19.720 239 HG1 THR 29 HG1 THR 29 93.354 -11.024 19.068 240 HG21 THR 29 HG21 THR 29 91.122 -11.601 19.061 241 HG22 THR 29 HG22 THR 29 89.947 -10.265 19.030 242 HG23 THR 29 HG23 THR 29 90.658 -10.860 17.510 243 H ASN 30 H ASN 30 90.803 -6.593 19.078 244 HA ASN 30 HA ASN 30 88.038 -7.265 19.100 245 HB2 ASN 30 HB2 ASN 30 88.940 -5.470 20.498 246 HB3 ASN 30 HB3 ASN 30 89.361 -4.516 19.056 247 HD21 ASN 30 HD21 ASN 30 87.724 -3.175 20.761 248 HD22 ASN 30 HD22 ASN 30 86.070 -3.179 20.192 249 H LEU 31 H LEU 31 89.792 -5.133 16.784 250 HA LEU 31 HA LEU 31 87.392 -4.902 15.081 251 HB2 LEU 31 HB3 LEU 31 90.299 -4.068 14.819 252 HB3 LEU 31 HB2 LEU 31 89.172 -3.924 13.449 253 HG LEU 31 HG LEU 31 87.714 -2.462 14.702 254 HD11 LEU 31 HD11 LEU 31 88.412 -1.829 17.095 255 HD12 LEU 31 HD12 LEU 31 87.724 -3.457 16.882 256 HD13 LEU 31 HD13 LEU 31 89.484 -3.249 17.047 257 HD21 LEU 31 HD21 LEU 31 90.336 -1.363 15.635 258 HD22 LEU 31 HD22 LEU 31 89.065 -0.598 14.651 259 HD23 LEU 31 HD23 LEU 31 90.204 -1.742 13.901 260 H TYR 32 H TYR 32 90.625 -6.421 14.654 261 HA TYR 32 HA TYR 32 91.263 -8.141 13.154 262 HB2 TYR 32 HB2 TYR 32 89.811 -9.288 14.958 263 HB3 TYR 32 HB3 TYR 32 88.515 -9.299 13.738 264 HD1 TYR 32 HD1 TYR 32 92.035 -10.382 14.382 265 HD2 TYR 32 HD2 TYR 32 88.511 -10.890 11.979 266 HE1 TYR 32 HE1 TYR 32 93.043 -12.389 13.328 267 HE2 TYR 32 HE2 TYR 32 89.520 -12.894 10.923 268 HH TYR 32 HH TYR 32 92.251 -13.655 10.605 269 H GLY 33 H GLY 33 91.262 -6.990 11.183 270 HA2 GLY 33 HA3 GLY 33 90.351 -7.634 8.870 271 HA3 GLY 33 HA2 GLY 33 88.734 -7.335 9.549 272 H ASP 34 H ASP 34 89.670 -4.986 11.130 273 HA ASP 34 HA ASP 34 89.058 -2.910 9.292 274 HB2 ASP 34 HB2 ASP 34 90.566 -2.991 11.911 275 HB3 ASP 34 HB3 ASP 34 90.489 -1.474 10.983 276 H PHE 35 H PHE 35 90.335 -1.493 8.012 277 HA PHE 35 HA PHE 35 93.254 -2.222 7.800 278 HB2 PHE 35 HB3 PHE 35 91.159 -2.276 5.620 279 HB3 PHE 35 HB2 PHE 35 92.849 -1.886 5.220 280 HD1 PHE 35 HD1 PHE 35 90.512 -4.516 5.735 281 HD2 PHE 35 HD2 PHE 35 94.656 -3.511 6.239 282 HE1 PHE 35 HE1 PHE 35 91.087 -6.929 5.813 283 HE2 PHE 35 HE2 PHE 35 95.233 -5.922 6.316 284 HZ PHE 35 HZ PHE 35 93.447 -7.631 6.103 285 H PHE 36 H PHE 36 94.403 -0.387 8.057 286 HA PHE 36 HA PHE 36 93.074 2.241 7.632 287 HB2 PHE 36 HB2 PHE 36 95.784 1.346 8.669 288 HB3 PHE 36 HB3 PHE 36 95.448 3.058 8.314 289 HD1 PHE 36 HD1 PHE 36 93.679 0.171 9.974 290 HD2 PHE 36 HD2 PHE 36 94.751 4.328 10.128 291 HE1 PHE 36 HE1 PHE 36 92.511 0.391 12.151 292 HE2 PHE 36 HE2 PHE 36 93.584 4.548 12.304 293 HZ PHE 36 HZ PHE 36 92.463 2.581 13.316 294 H THR 37 H THR 37 92.889 2.843 5.509 295 HA THR 37 HA THR 37 94.800 1.949 3.486 296 HB THR 37 HB THR 37 93.542 3.291 1.945 297 HG1 THR 37 HG1 THR 37 93.246 5.248 2.770 298 HG21 THR 37 HG21 THR 37 91.202 2.660 2.484 299 HG22 THR 37 HG22 THR 37 91.675 2.347 4.171 300 HG23 THR 37 HG23 THR 37 92.324 1.331 2.862 301 H GLY 38 H GLY 38 96.838 2.590 4.308 302 HA2 GLY 38 HA2 GLY 38 97.818 5.103 3.328 303 HA3 GLY 38 HA3 GLY 38 97.517 5.284 5.075 304 H ASP 39 H ASP 39 98.050 2.424 5.604 305 HA ASP 39 HA ASP 39 101.060 2.511 5.290 306 HB2 ASP 39 HB2 ASP 39 101.090 1.063 7.337 307 HB3 ASP 39 HB3 ASP 39 100.335 2.647 7.639 308 H ALA 40 H ALA 40 101.232 -0.289 6.251 309 HA ALA 40 HA ALA 40 99.904 -1.705 3.937 310 HB1 ALA 40 HB1 ALA 40 102.009 -2.947 3.519 311 HB2 ALA 40 HB2 ALA 40 102.824 -1.988 4.778 312 HB3 ALA 40 HB3 ALA 40 102.242 -1.197 3.293 313 H TYR 41 H TYR 41 99.183 -3.762 4.419 314 HA TYR 41 HA TYR 41 99.687 -4.668 7.264 315 HB2 TYR 41 HB3 TYR 41 97.282 -4.753 5.452 316 HB3 TYR 41 HB2 TYR 41 97.499 -6.067 6.632 317 HD1 TYR 41 HD1 TYR 41 96.734 -5.758 8.816 318 HD2 TYR 41 HD2 TYR 41 97.620 -2.314 6.406 319 HE1 TYR 41 HE1 TYR 41 95.885 -4.279 10.616 320 HE2 TYR 41 HE2 TYR 41 96.772 -0.835 8.208 321 HH TYR 41 HH TYR 41 94.878 -1.846 10.706 322 H VAL 42 H VAL 42 100.857 -6.509 7.465 323 HA VAL 42 HA VAL 42 101.203 -8.191 4.984 324 HB VAL 42 HB VAL 42 102.825 -7.953 7.553 325 HG11 VAL 42 HG11 VAL 42 102.758 -10.303 6.707 326 HG12 VAL 42 HG12 VAL 42 103.299 -9.725 5.114 327 HG13 VAL 42 HG13 VAL 42 104.371 -9.573 6.526 328 HG21 VAL 42 HG21 VAL 42 103.059 -6.119 5.869 329 HG22 VAL 42 HG22 VAL 42 104.551 -7.076 6.032 330 HG23 VAL 42 HG23 VAL 42 103.477 -7.333 4.636 331 H ILE 43 H ILE 43 100.030 -10.022 4.883 332 HA ILE 43 HA ILE 43 99.272 -11.332 7.507 333 HB ILE 43 HB ILE 43 97.670 -11.930 5.057 334 HG12 ILE 43 HG12 ILE 43 97.370 -9.294 6.555 335 HG13 ILE 43 HG13 ILE 43 98.097 -9.447 4.938 336 HG21 ILE 43 HG21 ILE 43 95.830 -11.727 6.774 337 HG22 ILE 43 HG22 ILE 43 97.074 -12.929 7.195 338 HG23 ILE 43 HG23 ILE 43 97.073 -11.335 7.987 339 HD11 ILE 43 HD11 ILE 43 95.701 -8.830 4.781 340 HD12 ILE 43 HD12 ILE 43 95.265 -10.289 5.704 341 HD13 ILE 43 HD13 ILE 43 95.992 -10.443 4.086 342 H LEU 44 H LEU 44 99.466 -13.582 7.620 343 HA LEU 44 HA LEU 44 100.851 -14.864 5.252 344 HB2 LEU 44 HB3 LEU 44 101.772 -14.501 8.002 345 HB3 LEU 44 HB2 LEU 44 101.680 -16.228 7.583 346 HG LEU 44 HG LEU 44 102.934 -15.669 5.440 347 HD11 LEU 44 HD11 LEU 44 104.169 -13.517 5.415 348 HD12 LEU 44 HD12 LEU 44 103.349 -13.032 6.919 349 HD13 LEU 44 HD13 LEU 44 102.409 -13.248 5.423 350 HD21 LEU 44 HD21 LEU 44 104.872 -14.784 7.445 351 HD22 LEU 44 HD22 LEU 44 103.858 -16.106 8.071 352 HD23 LEU 44 HD23 LEU 44 104.785 -16.330 6.568 353 H LYS 45 H LYS 45 100.414 -17.153 4.987 354 HA LYS 45 HA LYS 45 98.218 -18.223 6.747 355 HB2 LYS 45 HB2 LYS 45 97.555 -17.102 4.362 356 HB3 LYS 45 HB3 LYS 45 97.940 -18.753 3.818 357 HG2 LYS 45 HG2 LYS 45 96.382 -19.678 5.504 358 HG3 LYS 45 HG3 LYS 45 96.006 -18.031 6.066 359 HD2 LYS 45 HD3 LYS 45 94.249 -18.421 4.568 360 HD3 LYS 45 HD2 LYS 45 95.435 -17.611 3.516 361 HE2 LYS 45 HE3 LYS 45 96.243 -19.785 2.704 362 HE3 LYS 45 HE2 LYS 45 95.136 -20.633 3.811 363 HZ1 LYS 45 HZ1 LYS 45 94.220 -20.460 1.595 364 HZ2 LYS 45 HZ2 LYS 45 94.323 -18.814 1.632 365 HZ3 LYS 45 HZ3 LYS 45 93.297 -19.599 2.658 366 H THR 46 H THR 46 99.658 -19.745 7.618 367 HA THR 46 HA THR 46 101.150 -21.533 5.751 368 HB THR 46 HB THR 46 101.035 -21.117 8.740 369 HG1 THR 46 HG1 THR 46 103.313 -21.596 7.143 370 HG21 THR 46 HG21 THR 46 102.640 -23.172 8.804 371 HG22 THR 46 HG22 THR 46 101.870 -23.632 7.267 372 HG23 THR 46 HG23 THR 46 100.888 -23.479 8.743 373 H VAL 47 H VAL 47 99.978 -23.102 4.787 374 HA VAL 47 HA VAL 47 97.669 -24.300 6.283 375 HB VAL 47 HB VAL 47 98.344 -25.290 3.564 376 HG11 VAL 47 HG11 VAL 47 96.252 -25.866 4.766 377 HG12 VAL 47 HG12 VAL 47 95.827 -24.139 4.849 378 HG13 VAL 47 HG13 VAL 47 95.907 -24.961 3.272 379 HG21 VAL 47 HG21 VAL 47 97.330 -23.162 2.559 380 HG22 VAL 47 HG22 VAL 47 98.997 -23.012 3.163 381 HG23 VAL 47 HG23 VAL 47 97.641 -22.383 4.128 382 H GLN 48 H GLN 48 97.453 -26.711 6.143 383 HA GLN 48 HA GLN 48 100.163 -27.954 6.620 384 HB2 GLN 48 HB2 GLN 48 98.213 -27.954 8.375 385 HB3 GLN 48 HB3 GLN 48 97.510 -29.224 7.344 386 HG2 GLN 48 HG2 GLN 48 99.612 -30.533 7.536 387 HG3 GLN 48 HG3 GLN 48 100.298 -29.269 8.584 388 HE21 GLN 48 HE21 GLN 48 99.555 -32.196 9.174 389 HE22 GLN 48 HE22 GLN 48 98.494 -32.086 10.561 390 H LEU 49 H LEU 49 100.928 -29.190 4.984 391 HA LEU 49 HA LEU 49 99.177 -30.000 2.769 392 HB2 LEU 49 HB2 LEU 49 102.081 -30.386 3.498 393 HB3 LEU 49 HB3 LEU 49 101.364 -31.389 2.213 394 HG LEU 49 HG LEU 49 100.864 -28.418 2.170 395 HD11 LEU 49 HD11 LEU 49 102.978 -28.204 0.774 396 HD12 LEU 49 HD12 LEU 49 103.450 -29.814 1.368 397 HD13 LEU 49 HD13 LEU 49 103.258 -28.464 2.512 398 HD21 LEU 49 HD21 LEU 49 99.759 -29.943 0.554 399 HD22 LEU 49 HD22 LEU 49 100.895 -28.850 -0.272 400 HD23 LEU 49 HD23 LEU 49 101.352 -30.543 0.032 401 H ARG 50 H ARG 50 101.421 -32.432 3.848 402 HA ARG 50 HA ARG 50 99.121 -34.309 4.160 403 HB2 ARG 50 HB2 ARG 50 102.141 -34.733 4.177 404 HB3 ARG 50 HB3 ARG 50 100.941 -36.039 4.322 405 HG2 ARG 50 HG3 ARG 50 100.189 -35.773 2.121 406 HG3 ARG 50 HG2 ARG 50 100.740 -34.083 2.029 407 HD2 ARG 50 HD2 ARG 50 103.113 -34.902 2.110 408 HD3 ARG 50 HD3 ARG 50 102.502 -36.573 2.061 409 HE ARG 50 HE ARG 50 101.354 -35.110 -0.147 410 HH11 ARG 50 HH11 ARG 50 102.266 -35.419 -2.192 411 HH12 ARG 50 HH12 ARG 50 103.884 -36.067 -2.340 412 HH21 ARG 50 HH21 ARG 50 104.358 -36.355 1.098 413 HH22 ARG 50 HH22 ARG 50 105.064 -36.595 -0.484 414 H ASN 51 H ASN 51 102.128 -33.709 6.036 415 HA ASN 51 HA ASN 51 100.640 -33.368 8.533 416 HB2 ASN 51 HB3 ASN 51 101.769 -36.076 7.818 417 HB3 ASN 51 HB2 ASN 51 101.819 -35.529 9.511 418 HD21 ASN 51 HD21 ASN 51 100.102 -37.676 8.115 419 HD22 ASN 51 HD22 ASN 51 98.462 -37.237 8.537 420 H GLY 52 H GLY 52 102.951 -32.351 6.799 421 HA2 GLY 52 HA3 GLY 52 104.720 -31.728 9.082 422 HA3 GLY 52 HA2 GLY 52 105.493 -32.761 7.857 423 H ASN 53 H ASN 53 104.605 -31.804 5.478 424 HA ASN 53 HA ASN 53 106.083 -29.288 5.252 425 HB2 ASN 53 HB3 ASN 53 104.306 -30.815 3.302 426 HB3 ASN 53 HB2 ASN 53 105.229 -29.358 2.865 427 HD21 ASN 53 HD21 ASN 53 105.599 -32.728 4.098 428 HD22 ASN 53 HD22 ASN 53 107.252 -32.904 3.551 429 H LEU 54 H LEU 54 105.285 -27.193 4.886 430 HA LEU 54 HA LEU 54 102.291 -26.872 5.137 431 HB2 LEU 54 HB2 LEU 54 103.724 -24.688 6.426 432 HB3 LEU 54 HB3 LEU 54 102.467 -25.754 7.096 433 HG LEU 54 HG LEU 54 104.328 -27.524 7.343 434 HD11 LEU 54 HD11 LEU 54 106.425 -25.547 7.655 435 HD12 LEU 54 HD12 LEU 54 105.788 -25.481 5.994 436 HD13 LEU 54 HD13 LEU 54 106.416 -27.013 6.646 437 HD21 LEU 54 HD21 LEU 54 105.111 -26.516 9.471 438 HD22 LEU 54 HD22 LEU 54 104.511 -24.927 8.938 439 HD23 LEU 54 HD23 LEU 54 103.365 -26.254 9.244 440 H GLN 55 H GLN 55 101.650 -24.534 4.511 441 HA GLN 55 HA GLN 55 103.603 -23.447 2.478 442 HB2 GLN 55 HB2 GLN 55 101.833 -24.909 1.399 443 HB3 GLN 55 HB3 GLN 55 100.613 -23.753 1.986 444 HG2 GLN 55 HG2 GLN 55 101.806 -21.923 0.772 445 HG3 GLN 55 HG3 GLN 55 102.955 -23.124 0.135 446 HE21 GLN 55 HE21 GLN 55 99.371 -22.542 0.322 447 HE22 GLN 55 HE22 GLN 55 99.044 -23.209 -1.262 448 H TYR 56 H TYR 56 104.096 -21.521 3.452 449 HA TYR 56 HA TYR 56 102.047 -19.924 4.865 450 HB2 TYR 56 HB3 TYR 56 104.964 -19.826 4.365 451 HB3 TYR 56 HB2 TYR 56 104.191 -18.225 4.338 452 HD1 TYR 56 HD1 TYR 56 102.286 -18.000 6.300 453 HD2 TYR 56 HD2 TYR 56 105.772 -20.508 6.425 454 HE1 TYR 56 HE1 TYR 56 102.202 -17.995 8.780 455 HE2 TYR 56 HE2 TYR 56 105.685 -20.505 8.903 456 HH TYR 56 HH TYR 56 103.004 -19.484 10.670 457 H ASP 57 H ASP 57 100.611 -18.593 3.842 458 HA ASP 57 HA ASP 57 101.260 -17.800 1.001 459 HB2 ASP 57 HB3 ASP 57 99.011 -18.976 1.848 460 HB3 ASP 57 HB2 ASP 57 98.570 -17.300 2.255 461 H LEU 58 H LEU 58 101.957 -15.753 0.683 462 HA LEU 58 HA LEU 58 101.667 -13.820 2.958 463 HB2 LEU 58 HB2 LEU 58 103.406 -14.011 0.494 464 HB3 LEU 58 HB3 LEU 58 103.189 -12.441 1.301 465 HG LEU 58 HG LEU 58 103.978 -13.390 3.424 466 HD11 LEU 58 HD11 LEU 58 105.001 -15.773 3.249 467 HD12 LEU 58 HD12 LEU 58 103.985 -15.954 1.799 468 HD13 LEU 58 HD13 LEU 58 103.231 -15.644 3.381 469 HD21 LEU 58 HD21 LEU 58 105.527 -12.818 1.221 470 HD22 LEU 58 HD22 LEU 58 106.179 -13.178 2.838 471 HD23 LEU 58 HD23 LEU 58 106.077 -14.465 1.613 472 H HIS 59 H HIS 59 100.603 -11.866 2.794 473 HA HIS 59 HA HIS 59 99.463 -11.060 0.151 474 HB2 HIS 59 HB3 HIS 59 97.520 -11.032 2.431 475 HB3 HIS 59 HB2 HIS 59 97.231 -11.270 0.692 476 HD2 HIS 59 HD2 HIS 59 98.645 -13.451 3.720 477 HE1 HIS 59 HE1 HIS 59 97.076 -16.021 0.759 478 H TYR 60 H TYR 60 100.323 -9.021 0.088 479 HA TYR 60 HA TYR 60 100.296 -7.436 2.648 480 HB2 TYR 60 HB3 TYR 60 101.548 -5.796 0.885 481 HB3 TYR 60 HB2 TYR 60 102.400 -7.055 1.809 482 HD1 TYR 60 HD1 TYR 60 102.264 -9.492 0.678 483 HD2 TYR 60 HD2 TYR 60 101.862 -5.760 -1.410 484 HE1 TYR 60 HE1 TYR 60 102.904 -10.610 -1.441 485 HE2 TYR 60 HE2 TYR 60 102.504 -6.875 -3.530 486 HH TYR 60 HH TYR 60 102.355 -9.926 -4.145 487 H TRP 61 H TRP 61 98.519 -6.217 2.966 488 HA TRP 61 HA TRP 61 96.883 -5.430 0.594 489 HB2 TRP 61 HB2 TRP 61 95.940 -6.349 2.821 490 HB3 TRP 61 HB3 TRP 61 96.304 -4.741 3.493 491 HD1 TRP 61 HD1 TRP 61 94.197 -6.430 0.750 492 HE1 TRP 61 HE1 TRP 61 92.227 -4.887 0.121 493 HE3 TRP 61 HE3 TRP 61 95.436 -2.347 3.555 494 HZ2 TRP 61 HZ2 TRP 61 91.321 -2.229 0.772 495 HZ3 TRP 61 HZ3 TRP 61 94.002 -0.326 3.534 496 HH2 TRP 61 HH2 TRP 61 91.947 -0.261 2.148 497 H LEU 62 H LEU 62 97.007 -3.480 -0.328 498 HA LEU 62 HA LEU 62 98.268 -1.241 1.276 499 HB2 LEU 62 HB2 LEU 62 98.380 -1.291 -1.737 500 HB3 LEU 62 HB3 LEU 62 99.516 -0.564 -0.577 501 HG LEU 62 HG LEU 62 99.135 -3.573 -0.888 502 HD11 LEU 62 HD11 LEU 62 100.121 -3.156 -2.933 503 HD12 LEU 62 HD12 LEU 62 100.791 -1.593 -2.409 504 HD13 LEU 62 HD13 LEU 62 101.590 -3.109 -1.930 505 HD21 LEU 62 HD21 LEU 62 100.188 -3.319 1.159 506 HD22 LEU 62 HD22 LEU 62 101.618 -3.234 0.103 507 HD23 LEU 62 HD23 LEU 62 100.881 -1.738 0.725 508 H GLY 63 H GLY 63 96.547 0.048 1.825 509 HA2 GLY 63 HA3 GLY 63 94.080 0.160 0.313 510 HA3 GLY 63 HA2 GLY 63 94.587 1.343 1.541 511 H ASN 64 H ASN 64 96.854 0.851 -0.989 512 HA ASN 64 HA ASN 64 97.507 2.240 -2.782 513 HB2 ASN 64 HB2 ASN 64 95.036 1.662 -3.419 514 HB3 ASN 64 HB3 ASN 64 94.680 3.326 -2.898 515 HD21 ASN 64 HD21 ASN 64 96.536 1.370 -5.261 516 HD22 ASN 64 HD22 ASN 64 96.829 2.693 -6.366 517 H GLU 65 H GLU 65 96.554 3.347 0.185 518 HA GLU 65 HA GLU 65 97.012 6.236 -0.572 519 HB2 GLU 65 HB2 GLU 65 95.515 4.835 1.607 520 HB3 GLU 65 HB3 GLU 65 96.358 6.333 2.068 521 HG2 GLU 65 HG3 GLU 65 94.549 6.146 -0.373 522 HG3 GLU 65 HG2 GLU 65 93.950 6.617 1.235 523 H CYS 66 H CYS 66 98.840 3.677 0.097 524 HA CYS 66 HA CYS 66 100.567 5.092 2.127 525 HB2 CYS 66 HB2 CYS 66 99.839 2.664 2.483 526 HB3 CYS 66 HB3 CYS 66 100.858 2.244 1.086 527 HG CYS 66 HG CYS 66 102.277 1.768 3.580 528 H SER 67 H SER 67 102.668 5.700 1.600 529 HA SER 67 HA SER 67 103.279 6.277 -1.137 530 HB2 SER 67 HB2 SER 67 105.250 5.837 1.150 531 HB3 SER 67 HB3 SER 67 105.553 6.754 -0.345 532 HG SER 67 HG SER 67 104.932 8.119 1.425 533 H GLN 68 H GLN 68 104.617 5.237 -2.670 534 HA GLN 68 HA GLN 68 104.531 2.341 -2.646 535 HB2 GLN 68 HB2 GLN 68 104.695 3.851 -4.690 536 HB3 GLN 68 HB3 GLN 68 106.412 4.090 -4.286 537 HG2 GLN 68 HG3 GLN 68 106.544 2.277 -5.755 538 HG3 GLN 68 HG2 GLN 68 106.439 1.440 -4.188 539 HE21 GLN 68 HE21 GLN 68 104.126 0.812 -3.487 540 HE22 GLN 68 HE22 GLN 68 103.012 0.349 -4.753 541 H ASP 69 H ASP 69 106.871 4.684 -1.464 542 HA ASP 69 HA ASP 69 109.133 2.854 -1.331 543 HB2 ASP 69 HB3 ASP 69 108.692 5.118 0.631 544 HB3 ASP 69 HB2 ASP 69 110.211 4.549 -0.100 545 H GLU 70 H GLU 70 106.372 3.528 0.789 546 HA GLU 70 HA GLU 70 107.535 1.838 2.954 547 HB2 GLU 70 HB2 GLU 70 104.773 3.109 2.674 548 HB3 GLU 70 HB3 GLU 70 105.426 2.346 4.143 549 HG2 GLU 70 HG2 GLU 70 107.246 4.011 4.219 550 HG3 GLU 70 HG3 GLU 70 106.643 4.756 2.719 551 H SER 71 H SER 71 104.818 1.737 0.631 552 HA SER 71 HA SER 71 103.707 -0.766 1.397 553 HB2 SER 71 HB3 SER 71 102.764 0.769 -0.340 554 HB3 SER 71 HB2 SER 71 104.075 0.287 -1.443 555 HG SER 71 HG SER 71 102.956 -1.448 -1.883 556 H GLY 72 H GLY 72 106.345 -0.124 -0.968 557 HA2 GLY 72 HA2 GLY 72 106.849 -2.886 -1.589 558 HA3 GLY 72 HA3 GLY 72 108.044 -1.575 -1.735 559 H ALA 73 H ALA 73 108.356 -0.742 0.877 560 HA ALA 73 HA ALA 73 110.239 -2.520 1.966 561 HB1 ALA 73 HB1 ALA 73 109.864 -1.389 4.141 562 HB2 ALA 73 HB2 ALA 73 109.872 -0.214 2.805 563 HB3 ALA 73 HB3 ALA 73 108.330 -0.724 3.531 564 H ALA 74 H ALA 74 106.712 -2.426 2.620 565 HA ALA 74 HA ALA 74 106.751 -4.578 4.557 566 HB1 ALA 74 HB1 ALA 74 104.559 -3.697 2.624 567 HB2 ALA 74 HB2 ALA 74 104.322 -4.815 3.988 568 HB3 ALA 74 HB3 ALA 74 104.789 -3.125 4.294 569 H ALA 75 H ALA 75 105.887 -4.626 1.065 570 HA ALA 75 HA ALA 75 105.703 -7.479 0.856 571 HB1 ALA 75 HB1 ALA 75 106.096 -7.131 -1.569 572 HB2 ALA 75 HB2 ALA 75 106.660 -5.475 -1.241 573 HB3 ALA 75 HB3 ALA 75 104.964 -5.916 -0.928 574 H ILE 76 H ILE 76 108.449 -5.389 1.249 575 HA ILE 76 HA ILE 76 110.383 -7.365 0.176 576 HB ILE 76 HB ILE 76 110.728 -4.796 1.781 577 HG12 ILE 76 HG12 ILE 76 109.868 -4.940 -0.743 578 HG13 ILE 76 HG13 ILE 76 111.065 -3.718 -0.254 579 HG21 ILE 76 HG21 ILE 76 112.667 -6.075 2.263 580 HG22 ILE 76 HG22 ILE 76 113.147 -5.076 0.870 581 HG23 ILE 76 HG23 ILE 76 112.710 -6.785 0.631 582 HD11 ILE 76 HD11 ILE 76 111.571 -5.120 -2.384 583 HD12 ILE 76 HD12 ILE 76 112.870 -4.947 -1.180 584 HD13 ILE 76 HD13 ILE 76 111.921 -6.451 -1.255 585 H PHE 77 H PHE 77 109.815 -5.933 3.449 586 HA PHE 77 HA PHE 77 111.419 -7.933 4.795 587 HB2 PHE 77 HB2 PHE 77 109.185 -6.081 5.696 588 HB3 PHE 77 HB3 PHE 77 109.958 -7.225 6.819 589 HD1 PHE 77 HD1 PHE 77 110.191 -4.005 5.259 590 HD2 PHE 77 HD2 PHE 77 112.553 -7.172 6.943 591 HE1 PHE 77 HE1 PHE 77 112.089 -2.436 5.546 592 HE2 PHE 77 HE2 PHE 77 114.450 -5.602 7.236 593 HZ PHE 77 HZ PHE 77 114.219 -3.234 6.536 594 H THR 78 H THR 78 108.157 -7.896 3.556 595 HA THR 78 HA THR 78 107.232 -10.199 5.136 596 HB THR 78 HB THR 78 106.220 -8.755 2.659 597 HG1 THR 78 HG1 THR 78 105.754 -7.668 4.513 598 HG21 THR 78 HG21 THR 78 104.108 -10.297 3.388 599 HG22 THR 78 HG22 THR 78 105.274 -10.783 2.134 600 HG23 THR 78 HG23 THR 78 105.439 -11.408 3.792 601 H VAL 79 H VAL 79 108.270 -9.741 1.712 602 HA VAL 79 HA VAL 79 108.163 -12.628 1.186 603 HB VAL 79 HB VAL 79 109.616 -10.412 -0.328 604 HG11 VAL 79 HG11 VAL 79 110.386 -12.702 -0.888 605 HG12 VAL 79 HG12 VAL 79 109.456 -11.994 -2.231 606 HG13 VAL 79 HG13 VAL 79 108.700 -13.201 -1.164 607 HG21 VAL 79 HG21 VAL 79 106.997 -11.609 -1.195 608 HG22 VAL 79 HG22 VAL 79 106.971 -10.419 0.129 609 HG23 VAL 79 HG23 VAL 79 107.639 -9.970 -1.459 610 H GLN 80 H GLN 80 110.592 -10.384 2.408 611 HA GLN 80 HA GLN 80 112.865 -12.157 1.894 612 HB2 GLN 80 HB2 GLN 80 112.416 -9.785 3.739 613 HB3 GLN 80 HB3 GLN 80 113.952 -10.685 3.712 614 HG2 GLN 80 HG2 GLN 80 112.686 -9.608 1.169 615 HG3 GLN 80 HG3 GLN 80 113.769 -8.611 2.170 616 HE21 GLN 80 HE21 GLN 80 114.435 -9.449 -0.535 617 HE22 GLN 80 HE22 GLN 80 115.810 -10.525 -0.420 618 H LEU 81 H LEU 81 111.198 -11.300 4.998 619 HA LEU 81 HA LEU 81 112.487 -13.398 6.483 620 HB2 LEU 81 HB2 LEU 81 110.693 -11.387 7.091 621 HB3 LEU 81 HB3 LEU 81 109.682 -12.840 7.263 622 HG LEU 81 HG LEU 81 110.859 -12.179 9.391 623 HD11 LEU 81 HD11 LEU 81 110.502 -14.389 9.743 624 HD12 LEU 81 HD12 LEU 81 110.917 -14.797 8.062 625 HD13 LEU 81 HD13 LEU 81 112.203 -14.635 9.282 626 HD21 LEU 81 HD21 LEU 81 113.181 -12.103 9.584 627 HD22 LEU 81 HD22 LEU 81 113.437 -13.199 8.205 628 HD23 LEU 81 HD23 LEU 81 112.976 -11.503 7.921 629 H ASP 82 H ASP 82 109.330 -13.361 4.744 630 HA ASP 82 HA ASP 82 108.494 -15.988 5.339 631 HB2 ASP 82 HB3 ASP 82 107.068 -14.687 3.936 632 HB3 ASP 82 HB2 ASP 82 108.363 -14.404 2.748 633 H ASP 83 H ASP 83 110.869 -14.943 2.839 634 HA ASP 83 HA ASP 83 111.485 -17.629 1.964 635 HB2 ASP 83 HB2 ASP 83 112.237 -15.572 0.759 636 HB3 ASP 83 HB3 ASP 83 113.335 -15.201 2.110 637 H TYR 84 H TYR 84 112.361 -15.700 4.749 638 HA TYR 84 HA TYR 84 114.548 -17.455 5.628 639 HB2 TYR 84 HB2 TYR 84 114.106 -14.992 6.310 640 HB3 TYR 84 HB3 TYR 84 112.874 -15.651 7.412 641 HD1 TYR 84 HD1 TYR 84 113.566 -17.367 9.139 642 HD2 TYR 84 HD2 TYR 84 116.423 -15.139 6.833 643 HE1 TYR 84 HE1 TYR 84 115.337 -17.943 10.778 644 HE2 TYR 84 HE2 TYR 84 118.193 -15.711 8.470 645 HH TYR 84 HH TYR 84 118.566 -17.668 10.198 646 H LEU 85 H LEU 85 111.052 -17.446 5.836 647 HA LEU 85 HA LEU 85 111.018 -19.374 8.097 648 HB2 LEU 85 HB2 LEU 85 108.750 -18.576 6.224 649 HB3 LEU 85 HB3 LEU 85 108.605 -19.338 7.826 650 HG LEU 85 HG LEU 85 109.665 -16.549 7.204 651 HD11 LEU 85 HD11 LEU 85 107.197 -16.789 7.228 652 HD12 LEU 85 HD12 LEU 85 107.288 -17.553 8.833 653 HD13 LEU 85 HD13 LEU 85 107.762 -15.850 8.630 654 HD21 LEU 85 HD21 LEU 85 109.609 -16.565 9.869 655 HD22 LEU 85 HD22 LEU 85 111.037 -17.156 8.987 656 HD23 LEU 85 HD23 LEU 85 109.854 -18.313 9.640 657 H ASN 86 H ASN 86 110.064 -19.470 4.618 658 HA ASN 86 HA ASN 86 110.596 -22.450 4.755 659 HB2 ASN 86 HB2 ASN 86 108.150 -21.670 4.453 660 HB3 ASN 86 HB3 ASN 86 108.652 -21.120 2.837 661 HD21 ASN 86 HD21 ASN 86 110.446 -23.150 2.064 662 HD22 ASN 86 HD22 ASN 86 109.586 -24.670 1.971 663 H GLY 87 H GLY 87 110.624 -19.528 2.691 664 HA2 GLY 87 HA3 GLY 87 112.878 -19.285 1.461 665 HA3 GLY 87 HA2 GLY 87 112.629 -20.967 0.936 666 H ARG 88 H ARG 88 109.882 -20.923 0.357 667 HA ARG 88 HA ARG 88 109.849 -18.983 -1.965 668 HB2 ARG 88 HB3 ARG 88 108.353 -21.627 -1.684 669 HB3 ARG 88 HB2 ARG 88 108.456 -20.606 -3.138 670 HG2 ARG 88 HG2 ARG 88 110.776 -21.074 -3.434 671 HG3 ARG 88 HG3 ARG 88 110.937 -21.725 -1.785 672 HD2 ARG 88 HD3 ARG 88 109.296 -23.554 -2.463 673 HD3 ARG 88 HD2 ARG 88 109.450 -22.967 -4.136 674 HE ARG 88 HE ARG 88 111.608 -23.961 -4.248 675 HH11 ARG 88 HH11 ARG 88 113.300 -25.154 -3.340 676 HH12 ARG 88 HH12 ARG 88 113.361 -25.409 -1.611 677 HH21 ARG 88 HH21 ARG 88 110.435 -23.626 -0.988 678 HH22 ARG 88 HH22 ARG 88 111.744 -24.548 -0.284 679 H ALA 89 H ALA 89 107.161 -20.924 -0.687 680 HA ALA 89 HA ALA 89 105.150 -20.225 0.352 681 HB1 ALA 89 HB1 ALA 89 105.284 -18.535 1.899 682 HB2 ALA 89 HB2 ALA 89 106.034 -17.404 0.747 683 HB3 ALA 89 HB3 ALA 89 107.026 -18.643 1.551 684 H VAL 90 H VAL 90 103.227 -19.129 -0.310 685 HA VAL 90 HA VAL 90 103.350 -18.161 -3.104 686 HB VAL 90 HB VAL 90 100.878 -17.940 -1.390 687 HG11 VAL 90 HG11 VAL 90 100.843 -17.292 -3.783 688 HG12 VAL 90 HG12 VAL 90 99.828 -18.726 -3.494 689 HG13 VAL 90 HG13 VAL 90 101.439 -18.909 -4.229 690 HG21 VAL 90 HG21 VAL 90 100.535 -20.444 -2.026 691 HG22 VAL 90 HG22 VAL 90 102.303 -20.485 -2.227 692 HG23 VAL 90 HG23 VAL 90 101.596 -20.074 -0.646 693 H GLN 91 H GLN 91 102.723 -16.042 -3.813 694 HA GLN 91 HA GLN 91 102.827 -13.967 -1.606 695 HB2 GLN 91 HB3 GLN 91 104.122 -12.531 -3.048 696 HB3 GLN 91 HB2 GLN 91 104.908 -14.128 -3.071 697 HG2 GLN 91 HG2 GLN 91 103.500 -14.630 -5.160 698 HG3 GLN 91 HG3 GLN 91 103.104 -12.895 -5.188 699 HE21 GLN 91 HE21 GLN 91 105.208 -15.093 -6.538 700 HE22 GLN 91 HE22 GLN 91 106.577 -14.041 -6.820 701 H HIS 92 H HIS 92 101.139 -12.571 -1.574 702 HA HIS 92 HA HIS 92 99.448 -12.389 -4.083 703 HB2 HIS 92 HB2 HIS 92 98.587 -12.553 -1.164 704 HB3 HIS 92 HB3 HIS 92 97.499 -12.035 -2.474 705 HD2 HIS 92 HD2 HIS 92 99.880 -15.241 -2.074 706 HE1 HIS 92 HE1 HIS 92 96.163 -16.423 -3.696 707 H ARG 93 H ARG 93 99.160 -10.327 -4.802 708 HA ARG 93 HA ARG 93 100.041 -8.117 -2.937 709 HB2 ARG 93 HB2 ARG 93 101.356 -8.193 -4.977 710 HB3 ARG 93 HB3 ARG 93 99.886 -8.279 -5.978 711 HG2 ARG 93 HG2 ARG 93 99.245 -6.036 -5.377 712 HG3 ARG 93 HG3 ARG 93 100.486 -5.955 -4.103 713 HD2 ARG 93 HD2 ARG 93 100.892 -4.875 -6.524 714 HD3 ARG 93 HD3 ARG 93 102.216 -5.646 -5.618 715 HE ARG 93 HE ARG 93 102.274 -7.362 -7.257 716 HH11 ARG 93 HH11 ARG 93 101.486 -8.385 -9.113 717 HH12 ARG 93 HH12 ARG 93 99.919 -7.948 -9.755 718 HH21 ARG 93 HH21 ARG 93 99.289 -5.569 -7.294 719 HH22 ARG 93 HH22 ARG 93 98.680 -6.360 -8.730 720 H GLU 94 H GLU 94 98.512 -6.743 -2.190 721 HA GLU 94 HA GLU 94 95.878 -6.672 -3.684 722 HB2 GLU 94 HB2 GLU 94 96.541 -7.075 -0.835 723 HB3 GLU 94 HB3 GLU 94 95.338 -5.791 -1.100 724 HG2 GLU 94 HG2 GLU 94 94.350 -8.112 -0.825 725 HG3 GLU 94 HG3 GLU 94 93.903 -7.299 -2.345 726 H VAL 95 H VAL 95 96.147 -4.808 -4.897 727 HA VAL 95 HA VAL 95 97.211 -2.367 -3.502 728 HB VAL 95 HB VAL 95 96.330 -2.476 -6.396 729 HG11 VAL 95 HG11 VAL 95 97.013 -0.314 -5.390 730 HG12 VAL 95 HG12 VAL 95 98.564 -1.035 -4.898 731 HG13 VAL 95 HG13 VAL 95 98.181 -0.843 -6.625 732 HG21 VAL 95 HG21 VAL 95 98.849 -3.098 -6.775 733 HG22 VAL 95 HG22 VAL 95 98.770 -3.735 -5.115 734 HG23 VAL 95 HG23 VAL 95 97.700 -4.397 -6.375 735 H GLN 96 H GLN 96 94.642 -3.376 -2.676 736 HA GLN 96 HA GLN 96 92.415 -2.632 -2.390 737 HB2 GLN 96 HB2 GLN 96 93.988 -0.544 -1.839 738 HB3 GLN 96 HB3 GLN 96 93.224 0.124 -3.302 739 HG2 GLN 96 HG3 GLN 96 91.002 -0.787 -2.113 740 HG3 GLN 96 HG2 GLN 96 91.995 -0.587 -0.649 741 HE21 GLN 96 HE21 GLN 96 90.060 1.081 -2.992 742 HE22 GLN 96 HE22 GLN 96 90.462 2.706 -2.485 743 H GLY 97 H GLY 97 91.787 -3.888 -4.329 744 HA2 GLY 97 HA2 GLY 97 89.998 -2.715 -6.044 745 HA3 GLY 97 HA3 GLY 97 91.533 -2.349 -6.867 746 H PHE 98 H PHE 98 93.055 -4.443 -6.883 747 HA PHE 98 HA PHE 98 91.361 -6.566 -8.166 748 HB2 PHE 98 HB2 PHE 98 94.315 -5.871 -8.212 749 HB3 PHE 98 HB3 PHE 98 93.729 -7.444 -8.804 750 HD1 PHE 98 HD1 PHE 98 92.482 -7.621 -10.855 751 HD2 PHE 98 HD2 PHE 98 93.539 -3.764 -9.287 752 HE1 PHE 98 HE1 PHE 98 91.813 -6.566 -12.998 753 HE2 PHE 98 HE2 PHE 98 92.870 -2.709 -11.430 754 HZ PHE 98 HZ PHE 98 92.008 -4.111 -13.285 755 H GLU 99 H GLU 99 90.776 -6.843 -5.644 756 HA GLU 99 HA GLU 99 92.712 -8.268 -4.006 757 HB2 GLU 99 HB3 GLU 99 89.662 -8.263 -3.945 758 HB3 GLU 99 HB2 GLU 99 90.705 -8.937 -2.669 759 HG2 GLU 99 HG2 GLU 99 91.510 -6.827 -2.030 760 HG3 GLU 99 HG3 GLU 99 91.128 -6.092 -3.605 761 H SER 100 H SER 100 92.589 -10.582 -3.415 762 HA SER 100 HA SER 100 92.085 -12.219 -5.871 763 HB2 SER 100 HB2 SER 100 93.222 -13.158 -3.209 764 HB3 SER 100 HB3 SER 100 93.413 -13.912 -4.811 765 HG SER 100 HG SER 100 95.263 -12.657 -4.191 766 H ALA 101 H ALA 101 91.105 -14.478 -5.427 767 HA ALA 101 HA ALA 101 88.455 -14.051 -4.243 768 HB1 ALA 101 HB1 ALA 101 88.082 -16.433 -4.825 769 HB2 ALA 101 HB2 ALA 101 88.808 -15.548 -6.188 770 HB3 ALA 101 HB3 ALA 101 89.816 -16.617 -5.183 771 H THR 102 H THR 102 91.043 -16.430 -3.457 772 HA THR 102 HA THR 102 89.973 -17.353 -1.013 773 HB THR 102 HB THR 102 92.879 -16.803 -1.759 774 HG1 THR 102 HG1 THR 102 92.794 -19.087 -2.145 775 HG21 THR 102 HG21 THR 102 93.439 -18.376 0.073 776 HG22 THR 102 HG22 THR 102 92.602 -16.937 0.700 777 HG23 THR 102 HG23 THR 102 91.718 -18.471 0.518 778 H PHE 103 H PHE 103 92.091 -14.504 -1.531 779 HA PHE 103 HA PHE 103 92.244 -13.661 1.192 780 HB2 PHE 103 HB3 PHE 103 93.582 -12.575 -0.525 781 HB3 PHE 103 HB2 PHE 103 92.121 -12.023 -1.378 782 HD1 PHE 103 HD1 PHE 103 90.596 -10.354 -0.263 783 HD2 PHE 103 HD2 PHE 103 94.444 -11.377 1.349 784 HE1 PHE 103 HE1 PHE 103 90.550 -8.313 1.143 785 HE2 PHE 103 HE2 PHE 103 94.399 -9.332 2.751 786 HZ PHE 103 HZ PHE 103 92.453 -7.799 2.648 787 H LEU 104 H LEU 104 89.821 -12.765 -1.315 788 HA LEU 104 HA LEU 104 88.221 -11.146 0.482 789 HB2 LEU 104 HB3 LEU 104 87.805 -12.487 -2.181 790 HB3 LEU 104 HB2 LEU 104 86.371 -11.915 -1.296 791 HG LEU 104 HG LEU 104 88.746 -10.077 -1.560 792 HD11 LEU 104 HD11 LEU 104 88.359 -10.940 -3.852 793 HD12 LEU 104 HD12 LEU 104 86.630 -10.543 -3.709 794 HD13 LEU 104 HD13 LEU 104 87.845 -9.242 -3.714 795 HD21 LEU 104 HD21 LEU 104 86.797 -9.469 -0.149 796 HD22 LEU 104 HD22 LEU 104 86.934 -8.383 -1.552 797 HD23 LEU 104 HD23 LEU 104 85.718 -9.683 -1.548 798 H GLY 105 H GLY 105 88.680 -14.555 0.225 799 HA2 GLY 105 HA2 GLY 105 86.024 -15.232 1.368 800 HA3 GLY 105 HA3 GLY 105 87.358 -16.369 1.060 801 H TYR 106 H TYR 106 89.340 -14.698 2.503 802 HA TYR 106 HA TYR 106 88.694 -15.714 5.214 803 HB2 TYR 106 HB3 TYR 106 91.031 -15.547 3.894 804 HB3 TYR 106 HB2 TYR 106 91.080 -13.962 4.702 805 HD1 TYR 106 HD1 TYR 106 91.564 -17.508 5.088 806 HD2 TYR 106 HD2 TYR 106 90.649 -13.907 7.244 807 HE1 TYR 106 HE1 TYR 106 92.228 -18.610 7.207 808 HE2 TYR 106 HE2 TYR 106 91.315 -15.009 9.365 809 HH TYR 106 HH TYR 106 91.428 -17.956 9.974 810 H PHE 107 H PHE 107 88.919 -12.580 3.547 811 HA PHE 107 HA PHE 107 88.175 -11.242 6.151 812 HB2 PHE 107 HB2 PHE 107 89.359 -10.206 3.547 813 HB3 PHE 107 HB3 PHE 107 88.713 -9.121 4.802 814 HD1 PHE 107 HD1 PHE 107 91.399 -11.465 3.908 815 HD2 PHE 107 HD2 PHE 107 89.767 -9.009 7.029 816 HE1 PHE 107 HE1 PHE 107 93.516 -11.680 5.183 817 HE2 PHE 107 HE2 PHE 107 91.885 -9.218 8.303 818 HZ PHE 107 HZ PHE 107 93.760 -10.554 7.379 819 H LYS 108 H LYS 108 86.019 -11.019 6.406 820 HA LYS 108 HA LYS 108 84.343 -10.650 3.927 821 HB2 LYS 108 HB2 LYS 108 83.737 -12.527 5.454 822 HB3 LYS 108 HB3 LYS 108 83.508 -11.356 6.776 823 HG2 LYS 108 HG3 LYS 108 81.594 -10.425 5.799 824 HG3 LYS 108 HG2 LYS 108 82.057 -10.939 4.159 825 HD2 LYS 108 HD2 LYS 108 81.649 -13.310 4.804 826 HD3 LYS 108 HD3 LYS 108 81.143 -12.770 6.423 827 HE2 LYS 108 HE3 LYS 108 79.190 -11.740 5.610 828 HE3 LYS 108 HE2 LYS 108 79.831 -11.611 3.955 829 HZ1 LYS 108 HZ1 LYS 108 78.203 -13.371 4.144 830 HZ2 LYS 108 HZ2 LYS 108 79.088 -14.124 5.314 831 HZ3 LYS 108 HZ3 LYS 108 79.682 -14.004 3.780 832 H SER 109 H SER 109 85.701 -8.947 6.563 833 HA SER 109 HA SER 109 83.679 -7.061 7.239 834 HB2 SER 109 HB2 SER 109 85.521 -5.525 7.793 835 HB3 SER 109 HB3 SER 109 85.934 -7.179 8.306 836 HG SER 109 HG SER 109 87.657 -6.152 7.141 837 H GLY 110 H GLY 110 85.627 -7.352 4.306 838 HA2 GLY 110 HA3 GLY 110 85.029 -6.375 2.193 839 HA3 GLY 110 HA2 GLY 110 83.839 -5.343 3.021 840 H LEU 111 H LEU 111 87.310 -5.748 3.799 841 HA LEU 111 HA LEU 111 88.969 -4.091 4.010 842 HB2 LEU 111 HB2 LEU 111 87.520 -3.067 1.538 843 HB3 LEU 111 HB3 LEU 111 89.116 -2.507 2.087 844 HG LEU 111 HG LEU 111 89.450 -4.193 0.366 845 HD11 LEU 111 HD11 LEU 111 89.902 -5.491 3.088 846 HD12 LEU 111 HD12 LEU 111 90.797 -5.821 1.585 847 HD13 LEU 111 HD13 LEU 111 90.952 -4.238 2.384 848 HD21 LEU 111 HD21 LEU 111 88.277 -6.171 0.202 849 HD22 LEU 111 HD22 LEU 111 87.065 -5.230 1.104 850 HD23 LEU 111 HD23 LEU 111 88.138 -6.359 1.966 851 H LYS 112 H LYS 112 88.580 -2.989 5.849 852 HA LYS 112 HA LYS 112 86.438 -0.892 5.866 853 HB2 LYS 112 HB2 LYS 112 87.349 -2.683 7.793 854 HB3 LYS 112 HB3 LYS 112 88.130 -1.158 8.272 855 HG2 LYS 112 HG2 LYS 112 85.157 -1.435 7.652 856 HG3 LYS 112 HG3 LYS 112 85.844 -1.496 9.293 857 HD2 LYS 112 HD2 LYS 112 86.722 0.765 9.069 858 HD3 LYS 112 HD3 LYS 112 86.242 0.827 7.357 859 HE2 LYS 112 HE2 LYS 112 84.181 0.276 9.505 860 HE3 LYS 112 HE3 LYS 112 84.685 1.945 9.149 861 HZ1 LYS 112 HZ1 LYS 112 82.792 1.284 7.820 862 HZ2 LYS 112 HZ2 LYS 112 83.628 0.015 7.180 863 HZ3 LYS 112 HZ3 LYS 112 84.095 1.562 6.849 864 H TYR 113 H TYR 113 86.990 1.123 5.232 865 HA TYR 113 HA TYR 113 89.851 1.885 5.094 866 HB2 TYR 113 HB3 TYR 113 87.540 3.792 4.669 867 HB3 TYR 113 HB2 TYR 113 89.121 3.744 3.853 868 HD1 TYR 113 HD1 TYR 113 85.744 3.121 3.360 869 HD2 TYR 113 HD2 TYR 113 89.570 1.269 2.736 870 HE1 TYR 113 HE1 TYR 113 84.773 1.721 1.558 871 HE2 TYR 113 HE2 TYR 113 88.597 -0.133 0.936 872 HH TYR 113 HH TYR 113 85.370 -0.613 0.490 873 H LYS 114 H LYS 114 90.810 2.377 7.013 874 HA LYS 114 HA LYS 114 89.227 4.075 8.952 875 HB2 LYS 114 HB2 LYS 114 91.395 2.009 9.242 876 HB3 LYS 114 HB3 LYS 114 91.349 3.339 10.423 877 HG2 LYS 114 HG2 LYS 114 88.776 1.925 9.756 878 HG3 LYS 114 HG3 LYS 114 89.945 1.102 10.818 879 HD2 LYS 114 HD3 LYS 114 89.986 3.086 12.307 880 HD3 LYS 114 HD2 LYS 114 88.816 3.906 11.246 881 HE2 LYS 114 HE2 LYS 114 88.164 1.170 12.345 882 HE3 LYS 114 HE3 LYS 114 87.964 2.602 13.383 883 HZ1 LYS 114 HZ1 LYS 114 85.957 2.106 12.153 884 HZ2 LYS 114 HZ2 LYS 114 86.568 3.562 11.676 885 HZ3 LYS 114 HZ3 LYS 114 86.754 2.235 10.715 886 H LYS 115 H LYS 115 89.663 6.202 8.557 887 HA LYS 115 HA LYS 115 92.002 7.189 7.228 888 HB2 LYS 115 HB2 LYS 115 89.833 8.350 8.928 889 HB3 LYS 115 HB3 LYS 115 91.320 9.317 8.778 890 HG2 LYS 115 HG2 LYS 115 89.804 9.956 6.982 891 HG3 LYS 115 HG3 LYS 115 91.162 9.049 6.274 892 HD2 LYS 115 HD3 LYS 115 89.835 7.044 6.091 893 HD3 LYS 115 HD2 LYS 115 88.527 7.747 7.073 894 HE2 LYS 115 HE2 LYS 115 88.114 9.445 5.324 895 HE3 LYS 115 HE3 LYS 115 89.438 8.768 4.345 896 HZ1 LYS 115 HZ1 LYS 115 87.298 7.912 3.661 897 HZ2 LYS 115 HZ2 LYS 115 87.002 7.319 5.171 898 HZ3 LYS 115 HZ3 LYS 115 88.229 6.692 4.265 899 H GLY 116 H GLY 116 94.075 7.066 7.896 900 HA2 GLY 116 HA2 GLY 116 94.713 6.518 10.721 901 HA3 GLY 116 HA3 GLY 116 95.888 6.765 9.407 902 H GLY 117 H GLY 117 96.741 7.976 11.545 903 HA2 GLY 117 HA2 GLY 117 97.463 10.141 12.212 904 HA3 GLY 117 HA3 GLY 117 96.467 10.839 10.913 905 H VAL 118 H VAL 118 94.862 8.610 13.019 906 HA VAL 118 HA VAL 118 93.154 10.817 14.019 907 HB VAL 118 HB VAL 118 93.002 7.966 15.012 908 HG11 VAL 118 HG11 VAL 118 91.452 9.687 15.898 909 HG12 VAL 118 HG12 VAL 118 90.577 8.474 14.934 910 HG13 VAL 118 HG13 VAL 118 90.934 10.074 14.240 911 HG21 VAL 118 HG21 VAL 118 91.475 7.653 12.910 912 HG22 VAL 118 HG22 VAL 118 92.404 9.010 12.229 913 HG23 VAL 118 HG23 VAL 118 93.237 7.511 12.704 914 H ALA 119 H ALA 119 95.927 9.025 15.109 915 HA ALA 119 HA ALA 119 95.672 9.013 17.905 916 HB1 ALA 119 HB1 ALA 119 98.128 9.354 17.999 917 HB2 ALA 119 HB2 ALA 119 97.689 8.222 16.697 918 HB3 ALA 119 HB3 ALA 119 98.115 9.905 16.307 919 H SER 120 H SER 120 95.905 11.782 15.761 920 HA SER 120 HA SER 120 96.641 13.692 17.859 921 HB2 SER 120 HB2 SER 120 95.222 14.182 15.205 922 HB3 SER 120 HB3 SER 120 96.018 15.411 16.217 923 HG SER 120 HG SER 120 97.393 14.630 14.520 924 H GLY 121 H GLY 121 94.074 11.783 17.703 925 HA2 GLY 121 HA3 GLY 121 91.849 13.635 18.078 926 HA3 GLY 121 HA2 GLY 121 91.858 11.910 18.518 927 H PHE 122 H PHE 122 93.819 11.692 20.387 928 HA PHE 122 HA PHE 122 92.621 12.588 22.788 929 HB2 PHE 122 HB3 PHE 122 95.634 12.369 22.511 930 HB3 PHE 122 HB2 PHE 122 94.607 11.912 23.890 931 HD1 PHE 122 HD1 PHE 122 92.678 10.141 23.214 932 HD2 PHE 122 HD2 PHE 122 96.428 10.637 21.180 933 HE1 PHE 122 HE1 PHE 122 92.495 7.837 22.314 934 HE2 PHE 122 HE2 PHE 122 96.247 8.333 20.282 935 HZ PHE 122 HZ PHE 122 94.279 6.933 20.848 936 H LYS 123 H LYS 123 94.679 14.342 20.545 937 HA LYS 123 HA LYS 123 95.353 16.493 22.422 938 HB2 LYS 123 HB3 LYS 123 95.271 16.530 19.372 939 HB3 LYS 123 HB2 LYS 123 96.112 17.698 20.419 940 HG2 LYS 123 HG2 LYS 123 96.725 14.764 20.729 941 HG3 LYS 123 HG3 LYS 123 97.427 15.646 19.351 942 HD2 LYS 123 HD2 LYS 123 98.529 17.216 20.802 943 HD3 LYS 123 HD3 LYS 123 97.613 16.650 22.220 944 HE2 LYS 123 HE3 LYS 123 100.124 15.799 21.673 945 HE3 LYS 123 HE2 LYS 123 98.919 14.771 22.484 946 HZ1 LYS 123 HZ1 LYS 123 100.084 13.808 20.490 947 HZ2 LYS 123 HZ2 LYS 123 98.438 13.704 20.486 948 HZ3 LYS 123 HZ3 LYS 123 99.195 14.838 19.558 949 H HIS 124 H HIS 124 92.413 15.534 21.320 950 HA HIS 124 HA HIS 124 91.299 18.131 20.501 951 HB2 HIS 124 HB2 HIS 124 89.099 16.958 20.796 952 HB3 HIS 124 HB3 HIS 124 90.233 16.054 19.765 953 HD2 HIS 124 HD2 HIS 124 89.208 13.519 20.574 954 HE1 HIS 124 HE1 HIS 124 90.298 13.875 24.639 955 HE2 HIS 124 HE2 HIS 124 89.428 12.257 22.866 956 H VAL 125 H VAL 125 89.454 19.131 21.801 957 HA VAL 125 HA VAL 125 90.329 19.245 24.687 958 HB VAL 125 HB VAL 125 88.601 21.175 23.075 959 HG11 VAL 125 HG11 VAL 125 88.152 21.200 25.514 960 HG12 VAL 125 HG12 VAL 125 88.985 22.687 25.002 961 HG13 VAL 125 HG13 VAL 125 89.892 21.400 25.832 962 HG21 VAL 125 HG21 VAL 125 90.616 22.620 23.114 963 HG22 VAL 125 HG22 VAL 125 90.947 21.084 22.277 964 HG23 VAL 125 HG23 VAL 125 91.523 21.332 23.943 965 H VAL 126 H VAL 126 89.070 18.188 26.128 966 HA VAL 126 HA VAL 126 86.309 17.386 25.282 967 HB VAL 126 HB VAL 126 87.622 16.721 27.933 968 HG11 VAL 126 HG11 VAL 126 85.249 16.101 27.558 969 HG12 VAL 126 HG12 VAL 126 86.281 14.654 27.653 970 HG13 VAL 126 HG13 VAL 126 85.711 15.238 26.071 971 HG21 VAL 126 HG21 VAL 126 88.380 14.594 26.586 972 HG22 VAL 126 HG22 VAL 126 88.253 15.662 25.167 973 HG23 VAL 126 HG23 VAL 126 89.368 16.071 26.493 974 HA PRO 127 HA PRO 127 84.974 20.939 27.755 975 HB2 PRO 127 HB2 PRO 127 82.398 21.008 26.823 976 HB3 PRO 127 HB3 PRO 127 83.784 21.627 25.880 977 HG2 PRO 127 HG2 PRO 127 82.277 19.063 25.601 978 HG3 PRO 127 HG3 PRO 127 82.996 20.111 24.349 979 HD2 PRO 127 HD3 PRO 127 84.146 17.749 25.335 980 HD3 PRO 127 HD2 PRO 127 85.037 19.041 24.476 981 H ASN 128 H ASN 128 84.371 20.773 29.862 982 HA ASN 128 HA ASN 128 81.941 19.437 30.710 983 HB2 ASN 128 HB2 ASN 128 84.497 17.858 30.760 984 HB3 ASN 128 HB3 ASN 128 83.417 17.722 32.168 985 HD21 ASN 128 HD21 ASN 128 84.092 16.182 29.321 986 HD22 ASN 128 HD22 ASN 128 82.501 15.567 28.933 987 H GLU 129 H GLU 129 82.418 21.860 31.385 988 HA GLU 129 HA GLU 129 84.257 22.250 33.629 989 HB2 GLU 129 HB2 GLU 129 82.988 24.400 33.930 990 HB3 GLU 129 HB3 GLU 129 83.554 24.152 32.261 991 HG2 GLU 129 HG2 GLU 129 81.329 23.313 31.610 992 HG3 GLU 129 HG3 GLU 129 80.756 23.492 33.286 993 H VAL 130 H VAL 130 81.110 20.854 33.317 994 HA VAL 130 HA VAL 130 79.896 21.475 35.808 995 HB VAL 130 HB VAL 130 78.970 20.011 33.926 996 HG11 VAL 130 HG11 VAL 130 79.515 17.675 33.894 997 HG12 VAL 130 HG12 VAL 130 80.423 17.795 35.420 998 HG13 VAL 130 HG13 VAL 130 81.072 18.536 33.937 999 HG21 VAL 130 HG21 VAL 130 77.645 18.615 35.491 1000 HG22 VAL 130 HG22 VAL 130 78.825 18.943 36.782 1001 HG23 VAL 130 HG23 VAL 130 77.840 20.269 36.119 1002 H VAL 131 H VAL 131 82.768 19.598 35.142 1003 HA VAL 131 HA VAL 131 82.790 18.076 37.625 1004 HB VAL 131 HB VAL 131 85.184 19.032 35.996 1005 HG11 VAL 131 HG11 VAL 131 85.704 18.047 38.212 1006 HG12 VAL 131 HG12 VAL 131 86.219 16.966 36.894 1007 HG13 VAL 131 HG13 VAL 131 84.729 16.614 37.803 1008 HG21 VAL 131 HG21 VAL 131 83.497 17.931 34.547 1009 HG22 VAL 131 HG22 VAL 131 83.441 16.547 35.664 1010 HG23 VAL 131 HG23 VAL 131 84.931 16.898 34.756 1011 H VAL 132 H VAL 132 83.628 21.382 36.776 1012 HA VAL 132 HA VAL 132 85.254 21.870 39.170 1013 HB VAL 132 HB VAL 132 83.734 23.836 37.399 1014 HG11 VAL 132 HG11 VAL 132 84.412 24.763 39.597 1015 HG12 VAL 132 HG12 VAL 132 86.079 24.202 39.318 1016 HG13 VAL 132 HG13 VAL 132 85.380 25.468 38.279 1017 HG21 VAL 132 HG21 VAL 132 85.337 22.430 36.131 1018 HG22 VAL 132 HG22 VAL 132 86.618 22.842 37.296 1019 HG23 VAL 132 HG23 VAL 132 85.920 24.107 36.258 1020 H GLN 133 H GLN 133 81.816 21.916 38.409 1021 HA GLN 133 HA GLN 133 81.116 21.987 41.234 1022 HB2 GLN 133 HB2 GLN 133 81.779 24.416 40.783 1023 HB3 GLN 133 HB3 GLN 133 80.383 24.503 39.683 1024 HG2 GLN 133 HG2 GLN 133 78.846 23.971 41.488 1025 HG3 GLN 133 HG3 GLN 133 80.195 23.640 42.602 1026 HE21 GLN 133 HE21 GLN 133 81.443 26.139 40.921 1027 HE22 GLN 133 HE22 GLN 133 80.827 27.487 41.850 Start of MODEL 19 1 H1 GLU 1 H1 GLU 1 109.551 -7.583 23.059 2 H2 GLU 1 H2 GLU 1 108.255 -8.500 23.505 3 H3 GLU 1 H3 GLU 1 109.680 -8.631 24.326 4 HA GLU 1 HA GLU 1 110.640 -9.268 22.015 5 HB2 GLU 1 HB3 GLU 1 110.083 -11.674 22.566 6 HB3 GLU 1 HB2 GLU 1 110.748 -10.754 23.937 7 HG2 GLU 1 HG2 GLU 1 108.610 -10.520 24.960 8 HG3 GLU 1 HG3 GLU 1 107.754 -10.974 23.467 9 H HIS 2 H HIS 2 110.022 -10.236 20.036 10 HA HIS 2 HA HIS 2 107.067 -10.540 19.564 11 HB2 HIS 2 HB3 HIS 2 107.600 -9.332 17.270 12 HB3 HIS 2 HB2 HIS 2 107.255 -8.363 18.723 13 HD2 HIS 2 HD2 HIS 2 109.033 -6.279 17.910 14 HE1 HIS 2 HE1 HIS 2 112.553 -8.605 18.127 15 HE2 HIS 2 HE2 HIS 2 111.659 -6.228 17.858 16 HA PRO 3 HA PRO 3 109.976 -13.912 17.910 17 HB2 PRO 3 HB3 PRO 3 107.565 -15.460 18.820 18 HB3 PRO 3 HB2 PRO 3 109.300 -15.839 19.024 19 HG2 PRO 3 HG2 PRO 3 107.786 -14.928 21.051 20 HG3 PRO 3 HG3 PRO 3 109.506 -14.485 20.877 21 HD2 PRO 3 HD3 PRO 3 107.050 -12.837 20.355 22 HD3 PRO 3 HD2 PRO 3 108.672 -12.315 20.902 23 H GLU 4 H GLU 4 106.541 -13.117 17.510 24 HA GLU 4 HA GLU 4 105.963 -14.772 15.246 25 HB2 GLU 4 HB2 GLU 4 104.296 -12.960 14.656 26 HB3 GLU 4 HB3 GLU 4 104.198 -13.511 16.346 27 HG2 GLU 4 HG2 GLU 4 105.558 -11.582 17.069 28 HG3 GLU 4 HG3 GLU 4 105.708 -11.041 15.380 29 H PHE 5 H PHE 5 107.835 -11.793 15.526 30 HA PHE 5 HA PHE 5 107.867 -11.155 12.689 31 HB2 PHE 5 HB2 PHE 5 108.561 -9.430 14.180 32 HB3 PHE 5 HB3 PHE 5 109.707 -10.503 15.018 33 HD1 PHE 5 HD1 PHE 5 111.723 -11.377 13.720 34 HD2 PHE 5 HD2 PHE 5 109.233 -8.187 12.277 35 HE1 PHE 5 HE1 PHE 5 113.518 -10.684 12.156 36 HE2 PHE 5 HE2 PHE 5 111.030 -7.494 10.712 37 HZ PHE 5 HZ PHE 5 113.171 -8.743 10.651 38 H LEU 6 H LEU 6 110.050 -13.063 14.791 39 HA LEU 6 HA LEU 6 111.665 -13.828 12.398 40 HB2 LEU 6 HB2 LEU 6 112.584 -13.330 14.782 41 HB3 LEU 6 HB3 LEU 6 111.974 -14.949 15.200 42 HG LEU 6 HG LEU 6 113.259 -15.667 12.994 43 HD11 LEU 6 HD11 LEU 6 113.836 -13.347 12.328 44 HD12 LEU 6 HD12 LEU 6 115.302 -14.305 12.643 45 HD13 LEU 6 HD13 LEU 6 114.728 -13.132 13.853 46 HD21 LEU 6 HD21 LEU 6 115.273 -16.106 14.376 47 HD22 LEU 6 HD22 LEU 6 114.698 -14.933 15.585 48 HD23 LEU 6 HD23 LEU 6 113.784 -16.433 15.294 49 H LYS 7 H LYS 7 108.989 -15.003 14.267 50 HA LYS 7 HA LYS 7 109.370 -17.750 13.058 51 HB2 LYS 7 HB3 LYS 7 107.542 -16.859 15.333 52 HB3 LYS 7 HB2 LYS 7 107.777 -18.530 14.766 53 HG2 LYS 7 HG2 LYS 7 110.333 -18.007 15.214 54 HG3 LYS 7 HG3 LYS 7 109.681 -16.736 16.275 55 HD2 LYS 7 HD2 LYS 7 108.300 -18.447 17.448 56 HD3 LYS 7 HD3 LYS 7 109.004 -19.709 16.409 57 HE2 LYS 7 HE2 LYS 7 110.395 -17.991 18.495 58 HE3 LYS 7 HE3 LYS 7 110.307 -19.767 18.408 59 HZ1 LYS 7 HZ1 LYS 7 112.371 -19.323 17.560 60 HZ2 LYS 7 HZ2 LYS 7 111.486 -19.385 16.169 61 HZ3 LYS 7 HZ3 LYS 7 111.918 -17.927 16.806 62 H ALA 8 H ALA 8 106.657 -15.554 13.944 63 HA ALA 8 HA ALA 8 104.651 -15.114 12.776 64 HB1 ALA 8 HB1 ALA 8 106.706 -15.494 10.607 65 HB2 ALA 8 HB2 ALA 8 104.991 -15.408 10.139 66 HB3 ALA 8 HB3 ALA 8 105.743 -14.054 11.017 67 H GLY 9 H GLY 9 102.826 -16.328 12.448 68 HA2 GLY 9 HA2 GLY 9 101.530 -18.289 12.178 69 HA3 GLY 9 HA3 GLY 9 102.662 -18.709 10.870 70 H LYS 10 H LYS 10 103.250 -18.314 14.387 71 HA LYS 10 HA LYS 10 105.091 -20.383 14.723 72 HB2 LYS 10 HB2 LYS 10 102.776 -19.824 16.631 73 HB3 LYS 10 HB3 LYS 10 104.344 -20.555 17.048 74 HG2 LYS 10 HG3 LYS 10 105.522 -18.507 16.539 75 HG3 LYS 10 HG2 LYS 10 104.064 -17.780 15.822 76 HD2 LYS 10 HD2 LYS 10 103.041 -17.453 17.902 77 HD3 LYS 10 HD3 LYS 10 103.991 -18.738 18.686 78 HE2 LYS 10 HE2 LYS 10 104.813 -16.568 19.457 79 HE3 LYS 10 HE3 LYS 10 106.046 -17.310 18.409 80 HZ1 LYS 10 HZ1 LYS 10 104.072 -15.614 17.132 81 HZ2 LYS 10 HZ2 LYS 10 105.677 -15.796 16.800 82 HZ3 LYS 10 HZ3 LYS 10 105.199 -14.854 18.067 83 H GLU 11 H GLU 11 101.704 -20.690 13.939 84 HA GLU 11 HA GLU 11 102.094 -23.635 13.671 85 HB2 GLU 11 HB3 GLU 11 100.192 -22.343 15.646 86 HB3 GLU 11 HB2 GLU 11 99.795 -23.914 14.908 87 HG2 GLU 11 HG3 GLU 11 102.069 -24.746 15.657 88 HG3 GLU 11 HG2 GLU 11 102.266 -23.221 16.553 89 HA PRO 12 HA PRO 12 99.682 -23.324 10.001 90 HB2 PRO 12 HB2 PRO 12 97.773 -25.244 11.343 91 HB3 PRO 12 HB3 PRO 12 98.494 -25.312 9.709 92 HG2 PRO 12 HG2 PRO 12 99.401 -26.803 11.784 93 HG3 PRO 12 HG3 PRO 12 100.449 -26.224 10.462 94 HD2 PRO 12 HD3 PRO 12 100.374 -25.379 13.301 95 HD3 PRO 12 HD2 PRO 12 101.657 -25.123 12.080 96 H GLY 13 H GLY 13 98.450 -21.540 9.601 97 HA2 GLY 13 HA3 GLY 13 95.759 -21.180 10.169 98 HA3 GLY 13 HA2 GLY 13 96.544 -20.566 11.644 99 H LEU 14 H LEU 14 95.572 -18.464 10.960 100 HA LEU 14 HA LEU 14 97.363 -17.125 8.919 101 HB2 LEU 14 HB2 LEU 14 95.197 -17.286 7.888 102 HB3 LEU 14 HB3 LEU 14 94.371 -16.805 9.389 103 HG LEU 14 HG LEU 14 96.396 -14.858 8.424 104 HD11 LEU 14 HD11 LEU 14 95.477 -15.637 6.255 105 HD12 LEU 14 HD12 LEU 14 93.825 -15.353 6.854 106 HD13 LEU 14 HD13 LEU 14 94.936 -13.982 6.623 107 HD21 LEU 14 HD21 LEU 14 94.841 -14.437 10.313 108 HD22 LEU 14 HD22 LEU 14 94.566 -13.282 8.987 109 HD23 LEU 14 HD23 LEU 14 93.454 -14.653 9.218 110 H GLN 15 H GLN 15 98.129 -15.079 9.486 111 HA GLN 15 HA GLN 15 97.172 -13.966 12.121 112 HB2 GLN 15 HB3 GLN 15 100.086 -14.395 11.321 113 HB3 GLN 15 HB2 GLN 15 99.532 -13.539 12.780 114 HG2 GLN 15 HG2 GLN 15 98.155 -15.798 13.157 115 HG3 GLN 15 HG3 GLN 15 99.439 -16.478 12.130 116 HE21 GLN 15 HE21 GLN 15 101.549 -16.712 13.027 117 HE22 GLN 15 HE22 GLN 15 101.926 -16.277 14.679 118 H ILE 16 H ILE 16 97.650 -11.660 12.359 119 HA ILE 16 HA ILE 16 98.293 -10.340 9.709 120 HB ILE 16 HB ILE 16 96.447 -8.961 11.623 121 HG12 ILE 16 HG13 ILE 16 95.722 -11.438 10.010 122 HG13 ILE 16 HG12 ILE 16 95.465 -11.151 11.747 123 HG21 ILE 16 HG21 ILE 16 97.331 -8.275 9.218 124 HG22 ILE 16 HG22 ILE 16 96.037 -9.361 8.659 125 HG23 ILE 16 HG23 ILE 16 95.641 -7.953 9.673 126 HD11 ILE 16 HD11 ILE 16 93.336 -10.694 10.896 127 HD12 ILE 16 HD12 ILE 16 93.976 -10.017 9.380 128 HD13 ILE 16 HD13 ILE 16 94.066 -9.071 10.885 129 H TRP 17 H TRP 17 99.732 -8.650 9.815 130 HA TRP 17 HA TRP 17 100.350 -7.491 12.520 131 HB2 TRP 17 HB2 TRP 17 102.514 -8.498 10.623 132 HB3 TRP 17 HB3 TRP 17 102.739 -7.827 12.256 133 HD1 TRP 17 HD1 TRP 17 100.815 -9.314 14.019 134 HE1 TRP 17 HE1 TRP 17 100.892 -11.864 14.393 135 HE3 TRP 17 HE3 TRP 17 103.370 -10.676 9.813 136 HZ2 TRP 17 HZ2 TRP 17 101.937 -14.180 13.031 137 HZ3 TRP 17 HZ3 TRP 17 103.895 -13.057 9.377 138 HH2 TRP 17 HH2 TRP 17 103.180 -14.810 10.977 139 H ARG 18 H ARG 18 99.941 -5.357 12.162 140 HA ARG 18 HA ARG 18 100.212 -4.178 9.485 141 HB2 ARG 18 HB3 ARG 18 99.345 -2.216 10.441 142 HB3 ARG 18 HB2 ARG 18 98.656 -3.479 11.488 143 HG2 ARG 18 HG2 ARG 18 100.910 -3.102 12.859 144 HG3 ARG 18 HG3 ARG 18 100.866 -1.512 12.059 145 HD2 ARG 18 HD2 ARG 18 98.427 -1.346 12.853 146 HD3 ARG 18 HD3 ARG 18 98.775 -2.753 13.887 147 HE ARG 18 HE ARG 18 100.850 -0.941 14.458 148 HH11 ARG 18 HH11 ARG 18 100.661 0.564 16.133 149 HH12 ARG 18 HH12 ARG 18 99.078 1.071 16.680 150 HH21 ARG 18 HH21 ARG 18 97.368 -0.947 14.413 151 HH22 ARG 18 HH22 ARG 18 97.222 0.219 15.709 152 H VAL 19 H VAL 19 101.821 -2.726 8.745 153 HA VAL 19 HA VAL 19 104.462 -3.133 10.021 154 HB VAL 19 HB VAL 19 104.032 -1.114 7.830 155 HG11 VAL 19 HG11 VAL 19 106.285 -1.562 8.769 156 HG12 VAL 19 HG12 VAL 19 106.183 -2.072 7.067 157 HG13 VAL 19 HG13 VAL 19 106.107 -3.286 8.367 158 HG21 VAL 19 HG21 VAL 19 104.254 -3.151 6.229 159 HG22 VAL 19 HG22 VAL 19 103.676 -4.122 7.604 160 HG23 VAL 19 HG23 VAL 19 102.653 -2.829 6.935 161 H GLU 20 H GLU 20 105.696 -1.579 11.064 162 HA GLU 20 HA GLU 20 104.703 1.201 11.305 163 HB2 GLU 20 HB2 GLU 20 103.324 -0.149 12.970 164 HB3 GLU 20 HB3 GLU 20 104.846 -0.516 13.818 165 HG2 GLU 20 HG3 GLU 20 104.095 1.401 14.955 166 HG3 GLU 20 HG2 GLU 20 105.203 2.093 13.745 167 H LYS 21 H LYS 21 106.640 2.180 10.927 168 HA LYS 21 HA LYS 21 108.997 2.516 11.018 169 HB2 LYS 21 HB3 LYS 21 107.986 2.257 13.847 170 HB3 LYS 21 HB2 LYS 21 109.736 2.425 13.570 171 HG2 LYS 21 HG2 LYS 21 109.416 4.510 12.372 172 HG3 LYS 21 HG3 LYS 21 107.648 4.304 12.385 173 HD2 LYS 21 HD2 LYS 21 107.512 4.667 14.734 174 HD3 LYS 21 HD3 LYS 21 109.261 4.420 14.957 175 HE2 LYS 21 HE2 LYS 21 108.189 6.880 14.870 176 HE3 LYS 21 HE3 LYS 21 109.798 6.540 14.188 177 HZ1 LYS 21 HZ1 LYS 21 108.137 7.741 12.729 178 HZ2 LYS 21 HZ2 LYS 21 107.357 6.297 12.570 179 HZ3 LYS 21 HZ3 LYS 21 108.917 6.453 12.056 180 H PHE 22 H PHE 22 108.358 -0.165 10.306 181 HA PHE 22 HA PHE 22 109.374 -2.299 10.227 182 HB2 PHE 22 HB2 PHE 22 111.823 -1.125 11.553 183 HB3 PHE 22 HB3 PHE 22 111.719 -2.310 10.230 184 HD1 PHE 22 HD1 PHE 22 112.024 1.181 11.086 185 HD2 PHE 22 HD2 PHE 22 110.799 -1.510 7.971 186 HE1 PHE 22 HE1 PHE 22 112.210 3.015 9.430 187 HE2 PHE 22 HE2 PHE 22 110.986 0.324 6.313 188 HZ PHE 22 HZ PHE 22 111.691 2.588 7.043 189 H ASP 23 H ASP 23 107.729 -1.906 12.442 190 HA ASP 23 HA ASP 23 109.270 -3.418 14.568 191 HB2 ASP 23 HB2 ASP 23 108.666 -1.018 15.190 192 HB3 ASP 23 HB3 ASP 23 106.957 -1.504 15.084 193 H LEU 24 H LEU 24 106.488 -3.158 12.513 194 HA LEU 24 HA LEU 24 104.650 -4.608 12.214 195 HB2 LEU 24 HB2 LEU 24 106.787 -6.366 13.406 196 HB3 LEU 24 HB3 LEU 24 105.138 -7.018 13.250 197 HG LEU 24 HG LEU 24 105.181 -6.276 10.817 198 HD11 LEU 24 HD11 LEU 24 107.715 -6.122 10.030 199 HD12 LEU 24 HD12 LEU 24 106.864 -4.671 10.611 200 HD13 LEU 24 HD13 LEU 24 107.974 -5.546 11.694 201 HD21 LEU 24 HD21 LEU 24 106.599 -8.180 10.094 202 HD22 LEU 24 HD22 LEU 24 107.329 -8.251 11.716 203 HD23 LEU 24 HD23 LEU 24 105.601 -8.623 11.500 204 H VAL 25 H VAL 25 102.756 -4.425 13.282 205 HA VAL 25 HA VAL 25 102.720 -5.093 16.221 206 HB VAL 25 HB VAL 25 101.572 -2.566 14.946 207 HG11 VAL 25 HG11 VAL 25 100.062 -3.530 16.662 208 HG12 VAL 25 HG12 VAL 25 100.819 -2.030 17.247 209 HG13 VAL 25 HG13 VAL 25 101.418 -3.608 17.811 210 HG21 VAL 25 HG21 VAL 25 104.012 -2.486 15.388 211 HG22 VAL 25 HG22 VAL 25 103.724 -2.999 17.068 212 HG23 VAL 25 HG23 VAL 25 103.125 -1.421 16.504 213 HA PRO 26 HA PRO 26 99.392 -7.689 14.688 214 HB2 PRO 26 HB2 PRO 26 98.415 -7.184 17.500 215 HB3 PRO 26 HB3 PRO 26 98.553 -8.723 16.602 216 HG2 PRO 26 HG3 PRO 26 100.334 -7.979 18.483 217 HG3 PRO 26 HG2 PRO 26 100.791 -8.942 17.052 218 HD2 PRO 26 HD2 PRO 26 101.414 -6.096 17.695 219 HD3 PRO 26 HD3 PRO 26 102.242 -7.220 16.576 220 H VAL 27 H VAL 27 97.399 -7.260 13.787 221 HA VAL 27 HA VAL 27 96.432 -4.510 13.794 222 HB VAL 27 HB VAL 27 95.421 -7.155 12.723 223 HG11 VAL 27 HG11 VAL 27 93.576 -5.641 11.644 224 HG12 VAL 27 HG12 VAL 27 93.892 -4.557 13.020 225 HG13 VAL 27 HG13 VAL 27 93.335 -6.223 13.309 226 HG21 VAL 27 HG21 VAL 27 97.174 -5.896 11.501 227 HG22 VAL 27 HG22 VAL 27 95.654 -5.945 10.576 228 HG23 VAL 27 HG23 VAL 27 96.113 -4.467 11.456 229 HA PRO 28 HA PRO 28 94.296 -4.403 17.719 230 HB2 PRO 28 HB2 PRO 28 92.313 -2.872 16.023 231 HB3 PRO 28 HB3 PRO 28 92.980 -2.472 17.632 232 HG2 PRO 28 HG2 PRO 28 93.875 -1.310 15.366 233 HG3 PRO 28 HG3 PRO 28 94.930 -1.633 16.768 234 HD2 PRO 28 HD3 PRO 28 94.887 -2.948 14.101 235 HD3 PRO 28 HD2 PRO 28 96.194 -2.909 15.322 236 H THR 29 H THR 29 93.529 -6.510 18.040 237 HA THR 29 HA THR 29 91.709 -7.958 16.435 238 HB THR 29 HB THR 29 91.414 -8.040 19.440 239 HG1 THR 29 HG1 THR 29 93.610 -7.868 19.261 240 HG21 THR 29 HG21 THR 29 91.390 -10.477 18.983 241 HG22 THR 29 HG22 THR 29 91.701 -10.156 17.260 242 HG23 THR 29 HG23 THR 29 90.170 -9.630 18.001 243 H ASN 30 H ASN 30 91.092 -5.240 18.586 244 HA ASN 30 HA ASN 30 88.341 -5.471 19.107 245 HB2 ASN 30 HB2 ASN 30 90.255 -3.391 19.122 246 HB3 ASN 30 HB3 ASN 30 88.936 -2.797 18.086 247 HD21 ASN 30 HD21 ASN 30 89.882 -3.520 21.383 248 HD22 ASN 30 HD22 ASN 30 88.349 -3.108 22.120 249 H LEU 31 H LEU 31 89.906 -4.452 16.053 250 HA LEU 31 HA LEU 31 87.186 -4.461 14.761 251 HB2 LEU 31 HB2 LEU 31 89.868 -3.525 13.647 252 HB3 LEU 31 HB3 LEU 31 88.268 -3.284 12.906 253 HG LEU 31 HG LEU 31 88.802 -2.309 15.722 254 HD11 LEU 31 HD11 LEU 31 90.628 -1.397 14.312 255 HD12 LEU 31 HD12 LEU 31 89.428 -0.818 13.132 256 HD13 LEU 31 HD13 LEU 31 89.475 -0.120 14.769 257 HD21 LEU 31 HD21 LEU 31 86.486 -2.336 14.833 258 HD22 LEU 31 HD22 LEU 31 87.060 -0.668 15.073 259 HD23 LEU 31 HD23 LEU 31 87.012 -1.365 13.436 260 H TYR 32 H TYR 32 90.534 -5.626 14.144 261 HA TYR 32 HA TYR 32 91.252 -7.493 12.882 262 HB2 TYR 32 HB3 TYR 32 89.895 -8.497 14.877 263 HB3 TYR 32 HB2 TYR 32 88.642 -8.825 13.656 264 HD1 TYR 32 HD1 TYR 32 88.799 -10.734 12.297 265 HD2 TYR 32 HD2 TYR 32 92.304 -9.305 14.328 266 HE1 TYR 32 HE1 TYR 32 90.052 -12.740 11.549 267 HE2 TYR 32 HE2 TYR 32 93.555 -11.310 13.582 268 HH TYR 32 HH TYR 32 92.151 -14.060 12.442 269 H GLY 33 H GLY 33 91.084 -6.579 10.787 270 HA2 GLY 33 HA2 GLY 33 90.146 -7.550 8.607 271 HA3 GLY 33 HA3 GLY 33 88.534 -7.315 9.325 272 H ASP 34 H ASP 34 89.624 -4.737 10.612 273 HA ASP 34 HA ASP 34 89.031 -3.042 8.214 274 HB2 ASP 34 HB3 ASP 34 89.409 -2.228 11.129 275 HB3 ASP 34 HB2 ASP 34 88.723 -1.231 9.824 276 H PHE 35 H PHE 35 90.454 -1.393 7.485 277 HA PHE 35 HA PHE 35 93.159 -1.288 8.779 278 HB2 PHE 35 HB2 PHE 35 92.966 -1.670 5.780 279 HB3 PHE 35 HB3 PHE 35 94.366 -1.914 6.851 280 HD1 PHE 35 HD1 PHE 35 91.751 -3.538 5.102 281 HD2 PHE 35 HD2 PHE 35 94.002 -3.732 8.753 282 HE1 PHE 35 HE1 PHE 35 91.146 -5.930 5.346 283 HE2 PHE 35 HE2 PHE 35 93.402 -6.126 8.996 284 HZ PHE 35 HZ PHE 35 91.970 -7.224 7.296 285 H PHE 36 H PHE 36 94.316 0.640 8.271 286 HA PHE 36 HA PHE 36 92.528 2.843 7.348 287 HB2 PHE 36 HB2 PHE 36 95.425 2.938 8.301 288 HB3 PHE 36 HB3 PHE 36 94.321 4.322 8.120 289 HD1 PHE 36 HD1 PHE 36 95.174 1.360 10.138 290 HD2 PHE 36 HD2 PHE 36 92.438 4.637 9.665 291 HE1 PHE 36 HE1 PHE 36 94.317 0.974 12.433 292 HE2 PHE 36 HE2 PHE 36 91.573 4.245 11.956 293 HZ PHE 36 HZ PHE 36 92.515 2.416 13.341 294 H THR 37 H THR 37 92.374 3.083 5.165 295 HA THR 37 HA THR 37 94.335 2.117 3.293 296 HB THR 37 HB THR 37 93.093 3.276 1.616 297 HG1 THR 37 HG1 THR 37 91.469 4.909 2.680 298 HG21 THR 37 HG21 THR 37 90.920 2.495 2.024 299 HG22 THR 37 HG22 THR 37 90.960 2.980 3.736 300 HG23 THR 37 HG23 THR 37 91.870 1.549 3.195 301 H GLY 38 H GLY 38 96.379 2.826 4.089 302 HA2 GLY 38 HA2 GLY 38 97.380 5.221 2.861 303 HA3 GLY 38 HA3 GLY 38 97.060 5.582 4.575 304 H ASP 39 H ASP 39 97.595 2.773 5.386 305 HA ASP 39 HA ASP 39 100.608 2.917 5.194 306 HB2 ASP 39 HB2 ASP 39 99.296 3.005 7.468 307 HB3 ASP 39 HB3 ASP 39 99.077 1.257 7.212 308 H ALA 40 H ALA 40 100.858 0.170 6.224 309 HA ALA 40 HA ALA 40 99.665 -1.411 3.953 310 HB1 ALA 40 HB1 ALA 40 101.861 -2.474 3.515 311 HB2 ALA 40 HB2 ALA 40 101.930 -0.718 3.231 312 HB3 ALA 40 HB3 ALA 40 102.617 -1.406 4.722 313 H TYR 41 H TYR 41 99.376 -3.628 4.437 314 HA TYR 41 HA TYR 41 100.053 -4.393 7.285 315 HB2 TYR 41 HB2 TYR 41 97.487 -5.115 5.801 316 HB3 TYR 41 HB3 TYR 41 97.882 -5.477 7.499 317 HD1 TYR 41 HD1 TYR 41 97.534 -2.597 5.112 318 HD2 TYR 41 HD2 TYR 41 97.284 -3.957 9.179 319 HE1 TYR 41 HE1 TYR 41 96.633 -0.390 5.793 320 HE2 TYR 41 HE2 TYR 41 96.380 -1.750 9.861 321 HH TYR 41 HH TYR 41 96.674 0.884 8.487 322 H VAL 42 H VAL 42 100.776 -6.501 7.558 323 HA VAL 42 HA VAL 42 101.045 -8.097 4.998 324 HB VAL 42 HB VAL 42 102.844 -8.116 7.464 325 HG11 VAL 42 HG11 VAL 42 102.647 -10.251 6.081 326 HG12 VAL 42 HG12 VAL 42 104.283 -9.557 6.173 327 HG13 VAL 42 HG13 VAL 42 103.301 -9.327 4.707 328 HG21 VAL 42 HG21 VAL 42 104.471 -6.965 5.986 329 HG22 VAL 42 HG22 VAL 42 102.994 -5.994 6.190 330 HG23 VAL 42 HG23 VAL 42 103.254 -6.912 4.688 331 H ILE 43 H ILE 43 100.050 -10.048 4.983 332 HA ILE 43 HA ILE 43 99.306 -11.234 7.669 333 HB ILE 43 HB ILE 43 97.669 -11.866 5.234 334 HG12 ILE 43 HG12 ILE 43 97.342 -9.297 6.841 335 HG13 ILE 43 HG13 ILE 43 98.003 -9.374 5.190 336 HG21 ILE 43 HG21 ILE 43 95.881 -11.955 6.917 337 HG22 ILE 43 HG22 ILE 43 97.276 -12.914 7.467 338 HG23 ILE 43 HG23 ILE 43 96.982 -11.297 8.151 339 HD11 ILE 43 HD11 ILE 43 95.585 -8.826 5.156 340 HD12 ILE 43 HD12 ILE 43 95.232 -10.326 6.046 341 HD13 ILE 43 HD13 ILE 43 95.893 -10.405 4.395 342 H LEU 44 H LEU 44 99.512 -13.476 7.856 343 HA LEU 44 HA LEU 44 100.862 -14.833 5.506 344 HB2 LEU 44 HB2 LEU 44 101.716 -14.517 8.324 345 HB3 LEU 44 HB3 LEU 44 101.756 -16.201 7.750 346 HG LEU 44 HG LEU 44 103.013 -15.358 5.699 347 HD11 LEU 44 HD11 LEU 44 104.100 -13.139 5.908 348 HD12 LEU 44 HD12 LEU 44 103.218 -12.851 7.426 349 HD13 LEU 44 HD13 LEU 44 102.327 -12.986 5.891 350 HD21 LEU 44 HD21 LEU 44 104.163 -16.454 7.608 351 HD22 LEU 44 HD22 LEU 44 104.300 -14.880 8.428 352 HD23 LEU 44 HD23 LEU 44 105.174 -15.168 6.904 353 H LYS 45 H LYS 45 100.378 -17.108 5.273 354 HA LYS 45 HA LYS 45 98.227 -18.151 7.095 355 HB2 LYS 45 HB2 LYS 45 96.860 -17.256 5.370 356 HB3 LYS 45 HB3 LYS 45 97.997 -17.753 4.094 357 HG2 LYS 45 HG3 LYS 45 97.274 -19.954 4.116 358 HG3 LYS 45 HG2 LYS 45 96.850 -19.908 5.844 359 HD2 LYS 45 HD2 LYS 45 94.778 -20.021 4.603 360 HD3 LYS 45 HD3 LYS 45 94.925 -18.362 5.228 361 HE2 LYS 45 HE2 LYS 45 96.053 -17.813 2.954 362 HE3 LYS 45 HE3 LYS 45 95.385 -19.367 2.400 363 HZ1 LYS 45 HZ1 LYS 45 93.530 -17.668 3.794 364 HZ2 LYS 45 HZ2 LYS 45 94.053 -17.061 2.352 365 HZ3 LYS 45 HZ3 LYS 45 93.325 -18.540 2.409 366 H THR 46 H THR 46 99.679 -19.693 7.877 367 HA THR 46 HA THR 46 101.113 -21.466 5.968 368 HB THR 46 HB THR 46 100.842 -21.562 9.007 369 HG1 THR 46 HG1 THR 46 101.999 -19.753 7.750 370 HG21 THR 46 HG21 THR 46 101.431 -23.752 8.142 371 HG22 THR 46 HG22 THR 46 102.907 -23.006 8.799 372 HG23 THR 46 HG23 THR 46 102.636 -23.044 7.041 373 H VAL 47 H VAL 47 100.068 -23.129 5.026 374 HA VAL 47 HA VAL 47 97.685 -24.292 6.452 375 HB VAL 47 HB VAL 47 98.351 -25.238 3.723 376 HG11 VAL 47 HG11 VAL 47 96.231 -25.759 4.900 377 HG12 VAL 47 HG12 VAL 47 95.930 -24.825 3.416 378 HG13 VAL 47 HG13 VAL 47 95.863 -24.021 5.002 379 HG21 VAL 47 HG21 VAL 47 97.433 -23.070 2.730 380 HG22 VAL 47 HG22 VAL 47 97.730 -22.318 4.316 381 HG23 VAL 47 HG23 VAL 47 99.090 -22.974 3.373 382 H GLN 48 H GLN 48 97.452 -26.694 6.268 383 HA GLN 48 HA GLN 48 100.160 -28.047 6.334 384 HB2 GLN 48 HB3 GLN 48 99.244 -27.774 8.627 385 HB3 GLN 48 HB2 GLN 48 97.750 -28.600 8.123 386 HG2 GLN 48 HG3 GLN 48 98.997 -30.645 7.623 387 HG3 GLN 48 HG2 GLN 48 100.539 -29.827 7.969 388 HE21 GLN 48 HE21 GLN 48 97.373 -30.631 9.552 389 HE22 GLN 48 HE22 GLN 48 98.064 -30.822 11.148 390 H LEU 49 H LEU 49 100.204 -29.323 4.542 391 HA LEU 49 HA LEU 49 97.956 -30.187 3.040 392 HB2 LEU 49 HB3 LEU 49 100.585 -31.685 3.434 393 HB3 LEU 49 HB2 LEU 49 99.452 -31.890 2.077 394 HG LEU 49 HG LEU 49 100.499 -29.130 2.698 395 HD11 LEU 49 HD11 LEU 49 102.509 -30.583 2.680 396 HD12 LEU 49 HD12 LEU 49 101.996 -31.273 1.122 397 HD13 LEU 49 HD13 LEU 49 102.450 -29.555 1.228 398 HD21 LEU 49 HD21 LEU 49 98.737 -29.481 0.986 399 HD22 LEU 49 HD22 LEU 49 100.250 -28.912 0.240 400 HD23 LEU 49 HD23 LEU 49 99.796 -30.630 0.133 401 H ARG 50 H ARG 50 99.808 -32.827 4.455 402 HA ARG 50 HA ARG 50 97.393 -33.652 6.047 403 HB2 ARG 50 HB2 ARG 50 97.865 -36.037 5.100 404 HB3 ARG 50 HB3 ARG 50 96.981 -34.884 4.072 405 HG2 ARG 50 HG2 ARG 50 98.818 -34.517 2.672 406 HG3 ARG 50 HG3 ARG 50 99.995 -34.988 3.922 407 HD2 ARG 50 HD2 ARG 50 99.318 -36.619 1.872 408 HD3 ARG 50 HD3 ARG 50 99.770 -37.239 3.478 409 HE ARG 50 HE ARG 50 97.507 -37.900 3.824 410 HH11 ARG 50 HH11 ARG 50 95.376 -38.127 3.108 411 HH12 ARG 50 HH12 ARG 50 94.826 -37.241 1.704 412 HH21 ARG 50 HH21 ARG 50 97.897 -35.694 1.159 413 HH22 ARG 50 HH22 ARG 50 96.247 -35.870 0.605 414 H ASN 51 H ASN 51 100.821 -34.139 5.216 415 HA ASN 51 HA ASN 51 101.569 -34.378 8.014 416 HB2 ASN 51 HB2 ASN 51 100.464 -36.607 7.719 417 HB3 ASN 51 HB3 ASN 51 101.613 -36.973 6.409 418 HD21 ASN 51 HD21 ASN 51 103.761 -37.592 6.977 419 HD22 ASN 51 HD22 ASN 51 104.285 -37.761 8.638 420 H GLY 52 H GLY 52 102.323 -33.068 5.447 421 HA2 GLY 52 HA2 GLY 52 105.136 -34.160 5.194 422 HA3 GLY 52 HA3 GLY 52 104.292 -33.267 3.906 423 H ASN 53 H ASN 53 104.259 -31.010 3.965 424 HA ASN 53 HA ASN 53 105.727 -29.761 6.301 425 HB2 ASN 53 HB3 ASN 53 105.999 -29.255 3.315 426 HB3 ASN 53 HB2 ASN 53 106.533 -28.068 4.529 427 HD21 ASN 53 HD21 ASN 53 108.424 -28.554 5.800 428 HD22 ASN 53 HD22 ASN 53 109.430 -29.946 5.466 429 H LEU 54 H LEU 54 105.410 -27.094 5.534 430 HA LEU 54 HA LEU 54 102.395 -26.819 5.426 431 HB2 LEU 54 HB2 LEU 54 103.993 -24.759 6.890 432 HB3 LEU 54 HB3 LEU 54 102.386 -25.427 7.259 433 HG LEU 54 HG LEU 54 103.769 -27.651 7.717 434 HD11 LEU 54 HD11 LEU 54 105.896 -26.113 8.921 435 HD12 LEU 54 HD12 LEU 54 105.832 -25.740 7.182 436 HD13 LEU 54 HD13 LEU 54 106.016 -27.425 7.724 437 HD21 LEU 54 HD21 LEU 54 102.421 -26.404 9.384 438 HD22 LEU 54 HD22 LEU 54 103.953 -26.970 10.093 439 HD23 LEU 54 HD23 LEU 54 103.768 -25.264 9.620 440 H GLN 55 H GLN 55 101.686 -24.655 4.602 441 HA GLN 55 HA GLN 55 103.789 -23.467 2.772 442 HB2 GLN 55 HB3 GLN 55 102.164 -24.864 1.507 443 HB3 GLN 55 HB2 GLN 55 100.827 -23.894 2.171 444 HG2 GLN 55 HG2 GLN 55 101.583 -21.912 1.044 445 HG3 GLN 55 HG3 GLN 55 103.140 -22.664 0.621 446 HE21 GLN 55 HE21 GLN 55 99.862 -22.162 -0.420 447 HE22 GLN 55 HE22 GLN 55 99.921 -23.216 -1.815 448 H TYR 56 H TYR 56 104.228 -21.531 3.735 449 HA TYR 56 HA TYR 56 102.129 -19.971 5.114 450 HB2 TYR 56 HB2 TYR 56 105.006 -19.371 4.295 451 HB3 TYR 56 HB3 TYR 56 103.978 -18.205 5.161 452 HD1 TYR 56 HD1 TYR 56 104.910 -21.854 5.389 453 HD2 TYR 56 HD2 TYR 56 104.168 -18.171 7.472 454 HE1 TYR 56 HE1 TYR 56 105.467 -22.957 7.538 455 HE2 TYR 56 HE2 TYR 56 104.721 -19.276 9.622 456 HH TYR 56 HH TYR 56 104.837 -22.537 10.063 457 H ASP 57 H ASP 57 100.804 -18.472 4.169 458 HA ASP 57 HA ASP 57 101.461 -17.707 1.312 459 HB2 ASP 57 HB2 ASP 57 99.099 -18.808 2.462 460 HB3 ASP 57 HB3 ASP 57 98.726 -17.109 2.088 461 H LEU 58 H LEU 58 102.196 -15.658 1.145 462 HA LEU 58 HA LEU 58 101.590 -13.761 3.389 463 HB2 LEU 58 HB3 LEU 58 103.570 -13.674 1.078 464 HB3 LEU 58 HB2 LEU 58 103.345 -12.342 2.237 465 HG LEU 58 HG LEU 58 103.888 -13.887 4.104 466 HD11 LEU 58 HD11 LEU 58 105.051 -16.101 3.192 467 HD12 LEU 58 HD12 LEU 58 103.292 -16.045 3.459 468 HD13 LEU 58 HD13 LEU 58 103.950 -15.848 1.817 469 HD21 LEU 58 HD21 LEU 58 105.636 -12.580 2.665 470 HD22 LEU 58 HD22 LEU 58 106.062 -14.180 2.012 471 HD23 LEU 58 HD23 LEU 58 106.226 -13.858 3.754 472 H HIS 59 H HIS 59 100.561 -11.807 3.101 473 HA HIS 59 HA HIS 59 99.672 -11.067 0.334 474 HB2 HIS 59 HB2 HIS 59 97.581 -10.958 2.485 475 HB3 HIS 59 HB3 HIS 59 97.395 -11.198 0.733 476 HD2 HIS 59 HD2 HIS 59 98.590 -13.391 3.848 477 HE1 HIS 59 HE1 HIS 59 97.174 -15.949 0.801 478 H TYR 60 H TYR 60 100.448 -9.007 0.203 479 HA TYR 60 HA TYR 60 100.454 -7.344 2.699 480 HB2 TYR 60 HB2 TYR 60 101.478 -5.698 0.785 481 HB3 TYR 60 HB3 TYR 60 102.463 -6.861 1.702 482 HD1 TYR 60 HD1 TYR 60 102.408 -9.347 0.693 483 HD2 TYR 60 HD2 TYR 60 101.623 -5.759 -1.532 484 HE1 TYR 60 HE1 TYR 60 102.982 -10.527 -1.412 485 HE2 TYR 60 HE2 TYR 60 102.194 -6.939 -3.637 486 HH TYR 60 HH TYR 60 102.211 -10.032 -4.089 487 H TRP 61 H TRP 61 98.662 -6.173 3.127 488 HA TRP 61 HA TRP 61 96.814 -5.520 0.868 489 HB2 TRP 61 HB2 TRP 61 96.083 -6.445 3.174 490 HB3 TRP 61 HB3 TRP 61 96.412 -4.808 3.792 491 HD1 TRP 61 HD1 TRP 61 94.199 -6.653 1.240 492 HE1 TRP 61 HE1 TRP 61 92.113 -5.223 0.735 493 HE3 TRP 61 HE3 TRP 61 95.435 -2.454 3.869 494 HZ2 TRP 61 HZ2 TRP 61 91.128 -2.593 1.392 495 HZ3 TRP 61 HZ3 TRP 61 93.910 -0.502 3.911 496 HH2 TRP 61 HH2 TRP 61 91.758 -0.568 2.681 497 H LEU 62 H LEU 62 96.712 -3.559 -0.052 498 HA LEU 62 HA LEU 62 97.887 -1.221 1.461 499 HB2 LEU 62 HB2 LEU 62 98.143 -1.183 -1.507 500 HB3 LEU 62 HB3 LEU 62 99.295 -0.653 -0.259 501 HG LEU 62 HG LEU 62 98.705 -3.566 -0.946 502 HD11 LEU 62 HD11 LEU 62 100.943 -3.535 -2.014 503 HD12 LEU 62 HD12 LEU 62 99.837 -2.389 -2.809 504 HD13 LEU 62 HD13 LEU 62 101.076 -1.791 -1.680 505 HD21 LEU 62 HD21 LEU 62 101.233 -2.900 0.397 506 HD22 LEU 62 HD22 LEU 62 99.816 -2.417 1.360 507 HD23 LEU 62 HD23 LEU 62 100.002 -4.108 0.837 508 H GLY 63 H GLY 63 96.150 0.084 1.839 509 HA2 GLY 63 HA2 GLY 63 93.694 -0.038 0.317 510 HA3 GLY 63 HA3 GLY 63 94.153 1.283 1.417 511 H ASN 64 H ASN 64 96.476 0.640 -1.018 512 HA ASN 64 HA ASN 64 97.070 1.835 -2.967 513 HB2 ASN 64 HB3 ASN 64 94.572 1.168 -3.482 514 HB3 ASN 64 HB2 ASN 64 94.249 2.894 -3.190 515 HD21 ASN 64 HD21 ASN 64 97.170 1.373 -4.685 516 HD22 ASN 64 HD22 ASN 64 96.992 2.199 -6.217 517 H GLU 65 H GLU 65 96.119 3.199 -0.112 518 HA GLU 65 HA GLU 65 96.537 6.012 -1.139 519 HB2 GLU 65 HB3 GLU 65 95.020 4.801 1.132 520 HB3 GLU 65 HB2 GLU 65 95.854 6.334 1.481 521 HG2 GLU 65 HG2 GLU 65 94.760 7.376 -0.489 522 HG3 GLU 65 HG3 GLU 65 93.919 5.844 -0.829 523 H CYS 66 H CYS 66 98.408 3.568 -0.248 524 HA CYS 66 HA CYS 66 100.073 5.172 1.692 525 HB2 CYS 66 HB2 CYS 66 99.411 2.775 2.245 526 HB3 CYS 66 HB3 CYS 66 100.418 2.257 0.872 527 HG CYS 66 HG CYS 66 101.954 1.952 3.272 528 H SER 67 H SER 67 102.249 5.642 1.207 529 HA SER 67 HA SER 67 102.843 5.956 -1.638 530 HB2 SER 67 HB2 SER 67 105.062 6.748 -0.826 531 HB3 SER 67 HB3 SER 67 103.722 7.518 0.059 532 HG SER 67 HG SER 67 105.376 6.713 1.474 533 H GLN 68 H GLN 68 104.181 4.730 -2.962 534 HA GLN 68 HA GLN 68 104.513 1.930 -2.317 535 HB2 GLN 68 HB3 GLN 68 104.432 2.548 -4.633 536 HB3 GLN 68 HB2 GLN 68 105.746 3.733 -4.437 537 HG2 GLN 68 HG2 GLN 68 107.385 2.016 -4.138 538 HG3 GLN 68 HG3 GLN 68 106.140 0.765 -3.902 539 HE21 GLN 68 HE21 GLN 68 108.366 1.077 -6.023 540 HE22 GLN 68 HE22 GLN 68 107.511 0.934 -7.543 541 H ASP 69 H ASP 69 106.223 4.648 -1.227 542 HA ASP 69 HA ASP 69 108.906 3.488 -1.133 543 HB2 ASP 69 HB2 ASP 69 108.456 5.934 -0.936 544 HB3 ASP 69 HB3 ASP 69 107.653 5.646 0.627 545 H GLU 70 H GLU 70 106.286 3.825 1.321 546 HA GLU 70 HA GLU 70 107.824 2.056 3.165 547 HB2 GLU 70 HB2 GLU 70 106.632 3.879 4.206 548 HB3 GLU 70 HB3 GLU 70 105.125 3.454 3.359 549 HG2 GLU 70 HG3 GLU 70 104.885 1.420 4.621 550 HG3 GLU 70 HG2 GLU 70 106.536 1.554 5.274 551 H SER 71 H SER 71 104.854 1.979 1.194 552 HA SER 71 HA SER 71 103.876 -0.567 2.057 553 HB2 SER 71 HB3 SER 71 102.801 1.154 0.451 554 HB3 SER 71 HB2 SER 71 103.781 0.392 -0.825 555 HG SER 71 HG SER 71 101.686 -0.580 -0.613 556 H GLY 72 H GLY 72 106.001 0.172 -0.763 557 HA2 GLY 72 HA3 GLY 72 106.485 -2.481 -1.605 558 HA3 GLY 72 HA2 GLY 72 107.694 -1.180 -1.721 559 H ALA 73 H ALA 73 108.173 -0.648 0.980 560 HA ALA 73 HA ALA 73 110.107 -2.619 1.668 561 HB1 ALA 73 HB1 ALA 73 110.068 -1.618 3.937 562 HB2 ALA 73 HB2 ALA 73 108.532 -0.806 3.552 563 HB3 ALA 73 HB3 ALA 73 110.019 -0.356 2.683 564 H ALA 74 H ALA 74 106.782 -2.225 2.998 565 HA ALA 74 HA ALA 74 106.783 -4.469 4.725 566 HB1 ALA 74 HB1 ALA 74 104.454 -3.679 2.927 567 HB2 ALA 74 HB2 ALA 74 104.910 -2.783 4.395 568 HB3 ALA 74 HB3 ALA 74 104.373 -4.475 4.517 569 H ALA 75 H ALA 75 106.055 -4.363 1.218 570 HA ALA 75 HA ALA 75 105.531 -7.210 0.998 571 HB1 ALA 75 HB1 ALA 75 105.885 -6.855 -1.432 572 HB2 ALA 75 HB2 ALA 75 106.581 -5.251 -1.096 573 HB3 ALA 75 HB3 ALA 75 104.866 -5.569 -0.742 574 H ILE 76 H ILE 76 108.453 -5.339 1.303 575 HA ILE 76 HA ILE 76 110.164 -7.491 0.178 576 HB ILE 76 HB ILE 76 110.831 -4.936 1.704 577 HG12 ILE 76 HG12 ILE 76 109.734 -4.969 -0.709 578 HG13 ILE 76 HG13 ILE 76 111.116 -3.901 -0.371 579 HG21 ILE 76 HG21 ILE 76 112.698 -6.351 2.026 580 HG22 ILE 76 HG22 ILE 76 113.125 -5.426 0.566 581 HG23 ILE 76 HG23 ILE 76 112.526 -7.095 0.418 582 HD11 ILE 76 HD11 ILE 76 111.198 -5.375 -2.523 583 HD12 ILE 76 HD12 ILE 76 112.643 -5.326 -1.485 584 HD13 ILE 76 HD13 ILE 76 111.539 -6.720 -1.408 585 H PHE 77 H PHE 77 109.647 -6.006 3.426 586 HA PHE 77 HA PHE 77 111.319 -7.866 4.840 587 HB2 PHE 77 HB2 PHE 77 108.964 -6.128 5.588 588 HB3 PHE 77 HB3 PHE 77 109.586 -7.309 6.766 589 HD1 PHE 77 HD1 PHE 77 111.210 -5.069 4.210 590 HD2 PHE 77 HD2 PHE 77 110.967 -6.272 8.327 591 HE1 PHE 77 HE1 PHE 77 113.069 -3.526 4.771 592 HE2 PHE 77 HE2 PHE 77 112.830 -4.734 8.887 593 HZ PHE 77 HZ PHE 77 113.879 -3.358 7.109 594 H THR 78 H THR 78 107.887 -8.032 3.881 595 HA THR 78 HA THR 78 107.408 -10.550 5.302 596 HB THR 78 HB THR 78 105.686 -8.797 4.464 597 HG1 THR 78 HG1 THR 78 105.371 -11.597 4.021 598 HG21 THR 78 HG21 THR 78 104.875 -9.016 2.220 599 HG22 THR 78 HG22 THR 78 106.646 -8.902 2.085 600 HG23 THR 78 HG23 THR 78 105.842 -10.483 1.937 601 H VAL 79 H VAL 79 108.032 -9.706 1.868 602 HA VAL 79 HA VAL 79 107.985 -12.449 0.937 603 HB VAL 79 HB VAL 79 109.297 -9.918 -0.126 604 HG11 VAL 79 HG11 VAL 79 110.619 -11.886 -0.855 605 HG12 VAL 79 HG12 VAL 79 109.708 -11.188 -2.216 606 HG13 VAL 79 HG13 VAL 79 109.128 -12.674 -1.427 607 HG21 VAL 79 HG21 VAL 79 107.069 -11.540 -1.379 608 HG22 VAL 79 HG22 VAL 79 106.714 -10.399 -0.059 609 HG23 VAL 79 HG23 VAL 79 107.443 -9.811 -1.573 610 H GLN 80 H GLN 80 110.797 -10.298 1.629 611 HA GLN 80 HA GLN 80 112.815 -12.269 1.257 612 HB2 GLN 80 HB3 GLN 80 112.697 -9.929 3.205 613 HB3 GLN 80 HB2 GLN 80 114.170 -10.869 2.865 614 HG2 GLN 80 HG2 GLN 80 112.577 -9.701 0.577 615 HG3 GLN 80 HG3 GLN 80 113.689 -8.661 1.499 616 HE21 GLN 80 HE21 GLN 80 114.599 -8.818 -0.967 617 HE22 GLN 80 HE22 GLN 80 115.842 -10.032 -1.173 618 H LEU 81 H LEU 81 111.377 -11.286 4.432 619 HA LEU 81 HA LEU 81 112.637 -13.285 5.992 620 HB2 LEU 81 HB2 LEU 81 110.979 -11.376 6.681 621 HB3 LEU 81 HB3 LEU 81 109.717 -12.602 6.424 622 HG LEU 81 HG LEU 81 110.466 -12.536 8.794 623 HD11 LEU 81 HD11 LEU 81 110.556 -14.867 9.077 624 HD12 LEU 81 HD12 LEU 81 109.829 -14.708 7.460 625 HD13 LEU 81 HD13 LEU 81 111.557 -15.104 7.624 626 HD21 LEU 81 HD21 LEU 81 112.677 -12.782 9.464 627 HD22 LEU 81 HD22 LEU 81 112.923 -11.942 7.915 628 HD23 LEU 81 HD23 LEU 81 113.126 -13.708 8.012 629 H ASP 82 H ASP 82 109.535 -13.545 4.176 630 HA ASP 82 HA ASP 82 108.842 -16.178 4.893 631 HB2 ASP 82 HB2 ASP 82 107.286 -15.756 3.309 632 HB3 ASP 82 HB3 ASP 82 108.239 -14.373 2.724 633 H ASP 83 H ASP 83 111.170 -15.162 2.346 634 HA ASP 83 HA ASP 83 111.936 -17.857 1.641 635 HB2 ASP 83 HB2 ASP 83 113.644 -15.326 1.611 636 HB3 ASP 83 HB3 ASP 83 113.980 -16.827 0.716 637 H TYR 84 H TYR 84 112.751 -15.720 4.308 638 HA TYR 84 HA TYR 84 115.017 -17.385 5.206 639 HB2 TYR 84 HB2 TYR 84 114.932 -14.992 5.781 640 HB3 TYR 84 HB3 TYR 84 113.398 -15.241 6.650 641 HD1 TYR 84 HD1 TYR 84 113.366 -16.785 8.659 642 HD2 TYR 84 HD2 TYR 84 117.018 -15.478 6.815 643 HE1 TYR 84 HE1 TYR 84 114.625 -17.427 10.697 644 HE2 TYR 84 HE2 TYR 84 118.278 -16.121 8.853 645 HH TYR 84 HH TYR 84 117.118 -18.112 11.204 646 H LEU 85 H LEU 85 111.535 -17.359 5.569 647 HA LEU 85 HA LEU 85 111.619 -19.099 7.974 648 HB2 LEU 85 HB2 LEU 85 109.536 -17.756 6.319 649 HB3 LEU 85 HB3 LEU 85 109.053 -19.305 7.048 650 HG LEU 85 HG LEU 85 110.373 -17.052 8.617 651 HD11 LEU 85 HD11 LEU 85 108.190 -16.304 7.706 652 HD12 LEU 85 HD12 LEU 85 108.101 -16.547 9.466 653 HD13 LEU 85 HD13 LEU 85 107.416 -17.765 8.364 654 HD21 LEU 85 HD21 LEU 85 110.569 -19.334 9.576 655 HD22 LEU 85 HD22 LEU 85 108.805 -19.535 9.456 656 HD23 LEU 85 HD23 LEU 85 109.489 -18.317 10.559 657 H ASN 86 H ASN 86 110.630 -19.473 4.528 658 HA ASN 86 HA ASN 86 111.153 -22.436 4.900 659 HB2 ASN 86 HB3 ASN 86 108.709 -21.717 4.550 660 HB3 ASN 86 HB2 ASN 86 109.195 -21.233 2.907 661 HD21 ASN 86 HD21 ASN 86 111.195 -23.407 2.586 662 HD22 ASN 86 HD22 ASN 86 110.274 -24.883 2.407 663 H GLY 87 H GLY 87 111.179 -19.680 2.628 664 HA2 GLY 87 HA2 GLY 87 113.414 -19.514 1.359 665 HA3 GLY 87 HA3 GLY 87 113.183 -21.238 0.973 666 H ARG 88 H ARG 88 110.153 -20.546 0.868 667 HA ARG 88 HA ARG 88 110.130 -19.024 -1.724 668 HB2 ARG 88 HB2 ARG 88 109.192 -21.880 -1.286 669 HB3 ARG 88 HB3 ARG 88 108.497 -20.862 -2.570 670 HG2 ARG 88 HG2 ARG 88 111.499 -21.125 -2.278 671 HG3 ARG 88 HG3 ARG 88 110.566 -22.376 -3.132 672 HD2 ARG 88 HD3 ARG 88 109.881 -19.593 -3.905 673 HD3 ARG 88 HD2 ARG 88 111.544 -20.083 -4.309 674 HE ARG 88 HE ARG 88 110.664 -21.789 -5.792 675 HH11 ARG 88 HH11 ARG 88 108.950 -22.472 -7.092 676 HH12 ARG 88 HH12 ARG 88 107.325 -21.910 -6.767 677 HH21 ARG 88 HH21 ARG 88 108.266 -19.969 -4.036 678 HH22 ARG 88 HH22 ARG 88 106.940 -20.500 -5.046 679 H ALA 89 H ALA 89 107.588 -21.089 -0.340 680 HA ALA 89 HA ALA 89 105.507 -20.495 0.614 681 HB1 ALA 89 HB1 ALA 89 105.457 -18.726 2.153 682 HB2 ALA 89 HB2 ALA 89 107.197 -19.092 2.082 683 HB3 ALA 89 HB3 ALA 89 106.541 -17.710 1.173 684 H VAL 90 H VAL 90 103.578 -19.546 -0.125 685 HA VAL 90 HA VAL 90 103.806 -18.226 -2.774 686 HB VAL 90 HB VAL 90 101.229 -18.614 -1.228 687 HG11 VAL 90 HG11 VAL 90 101.184 -17.435 -3.409 688 HG12 VAL 90 HG12 VAL 90 100.358 -19.008 -3.515 689 HG13 VAL 90 HG13 VAL 90 102.001 -18.820 -4.173 690 HG21 VAL 90 HG21 VAL 90 101.263 -20.921 -2.483 691 HG22 VAL 90 HG22 VAL 90 102.146 -20.768 -0.946 692 HG23 VAL 90 HG23 VAL 90 103.029 -20.699 -2.489 693 H GLN 91 H GLN 91 102.981 -16.114 -3.261 694 HA GLN 91 HA GLN 91 102.595 -14.377 -0.809 695 HB2 GLN 91 HB3 GLN 91 103.798 -13.315 -3.370 696 HB3 GLN 91 HB2 GLN 91 103.981 -12.713 -1.705 697 HG2 GLN 91 HG2 GLN 91 106.051 -13.764 -2.098 698 HG3 GLN 91 HG3 GLN 91 105.126 -15.034 -1.260 699 HE21 GLN 91 HE21 GLN 91 104.722 -13.964 -4.683 700 HE22 GLN 91 HE22 GLN 91 105.168 -15.508 -5.374 701 H HIS 92 H HIS 92 101.256 -12.457 -1.183 702 HA HIS 92 HA HIS 92 99.548 -12.625 -3.662 703 HB2 HIS 92 HB2 HIS 92 98.607 -12.634 -0.769 704 HB3 HIS 92 HB3 HIS 92 97.551 -12.135 -2.112 705 HD2 HIS 92 HD2 HIS 92 99.771 -15.392 -1.371 706 HE1 HIS 92 HE1 HIS 92 96.234 -16.516 -3.390 707 H ARG 93 H ARG 93 98.802 -10.609 -4.377 708 HA ARG 93 HA ARG 93 99.843 -8.253 -2.782 709 HB2 ARG 93 HB2 ARG 93 101.012 -8.418 -4.899 710 HB3 ARG 93 HB3 ARG 93 99.485 -8.649 -5.784 711 HG2 ARG 93 HG2 ARG 93 98.769 -6.393 -5.288 712 HG3 ARG 93 HG3 ARG 93 100.119 -6.155 -4.151 713 HD2 ARG 93 HD3 ARG 93 100.408 -5.134 -6.496 714 HD3 ARG 93 HD2 ARG 93 101.736 -6.167 -5.916 715 HE ARG 93 HE ARG 93 99.854 -7.814 -7.359 716 HH11 ARG 93 HH11 ARG 93 100.379 -8.391 -9.478 717 HH12 ARG 93 HH12 ARG 93 101.567 -7.466 -10.369 718 HH21 ARG 93 HH21 ARG 93 102.168 -5.245 -7.755 719 HH22 ARG 93 HH22 ARG 93 102.576 -5.691 -9.396 720 H GLU 94 H GLU 94 98.318 -6.871 -2.024 721 HA GLU 94 HA GLU 94 95.622 -6.908 -3.404 722 HB2 GLU 94 HB2 GLU 94 96.357 -7.223 -0.513 723 HB3 GLU 94 HB3 GLU 94 94.921 -6.238 -0.881 724 HG2 GLU 94 HG2 GLU 94 94.250 -8.576 -0.572 725 HG3 GLU 94 HG3 GLU 94 94.036 -8.120 -2.279 726 H VAL 95 H VAL 95 96.185 -5.001 -4.589 727 HA VAL 95 HA VAL 95 96.957 -2.585 -2.998 728 HB VAL 95 HB VAL 95 96.326 -2.642 -5.964 729 HG11 VAL 95 HG11 VAL 95 96.717 -0.459 -4.854 730 HG12 VAL 95 HG12 VAL 95 98.275 -1.054 -4.234 731 HG13 VAL 95 HG13 VAL 95 98.035 -0.846 -5.985 732 HG21 VAL 95 HG21 VAL 95 98.927 -3.021 -6.099 733 HG22 VAL 95 HG22 VAL 95 97.857 -4.426 -5.878 734 HG23 VAL 95 HG23 VAL 95 98.726 -3.741 -4.484 735 H GLN 96 H GLN 96 94.372 -3.733 -2.438 736 HA GLN 96 HA GLN 96 92.126 -3.036 -2.225 737 HB2 GLN 96 HB2 GLN 96 93.658 -0.818 -1.789 738 HB3 GLN 96 HB3 GLN 96 92.696 -0.268 -3.182 739 HG2 GLN 96 HG3 GLN 96 90.674 -1.294 -1.823 740 HG3 GLN 96 HG2 GLN 96 91.770 -1.114 -0.432 741 HE21 GLN 96 HE21 GLN 96 89.918 0.522 0.160 742 HE22 GLN 96 HE22 GLN 96 90.131 2.157 -0.427 743 H GLY 97 H GLY 97 91.527 -4.345 -4.090 744 HA2 GLY 97 HA2 GLY 97 89.794 -3.524 -5.923 745 HA3 GLY 97 HA3 GLY 97 91.239 -2.786 -6.653 746 H PHE 98 H PHE 98 93.190 -4.608 -6.471 747 HA PHE 98 HA PHE 98 92.104 -6.854 -8.139 748 HB2 PHE 98 HB2 PHE 98 94.170 -5.362 -8.727 749 HB3 PHE 98 HB3 PHE 98 95.031 -6.360 -7.531 750 HD1 PHE 98 HD1 PHE 98 92.930 -6.559 -10.625 751 HD2 PHE 98 HD2 PHE 98 95.792 -8.524 -8.096 752 HE1 PHE 98 HE1 PHE 98 93.185 -8.357 -12.312 753 HE2 PHE 98 HE2 PHE 98 96.045 -10.326 -9.781 754 HZ PHE 98 HZ PHE 98 94.741 -10.243 -11.891 755 H GLU 99 H GLU 99 91.200 -7.389 -5.721 756 HA GLU 99 HA GLU 99 93.263 -8.967 -4.224 757 HB2 GLU 99 HB2 GLU 99 90.324 -8.818 -3.514 758 HB3 GLU 99 HB3 GLU 99 91.727 -9.023 -2.439 759 HG2 GLU 99 HG2 GLU 99 92.455 -6.691 -3.022 760 HG3 GLU 99 HG3 GLU 99 90.964 -6.500 -3.976 761 H SER 100 H SER 100 93.020 -11.238 -3.848 762 HA SER 100 HA SER 100 91.584 -12.604 -6.090 763 HB2 SER 100 HB2 SER 100 93.580 -13.520 -3.985 764 HB3 SER 100 HB3 SER 100 92.755 -14.656 -5.079 765 HG SER 100 HG SER 100 94.784 -13.918 -5.928 766 H ALA 101 H ALA 101 90.597 -14.862 -5.311 767 HA ALA 101 HA ALA 101 88.380 -14.136 -3.527 768 HB1 ALA 101 HB1 ALA 101 87.646 -16.476 -3.890 769 HB2 ALA 101 HB2 ALA 101 88.082 -15.696 -5.429 770 HB3 ALA 101 HB3 ALA 101 89.206 -16.844 -4.664 771 H THR 102 H THR 102 91.473 -15.777 -3.172 772 HA THR 102 HA THR 102 90.880 -17.153 -0.691 773 HB THR 102 HB THR 102 93.584 -15.943 -1.345 774 HG1 THR 102 HG1 THR 102 93.875 -17.806 -2.695 775 HG21 THR 102 HG21 THR 102 94.368 -18.071 -0.345 776 HG22 THR 102 HG22 THR 102 93.301 -17.193 0.776 777 HG23 THR 102 HG23 THR 102 92.679 -18.592 -0.131 778 H PHE 103 H PHE 103 92.470 -13.987 -1.306 779 HA PHE 103 HA PHE 103 92.590 -13.236 1.483 780 HB2 PHE 103 HB2 PHE 103 93.926 -12.059 -0.181 781 HB3 PHE 103 HB3 PHE 103 92.461 -11.542 -1.050 782 HD1 PHE 103 HD1 PHE 103 94.729 -10.841 1.697 783 HD2 PHE 103 HD2 PHE 103 90.817 -10.013 0.131 784 HE1 PHE 103 HE1 PHE 103 94.569 -8.840 3.155 785 HE2 PHE 103 HE2 PHE 103 90.656 -8.011 1.589 786 HZ PHE 103 HZ PHE 103 92.531 -7.428 3.103 787 H LEU 104 H LEU 104 90.205 -12.378 -1.087 788 HA LEU 104 HA LEU 104 88.477 -10.935 0.757 789 HB2 LEU 104 HB3 LEU 104 88.225 -12.067 -2.020 790 HB3 LEU 104 HB2 LEU 104 86.732 -11.634 -1.153 791 HG LEU 104 HG LEU 104 89.055 -9.698 -1.231 792 HD11 LEU 104 HD11 LEU 104 88.621 -10.355 -3.584 793 HD12 LEU 104 HD12 LEU 104 86.888 -10.017 -3.357 794 HD13 LEU 104 HD13 LEU 104 88.071 -8.690 -3.271 795 HD21 LEU 104 HD21 LEU 104 87.134 -9.277 0.283 796 HD22 LEU 104 HD22 LEU 104 87.204 -8.061 -1.015 797 HD23 LEU 104 HD23 LEU 104 86.020 -9.388 -1.100 798 H GLY 105 H GLY 105 88.908 -14.329 -0.032 799 HA2 GLY 105 HA2 GLY 105 86.350 -15.292 0.910 800 HA3 GLY 105 HA3 GLY 105 87.854 -16.244 0.867 801 H TYR 106 H TYR 106 89.497 -14.867 2.602 802 HA TYR 106 HA TYR 106 88.462 -15.717 5.181 803 HB2 TYR 106 HB2 TYR 106 90.951 -14.854 4.103 804 HB3 TYR 106 HB3 TYR 106 90.576 -13.742 5.440 805 HD1 TYR 106 HD1 TYR 106 91.689 -17.057 4.537 806 HD2 TYR 106 HD2 TYR 106 89.909 -14.755 7.698 807 HE1 TYR 106 HE1 TYR 106 92.320 -18.812 6.172 808 HE2 TYR 106 HE2 TYR 106 90.542 -16.509 9.332 809 HH TYR 106 HH TYR 106 91.034 -19.094 9.189 810 H PHE 107 H PHE 107 88.982 -12.460 3.741 811 HA PHE 107 HA PHE 107 87.237 -11.355 5.949 812 HB2 PHE 107 HB2 PHE 107 88.869 -9.715 3.987 813 HB3 PHE 107 HB3 PHE 107 88.287 -9.258 5.606 814 HD1 PHE 107 HD1 PHE 107 89.144 -10.823 7.575 815 HD2 PHE 107 HD2 PHE 107 91.082 -10.416 3.763 816 HE1 PHE 107 HE1 PHE 107 91.268 -11.635 8.568 817 HE2 PHE 107 HE2 PHE 107 93.204 -11.231 4.755 818 HZ PHE 107 HZ PHE 107 93.296 -11.839 7.157 819 H LYS 108 H LYS 108 85.490 -12.484 4.519 820 HA LYS 108 HA LYS 108 84.801 -10.853 2.101 821 HB2 LYS 108 HB2 LYS 108 84.605 -13.334 2.009 822 HB3 LYS 108 HB3 LYS 108 83.423 -13.280 3.338 823 HG2 LYS 108 HG2 LYS 108 81.854 -12.027 1.991 824 HG3 LYS 108 HG3 LYS 108 83.065 -11.781 0.710 825 HD2 LYS 108 HD3 LYS 108 81.604 -13.578 -0.005 826 HD3 LYS 108 HD2 LYS 108 83.164 -14.306 0.449 827 HE2 LYS 108 HE2 LYS 108 82.307 -15.079 2.545 828 HE3 LYS 108 HE3 LYS 108 80.853 -14.061 2.410 829 HZ1 LYS 108 HZ1 LYS 108 80.392 -16.352 1.841 830 HZ2 LYS 108 HZ2 LYS 108 81.528 -16.330 0.645 831 HZ3 LYS 108 HZ3 LYS 108 80.180 -15.387 0.520 832 H SER 109 H SER 109 84.067 -11.054 5.470 833 HA SER 109 HA SER 109 81.327 -10.081 5.369 834 HB2 SER 109 HB3 SER 109 83.399 -9.624 7.558 835 HB3 SER 109 HB2 SER 109 81.627 -9.575 7.730 836 HG SER 109 HG SER 109 82.528 -11.615 8.371 837 H GLY 110 H GLY 110 84.166 -8.619 4.344 838 HA2 GLY 110 HA2 GLY 110 84.171 -6.373 3.406 839 HA3 GLY 110 HA3 GLY 110 82.826 -5.935 4.486 840 H LEU 111 H LEU 111 86.188 -5.747 4.014 841 HA LEU 111 HA LEU 111 87.018 -5.671 6.818 842 HB2 LEU 111 HB2 LEU 111 88.918 -4.187 5.597 843 HB3 LEU 111 HB3 LEU 111 88.870 -5.961 5.465 844 HG LEU 111 HG LEU 111 87.263 -4.323 3.510 845 HD11 LEU 111 HD11 LEU 111 89.497 -3.246 3.534 846 HD12 LEU 111 HD12 LEU 111 90.265 -4.837 3.312 847 HD13 LEU 111 HD13 LEU 111 89.241 -4.156 2.025 848 HD21 LEU 111 HD21 LEU 111 88.918 -6.620 2.642 849 HD22 LEU 111 HD22 LEU 111 87.190 -6.294 2.369 850 HD23 LEU 111 HD23 LEU 111 87.726 -7.023 3.901 851 H LYS 112 H LYS 112 87.939 -2.843 5.069 852 HA LYS 112 HA LYS 112 85.948 -0.948 5.564 853 HB2 LYS 112 HB3 LYS 112 87.070 -1.960 8.090 854 HB3 LYS 112 HB2 LYS 112 87.256 -0.198 7.927 855 HG2 LYS 112 HG2 LYS 112 84.948 0.173 7.824 856 HG3 LYS 112 HG3 LYS 112 84.605 -1.472 7.237 857 HD2 LYS 112 HD3 LYS 112 85.156 -2.405 9.442 858 HD3 LYS 112 HD2 LYS 112 85.604 -0.789 10.038 859 HE2 LYS 112 HE2 LYS 112 82.839 -1.560 9.004 860 HE3 LYS 112 HE3 LYS 112 83.289 -1.457 10.723 861 HZ1 LYS 112 HZ1 LYS 112 82.272 0.579 9.946 862 HZ2 LYS 112 HZ2 LYS 112 83.841 0.857 10.372 863 HZ3 LYS 112 HZ3 LYS 112 83.424 0.761 8.779 864 H TYR 113 H TYR 113 86.780 0.639 4.318 865 HA TYR 113 HA TYR 113 89.755 1.021 4.294 866 HB2 TYR 113 HB2 TYR 113 88.824 2.803 2.462 867 HB3 TYR 113 HB3 TYR 113 89.123 1.089 2.082 868 HD1 TYR 113 HD1 TYR 113 87.238 -0.535 2.075 869 HD2 TYR 113 HD2 TYR 113 86.586 3.676 2.608 870 HE1 TYR 113 HE1 TYR 113 84.831 -0.844 1.564 871 HE2 TYR 113 HE2 TYR 113 84.179 3.369 2.101 872 HH TYR 113 HH TYR 113 82.914 0.707 0.633 873 H LYS 114 H LYS 114 90.447 2.341 5.920 874 HA LYS 114 HA LYS 114 88.811 4.837 6.436 875 HB2 LYS 114 HB3 LYS 114 90.452 3.036 8.213 876 HB3 LYS 114 HB2 LYS 114 90.333 4.764 8.621 877 HG2 LYS 114 HG2 LYS 114 87.896 4.638 8.659 878 HG3 LYS 114 HG3 LYS 114 87.938 2.954 8.085 879 HD2 LYS 114 HD2 LYS 114 88.898 2.172 10.128 880 HD3 LYS 114 HD3 LYS 114 89.326 3.820 10.648 881 HE2 LYS 114 HE2 LYS 114 86.845 4.354 10.687 882 HE3 LYS 114 HE3 LYS 114 86.533 2.624 10.404 883 HZ1 LYS 114 HZ1 LYS 114 86.509 3.162 12.747 884 HZ2 LYS 114 HZ2 LYS 114 88.050 3.745 12.674 885 HZ3 LYS 114 HZ3 LYS 114 87.762 2.142 12.413 886 H LYS 115 H LYS 115 89.814 6.806 6.172 887 HA LYS 115 HA LYS 115 92.275 6.935 4.662 888 HB2 LYS 115 HB2 LYS 115 90.587 8.940 6.170 889 HB3 LYS 115 HB3 LYS 115 92.173 9.426 5.525 890 HG2 LYS 115 HG2 LYS 115 91.515 8.769 3.270 891 HG3 LYS 115 HG3 LYS 115 89.982 8.095 3.873 892 HD2 LYS 115 HD2 LYS 115 89.110 10.238 4.397 893 HD3 LYS 115 HD3 LYS 115 90.718 11.000 4.353 894 HE2 LYS 115 HE2 LYS 115 89.275 11.486 2.324 895 HE3 LYS 115 HE3 LYS 115 90.848 10.743 1.945 896 HZ1 LYS 115 HZ1 LYS 115 88.666 9.800 0.943 897 HZ2 LYS 115 HZ2 LYS 115 88.541 9.014 2.387 898 HZ3 LYS 115 HZ3 LYS 115 89.861 8.773 1.429 899 H GLY 116 H GLY 116 94.248 6.392 5.436 900 HA2 GLY 116 HA2 GLY 116 94.772 6.718 8.374 901 HA3 GLY 116 HA3 GLY 116 95.787 5.812 7.226 902 H GLY 117 H GLY 117 95.960 8.390 9.154 903 HA2 GLY 117 HA2 GLY 117 98.203 9.569 7.782 904 HA3 GLY 117 HA3 GLY 117 96.769 10.578 7.474 905 H VAL 118 H VAL 118 97.426 8.703 10.434 906 HA VAL 118 HA VAL 118 96.649 10.637 12.287 907 HB VAL 118 HB VAL 118 99.113 8.863 12.586 908 HG11 VAL 118 HG11 VAL 118 98.833 10.574 14.359 909 HG12 VAL 118 HG12 VAL 118 98.513 8.941 14.990 910 HG13 VAL 118 HG13 VAL 118 97.158 10.032 14.617 911 HG21 VAL 118 HG21 VAL 118 97.519 7.199 13.504 912 HG22 VAL 118 HG22 VAL 118 97.134 7.588 11.810 913 HG23 VAL 118 HG23 VAL 118 96.164 8.290 13.128 914 H ALA 119 H ALA 119 99.444 10.734 10.206 915 HA ALA 119 HA ALA 119 101.180 12.455 11.659 916 HB1 ALA 119 HB1 ALA 119 101.960 13.252 9.445 917 HB2 ALA 119 HB2 ALA 119 100.518 12.542 8.681 918 HB3 ALA 119 HB3 ALA 119 101.732 11.487 9.444 919 H SER 120 H SER 120 98.022 13.087 10.324 920 HA SER 120 HA SER 120 98.290 15.978 10.112 921 HB2 SER 120 HB2 SER 120 96.429 14.444 9.155 922 HB3 SER 120 HB3 SER 120 95.704 14.541 10.778 923 HG SER 120 HG SER 120 94.942 16.212 9.361 924 H GLY 121 H GLY 121 98.809 14.158 12.694 925 HA2 GLY 121 HA3 GLY 121 97.200 15.624 14.701 926 HA3 GLY 121 HA2 GLY 121 98.482 14.435 15.039 927 H PHE 122 H PHE 122 100.292 15.980 13.114 928 HA PHE 122 HA PHE 122 101.784 17.458 15.007 929 HB2 PHE 122 HB2 PHE 122 102.330 16.820 12.529 930 HB3 PHE 122 HB3 PHE 122 101.574 18.381 12.127 931 HD1 PHE 122 HD1 PHE 122 102.516 20.496 13.054 932 HD2 PHE 122 HD2 PHE 122 104.475 16.715 13.604 933 HE1 PHE 122 HE1 PHE 122 104.607 21.671 13.683 934 HE2 PHE 122 HE2 PHE 122 106.566 17.890 14.236 935 HZ PHE 122 HZ PHE 122 106.632 20.368 14.273 936 H LYS 123 H LYS 123 98.754 18.274 13.547 937 HA LYS 123 HA LYS 123 98.990 21.175 13.755 938 HB2 LYS 123 HB3 LYS 123 97.230 19.733 12.470 939 HB3 LYS 123 HB2 LYS 123 96.386 19.648 14.035 940 HG2 LYS 123 HG3 LYS 123 96.593 22.211 14.116 941 HG3 LYS 123 HG2 LYS 123 97.071 22.122 12.404 942 HD2 LYS 123 HD2 LYS 123 94.929 20.740 12.039 943 HD3 LYS 123 HD3 LYS 123 94.441 21.268 13.668 944 HE2 LYS 123 HE2 LYS 123 95.015 23.007 11.235 945 HE3 LYS 123 HE3 LYS 123 93.481 22.848 12.125 946 HZ1 LYS 123 HZ1 LYS 123 94.355 24.746 13.012 947 HZ2 LYS 123 HZ2 LYS 123 95.923 24.247 12.904 948 HZ3 LYS 123 HZ3 LYS 123 94.945 23.641 14.085 949 H HIS 124 H HIS 124 97.727 18.624 15.933 950 HA HIS 124 HA HIS 124 97.249 18.721 18.241 951 HB2 HIS 124 HB2 HIS 124 99.438 20.745 17.849 952 HB3 HIS 124 HB3 HIS 124 98.583 20.734 19.410 953 HD2 HIS 124 HD2 HIS 124 101.649 19.123 18.120 954 HE1 HIS 124 HE1 HIS 124 99.936 16.122 20.549 955 HE2 HIS 124 HE2 HIS 124 102.068 16.835 19.339 956 H VAL 125 H VAL 125 95.587 19.571 19.460 957 HA VAL 125 HA VAL 125 94.738 22.398 18.867 958 HB VAL 125 HB VAL 125 92.771 20.074 18.923 959 HG11 VAL 125 HG11 VAL 125 91.885 22.314 19.516 960 HG12 VAL 125 HG12 VAL 125 91.255 21.774 17.942 961 HG13 VAL 125 HG13 VAL 125 92.563 22.980 18.010 962 HG21 VAL 125 HG21 VAL 125 92.643 20.575 16.402 963 HG22 VAL 125 HG22 VAL 125 94.182 21.446 16.602 964 HG23 VAL 125 HG23 VAL 125 94.093 19.704 16.957 965 H VAL 126 H VAL 126 94.159 23.459 20.713 966 HA VAL 126 HA VAL 126 94.020 21.799 23.222 967 HB VAL 126 HB VAL 126 94.400 24.786 22.728 968 HG11 VAL 126 HG11 VAL 126 93.061 24.387 24.779 969 HG12 VAL 126 HG12 VAL 126 94.284 23.227 25.350 970 HG13 VAL 126 HG13 VAL 126 94.700 24.949 25.186 971 HG21 VAL 126 HG21 VAL 126 96.368 23.347 22.270 972 HG22 VAL 126 HG22 VAL 126 96.213 22.620 23.887 973 HG23 VAL 126 HG23 VAL 126 96.629 24.343 23.723 974 HA PRO 127 HA PRO 127 89.517 22.091 22.820 975 HB2 PRO 127 HB3 PRO 127 89.826 21.491 25.760 976 HB3 PRO 127 HB2 PRO 127 88.742 20.733 24.558 977 HG2 PRO 127 HG2 PRO 127 90.989 19.532 25.414 978 HG3 PRO 127 HG3 PRO 127 90.404 19.365 23.736 979 HD2 PRO 127 HD3 PRO 127 92.738 20.910 24.789 980 HD3 PRO 127 HD2 PRO 127 92.480 20.211 23.162 981 H ASN 128 H ASN 128 88.032 23.722 23.283 982 HA ASN 128 HA ASN 128 89.053 26.219 24.347 983 HB2 ASN 128 HB2 ASN 128 86.542 26.828 24.370 984 HB3 ASN 128 HB3 ASN 128 87.240 26.360 22.801 985 HD21 ASN 128 HD21 ASN 128 86.780 24.140 22.000 986 HD22 ASN 128 HD22 ASN 128 85.390 23.271 22.612 987 H GLU 129 H GLU 129 89.149 26.956 26.418 988 HA GLU 129 HA GLU 129 88.171 25.131 28.565 989 HB2 GLU 129 HB2 GLU 129 89.756 27.735 28.634 990 HB3 GLU 129 HB3 GLU 129 89.335 26.777 30.074 991 HG2 GLU 129 HG3 GLU 129 91.479 25.966 29.552 992 HG3 GLU 129 HG2 GLU 129 90.425 24.786 28.737 993 H VAL 130 H VAL 130 87.134 27.969 26.887 994 HA VAL 130 HA VAL 130 85.698 29.416 28.840 995 HB VAL 130 HB VAL 130 84.632 28.686 26.078 996 HG11 VAL 130 HG11 VAL 130 83.038 29.857 27.575 997 HG12 VAL 130 HG12 VAL 130 83.564 30.917 26.245 998 HG13 VAL 130 HG13 VAL 130 84.252 31.125 27.874 999 HG21 VAL 130 HG21 VAL 130 85.866 30.694 25.301 1000 HG22 VAL 130 HG22 VAL 130 86.982 29.473 25.958 1001 HG23 VAL 130 HG23 VAL 130 86.554 30.901 26.930 1002 H VAL 131 H VAL 131 84.398 26.663 26.900 1003 HA VAL 131 HA VAL 131 81.906 26.439 28.248 1004 HB VAL 131 HB VAL 131 82.568 25.121 26.229 1005 HG11 VAL 131 HG11 VAL 131 84.121 23.358 26.319 1006 HG12 VAL 131 HG12 VAL 131 84.878 24.580 27.368 1007 HG13 VAL 131 HG13 VAL 131 83.998 23.211 28.088 1008 HG21 VAL 131 HG21 VAL 131 80.637 24.416 27.617 1009 HG22 VAL 131 HG22 VAL 131 81.725 23.442 28.635 1010 HG23 VAL 131 HG23 VAL 131 81.477 23.006 26.927 1011 H VAL 132 H VAL 132 85.117 25.198 29.193 1012 HA VAL 132 HA VAL 132 84.108 23.684 31.480 1013 HB VAL 132 HB VAL 132 86.882 24.898 31.142 1014 HG11 VAL 132 HG11 VAL 132 86.361 23.920 33.360 1015 HG12 VAL 132 HG12 VAL 132 87.549 22.924 32.486 1016 HG13 VAL 132 HG13 VAL 132 85.847 22.409 32.573 1017 HG21 VAL 132 HG21 VAL 132 87.465 22.777 29.993 1018 HG22 VAL 132 HG22 VAL 132 85.764 22.262 30.082 1019 HG23 VAL 132 HG23 VAL 132 86.217 23.670 29.091 1020 H GLN 133 H GLN 133 84.966 27.055 30.922 1021 HA GLN 133 HA GLN 133 83.650 27.888 33.375 1022 HB2 GLN 133 HB2 GLN 133 85.661 28.737 34.584 1023 HB3 GLN 133 HB3 GLN 133 85.666 26.962 34.451 1024 HG2 GLN 133 HG2 GLN 133 87.119 27.193 32.396 1025 HG3 GLN 133 HG3 GLN 133 87.220 28.939 32.726 1026 HE21 GLN 133 HE21 GLN 133 87.309 26.095 34.981 1027 HE22 GLN 133 HE22 GLN 133 88.859 26.519 35.674 Start of MODEL 20 1 H1 GLU 1 H1 GLU 1 112.348 -8.202 21.108 2 H2 GLU 1 H2 GLU 1 111.904 -8.283 22.695 3 H3 GLU 1 H3 GLU 1 112.942 -7.106 22.188 4 HA GLU 1 HA GLU 1 114.746 -8.422 22.177 5 HB2 GLU 1 HB3 GLU 1 112.744 -9.807 24.006 6 HB3 GLU 1 HB2 GLU 1 114.464 -10.260 23.932 7 HG2 GLU 1 HG2 GLU 1 114.185 -8.666 25.746 8 HG3 GLU 1 HG3 GLU 1 115.042 -7.845 24.419 9 H HIS 2 H HIS 2 112.042 -10.812 22.217 10 HA HIS 2 HA HIS 2 113.305 -12.061 19.777 11 HB2 HIS 2 HB2 HIS 2 113.868 -13.200 22.083 12 HB3 HIS 2 HB3 HIS 2 112.190 -13.788 21.996 13 HD2 HIS 2 HD2 HIS 2 114.666 -15.968 21.551 14 HE1 HIS 2 HE1 HIS 2 113.531 -15.828 17.486 15 HE2 HIS 2 HE2 HIS 2 114.824 -17.178 19.225 16 HA PRO 3 HA PRO 3 108.677 -11.588 19.494 17 HB2 PRO 3 HB2 PRO 3 108.647 -10.189 17.130 18 HB3 PRO 3 HB3 PRO 3 108.836 -9.401 18.723 19 HG2 PRO 3 HG3 PRO 3 110.895 -10.051 16.656 20 HG3 PRO 3 HG2 PRO 3 110.758 -8.626 17.721 21 HD2 PRO 3 HD3 PRO 3 112.470 -10.785 18.168 22 HD3 PRO 3 HD2 PRO 3 111.898 -9.672 19.447 23 H GLU 4 H GLU 4 107.335 -12.943 18.294 24 HA GLU 4 HA GLU 4 108.492 -15.140 16.871 25 HB2 GLU 4 HB2 GLU 4 105.687 -13.951 16.706 26 HB3 GLU 4 HB3 GLU 4 106.151 -15.528 16.024 27 HG2 GLU 4 HG2 GLU 4 106.655 -16.426 18.184 28 HG3 GLU 4 HG3 GLU 4 106.618 -14.816 18.943 29 H PHE 5 H PHE 5 107.868 -11.887 15.849 30 HA PHE 5 HA PHE 5 107.333 -12.028 13.122 31 HB2 PHE 5 HB3 PHE 5 107.817 -9.905 14.260 32 HB3 PHE 5 HB2 PHE 5 109.522 -10.375 14.459 33 HD1 PHE 5 HD1 PHE 5 111.062 -9.702 12.840 34 HD2 PHE 5 HD2 PHE 5 106.913 -10.013 11.770 35 HE1 PHE 5 HE1 PHE 5 111.574 -8.798 10.590 36 HE2 PHE 5 HE2 PHE 5 107.427 -9.109 9.519 37 HZ PHE 5 HZ PHE 5 109.757 -8.503 8.928 38 H LEU 6 H LEU 6 110.126 -13.319 14.770 39 HA LEU 6 HA LEU 6 111.812 -13.506 12.371 40 HB2 LEU 6 HB3 LEU 6 112.665 -13.546 14.753 41 HB3 LEU 6 HB2 LEU 6 111.954 -15.169 14.923 42 HG LEU 6 HG LEU 6 113.313 -15.870 12.892 43 HD11 LEU 6 HD11 LEU 6 113.702 -13.592 11.990 44 HD12 LEU 6 HD12 LEU 6 114.669 -13.189 13.429 45 HD13 LEU 6 HD13 LEU 6 115.242 -14.433 12.292 46 HD21 LEU 6 HD21 LEU 6 115.427 -16.064 14.174 47 HD22 LEU 6 HD22 LEU 6 114.018 -16.394 15.209 48 HD23 LEU 6 HD23 LEU 6 114.849 -14.824 15.312 49 H LYS 7 H LYS 7 109.404 -15.579 13.955 50 HA LYS 7 HA LYS 7 109.933 -17.669 11.837 51 HB2 LYS 7 HB3 LYS 7 108.212 -18.930 13.448 52 HB3 LYS 7 HB2 LYS 7 109.946 -18.839 13.842 53 HG2 LYS 7 HG2 LYS 7 109.572 -16.945 15.323 54 HG3 LYS 7 HG3 LYS 7 107.870 -16.829 14.818 55 HD2 LYS 7 HD3 LYS 7 107.718 -18.016 16.846 56 HD3 LYS 7 HD2 LYS 7 107.723 -19.322 15.636 57 HE2 LYS 7 HE2 LYS 7 109.294 -19.774 17.529 58 HE3 LYS 7 HE3 LYS 7 110.135 -19.657 15.965 59 HZ1 LYS 7 HZ1 LYS 7 110.954 -18.334 18.039 60 HZ2 LYS 7 HZ2 LYS 7 109.823 -17.236 17.552 61 HZ3 LYS 7 HZ3 LYS 7 111.043 -17.671 16.531 62 H ALA 8 H ALA 8 107.336 -15.752 13.382 63 HA ALA 8 HA ALA 8 105.196 -15.186 12.557 64 HB1 ALA 8 HB1 ALA 8 106.890 -15.493 10.094 65 HB2 ALA 8 HB2 ALA 8 105.992 -14.075 10.687 66 HB3 ALA 8 HB3 ALA 8 105.126 -15.401 9.875 67 H GLY 9 H GLY 9 103.224 -16.229 12.130 68 HA2 GLY 9 HA3 GLY 9 101.806 -18.111 11.951 69 HA3 GLY 9 HA2 GLY 9 102.902 -18.660 10.661 70 H LYS 10 H LYS 10 103.464 -18.177 14.181 71 HA LYS 10 HA LYS 10 105.176 -20.370 14.568 72 HB2 LYS 10 HB2 LYS 10 104.056 -20.489 16.924 73 HB3 LYS 10 HB3 LYS 10 104.840 -18.965 16.445 74 HG2 LYS 10 HG3 LYS 10 102.746 -17.933 15.926 75 HG3 LYS 10 HG2 LYS 10 101.885 -19.491 15.961 76 HD2 LYS 10 HD2 LYS 10 102.314 -19.692 18.382 77 HD3 LYS 10 HD3 LYS 10 103.223 -18.162 18.361 78 HE2 LYS 10 HE2 LYS 10 100.266 -18.537 17.710 79 HE3 LYS 10 HE3 LYS 10 100.947 -17.724 19.140 80 HZ1 LYS 10 HZ1 LYS 10 100.588 -15.969 17.762 81 HZ2 LYS 10 HZ2 LYS 10 100.857 -16.816 16.373 82 HZ3 LYS 10 HZ3 LYS 10 102.130 -16.335 17.304 83 H GLU 11 H GLU 11 101.694 -20.392 14.040 84 HA GLU 11 HA GLU 11 101.837 -23.369 13.796 85 HB2 GLU 11 HB2 GLU 11 100.277 -21.872 15.894 86 HB3 GLU 11 HB3 GLU 11 99.536 -23.312 15.156 87 HG2 GLU 11 HG2 GLU 11 101.568 -24.633 15.728 88 HG3 GLU 11 HG3 GLU 11 102.274 -23.193 16.500 89 HA PRO 12 HA PRO 12 99.222 -22.974 10.279 90 HB2 PRO 12 HB2 PRO 12 97.220 -24.642 11.807 91 HB3 PRO 12 HB3 PRO 12 97.838 -24.848 10.143 92 HG2 PRO 12 HG2 PRO 12 98.708 -26.338 12.231 93 HG3 PRO 12 HG3 PRO 12 99.735 -25.917 10.834 94 HD2 PRO 12 HD3 PRO 12 99.889 -24.952 13.634 95 HD3 PRO 12 HD2 PRO 12 101.129 -24.886 12.347 96 H GLY 13 H GLY 13 97.917 -21.283 9.715 97 HA2 GLY 13 HA3 GLY 13 95.398 -20.584 10.471 98 HA3 GLY 13 HA2 GLY 13 96.311 -19.984 11.875 99 H LEU 14 H LEU 14 95.415 -17.857 11.093 100 HA LEU 14 HA LEU 14 97.225 -16.735 8.939 101 HB2 LEU 14 HB2 LEU 14 94.908 -16.866 8.117 102 HB3 LEU 14 HB3 LEU 14 94.326 -16.013 9.567 103 HG LEU 14 HG LEU 14 96.427 -14.785 7.750 104 HD11 LEU 14 HD11 LEU 14 94.580 -13.600 6.593 105 HD12 LEU 14 HD12 LEU 14 93.393 -14.551 7.518 106 HD13 LEU 14 HD13 LEU 14 94.466 -15.360 6.351 107 HD21 LEU 14 HD21 LEU 14 94.730 -13.958 10.061 108 HD22 LEU 14 HD22 LEU 14 96.331 -13.367 9.553 109 HD23 LEU 14 HD23 LEU 14 94.863 -12.767 8.745 110 H GLN 15 H GLN 15 98.504 -15.098 9.661 111 HA GLN 15 HA GLN 15 97.638 -13.731 12.224 112 HB2 GLN 15 HB3 GLN 15 100.462 -14.255 11.191 113 HB3 GLN 15 HB2 GLN 15 100.046 -13.414 12.703 114 HG2 GLN 15 HG2 GLN 15 98.629 -15.652 13.124 115 HG3 GLN 15 HG3 GLN 15 99.842 -16.335 12.017 116 HE21 GLN 15 HE21 GLN 15 102.010 -16.585 12.779 117 HE22 GLN 15 HE22 GLN 15 102.478 -16.202 14.420 118 H ILE 16 H ILE 16 97.644 -11.495 12.240 119 HA ILE 16 HA ILE 16 98.365 -10.197 9.604 120 HB ILE 16 HB ILE 16 96.700 -8.781 11.665 121 HG12 ILE 16 HG13 ILE 16 95.787 -11.164 10.001 122 HG13 ILE 16 HG12 ILE 16 95.656 -10.952 11.764 123 HG21 ILE 16 HG21 ILE 16 97.478 -8.053 9.232 124 HG22 ILE 16 HG22 ILE 16 95.833 -7.677 9.797 125 HG23 ILE 16 HG23 ILE 16 96.108 -9.067 8.719 126 HD11 ILE 16 HD11 ILE 16 93.495 -10.373 11.087 127 HD12 ILE 16 HD12 ILE 16 94.055 -9.659 9.556 128 HD13 ILE 16 HD13 ILE 16 94.287 -8.779 11.086 129 H TRP 17 H TRP 17 99.788 -8.469 9.592 130 HA TRP 17 HA TRP 17 100.705 -7.403 12.252 131 HB2 TRP 17 HB2 TRP 17 102.589 -8.459 10.093 132 HB3 TRP 17 HB3 TRP 17 103.073 -7.687 11.622 133 HD1 TRP 17 HD1 TRP 17 101.306 -9.045 13.707 134 HE1 TRP 17 HE1 TRP 17 101.467 -11.560 14.251 135 HE3 TRP 17 HE3 TRP 17 103.489 -10.680 9.386 136 HZ2 TRP 17 HZ2 TRP 17 102.425 -13.956 12.964 137 HZ3 TRP 17 HZ3 TRP 17 104.014 -13.079 9.074 138 HH2 TRP 17 HH2 TRP 17 103.487 -14.717 10.857 139 H ARG 18 H ARG 18 100.268 -5.264 12.011 140 HA ARG 18 HA ARG 18 100.369 -4.011 9.326 141 HB2 ARG 18 HB3 ARG 18 98.653 -3.337 10.983 142 HB3 ARG 18 HB2 ARG 18 99.935 -2.800 12.095 143 HG2 ARG 18 HG3 ARG 18 100.171 -1.666 9.371 144 HG3 ARG 18 HG2 ARG 18 98.679 -1.191 10.218 145 HD2 ARG 18 HD2 ARG 18 101.516 -0.925 11.313 146 HD3 ARG 18 HD3 ARG 18 100.507 0.407 10.698 147 HE ARG 18 HE ARG 18 100.210 -0.960 13.317 148 HH11 ARG 18 HH11 ARG 18 98.635 -0.036 14.650 149 HH12 ARG 18 HH12 ARG 18 97.493 1.113 13.991 150 HH21 ARG 18 HH21 ARG 18 98.813 0.962 10.771 151 HH22 ARG 18 HH22 ARG 18 97.594 1.676 11.803 152 H VAL 19 H VAL 19 101.976 -2.674 8.539 153 HA VAL 19 HA VAL 19 104.507 -2.644 10.144 154 HB VAL 19 HB VAL 19 104.392 -1.372 7.446 155 HG11 VAL 19 HG11 VAL 19 106.505 -1.697 8.705 156 HG12 VAL 19 HG12 VAL 19 106.505 -2.643 7.197 157 HG13 VAL 19 HG13 VAL 19 106.204 -3.451 8.754 158 HG21 VAL 19 HG21 VAL 19 104.518 -3.730 6.425 159 HG22 VAL 19 HG22 VAL 19 103.836 -4.317 7.960 160 HG23 VAL 19 HG23 VAL 19 102.908 -3.183 6.950 161 H GLU 20 H GLU 20 105.492 -0.746 10.835 162 HA GLU 20 HA GLU 20 104.383 1.883 10.041 163 HB2 GLU 20 HB3 GLU 20 102.721 1.286 11.718 164 HB3 GLU 20 HB2 GLU 20 103.991 0.788 12.861 165 HG2 GLU 20 HG2 GLU 20 103.053 3.092 13.313 166 HG3 GLU 20 HG3 GLU 20 104.811 3.070 13.038 167 H LYS 21 H LYS 21 106.132 3.197 9.943 168 HA LYS 21 HA LYS 21 108.407 3.832 10.251 169 HB2 LYS 21 HB2 LYS 21 107.022 4.659 12.318 170 HB3 LYS 21 HB3 LYS 21 107.885 3.377 13.201 171 HG2 LYS 21 HG2 LYS 21 109.176 5.410 13.437 172 HG3 LYS 21 HG3 LYS 21 110.054 4.353 12.307 173 HD2 LYS 21 HD2 LYS 21 109.634 5.714 10.493 174 HD3 LYS 21 HD3 LYS 21 108.049 6.234 11.116 175 HE2 LYS 21 HE2 LYS 21 110.726 7.112 12.287 176 HE3 LYS 21 HE3 LYS 21 109.781 8.067 11.120 177 HZ1 LYS 21 HZ1 LYS 21 109.306 8.710 13.388 178 HZ2 LYS 21 HZ2 LYS 21 107.960 8.062 12.690 179 HZ3 LYS 21 HZ3 LYS 21 108.835 7.176 13.771 180 H PHE 22 H PHE 22 107.824 0.873 10.041 181 HA PHE 22 HA PHE 22 109.149 -1.084 10.146 182 HB2 PHE 22 HB2 PHE 22 111.399 0.452 11.446 183 HB3 PHE 22 HB3 PHE 22 111.473 -0.845 10.229 184 HD1 PHE 22 HD1 PHE 22 109.666 0.009 8.138 185 HD2 PHE 22 HD2 PHE 22 112.336 2.383 10.524 186 HE1 PHE 22 HE1 PHE 22 109.762 1.712 6.335 187 HE2 PHE 22 HE2 PHE 22 112.437 4.081 8.719 188 HZ PHE 22 HZ PHE 22 111.146 3.748 6.628 189 H ASP 23 H ASP 23 107.349 -0.587 12.233 190 HA ASP 23 HA ASP 23 108.921 -1.554 14.637 191 HB2 ASP 23 HB2 ASP 23 107.601 0.712 14.712 192 HB3 ASP 23 HB3 ASP 23 106.156 -0.324 14.794 193 H LEU 24 H LEU 24 106.267 -2.128 12.416 194 HA LEU 24 HA LEU 24 104.841 -3.998 12.191 195 HB2 LEU 24 HB2 LEU 24 107.294 -5.085 13.550 196 HB3 LEU 24 HB3 LEU 24 105.855 -6.128 13.464 197 HG LEU 24 HG LEU 24 106.738 -4.673 10.976 198 HD11 LEU 24 HD11 LEU 24 108.815 -5.687 11.877 199 HD12 LEU 24 HD12 LEU 24 107.980 -7.251 12.040 200 HD13 LEU 24 HD13 LEU 24 108.259 -6.555 10.426 201 HD21 LEU 24 HD21 LEU 24 104.631 -5.981 11.029 202 HD22 LEU 24 HD22 LEU 24 105.817 -6.726 9.931 203 HD23 LEU 24 HD23 LEU 24 105.539 -7.423 11.545 204 H VAL 25 H VAL 25 102.915 -4.247 13.199 205 HA VAL 25 HA VAL 25 102.906 -4.721 16.164 206 HB VAL 25 HB VAL 25 101.221 -2.557 14.827 207 HG11 VAL 25 HG11 VAL 25 100.175 -3.657 16.788 208 HG12 VAL 25 HG12 VAL 25 100.645 -1.983 17.169 209 HG13 VAL 25 HG13 VAL 25 101.641 -3.341 17.747 210 HG21 VAL 25 HG21 VAL 25 102.654 -0.962 16.041 211 HG22 VAL 25 HG22 VAL 25 103.641 -1.958 14.946 212 HG23 VAL 25 HG23 VAL 25 103.624 -2.305 16.692 213 HA PRO 26 HA PRO 26 99.816 -7.521 14.497 214 HB2 PRO 26 HB3 PRO 26 99.204 -8.788 16.852 215 HB3 PRO 26 HB2 PRO 26 100.711 -9.110 15.946 216 HG2 PRO 26 HG2 PRO 26 100.252 -7.432 18.384 217 HG3 PRO 26 HG3 PRO 26 101.628 -8.490 17.967 218 HD2 PRO 26 HD3 PRO 26 101.636 -5.717 17.700 219 HD3 PRO 26 HD2 PRO 26 102.702 -6.820 16.777 220 H VAL 27 H VAL 27 97.748 -6.930 14.025 221 HA VAL 27 HA VAL 27 96.254 -5.295 16.061 222 HB VAL 27 HB VAL 27 95.402 -5.943 13.213 223 HG11 VAL 27 HG11 VAL 27 93.693 -4.998 14.740 224 HG12 VAL 27 HG12 VAL 27 94.141 -3.826 13.478 225 HG13 VAL 27 HG13 VAL 27 94.787 -3.648 15.127 226 HG21 VAL 27 HG21 VAL 27 96.386 -3.507 12.882 227 HG22 VAL 27 HG22 VAL 27 97.398 -3.941 14.280 228 HG23 VAL 27 HG23 VAL 27 97.467 -4.918 12.794 229 HA PRO 28 HA PRO 28 93.996 -8.842 17.554 230 HB2 PRO 28 HB3 PRO 28 91.728 -6.852 17.485 231 HB3 PRO 28 HB2 PRO 28 92.230 -7.952 18.802 232 HG2 PRO 28 HG3 PRO 28 92.806 -5.313 18.793 233 HG3 PRO 28 HG2 PRO 28 93.884 -6.533 19.524 234 HD2 PRO 28 HD2 PRO 28 94.263 -4.924 17.049 235 HD3 PRO 28 HD3 PRO 28 95.475 -5.783 18.045 236 H THR 29 H THR 29 93.744 -10.272 15.837 237 HA THR 29 HA THR 29 92.499 -9.808 13.350 238 HB THR 29 HB THR 29 92.224 -12.371 14.979 239 HG1 THR 29 HG1 THR 29 94.251 -12.876 13.973 240 HG21 THR 29 HG21 THR 29 92.250 -13.433 12.739 241 HG22 THR 29 HG22 THR 29 92.368 -11.828 11.979 242 HG23 THR 29 HG23 THR 29 90.903 -12.279 12.884 243 H ASN 30 H ASN 30 90.971 -10.669 16.464 244 HA ASN 30 HA ASN 30 88.297 -10.994 15.407 245 HB2 ASN 30 HB2 ASN 30 89.202 -11.592 17.754 246 HB3 ASN 30 HB3 ASN 30 88.950 -9.877 18.158 247 HD21 ASN 30 HD21 ASN 30 87.038 -12.346 16.281 248 HD22 ASN 30 HD22 ASN 30 85.546 -12.039 17.141 249 H LEU 31 H LEU 31 89.837 -8.148 17.008 250 HA LEU 31 HA LEU 31 87.558 -6.451 16.135 251 HB2 LEU 31 HB2 LEU 31 89.096 -6.303 18.321 252 HB3 LEU 31 HB3 LEU 31 90.107 -5.303 17.251 253 HG LEU 31 HG LEU 31 87.859 -4.090 16.662 254 HD11 LEU 31 HD11 LEU 31 86.390 -5.736 17.797 255 HD12 LEU 31 HD12 LEU 31 87.178 -5.366 19.350 256 HD13 LEU 31 HD13 LEU 31 86.218 -4.118 18.519 257 HD21 LEU 31 HD21 LEU 31 89.741 -3.077 17.920 258 HD22 LEU 31 HD22 LEU 31 88.173 -2.567 18.590 259 HD23 LEU 31 HD23 LEU 31 89.132 -3.814 19.421 260 H TYR 32 H TYR 32 89.827 -7.797 14.350 261 HA TYR 32 HA TYR 32 90.961 -5.376 13.055 262 HB2 TYR 32 HB2 TYR 32 92.306 -7.431 13.152 263 HB3 TYR 32 HB3 TYR 32 91.031 -8.334 12.301 264 HD1 TYR 32 HD1 TYR 32 92.869 -5.073 11.845 265 HD2 TYR 32 HD2 TYR 32 91.441 -8.704 10.048 266 HE1 TYR 32 HE1 TYR 32 93.826 -4.373 9.669 267 HE2 TYR 32 HE2 TYR 32 92.399 -8.003 7.870 268 HH TYR 32 HH TYR 32 94.662 -5.864 7.438 269 H GLY 33 H GLY 33 90.120 -7.728 10.766 270 HA2 GLY 33 HA3 GLY 33 88.598 -7.652 8.961 271 HA3 GLY 33 HA2 GLY 33 87.400 -7.097 10.154 272 H ASP 34 H ASP 34 89.816 -4.882 10.405 273 HA ASP 34 HA ASP 34 88.494 -3.118 8.329 274 HB2 ASP 34 HB3 ASP 34 88.077 -2.208 10.504 275 HB3 ASP 34 HB2 ASP 34 89.749 -2.512 11.033 276 H PHE 35 H PHE 35 89.977 -1.392 7.426 277 HA PHE 35 HA PHE 35 92.871 -2.195 7.459 278 HB2 PHE 35 HB3 PHE 35 91.360 -1.783 4.849 279 HB3 PHE 35 HB2 PHE 35 93.027 -2.367 5.065 280 HD1 PHE 35 HD1 PHE 35 89.472 -3.204 5.933 281 HD2 PHE 35 HD2 PHE 35 93.448 -4.671 5.224 282 HE1 PHE 35 HE1 PHE 35 88.637 -5.535 6.074 283 HE2 PHE 35 HE2 PHE 35 92.611 -7.003 5.367 284 HZ PHE 35 HZ PHE 35 90.205 -7.434 5.786 285 H PHE 36 H PHE 36 93.988 -0.355 7.833 286 HA PHE 36 HA PHE 36 92.713 2.273 7.377 287 HB2 PHE 36 HB2 PHE 36 95.408 1.339 8.414 288 HB3 PHE 36 HB3 PHE 36 95.103 3.059 8.070 289 HD1 PHE 36 HD1 PHE 36 93.272 0.190 9.693 290 HD2 PHE 36 HD2 PHE 36 94.415 4.327 9.888 291 HE1 PHE 36 HE1 PHE 36 92.094 0.415 11.866 292 HE2 PHE 36 HE2 PHE 36 93.235 4.551 12.056 293 HZ PHE 36 HZ PHE 36 92.074 2.596 13.045 294 H THR 37 H THR 37 92.631 3.130 5.355 295 HA THR 37 HA THR 37 94.468 2.178 3.262 296 HB THR 37 HB THR 37 93.256 3.598 1.771 297 HG1 THR 37 HG1 THR 37 93.102 5.557 2.635 298 HG21 THR 37 HG21 THR 37 90.805 3.359 3.108 299 HG22 THR 37 HG22 THR 37 91.805 2.069 3.819 300 HG23 THR 37 HG23 THR 37 91.551 2.130 2.058 301 H GLY 38 H GLY 38 96.537 2.710 4.114 302 HA2 GLY 38 HA3 GLY 38 97.629 5.183 3.190 303 HA3 GLY 38 HA2 GLY 38 97.293 5.381 4.927 304 H ASP 39 H ASP 39 97.719 2.460 5.412 305 HA ASP 39 HA ASP 39 100.739 2.483 5.185 306 HB2 ASP 39 HB3 ASP 39 98.990 1.125 7.288 307 HB3 ASP 39 HB2 ASP 39 100.769 1.172 7.264 308 H ALA 40 H ALA 40 100.904 -0.281 6.134 309 HA ALA 40 HA ALA 40 99.487 -1.753 3.919 310 HB1 ALA 40 HB1 ALA 40 101.594 -2.924 3.340 311 HB2 ALA 40 HB2 ALA 40 102.474 -1.923 4.520 312 HB3 ALA 40 HB3 ALA 40 101.746 -1.170 3.081 313 H TYR 41 H TYR 41 98.904 -3.849 4.485 314 HA TYR 41 HA TYR 41 99.647 -4.641 7.311 315 HB2 TYR 41 HB3 TYR 41 97.157 -5.119 5.634 316 HB3 TYR 41 HB2 TYR 41 97.510 -6.076 7.092 317 HD1 TYR 41 HD1 TYR 41 96.779 -5.272 9.159 318 HD2 TYR 41 HD2 TYR 41 97.381 -2.496 5.936 319 HE1 TYR 41 HE1 TYR 41 95.907 -3.435 10.578 320 HE2 TYR 41 HE2 TYR 41 96.507 -0.660 7.354 321 HH TYR 41 HH TYR 41 96.210 -0.819 10.630 322 H VAL 42 H VAL 42 100.986 -6.357 7.451 323 HA VAL 42 HA VAL 42 101.269 -8.122 5.034 324 HB VAL 42 HB VAL 42 102.926 -7.804 7.574 325 HG11 VAL 42 HG11 VAL 42 102.938 -10.159 6.796 326 HG12 VAL 42 HG12 VAL 42 103.368 -9.615 5.157 327 HG13 VAL 42 HG13 VAL 42 104.511 -9.380 6.501 328 HG21 VAL 42 HG21 VAL 42 104.621 -6.941 5.980 329 HG22 VAL 42 HG22 VAL 42 103.475 -7.173 4.638 330 HG23 VAL 42 HG23 VAL 42 103.126 -5.977 5.909 331 H ILE 43 H ILE 43 100.179 -10.019 4.995 332 HA ILE 43 HA ILE 43 99.493 -11.263 7.672 333 HB ILE 43 HB ILE 43 97.839 -11.920 5.267 334 HG12 ILE 43 HG13 ILE 43 97.552 -9.293 6.787 335 HG13 ILE 43 HG12 ILE 43 98.169 -9.440 5.124 336 HG21 ILE 43 HG21 ILE 43 96.064 -11.961 6.960 337 HG22 ILE 43 HG22 ILE 43 97.466 -12.884 7.551 338 HG23 ILE 43 HG23 ILE 43 97.161 -11.241 8.164 339 HD11 ILE 43 HD11 ILE 43 95.755 -8.876 5.130 340 HD12 ILE 43 HD12 ILE 43 96.034 -10.485 4.423 341 HD13 ILE 43 HD13 ILE 43 95.416 -10.339 6.085 342 H LEU 44 H LEU 44 99.727 -13.486 7.849 343 HA LEU 44 HA LEU 44 100.995 -14.859 5.468 344 HB2 LEU 44 HB2 LEU 44 102.064 -14.404 8.167 345 HB3 LEU 44 HB3 LEU 44 102.009 -16.134 7.754 346 HG LEU 44 HG LEU 44 103.110 -15.516 5.532 347 HD11 LEU 44 HD11 LEU 44 102.988 -12.857 6.903 348 HD12 LEU 44 HD12 LEU 44 102.922 -13.249 5.168 349 HD13 LEU 44 HD13 LEU 44 104.485 -13.237 6.019 350 HD21 LEU 44 HD21 LEU 44 104.372 -16.510 7.424 351 HD22 LEU 44 HD22 LEU 44 104.636 -14.885 8.100 352 HD23 LEU 44 HD23 LEU 44 105.369 -15.330 6.540 353 H LYS 45 H LYS 45 99.878 -16.660 4.888 354 HA LYS 45 HA LYS 45 97.972 -17.794 6.939 355 HB2 LYS 45 HB2 LYS 45 97.326 -16.939 4.487 356 HB3 LYS 45 HB3 LYS 45 97.880 -18.568 4.031 357 HG2 LYS 45 HG3 LYS 45 96.354 -19.492 5.837 358 HG3 LYS 45 HG2 LYS 45 95.699 -17.849 6.034 359 HD2 LYS 45 HD3 LYS 45 94.198 -18.701 4.473 360 HD3 LYS 45 HD2 LYS 45 95.425 -18.013 3.382 361 HE2 LYS 45 HE2 LYS 45 96.547 -20.265 3.314 362 HE3 LYS 45 HE3 LYS 45 95.201 -20.921 4.277 363 HZ1 LYS 45 HZ1 LYS 45 94.601 -21.308 2.088 364 HZ2 LYS 45 HZ2 LYS 45 93.759 -19.939 2.454 365 HZ3 LYS 45 HZ3 LYS 45 95.133 -19.844 1.547 366 H THR 46 H THR 46 99.387 -19.184 8.035 367 HA THR 46 HA THR 46 101.124 -21.055 6.555 368 HB THR 46 HB THR 46 100.245 -21.141 9.475 369 HG1 THR 46 HG1 THR 46 101.353 -19.338 9.559 370 HG21 THR 46 HG21 THR 46 102.384 -22.359 9.766 371 HG22 THR 46 HG22 THR 46 102.688 -22.242 8.016 372 HG23 THR 46 HG23 THR 46 101.317 -23.204 8.619 373 H VAL 47 H VAL 47 99.942 -22.448 5.261 374 HA VAL 47 HA VAL 47 97.576 -23.831 6.472 375 HB VAL 47 HB VAL 47 98.476 -24.608 3.757 376 HG11 VAL 47 HG11 VAL 47 96.294 -25.257 4.740 377 HG12 VAL 47 HG12 VAL 47 95.861 -23.539 4.907 378 HG13 VAL 47 HG13 VAL 47 96.071 -24.250 3.289 379 HG21 VAL 47 HG21 VAL 47 97.560 -22.417 2.812 380 HG22 VAL 47 HG22 VAL 47 99.160 -22.306 3.585 381 HG23 VAL 47 HG23 VAL 47 97.711 -21.744 4.453 382 H GLN 48 H GLN 48 97.439 -26.231 6.133 383 HA GLN 48 HA GLN 48 100.183 -27.489 6.402 384 HB2 GLN 48 HB3 GLN 48 99.009 -27.427 8.582 385 HB3 GLN 48 HB2 GLN 48 97.603 -28.237 7.852 386 HG2 GLN 48 HG2 GLN 48 98.974 -30.209 7.329 387 HG3 GLN 48 HG3 GLN 48 100.423 -29.396 7.967 388 HE21 GLN 48 HE21 GLN 48 97.528 -31.192 8.827 389 HE22 GLN 48 HE22 GLN 48 97.797 -31.172 10.555 390 H LEU 49 H LEU 49 100.568 -29.000 4.862 391 HA LEU 49 HA LEU 49 98.543 -29.713 2.908 392 HB2 LEU 49 HB2 LEU 49 101.151 -31.153 3.569 393 HB3 LEU 49 HB3 LEU 49 100.214 -31.310 2.065 394 HG LEU 49 HG LEU 49 101.287 -28.641 3.061 395 HD11 LEU 49 HD11 LEU 49 103.176 -30.205 2.695 396 HD12 LEU 49 HD12 LEU 49 103.129 -28.951 1.433 397 HD13 LEU 49 HD13 LEU 49 102.540 -30.593 1.078 398 HD21 LEU 49 HD21 LEU 49 99.426 -28.585 1.419 399 HD22 LEU 49 HD22 LEU 49 100.943 -28.006 0.688 400 HD23 LEU 49 HD23 LEU 49 100.354 -29.648 0.334 401 H ARG 50 H ARG 50 100.280 -32.409 4.325 402 HA ARG 50 HA ARG 50 97.742 -33.367 5.627 403 HB2 ARG 50 HB2 ARG 50 99.392 -35.051 3.693 404 HB3 ARG 50 HB3 ARG 50 97.889 -35.532 4.517 405 HG2 ARG 50 HG2 ARG 50 96.715 -33.632 3.350 406 HG3 ARG 50 HG3 ARG 50 98.212 -33.324 2.438 407 HD2 ARG 50 HD2 ARG 50 96.840 -36.042 2.485 408 HD3 ARG 50 HD3 ARG 50 96.477 -34.800 1.262 409 HE ARG 50 HE ARG 50 98.872 -36.487 1.343 410 HH11 ARG 50 HH11 ARG 50 100.433 -36.042 -0.229 411 HH12 ARG 50 HH12 ARG 50 100.390 -34.525 -1.098 412 HH21 ARG 50 HH21 ARG 50 97.568 -33.352 0.571 413 HH22 ARG 50 HH22 ARG 50 98.775 -33.009 -0.648 414 H ASN 51 H ASN 51 101.245 -33.664 5.128 415 HA ASN 51 HA ASN 51 101.700 -34.186 7.951 416 HB2 ASN 51 HB3 ASN 51 100.737 -36.419 7.180 417 HB3 ASN 51 HB2 ASN 51 102.167 -36.586 6.133 418 HD21 ASN 51 HD21 ASN 51 101.649 -35.473 9.563 419 HD22 ASN 51 HD22 ASN 51 102.891 -36.510 10.226 420 H GLY 52 H GLY 52 102.662 -32.532 5.699 421 HA2 GLY 52 HA2 GLY 52 105.546 -33.461 5.658 422 HA3 GLY 52 HA3 GLY 52 104.800 -32.512 4.350 423 H ASN 53 H ASN 53 104.644 -30.276 4.567 424 HA ASN 53 HA ASN 53 105.664 -29.143 7.182 425 HB2 ASN 53 HB2 ASN 53 106.384 -28.352 4.331 426 HB3 ASN 53 HB3 ASN 53 106.723 -27.322 5.742 427 HD21 ASN 53 HD21 ASN 53 107.687 -28.932 7.683 428 HD22 ASN 53 HD22 ASN 53 109.058 -29.867 7.131 429 H LEU 54 H LEU 54 105.379 -26.416 6.357 430 HA LEU 54 HA LEU 54 102.381 -26.287 5.939 431 HB2 LEU 54 HB2 LEU 54 103.834 -24.188 7.536 432 HB3 LEU 54 HB3 LEU 54 102.152 -24.752 7.673 433 HG LEU 54 HG LEU 54 103.353 -27.048 8.339 434 HD11 LEU 54 HD11 LEU 54 105.288 -25.599 9.901 435 HD12 LEU 54 HD12 LEU 54 105.531 -25.184 8.188 436 HD13 LEU 54 HD13 LEU 54 105.574 -26.886 8.705 437 HD21 LEU 54 HD21 LEU 54 101.776 -25.751 9.749 438 HD22 LEU 54 HD22 LEU 54 103.143 -26.362 10.712 439 HD23 LEU 54 HD23 LEU 54 103.097 -24.653 10.215 440 H GLN 55 H GLN 55 101.672 -24.106 5.089 441 HA GLN 55 HA GLN 55 103.858 -22.863 3.403 442 HB2 GLN 55 HB2 GLN 55 102.342 -24.416 2.090 443 HB3 GLN 55 HB3 GLN 55 100.984 -23.343 2.506 444 HG2 GLN 55 HG2 GLN 55 102.399 -21.427 1.528 445 HG3 GLN 55 HG3 GLN 55 103.455 -22.693 0.856 446 HE21 GLN 55 HE21 GLN 55 102.834 -22.182 -1.367 447 HE22 GLN 55 HE22 GLN 55 101.242 -22.588 -1.969 448 H TYR 56 H TYR 56 104.066 -20.773 3.997 449 HA TYR 56 HA TYR 56 101.740 -19.386 5.276 450 HB2 TYR 56 HB2 TYR 56 104.510 -18.248 4.723 451 HB3 TYR 56 HB3 TYR 56 103.324 -17.704 5.933 452 HD1 TYR 56 HD1 TYR 56 105.393 -20.686 4.962 453 HD2 TYR 56 HD2 TYR 56 103.414 -18.547 8.118 454 HE1 TYR 56 HE1 TYR 56 106.385 -22.227 6.631 455 HE2 TYR 56 HE2 TYR 56 104.404 -20.093 9.786 456 HH TYR 56 HH TYR 56 105.311 -22.566 9.723 457 H ASP 57 H ASP 57 100.390 -18.143 4.057 458 HA ASP 57 HA ASP 57 101.262 -17.450 1.276 459 HB2 ASP 57 HB3 ASP 57 98.586 -16.919 2.638 460 HB3 ASP 57 HB2 ASP 57 98.934 -16.870 0.893 461 H LEU 58 H LEU 58 102.213 -15.522 0.904 462 HA LEU 58 HA LEU 58 102.111 -13.420 2.996 463 HB2 LEU 58 HB2 LEU 58 103.387 -13.406 0.225 464 HB3 LEU 58 HB3 LEU 58 103.670 -12.212 1.515 465 HG LEU 58 HG LEU 58 104.091 -15.148 2.086 466 HD11 LEU 58 HD11 LEU 58 106.447 -14.914 1.349 467 HD12 LEU 58 HD12 LEU 58 105.324 -14.698 -0.015 468 HD13 LEU 58 HD13 LEU 58 106.093 -13.280 0.738 469 HD21 LEU 58 HD21 LEU 58 105.992 -13.135 3.088 470 HD22 LEU 58 HD22 LEU 58 104.310 -12.772 3.543 471 HD23 LEU 58 HD23 LEU 58 105.033 -14.336 3.986 472 H HIS 59 H HIS 59 100.739 -11.722 3.016 473 HA HIS 59 HA HIS 59 99.446 -10.925 0.413 474 HB2 HIS 59 HB3 HIS 59 98.052 -11.694 3.003 475 HB3 HIS 59 HB2 HIS 59 97.280 -10.630 1.803 476 HD2 HIS 59 HD2 HIS 59 98.997 -14.250 1.611 477 HE1 HIS 59 HE1 HIS 59 95.708 -14.099 -1.036 478 H TYR 60 H TYR 60 100.241 -8.862 0.226 479 HA TYR 60 HA TYR 60 100.275 -7.184 2.731 480 HB2 TYR 60 HB2 TYR 60 101.454 -5.572 0.919 481 HB3 TYR 60 HB3 TYR 60 102.359 -6.813 1.815 482 HD1 TYR 60 HD1 TYR 60 102.186 -9.263 0.682 483 HD2 TYR 60 HD2 TYR 60 101.732 -5.521 -1.377 484 HE1 TYR 60 HE1 TYR 60 102.790 -10.365 -1.455 485 HE2 TYR 60 HE2 TYR 60 102.333 -6.623 -3.514 486 HH TYR 60 HH TYR 60 102.194 -9.701 -4.126 487 H TRP 61 H TRP 61 98.417 -6.084 3.037 488 HA TRP 61 HA TRP 61 96.787 -5.360 0.632 489 HB2 TRP 61 HB3 TRP 61 95.671 -6.426 2.579 490 HB3 TRP 61 HB2 TRP 61 96.182 -5.066 3.607 491 HD1 TRP 61 HD1 TRP 61 93.639 -6.067 0.998 492 HE1 TRP 61 HE1 TRP 61 91.933 -4.166 0.642 493 HE3 TRP 61 HE3 TRP 61 95.966 -2.382 3.657 494 HZ2 TRP 61 HZ2 TRP 61 91.638 -1.404 1.418 495 HZ3 TRP 61 HZ3 TRP 61 94.951 -0.128 3.837 496 HH2 TRP 61 HH2 TRP 61 92.795 0.366 2.718 497 H LEU 62 H LEU 62 96.732 -3.353 -0.185 498 HA LEU 62 HA LEU 62 97.739 -1.093 1.558 499 HB2 LEU 62 HB2 LEU 62 98.126 -0.760 -1.358 500 HB3 LEU 62 HB3 LEU 62 99.255 -0.441 -0.021 501 HG LEU 62 HG LEU 62 98.582 -3.221 -1.081 502 HD11 LEU 62 HD11 LEU 62 99.837 -2.390 -2.845 503 HD12 LEU 62 HD12 LEU 62 100.664 -1.186 -1.827 504 HD13 LEU 62 HD13 LEU 62 101.156 -2.896 -1.762 505 HD21 LEU 62 HD21 LEU 62 101.106 -2.847 0.357 506 HD22 LEU 62 HD22 LEU 62 99.795 -4.010 0.664 507 HD23 LEU 62 HD23 LEU 62 99.712 -2.373 1.357 508 H GLY 63 H GLY 63 96.314 0.609 1.656 509 HA2 GLY 63 HA2 GLY 63 93.791 0.353 0.105 510 HA3 GLY 63 HA3 GLY 63 94.144 1.583 1.342 511 H ASN 64 H ASN 64 96.463 1.009 -1.192 512 HA ASN 64 HA ASN 64 97.168 2.393 -2.968 513 HB2 ASN 64 HB2 ASN 64 94.667 1.894 -3.584 514 HB3 ASN 64 HB3 ASN 64 94.384 3.578 -3.081 515 HD21 ASN 64 HD21 ASN 64 94.552 5.041 -4.773 516 HD22 ASN 64 HD22 ASN 64 95.577 4.832 -6.176 517 H GLU 65 H GLU 65 96.254 3.521 0.003 518 HA GLU 65 HA GLU 65 96.839 6.391 -0.748 519 HB2 GLU 65 HB2 GLU 65 95.283 5.066 1.462 520 HB3 GLU 65 HB3 GLU 65 96.092 6.611 1.817 521 HG2 GLU 65 HG2 GLU 65 94.456 6.337 -0.707 522 HG3 GLU 65 HG3 GLU 65 93.630 6.607 0.846 523 H CYS 66 H CYS 66 98.534 3.769 -0.066 524 HA CYS 66 HA CYS 66 100.252 5.076 2.044 525 HB2 CYS 66 HB3 CYS 66 101.052 2.925 2.594 526 HB3 CYS 66 HB2 CYS 66 99.338 2.629 2.219 527 HG CYS 66 HG CYS 66 100.022 2.000 -0.585 528 H SER 67 H SER 67 102.254 5.826 1.501 529 HA SER 67 HA SER 67 103.019 6.217 -1.217 530 HB2 SER 67 HB3 SER 67 104.704 6.068 1.317 531 HB3 SER 67 HB2 SER 67 105.339 6.600 -0.259 532 HG SER 67 HG SER 67 104.581 8.367 1.039 533 H GLN 68 H GLN 68 104.735 5.207 -2.479 534 HA GLN 68 HA GLN 68 104.569 2.305 -2.446 535 HB2 GLN 68 HB2 GLN 68 106.767 3.916 -3.791 536 HB3 GLN 68 HB3 GLN 68 106.056 2.369 -4.310 537 HG2 GLN 68 HG2 GLN 68 103.881 3.516 -4.701 538 HG3 GLN 68 HG3 GLN 68 104.622 5.062 -4.221 539 HE21 GLN 68 HE21 GLN 68 104.776 2.439 -6.686 540 HE22 GLN 68 HE22 GLN 68 105.555 3.424 -7.903 541 H ASP 69 H ASP 69 106.320 4.467 -0.509 542 HA ASP 69 HA ASP 69 108.744 2.817 -0.203 543 HB2 ASP 69 HB2 ASP 69 108.835 5.220 0.259 544 HB3 ASP 69 HB3 ASP 69 107.569 5.060 1.500 545 H GLU 70 H GLU 70 105.624 3.165 1.492 546 HA GLU 70 HA GLU 70 106.502 1.224 3.581 547 HB2 GLU 70 HB2 GLU 70 103.708 2.333 3.094 548 HB3 GLU 70 HB3 GLU 70 104.351 1.626 4.595 549 HG2 GLU 70 HG2 GLU 70 105.416 4.163 3.277 550 HG3 GLU 70 HG3 GLU 70 104.283 4.134 4.650 551 H SER 71 H SER 71 104.670 1.297 0.580 552 HA SER 71 HA SER 71 103.321 -1.260 0.973 553 HB2 SER 71 HB2 SER 71 102.523 0.303 -0.717 554 HB3 SER 71 HB3 SER 71 104.100 0.275 -1.544 555 HG SER 71 HG SER 71 103.743 -1.856 -2.117 556 H GLY 72 H GLY 72 106.139 -0.407 -1.114 557 HA2 GLY 72 HA3 GLY 72 106.850 -3.144 -1.656 558 HA3 GLY 72 HA2 GLY 72 107.957 -1.757 -1.784 559 H ALA 73 H ALA 73 108.253 -0.841 0.744 560 HA ALA 73 HA ALA 73 110.117 -2.570 1.950 561 HB1 ALA 73 HB1 ALA 73 109.698 -1.300 4.067 562 HB2 ALA 73 HB2 ALA 73 109.852 -0.233 2.651 563 HB3 ALA 73 HB3 ALA 73 108.244 -0.592 3.324 564 H ALA 74 H ALA 74 106.596 -2.358 2.619 565 HA ALA 74 HA ALA 74 106.613 -4.386 4.689 566 HB1 ALA 74 HB1 ALA 74 104.153 -4.619 4.079 567 HB2 ALA 74 HB2 ALA 74 104.443 -3.460 2.760 568 HB3 ALA 74 HB3 ALA 74 104.674 -2.959 4.452 569 H ALA 75 H ALA 75 105.640 -4.634 1.234 570 HA ALA 75 HA ALA 75 105.418 -7.497 1.232 571 HB1 ALA 75 HB1 ALA 75 105.666 -7.313 -1.229 572 HB2 ALA 75 HB2 ALA 75 104.575 -6.054 -0.603 573 HB3 ALA 75 HB3 ALA 75 106.249 -5.641 -1.046 574 H ILE 76 H ILE 76 108.186 -5.412 1.344 575 HA ILE 76 HA ILE 76 110.057 -7.418 0.233 576 HB ILE 76 HB ILE 76 110.424 -4.791 1.726 577 HG12 ILE 76 HG12 ILE 76 109.648 -5.141 -0.818 578 HG13 ILE 76 HG13 ILE 76 110.783 -3.848 -0.362 579 HG21 ILE 76 HG21 ILE 76 112.347 -6.043 2.349 580 HG22 ILE 76 HG22 ILE 76 112.868 -5.116 0.923 581 HG23 ILE 76 HG23 ILE 76 112.448 -6.838 0.760 582 HD11 ILE 76 HD11 ILE 76 111.435 -5.352 -2.372 583 HD12 ILE 76 HD12 ILE 76 111.757 -6.612 -1.157 584 HD13 ILE 76 HD13 ILE 76 112.669 -5.084 -1.117 585 H PHE 77 H PHE 77 109.488 -6.034 3.522 586 HA PHE 77 HA PHE 77 111.308 -7.788 4.876 587 HB2 PHE 77 HB2 PHE 77 108.819 -6.282 5.694 588 HB3 PHE 77 HB3 PHE 77 109.577 -7.416 6.838 589 HD1 PHE 77 HD1 PHE 77 112.208 -7.182 7.061 590 HD2 PHE 77 HD2 PHE 77 109.605 -4.088 5.614 591 HE1 PHE 77 HE1 PHE 77 113.928 -5.479 7.607 592 HE2 PHE 77 HE2 PHE 77 111.323 -2.386 6.158 593 HZ PHE 77 HZ PHE 77 113.485 -3.080 7.155 594 H THR 78 H THR 78 107.934 -8.265 3.851 595 HA THR 78 HA THR 78 107.746 -10.858 5.262 596 HB THR 78 HB THR 78 105.842 -9.169 4.579 597 HG1 THR 78 HG1 THR 78 105.908 -11.944 4.721 598 HG21 THR 78 HG21 THR 78 104.776 -9.647 2.451 599 HG22 THR 78 HG22 THR 78 105.939 -10.951 2.108 600 HG23 THR 78 HG23 THR 78 106.483 -9.256 2.133 601 H VAL 79 H VAL 79 108.058 -9.796 1.842 602 HA VAL 79 HA VAL 79 108.122 -12.459 0.737 603 HB VAL 79 HB VAL 79 109.355 -9.836 -0.204 604 HG11 VAL 79 HG11 VAL 79 110.612 -11.757 -1.143 605 HG12 VAL 79 HG12 VAL 79 109.633 -10.959 -2.397 606 HG13 VAL 79 HG13 VAL 79 109.084 -12.493 -1.680 607 HG21 VAL 79 HG21 VAL 79 107.071 -11.317 -1.504 608 HG22 VAL 79 HG22 VAL 79 106.759 -10.386 -0.019 609 HG23 VAL 79 HG23 VAL 79 107.408 -9.569 -1.462 610 H GLN 80 H GLN 80 110.796 -10.288 1.784 611 HA GLN 80 HA GLN 80 112.858 -12.257 1.154 612 HB2 GLN 80 HB3 GLN 80 112.852 -9.834 3.002 613 HB3 GLN 80 HB2 GLN 80 114.303 -10.790 2.615 614 HG2 GLN 80 HG2 GLN 80 113.861 -10.343 0.169 615 HG3 GLN 80 HG3 GLN 80 112.544 -9.249 0.657 616 HE21 GLN 80 HE21 GLN 80 114.227 -7.764 -0.653 617 HE22 GLN 80 HE22 GLN 80 115.396 -6.941 0.354 618 H LEU 81 H LEU 81 111.620 -11.121 4.364 619 HA LEU 81 HA LEU 81 112.952 -13.126 5.886 620 HB2 LEU 81 HB3 LEU 81 111.553 -11.127 6.727 621 HB3 LEU 81 HB2 LEU 81 110.132 -12.173 6.504 622 HG LEU 81 HG LEU 81 111.019 -12.245 8.843 623 HD11 LEU 81 HD11 LEU 81 110.674 -14.539 9.085 624 HD12 LEU 81 HD12 LEU 81 111.626 -14.941 7.636 625 HD13 LEU 81 HD13 LEU 81 109.988 -14.267 7.466 626 HD21 LEU 81 HD21 LEU 81 113.195 -12.882 9.369 627 HD22 LEU 81 HD22 LEU 81 113.482 -12.039 7.828 628 HD23 LEU 81 HD23 LEU 81 113.398 -13.816 7.868 629 H ASP 82 H ASP 82 109.617 -13.238 4.504 630 HA ASP 82 HA ASP 82 108.920 -15.842 5.301 631 HB2 ASP 82 HB2 ASP 82 107.412 -14.442 3.957 632 HB3 ASP 82 HB3 ASP 82 108.500 -14.579 2.555 633 H ASP 83 H ASP 83 110.927 -14.910 2.457 634 HA ASP 83 HA ASP 83 111.454 -17.591 1.592 635 HB2 ASP 83 HB2 ASP 83 112.142 -15.587 0.295 636 HB3 ASP 83 HB3 ASP 83 113.339 -15.188 1.551 637 H TYR 84 H TYR 84 112.694 -15.657 4.254 638 HA TYR 84 HA TYR 84 114.899 -17.457 4.927 639 HB2 TYR 84 HB3 TYR 84 114.551 -15.019 5.704 640 HB3 TYR 84 HB2 TYR 84 113.387 -15.682 6.877 641 HD1 TYR 84 HD1 TYR 84 116.943 -15.622 5.833 642 HD2 TYR 84 HD2 TYR 84 114.120 -17.037 8.744 643 HE1 TYR 84 HE1 TYR 84 118.811 -16.263 7.333 644 HE2 TYR 84 HE2 TYR 84 115.986 -17.675 10.246 645 HH TYR 84 HH TYR 84 119.116 -18.011 9.282 646 H LEU 85 H LEU 85 111.440 -17.455 5.452 647 HA LEU 85 HA LEU 85 111.596 -19.396 7.688 648 HB2 LEU 85 HB3 LEU 85 109.196 -18.584 5.992 649 HB3 LEU 85 HB2 LEU 85 109.160 -19.393 7.578 650 HG LEU 85 HG LEU 85 110.230 -16.598 6.986 651 HD11 LEU 85 HD11 LEU 85 107.887 -16.407 7.096 652 HD12 LEU 85 HD12 LEU 85 107.738 -17.723 8.285 653 HD13 LEU 85 HD13 LEU 85 108.369 -16.136 8.788 654 HD21 LEU 85 HD21 LEU 85 110.217 -16.704 9.659 655 HD22 LEU 85 HD22 LEU 85 110.444 -18.443 9.356 656 HD23 LEU 85 HD23 LEU 85 111.623 -17.268 8.724 657 H ASN 86 H ASN 86 110.347 -19.524 4.303 658 HA ASN 86 HA ASN 86 110.939 -22.494 4.411 659 HB2 ASN 86 HB3 ASN 86 109.066 -22.601 2.619 660 HB3 ASN 86 HB2 ASN 86 108.573 -22.333 4.308 661 HD21 ASN 86 HD21 ASN 86 108.174 -21.161 1.145 662 HD22 ASN 86 HD22 ASN 86 107.603 -19.556 1.543 663 H GLY 87 H GLY 87 110.739 -19.595 2.319 664 HA2 GLY 87 HA2 GLY 87 112.654 -19.170 0.775 665 HA3 GLY 87 HA3 GLY 87 112.815 -20.930 0.565 666 H ARG 88 H ARG 88 109.556 -20.312 0.705 667 HA ARG 88 HA ARG 88 109.349 -19.688 -2.235 668 HB2 ARG 88 HB3 ARG 88 107.791 -21.946 -0.918 669 HB3 ARG 88 HB2 ARG 88 107.913 -21.566 -2.653 670 HG2 ARG 88 HG2 ARG 88 110.273 -22.172 -2.677 671 HG3 ARG 88 HG3 ARG 88 110.278 -22.387 -0.910 672 HD2 ARG 88 HD2 ARG 88 110.011 -24.595 -1.629 673 HD3 ARG 88 HD3 ARG 88 108.315 -24.097 -1.425 674 HE ARG 88 HE ARG 88 108.830 -23.434 -4.075 675 HH11 ARG 88 HH11 ARG 88 108.576 -24.902 -5.775 676 HH12 ARG 88 HH12 ARG 88 108.700 -26.621 -5.471 677 HH21 ARG 88 HH21 ARG 88 109.308 -26.235 -2.065 678 HH22 ARG 88 HH22 ARG 88 109.112 -27.372 -3.380 679 H ALA 89 H ALA 89 106.853 -20.904 -0.008 680 HA ALA 89 HA ALA 89 104.853 -19.874 0.705 681 HB1 ALA 89 HB1 ALA 89 105.217 -17.262 1.122 682 HB2 ALA 89 HB2 ALA 89 106.928 -17.704 0.911 683 HB3 ALA 89 HB3 ALA 89 105.961 -18.474 2.192 684 H VAL 90 H VAL 90 103.067 -18.532 -0.035 685 HA VAL 90 HA VAL 90 103.271 -18.017 -2.977 686 HB VAL 90 HB VAL 90 100.782 -17.654 -1.283 687 HG11 VAL 90 HG11 VAL 90 101.297 -18.613 -4.136 688 HG12 VAL 90 HG12 VAL 90 100.752 -16.983 -3.674 689 HG13 VAL 90 HG13 VAL 90 99.698 -18.388 -3.387 690 HG21 VAL 90 HG21 VAL 90 100.404 -20.157 -1.992 691 HG22 VAL 90 HG22 VAL 90 101.404 -19.810 -0.562 692 HG23 VAL 90 HG23 VAL 90 102.179 -20.210 -2.113 693 H GLN 91 H GLN 91 102.717 -15.971 -3.912 694 HA GLN 91 HA GLN 91 103.009 -13.688 -1.948 695 HB2 GLN 91 HB2 GLN 91 103.674 -12.421 -4.116 696 HB3 GLN 91 HB3 GLN 91 104.838 -13.599 -3.463 697 HG2 GLN 91 HG2 GLN 91 104.148 -15.278 -5.064 698 HG3 GLN 91 HG3 GLN 91 102.777 -14.278 -5.602 699 HE21 GLN 91 HE21 GLN 91 106.399 -14.166 -5.359 700 HE22 GLN 91 HE22 GLN 91 106.604 -13.217 -6.814 701 H HIS 92 H HIS 92 101.392 -12.192 -1.820 702 HA HIS 92 HA HIS 92 99.343 -12.148 -4.031 703 HB2 HIS 92 HB2 HIS 92 98.793 -12.437 -1.047 704 HB3 HIS 92 HB3 HIS 92 97.554 -11.990 -2.244 705 HD2 HIS 92 HD2 HIS 92 100.106 -15.057 -1.859 706 HE1 HIS 92 HE1 HIS 92 96.515 -16.420 -3.616 707 H ARG 93 H ARG 93 99.115 -10.081 -4.703 708 HA ARG 93 HA ARG 93 99.837 -7.901 -2.733 709 HB2 ARG 93 HB2 ARG 93 100.389 -6.525 -4.667 710 HB3 ARG 93 HB3 ARG 93 101.226 -8.087 -4.833 711 HG2 ARG 93 HG2 ARG 93 98.948 -8.733 -6.109 712 HG3 ARG 93 HG3 ARG 93 98.909 -6.977 -6.393 713 HD2 ARG 93 HD3 ARG 93 100.106 -7.963 -8.244 714 HD3 ARG 93 HD2 ARG 93 101.315 -7.164 -7.211 715 HE ARG 93 HE ARG 93 100.999 -9.941 -6.404 716 HH11 ARG 93 HH11 ARG 93 102.649 -11.361 -7.007 717 HH12 ARG 93 HH12 ARG 93 103.755 -10.922 -8.289 718 HH21 ARG 93 HH21 ARG 93 102.259 -7.834 -8.875 719 HH22 ARG 93 HH22 ARG 93 103.536 -8.935 -9.341 720 H GLU 94 H GLU 94 98.150 -6.734 -1.982 721 HA GLU 94 HA GLU 94 95.684 -6.583 -3.739 722 HB2 GLU 94 HB3 GLU 94 95.279 -5.982 -0.883 723 HB3 GLU 94 HB2 GLU 94 94.386 -7.097 -1.945 724 HG2 GLU 94 HG2 GLU 94 96.427 -8.663 -1.745 725 HG3 GLU 94 HG3 GLU 94 96.957 -7.618 -0.405 726 H VAL 95 H VAL 95 96.360 -4.652 -4.776 727 HA VAL 95 HA VAL 95 97.090 -2.312 -3.081 728 HB VAL 95 HB VAL 95 96.492 -2.165 -6.041 729 HG11 VAL 95 HG11 VAL 95 97.091 -0.116 -4.779 730 HG12 VAL 95 HG12 VAL 95 98.586 -0.901 -4.215 731 HG13 VAL 95 HG13 VAL 95 98.366 -0.544 -5.945 732 HG21 VAL 95 HG21 VAL 95 99.025 -2.790 -6.253 733 HG22 VAL 95 HG22 VAL 95 98.805 -3.563 -4.665 734 HG23 VAL 95 HG23 VAL 95 97.842 -4.106 -6.061 735 H GLN 96 H GLN 96 94.464 -3.406 -2.604 736 HA GLN 96 HA GLN 96 92.295 -2.525 -2.258 737 HB2 GLN 96 HB3 GLN 96 93.796 -0.331 -2.086 738 HB3 GLN 96 HB2 GLN 96 93.030 0.048 -3.648 739 HG2 GLN 96 HG2 GLN 96 90.788 -0.314 -2.607 740 HG3 GLN 96 HG3 GLN 96 91.582 -0.613 -1.043 741 HE21 GLN 96 HE21 GLN 96 91.029 1.893 -3.563 742 HE22 GLN 96 HE22 GLN 96 91.373 3.246 -2.509 743 H GLY 97 H GLY 97 91.768 -4.145 -3.976 744 HA2 GLY 97 HA3 GLY 97 89.867 -3.620 -5.763 745 HA3 GLY 97 HA2 GLY 97 91.219 -2.882 -6.655 746 H PHE 98 H PHE 98 93.288 -4.535 -6.456 747 HA PHE 98 HA PHE 98 92.299 -6.977 -7.857 748 HB2 PHE 98 HB2 PHE 98 95.189 -6.262 -7.238 749 HB3 PHE 98 HB3 PHE 98 94.564 -7.287 -8.552 750 HD1 PHE 98 HD1 PHE 98 93.909 -6.343 -10.628 751 HD2 PHE 98 HD2 PHE 98 94.631 -3.782 -7.256 752 HE1 PHE 98 HE1 PHE 98 93.752 -4.356 -12.104 753 HE2 PHE 98 HE2 PHE 98 94.478 -1.796 -8.731 754 HZ PHE 98 HZ PHE 98 94.035 -2.081 -11.155 755 H GLU 99 H GLU 99 91.395 -7.240 -5.357 756 HA GLU 99 HA GLU 99 93.290 -8.374 -3.465 757 HB2 GLU 99 HB2 GLU 99 90.276 -8.717 -3.772 758 HB3 GLU 99 HB3 GLU 99 91.214 -9.321 -2.386 759 HG2 GLU 99 HG2 GLU 99 91.494 -6.431 -3.206 760 HG3 GLU 99 HG3 GLU 99 90.062 -6.935 -2.277 761 H SER 100 H SER 100 92.668 -10.803 -2.684 762 HA SER 100 HA SER 100 92.881 -12.499 -5.186 763 HB2 SER 100 HB3 SER 100 94.196 -12.774 -2.455 764 HB3 SER 100 HB2 SER 100 94.142 -14.105 -3.637 765 HG SER 100 HG SER 100 95.353 -11.542 -3.936 766 H ALA 101 H ALA 101 91.933 -14.664 -5.014 767 HA ALA 101 HA ALA 101 89.302 -14.638 -3.852 768 HB1 ALA 101 HB1 ALA 101 89.277 -17.066 -4.356 769 HB2 ALA 101 HB2 ALA 101 89.960 -16.137 -5.712 770 HB3 ALA 101 HB3 ALA 101 91.038 -17.030 -4.613 771 H THR 102 H THR 102 92.280 -16.334 -2.757 772 HA THR 102 HA THR 102 91.145 -17.441 -0.371 773 HB THR 102 HB THR 102 93.990 -16.416 -0.794 774 HG1 THR 102 HG1 THR 102 94.328 -18.619 -1.433 775 HG21 THR 102 HG21 THR 102 94.560 -18.115 0.922 776 HG22 THR 102 HG22 THR 102 92.835 -18.517 1.096 777 HG23 THR 102 HG23 THR 102 93.426 -16.907 1.571 778 H PHE 103 H PHE 103 92.949 -14.363 -0.805 779 HA PHE 103 HA PHE 103 92.680 -13.444 1.890 780 HB2 PHE 103 HB3 PHE 103 94.141 -12.275 0.360 781 HB3 PHE 103 HB2 PHE 103 92.794 -11.927 -0.750 782 HD1 PHE 103 HD1 PHE 103 94.367 -11.068 2.480 783 HD2 PHE 103 HD2 PHE 103 91.142 -10.211 -0.225 784 HE1 PHE 103 HE1 PHE 103 93.888 -8.971 3.715 785 HE2 PHE 103 HE2 PHE 103 90.663 -8.114 1.011 786 HZ PHE 103 HZ PHE 103 92.038 -7.493 2.980 787 H LEU 104 H LEU 104 90.432 -13.222 -0.874 788 HA LEU 104 HA LEU 104 88.532 -11.503 0.541 789 HB2 LEU 104 HB3 LEU 104 88.377 -13.279 -1.917 790 HB3 LEU 104 HB2 LEU 104 86.935 -12.453 -1.279 791 HG LEU 104 HG LEU 104 89.466 -10.864 -1.695 792 HD11 LEU 104 HD11 LEU 104 89.148 -12.127 -3.806 793 HD12 LEU 104 HD12 LEU 104 88.769 -10.403 -4.029 794 HD13 LEU 104 HD13 LEU 104 87.452 -11.589 -3.872 795 HD21 LEU 104 HD21 LEU 104 87.492 -9.860 -0.577 796 HD22 LEU 104 HD22 LEU 104 87.803 -9.080 -2.146 797 HD23 LEU 104 HD23 LEU 104 86.486 -10.267 -1.988 798 H GLY 105 H GLY 105 89.068 -14.996 0.311 799 HA2 GLY 105 HA2 GLY 105 86.488 -15.763 1.427 800 HA3 GLY 105 HA3 GLY 105 87.948 -16.780 1.387 801 H TYR 106 H TYR 106 89.634 -14.884 2.842 802 HA TYR 106 HA TYR 106 88.831 -15.675 5.558 803 HB2 TYR 106 HB2 TYR 106 91.234 -15.133 4.390 804 HB3 TYR 106 HB3 TYR 106 90.924 -13.574 5.191 805 HD1 TYR 106 HD1 TYR 106 91.757 -17.096 5.655 806 HD2 TYR 106 HD2 TYR 106 90.496 -13.513 7.662 807 HE1 TYR 106 HE1 TYR 106 92.412 -18.085 7.832 808 HE2 TYR 106 HE2 TYR 106 91.147 -14.504 9.839 809 HH TYR 106 HH TYR 106 91.421 -17.325 10.593 810 H PHE 107 H PHE 107 89.097 -12.538 3.816 811 HA PHE 107 HA PHE 107 87.451 -11.333 6.051 812 HB2 PHE 107 HB2 PHE 107 89.054 -9.852 3.924 813 HB3 PHE 107 HB3 PHE 107 88.379 -9.194 5.434 814 HD1 PHE 107 HD1 PHE 107 89.233 -10.194 7.655 815 HD2 PHE 107 HD2 PHE 107 91.225 -10.764 3.890 816 HE1 PHE 107 HE1 PHE 107 91.322 -10.793 8.850 817 HE2 PHE 107 HE2 PHE 107 93.313 -11.364 5.087 818 HZ PHE 107 HZ PHE 107 93.361 -11.378 7.568 819 H LYS 108 H LYS 108 85.476 -12.232 5.089 820 HA LYS 108 HA LYS 108 84.747 -11.044 2.424 821 HB2 LYS 108 HB3 LYS 108 84.364 -13.503 2.899 822 HB3 LYS 108 HB2 LYS 108 83.175 -13.019 4.132 823 HG2 LYS 108 HG2 LYS 108 82.115 -11.592 2.208 824 HG3 LYS 108 HG3 LYS 108 83.062 -12.642 1.127 825 HD2 LYS 108 HD2 LYS 108 81.093 -13.874 1.277 826 HD3 LYS 108 HD3 LYS 108 82.005 -14.572 2.637 827 HE2 LYS 108 HE2 LYS 108 79.767 -14.034 3.422 828 HE3 LYS 108 HE3 LYS 108 80.902 -12.873 4.150 829 HZ1 LYS 108 HZ1 LYS 108 78.963 -11.775 3.247 830 HZ2 LYS 108 HZ2 LYS 108 79.259 -12.388 1.746 831 HZ3 LYS 108 HZ3 LYS 108 80.311 -11.312 2.419 832 H SER 109 H SER 109 83.867 -11.013 5.862 833 HA SER 109 HA SER 109 81.708 -9.007 5.237 834 HB2 SER 109 HB2 SER 109 82.349 -10.774 7.610 835 HB3 SER 109 HB3 SER 109 81.328 -9.329 7.817 836 HG SER 109 HG SER 109 80.096 -11.222 7.287 837 H GLY 110 H GLY 110 84.908 -8.858 5.592 838 HA2 GLY 110 HA3 GLY 110 84.930 -6.659 7.637 839 HA3 GLY 110 HA2 GLY 110 86.363 -7.411 6.897 840 H LEU 111 H LEU 111 87.324 -6.335 5.235 841 HA LEU 111 HA LEU 111 87.688 -4.600 3.685 842 HB2 LEU 111 HB2 LEU 111 84.799 -5.359 3.186 843 HB3 LEU 111 HB3 LEU 111 85.615 -4.100 2.229 844 HG LEU 111 HG LEU 111 85.708 -6.431 1.219 845 HD11 LEU 111 HD11 LEU 111 87.358 -4.674 0.628 846 HD12 LEU 111 HD12 LEU 111 88.116 -6.284 0.651 847 HD13 LEU 111 HD13 LEU 111 88.370 -5.162 2.009 848 HD21 LEU 111 HD21 LEU 111 87.059 -8.123 2.237 849 HD22 LEU 111 HD22 LEU 111 86.028 -7.495 3.545 850 HD23 LEU 111 HD23 LEU 111 87.727 -6.979 3.426 851 H LYS 112 H LYS 112 88.128 -2.815 4.865 852 HA LYS 112 HA LYS 112 85.893 -0.858 5.183 853 HB2 LYS 112 HB2 LYS 112 86.411 -2.374 7.356 854 HB3 LYS 112 HB3 LYS 112 87.692 -1.156 7.566 855 HG2 LYS 112 HG3 LYS 112 86.053 0.653 7.490 856 HG3 LYS 112 HG2 LYS 112 84.749 -0.497 7.106 857 HD2 LYS 112 HD2 LYS 112 85.167 -1.645 9.292 858 HD3 LYS 112 HD3 LYS 112 86.390 -0.411 9.678 859 HE2 LYS 112 HE2 LYS 112 84.311 0.260 10.732 860 HE3 LYS 112 HE3 LYS 112 84.589 1.347 9.350 861 HZ1 LYS 112 HZ1 LYS 112 82.329 0.526 9.396 862 HZ2 LYS 112 HZ2 LYS 112 82.849 -1.038 9.333 863 HZ3 LYS 112 HZ3 LYS 112 83.106 -0.032 8.052 864 H TYR 113 H TYR 113 86.891 0.516 3.706 865 HA TYR 113 HA TYR 113 89.787 1.096 3.959 866 HB2 TYR 113 HB3 TYR 113 88.741 3.026 2.267 867 HB3 TYR 113 HB2 TYR 113 89.342 1.432 1.752 868 HD1 TYR 113 HD1 TYR 113 86.469 3.588 1.988 869 HD2 TYR 113 HD2 TYR 113 87.669 -0.530 1.758 870 HE1 TYR 113 HE1 TYR 113 84.186 2.964 1.250 871 HE2 TYR 113 HE2 TYR 113 85.385 -1.153 1.017 872 HH TYR 113 HH TYR 113 83.413 0.108 -0.192 873 H LYS 114 H LYS 114 90.386 2.293 5.707 874 HA LYS 114 HA LYS 114 88.712 4.747 6.306 875 HB2 LYS 114 HB2 LYS 114 88.828 2.877 8.082 876 HB3 LYS 114 HB3 LYS 114 90.536 3.333 8.283 877 HG2 LYS 114 HG3 LYS 114 89.930 5.597 8.903 878 HG3 LYS 114 HG2 LYS 114 88.224 5.308 8.484 879 HD2 LYS 114 HD2 LYS 114 88.036 3.641 10.280 880 HD3 LYS 114 HD3 LYS 114 89.761 3.836 10.670 881 HE2 LYS 114 HE3 LYS 114 87.593 5.970 10.890 882 HE3 LYS 114 HE2 LYS 114 88.428 5.161 12.238 883 HZ1 LYS 114 HZ1 LYS 114 89.664 7.037 12.020 884 HZ2 LYS 114 HZ2 LYS 114 90.503 6.067 10.983 885 HZ3 LYS 114 HZ3 LYS 114 89.435 7.176 10.392 886 H LYS 115 H LYS 115 89.916 6.664 6.933 887 HA LYS 115 HA LYS 115 92.402 6.952 5.404 888 HB2 LYS 115 HB2 LYS 115 92.384 9.220 6.801 889 HB3 LYS 115 HB3 LYS 115 91.216 8.956 5.484 890 HG2 LYS 115 HG3 LYS 115 90.435 7.955 8.197 891 HG3 LYS 115 HG2 LYS 115 90.461 9.720 7.972 892 HD2 LYS 115 HD2 LYS 115 89.143 7.999 5.876 893 HD3 LYS 115 HD3 LYS 115 88.275 8.325 7.395 894 HE2 LYS 115 HE2 LYS 115 88.501 10.740 7.049 895 HE3 LYS 115 HE3 LYS 115 89.485 10.468 5.591 896 HZ1 LYS 115 HZ1 LYS 115 87.183 10.901 5.044 897 HZ2 LYS 115 HZ2 LYS 115 87.592 9.366 4.600 898 HZ3 LYS 115 HZ3 LYS 115 86.680 9.618 5.951 899 H GLY 116 H GLY 116 94.470 7.676 6.367 900 HA2 GLY 116 HA3 GLY 116 94.842 6.913 9.244 901 HA3 GLY 116 HA2 GLY 116 95.795 6.026 8.030 902 H GLY 117 H GLY 117 95.466 8.992 9.816 903 HA2 GLY 117 HA2 GLY 117 97.561 10.336 8.142 904 HA3 GLY 117 HA3 GLY 117 96.654 11.082 9.480 905 H VAL 118 H VAL 118 98.257 7.910 9.624 906 HA VAL 118 HA VAL 118 99.817 8.901 11.968 907 HB VAL 118 HB VAL 118 100.002 6.131 10.745 908 HG11 VAL 118 HG11 VAL 118 101.547 6.744 12.585 909 HG12 VAL 118 HG12 VAL 118 100.158 7.213 13.594 910 HG13 VAL 118 HG13 VAL 118 100.376 5.512 13.116 911 HG21 VAL 118 HG21 VAL 118 98.108 5.665 12.512 912 HG22 VAL 118 HG22 VAL 118 97.747 7.397 12.317 913 HG23 VAL 118 HG23 VAL 118 97.662 6.307 10.913 914 H ALA 119 H ALA 119 100.331 7.833 8.621 915 HA ALA 119 HA ALA 119 103.278 7.940 8.917 916 HB1 ALA 119 HB1 ALA 119 103.282 7.517 6.473 917 HB2 ALA 119 HB2 ALA 119 102.213 6.372 7.319 918 HB3 ALA 119 HB3 ALA 119 101.518 7.749 6.430 919 H SER 120 H SER 120 100.660 10.052 7.838 920 HA SER 120 HA SER 120 102.596 12.028 6.733 921 HB2 SER 120 HB2 SER 120 99.573 12.024 7.076 922 HB3 SER 120 HB3 SER 120 100.477 13.431 6.465 923 HG SER 120 HG SER 120 99.745 12.035 4.762 924 H GLY 121 H GLY 121 101.937 11.086 9.722 925 HA2 GLY 121 HA2 GLY 121 101.402 13.677 11.024 926 HA3 GLY 121 HA3 GLY 121 101.855 12.161 11.840 927 H PHE 122 H PHE 122 104.260 11.714 10.233 928 HA PHE 122 HA PHE 122 106.043 13.557 11.740 929 HB2 PHE 122 HB2 PHE 122 106.992 11.532 9.702 930 HB3 PHE 122 HB3 PHE 122 107.775 12.057 11.212 931 HD1 PHE 122 HD1 PHE 122 106.387 9.287 9.830 932 HD2 PHE 122 HD2 PHE 122 105.833 11.794 13.275 933 HE1 PHE 122 HE1 PHE 122 105.335 7.394 11.040 934 HE2 PHE 122 HE2 PHE 122 104.776 9.903 14.482 935 HZ PHE 122 HZ PHE 122 104.529 7.702 13.363 936 H LYS 123 H LYS 123 104.847 13.120 8.459 937 HA LYS 123 HA LYS 123 106.914 14.751 7.184 938 HB2 LYS 123 HB2 LYS 123 105.497 13.172 5.906 939 HB3 LYS 123 HB3 LYS 123 104.056 14.138 6.307 940 HG2 LYS 123 HG3 LYS 123 104.709 15.923 4.938 941 HG3 LYS 123 HG2 LYS 123 106.431 15.475 5.004 942 HD2 LYS 123 HD2 LYS 123 105.463 14.953 2.783 943 HD3 LYS 123 HD3 LYS 123 105.959 13.467 3.627 944 HE2 LYS 123 HE2 LYS 123 103.651 13.046 4.328 945 HE3 LYS 123 HE3 LYS 123 103.123 14.591 3.619 946 HZ1 LYS 123 HZ1 LYS 123 102.697 12.743 2.142 947 HZ2 LYS 123 HZ2 LYS 123 103.805 13.762 1.468 948 HZ3 LYS 123 HZ3 LYS 123 104.294 12.331 2.125 949 H HIS 124 H HIS 124 104.695 15.575 9.491 950 HA HIS 124 HA HIS 124 103.812 18.147 8.303 951 HB2 HIS 124 HB3 HIS 124 103.522 16.793 10.998 952 HB3 HIS 124 HB2 HIS 124 103.115 18.515 10.808 953 HD2 HIS 124 HD2 HIS 124 102.220 16.658 7.594 954 HE1 HIS 124 HE1 HIS 124 98.680 16.732 9.894 955 HE2 HIS 124 HE2 HIS 124 99.629 16.240 7.574 956 H VAL 125 H VAL 125 105.010 19.982 8.320 957 HA VAL 125 HA VAL 125 107.013 20.341 10.537 958 HB VAL 125 HB VAL 125 107.613 20.516 7.553 959 HG11 VAL 125 HG11 VAL 125 108.592 22.440 8.775 960 HG12 VAL 125 HG12 VAL 125 109.317 21.321 9.954 961 HG13 VAL 125 HG13 VAL 125 109.857 21.300 8.258 962 HG21 VAL 125 HG21 VAL 125 107.744 18.251 8.557 963 HG22 VAL 125 HG22 VAL 125 109.362 18.856 8.130 964 HG23 VAL 125 HG23 VAL 125 108.823 18.876 9.826 965 H VAL 126 H VAL 126 106.870 22.376 11.346 966 HA VAL 126 HA VAL 126 104.968 24.275 10.240 967 HB VAL 126 HB VAL 126 107.240 25.043 12.093 968 HG11 VAL 126 HG11 VAL 126 105.621 26.774 11.362 969 HG12 VAL 126 HG12 VAL 126 105.451 26.433 13.100 970 HG13 VAL 126 HG13 VAL 126 104.277 25.762 11.942 971 HG21 VAL 126 HG21 VAL 126 105.528 24.225 13.912 972 HG22 VAL 126 HG22 VAL 126 106.593 23.030 13.132 973 HG23 VAL 126 HG23 VAL 126 104.900 23.191 12.606 974 HA PRO 127 HA PRO 127 107.560 25.668 6.809 975 HB2 PRO 127 HB2 PRO 127 105.744 28.052 7.174 976 HB3 PRO 127 HB3 PRO 127 106.188 27.177 5.681 977 HG2 PRO 127 HG3 PRO 127 103.812 26.832 6.890 978 HG3 PRO 127 HG2 PRO 127 104.651 25.507 6.039 979 HD2 PRO 127 HD2 PRO 127 104.251 25.927 8.973 980 HD3 PRO 127 HD3 PRO 127 104.549 24.413 8.066 981 H ASN 128 H ASN 128 109.444 26.849 6.811 982 HA ASN 128 HA ASN 128 111.106 28.331 7.602 983 HB2 ASN 128 HB3 ASN 128 108.991 29.904 7.232 984 HB3 ASN 128 HB2 ASN 128 109.013 29.984 9.010 985 HD21 ASN 128 HD21 ASN 128 110.872 30.993 10.060 986 HD22 ASN 128 HD22 ASN 128 112.011 31.952 9.143 987 H GLU 129 H GLU 129 111.994 26.810 9.088 988 HA GLU 129 HA GLU 129 110.851 26.600 11.809 989 HB2 GLU 129 HB2 GLU 129 113.510 25.631 10.665 990 HB3 GLU 129 HB3 GLU 129 112.841 25.178 12.251 991 HG2 GLU 129 HG2 GLU 129 112.207 23.392 10.814 992 HG3 GLU 129 HG3 GLU 129 110.746 24.402 10.930 993 H VAL 130 H VAL 130 113.058 28.696 10.163 994 HA VAL 130 HA VAL 130 114.899 29.451 12.155 995 HB VAL 130 HB VAL 130 113.398 31.559 10.578 996 HG11 VAL 130 HG11 VAL 130 115.247 32.241 12.083 997 HG12 VAL 130 HG12 VAL 130 115.684 32.497 10.377 998 HG13 VAL 130 HG13 VAL 130 116.337 31.098 11.263 999 HG21 VAL 130 HG21 VAL 130 115.316 30.804 8.825 1000 HG22 VAL 130 HG22 VAL 130 113.669 30.131 8.785 1001 HG23 VAL 130 HG23 VAL 130 114.982 29.223 9.571 1002 H VAL 131 H VAL 131 111.445 29.741 12.220 1003 HA VAL 131 HA VAL 131 111.236 31.971 14.066 1004 HB VAL 131 HB VAL 131 109.412 29.555 13.673 1005 HG11 VAL 131 HG11 VAL 131 109.025 30.714 15.831 1006 HG12 VAL 131 HG12 VAL 131 108.908 32.269 14.974 1007 HG13 VAL 131 HG13 VAL 131 107.683 31.007 14.698 1008 HG21 VAL 131 HG21 VAL 131 108.122 31.118 12.243 1009 HG22 VAL 131 HG22 VAL 131 109.345 32.381 12.519 1010 HG23 VAL 131 HG23 VAL 131 109.777 30.905 11.624 1011 H VAL 132 H VAL 132 111.468 28.423 14.564 1012 HA VAL 132 HA VAL 132 111.325 28.636 17.473 1013 HB VAL 132 HB VAL 132 112.731 26.403 15.978 1014 HG11 VAL 132 HG11 VAL 132 112.678 26.356 18.458 1015 HG12 VAL 132 HG12 VAL 132 110.905 26.510 18.422 1016 HG13 VAL 132 HG13 VAL 132 111.684 25.048 17.772 1017 HG21 VAL 132 HG21 VAL 132 110.284 25.438 15.923 1018 HG22 VAL 132 HG22 VAL 132 110.794 26.573 14.651 1019 HG23 VAL 132 HG23 VAL 132 109.797 27.148 16.009 1020 H GLN 133 H GLN 133 113.905 28.898 15.088 1021 HA GLN 133 HA GLN 133 115.867 29.188 17.379 1022 HB2 GLN 133 HB2 GLN 133 116.516 28.571 14.467 1023 HB3 GLN 133 HB3 GLN 133 117.612 28.477 15.867 1024 HG2 GLN 133 HG3 GLN 133 115.936 26.750 16.828 1025 HG3 GLN 133 HG2 GLN 133 115.261 26.680 15.183 1026 HE21 GLN 133 HE21 GLN 133 118.331 27.409 14.443 1027 HE22 GLN 133 HE22 GLN 133 119.046 25.813 14.394
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